A0A096MM82_PAPAN Loading...

Rap guanine nucleotide exchange factor 3

AlphaFold DB (A0A2K6A4U9), UniProt , Accession A0A096MM82, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 925 aa.

						>A0A096MM82_PAPAN|A0A096MM82
MKVGWPGESCWQVGLAVEDSPALGAPRVGPLPDVVPEGTLLNMVLRKMHRPRSCSYQLLLEHQRPSCIQGLRWTPLTNSEESLDFSESLEQASTERVLRAGRQLHRQLLATCPNLIRDRKYHLRLYRQCCSGRELVDGILALGLGVHSRSQVVGICQVLLDEGALCHVKHDWAFQDRDAQFYRFPGPEPEPEPVGAHEMEEELAEAVALLSQRGPDALLTVALRKPPGQRTDEELDLIFEELLHIKAVAHLSNSVKRELAAVLLFEPHSKAGTVLFSQGDKGTSWYIIWKGSVNVVTHGKGLVTTLHEGDDFGQLALVNDAPRAATIILREDNCHFLRVDKQDFNRIIKDVEAKTMRLEEHGKVVLVLERASQGAGPSRPPTPGRNRYTVMSGTPEKILELLLEAMGPDSSAHDPTETFLSDFLLTHRVFMPSAQLCAALLHHFHAEPAGGSEQERSTYICNKRQQILRLVSQWVALYGSMLHTDPVATSFLQKLSDLVGRDARLSNLLREQWPERRRHHRLENGCGNASPQMKARNLPVWLPNQDEPLPGSSCAIRVGDKVPYDICLPDHSVLTLQLPVTASVREVMAALAQEDGWTKGQVLVKVNSAGDAIGLQPDARGVATSLGLNERLFVVNPQEVHELTPHPDQLGPTVGSAEGLDLVSAKDLAGQLTDHDWSLFNSIHQVELIYYALGPQHLRDVTTANLERFMRRFNELQYWVATELCLCPVPGPRAQLLRKFIKLAAHLKEQKNLNSFFAVMFGLSNSAISRLAHTWERLPHKVRKLYSALERLLDPSWNHRVYRLALAKLSPPVIPFMPLLLKDMTFIHEGNHTLVENLINFEKMRMMARAARMLHHCRSHNPVPLSPLRSRVSHLHEDSQVARISTCSEQSLSTRSPASTWAYVQQLKVIDNQRELSRLSRELEP
					

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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	23.3	Very low	22.4	Very low	248 Å²	248	161.6 Å²	161.6	100%	1.222	86%	0.862	S	S	*	*				0	131.2	0	-105.3	167.2	166.7	0	0	107.7
2	K	20.8	Very low	22.3	Very low	203 Å²	203	163.2 Å²	163.2	88%	0.883	86%	0.861	S	S	*	*			trans	-71.6	174.1	-178.2	-93.3	-178.7	174.5	-179.6	0	111.9
3	V	21.3	Very low	22.2	Very low	149 Å²	149	161.8 Å²	161.8	90%	0.903	86%	0.862	S	S	*	*			trans	104.2	118.2	164.1	-164.1	0	0	0	0	111.3
4	G	21.5	Very low	22.2	Very low	64 Å²	64	155.8 Å²	155.8	66%	0.66	86%	0.858	S	S	*	*			cis	131.2	118.4	15.9	0	0	0	0	0	108
5	W	21.1	Very low	22.2	Very low	250 Å²	250	157 Å²	157	95%	0.947	86%	0.861	S	S	*	*			trans	-65.7	157.4	178.8	-69.9	72.2	0	0	0	112.4
6	P	26.5	Very low	22.3	Very low	126 Å²	126	152.8 Å²	152.8	82%	0.818	85%	0.854	S	S	*	*				-138.6	154.3	103	33	-17.2	0	0	0	111.6
7	G	22.5	Very low	22.3	Very low	61 Å²	61	151.1 Å²	151.1	63%	0.629	85%	0.848	S	S	*	*			cis	105	86.8	32.2	0	0	0	0	0	109.9
8	E	23	Very low	22.4	Very low	197 Å²	197	152.2 Å²	152.2	92%	0.921	85%	0.845	S	S	*	*			trans	36.7	128.7	149.8	-61.2	179.2	165.6	0	0	121.9
9	S	22.1	Very low	22.5	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	84%	0.84	S	S	*	*				-170.4	128.3	129.4	55.7	0	0	0	0	113.3
10	C	22.2	Very low	22.5	Very low	112 Å²	112	149.4 Å²	149.4	76%	0.757	84%	0.836	S	S	*	*			trans	42.9	122.6	144.5	-77.3	0	0	0	0	120.7
11	W	22.3	Very low	23.3	Very low	258 Å²	258	148.1 Å²	148.1	98%	0.977	83%	0.834	S	S	*	*			trans	-145	122.9	130.5	-77.5	102.8	0	0	0	112.1
12	Q	20.7	Very low	23.4	Very low	180 Å²	180	140.7 Å²	140.7	84%	0.841	81%	0.812	S	S	*	*			trans	-79.3	140.8	166.9	-74.5	176	-39.1	0	0	110.6
13	V	21.1	Very low	23.6	Very low	145 Å²	145	139.6 Å²	139.6	88%	0.879	82%	0.815	S	S	*	*			trans	17.6	126.5	143.5	-169	0	0	0	0	119.3
14	G	22.7	Very low	23.9	Very low	78 Å²	78	136.3 Å²	136.3	80%	0.804	81%	0.811	S	S	*	*			trans	-179.7	113.3	155.5	0	0	0	0	0	114.1
15	L	21.9	Very low	24.1	Very low	174 Å²	174	138 Å²	138	91%	0.911	82%	0.819	S	S	*	*			trans	-76.5	146.3	179.1	-78.5	139	0	0	0	113.9
16	A	23.3	Very low	24.5	Very low	90 Å²	90	131.8 Å²	131.8	74%	0.744	81%	0.811	S	S	*	*			trans	179.2	110	142.8	0	0	0	0	0	108.5
17	V	23.4	Very low	24.5	Very low	124 Å²	124	137.7 Å²	137.7	75%	0.752	82%	0.817	S	S	*	*				81.3	120.2	78.8	175.7	0	0	0	0	114.1
18	E	23.5	Very low	24.9	Very low	170 Å²	170	141.8 Å²	141.8	79%	0.794	83%	0.829	S	S	*	*			trans	89.9	114.1	152.5	-82.1	168.9	-162.6	0	0	124.4
19	D	23.9	Very low	25	Very low	139 Å²	139	135 Å²	135	74%	0.743	81%	0.813	S	S	*	*			trans	68.8	101.8	131.7	-68.2	-12.5	0	0	0	124.8
20	S	23.5	Very low	25.2	Very low	110 Å²	110	136 Å²	136	77%	0.769	82%	0.816	S	S	*	*				32.7	163.5	119.9	-62.7	0	0	0	0	122.6
21	P	38.8	Very low	25.4	Very low	122 Å²	122	138.8 Å²	138.8	79%	0.792	82%	0.823	S	S	*	*			cis	-135.8	159.8	-35	36.4	-19.6	0	0	0	113.4
22	A	25.2	Very low	25.7	Very low	92 Å²	92	131.5 Å²	131.5	76%	0.76	81%	0.809	S	S	*	*			trans	-176.2	115.3	147.3	0	0	0	0	0	114.4
23	L	26.2	Very low	26.1	Very low	181 Å²	181	131.1 Å²	131.1	95%	0.948	81%	0.812	S	S	*	*			trans	45.3	117.4	135.5	-74.8	147.3	0	0	0	121.8
24	G	26.1	Very low	26.3	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	80%	0.803	S	S	*	*			trans	166.2	111.7	153.1	0	0	0	0	0	114.2
25	A	26.7	Very low	26.4	Very low	101 Å²	101	131.8 Å²	131.8	84%	0.835	80%	0.801	S	S	*	*			trans	-79	-177.4	-169.7	0	0	0	0	0	114.7
26	P	28.8	Very low	26.7	Very low	118 Å²	118	128.5 Å²	128.5	77%	0.766	79%	0.79	S	S	*	*				-94.5	155	-126.4	35.8	-20.4	0	0	0	114.4
27	R	25.7	Very low	27.3	Very low	250 Å²	250	132.8 Å²	132.8	94%	0.943	79%	0.794	S	S	*	*			trans	-131.5	120.5	159.4	-78.8	-170.5	173.8	-175.5	-1.3	111	G29	R27-G29 PolarHBondContact O-N 3.29Å
28	V	31.2	Very low	27.8	Very low	147 Å²	147	130.2 Å²	130.2	89%	0.891	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-58.2	117.7	174.5	175	0	0	0	0	109.4
29	G	25.9	Very low	27.9	Very low	56 Å²	56	125.9 Å²	125.9	58%	0.577	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-97.1	148.2	164.5	0	0	0	0	0	110.2	R27	R27-G29 PolarHBondContact O-N 3.29Å
30	P	26.2	Very low	28.4	Very low	129 Å²	129	125 Å²	125	84%	0.838	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65.4	138.8	177.1	28.2	-31.7	0	0	0	110.3
31	L	26.1	Very low	28.7	Very low	171 Å²	171	123.8 Å²	123.8	90%	0.895	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-57.6	129.3	170.3	-81.4	147.2	0	0	0	109.6
32	P	28.6	Very low	28.3	Very low	105 Å²	105	122.1 Å²	122.1	68%	0.682	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-77	131.3	167.6	29.3	-29.2	0	0	0	110.1	V34	P32-V34 HydrophobicContact CB-CG2 4.42Å; P32-V34 PolarHBondContact O-N 2.99Å
33	D	29.3	Very low	28.7	Very low	172 Å²	172	124.9 Å²	124.9	92%	0.92	74%	0.741	S	S	*	*			trans	-59.4	99.4	161.4	-83.9	-39	0	0	0	108.9
34	V	24.8	Very low	28.8	Very low	114 Å²	114	120.9 Å²	120.9	69%	0.691	72%	0.723	S	S	*	*			trans	-129.8	101.1	163.5	-178.2	0	0	0	0	106.6	P32 P36	P32-V34 HydrophobicContact CB-CG2 4.42Å; P32-V34 PolarHBondContact O-N 2.99Å; V34-P36 VanDerWaalsContact O-CD 3.28Å; V34-P36 WeakPolarHBondContact O-CD 3.4Å
35	V	26.6	Very low	29	Very low	124 Å²	124	118.9 Å²	118.9	75%	0.752	69%	0.694	S	S	*	*			trans	-73.2	116.9	167.7	177.4	0	0	0	0	107.4	E37	V35-E37 PolarHBondContact O-N 3.25Å
36	P	27.9	Very low	29.1	Very low	104 Å²	104	124.5 Å²	124.5	68%	0.675	69%	0.694	S	S	*	*			trans	-80.9	112.1	167.9	-4.1	23.8	0	0	0	108.1	V34 G38	V34-P36 VanDerWaalsContact O-CD 3.28Å; V34-P36 WeakPolarHBondContact O-CD 3.4Å; P36-G38 PolarHBondContact O-N 3.09Å
37	E	34.7	Very low	29.2	Very low	181 Å²	181	128.2 Å²	128.2	85%	0.846	70%	0.697	S	S	*	*			trans	-58.2	121.6	166.5	-74.2	-174.5	139.5	0	0	109.9	V35	V35-E37 PolarHBondContact O-N 3.25Å
38	G	34.1	Very low	29.2	Very low	70 Å²	70	120.5 Å²	120.5	72%	0.722	67%	0.673	S	S	*	*			trans	153.8	55.4	175.5	0	0	0	0	0	113.6	P36	P36-G38 PolarHBondContact O-N 3.09Å
39	T	26.6	Very low	28.8	Very low	78 Å²	78	120.8 Å²	120.8	48%	0.479	66%	0.664	S	S	.	*			trans	-123.2	142.9	172.5	1	0	0	0	0	109.5	L41 N42	T39-L41 PolarHBondContact O-N 3.26Å; T39-N42 PolarHBondContact O-N 3.46Å
40	L	33.1	Very low	28.7	Very low	120 Å²	120	129 Å²	129	63%	0.628	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.9	-15.4	171.6	-81.2	149.1	0	0	0	114.4	N42 M43	L40-N42 VanDerWaalsContact C-N 3.34Å; L40-N42 PolarHBondContact O-N 2.9Å; L40-M43 HydrophobicContact CD2-CE 4.49Å; L40-M43 HydrophobicContact CD2-SD 3.93Å; L40-M43 WeakPolarHBondContact O-CB 3.48Å; L40-M43 PolarHBondContact O-N 2.78Å
41	L	30.6	Very low	28.6	Very low	85 Å²	85	127.9 Å²	127.9	45%	0.445	67%	0.671	S	S	.	*	H	α-helix	trans	-58.5	-35.1	171.1	-150	72.4	0	0	0	113.6	T39 M43 L45 T825 E829	T39-L41 PolarHBondContact O-N 3.26Å; L41-M43 PolarHBondContact O-N 3.42Å; L41-L45 HydrophobicContact CG-CD1 4.29Å; L41-L45 VanDerWaalsContact O-CD1 3.28Å; L41-L45 WeakPolarHBondContact O-CD1 3.44Å; L41-L45 WeakPolarHBondContact O-CG 3.47Å; L41-T825 HydrophobicContact CD1-CG2 4.27Å; L41-E829 VanDerWaalsContact CD2-OE1 3.31Å; L41-E829 WeakPolarHBondContact CD2-OE1 3.37Å; L41-E829 WeakPolarHBondContact CG-OE1 3.36Å
42	N	30.3	Very low	28.6	Very low	88 Å²	88	123.6 Å²	123.6	47%	0.471	64%	0.643	S	S	.	*	H	α-helix	trans	-71.8	-14.6	175.9	-98.1	-31.4	0	0	0	113.7	T39 L40	T39-N42 PolarHBondContact O-N 3.46Å; L40-N42 VanDerWaalsContact C-N 3.34Å; L40-N42 PolarHBondContact O-N 2.9Å
43	M	32.5	Very low	28.5	Very low	150 Å²	150	122.9 Å²	122.9	74%	0.739	64%	0.64	S	S	*	*	H	α-helix	trans	-85.9	-26.3	-178.9	-71.9	173.3	56.3	0	0	113.5	L40 L41	L40-M43 HydrophobicContact CD2-CE 4.49Å; L40-M43 HydrophobicContact CD2-SD 3.93Å; L40-M43 WeakPolarHBondContact O-CB 3.48Å; L40-M43 PolarHBondContact O-N 2.78Å; L41-M43 PolarHBondContact O-N 3.42Å
44	V	29.8	Very low	28.3	Very low	96 Å²	96	118.4 Å²	118.4	58%	0.582	62%	0.621	S	S	*	*	H	α-helix	trans	-81.4	-27.6	175.6	179.7	0	0	0	0	111.2
45	L	30.7	Very low	28.1	Very low	37 Å²	37	118.3 Å²	118.3	19%	0.194	63%	0.626	C	S	.	*	H	α-helix	trans	-95.5	-18.4	-163.4	-66.3	168.7	0	0	0	115.7	L41 K47 F826 E829	L41-L45 HydrophobicContact CG-CD1 4.29Å; L41-L45 VanDerWaalsContact O-CD1 3.28Å; L41-L45 WeakPolarHBondContact O-CD1 3.44Å; L41-L45 WeakPolarHBondContact O-CG 3.47Å; L45-K47 VanDerWaalsContact C-N 3.31Å; L45-K47 PolarHBondContact O-N 3.12Å; L45-F826 HydrophobicContact CD2-CE2 4.32Å; L45-F826 HydrophobicContact CD2-CZ 4.46Å; L45-E829 VanDerWaalsContact CD1-OE1 3.3Å; L45-E829 WeakPolarHBondContact CD1-OE1 3.45Å; L45-E829 VanDerWaalsContact CD1-OE2 3.28Å; L45-E829 WeakPolarHBondContact CD1-OE2 3.4Å
46	R	27	Very low	27.9	Very low	220 Å²	220	121.3 Å²	121.3	83%	0.83	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-3.1	-174.2	-90.2	-168.6	177.2	-172.9	1.3	116.9
47	K	31	Very low	27.5	Very low	195 Å²	195	125.2 Å²	125.2	85%	0.848	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.5	59.8	173.3	-73	-167.6	178.1	-179.4	0	113.3	L45	L45-K47 VanDerWaalsContact C-N 3.31Å; L45-K47 PolarHBondContact O-N 3.12Å
48	M	26.6	Very low	26.9	Very low	88 Å²	88	123.5 Å²	123.5	43%	0.433	63%	0.63	S	S	.	*			trans	-143.9	50.3	155.9	-86.3	-159.2	-80.4	0	0	110.3	K822	M48-K822 HydrophobicContact CE-CD 3.81Å; M48-K822 HydrophobicContact CE-CG 4.48Å; M48-K822 HydrophobicContact SD-CD 4.18Å; M48-K822 PolarHBondContact SD-NZ 2.78Å
49	H	23	Very low	26.2	Very low	153 Å²	153	127.9 Å²	127.9	71%	0.708	64%	0.636	S	S	*	*			trans	-111.1	126.7	160.4	-70.2	7.4	0	0	0	107.2
50	R	23.1	Very low	26	Very low	229 Å²	229	130.3 Å²	130.3	86%	0.864	65%	0.645	S	S	*	*			trans	-126.9	133.2	147.2	-84.6	-168.5	176.9	179.3	-0.1	106.5
51	P	24.3	Very low	25.5	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	66%	0.657	S	S	*	*				-102.7	179.8	129.3	4	16.4	0	0	0	108.3
52	R	25.9	Very low	25.2	Very low	81 Å²	81	137.5 Å²	137.5	31%	0.306	67%	0.673	S	S	.	*	S	Bend	trans	-47.3	156.2	177.8	-61.4	175.4	178.4	141.5	-3	112.1	C54 D216 W289	R52-C54 PolarHBondContact O-N 2.97Å; R52-C54 VanDerWaalsContact O-N 3.11Å; R52-D216 IonicContact CZ-OD1 2.71Å; R52-D216 IonicContact CZ-OD2 3.09Å; R52-D216 IonicContact NE-OD1 2.98Å; R52-D216 IonicContact NE-OD2 3.02Å; R52-D216 PolarHBondContact NE-OD2 3.27Å; R52-D216 VanDerWaalsContact NH2-CG 3.33Å; R52-D216 IonicContact NH2-OD1 3.21Å; R52-D216 PolarHBondContact NH2-OD1 2.89Å; R52-D216 IonicContact NH2-OD2 3.97Å; R52-D216 PolarHBondContact NH2-OD2 2.86Å; R52-W289 VanDerWaalsContact NH1-NE1 3.19Å
53	S	28	Very low	24.8	Very low	90 Å²	90	141.8 Å²	141.8	63%	0.629	69%	0.69	S	S	*	*	S	Bend	trans	-22	106.2	176.1	43.3	0	0	0	0	115
54	C	23.2	Very low	24.4	Very low	77 Å²	77	145.6 Å²	145.6	52%	0.52	70%	0.697	S	S	.	*			trans	-148.8	119.6	165	-83.7	0	0	0	0	109.1	R52 Y56	R52-C54 PolarHBondContact O-N 2.97Å; R52-C54 VanDerWaalsContact O-N 3.11Å; C54-Y56 HydrophobicContact CB-CD2 4.48Å; C54-Y56 HydrophobicContact CB-CE2 3.86Å
55	S	21.3	Very low	24.1	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	71%	0.71	S	S	*	*			trans	-83.9	122.6	165.9	50.3	0	0	0	0	109.1
56	Y	22.4	Very low	23.9	Very low	188 Å²	188	151.1 Å²	151.1	74%	0.737	74%	0.74	S	S	*	*			trans	-103.8	120.8	167.5	-66.3	-86.8	0	0	0	109	C54 L58	C54-Y56 HydrophobicContact CB-CD2 4.48Å; C54-Y56 HydrophobicContact CB-CE2 3.86Å; Y56-L58 PolarHBondContact O-N 2.84Å
57	Q	20.1	Very low	23.8	Very low	185 Å²	185	145.1 Å²	145.1	86%	0.864	73%	0.73	S	S	*	*			trans	-81.6	103.5	159.1	-111.3	179.2	-9.6	0	0	107.4	L59	Q57-L59 PolarHBondContact O-N 2.78Å
58	L	20.6	Very low	23.6	Very low	145 Å²	145	140.3 Å²	140.3	76%	0.759	71%	0.713	S	S	*	*			trans	-78.8	105.7	166	-79.8	162.6	0	0	0	107.8	Y56 L60	Y56-L58 PolarHBondContact O-N 2.84Å; L58-L60 VanDerWaalsContact C-N 3.33Å; L58-L60 HydrophobicContact CB-CD1 4.49Å; L58-L60 HydrophobicContact CB-CG 4.47Å; L58-L60 PolarHBondContact O-N 3.35Å; L58-L60 VanDerWaalsContact O-N 3.08Å
59	L	20.4	Very low	23.7	Very low	162 Å²	162	141.2 Å²	141.2	85%	0.848	72%	0.716	S	S	*	*			trans	-76.6	90.9	165.8	-142.2	126.6	0	0	0	107.2	Q57 E61	Q57-L59 PolarHBondContact O-N 2.78Å; L59-E61 PolarHBondContact O-N 2.82Å
60	L	23.1	Very low	23.7	Very low	129 Å²	129	136.4 Å²	136.4	68%	0.675	71%	0.708	S	S	*	*			trans	-84.1	99.8	174.8	-84.3	155.9	0	0	0	109.3	L58 H62	L58-L60 VanDerWaalsContact C-N 3.33Å; L58-L60 HydrophobicContact CB-CD1 4.49Å; L58-L60 HydrophobicContact CB-CG 4.47Å; L58-L60 PolarHBondContact O-N 3.35Å; L58-L60 VanDerWaalsContact O-N 3.08Å; L60-H62 PolarHBondContact O-N 2.58Å; L60-H62 PolarHBondContact O-ND1 3.31Å; L60-H62 VanDerWaalsContact O-ND1 3.12Å
61	E	22.1	Very low	23.7	Very low	185 Å²	185	131.3 Å²	131.3	86%	0.864	70%	0.697	S	S	*	*			trans	-63.6	118.5	153.6	-80.6	-175	152.4	0	0	108	L59	L59-E61 PolarHBondContact O-N 2.82Å
62	H	23.2	Very low	23.6	Very low	172 Å²	172	132 Å²	132	80%	0.796	69%	0.686	S	S	*	*			trans	-71.7	148.4	-166.1	-82.6	55.7	0	0	0	114.6	L60	L60-H62 PolarHBondContact O-N 2.58Å; L60-H62 PolarHBondContact O-ND1 3.31Å; L60-H62 VanDerWaalsContact O-ND1 3.12Å
63	Q	23.1	Very low	23.6	Very low	177 Å²	177	138.3 Å²	138.3	83%	0.827	71%	0.71	S	S	*	*				-175.3	127.7	103.7	-94.5	-171.3	20.8	0	0	113.5
64	R	22.6	Very low	23.4	Very low	231 Å²	231	138.9 Å²	138.9	87%	0.872	71%	0.71	S	S	*	*			trans	101.5	134.5	161.9	-61.7	-171.7	-176.1	-174.3	1.2	119.9
65	P	25.3	Very low	23.5	Very low	132 Å²	132	140.8 Å²	140.8	86%	0.857	72%	0.721	S	S	*	*			trans	-105.2	131.6	-165.2	36.8	-23.4	0	0	0	112.8
66	S	25.7	Very low	23.6	Very low	117 Å²	117	143.4 Å²	143.4	82%	0.818	73%	0.725	S	S	*	*			trans	-117.5	111.9	177.9	53	0	0	0	0	112
67	C	25.7	Very low	23.7	Very low	94 Å²	94	141 Å²	141	64%	0.635	73%	0.731	S	S	*	*			trans	42.8	134.1	151.9	-159.2	0	0	0	0	121.8
68	I	25.6	Very low	23.9	Very low	93 Å²	93	140 Å²	140	48%	0.477	73%	0.731	S	S	.	*			trans	-107.4	119.6	-164.8	-72.1	177.1	0	0	0	113.5
69	Q	28.7	Very low	24.2	Very low	108 Å²	108	138.6 Å²	138.6	51%	0.505	73%	0.734	S	S	.	*				51.3	113	127.8	-52	-178.1	1.2	0	0	123.7	R72	Q69-R72 VanDerWaalsContact OE1-NE 3.16Å
70	G	22.6	Very low	24.5	Very low	52 Å²	52	139.9 Å²	139.9	54%	0.536	74%	0.735	S	S	.	*	S	Bend		-160.7	122.1	126.8	0	0	0	0	0	107.3
71	L	24.1	Very low	24.6	Very low	121 Å²	121	141.7 Å²	141.7	63%	0.634	74%	0.74	S	S	*	*	S	Bend	cis	-91.9	135.4	26.2	-64.3	135.5	0	0	0	114.7
72	R	22.4	Very low	24.9	Very low	121 Å²	121	138.2 Å²	138.2	46%	0.457	74%	0.736	S	S	.	*			trans	-103.5	111.5	171.8	-157.4	-179.4	-165.2	-165.7	2.9	109.2	Q69	Q69-R72 VanDerWaalsContact OE1-NE 3.16Å
73	W	24.8	Very low	25.1	Very low	213 Å²	213	136 Å²	136	81%	0.807	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-85.4	126.8	155.1	-65.7	92.1	0	0	0	107	P75	W73-P75 VanDerWaalsContact O-CD 3.27Å; W73-P75 WeakPolarHBondContact O-CD 3.46Å
74	T	23.5	Very low	25.4	Very low	103 Å²	103	134.8 Å²	134.8	63%	0.632	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-83.8	118.5	169.7	31.9	0	0	0	0	110.2
75	P	25.2	Very low	25.6	Very low	117 Å²	117	129.3 Å²	129.3	76%	0.76	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-87.9	149.2	143.5	27.1	-14.6	0	0	0	109.6	W73	W73-P75 VanDerWaalsContact O-CD 3.27Å; W73-P75 WeakPolarHBondContact O-CD 3.46Å
76	L	24.2	Very low	25.9	Very low	166 Å²	166	127 Å²	127	87%	0.869	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-56.3	158.1	176.7	-68.6	156.3	0	0	0	112.1
77	T	25.3	Very low	26.3	Very low	139 Å²	139	128 Å²	128	85%	0.853	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-58.9	131.4	-175.5	45.3	0	0	0	0	113.5
78	N	24.2	Very low	27	Very low	163 Å²	163	126.6 Å²	126.6	87%	0.872	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-75.8	118.8	168.6	-69.5	-15.1	0	0	0	110.1
79	S	26.6	Very low	27.7	Very low	116 Å²	116	126.8 Å²	126.8	81%	0.811	68%	0.683	S	S	*	*			trans	-105.7	127.4	149.3	55.7	0	0	0	0	107.6
80	E	27	Very low	28.9	Very low	189 Å²	189	126 Å²	126	88%	0.883	68%	0.679	S	S	*	*			trans	-61.9	131.1	-177.6	-62	174.3	144.1	0	0	111.9
81	E	25.2	Very low	30.6	Very low	166 Å²	166	129.9 Å²	129.9	78%	0.776	68%	0.683	S	S	*	*			trans	-172.4	127	136.8	-102.7	171	-159.9	0	0	108.2	L83	E81-L83 PolarHBondContact O-N 3.12Å
82	S	28.1	Very low	32.1	Very low	112 Å²	112	126.7 Å²	126.7	78%	0.783	68%	0.675	S	S	*	*			trans	-68.1	107.1	-179.1	54.2	0	0	0	0	110.7
83	L	27.5	Very low	34.4	Very low	127 Å²	127	122.1 Å²	122.1	67%	0.665	66%	0.661	S	S	*	*			trans	-126.5	143.1	168.4	-68.9	167.6	0	0	0	107.8	E81 F85	E81-L83 PolarHBondContact O-N 3.12Å; L83-F85 WeakPolarHBondContact O-CD2 3.27Å; L83-F85 WeakPolarHBondContact O-CE2 3.38Å; L83-F85 PolarHBondContact O-N 3.34Å
84	D	29.1	Very low	37	Very low	150 Å²	150	114.1 Å²	114.1	80%	0.802	64%	0.636	S	S	*	*			trans	-57.6	95.5	177.9	-89.8	-41.5	0	0	0	110.9
85	F	28	Very low	39.8	Very low	117 Å²	117	113.7 Å²	113.7	51%	0.513	63%	0.626	S	S	.	*	H	α-helix	trans	-80.2	-16.7	-171.3	-83.6	-79.6	0	0	0	114.1	L83 L89	L83-F85 WeakPolarHBondContact O-CD2 3.27Å; L83-F85 WeakPolarHBondContact O-CE2 3.38Å; L83-F85 PolarHBondContact O-N 3.34Å; F85-L89 WeakPolarHBondContact O-CB 3.34Å; F85-L89 PolarHBondContact O-N 3.5Å
86	S	31.7	Very low	42.5	Very low	84 Å²	84	115.6 Å²	115.6	59%	0.587	62%	0.619	S	S	*	*	H	α-helix	trans	-70.4	-49.1	-171.5	56.1	0	0	0	0	113.1	S88 L89 E90	S86-S88 VanDerWaalsContact C-N 3.33Å; S86-S88 PolarHBondContact O-N 2.98Å; S86-L89 PolarHBondContact O-N 3.36Å; S86-E90 PolarHBondContact O-N 3.02Å; S86-E90 VanDerWaalsContact O-N 3.12Å
87	E	33.2	Very low	45.4	Very low	138 Å²	138	107.7 Å²	107.7	65%	0.645	58%	0.577	S	S	*	*	H	α-helix	trans	-66.2	-37.5	176	-71.7	-168.4	150.4	0	0	111.6	Q91	E87-Q91 WeakPolarHBondContact O-CB 3.43Å; E87-Q91 WeakPolarHBondContact O-CG 3.48Å; E87-Q91 PolarHBondContact O-N 2.87Å; E87-Q91 VanDerWaalsContact O-N 3.12Å
88	S	39.6	Very low	48.4	Very low	63 Å²	63	103 Å²	103	44%	0.441	55%	0.547	S	S	.	.	H	α-helix	trans	-62.2	-41.8	175.1	162.8	0	0	0	0	112.7	S86 A92	S86-S88 VanDerWaalsContact C-N 3.33Å; S86-S88 PolarHBondContact O-N 2.98Å; S88-A92 WeakPolarHBondContact O-CB 3.37Å; S88-A92 PolarHBondContact O-N 3.17Å
89	L	42	Very low	51.3	Low	98 Å²	98	102.1 Å²	102.1	51%	0.513	53%	0.531	S	S	.	.	H	α-helix	trans	-73.1	-41.9	-179.7	-121.6	89.8	0	0	0	112.5	F85 S86 A92 S93	F85-L89 WeakPolarHBondContact O-CB 3.34Å; F85-L89 PolarHBondContact O-N 3.5Å; S86-L89 PolarHBondContact O-N 3.36Å; L89-A92 PolarHBondContact O-N 2.99Å; L89-S93 VanDerWaalsContact O-CB 3.25Å; L89-S93 WeakPolarHBondContact O-CB 3.49Å; L89-S93 PolarHBondContact O-N 3.13Å
90	E	52.3	Low	54.2	Low	91 Å²	91	96.8 Å²	96.8	43%	0.425	50%	0.495	S	S	.	.	H	α-helix	trans	-63.5	-46.6	178.2	-75.3	-161.5	160.1	0	0	110.1	S86 A92 S93 T94 K290	S86-E90 PolarHBondContact O-N 3.02Å; S86-E90 VanDerWaalsContact O-N 3.12Å; E90-A92 PolarHBondContact O-N 3.12Å; E90-S93 WeakPolarHBondContact O-CA 3.31Å; E90-S93 WeakPolarHBondContact O-CB 3.41Å; E90-S93 PolarHBondContact O-N 2.86Å; E90-S93 PolarHBondContact O-OG 2.85Å; E90-T94 PolarHBondContact O-N 2.72Å; E90-T94 PolarHBondContact O-OG1 3.32Å; E90-K290 IonicContact OE1-NZ 2.88Å; E90-K290 PolarHBondContact OE1-NZ 3.25Å
91	Q	58.1	Low	57.2	Low	134 Å²	134	87.9 Å²	87.9	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-59.9	-45	174.7	-72	174.1	8.4	0	0	112.4	E87 S93 T94 E95	E87-Q91 WeakPolarHBondContact O-CB 3.43Å; E87-Q91 WeakPolarHBondContact O-CG 3.48Å; E87-Q91 PolarHBondContact O-N 2.87Å; E87-Q91 VanDerWaalsContact O-N 3.12Å; Q91-S93 PolarHBondContact O-N 2.72Å; Q91-T94 PolarHBondContact O-N 3.21Å; Q91-E95 PolarHBondContact O-N 3.44Å
92	A	57.2	Low	60.2	Low	54 Å²	54	85.1 Å²	85.1	45%	0.446	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-31.5	175.1	0	0	0	0	0	112.1	S88 L89 E90 R96	S88-A92 WeakPolarHBondContact O-CB 3.37Å; S88-A92 PolarHBondContact O-N 3.17Å; L89-A92 PolarHBondContact O-N 2.99Å; E90-A92 PolarHBondContact O-N 3.12Å; A92-R96 VanDerWaalsContact O-CG 3.29Å; A92-R96 WeakPolarHBondContact O-CG 3.35Å; A92-R96 PolarHBondContact O-N 2.83Å
93	S	69.9	Low	62.9	Low	25 Å²	25	80.2 Å²	80.2	18%	0.175	40%	0.4	C	S	.	.	H	α-helix	trans	-77.5	-39.8	179.8	97.1	0	0	0	0	113	L89 E90 Q91 E95 R96 V97 R213	L89-S93 VanDerWaalsContact O-CB 3.25Å; L89-S93 WeakPolarHBondContact O-CB 3.49Å; L89-S93 PolarHBondContact O-N 3.13Å; E90-S93 WeakPolarHBondContact O-CA 3.31Å; E90-S93 WeakPolarHBondContact O-CB 3.41Å; E90-S93 PolarHBondContact O-N 2.86Å; E90-S93 PolarHBondContact O-OG 2.85Å; Q91-S93 PolarHBondContact O-N 2.72Å; S93-E95 VanDerWaalsContact C-N 3.33Å; S93-R96 PolarHBondContact O-N 3.44Å; S93-V97 PolarHBondContact O-N 2.77Å; S93-V97 VanDerWaalsContact O-N 3.1Å; S93-R213 PolarHBondContact OG-NH1 3.48Å; S93-R213 PolarHBondContact OG-NH2 3.42Å; S93-R213 VanDerWaalsContact OG-NH2 3.09Å
94	T	79.6	Confident	65.8	Low	45 Å²	45	74.1 Å²	74.1	28%	0.276	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-44.5	170.7	-62.7	0	0	0	0	110.1	E90 Q91 R96 V97 L98 E162	E90-T94 PolarHBondContact O-N 2.72Å; E90-T94 PolarHBondContact O-OG1 3.32Å; Q91-T94 PolarHBondContact O-N 3.21Å; T94-R96 VanDerWaalsContact C-N 3.3Å; T94-R96 PolarHBondContact O-N 2.99Å; T94-V97 PolarHBondContact O-N 3.42Å; T94-V97 VanDerWaalsContact O-N 3.08Å; T94-L98 HydrophobicContact CG2-CD1 4Å; T94-L98 HydrophobicContact CG2-CG 4.36Å; T94-L98 WeakPolarHBondContact O-CG 3.45Å; T94-L98 PolarHBondContact O-N 2.68Å; T94-E162 WeakPolarHBondContact CB-OE2 3.2Å; T94-E162 VanDerWaalsContact CG2-OE2 3.29Å; T94-E162 WeakPolarHBondContact CG2-OE2 3.36Å; T94-E162 PolarHBondContact OG1-OE2 3.42Å
95	E	81.1	Confident	68.7	Low	93 Å²	93	68.3 Å²	68.3	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-63.1	-36.3	178.2	-172.5	54.1	-141.1	0	0	112.5	Q91 S93 L98 R99 R102	Q91-E95 PolarHBondContact O-N 3.44Å; S93-E95 VanDerWaalsContact C-N 3.33Å; E95-L98 PolarHBondContact O-N 3.45Å; E95-R99 WeakPolarHBondContact O-CB 3.34Å; E95-R99 PolarHBondContact O-N 2.87Å; E95-R102 IonicContact OE1-CZ 3.69Å; E95-R102 IonicContact OE1-NH1 2.65Å; E95-R102 IonicContact OE1-NH2 3.56Å; E95-R102 PolarHBondContact OE1-NH2 3.01Å
96	R	82.8	Confident	71.5	Confident	157 Å²	157	67.3 Å²	67.3	59%	0.592	33%	0.33	S	S	*	.	H	α-helix	trans	-64	-40	173	-73.4	177.1	71	-164.8	2.1	112.3	A92 S93 T94 A100 L209	A92-R96 VanDerWaalsContact O-CG 3.29Å; A92-R96 WeakPolarHBondContact O-CG 3.35Å; A92-R96 PolarHBondContact O-N 2.83Å; S93-R96 PolarHBondContact O-N 3.44Å; T94-R96 VanDerWaalsContact C-N 3.3Å; T94-R96 PolarHBondContact O-N 2.99Å; R96-A100 WeakPolarHBondContact O-CB 3.45Å; R96-A100 PolarHBondContact O-N 2.88Å; R96-L209 HydrophobicContact CB-CD2 4Å
97	V	85.6	Confident	74.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68	-42.3	175.7	175.3	0	0	0	0	110.8	S93 T94 R99 A100 G101 V158 L159 E162 L210	S93-V97 PolarHBondContact O-N 2.77Å; S93-V97 VanDerWaalsContact O-N 3.1Å; T94-V97 PolarHBondContact O-N 3.42Å; T94-V97 VanDerWaalsContact O-N 3.08Å; V97-R99 PolarHBondContact O-N 3.39Å; V97-A100 PolarHBondContact O-N 2.75Å; V97-G101 PolarHBondContact O-N 2.82Å; V97-V158 HydrophobicContact CG1-CG1 3.82Å; V97-V158 HydrophobicContact CG2-CG1 4.22Å; V97-L159 HydrophobicContact CG1-CD2 4.3Å; V97-E162 HydrophobicContact CB-CB 4.19Å; V97-E162 HydrophobicContact CB-CG 4.08Å; V97-E162 HydrophobicContact CG1-CB 3.73Å; V97-E162 HydrophobicContact CG1-CG 3.8Å; V97-E162 HydrophobicContact CG2-CG 4.26Å; V97-L210 HydrophobicContact CG1-CD2 3.92Å
98	L	87.9	Confident	76.7	Confident	42 Å²	42	58.4 Å²	58.4	22%	0.22	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-44.3	175.2	-70.4	170.6	0	0	0	111.2	T94 E95 G101 R102 A164	T94-L98 HydrophobicContact CG2-CD1 4Å; T94-L98 HydrophobicContact CG2-CG 4.36Å; T94-L98 WeakPolarHBondContact O-CG 3.45Å; T94-L98 PolarHBondContact O-N 2.68Å; E95-L98 PolarHBondContact O-N 3.45Å; L98-G101 PolarHBondContact O-N 3.33Å; L98-R102 WeakPolarHBondContact O-CG 3.47Å; L98-R102 PolarHBondContact O-N 2.86Å; L98-A164 HydrophobicContact CD2-CB 4.01Å
99	R	85.4	Confident	79	Confident	143 Å²	143	57.7 Å²	57.7	54%	0.54	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-46.3	173.6	-176.7	176.6	175.7	168.5	-2.8	111.8	E95 V97 G101 R102 Q103 E202	E95-R99 WeakPolarHBondContact O-CB 3.34Å; E95-R99 PolarHBondContact O-N 2.87Å; V97-R99 PolarHBondContact O-N 3.39Å; R99-G101 VanDerWaalsContact C-N 3.31Å; R99-G101 PolarHBondContact O-N 3.13Å; R99-R102 PolarHBondContact O-N 2.89Å; R99-Q103 PolarHBondContact O-N 2.71Å; R99-E202 IonicContact NH2-OE1 3.72Å; R99-E202 PolarHBondContact NH2-OE1 2.93Å
100	A	87.1	Confident	81	Confident	5 Å²	5	56.9 Å²	56.9	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-41.1	176.5	0	0	0	0	0	112	R96 V97 Q103 L104 A206 L209 L210	R96-A100 WeakPolarHBondContact O-CB 3.45Å; R96-A100 PolarHBondContact O-N 2.88Å; V97-A100 PolarHBondContact O-N 2.75Å; A100-Q103 PolarHBondContact O-N 3.03Å; A100-L104 WeakPolarHBondContact O-CB 3.42Å; A100-L104 PolarHBondContact O-N 3.35Å; A100-A206 HydrophobicContact CB-CB 3.68Å; A100-L209 HydrophobicContact CB-CD2 4.43Å; A100-L210 HydrophobicContact CB-CD1 4.15Å; A100-L210 HydrophobicContact CB-CD2 4.3Å; A100-L210 HydrophobicContact CB-CG 4.12Å
101	G	89.3	Confident	82.5	Confident	2 Å²	2	56.2 Å²	56.2	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-43.1	174.6	0	0	0	0	0	113	V97 L98 R99 L104 H105	V97-G101 PolarHBondContact O-N 2.82Å; L98-G101 PolarHBondContact O-N 3.33Å; R99-G101 VanDerWaalsContact C-N 3.31Å; R99-G101 PolarHBondContact O-N 3.13Å; G101-L104 PolarHBondContact O-N 2.91Å; G101-H105 VanDerWaalsContact O-CB 3.29Å; G101-H105 WeakPolarHBondContact O-CB 3.44Å; G101-H105 PolarHBondContact O-N 3Å
102	R	87.9	Confident	83.8	Confident	108 Å²	108	51.2 Å²	51.2	41%	0.408	26%	0.259	S	S	.	.	H	α-helix	trans	-61.9	-42.9	174.1	-70.6	-174.4	-65.6	-99.2	6.9	112	E95 L98 R99 H105 R106	E95-R102 IonicContact OE1-CZ 3.69Å; E95-R102 IonicContact OE1-NH1 2.65Å; E95-R102 IonicContact OE1-NH2 3.56Å; E95-R102 PolarHBondContact OE1-NH2 3.01Å; L98-R102 WeakPolarHBondContact O-CG 3.47Å; L98-R102 PolarHBondContact O-N 2.86Å; R99-R102 PolarHBondContact O-N 2.89Å; R102-H105 PolarHBondContact O-N 3.01Å; R102-R106 WeakPolarHBondContact O-CG 3.35Å; R102-R106 PolarHBondContact O-N 3.16Å
103	Q	86.3	Confident	84.9	Confident	8 Å²	8	53 Å²	53	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-46.3	177.2	-160.7	83	-11.2	0	0	111.4	R99 A100 R106 Q107 E202 L203 A206	R99-Q103 PolarHBondContact O-N 2.71Å; A100-Q103 PolarHBondContact O-N 3.03Å; Q103-R106 PolarHBondContact O-N 2.87Å; Q103-Q107 WeakPolarHBondContact O-CG 3.47Å; Q103-Q107 PolarHBondContact O-N 2.75Å; Q103-E202 VanDerWaalsContact NE2-CB 3.27Å; Q103-E202 PolarHBondContact NE2-OE2 3.37Å; Q103-L203 HydrophobicContact CG-CB 4.12Å; Q103-L203 HydrophobicContact CG-CD1 3.99Å; Q103-A206 HydrophobicContact CB-CB 4.29Å
104	L	88.6	Confident	85.6	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.6	-43	177.6	-175.2	64.6	0	0	0	111.3	A100 G101 Q107 L108 I139 L142 I155 L159 L203 V207 L210	A100-L104 WeakPolarHBondContact O-CB 3.42Å; A100-L104 PolarHBondContact O-N 3.35Å; G101-L104 PolarHBondContact O-N 2.91Å; L104-Q107 PolarHBondContact O-N 2.7Å; L104-L108 HydrophobicContact CD1-CD1 4.46Å; L104-L108 HydrophobicContact CD1-CG 4.45Å; L104-L108 HydrophobicContact CG-CD1 3.96Å; L104-L108 HydrophobicContact CG-CG 4.39Å; L104-L108 WeakPolarHBondContact O-CB 3.45Å; L104-L108 VanDerWaalsContact O-CG 3.3Å; L104-L108 WeakPolarHBondContact O-CG 3.5Å; L104-L108 PolarHBondContact O-N 3.22Å; L104-I139 HydrophobicContact CD1-CG1 4.45Å; L104-I139 HydrophobicContact CD2-CD1 4Å; L104-I139 HydrophobicContact CD2-CG1 4.29Å; L104-L142 HydrophobicContact CD1-CD1 3.7Å; L104-I155 HydrophobicContact CD2-CG2 4.38Å; L104-L159 HydrophobicContact CD2-CD1 3.89Å; L104-L203 HydrophobicContact CD1-CD1 4.43Å; L104-V207 HydrophobicContact CD1-CG2 4.14Å; L104-L210 HydrophobicContact CD2-CD1 4.32Å
105	H	89.8	Confident	86.1	Confident	28 Å²	28	56.4 Å²	56.4	13%	0.13	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-46.7	177.6	-178.5	-151.4	0	0	0	112.1	G101 R102 Q107 L108 L109 I116 F184	G101-H105 VanDerWaalsContact O-CB 3.29Å; G101-H105 WeakPolarHBondContact O-CB 3.44Å; G101-H105 PolarHBondContact O-N 3Å; R102-H105 PolarHBondContact O-N 3.01Å; H105-Q107 VanDerWaalsContact C-N 3.31Å; H105-Q107 PolarHBondContact O-N 2.93Å; H105-L108 PolarHBondContact O-N 3.4Å; H105-L109 PolarHBondContact O-N 3Å; H105-I116 WeakPolarHBondContact NE2-CD1 3.35Å; H105-F184 HydrophobicContact CB-CD1 3.81Å; H105-F184 HydrophobicContact CB-CE1 4.03Å; H105-F184 HydrophobicContact CB-CG 4.09Å; H105-F184 HydrophobicContact CB-CZ 4.5Å; H105-F184 AromaticContact CD2-CD2 3.61Å; H105-F184 AromaticContact CD2-CG 3.72Å; H105-F184 AromaticContact CG-CD1 3.93Å; H105-F184 AromaticContact CG-CG 3.68Å; H105-F184 AromaticContact ND1-CG 3.98Å; H105-F184 AromaticContact NE2-CD2 3.97Å
106	R	85.9	Confident	86.4	Confident	96 Å²	96	53 Å²	53	36%	0.362	27%	0.265	S	S	.	.	H	α-helix	trans	-53.7	-48	174.7	-74.4	170	-172.8	171.8	-8	111.9	R102 Q103 L109 A110 P189	R102-R106 WeakPolarHBondContact O-CG 3.35Å; R102-R106 PolarHBondContact O-N 3.16Å; Q103-R106 PolarHBondContact O-N 2.87Å; R106-L109 PolarHBondContact O-N 2.74Å; R106-A110 PolarHBondContact O-N 2.85Å; R106-P189 HydrophobicContact CB-CG 4.44Å; R106-P189 HydrophobicContact CG-CB 3.62Å; R106-P189 HydrophobicContact CG-CG 3.27Å
107	Q	86.9	Confident	86.8	Confident	33 Å²	33	51.4 Å²	51.4	15%	0.154	26%	0.259	C	S	.	.	H	α-helix	trans	-72.9	-34.2	-174.9	-73.8	-75.4	-2.4	0	0	112.9	Q103 L104 H105 A110 T111 L203	Q103-Q107 WeakPolarHBondContact O-CG 3.47Å; Q103-Q107 PolarHBondContact O-N 2.75Å; L104-Q107 PolarHBondContact O-N 2.7Å; H105-Q107 VanDerWaalsContact C-N 3.31Å; H105-Q107 PolarHBondContact O-N 2.93Å; Q107-A110 PolarHBondContact O-N 2.71Å; Q107-T111 WeakPolarHBondContact O-CB 3.37Å; Q107-T111 PolarHBondContact O-N 2.59Å; Q107-T111 PolarHBondContact O-OG1 2.77Å; Q107-L203 HydrophobicContact CB-CD1 4.12Å; Q107-L203 HydrophobicContact CB-CD2 3.87Å; Q107-L203 HydrophobicContact CG-CD1 3.89Å; Q107-L203 HydrophobicContact CG-CD2 3.45Å; Q107-L203 VanDerWaalsContact CG-CD2 3.45Å; Q107-L203 HydrophobicContact CG-CG 4.15Å
108	L	88.4	Confident	87	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-40.4	170.4	-73.6	170.9	0	0	0	112	L104 H105 C112 L115 L135 I139 L142 F184	L104-L108 HydrophobicContact CD1-CD1 4.46Å; L104-L108 HydrophobicContact CD1-CG 4.45Å; L104-L108 HydrophobicContact CG-CD1 3.96Å; L104-L108 HydrophobicContact CG-CG 4.39Å; L104-L108 WeakPolarHBondContact O-CB 3.45Å; L104-L108 VanDerWaalsContact O-CG 3.3Å; L104-L108 WeakPolarHBondContact O-CG 3.5Å; L104-L108 PolarHBondContact O-N 3.22Å; H105-L108 PolarHBondContact O-N 3.4Å; L108-C112 CarbonylContact O-C 3.59Å; L108-C112 VanDerWaalsContact O-CA 3.29Å; L108-C112 WeakPolarHBondContact O-CA 3.43Å; L108-C112 VanDerWaalsContact O-CB 3.32Å; L108-C112 WeakPolarHBondContact O-CB 3.5Å; L108-C112 PolarHBondContact O-N 2.94Å; L108-L115 HydrophobicContact CB-CD2 4.16Å; L108-L115 HydrophobicContact CD1-CD2 4.37Å; L108-L115 HydrophobicContact CD2-CD2 4.07Å; L108-L115 HydrophobicContact CG-CD2 4.44Å; L108-L135 HydrophobicContact CD1-CD1 3.66Å; L108-I139 HydrophobicContact CD1-CG1 4.16Å; L108-I139 HydrophobicContact CD2-CG1 4.12Å; L108-L142 HydrophobicContact CD2-CD1 3.91Å; L108-L142 HydrophobicContact CD2-CG 4.33Å; L108-L142 HydrophobicContact CG-CD1 4.26Å; L108-F184 HydrophobicContact CD1-CZ 4.21Å
109	L	86.3	Confident	87	Confident	49 Å²	49	53.9 Å²	53.9	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-41.5	174.8	-75.2	173.1	0	0	0	112	H105 R106 I116	H105-L109 PolarHBondContact O-N 3Å; R106-L109 PolarHBondContact O-N 2.74Å; L109-I116 HydrophobicContact CD2-CB 4.35Å; L109-I116 HydrophobicContact CD2-CD1 3.9Å; L109-I116 HydrophobicContact CD2-CG1 4.38Å; L109-I116 HydrophobicContact CG-CD1 4.36Å
110	A	84.1	Confident	87.2	Confident	81 Å²	81	55.5 Å²	55.5	67%	0.669	28%	0.281	S	S	*	.	H	α-helix	trans	-67.3	-39.8	179	0	0	0	0	0	112.9	R106 Q107	R106-A110 PolarHBondContact O-N 2.85Å; Q107-A110 PolarHBondContact O-N 2.71Å
111	T	84.1	Confident	87.2	Confident	76 Å²	76	59.1 Å²	59.1	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-92.6	-28.4	-173.5	-48.5	0	0	0	0	112.6	Q107 L142	Q107-T111 WeakPolarHBondContact O-CB 3.37Å; Q107-T111 PolarHBondContact O-N 2.59Å; Q107-T111 PolarHBondContact O-OG1 2.77Å; T111-L142 HydrophobicContact CG2-CD2 3.97Å
112	C	85.9	Confident	87	Confident	30 Å²	30	66 Å²	66	20%	0.203	33%	0.326	C	S	.	.			trans	-133.1	69.2	-174.3	-61.2	0	0	0	0	111	L108 N114 L115	L108-C112 CarbonylContact O-C 3.59Å; L108-C112 VanDerWaalsContact O-CA 3.29Å; L108-C112 WeakPolarHBondContact O-CA 3.43Å; L108-C112 VanDerWaalsContact O-CB 3.32Å; L108-C112 WeakPolarHBondContact O-CB 3.5Å; L108-C112 PolarHBondContact O-N 2.94Å; C112-N114 PolarHBondContact O-N 2.88Å; C112-L115 HydrophobicContact CB-CB 3.95Å; C112-L115 HydrophobicContact CB-CD2 4.42Å; C112-L115 WeakPolarHBondContact O-CB 3.26Å; C112-L115 PolarHBondContact O-N 3.25Å
113	P	79.8	Confident	86.9	Confident	90 Å²	90	69.8 Å²	69.8	58%	0.584	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.6	-171.5	23.8	-34.6	0	0	0	114.4
114	N	85.8	Confident	86.9	Confident	130 Å²	130	77.7 Å²	77.7	70%	0.695	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-1.1	178.4	-67.7	-40.6	0	0	0	114.1	C112 R117	C112-N114 PolarHBondContact O-N 2.88Å; N114-R117 WeakPolarHBondContact O-CD 3.41Å; N114-R117 PolarHBondContact O-NE 2.83Å
115	L	88.6	Confident	87	Confident	13 Å²	13	81.7 Å²	81.7	7%	0.068	40%	0.403	C	S	.	.	S	Bend	trans	-65.4	-50	-175.5	178.6	61.2	0	0	0	111.5	L108 C112 R119 C130 E134 L135	L108-L115 HydrophobicContact CB-CD2 4.16Å; L108-L115 HydrophobicContact CD1-CD2 4.37Å; L108-L115 HydrophobicContact CD2-CD2 4.07Å; L108-L115 HydrophobicContact CG-CD2 4.44Å; C112-L115 HydrophobicContact CB-CB 3.95Å; C112-L115 HydrophobicContact CB-CD2 4.42Å; C112-L115 WeakPolarHBondContact O-CB 3.26Å; C112-L115 PolarHBondContact O-N 3.25Å; L115-R119 PolarHBondContact O-NH2 3.07Å; L115-C130 HydrophobicContact CD1-CB 3.87Å; L115-C130 HydrophobicContact CG-CB 3.93Å; L115-C130 WeakPolarHBondContact O-CB 3.22Å; L115-E134 HydrophobicContact CD1-CB 3.55Å; L115-E134 WeakPolarHBondContact CD1-O 3.45Å; L115-L135 HydrophobicContact CD2-CD1 4.18Å
116	I	88.9	Confident	86.9	Confident	22 Å²	22	81.8 Å²	81.8	11%	0.113	40%	0.403	C	S	.	.	S	Bend	trans	-97.2	114.2	-178.3	-56	-178.1	0	0	0	108.4	H105 L109 Q128 F184	H105-I116 WeakPolarHBondContact NE2-CD1 3.35Å; L109-I116 HydrophobicContact CD2-CB 4.35Å; L109-I116 HydrophobicContact CD2-CD1 3.9Å; L109-I116 HydrophobicContact CD2-CG1 4.38Å; L109-I116 HydrophobicContact CG-CD1 4.36Å; I116-Q128 HydrophobicContact CG2-CB 4.25Å; I116-F184 HydrophobicContact CD1-CD2 3.98Å; I116-F184 HydrophobicContact CD1-CE2 4.41Å
117	R	89.6	Confident	87.1	Confident	123 Å²	123	84.7 Å²	84.7	46%	0.464	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	168	-177.1	55.3	-178.5	171.6	142.4	-1.3	111.9	N114 R119 C129 E134	N114-R117 WeakPolarHBondContact O-CD 3.41Å; N114-R117 PolarHBondContact O-NE 2.83Å; R117-R119 HydrophobicContact CG-CG 4.33Å; R117-C129 PolarHBondContact N-O 3.33Å; R117-C129 VanDerWaalsContact N-O 3.1Å; R117-C129 PolarHBondContact O-N 3.47Å; R117-E134 IonicContact NH2-OE1 3.37Å; R117-E134 PolarHBondContact NH2-OE1 2.88Å
118	D	90.2	Very high	87.1	Confident	64 Å²	64	88 Å²	88	34%	0.342	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127.5	171.7	-76.3	11.5	0	0	0	110.1	L125 Y126 R127 Q128	D118-L125 HydrophobicContact CB-CD1 4.14Å; D118-Y126 CarbonylContact C-O 3.49Å; D118-Y126 WeakPolarHBondContact CA-O 3.27Å; D118-R127 WeakPolarHBondContact OD1-CA 3.48Å; D118-R127 WeakPolarHBondContact OD1-CB 3.3Å; D118-R127 IonicContact OD2-CZ 3.3Å; D118-R127 IonicContact OD2-NE 2.62Å; D118-R127 PolarHBondContact OD2-NE 2.9Å; D118-R127 IonicContact OD2-NH2 3.39Å; D118-Q128 PolarHBondContact OD1-N 3.33Å
119	R	89	Confident	87.3	Confident	29 Å²	29	87.9 Å²	87.9	11%	0.109	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.7	-176.7	-63.4	-179.5	-176.7	-105.6	-8.5	110.9	L115 R117 Y126 C129 E134	L115-R119 PolarHBondContact O-NH2 3.07Å; R117-R119 HydrophobicContact CG-CG 4.33Å; R119-Y126 PolarHBondContact N-O 3.31Å; R119-Y126 PolarHBondContact O-N 3.01Å; R119-C129 PolarHBondContact NE-O 2.76Å; R119-C129 VanDerWaalsContact NE-O 3.11Å; R119-E134 IonicContact CZ-OE1 3.26Å; R119-E134 IonicContact CZ-OE2 3.58Å; R119-E134 IonicContact NE-OE2 2.7Å; R119-E134 VanDerWaalsContact NH1-CD 3.3Å; R119-E134 IonicContact NH1-OE1 3.88Å; R119-E134 PolarHBondContact NH1-OE1 3.03Å; R119-E134 VanDerWaalsContact NH1-OE1 3.08Å; R119-E134 IonicContact NH1-OE2 2.9Å; R119-E134 PolarHBondContact NH1-OE2 2.83Å; R119-E134 IonicContact NH2-OE1 2.76Å; R119-E134 PolarHBondContact NH2-OE1 2.82Å; R119-E134 IonicContact NH2-OE2 3.83Å; R119-E134 PolarHBondContact NH2-OE2 3.45Å
120	K	87.9	Confident	87.6	Confident	178 Å²	178	85.6 Å²	85.6	77%	0.774	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.9	172.2	-69.7	-177.9	-178.4	177.6	0	109.7	R124 L125	K120-R124 CarbonylContact C-O 3.5Å; K120-R124 WeakPolarHBondContact CA-O 3.34Å; K120-L125 HydrophobicContact CD-CD1 4.46Å; K120-L125 HydrophobicContact CG-CD1 3.56Å
121	Y	87.8	Confident	88.1	Confident	81 Å²	81	81.8 Å²	81.8	32%	0.318	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	129.2	177	-175.4	-103.3	0	0	0	110.2	L123 R124 A179 F181	Y121-L123 VanDerWaalsContact C-N 3.3Å; Y121-L123 PolarHBondContact O-N 3.21Å; Y121-R124 PolarHBondContact N-O 2.88Å; Y121-R124 PolarHBondContact O-N 2.87Å; Y121-A179 HydrophobicContact CE2-CB 4.42Å; Y121-F181 AromaticContact CD1-CE2 3.86Å; Y121-F181 HydrophobicContact CD1-CE2 3.86Å; Y121-F181 HydrophobicContact CD1-CZ 4.41Å; Y121-F181 HydrophobicContact CD2-CE2 4.46Å; Y121-F181 HydrophobicContact CD2-CZ 4.23Å; Y121-F181 AromaticContact CG-CE2 3.74Å; Y121-F181 HydrophobicContact CG-CE2 3.74Å; Y121-F181 AromaticContact CG-CZ 3.92Å; Y121-F181 HydrophobicContact CG-CZ 3.92Å
122	H	84.3	Confident	88.6	Confident	147 Å²	147	78.2 Å²	78.2	68%	0.681	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.2	51	-169.3	-66.7	-62.7	0	0	0	113.6	R124	H122-R124 PolarHBondContact O-N 3.44Å
123	L	86.3	Confident	89	Confident	186 Å²	186	82.4 Å²	82.4	97%	0.974	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	3.7	179.8	-53.2	170.3	0	0	0	115.4	Y121	Y121-L123 VanDerWaalsContact C-N 3.3Å; Y121-L123 PolarHBondContact O-N 3.21Å
124	R	87.4	Confident	89.6	Confident	175 Å²	175	80.4 Å²	80.4	66%	0.66	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.1	172.1	-66.5	-174.6	-179.2	-176.8	0.1	110.5	K120 Y121 H122 Y126	K120-R124 CarbonylContact C-O 3.5Å; K120-R124 WeakPolarHBondContact CA-O 3.34Å; Y121-R124 PolarHBondContact N-O 2.88Å; Y121-R124 PolarHBondContact O-N 2.87Å; H122-R124 PolarHBondContact O-N 3.44Å; R124-Y126 HydrophobicContact CB-CE2 4.02Å
125	L	89.1	Confident	90	Very high	84 Å²	84	74.2 Å²	74.2	44%	0.44	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.2	174.4	-177.1	71.2	0	0	0	109.5	D118 K120 R127	D118-L125 HydrophobicContact CB-CD1 4.14Å; K120-L125 HydrophobicContact CD-CD1 4.46Å; K120-L125 HydrophobicContact CG-CD1 3.56Å; L125-R127 HydrophobicContact CD2-CG 4.25Å; L125-R127 HydrophobicContact CG-CG 4.27Å
126	Y	89.1	Confident	90.3	Very high	29 Å²	29	73.6 Å²	73.6	11%	0.114	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	113.6	172.4	-59.1	-73.3	0	0	0	108.6	D118 R119 R124 C129 V168 F181	D118-Y126 CarbonylContact C-O 3.49Å; D118-Y126 WeakPolarHBondContact CA-O 3.27Å; R119-Y126 PolarHBondContact N-O 3.31Å; R119-Y126 PolarHBondContact O-N 3.01Å; R124-Y126 HydrophobicContact CB-CE2 4.02Å; Y126-C129 PolarHBondContact O-SG 2.89Å; Y126-C129 VanDerWaalsContact O-SG 3.36Å; Y126-V168 HydrophobicContact CD1-CB 4.41Å; Y126-V168 HydrophobicContact CD1-CG1 3.31Å; Y126-V168 HydrophobicContact CE1-CG1 3.79Å; Y126-V168 HydrophobicContact CG-CG1 4.23Å; Y126-F181 AromaticContact CD2-CD2 3.8Å; Y126-F181 HydrophobicContact CD2-CD2 3.8Å; Y126-F181 AromaticContact CD2-CE2 3.93Å; Y126-F181 HydrophobicContact CD2-CE2 3.93Å; Y126-F181 HydrophobicContact CE2-CD2 4.08Å; Y126-F181 HydrophobicContact CE2-CE2 4.06Å; Y126-F181 HydrophobicContact CG-CD2 4.24Å
127	R	89.1	Confident	90.5	Very high	157 Å²	157	75.9 Å²	75.9	59%	0.592	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	145.9	-174.3	-52.3	-169.9	92	147.2	0.7	112.1	D118 L125 C129 R183	D118-R127 WeakPolarHBondContact OD1-CA 3.48Å; D118-R127 WeakPolarHBondContact OD1-CB 3.3Å; D118-R127 IonicContact OD2-CZ 3.3Å; D118-R127 IonicContact OD2-NE 2.62Å; D118-R127 PolarHBondContact OD2-NE 2.9Å; D118-R127 IonicContact OD2-NH2 3.39Å; L125-R127 HydrophobicContact CD2-CG 4.25Å; L125-R127 HydrophobicContact CG-CG 4.27Å; R127-C129 PolarHBondContact O-N 3.07Å; R127-R183 PolarHBondContact O-NE 3.44Å; R127-R183 PolarHBondContact O-NH2 2.92Å
128	Q	88.4	Confident	90.5	Very high	102 Å²	102	70.3 Å²	70.3	48%	0.477	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.3	62.6	173.8	-64.6	-64.3	-14.8	0	0	112.3	I116 D118	I116-Q128 HydrophobicContact CG2-CB 4.25Å; D118-Q128 PolarHBondContact OD1-N 3.33Å
129	C	90.9	Very high	90.5	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	157.2	-175.7	67.5	0	0	0	0	112.4	R117 R119 Y126 R127 V168 F181 Y182	R117-C129 PolarHBondContact N-O 3.33Å; R117-C129 VanDerWaalsContact N-O 3.1Å; R117-C129 PolarHBondContact O-N 3.47Å; R119-C129 PolarHBondContact NE-O 2.76Å; R119-C129 VanDerWaalsContact NE-O 3.11Å; Y126-C129 PolarHBondContact O-SG 2.89Å; Y126-C129 VanDerWaalsContact O-SG 3.36Å; R127-C129 PolarHBondContact O-N 3.07Å; C129-V168 HydrophobicContact CB-CG2 4.24Å; C129-F181 HydrophobicContact CB-CB 4.42Å; C129-Y182 VanDerWaalsContact CA-O 3.25Å; C129-Y182 WeakPolarHBondContact CA-O 3.25Å; C129-Y182 VanDerWaalsContact CB-O 3.29Å; C129-Y182 WeakPolarHBondContact CB-O 3.39Å
130	C	93.3	Very high	90.5	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.007	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	151.2	173.2	56.6	0	0	0	0	110	L115 F181 Y182	L115-C130 HydrophobicContact CD1-CB 3.87Å; L115-C130 HydrophobicContact CG-CB 3.93Å; L115-C130 WeakPolarHBondContact O-CB 3.22Å; C130-F181 WeakPolarHBondContact O-CA 3.42Å; C130-Y182 PolarHBondContact N-O 3.33Å; C130-Y182 PolarHBondContact O-N 3.25Å
131	S	94.9	Very high	90.5	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.007	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	153.5	167.4	71	0	0	0	0	110.1	R133 E134 L135 D178 Q180	S131-R133 PolarHBondContact O-N 3.22Å; S131-E134 VanDerWaalsContact CB-OE2 3.29Å; S131-E134 WeakPolarHBondContact CB-OE2 3.34Å; S131-E134 PolarHBondContact N-OE2 3.48Å; S131-E134 PolarHBondContact O-N 3.38Å; S131-E134 WeakPolarHBondContact OG-CB 3.42Å; S131-E134 VanDerWaalsContact OG-CD 3.25Å; S131-E134 VanDerWaalsContact OG-CG 3.3Å; S131-E134 WeakPolarHBondContact OG-CG 3.19Å; S131-E134 PolarHBondContact OG-N 3.24Å; S131-E134 VanDerWaalsContact OG-N 3.12Å; S131-E134 PolarHBondContact OG-OE2 3.44Å; S131-L135 WeakPolarHBondContact O-CB 3.36Å; S131-L135 PolarHBondContact O-N 3.02Å; S131-D178 WeakPolarHBondContact CB-O 3.29Å; S131-Q180 CarbonylContact C-O 3.6Å; S131-Q180 VanDerWaalsContact CA-O 3.29Å; S131-Q180 WeakPolarHBondContact CA-O 3.28Å
132	G	94.1	Very high	90.3	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-56.8	-40.2	175.1	0	0	0	0	0	112	L135 V136 R177 Q180	G132-L135 PolarHBondContact O-N 2.91Å; G132-V136 WeakPolarHBondContact O-CG2 3.22Å; G132-V136 PolarHBondContact O-N 3.12Å; G132-R177 PolarHBondContact N-O 3.14Å; G132-Q180 PolarHBondContact N-O 2.69Å
133	R	94.1	Very high	89.7	Confident	118 Å²	118	56.9 Å²	56.9	45%	0.445	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-50.5	179.3	-169.4	-176	-173.3	156.7	-0.1	113.4	S131 L135 V136 D137 D176 R177 D178	S131-R133 PolarHBondContact O-N 3.22Å; R133-L135 VanDerWaalsContact C-N 3.26Å; R133-L135 PolarHBondContact O-N 3.42Å; R133-V136 PolarHBondContact O-N 3.3Å; R133-D137 VanDerWaalsContact O-CG 3.28Å; R133-D137 PolarHBondContact O-N 3.37Å; R133-D176 WeakPolarHBondContact CA-OD1 3.29Å; R133-R177 PolarHBondContact N-O 2.88Å; R133-D178 WeakPolarHBondContact CB-OD1 3.3Å; R133-D178 VanDerWaalsContact CD-CG 3.43Å; R133-D178 WeakPolarHBondContact CD-OD1 3.36Å; R133-D178 WeakPolarHBondContact CD-OD2 3.22Å; R133-D178 IonicContact CZ-OD2 3.01Å; R133-D178 IonicContact NE-OD2 2.9Å; R133-D178 IonicContact NH1-OD2 3.98Å; R133-D178 PolarHBondContact NH1-OD2 3.37Å
134	E	93.8	Very high	89.1	Confident	49 Å²	49	50.1 Å²	50.1	23%	0.229	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-31.6	179.1	-67.7	156.2	136	0	0	111.4	L115 R117 R119 S131 D137 G138	L115-E134 HydrophobicContact CD1-CB 3.55Å; L115-E134 WeakPolarHBondContact CD1-O 3.45Å; R117-E134 IonicContact NH2-OE1 3.37Å; R117-E134 PolarHBondContact NH2-OE1 2.88Å; R119-E134 IonicContact CZ-OE1 3.26Å; R119-E134 IonicContact CZ-OE2 3.58Å; R119-E134 IonicContact NE-OE2 2.7Å; R119-E134 VanDerWaalsContact NH1-CD 3.3Å; R119-E134 IonicContact NH1-OE1 3.88Å; R119-E134 PolarHBondContact NH1-OE1 3.03Å; R119-E134 VanDerWaalsContact NH1-OE1 3.08Å; R119-E134 IonicContact NH1-OE2 2.9Å; R119-E134 PolarHBondContact NH1-OE2 2.83Å; R119-E134 IonicContact NH2-OE1 2.76Å; R119-E134 PolarHBondContact NH2-OE1 2.82Å; R119-E134 IonicContact NH2-OE2 3.83Å; R119-E134 PolarHBondContact NH2-OE2 3.45Å; S131-E134 VanDerWaalsContact CB-OE2 3.29Å; S131-E134 WeakPolarHBondContact CB-OE2 3.34Å; S131-E134 PolarHBondContact N-OE2 3.48Å; S131-E134 PolarHBondContact O-N 3.38Å; S131-E134 WeakPolarHBondContact OG-CB 3.42Å; S131-E134 VanDerWaalsContact OG-CD 3.25Å; S131-E134 VanDerWaalsContact OG-CG 3.3Å; S131-E134 WeakPolarHBondContact OG-CG 3.19Å; S131-E134 PolarHBondContact OG-N 3.24Å; S131-E134 VanDerWaalsContact OG-N 3.12Å; S131-E134 PolarHBondContact OG-OE2 3.44Å; E134-D137 PolarHBondContact O-N 2.8Å; E134-G138 PolarHBondContact O-N 3.44Å
135	L	94.1	Very high	88.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-42.7	174.5	-179	59.8	0	0	0	111	L108 L115 S131 G132 R133 D137 G138 I139 L165 F174 F184	L108-L135 HydrophobicContact CD1-CD1 3.66Å; L115-L135 HydrophobicContact CD2-CD1 4.18Å; S131-L135 WeakPolarHBondContact O-CB 3.36Å; S131-L135 PolarHBondContact O-N 3.02Å; G132-L135 PolarHBondContact O-N 2.91Å; R133-L135 VanDerWaalsContact C-N 3.26Å; R133-L135 PolarHBondContact O-N 3.42Å; L135-D137 VanDerWaalsContact C-N 3.35Å; L135-G138 PolarHBondContact O-N 3.08Å; L135-I139 HydrophobicContact CD1-CD1 4.06Å; L135-I139 HydrophobicContact CD1-CG1 4.36Å; L135-I139 HydrophobicContact CG-CD1 4.11Å; L135-I139 WeakPolarHBondContact O-CG1 3.44Å; L135-I139 PolarHBondContact O-N 3.44Å; L135-L165 HydrophobicContact CD2-CD1 4.24Å; L135-L165 HydrophobicContact CD2-CD2 3.85Å; L135-F174 HydrophobicContact CD2-CE2 3.97Å; L135-F174 HydrophobicContact CD2-CZ 4.23Å; L135-F184 HydrophobicContact CD1-CE2 4.22Å; L135-F184 HydrophobicContact CD1-CZ 4.25Å
136	V	94.3	Very high	87.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-46.1	174.4	170.4	0	0	0	0	111	G132 R133 G138 I139 L140 R149 V152 V153 F174 D176	G132-V136 WeakPolarHBondContact O-CG2 3.22Å; G132-V136 PolarHBondContact O-N 3.12Å; R133-V136 PolarHBondContact O-N 3.3Å; V136-G138 VanDerWaalsContact C-N 3.35Å; V136-G138 PolarHBondContact O-N 3.08Å; V136-I139 PolarHBondContact O-N 3.23Å; V136-L140 HydrophobicContact CG1-CD1 4.11Å; V136-L140 WeakPolarHBondContact O-CG 3.2Å; V136-L140 PolarHBondContact O-N 3.42Å; V136-R149 HydrophobicContact CG1-CB 4.07Å; V136-R149 HydrophobicContact CG1-CG 4.12Å; V136-V152 HydrophobicContact CB-CG1 4.2Å; V136-V152 HydrophobicContact CG1-CB 4.16Å; V136-V152 HydrophobicContact CG1-CG1 4.19Å; V136-V152 HydrophobicContact CG2-CB 4.48Å; V136-V152 HydrophobicContact CG2-CG1 4Å; V136-V153 HydrophobicContact CG2-CG2 4.26Å; V136-F174 HydrophobicContact CG2-CE1 3.81Å; V136-F174 HydrophobicContact CG2-CZ 4.14Å; V136-D176 HydrophobicContact CG2-CB 4.26Å
137	D	92.4	Very high	87.3	Confident	69 Å²	69	44.7 Å²	44.7	37%	0.369	24%	0.241	S	C	.	.	H	α-helix	trans	-62.9	-41.2	178.5	-66	-23.2	0	0	0	111.8	R133 E134 L135 L140 A141 R149	R133-D137 VanDerWaalsContact O-CG 3.28Å; R133-D137 PolarHBondContact O-N 3.37Å; E134-D137 PolarHBondContact O-N 2.8Å; L135-D137 VanDerWaalsContact C-N 3.35Å; D137-L140 PolarHBondContact O-N 3.36Å; D137-A141 WeakPolarHBondContact O-CB 3.36Å; D137-A141 PolarHBondContact O-N 2.84Å; D137-R149 IonicContact OD1-CZ 3.15Å; D137-R149 IonicContact OD1-NH1 2.72Å; D137-R149 PolarHBondContact OD1-NH1 3.38Å; D137-R149 IonicContact OD1-NH2 2.69Å; D137-R149 PolarHBondContact OD1-NH2 2.68Å
138	G	90.8	Very high	87.1	Confident	6 Å²	6	39.3 Å²	39.3	6%	0.062	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-46.9	177.4	0	0	0	0	0	112.5	E134 L135 V136 L140 A141 L142	E134-G138 PolarHBondContact O-N 3.44Å; L135-G138 PolarHBondContact O-N 3.08Å; V136-G138 VanDerWaalsContact C-N 3.35Å; V136-G138 PolarHBondContact O-N 3.08Å; G138-L140 PolarHBondContact O-N 2.87Å; G138-A141 WeakPolarHBondContact O-CB 3.26Å; G138-A141 PolarHBondContact O-N 3.39Å; G138-L142 PolarHBondContact O-N 3.3Å
139	I	90.4	Very high	87.1	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-38.6	178.5	-65.3	167.4	0	0	0	111.1	L104 L108 L135 V136 A141 L142 V152	L104-I139 HydrophobicContact CD1-CG1 4.45Å; L104-I139 HydrophobicContact CD2-CD1 4Å; L104-I139 HydrophobicContact CD2-CG1 4.29Å; L108-I139 HydrophobicContact CD1-CG1 4.16Å; L108-I139 HydrophobicContact CD2-CG1 4.12Å; L135-I139 HydrophobicContact CD1-CD1 4.06Å; L135-I139 HydrophobicContact CD1-CG1 4.36Å; L135-I139 HydrophobicContact CG-CD1 4.11Å; L135-I139 WeakPolarHBondContact O-CG1 3.44Å; L135-I139 PolarHBondContact O-N 3.44Å; V136-I139 PolarHBondContact O-N 3.23Å; I139-A141 VanDerWaalsContact C-N 3.3Å; I139-A141 PolarHBondContact O-N 3.21Å; I139-L142 PolarHBondContact O-N 2.9Å; I139-V152 HydrophobicContact CB-CG1 3.75Å; I139-V152 HydrophobicContact CB-CG2 4.4Å; I139-V152 HydrophobicContact CD1-CG1 3.66Å; I139-V152 HydrophobicContact CG1-CG1 4.28Å; I139-V152 HydrophobicContact CG2-CG1 3.84Å; I139-V152 HydrophobicContact CG2-CG2 3.96Å
140	L	88.4	Confident	86.9	Confident	51 Å²	51	41.5 Å²	41.5	27%	0.267	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-38.3	174	-73.9	173.3	0	0	0	112	V136 D137 G138 L142 G143 V146 R149 V152	V136-L140 HydrophobicContact CG1-CD1 4.11Å; V136-L140 WeakPolarHBondContact O-CG 3.2Å; V136-L140 PolarHBondContact O-N 3.42Å; D137-L140 PolarHBondContact O-N 3.36Å; G138-L140 PolarHBondContact O-N 2.87Å; L140-L142 PolarHBondContact O-N 3.32Å; L140-G143 PolarHBondContact O-N 3.38Å; L140-V146 HydrophobicContact CD2-CG1 4.39Å; L140-R149 HydrophobicContact CD1-CG 3.97Å; L140-V152 HydrophobicContact CD2-CG2 3.75Å; L140-V152 HydrophobicContact CG-CG2 3.9Å
141	A	87.2	Confident	86.5	Confident	73 Å²	73	44.2 Å²	44.2	60%	0.603	25%	0.254	S	S	*	.	H	α-helix	trans	-65.3	-25	179	0	0	0	0	0	113.3	D137 G138 I139 G143	D137-A141 WeakPolarHBondContact O-CB 3.36Å; D137-A141 PolarHBondContact O-N 2.84Å; G138-A141 WeakPolarHBondContact O-CB 3.26Å; G138-A141 PolarHBondContact O-N 3.39Å; I139-A141 VanDerWaalsContact C-N 3.3Å; I139-A141 PolarHBondContact O-N 3.21Å; A141-G143 PolarHBondContact O-N 2.65Å
142	L	84.3	Confident	86.4	Confident	29 Å²	29	44.1 Å²	44.1	15%	0.152	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.7	176.3	-61.2	178.5	0	0	0	113.2	L104 L108 T111 G138 I139 L140 L144	L104-L142 HydrophobicContact CD1-CD1 3.7Å; L108-L142 HydrophobicContact CD2-CD1 3.91Å; L108-L142 HydrophobicContact CD2-CG 4.33Å; L108-L142 HydrophobicContact CG-CD1 4.26Å; T111-L142 HydrophobicContact CG2-CD2 3.97Å; G138-L142 PolarHBondContact O-N 3.3Å; I139-L142 PolarHBondContact O-N 2.9Å; L140-L142 PolarHBondContact O-N 3.32Å; L142-L144 VanDerWaalsContact C-N 3.28Å; L142-L144 HydrophobicContact CB-CD1 3.67Å; L142-L144 HydrophobicContact CB-CG 3.86Å; L142-L144 HydrophobicContact CD1-CD1 3.85Å; L142-L144 HydrophobicContact CG-CD1 4.38Å; L142-L144 PolarHBondContact O-N 2.84Å
143	G	72.3	Confident	86.3	Confident	61 Å²	61	45.3 Å²	45.3	63%	0.629	26%	0.261	S	S	*	.			trans	66.9	21.6	174.4	0	0	0	0	0	115.5	L140 A141 G145	L140-G143 PolarHBondContact O-N 3.38Å; A141-G143 PolarHBondContact O-N 2.65Å; G143-G145 PolarHBondContact O-N 2.88Å
144	L	73.5	Confident	86.1	Confident	43 Å²	43	39.8 Å²	39.8	23%	0.225	24%	0.24	C	C	.	.	S	Bend	trans	-81.7	36.5	-172.2	-62	165.3	0	0	0	114.1	L142 V146 L203 V207	L142-L144 VanDerWaalsContact C-N 3.28Å; L142-L144 HydrophobicContact CB-CD1 3.67Å; L142-L144 HydrophobicContact CB-CG 3.86Å; L142-L144 HydrophobicContact CD1-CD1 3.85Å; L142-L144 HydrophobicContact CG-CD1 4.38Å; L142-L144 PolarHBondContact O-N 2.84Å; L144-V146 VanDerWaalsContact C-N 3.34Å; L144-V146 PolarHBondContact O-N 2.83Å; L144-L203 HydrophobicContact CD1-CD1 4.16Å; L144-L203 HydrophobicContact CD1-CD2 3.54Å; L144-L203 HydrophobicContact CD1-CG 3.67Å; L144-L203 HydrophobicContact CD2-CD2 3.96Å; L144-L203 HydrophobicContact CD2-CG 4.3Å; L144-L203 HydrophobicContact CG-CD2 4.38Å; L144-V207 HydrophobicContact CB-CB 4.28Å; L144-V207 HydrophobicContact CB-CG1 4.04Å; L144-V207 HydrophobicContact CB-CG2 4.26Å; L144-V207 HydrophobicContact CD1-CG2 3.67Å
145	G	68.6	Low	86	Confident	28 Å²	28	37.4 Å²	37.4	29%	0.289	23%	0.229	S	C	.	.	S	Bend	trans	77.6	14.2	179.2	0	0	0	0	0	115.4	G143 H147	G143-G145 PolarHBondContact O-N 2.88Å; G145-H147 VanDerWaalsContact C-CE1 3.49Å; G145-H147 PolarHBondContact O-CE1 2.78Å; G145-H147 PolarHBondContact O-ND1 2.89Å
146	V	78.5	Confident	86	Confident	14 Å²	14	37.4 Å²	37.4	9%	0.085	23%	0.229	C	C	.	.			trans	-95.2	129.8	168.9	-172	0	0	0	0	109	L140 L144 Q151 V152 I155 V207	L140-V146 HydrophobicContact CD2-CG1 4.39Å; L144-V146 VanDerWaalsContact C-N 3.34Å; L144-V146 PolarHBondContact O-N 2.83Å; V146-Q151 HydrophobicContact CG1-CB 3.64Å; V146-V152 HydrophobicContact CB-CG2 4.43Å; V146-V152 HydrophobicContact CG1-CG2 3.45Å; V146-V152 VanDerWaalsContact CG1-CG2 3.45Å; V146-I155 HydrophobicContact CG1-CD1 4.33Å; V146-I155 HydrophobicContact CG2-CD1 3.67Å; V146-V207 HydrophobicContact CG2-CG1 3.64Å
147	H	79.1	Confident	86	Confident	132 Å²	132	37.5 Å²	37.5	61%	0.611	23%	0.23	S	C	*	.			trans	-121.8	0.7	-166.8	-51.8	89.9	0	0	0	114.1	G145	G145-H147 VanDerWaalsContact C-CE1 3.49Å; G145-H147 PolarHBondContact O-CE1 2.78Å; G145-H147 PolarHBondContact O-ND1 2.89Å
148	S	84.8	Confident	86	Confident	45 Å²	45	34.5 Å²	34.5	32%	0.315	21%	0.214	S	C	.	.			trans	-149.4	151.9	-178	66.6	0	0	0	0	111.7	S150 Q151 V152	S148-S150 VanDerWaalsContact C-N 3.31Å; S148-S150 PolarHBondContact O-N 2.91Å; S148-Q151 PolarHBondContact O-N 2.94Å; S148-Q151 WeakPolarHBondContact OG-CB 3.04Å; S148-Q151 VanDerWaalsContact OG-CG 3.24Å; S148-Q151 WeakPolarHBondContact OG-CG 3.32Å; S148-Q151 PolarHBondContact OG-N 3.06Å; S148-V152 PolarHBondContact O-N 3.33Å
149	R	90	Very high	86.2	Confident	84 Å²	84	34.2 Å²	34.2	32%	0.317	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-40.9	175.4	-58.6	-175.3	74.6	79.3	3.8	111.9	V136 D137 L140 Q151 V152 V153 D176	V136-R149 HydrophobicContact CG1-CB 4.07Å; V136-R149 HydrophobicContact CG1-CG 4.12Å; D137-R149 IonicContact OD1-CZ 3.15Å; D137-R149 IonicContact OD1-NH1 2.72Å; D137-R149 PolarHBondContact OD1-NH1 3.38Å; D137-R149 IonicContact OD1-NH2 2.69Å; D137-R149 PolarHBondContact OD1-NH2 2.68Å; L140-R149 HydrophobicContact CD1-CG 3.97Å; R149-Q151 VanDerWaalsContact C-N 3.34Å; R149-Q151 PolarHBondContact O-N 2.81Å; R149-V152 WeakPolarHBondContact O-CB 3.27Å; R149-V152 PolarHBondContact O-N 2.88Å; R149-V153 WeakPolarHBondContact O-CG2 3.22Å; R149-V153 PolarHBondContact O-N 2.94Å; R149-D176 IonicContact CZ-OD1 3.52Å; R149-D176 IonicContact CZ-OD2 3.49Å; R149-D176 IonicContact NE-OD1 3.08Å; R149-D176 IonicContact NE-OD2 2.66Å; R149-D176 PolarHBondContact NE-OD2 3.01Å; R149-D176 IonicContact NH2-OD1 2.7Å; R149-D176 PolarHBondContact NH2-OD1 3.37Å; R149-D176 IonicContact NH2-OD2 3.4Å; R149-D176 PolarHBondContact NH2-OD2 3.2Å
150	S	86.3	Confident	86.3	Confident	63 Å²	63	35 Å²	35	44%	0.441	22%	0.215	S	C	.	.	H	α-helix	trans	-58.1	-42.2	177.2	173.6	0	0	0	0	112.6	S148 V152 V153 G154	S148-S150 VanDerWaalsContact C-N 3.31Å; S148-S150 PolarHBondContact O-N 2.91Å; S150-V152 VanDerWaalsContact C-N 3.32Å; S150-V152 PolarHBondContact O-N 3.18Å; S150-V153 PolarHBondContact O-N 3.28Å; S150-G154 PolarHBondContact O-N 3.14Å
151	Q	85	Confident	86.3	Confident	58 Å²	58	36.2 Å²	36.2	27%	0.271	22%	0.222	S	C	.	.	H	α-helix	trans	-60.7	-41.9	174	-77.8	173.3	-14.6	0	0	112.1	V146 S148 R149 G154 I155	V146-Q151 HydrophobicContact CG1-CB 3.64Å; S148-Q151 PolarHBondContact O-N 2.94Å; S148-Q151 WeakPolarHBondContact OG-CB 3.04Å; S148-Q151 VanDerWaalsContact OG-CG 3.24Å; S148-Q151 WeakPolarHBondContact OG-CG 3.32Å; S148-Q151 PolarHBondContact OG-N 3.06Å; R149-Q151 VanDerWaalsContact C-N 3.34Å; R149-Q151 PolarHBondContact O-N 2.81Å; Q151-G154 PolarHBondContact O-N 3.23Å; Q151-I155 WeakPolarHBondContact O-CG1 3.5Å; Q151-I155 PolarHBondContact O-N 3.41Å
152	V	91.4	Very high	86.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-38.8	177.1	-177	0	0	0	0	111.7	V136 I139 L140 V146 S148 R149 S150 G154 I155 C156	V136-V152 HydrophobicContact CB-CG1 4.2Å; V136-V152 HydrophobicContact CG1-CB 4.16Å; V136-V152 HydrophobicContact CG1-CG1 4.19Å; V136-V152 HydrophobicContact CG2-CB 4.48Å; V136-V152 HydrophobicContact CG2-CG1 4Å; I139-V152 HydrophobicContact CB-CG1 3.75Å; I139-V152 HydrophobicContact CB-CG2 4.4Å; I139-V152 HydrophobicContact CD1-CG1 3.66Å; I139-V152 HydrophobicContact CG1-CG1 4.28Å; I139-V152 HydrophobicContact CG2-CG1 3.84Å; I139-V152 HydrophobicContact CG2-CG2 3.96Å; L140-V152 HydrophobicContact CD2-CG2 3.75Å; L140-V152 HydrophobicContact CG-CG2 3.9Å; V146-V152 HydrophobicContact CB-CG2 4.43Å; V146-V152 HydrophobicContact CG1-CG2 3.45Å; V146-V152 VanDerWaalsContact CG1-CG2 3.45Å; S148-V152 PolarHBondContact O-N 3.33Å; R149-V152 WeakPolarHBondContact O-CB 3.27Å; R149-V152 PolarHBondContact O-N 2.88Å; S150-V152 VanDerWaalsContact C-N 3.32Å; S150-V152 PolarHBondContact O-N 3.18Å; V152-G154 PolarHBondContact O-N 2.85Å; V152-I155 WeakPolarHBondContact O-CB 3.41Å; V152-I155 PolarHBondContact O-N 2.84Å; V152-I155 VanDerWaalsContact O-N 3.13Å; V152-C156 WeakPolarHBondContact O-CB 3.34Å; V152-C156 PolarHBondContact O-N 3.41Å; V152-C156 PolarHBondContact O-SG 3.19Å; V152-C156 VanDerWaalsContact O-SG 3.38Å
153	V	92.7	Very high	86.5	Confident	25 Å²	25	35.3 Å²	35.3	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-40.7	173	170.9	0	0	0	0	110.4	V136 R149 S150 C156 Q157 F174 D176 L218	V136-V153 HydrophobicContact CG2-CG2 4.26Å; R149-V153 WeakPolarHBondContact O-CG2 3.22Å; R149-V153 PolarHBondContact O-N 2.94Å; S150-V153 PolarHBondContact O-N 3.28Å; V153-C156 PolarHBondContact O-N 3.49Å; V153-Q157 WeakPolarHBondContact O-CB 3.22Å; V153-Q157 PolarHBondContact O-N 2.7Å; V153-F174 HydrophobicContact CB-CD1 4.37Å; V153-F174 HydrophobicContact CG1-CD1 4.09Å; V153-F174 HydrophobicContact CG2-CD1 4.24Å; V153-F174 HydrophobicContact CG2-CE1 4.21Å; V153-D176 HydrophobicContact CG2-CB 3.84Å; V153-L218 HydrophobicContact CG1-CD2 3.8Å
154	G	89.7	Confident	87.4	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-44.9	172.2	0	0	0	0	0	113.5	S150 Q151 V152 C156 Q157 V158 G214	S150-G154 PolarHBondContact O-N 3.14Å; Q151-G154 PolarHBondContact O-N 3.23Å; V152-G154 PolarHBondContact O-N 2.85Å; G154-C156 PolarHBondContact O-N 3.33Å; G154-Q157 PolarHBondContact O-N 3.45Å; G154-V158 WeakPolarHBondContact O-CG2 3.45Å; G154-V158 PolarHBondContact O-N 3.11Å; G154-G214 WeakPolarHBondContact O-CA 3.4Å
155	I	92	Very high	88.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.6	-49.6	174.6	-70.8	167.8	0	0	0	110.8	L104 V146 Q151 V152 Q157 V158 L159 V207 L210 S211	L104-I155 HydrophobicContact CD2-CG2 4.38Å; V146-I155 HydrophobicContact CG1-CD1 4.33Å; V146-I155 HydrophobicContact CG2-CD1 3.67Å; Q151-I155 WeakPolarHBondContact O-CG1 3.5Å; Q151-I155 PolarHBondContact O-N 3.41Å; V152-I155 WeakPolarHBondContact O-CB 3.41Å; V152-I155 PolarHBondContact O-N 2.84Å; V152-I155 VanDerWaalsContact O-N 3.13Å; I155-Q157 VanDerWaalsContact C-N 3.31Å; I155-Q157 PolarHBondContact O-N 2.8Å; I155-V158 PolarHBondContact O-N 3.12Å; I155-L159 HydrophobicContact CG2-CD1 4.32Å; I155-L159 WeakPolarHBondContact O-CG 3.42Å; I155-L159 PolarHBondContact O-N 3.06Å; I155-L159 VanDerWaalsContact O-N 3.09Å; I155-V207 HydrophobicContact CD1-CG1 4.37Å; I155-L210 HydrophobicContact CB-CB 4.31Å; I155-L210 HydrophobicContact CG1-CB 3.99Å; I155-L210 HydrophobicContact CG2-CB 3.87Å; I155-L210 HydrophobicContact CG2-CD1 3.92Å; I155-L210 HydrophobicContact CG2-CG 4.45Å; I155-S211 WeakPolarHBondContact CD1-OG 3.34Å
156	C	94.4	Very high	89.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-33.8	179.8	-68.1	0	0	0	0	112.2	V152 V153 G154 L159 L160 L165 F174	V152-C156 WeakPolarHBondContact O-CB 3.34Å; V152-C156 PolarHBondContact O-N 3.41Å; V152-C156 PolarHBondContact O-SG 3.19Å; V152-C156 VanDerWaalsContact O-SG 3.38Å; V153-C156 PolarHBondContact O-N 3.49Å; G154-C156 PolarHBondContact O-N 3.33Å; C156-L159 PolarHBondContact O-N 3.18Å; C156-L160 WeakPolarHBondContact O-CB 3.27Å; C156-L160 PolarHBondContact O-N 2.93Å; C156-L165 HydrophobicContact CB-CD2 4.34Å; C156-F174 HydrophobicContact CB-CB 4.39Å; C156-F174 HydrophobicContact CB-CD1 3.69Å; C156-F174 HydrophobicContact CB-CD2 3.51Å; C156-F174 HydrophobicContact CB-CE1 3.74Å; C156-F174 HydrophobicContact CB-CE2 3.57Å; C156-F174 HydrophobicContact CB-CG 3.57Å; C156-F174 HydrophobicContact CB-CZ 3.68Å
157	Q	94.7	Very high	90.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-64.2	-44.3	173.7	-173.1	64.7	50	0	0	111.2	V153 G154 I155 L159 L160 D161 W172 F174 A217 L218 V221	V153-Q157 WeakPolarHBondContact O-CB 3.22Å; V153-Q157 PolarHBondContact O-N 2.7Å; G154-Q157 PolarHBondContact O-N 3.45Å; I155-Q157 VanDerWaalsContact C-N 3.31Å; I155-Q157 PolarHBondContact O-N 2.8Å; Q157-L159 VanDerWaalsContact C-N 3.3Å; Q157-L159 PolarHBondContact O-N 3.35Å; Q157-L160 WeakPolarHBondContact O-CB 3.32Å; Q157-L160 PolarHBondContact O-N 3.14Å; Q157-L160 VanDerWaalsContact O-N 3.07Å; Q157-D161 PolarHBondContact NE2-OD1 2.94Å; Q157-D161 VanDerWaalsContact O-CG 3.27Å; Q157-D161 PolarHBondContact O-N 3.2Å; Q157-W172 PolarHBondContact NE2-O 3.31Å; Q157-F174 HydrophobicContact CB-CB 4.45Å; Q157-A217 HydrophobicContact CB-CB 4.06Å; Q157-A217 HydrophobicContact CG-CB 3.72Å; Q157-L218 HydrophobicContact CB-CD2 4.31Å; Q157-V221 HydrophobicContact CG-CG2 3.68Å
158	V	92.3	Very high	90.8	Very high	6 Å²	6	26.6 Å²	26.6	4%	0.036	15%	0.154	C	C	.	.	H	α-helix	trans	-58.6	-43.6	175	170.8	0	0	0	0	111.2	V97 G154 I155 L160 D161 E162 L210 R213 A217	V97-V158 HydrophobicContact CG1-CG1 3.82Å; V97-V158 HydrophobicContact CG2-CG1 4.22Å; G154-V158 WeakPolarHBondContact O-CG2 3.45Å; G154-V158 PolarHBondContact O-N 3.11Å; I155-V158 PolarHBondContact O-N 3.12Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 3.21Å; V158-D161 PolarHBondContact O-N 2.65Å; V158-E162 WeakPolarHBondContact O-CB 3.21Å; V158-E162 WeakPolarHBondContact O-CG 3.1Å; V158-E162 PolarHBondContact O-N 3.22Å; V158-E162 VanDerWaalsContact O-N 3.17Å; V158-L210 HydrophobicContact CB-CD2 4.43Å; V158-L210 HydrophobicContact CG1-CD2 3.76Å; V158-R213 HydrophobicContact CG1-CB 4.13Å; V158-R213 HydrophobicContact CG2-CB 3.65Å; V158-A217 HydrophobicContact CG2-CB 3.67Å
159	L	93.6	Very high	90.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-36.5	176.3	-64.6	172.2	0	0	0	112	V97 L104 I155 C156 Q157 G163 A164 L165 L210	V97-L159 HydrophobicContact CG1-CD2 4.3Å; L104-L159 HydrophobicContact CD2-CD1 3.89Å; I155-L159 HydrophobicContact CG2-CD1 4.32Å; I155-L159 WeakPolarHBondContact O-CG 3.42Å; I155-L159 PolarHBondContact O-N 3.06Å; I155-L159 VanDerWaalsContact O-N 3.09Å; C156-L159 PolarHBondContact O-N 3.18Å; Q157-L159 VanDerWaalsContact C-N 3.3Å; Q157-L159 PolarHBondContact O-N 3.35Å; L159-G163 CarbonylContact O-C 3.57Å; L159-G163 PolarHBondContact O-N 3.36Å; L159-A164 HydrophobicContact CB-CB 4.11Å; L159-A164 HydrophobicContact CD2-CB 3.63Å; L159-A164 HydrophobicContact CG-CB 4.48Å; L159-A164 CarbonylContact O-C 3.55Å; L159-A164 WeakPolarHBondContact O-CA 3.3Å; L159-A164 PolarHBondContact O-N 2.85Å; L159-L165 HydrophobicContact CB-CB 3.72Å; L159-L165 PolarHBondContact O-N 3.5Å; L159-L210 HydrophobicContact CD1-CD1 4.48Å; L159-L210 HydrophobicContact CD2-CD1 4.01Å; L159-L210 HydrophobicContact CD2-CD2 3.73Å; L159-L210 HydrophobicContact CG-CD1 4.39Å; L159-L210 HydrophobicContact CG-CD2 4.19Å
160	L	92.8	Very high	90.7	Very high	21 Å²	21	33.9 Å²	33.9	11%	0.11	19%	0.185	C	C	.	.	H	α-helix	trans	-68.8	-45.8	178.2	-174.1	66.6	0	0	0	111.8	C156 Q157 V158 E162 G163 L165 H167 W172 F174 Y182	C156-L160 WeakPolarHBondContact O-CB 3.27Å; C156-L160 PolarHBondContact O-N 2.93Å; Q157-L160 WeakPolarHBondContact O-CB 3.32Å; Q157-L160 PolarHBondContact O-N 3.14Å; Q157-L160 VanDerWaalsContact O-N 3.07Å; V158-L160 VanDerWaalsContact C-N 3.3Å; V158-L160 PolarHBondContact O-N 3.21Å; L160-E162 VanDerWaalsContact C-N 3.34Å; L160-E162 PolarHBondContact O-N 2.89Å; L160-G163 PolarHBondContact O-N 2.77Å; L160-L165 WeakPolarHBondContact CA-O 3.22Å; L160-L165 WeakPolarHBondContact CD1-O 3.42Å; L160-H167 HydrophobicContact CD1-CB 4.28Å; L160-W172 WeakPolarHBondContact CD2-O 3.38Å; L160-F174 HydrophobicContact CD2-CB 4.2Å; L160-Y182 HydrophobicContact CD2-CE1 4.5Å
161	D	88.2	Confident	90.9	Very high	76 Å²	76	33.3 Å²	33.3	41%	0.406	18%	0.177	S	C	.	.	H	α-helix	trans	-63.4	-39.3	-178.8	-69.3	-21.2	0	0	0	111.9	Q157 V158 G163	Q157-D161 PolarHBondContact NE2-OD1 2.94Å; Q157-D161 VanDerWaalsContact O-CG 3.27Å; Q157-D161 PolarHBondContact O-N 3.2Å; V158-D161 PolarHBondContact O-N 2.65Å; D161-G163 VanDerWaalsContact C-N 3.34Å
162	E	88.9	Confident	90.9	Very high	53 Å²	53	35.7 Å²	35.7	25%	0.248	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	2.7	-178.5	-58.7	-81.7	-172.7	0	0	112.5	T94 V97 V158 L160 A164 R213	T94-E162 WeakPolarHBondContact CB-OE2 3.2Å; T94-E162 VanDerWaalsContact CG2-OE2 3.29Å; T94-E162 WeakPolarHBondContact CG2-OE2 3.36Å; T94-E162 PolarHBondContact OG1-OE2 3.42Å; V97-E162 HydrophobicContact CB-CB 4.19Å; V97-E162 HydrophobicContact CB-CG 4.08Å; V97-E162 HydrophobicContact CG1-CB 3.73Å; V97-E162 HydrophobicContact CG1-CG 3.8Å; V97-E162 HydrophobicContact CG2-CG 4.26Å; V158-E162 WeakPolarHBondContact O-CB 3.21Å; V158-E162 WeakPolarHBondContact O-CG 3.1Å; V158-E162 PolarHBondContact O-N 3.22Å; V158-E162 VanDerWaalsContact O-N 3.17Å; L160-E162 VanDerWaalsContact C-N 3.34Å; L160-E162 PolarHBondContact O-N 2.89Å; E162-A164 VanDerWaalsContact C-N 3.32Å; E162-A164 PolarHBondContact O-N 2.98Å; E162-R213 IonicContact OE1-NH1 2.7Å; E162-R213 PolarHBondContact OE1-NH1 3.38Å
163	G	88.6	Confident	90.9	Very high	31 Å²	31	36.2 Å²	36.2	32%	0.32	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	12.2	176.4	0	0	0	0	0	115.7	L159 L160 D161 L165 P185	L159-G163 CarbonylContact O-C 3.57Å; L159-G163 PolarHBondContact O-N 3.36Å; L160-G163 PolarHBondContact O-N 2.77Å; D161-G163 VanDerWaalsContact C-N 3.34Å; G163-L165 VanDerWaalsContact C-N 3.25Å; G163-P185 WeakPolarHBondContact O-CG 3.35Å
164	A	90.1	Very high	91	Very high	8 Å²	8	35.6 Å²	35.6	7%	0.066	18%	0.183	C	C	.	.	S	Bend	trans	-74.1	-17.8	169.9	0	0	0	0	0	112.9	L98 L159 E162 F184 P185	L98-A164 HydrophobicContact CD2-CB 4.01Å; L159-A164 HydrophobicContact CB-CB 4.11Å; L159-A164 HydrophobicContact CD2-CB 3.63Å; L159-A164 HydrophobicContact CG-CB 4.48Å; L159-A164 CarbonylContact O-C 3.55Å; L159-A164 WeakPolarHBondContact O-CA 3.3Å; L159-A164 PolarHBondContact O-N 2.85Å; E162-A164 VanDerWaalsContact C-N 3.32Å; E162-A164 PolarHBondContact O-N 2.98Å; A164-F184 VanDerWaalsContact O-CD1 3.27Å; A164-F184 WeakPolarHBondContact O-CD1 3.31Å; A164-P185 WeakPolarHBondContact O-CD 3.4Å
165	L	93.6	Very high	91.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-134.4	145.6	172.6	-174	70.7	0	0	0	107.7	L135 C156 L159 L160 G163 F174 Y182 F184	L135-L165 HydrophobicContact CD2-CD1 4.24Å; L135-L165 HydrophobicContact CD2-CD2 3.85Å; C156-L165 HydrophobicContact CB-CD2 4.34Å; L159-L165 HydrophobicContact CB-CB 3.72Å; L159-L165 PolarHBondContact O-N 3.5Å; L160-L165 WeakPolarHBondContact CA-O 3.22Å; L160-L165 WeakPolarHBondContact CD1-O 3.42Å; G163-L165 VanDerWaalsContact C-N 3.25Å; L165-F174 HydrophobicContact CD2-CD2 4.04Å; L165-F174 HydrophobicContact CD2-CE2 4.02Å; L165-Y182 HydrophobicContact CD2-CD1 4.09Å; L165-Y182 HydrophobicContact CD2-CG 4.28Å; L165-Y182 HydrophobicContact CG-CD1 4.33Å; L165-F184 HydrophobicContact CD1-CD1 4.16Å; L165-F184 HydrophobicContact CD1-CD2 4Å; L165-F184 HydrophobicContact CD1-CE1 4.01Å; L165-F184 HydrophobicContact CD1-CE2 3.82Å; L165-F184 HydrophobicContact CD1-CG 4.16Å; L165-F184 HydrophobicContact CD1-CZ 3.83Å
166	C	92.6	Very high	91.2	Very high	52 Å²	52	40.2 Å²	40.2	35%	0.351	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.9	178.4	-59	0	0	0	0	110.3	Y182 R183	C166-Y182 CarbonylContact O-C 3.53Å; C166-Y182 VanDerWaalsContact O-CA 3.25Å; C166-Y182 WeakPolarHBondContact O-CA 3.42Å; C166-R183 PolarHBondContact N-O 3.13Å; C166-R183 PolarHBondContact O-N 3.43Å
167	H	93.9	Very high	91.1	Very high	7 Å²	7	48 Å²	48	3%	0.032	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	134.6	167.4	-173.9	-110.6	0	0	0	109.8	L160 K169 H170 D171 Q180 F181 Y182	L160-H167 HydrophobicContact CD1-CB 4.28Å; H167-K169 PolarHBondContact ND1-N 2.88Å; H167-K169 PolarHBondContact O-N 3.5Å; H167-K169 VanDerWaalsContact O-N 3.13Å; H167-H170 PolarHBondContact O-N 3.02Å; H167-D171 HydrophobicContact CB-CB 4.2Å; H167-D171 WeakPolarHBondContact CB-O 3.28Å; H167-D171 WeakPolarHBondContact ND1-CB 2.95Å; H167-D171 PolarHBondContact ND1-N 3.13Å; H167-D171 VanDerWaalsContact ND1-N 3.15Å; H167-Q180 PolarHBondContact CE1-OE1 2.82Å; H167-Q180 PolarHBondContact NE2-OE1 2.92Å; H167-Q180 VanDerWaalsContact NE2-OE1 3.13Å; H167-F181 PolarHBondContact CD2-O 3.33Å; H167-Y182 HydrophobicContact CB-CD1 3.94Å; H167-Y182 HydrophobicContact CB-CE1 3.82Å; H167-Y182 AromaticContact CD2-CD1 3.88Å; H167-Y182 AromaticContact CD2-CE1 3.46Å; H167-Y182 VanDerWaalsContact CD2-CE1 3.46Å; H167-Y182 WeakPolarHBondContact CD2-CE1 3.43Å; H167-Y182 AromaticContact CD2-CZ 3.58Å
168	V	90.7	Very high	90.8	Very high	27 Å²	27	51.9 Å²	51.9	16%	0.164	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.1	-173	179.3	0	0	0	0	112.8	Y126 C129 F181 R183	Y126-V168 HydrophobicContact CD1-CB 4.41Å; Y126-V168 HydrophobicContact CD1-CG1 3.31Å; Y126-V168 HydrophobicContact CE1-CG1 3.79Å; Y126-V168 HydrophobicContact CG-CG1 4.23Å; C129-V168 HydrophobicContact CB-CG2 4.24Å; V168-F181 HydrophobicContact CB-CB 4.31Å; V168-F181 HydrophobicContact CG2-CB 3.97Å; V168-F181 VanDerWaalsContact CG2-O 3.31Å; V168-F181 WeakPolarHBondContact CG2-O 2.89Å; V168-F181 PolarHBondContact N-O 2.86Å; V168-R183 HydrophobicContact CG2-CB 4.46Å
169	K	87	Confident	90.6	Very high	110 Å²	110	53.3 Å²	53.3	48%	0.478	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	10.7	172.3	-54.2	176.6	-177.4	165.7	0	113.6	H167 D171	H167-K169 PolarHBondContact ND1-N 2.88Å; H167-K169 PolarHBondContact O-N 3.5Å; H167-K169 VanDerWaalsContact O-N 3.13Å; K169-D171 VanDerWaalsContact C-N 3.33Å; K169-D171 PolarHBondContact O-N 3.28Å
170	H	87.1	Confident	90.5	Very high	173 Å²	173	55 Å²	55	80%	0.801	28%	0.277	S	S	*	.			trans	58.8	42.1	-176.9	-47	86.9	0	0	0	113	H167	H167-H170 PolarHBondContact O-N 3.02Å
171	D	89.1	Confident	90.6	Very high	51 Å²	51	54.6 Å²	54.6	27%	0.273	27%	0.274	S	S	.	.			trans	-78.8	143.9	168.3	-160.3	-15.3	0	0	0	107.8	H167 K169 Q175	H167-D171 HydrophobicContact CB-CB 4.2Å; H167-D171 WeakPolarHBondContact CB-O 3.28Å; H167-D171 WeakPolarHBondContact ND1-CB 2.95Å; H167-D171 PolarHBondContact ND1-N 3.13Å; H167-D171 VanDerWaalsContact ND1-N 3.15Å; K169-D171 VanDerWaalsContact C-N 3.33Å; K169-D171 PolarHBondContact O-N 3.28Å; D171-Q175 PolarHBondContact OD2-NE2 2.76Å
172	W	86.1	Confident	90.9	Very high	108 Å²	108	51 Å²	51	41%	0.409	26%	0.255	S	S	.	.	S	Bend	trans	-90.7	-18.7	-172.4	63	-91.4	0	0	0	112.3	Q157 L160 V221 R224	Q157-W172 PolarHBondContact NE2-O 3.31Å; L160-W172 WeakPolarHBondContact CD2-O 3.38Å; W172-V221 HydrophobicContact CE3-CG2 4.47Å; W172-V221 HydrophobicContact CH2-CG1 3.97Å; W172-V221 HydrophobicContact CZ3-CB 3.98Å; W172-V221 HydrophobicContact CZ3-CG1 3.77Å; W172-V221 HydrophobicContact CZ3-CG2 3.85Å; W172-R224 HydrophobicContact CH2-CB 3.7Å; W172-R224 HydrophobicContact CZ2-CB 4.37Å; W172-R224 HydrophobicContact CZ3-CB 4.02Å
173	A	91.6	Very high	91.1	Very high	11 Å²	11	53 Å²	53	9%	0.091	26%	0.26	C	S	.	.	S	Bend	trans	-108.6	128.4	178.5	0	0	0	0	0	111.2	V221	A173-V221 HydrophobicContact CB-CG1 4.05Å
174	F	94.6	Very high	91.2	Very high	12 Å²	12	52.3 Å²	52.3	5%	0.053	25%	0.249	C	C	.	.			trans	-67.9	136.7	171	-173.5	-90.9	0	0	0	110.3	L135 V136 V153 C156 Q157 L160 L165 Y182	L135-F174 HydrophobicContact CD2-CE2 3.97Å; L135-F174 HydrophobicContact CD2-CZ 4.23Å; V136-F174 HydrophobicContact CG2-CE1 3.81Å; V136-F174 HydrophobicContact CG2-CZ 4.14Å; V153-F174 HydrophobicContact CB-CD1 4.37Å; V153-F174 HydrophobicContact CG1-CD1 4.09Å; V153-F174 HydrophobicContact CG2-CD1 4.24Å; V153-F174 HydrophobicContact CG2-CE1 4.21Å; C156-F174 HydrophobicContact CB-CB 4.39Å; C156-F174 HydrophobicContact CB-CD1 3.69Å; C156-F174 HydrophobicContact CB-CD2 3.51Å; C156-F174 HydrophobicContact CB-CE1 3.74Å; C156-F174 HydrophobicContact CB-CE2 3.57Å; C156-F174 HydrophobicContact CB-CG 3.57Å; C156-F174 HydrophobicContact CB-CZ 3.68Å; Q157-F174 HydrophobicContact CB-CB 4.45Å; L160-F174 HydrophobicContact CD2-CB 4.2Å; L165-F174 HydrophobicContact CD2-CD2 4.04Å; L165-F174 HydrophobicContact CD2-CE2 4.02Å; F174-Y182 AromaticContact CD2-CD1 3.85Å; F174-Y182 HydrophobicContact CD2-CD1 3.85Å; F174-Y182 HydrophobicContact CD2-CD2 4.28Å; F174-Y182 AromaticContact CD2-CE1 3.4Å; F174-Y182 HydrophobicContact CD2-CE1 3.4Å; F174-Y182 VanDerWaalsContact CD2-CE1 3.4Å; F174-Y182 AromaticContact CD2-CE2 3.9Å; F174-Y182 HydrophobicContact CD2-CE2 3.9Å; F174-Y182 HydrophobicContact CD2-CG 4.27Å; F174-Y182 AromaticContact CD2-CZ 3.45Å; F174-Y182 VanDerWaalsContact CD2-CZ 3.45Å; F174-Y182 HydrophobicContact CE2-CD1 4.04Å; F174-Y182 AromaticContact CE2-CD2 3.74Å; F174-Y182 HydrophobicContact CE2-CD2 3.74Å; F174-Y182 AromaticContact CE2-CE1 3.89Å; F174-Y182 HydrophobicContact CE2-CE1 3.89Å; F174-Y182 AromaticContact CE2-CE2 3.59Å; F174-Y182 HydrophobicContact CE2-CE2 3.59Å; F174-Y182 AromaticContact CE2-CG 3.98Å; F174-Y182 HydrophobicContact CE2-CG 3.98Å; F174-Y182 AromaticContact CE2-CZ 3.67Å; F174-Y182 HydrophobicContact CG-CE1 4.3Å; F174-Y182 HydrophobicContact CZ-CE2 4.28Å
175	Q	91.8	Very high	90.8	Very high	48 Å²	48	55.3 Å²	55.3	22%	0.224	27%	0.267	C	S	.	.			trans	-130.7	122.1	-176.5	-69.4	173.4	46.8	0	0	109.7	D171 R177 Q180 Y182	D171-Q175 PolarHBondContact OD2-NE2 2.76Å; Q175-R177 HydrophobicContact CB-CG 4.47Å; Q175-R177 PolarHBondContact O-N 2.84Å; Q175-Q180 HydrophobicContact CB-CB 4.42Å; Q175-Q180 HydrophobicContact CB-CG 3.96Å; Q175-Y182 PolarHBondContact N-OH 3.25Å
176	D	93.8	Very high	89.6	Confident	49 Å²	49	58.4 Å²	58.4	26%	0.262	30%	0.299	S	S	.	.			trans	-74.2	72.7	171.8	-174.9	7.9	0	0	0	110.8	R133 V136 R149 V153	R133-D176 WeakPolarHBondContact CA-OD1 3.29Å; V136-D176 HydrophobicContact CG2-CB 4.26Å; R149-D176 IonicContact CZ-OD1 3.52Å; R149-D176 IonicContact CZ-OD2 3.49Å; R149-D176 IonicContact NE-OD1 3.08Å; R149-D176 IonicContact NE-OD2 2.66Å; R149-D176 PolarHBondContact NE-OD2 3.01Å; R149-D176 IonicContact NH2-OD1 2.7Å; R149-D176 PolarHBondContact NH2-OD1 3.37Å; R149-D176 IonicContact NH2-OD2 3.4Å; R149-D176 PolarHBondContact NH2-OD2 3.2Å; V153-D176 HydrophobicContact CG2-CB 3.84Å
177	R	92.5	Very high	87.9	Confident	163 Å²	163	61.8 Å²	61.8	62%	0.615	32%	0.321	S	S	*	.			trans	-142.8	148.4	-177.5	-66.1	-171.4	176.7	-169.6	0.6	111.9	G132 R133 Q175 A179 Q180	G132-R177 PolarHBondContact N-O 3.14Å; R133-R177 PolarHBondContact N-O 2.88Å; Q175-R177 HydrophobicContact CB-CG 4.47Å; Q175-R177 PolarHBondContact O-N 2.84Å; R177-A179 VanDerWaalsContact C-N 3.33Å; R177-A179 PolarHBondContact O-N 2.72Å; R177-Q180 HydrophobicContact CB-CG 4.09Å
178	D	88.6	Confident	86.2	Confident	83 Å²	83	68.6 Å²	68.6	44%	0.444	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-30.8	179.5	-70.1	-58.1	0	0	0	113.5	S131 R133 F181	S131-D178 WeakPolarHBondContact CB-O 3.29Å; R133-D178 WeakPolarHBondContact CB-OD1 3.3Å; R133-D178 VanDerWaalsContact CD-CG 3.43Å; R133-D178 WeakPolarHBondContact CD-OD1 3.36Å; R133-D178 WeakPolarHBondContact CD-OD2 3.22Å; R133-D178 IonicContact CZ-OD2 3.01Å; R133-D178 IonicContact NE-OD2 2.9Å; R133-D178 IonicContact NH1-OD2 3.98Å; R133-D178 PolarHBondContact NH1-OD2 3.37Å; D178-F181 WeakPolarHBondContact O-CE1 3.33Å
179	A	87.6	Confident	84.6	Confident	37 Å²	37	69.2 Å²	69.2	31%	0.306	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	3.5	-175.8	0	0	0	0	0	114.5	Y121 R177	Y121-A179 HydrophobicContact CE2-CB 4.42Å; R177-A179 VanDerWaalsContact C-N 3.33Å; R177-A179 PolarHBondContact O-N 2.72Å
180	Q	92.5	Very high	82.9	Confident	34 Å²	34	71.8 Å²	71.8	16%	0.159	37%	0.37	C	S	.	.			trans	-110.6	127.4	178	-59.4	-66.4	10.9	0	0	109.3	S131 G132 H167 Q175 R177 Y182	S131-Q180 CarbonylContact C-O 3.6Å; S131-Q180 VanDerWaalsContact CA-O 3.29Å; S131-Q180 WeakPolarHBondContact CA-O 3.28Å; G132-Q180 PolarHBondContact N-O 2.69Å; H167-Q180 PolarHBondContact CE1-OE1 2.82Å; H167-Q180 PolarHBondContact NE2-OE1 2.92Å; H167-Q180 VanDerWaalsContact NE2-OE1 3.13Å; Q175-Q180 HydrophobicContact CB-CB 4.42Å; Q175-Q180 HydrophobicContact CB-CG 3.96Å; R177-Q180 HydrophobicContact CB-CG 4.09Å; Q180-Y182 HydrophobicContact CB-CE2 3.91Å
181	F	94.3	Very high	81.3	Confident	13 Å²	13	69.7 Å²	69.7	6%	0.057	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.1	-170.7	-55	-59.7	0	0	0	111.3	Y121 Y126 C129 C130 H167 V168 D178	Y121-F181 AromaticContact CD1-CE2 3.86Å; Y121-F181 HydrophobicContact CD1-CE2 3.86Å; Y121-F181 HydrophobicContact CD1-CZ 4.41Å; Y121-F181 HydrophobicContact CD2-CE2 4.46Å; Y121-F181 HydrophobicContact CD2-CZ 4.23Å; Y121-F181 AromaticContact CG-CE2 3.74Å; Y121-F181 HydrophobicContact CG-CE2 3.74Å; Y121-F181 AromaticContact CG-CZ 3.92Å; Y121-F181 HydrophobicContact CG-CZ 3.92Å; Y126-F181 AromaticContact CD2-CD2 3.8Å; Y126-F181 HydrophobicContact CD2-CD2 3.8Å; Y126-F181 AromaticContact CD2-CE2 3.93Å; Y126-F181 HydrophobicContact CD2-CE2 3.93Å; Y126-F181 HydrophobicContact CE2-CD2 4.08Å; Y126-F181 HydrophobicContact CE2-CE2 4.06Å; Y126-F181 HydrophobicContact CG-CD2 4.24Å; C129-F181 HydrophobicContact CB-CB 4.42Å; C130-F181 WeakPolarHBondContact O-CA 3.42Å; H167-F181 PolarHBondContact CD2-O 3.33Å; V168-F181 HydrophobicContact CB-CB 4.31Å; V168-F181 HydrophobicContact CG2-CB 3.97Å; V168-F181 VanDerWaalsContact CG2-O 3.31Å; V168-F181 WeakPolarHBondContact CG2-O 2.89Å; V168-F181 PolarHBondContact N-O 2.86Å; D178-F181 WeakPolarHBondContact O-CE1 3.33Å
182	Y	95.2	Very high	79.5	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.3	-178	-55.9	-95	0	0	0	111.2	C129 C130 L160 L165 C166 H167 F174 Q175 Q180	C129-Y182 VanDerWaalsContact CA-O 3.25Å; C129-Y182 WeakPolarHBondContact CA-O 3.25Å; C129-Y182 VanDerWaalsContact CB-O 3.29Å; C129-Y182 WeakPolarHBondContact CB-O 3.39Å; C130-Y182 PolarHBondContact N-O 3.33Å; C130-Y182 PolarHBondContact O-N 3.25Å; L160-Y182 HydrophobicContact CD2-CE1 4.5Å; L165-Y182 HydrophobicContact CD2-CD1 4.09Å; L165-Y182 HydrophobicContact CD2-CG 4.28Å; L165-Y182 HydrophobicContact CG-CD1 4.33Å; C166-Y182 CarbonylContact O-C 3.53Å; C166-Y182 VanDerWaalsContact O-CA 3.25Å; C166-Y182 WeakPolarHBondContact O-CA 3.42Å; H167-Y182 HydrophobicContact CB-CD1 3.94Å; H167-Y182 HydrophobicContact CB-CE1 3.82Å; H167-Y182 AromaticContact CD2-CD1 3.88Å; H167-Y182 AromaticContact CD2-CE1 3.46Å; H167-Y182 VanDerWaalsContact CD2-CE1 3.46Å; H167-Y182 WeakPolarHBondContact CD2-CE1 3.43Å; H167-Y182 AromaticContact CD2-CZ 3.58Å; F174-Y182 AromaticContact CD2-CD1 3.85Å; F174-Y182 HydrophobicContact CD2-CD1 3.85Å; F174-Y182 HydrophobicContact CD2-CD2 4.28Å; F174-Y182 AromaticContact CD2-CE1 3.4Å; F174-Y182 HydrophobicContact CD2-CE1 3.4Å; F174-Y182 VanDerWaalsContact CD2-CE1 3.4Å; F174-Y182 AromaticContact CD2-CE2 3.9Å; F174-Y182 HydrophobicContact CD2-CE2 3.9Å; F174-Y182 HydrophobicContact CD2-CG 4.27Å; F174-Y182 AromaticContact CD2-CZ 3.45Å; F174-Y182 VanDerWaalsContact CD2-CZ 3.45Å; F174-Y182 HydrophobicContact CE2-CD1 4.04Å; F174-Y182 AromaticContact CE2-CD2 3.74Å; F174-Y182 HydrophobicContact CE2-CD2 3.74Å; F174-Y182 AromaticContact CE2-CE1 3.89Å; F174-Y182 HydrophobicContact CE2-CE1 3.89Å; F174-Y182 AromaticContact CE2-CE2 3.59Å; F174-Y182 HydrophobicContact CE2-CE2 3.59Å; F174-Y182 AromaticContact CE2-CG 3.98Å; F174-Y182 HydrophobicContact CE2-CG 3.98Å; F174-Y182 AromaticContact CE2-CZ 3.67Å; F174-Y182 HydrophobicContact CG-CE1 4.3Å; F174-Y182 HydrophobicContact CZ-CE2 4.28Å; Q175-Y182 PolarHBondContact N-OH 3.25Å; Q180-Y182 HydrophobicContact CB-CE2 3.91Å
183	R	93	Very high	77.5	Confident	95 Å²	95	75.9 Å²	75.9	36%	0.358	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138.4	-179.2	-179.5	-178.5	-59.2	126.9	0.2	110.5	R127 C166 V168	R127-R183 PolarHBondContact O-NE 3.44Å; R127-R183 PolarHBondContact O-NH2 2.92Å; C166-R183 PolarHBondContact N-O 3.13Å; C166-R183 PolarHBondContact O-N 3.43Å; V168-R183 HydrophobicContact CG2-CB 4.46Å
184	F	90.5	Very high	75.6	Confident	18 Å²	18	78.4 Å²	78.4	8%	0.079	43%	0.43	C	S	.	.			trans	-82.3	126.4	167.7	-70.8	-88.8	0	0	0	109.7	H105 L108 I116 L135 A164 L165	H105-F184 HydrophobicContact CB-CD1 3.81Å; H105-F184 HydrophobicContact CB-CE1 4.03Å; H105-F184 HydrophobicContact CB-CG 4.09Å; H105-F184 HydrophobicContact CB-CZ 4.5Å; H105-F184 AromaticContact CD2-CD2 3.61Å; H105-F184 AromaticContact CD2-CG 3.72Å; H105-F184 AromaticContact CG-CD1 3.93Å; H105-F184 AromaticContact CG-CG 3.68Å; H105-F184 AromaticContact ND1-CG 3.98Å; H105-F184 AromaticContact NE2-CD2 3.97Å; L108-F184 HydrophobicContact CD1-CZ 4.21Å; I116-F184 HydrophobicContact CD1-CD2 3.98Å; I116-F184 HydrophobicContact CD1-CE2 4.41Å; L135-F184 HydrophobicContact CD1-CE2 4.22Å; L135-F184 HydrophobicContact CD1-CZ 4.25Å; A164-F184 VanDerWaalsContact O-CD1 3.27Å; A164-F184 WeakPolarHBondContact O-CD1 3.31Å; L165-F184 HydrophobicContact CD1-CD1 4.16Å; L165-F184 HydrophobicContact CD1-CD2 4Å; L165-F184 HydrophobicContact CD1-CE1 4.01Å; L165-F184 HydrophobicContact CD1-CE2 3.82Å; L165-F184 HydrophobicContact CD1-CG 4.16Å; L165-F184 HydrophobicContact CD1-CZ 3.83Å
185	P	81.1	Confident	73.9	Confident	71 Å²	71	79.8 Å²	79.8	46%	0.461	45%	0.448	S	S	.	.			trans	-80.7	142.9	177.9	28	-23.9	0	0	0	111.9	G163 A164	G163-P185 WeakPolarHBondContact O-CG 3.35Å; A164-P185 WeakPolarHBondContact O-CD 3.4Å
186	G	68.4	Low	72.3	Confident	64 Å²	64	81.4 Å²	81.4	66%	0.66	47%	0.47	S	S	*	.	S	Bend	trans	118.1	166.6	175	0	0	0	0	0	114.5
187	P	56.6	Low	70.4	Confident	124 Å²	124	84.6 Å²	84.6	81%	0.805	48%	0.483	S	S	*	.	S	Bend	trans	-64.7	154.6	172.1	26.7	-31.8	0	0	0	111.3
188	E	58.8	Low	68.9	Low	149 Å²	149	82.5 Å²	82.5	70%	0.696	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-54.9	130.7	172.5	-79	-174.6	170.9	0	0	109.3	E190	E188-E190 PolarHBondContact O-N 3.31Å
189	P	56.4	Low	67.7	Low	40 Å²	40	81.9 Å²	81.9	26%	0.26	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-62.8	123.6	-176	19.2	-27.8	0	0	0	111.2	R106	R106-P189 HydrophobicContact CB-CG 4.44Å; R106-P189 HydrophobicContact CG-CB 3.62Å; R106-P189 HydrophobicContact CG-CG 3.27Å
190	E	51.8	Low	66.8	Low	164 Å²	164	84.2 Å²	84.2	77%	0.766	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-60.8	140.8	172.5	-68.5	-173.2	172.4	0	0	110.8	E188 E192	E188-E190 PolarHBondContact O-N 3.31Å; E190-E192 PolarHBondContact O-N 3.12Å
191	P	53.1	Low	65.7	Low	129 Å²	129	87.1 Å²	87.1	84%	0.838	49%	0.493	S	S	*	.			trans	-74.4	96.3	175.7	28.9	-31.2	0	0	0	109.8
192	E	51.4	Low	64.9	Low	153 Å²	153	89.9 Å²	89.9	72%	0.715	51%	0.506	S	S	*	.			trans	-72.6	143.9	165.7	-74.7	-158.1	170.3	0	0	110.8	E190 V194	E190-E192 PolarHBondContact O-N 3.12Å; E192-V194 HydrophobicContact CB-CG2 4.29Å; E192-V194 PolarHBondContact O-N 3.26Å
193	P	44.9	Very low	64.2	Low	136 Å²	136	90.2 Å²	90.2	88%	0.883	51%	0.508	S	S	*	.			trans	-79.5	70.1	-179.3	34.1	-34	0	0	0	110.3
194	V	51.6	Low	63.5	Low	64 Å²	64	88 Å²	88	39%	0.388	51%	0.51	S	S	.	.			trans	-101.8	139.5	171.6	-175.7	0	0	0	0	108.6	E192 E198	E192-V194 HydrophobicContact CB-CG2 4.29Å; E192-V194 PolarHBondContact O-N 3.26Å; V194-E198 HydrophobicContact CG1-CB 3.94Å; V194-E198 WeakPolarHBondContact CG1-OE2 3.14Å
195	G	57.5	Low	63	Low	41 Å²	41	93.2 Å²	93.2	42%	0.423	54%	0.535	S	S	.	.			trans	-58.8	139.3	-175.3	0	0	0	0	0	112.2	H197 E198 M199	G195-H197 PolarHBondContact O-N 3.31Å; G195-E198 PolarHBondContact O-N 3.44Å; G195-M199 PolarHBondContact O-N 3.27Å
196	A	58.3	Low	63.2	Low	83 Å²	83	90.3 Å²	90.3	69%	0.686	52%	0.516	S	S	*	.	H	α-helix	trans	-53.6	-26.8	-176.4	0	0	0	0	0	114.4
197	H	55.2	Low	63.9	Low	116 Å²	116	87.3 Å²	87.3	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-78.4	-36.8	178.3	-103.1	-61.6	0	0	0	114.1	G195 M199 E200 E201 H780	G195-H197 PolarHBondContact O-N 3.31Å; H197-M199 VanDerWaalsContact C-N 3.31Å; H197-E200 PolarHBondContact O-N 3.06Å; H197-E201 PolarHBondContact O-N 2.93Å; H197-H780 AromaticContact CE1-CD2 3.77Å; H197-H780 AromaticContact CE1-NE2 3.48Å; H197-H780 PolarHBondContact CE1-NE2 3.11Å; H197-H780 AromaticContact ND1-CE1 3.91Å; H197-H780 AromaticContact ND1-NE2 3.55Å
198	E	59.5	Low	65	Low	119 Å²	119	84.2 Å²	84.2	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-69	-35.1	177.7	-69.4	173.3	165.7	0	0	110.3	V194 G195 E200 E201 E202	V194-E198 HydrophobicContact CG1-CB 3.94Å; V194-E198 WeakPolarHBondContact CG1-OE2 3.14Å; G195-E198 PolarHBondContact O-N 3.44Å; E198-E200 PolarHBondContact O-N 2.92Å; E198-E201 PolarHBondContact O-N 3.42Å; E198-E202 WeakPolarHBondContact O-CG 3.3Å; E198-E202 PolarHBondContact O-N 3.12Å
199	M	64	Low	66.2	Low	70 Å²	70	78.2 Å²	78.2	35%	0.345	44%	0.443	S	S	.	.	H	α-helix	trans	-67.1	-30.9	178.5	-165.7	166.1	61.7	0	0	113.6	G195 H197 L203	G195-M199 PolarHBondContact O-N 3.27Å; H197-M199 VanDerWaalsContact C-N 3.31Å; M199-L203 VanDerWaalsContact O-CB 3.31Å; M199-L203 WeakPolarHBondContact O-CB 3.44Å; M199-L203 PolarHBondContact O-N 3.18Å
200	E	69	Low	67.7	Low	85 Å²	85	76.3 Å²	76.3	40%	0.397	43%	0.43	S	S	.	.	H	α-helix	trans	-73.7	-36.8	175.8	-163.5	-171.7	155.6	0	0	111.4	H197 E198 A204 K784	H197-E200 PolarHBondContact O-N 3.06Å; E198-E200 PolarHBondContact O-N 2.92Å; E200-A204 PolarHBondContact O-N 2.74Å; E200-K784 IonicContact OE1-NZ 2.87Å; E200-K784 PolarHBondContact OE1-NZ 3.5Å
201	E	69.3	Low	69.2	Low	96 Å²	96	70.4 Å²	70.4	45%	0.449	41%	0.408	S	S	.	.	H	α-helix	trans	-70.4	-47.2	178.4	-168.2	162.6	-161.8	0	0	111.2	H197 E198 L203 A204 E205	H197-E201 PolarHBondContact O-N 2.93Å; E198-E201 PolarHBondContact O-N 3.42Å; E201-L203 VanDerWaalsContact C-N 3.27Å; E201-L203 PolarHBondContact O-N 2.91Å; E201-A204 WeakPolarHBondContact O-CB 3.45Å; E201-A204 PolarHBondContact O-N 3.15Å; E201-A204 VanDerWaalsContact O-N 3.14Å; E201-E205 PolarHBondContact O-N 2.88Å
202	E	76.9	Confident	70.5	Confident	70 Å²	70	68.4 Å²	68.4	33%	0.327	39%	0.387	S	S	.	.	H	α-helix	trans	-59.5	-36.6	173.8	-74	-167.6	144.1	0	0	112.7	R99 Q103 E198 E205 A206	R99-E202 IonicContact NH2-OE1 3.72Å; R99-E202 PolarHBondContact NH2-OE1 2.93Å; Q103-E202 VanDerWaalsContact NE2-CB 3.27Å; Q103-E202 PolarHBondContact NE2-OE2 3.37Å; E198-E202 WeakPolarHBondContact O-CG 3.3Å; E198-E202 PolarHBondContact O-N 3.12Å; E202-E205 PolarHBondContact O-N 3.07Å; E202-A206 VanDerWaalsContact O-CB 3.32Å; E202-A206 WeakPolarHBondContact O-CB 3.43Å; E202-A206 PolarHBondContact O-N 3.21Å
203	L	81.3	Confident	72	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-67.9	-41.1	176.2	178.5	66.6	0	0	0	111.8	Q103 L104 Q107 L144 M199 E201 E205 A206 V207	Q103-L203 HydrophobicContact CG-CB 4.12Å; Q103-L203 HydrophobicContact CG-CD1 3.99Å; L104-L203 HydrophobicContact CD1-CD1 4.43Å; Q107-L203 HydrophobicContact CB-CD1 4.12Å; Q107-L203 HydrophobicContact CB-CD2 3.87Å; Q107-L203 HydrophobicContact CG-CD1 3.89Å; Q107-L203 HydrophobicContact CG-CD2 3.45Å; Q107-L203 VanDerWaalsContact CG-CD2 3.45Å; Q107-L203 HydrophobicContact CG-CG 4.15Å; L144-L203 HydrophobicContact CD1-CD1 4.16Å; L144-L203 HydrophobicContact CD1-CD2 3.54Å; L144-L203 HydrophobicContact CD1-CG 3.67Å; L144-L203 HydrophobicContact CD2-CD2 3.96Å; L144-L203 HydrophobicContact CD2-CG 4.3Å; L144-L203 HydrophobicContact CG-CD2 4.38Å; M199-L203 VanDerWaalsContact O-CB 3.31Å; M199-L203 WeakPolarHBondContact O-CB 3.44Å; M199-L203 PolarHBondContact O-N 3.18Å; E201-L203 VanDerWaalsContact C-N 3.27Å; E201-L203 PolarHBondContact O-N 2.91Å; L203-E205 VanDerWaalsContact C-N 3.32Å; L203-A206 PolarHBondContact O-N 2.9Å; L203-V207 HydrophobicContact CD1-CG2 4.38Å; L203-V207 WeakPolarHBondContact O-CG2 3.38Å; L203-V207 PolarHBondContact O-N 3.47Å
204	A	78.1	Confident	73.9	Confident	49 Å²	49	58.4 Å²	58.4	41%	0.405	33%	0.325	S	S	.	.	H	α-helix	trans	-62.5	-41.4	176.4	0	0	0	0	0	111.2	E200 E201 A208	E200-A204 PolarHBondContact O-N 2.74Å; E201-A204 WeakPolarHBondContact O-CB 3.45Å; E201-A204 PolarHBondContact O-N 3.15Å; E201-A204 VanDerWaalsContact O-N 3.14Å; A204-A208 VanDerWaalsContact O-CB 3.31Å; A204-A208 WeakPolarHBondContact O-CB 3.43Å; A204-A208 PolarHBondContact O-N 3.16Å
205	E	79.6	Confident	75.3	Confident	128 Å²	128	56.2 Å²	56.2	60%	0.598	31%	0.313	S	S	*	.	H	α-helix	trans	-64.3	-43.2	173.8	-70.2	-176.3	179.6	0	0	112.5	E201 E202 L203 A208 L209	E201-E205 PolarHBondContact O-N 2.88Å; E202-E205 PolarHBondContact O-N 3.07Å; L203-E205 VanDerWaalsContact C-N 3.32Å; E205-A208 PolarHBondContact O-N 3.47Å; E205-L209 PolarHBondContact O-N 2.83Å
206	A	84.7	Confident	76.3	Confident	9 Å²	9	56.6 Å²	56.6	7%	0.074	31%	0.305	C	S	.	.	H	α-helix	trans	-58.8	-48.6	176	0	0	0	0	0	111.7	A100 Q103 E202 L203 A208 L209 L210	A100-A206 HydrophobicContact CB-CB 3.68Å; Q103-A206 HydrophobicContact CB-CB 4.29Å; E202-A206 VanDerWaalsContact O-CB 3.32Å; E202-A206 WeakPolarHBondContact O-CB 3.43Å; E202-A206 PolarHBondContact O-N 3.21Å; L203-A206 PolarHBondContact O-N 2.9Å; A206-A208 VanDerWaalsContact C-N 3.34Å; A206-A208 PolarHBondContact O-N 3.3Å; A206-L209 PolarHBondContact O-N 3.11Å; A206-L210 VanDerWaalsContact O-CG 3.31Å; A206-L210 WeakPolarHBondContact O-CG 3.28Å; A206-L210 PolarHBondContact O-N 3.04Å; A206-L210 VanDerWaalsContact O-N 3.07Å
207	V	85	Confident	77.6	Confident	1 Å²	1	53 Å²	53	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-67.6	-35.1	178	172.7	0	0	0	0	111.8	L104 L144 V146 I155 L203 L210 S211	L104-V207 HydrophobicContact CD1-CG2 4.14Å; L144-V207 HydrophobicContact CB-CB 4.28Å; L144-V207 HydrophobicContact CB-CG1 4.04Å; L144-V207 HydrophobicContact CB-CG2 4.26Å; L144-V207 HydrophobicContact CD1-CG2 3.67Å; V146-V207 HydrophobicContact CG2-CG1 3.64Å; I155-V207 HydrophobicContact CD1-CG1 4.37Å; L203-V207 HydrophobicContact CD1-CG2 4.38Å; L203-V207 WeakPolarHBondContact O-CG2 3.38Å; L203-V207 PolarHBondContact O-N 3.47Å; V207-L210 PolarHBondContact O-N 3.08Å; V207-S211 VanDerWaalsContact O-CB 3.23Å; V207-S211 WeakPolarHBondContact O-CB 3.42Å; V207-S211 PolarHBondContact O-N 2.89Å; V207-S211 PolarHBondContact O-OG 2.93Å
208	A	79.5	Confident	79.1	Confident	59 Å²	59	49 Å²	49	49%	0.488	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-45.1	174.3	0	0	0	0	0	111.7	A204 E205 A206 L210 S211 Q212	A204-A208 VanDerWaalsContact O-CB 3.31Å; A204-A208 WeakPolarHBondContact O-CB 3.43Å; A204-A208 PolarHBondContact O-N 3.16Å; E205-A208 PolarHBondContact O-N 3.47Å; A206-A208 VanDerWaalsContact C-N 3.34Å; A206-A208 PolarHBondContact O-N 3.3Å; A208-L210 PolarHBondContact O-N 3.5Å; A208-S211 PolarHBondContact O-N 2.97Å; A208-Q212 WeakPolarHBondContact O-CB 3.34Å; A208-Q212 PolarHBondContact O-N 3.48Å
209	L	83.1	Confident	80.4	Confident	23 Å²	23	43.4 Å²	43.4	12%	0.12	23%	0.232	C	C	.	.	H	α-helix	trans	-58	-49.4	175.3	175.6	66.9	0	0	0	111.5	R96 A100 E205 A206 S211 Q212 R213	R96-L209 HydrophobicContact CB-CD2 4Å; A100-L209 HydrophobicContact CB-CD2 4.43Å; E205-L209 PolarHBondContact O-N 2.83Å; A206-L209 PolarHBondContact O-N 3.11Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 3.12Å; L209-Q212 PolarHBondContact O-N 2.93Å; L209-R213 PolarHBondContact O-N 3.25Å
210	L	88.1	Confident	81.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-39.9	179.4	-64	170.2	0	0	0	111.5	V97 A100 L104 I155 V158 L159 A206 V207 A208 Q212 R213 G214	V97-L210 HydrophobicContact CG1-CD2 3.92Å; A100-L210 HydrophobicContact CB-CD1 4.15Å; A100-L210 HydrophobicContact CB-CD2 4.3Å; A100-L210 HydrophobicContact CB-CG 4.12Å; L104-L210 HydrophobicContact CD2-CD1 4.32Å; I155-L210 HydrophobicContact CB-CB 4.31Å; I155-L210 HydrophobicContact CG1-CB 3.99Å; I155-L210 HydrophobicContact CG2-CB 3.87Å; I155-L210 HydrophobicContact CG2-CD1 3.92Å; I155-L210 HydrophobicContact CG2-CG 4.45Å; V158-L210 HydrophobicContact CB-CD2 4.43Å; V158-L210 HydrophobicContact CG1-CD2 3.76Å; L159-L210 HydrophobicContact CD1-CD1 4.48Å; L159-L210 HydrophobicContact CD2-CD1 4.01Å; L159-L210 HydrophobicContact CD2-CD2 3.73Å; L159-L210 HydrophobicContact CG-CD1 4.39Å; L159-L210 HydrophobicContact CG-CD2 4.19Å; A206-L210 VanDerWaalsContact O-CG 3.31Å; A206-L210 WeakPolarHBondContact O-CG 3.28Å; A206-L210 PolarHBondContact O-N 3.04Å; A206-L210 VanDerWaalsContact O-N 3.07Å; V207-L210 PolarHBondContact O-N 3.08Å; A208-L210 PolarHBondContact O-N 3.5Å; L210-Q212 VanDerWaalsContact C-N 3.3Å; L210-Q212 PolarHBondContact O-N 3.28Å; L210-R213 PolarHBondContact O-N 2.95Å; L210-G214 PolarHBondContact O-N 2.57Å
211	S	83.4	Confident	82.3	Confident	41 Å²	41	37.8 Å²	37.8	29%	0.287	21%	0.207	S	C	.	.	H	α-helix	trans	-65.3	-34.1	177.5	-61.1	0	0	0	0	112.3	I155 V207 A208 L209 P215	I155-S211 WeakPolarHBondContact CD1-OG 3.34Å; V207-S211 VanDerWaalsContact O-CB 3.23Å; V207-S211 WeakPolarHBondContact O-CB 3.42Å; V207-S211 PolarHBondContact O-N 2.89Å; V207-S211 PolarHBondContact O-OG 2.93Å; A208-S211 PolarHBondContact O-N 2.97Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 3.12Å; S211-P215 WeakPolarHBondContact O-CD 2.85Å
212	Q	80.2	Confident	83.3	Confident	86 Å²	86	33.2 Å²	33.2	40%	0.402	19%	0.186	S	C	.	.	H	α-helix	trans	-69.2	-39.5	176.9	-172	179.3	29.1	0	0	111.8	A208 L209 L210 S796	A208-Q212 WeakPolarHBondContact O-CB 3.34Å; A208-Q212 PolarHBondContact O-N 3.48Å; L209-Q212 PolarHBondContact O-N 2.93Å; L210-Q212 VanDerWaalsContact C-N 3.3Å; L210-Q212 PolarHBondContact O-N 3.28Å; Q212-S796 PolarHBondContact NE2-OG 3.19Å; Q212-S796 VanDerWaalsContact NE2-OG 3.09Å
213	R	82.2	Confident	83.8	Confident	77 Å²	77	30 Å²	30	29%	0.291	17%	0.171	S	C	.	.	H	α-helix	trans	-80.1	-24.7	178.1	-71.4	-168.7	167.1	-152	-5.8	113.8	S93 V158 E162 L209 L210 D216 A217	S93-R213 PolarHBondContact OG-NH1 3.48Å; S93-R213 PolarHBondContact OG-NH2 3.42Å; S93-R213 VanDerWaalsContact OG-NH2 3.09Å; V158-R213 HydrophobicContact CG1-CB 4.13Å; V158-R213 HydrophobicContact CG2-CB 3.65Å; E162-R213 IonicContact OE1-NH1 2.7Å; E162-R213 PolarHBondContact OE1-NH1 3.38Å; L209-R213 PolarHBondContact O-N 3.25Å; L210-R213 PolarHBondContact O-N 2.95Å; R213-D216 WeakPolarHBondContact O-CB 3.25Å; R213-D216 PolarHBondContact O-N 3.28Å; R213-D216 VanDerWaalsContact O-N 3.11Å; R213-A217 PolarHBondContact O-N 2.82Å
214	G	85.3	Confident	84.2	Confident	2 Å²	2	35.1 Å²	35.1	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-49.8	-51.2	-173.9	0	0	0	0	0	115.3	G154 L210 D216 A217 L218	G154-G214 WeakPolarHBondContact O-CA 3.4Å; L210-G214 PolarHBondContact O-N 2.57Å; G214-D216 VanDerWaalsContact C-N 3.26Å; G214-D216 PolarHBondContact O-N 3.31Å; G214-A217 WeakPolarHBondContact O-CB 3.28Å; G214-A217 PolarHBondContact O-N 3.22Å; G214-L218 WeakPolarHBondContact O-CG 3.15Å; G214-L218 PolarHBondContact O-N 3.47Å
215	P	80.4	Confident	84.7	Confident	19 Å²	19	35.3 Å²	35.3	12%	0.123	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-30.3	-177.7	-17.9	29	0	0	0	113.4	S211 L218 L219 W797	S211-P215 WeakPolarHBondContact O-CD 2.85Å; P215-L218 PolarHBondContact O-N 2.9Å; P215-L219 WeakPolarHBondContact O-CB 3.3Å; P215-L219 PolarHBondContact O-N 2.76Å; P215-W797 HydrophobicContact CB-CD2 4.17Å; P215-W797 HydrophobicContact CB-CE3 4.37Å; P215-W797 HydrophobicContact CB-CH2 3.78Å; P215-W797 HydrophobicContact CB-CZ2 3.55Å; P215-W797 HydrophobicContact CB-CZ3 4.13Å; P215-W797 HydrophobicContact CG-CZ2 4.24Å
216	D	79.2	Confident	85.2	Confident	49 Å²	49	32.4 Å²	32.4	26%	0.262	17%	0.174	S	C	.	.	H	α-helix	trans	-67.8	-40.7	177.1	-159.7	43	0	0	0	111.9	R52 R213 G214 L219 T220 W797	R52-D216 IonicContact CZ-OD1 2.71Å; R52-D216 IonicContact CZ-OD2 3.09Å; R52-D216 IonicContact NE-OD1 2.98Å; R52-D216 IonicContact NE-OD2 3.02Å; R52-D216 PolarHBondContact NE-OD2 3.27Å; R52-D216 VanDerWaalsContact NH2-CG 3.33Å; R52-D216 IonicContact NH2-OD1 3.21Å; R52-D216 PolarHBondContact NH2-OD1 2.89Å; R52-D216 IonicContact NH2-OD2 3.97Å; R52-D216 PolarHBondContact NH2-OD2 2.86Å; R213-D216 WeakPolarHBondContact O-CB 3.25Å; R213-D216 PolarHBondContact O-N 3.28Å; R213-D216 VanDerWaalsContact O-N 3.11Å; G214-D216 VanDerWaalsContact C-N 3.26Å; G214-D216 PolarHBondContact O-N 3.31Å; D216-L219 PolarHBondContact O-N 2.89Å; D216-T220 PolarHBondContact O-N 2.87Å; D216-T220 PolarHBondContact O-OG1 3.09Å; D216-W797 HydrophobicContact CB-CH2 4.38Å; D216-W797 HydrophobicContact CB-CZ2 4.04Å
217	A	85.9	Confident	85.4	Confident	8 Å²	8	34 Å²	34	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-64.1	-44.2	174.4	0	0	0	0	0	110.8	Q157 V158 R213 G214 L219 T220 V221	Q157-A217 HydrophobicContact CB-CB 4.06Å; Q157-A217 HydrophobicContact CG-CB 3.72Å; V158-A217 HydrophobicContact CG2-CB 3.67Å; R213-A217 PolarHBondContact O-N 2.82Å; G214-A217 WeakPolarHBondContact O-CB 3.28Å; G214-A217 PolarHBondContact O-N 3.22Å; A217-L219 PolarHBondContact O-N 3.43Å; A217-T220 PolarHBondContact O-N 3.42Å; A217-V221 WeakPolarHBondContact O-CG2 3.49Å; A217-V221 PolarHBondContact O-N 3.39Å
218	L	87.2	Confident	85.6	Confident	32 Å²	32	37.9 Å²	37.9	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-40.3	176.5	-64.6	-177.6	0	0	0	113.1	V153 Q157 G214 P215 T220 V221 A222 L237	V153-L218 HydrophobicContact CG1-CD2 3.8Å; Q157-L218 HydrophobicContact CB-CD2 4.31Å; G214-L218 WeakPolarHBondContact O-CG 3.15Å; G214-L218 PolarHBondContact O-N 3.47Å; P215-L218 PolarHBondContact O-N 2.9Å; L218-T220 VanDerWaalsContact C-N 3.34Å; L218-V221 WeakPolarHBondContact O-CB 3.33Å; L218-V221 PolarHBondContact O-N 3.17Å; L218-A222 PolarHBondContact O-N 3.43Å; L218-L237 HydrophobicContact CB-CD2 4.04Å
219	L	85.3	Confident	86.1	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-45.2	175.3	173.8	67.1	0	0	0	111	P215 D216 A217 V221 A222 L223 L237 I238 E241 W289	P215-L219 WeakPolarHBondContact O-CB 3.3Å; P215-L219 PolarHBondContact O-N 2.76Å; D216-L219 PolarHBondContact O-N 2.89Å; A217-L219 PolarHBondContact O-N 3.43Å; L219-V221 VanDerWaalsContact C-N 3.26Å; L219-V221 PolarHBondContact O-N 3.27Å; L219-A222 PolarHBondContact O-N 2.78Å; L219-L223 HydrophobicContact CD1-CD1 4.13Å; L219-L223 HydrophobicContact CD1-CG 4.28Å; L219-L223 HydrophobicContact CG-CD1 3.99Å; L219-L223 WeakPolarHBondContact O-CB 3.48Å; L219-L223 WeakPolarHBondContact O-CG 3.47Å; L219-L223 PolarHBondContact O-N 3.48Å; L219-L237 HydrophobicContact CB-CD2 4.12Å; L219-L237 HydrophobicContact CB-CG 4.38Å; L219-L237 HydrophobicContact CD1-CG 4.19Å; L219-I238 HydrophobicContact CD1-CG1 4.07Å; L219-E241 HydrophobicContact CD1-CB 4.12Å; L219-E241 HydrophobicContact CD1-CG 3.79Å; L219-E241 HydrophobicContact CD2-CB 4.14Å; L219-E241 HydrophobicContact CD2-CG 3.52Å; L219-E241 HydrophobicContact CG-CG 4.23Å; L219-W289 HydrophobicContact CD2-CH2 3.58Å; L219-W289 HydrophobicContact CD2-CZ2 3.54Å; L219-W289 HydrophobicContact CG-CZ2 4.38Å
220	T	85.1	Confident	86.5	Confident	24 Å²	24	41.5 Å²	41.5	15%	0.147	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-38.6	176.3	-57.9	0	0	0	0	111.1	D216 A217 L218 R224	D216-T220 PolarHBondContact O-N 2.87Å; D216-T220 PolarHBondContact O-OG1 3.09Å; A217-T220 PolarHBondContact O-N 3.42Å; L218-T220 VanDerWaalsContact C-N 3.34Å; T220-R224 WeakPolarHBondContact O-CB 3.32Å; T220-R224 VanDerWaalsContact O-CG 3.32Å; T220-R224 WeakPolarHBondContact O-CG 3.36Å; T220-R224 PolarHBondContact O-N 2.88Å
221	V	89	Confident	86.5	Confident	12 Å²	12	44.7 Å²	44.7	7%	0.073	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-48.5	173.8	171.1	0	0	0	0	111.9	Q157 W172 A173 A217 L218 L219 L223 R224 K225	Q157-V221 HydrophobicContact CG-CG2 3.68Å; W172-V221 HydrophobicContact CE3-CG2 4.47Å; W172-V221 HydrophobicContact CH2-CG1 3.97Å; W172-V221 HydrophobicContact CZ3-CB 3.98Å; W172-V221 HydrophobicContact CZ3-CG1 3.77Å; W172-V221 HydrophobicContact CZ3-CG2 3.85Å; A173-V221 HydrophobicContact CB-CG1 4.05Å; A217-V221 WeakPolarHBondContact O-CG2 3.49Å; A217-V221 PolarHBondContact O-N 3.39Å; L218-V221 WeakPolarHBondContact O-CB 3.33Å; L218-V221 PolarHBondContact O-N 3.17Å; L219-V221 VanDerWaalsContact C-N 3.26Å; L219-V221 PolarHBondContact O-N 3.27Å; V221-L223 VanDerWaalsContact C-N 3.32Å; V221-L223 PolarHBondContact O-N 2.85Å; V221-R224 PolarHBondContact O-N 3.44Å; V221-K225 PolarHBondContact O-N 2.72Å
222	A	88.9	Confident	86.5	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-42.1	178.8	0	0	0	0	0	112.1	L218 L219 K225 R230 E234 I238	L218-A222 PolarHBondContact O-N 3.43Å; L219-A222 PolarHBondContact O-N 2.78Å; A222-K225 WeakPolarHBondContact O-CB 3.49Å; A222-K225 PolarHBondContact O-N 3.16Å; A222-R230 PolarHBondContact O-NE 3.28Å; A222-R230 VanDerWaalsContact O-NE 3.07Å; A222-E234 HydrophobicContact CB-CB 3.9Å; A222-E234 HydrophobicContact CB-CG 4.04Å; A222-I238 HydrophobicContact CB-CD1 4.04Å; A222-I238 HydrophobicContact CB-CG1 4.14Å
223	L	88.4	Confident	86.5	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-36.1	178.7	-74.8	171.7	0	0	0	112.8	L219 V221 K225 R230 I238 F265 W289 L337	L219-L223 HydrophobicContact CD1-CD1 4.13Å; L219-L223 HydrophobicContact CD1-CG 4.28Å; L219-L223 HydrophobicContact CG-CD1 3.99Å; L219-L223 WeakPolarHBondContact O-CB 3.48Å; L219-L223 WeakPolarHBondContact O-CG 3.47Å; L219-L223 PolarHBondContact O-N 3.48Å; V221-L223 VanDerWaalsContact C-N 3.32Å; V221-L223 PolarHBondContact O-N 2.85Å; L223-K225 VanDerWaalsContact C-N 3.28Å; L223-K225 PolarHBondContact O-N 2.9Å; L223-R230 PolarHBondContact O-NH2 2.96Å; L223-R230 VanDerWaalsContact O-NH2 3.15Å; L223-I238 HydrophobicContact CD2-CD1 4.06Å; L223-I238 HydrophobicContact CD2-CG1 3.97Å; L223-I238 HydrophobicContact CD2-CG2 4.03Å; L223-I238 HydrophobicContact CG-CG1 4.25Å; L223-F265 HydrophobicContact CB-CB 4.07Å; L223-F265 HydrophobicContact CB-CD2 4.13Å; L223-F265 HydrophobicContact CB-CG 4.33Å; L223-F265 HydrophobicContact CD1-CD2 4.46Å; L223-F265 VanDerWaalsContact O-CB 3.3Å; L223-F265 WeakPolarHBondContact O-CB 3.25Å; L223-W289 HydrophobicContact CD1-CZ2 4.3Å; L223-L337 HydrophobicContact CD1-CD2 3.96Å; L223-L337 HydrophobicContact CD2-CD2 3.93Å; L223-L337 HydrophobicContact CG-CD2 4.49Å
224	R	88.8	Confident	86.7	Confident	114 Å²	114	50.2 Å²	50.2	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-71.1	-20.4	176.4	-75.6	178.3	-177.5	-173.7	3.9	113.5	W172 T220 V221 F265	W172-R224 HydrophobicContact CH2-CB 3.7Å; W172-R224 HydrophobicContact CZ2-CB 4.37Å; W172-R224 HydrophobicContact CZ3-CB 4.02Å; T220-R224 WeakPolarHBondContact O-CB 3.32Å; T220-R224 VanDerWaalsContact O-CG 3.32Å; T220-R224 WeakPolarHBondContact O-CG 3.36Å; T220-R224 PolarHBondContact O-N 2.88Å; V221-R224 PolarHBondContact O-N 3.44Å; R224-F265 HydrophobicContact CG-CD1 3.62Å; R224-F265 HydrophobicContact CG-CE1 4.07Å; R224-F265 HydrophobicContact CG-CG 4.23Å
225	K	90.1	Very high	86.9	Confident	52 Å²	52	52.1 Å²	52.1	23%	0.226	29%	0.287	C	S	.	.	S	Bend	trans	-69.4	143	174.6	-72.1	-179.4	178.3	-174.3	0	111.1	V221 A222 L223 R230 E234	V221-K225 PolarHBondContact O-N 2.72Å; A222-K225 WeakPolarHBondContact O-CB 3.49Å; A222-K225 PolarHBondContact O-N 3.16Å; L223-K225 VanDerWaalsContact C-N 3.28Å; L223-K225 PolarHBondContact O-N 2.9Å; K225-R230 HydrophobicContact CB-CG 4.19Å; K225-R230 PolarHBondContact O-NE 2.92Å; K225-R230 PolarHBondContact O-NH2 3.3Å; K225-E234 WeakPolarHBondContact CD-OE2 3.22Å; K225-E234 WeakPolarHBondContact CE-OE1 3.26Å; K225-E234 IonicContact NZ-OE1 2.72Å; K225-E234 PolarHBondContact NZ-OE1 2.92Å; K225-E234 IonicContact NZ-OE2 3.37Å; K225-E234 PolarHBondContact NZ-OE2 3.35Å
226	P	88.9	Confident	86.9	Confident	68 Å²	68	55.8 Å²	55.8	44%	0.442	31%	0.305	S	S	.	.			trans	-57.4	142.5	168.9	-22.7	33	0	0	0	111.3	G228 Q229	P226-G228 VanDerWaalsContact C-N 3.3Å; P226-G228 PolarHBondContact O-N 2.79Å; P226-G228 VanDerWaalsContact O-N 3.11Å; P226-Q229 HydrophobicContact CB-CG 4.48Å; P226-Q229 PolarHBondContact O-N 3.5Å
227	P	89.8	Confident	87	Confident	43 Å²	43	55.2 Å²	55.2	28%	0.279	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-38	-51.5	177	-40.8	42.1	0	0	0	115.5	Q229 R230 A261 L264	P227-Q229 PolarHBondContact O-N 3.13Å; P227-R230 PolarHBondContact O-N 2.78Å; P227-A261 VanDerWaalsContact CB-O 3.22Å; P227-A261 WeakPolarHBondContact CB-O 3.25Å; P227-L264 HydrophobicContact CG-CD2 3.74Å
228	G	88.1	Confident	87.1	Confident	82 Å²	82	55 Å²	55	85%	0.845	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-74.3	-0.9	-176.7	0	0	0	0	0	116.3	P226	P226-G228 VanDerWaalsContact C-N 3.3Å; P226-G228 PolarHBondContact O-N 2.79Å; P226-G228 VanDerWaalsContact O-N 3.11Å
229	Q	90.8	Very high	87	Confident	137 Å²	137	54.1 Å²	54.1	64%	0.64	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-112.9	1.9	-179.2	-63.6	-177.7	5.7	0	0	113.3	P226 P227	P226-Q229 HydrophobicContact CB-CG 4.48Å; P226-Q229 PolarHBondContact O-N 3.5Å; P227-Q229 PolarHBondContact O-N 3.13Å
230	R	91.3	Very high	86.6	Confident	20 Å²	20	58.8 Å²	58.8	8%	0.075	32%	0.316	C	S	.	.			trans	-76.2	137.8	177.4	-65	179.3	179.4	147.5	13	110.2	A222 L223 K225 P227 E234 L235 A260 L263	A222-R230 PolarHBondContact O-NE 3.28Å; A222-R230 VanDerWaalsContact O-NE 3.07Å; L223-R230 PolarHBondContact O-NH2 2.96Å; L223-R230 VanDerWaalsContact O-NH2 3.15Å; K225-R230 HydrophobicContact CB-CG 4.19Å; K225-R230 PolarHBondContact O-NE 2.92Å; K225-R230 PolarHBondContact O-NH2 3.3Å; P227-R230 PolarHBondContact O-N 2.78Å; R230-E234 WeakPolarHBondContact CA-OE2 3.31Å; R230-E234 HydrophobicContact CB-CB 4.45Å; R230-L235 HydrophobicContact CB-CD2 3.84Å; R230-L235 HydrophobicContact CB-CG 4.08Å; R230-L235 HydrophobicContact CG-CD2 4.49Å; R230-A260 PolarHBondContact NH1-O 3.03Å; R230-L263 VanDerWaalsContact CZ-O 3.24Å; R230-L263 PolarHBondContact NH1-O 2.96Å; R230-L263 PolarHBondContact NH2-O 3.37Å
231	T	88.8	Confident	86.3	Confident	68 Å²	68	59.3 Å²	59.3	42%	0.417	32%	0.317	S	S	.	.			trans	-81.5	163	171.3	65.1	0	0	0	0	110.9	E233 E234 L235	T231-E233 PolarHBondContact O-N 3.49Å; T231-E234 PolarHBondContact N-OE2 3.44Å; T231-E234 VanDerWaalsContact N-OE2 3.09Å; T231-E234 WeakPolarHBondContact O-CB 3.19Å; T231-E234 PolarHBondContact O-N 2.87Å; T231-E234 VanDerWaalsContact OG1-CG 3.32Å; T231-E234 WeakPolarHBondContact OG1-CG 3.42Å; T231-E234 PolarHBondContact OG1-N 2.97Å; T231-L235 WeakPolarHBondContact O-CG 3.04Å; T231-L235 PolarHBondContact O-N 3.01Å
232	D	82.7	Confident	85.9	Confident	131 Å²	131	58.9 Å²	58.9	70%	0.701	31%	0.314	S	S	*	.	H	α-helix	trans	-57.1	-38.7	176.1	-64.9	-31.5	0	0	0	112.2	E234 L235 D236	D232-E234 VanDerWaalsContact C-N 3.31Å; D232-E234 PolarHBondContact O-N 3.24Å; D232-L235 PolarHBondContact O-N 3.15Å; D232-D236 PolarHBondContact O-N 2.68Å
233	E	80.3	Confident	85.1	Confident	154 Å²	154	61.7 Å²	61.7	72%	0.72	33%	0.329	S	S	*	.	H	α-helix	trans	-63.3	-35.5	175.7	-63.8	-178.9	178.3	0	0	112.7	T231 L237	T231-E233 PolarHBondContact O-N 3.49Å; E233-L237 WeakPolarHBondContact O-CB 3.44Å; E233-L237 PolarHBondContact O-N 3.17Å
234	E	86.8	Confident	84.2	Confident	34 Å²	34	67.1 Å²	67.1	16%	0.159	35%	0.354	C	S	.	.	H	α-helix	trans	-74.9	-36.3	177.2	-72.3	173.7	157.8	0	0	111.7	A222 K225 R230 T231 D232 L237 I238	A222-E234 HydrophobicContact CB-CB 3.9Å; A222-E234 HydrophobicContact CB-CG 4.04Å; K225-E234 WeakPolarHBondContact CD-OE2 3.22Å; K225-E234 WeakPolarHBondContact CE-OE1 3.26Å; K225-E234 IonicContact NZ-OE1 2.72Å; K225-E234 PolarHBondContact NZ-OE1 2.92Å; K225-E234 IonicContact NZ-OE2 3.37Å; K225-E234 PolarHBondContact NZ-OE2 3.35Å; R230-E234 WeakPolarHBondContact CA-OE2 3.31Å; R230-E234 HydrophobicContact CB-CB 4.45Å; T231-E234 PolarHBondContact N-OE2 3.44Å; T231-E234 VanDerWaalsContact N-OE2 3.09Å; T231-E234 WeakPolarHBondContact O-CB 3.19Å; T231-E234 PolarHBondContact O-N 2.87Å; T231-E234 VanDerWaalsContact OG1-CG 3.32Å; T231-E234 WeakPolarHBondContact OG1-CG 3.42Å; T231-E234 PolarHBondContact OG1-N 2.97Å; D232-E234 VanDerWaalsContact C-N 3.31Å; D232-E234 PolarHBondContact O-N 3.24Å; E234-L237 PolarHBondContact O-N 3.42Å; E234-I238 VanDerWaalsContact O-CG1 3.29Å; E234-I238 WeakPolarHBondContact O-CG1 3.35Å; E234-I238 PolarHBondContact O-N 2.82Å
235	L	88.5	Confident	83.5	Confident	42 Å²	42	62.5 Å²	62.5	22%	0.22	34%	0.338	C	S	.	.	H	α-helix	trans	-64.4	-43.4	172.7	-67.2	176.9	0	0	0	111.2	R230 T231 D232 L237 I238 F239 A261	R230-L235 HydrophobicContact CB-CD2 3.84Å; R230-L235 HydrophobicContact CB-CG 4.08Å; R230-L235 HydrophobicContact CG-CD2 4.49Å; T231-L235 WeakPolarHBondContact O-CG 3.04Å; T231-L235 PolarHBondContact O-N 3.01Å; D232-L235 PolarHBondContact O-N 3.15Å; L235-L237 VanDerWaalsContact C-N 3.34Å; L235-I238 PolarHBondContact O-N 2.83Å; L235-F239 VanDerWaalsContact O-CB 3.27Å; L235-F239 WeakPolarHBondContact O-CB 3.43Å; L235-F239 PolarHBondContact O-N 3.06Å; L235-A261 HydrophobicContact CD2-CB 4.21Å
236	D	80.4	Confident	82.7	Confident	96 Å²	96	67.7 Å²	67.7	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-61.8	-42.3	174.2	-77.4	-21.3	0	0	0	111.1	D232 I238 F239 E240	D232-D236 PolarHBondContact O-N 2.68Å; D236-I238 PolarHBondContact O-N 3.06Å; D236-F239 PolarHBondContact O-N 3.14Å; D236-E240 WeakPolarHBondContact O-CB 3.39Å; D236-E240 VanDerWaalsContact O-CG 3.29Å; D236-E240 WeakPolarHBondContact O-CG 3.31Å; D236-E240 PolarHBondContact O-N 2.94Å
237	L	82.4	Confident	82	Confident	38 Å²	38	64.7 Å²	64.7	20%	0.199	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-46.4	176.3	-176.8	65.6	0	0	0	112	L218 L219 E233 E234 L235 E241	L218-L237 HydrophobicContact CB-CD2 4.04Å; L219-L237 HydrophobicContact CB-CD2 4.12Å; L219-L237 HydrophobicContact CB-CG 4.38Å; L219-L237 HydrophobicContact CD1-CG 4.19Å; E233-L237 WeakPolarHBondContact O-CB 3.44Å; E233-L237 PolarHBondContact O-N 3.17Å; E234-L237 PolarHBondContact O-N 3.42Å; L235-L237 VanDerWaalsContact C-N 3.34Å; L237-E241 WeakPolarHBondContact O-CG 3.32Å; L237-E241 PolarHBondContact O-N 2.9Å
238	I	87.9	Confident	81.5	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-64.1	-44.5	176.5	-64.9	163.6	0	0	0	110	L219 A222 L223 E234 L235 D236 E240 E241 L242 A260 L263	L219-I238 HydrophobicContact CD1-CG1 4.07Å; A222-I238 HydrophobicContact CB-CD1 4.04Å; A222-I238 HydrophobicContact CB-CG1 4.14Å; L223-I238 HydrophobicContact CD2-CD1 4.06Å; L223-I238 HydrophobicContact CD2-CG1 3.97Å; L223-I238 HydrophobicContact CD2-CG2 4.03Å; L223-I238 HydrophobicContact CG-CG1 4.25Å; E234-I238 VanDerWaalsContact O-CG1 3.29Å; E234-I238 WeakPolarHBondContact O-CG1 3.35Å; E234-I238 PolarHBondContact O-N 2.82Å; L235-I238 PolarHBondContact O-N 2.83Å; D236-I238 PolarHBondContact O-N 3.06Å; I238-E240 PolarHBondContact O-N 3.47Å; I238-E241 WeakPolarHBondContact O-CB 3.34Å; I238-E241 PolarHBondContact O-N 3.27Å; I238-E241 VanDerWaalsContact O-N 3.15Å; I238-L242 HydrophobicContact CG2-CD1 4.3Å; I238-L242 HydrophobicContact CG2-CG 4.31Å; I238-L242 WeakPolarHBondContact O-CG 3.36Å; I238-L242 PolarHBondContact O-N 3.22Å; I238-A260 HydrophobicContact CB-CB 4.04Å; I238-A260 HydrophobicContact CG2-CB 3.72Å; I238-L263 HydrophobicContact CG2-CD1 4.42Å
239	F	84.5	Confident	80.5	Confident	15 Å²	15	60.7 Å²	60.7	7%	0.066	30%	0.304	C	S	.	.	H	α-helix	trans	-59.1	-47.4	179.4	168.4	-100	0	0	0	112.3	L235 D236 E241 L242 L243 N253 K256 R257 A260	L235-F239 VanDerWaalsContact O-CB 3.27Å; L235-F239 WeakPolarHBondContact O-CB 3.43Å; L235-F239 PolarHBondContact O-N 3.06Å; D236-F239 PolarHBondContact O-N 3.14Å; F239-E241 PolarHBondContact O-N 3.41Å; F239-L242 WeakPolarHBondContact O-CB 3.49Å; F239-L242 PolarHBondContact O-N 2.92Å; F239-L242 VanDerWaalsContact O-N 3.12Å; F239-L243 HydrophobicContact CE1-CD1 4.09Å; F239-L243 HydrophobicContact CE1-CD2 4.35Å; F239-L243 HydrophobicContact CE1-CG 4.36Å; F239-L243 HydrophobicContact CE2-CD2 4.23Å; F239-L243 HydrophobicContact CZ-CD1 4.42Å; F239-L243 HydrophobicContact CZ-CD2 3.86Å; F239-L243 HydrophobicContact CZ-CG 4.34Å; F239-L243 PolarHBondContact O-N 3.32Å; F239-N253 HydrophobicContact CE2-CB 4.36Å; F239-N253 HydrophobicContact CZ-CB 4.29Å; F239-K256 HydrophobicContact CD2-CB 3.92Å; F239-K256 HydrophobicContact CE2-CB 3.79Å; F239-R257 HydrophobicContact CD2-CB 4.33Å; F239-R257 HydrophobicContact CD2-CG 3.43Å; F239-R257 VanDerWaalsContact CD2-CG 3.43Å; F239-R257 HydrophobicContact CE2-CG 3.57Å; F239-R257 HydrophobicContact CG-CG 4.06Å; F239-R257 HydrophobicContact CZ-CG 4.3Å; F239-A260 HydrophobicContact CB-CB 4.17Å
240	E	77.4	Confident	79.4	Confident	99 Å²	99	60.7 Å²	60.7	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-58	-35.5	176.9	-72.5	-66.3	144.5	0	0	111.2	D236 I238 L243 H244	D236-E240 WeakPolarHBondContact O-CB 3.39Å; D236-E240 VanDerWaalsContact O-CG 3.29Å; D236-E240 WeakPolarHBondContact O-CG 3.31Å; D236-E240 PolarHBondContact O-N 2.94Å; I238-E240 PolarHBondContact O-N 3.47Å; E240-L243 WeakPolarHBondContact O-CB 3.2Å; E240-L243 PolarHBondContact O-N 3.05Å; E240-H244 PolarHBondContact O-CE1 2.92Å; E240-H244 PolarHBondContact O-ND1 2.99Å
241	E	78.4	Confident	78.7	Confident	35 Å²	35	61.7 Å²	61.7	16%	0.164	31%	0.311	C	S	.	.	H	α-helix	trans	-73.6	-37.6	176.3	-70	-64.9	119.2	0	0	112.9	L219 L237 I238 F239 L243 H244 I245 W797	L219-E241 HydrophobicContact CD1-CB 4.12Å; L219-E241 HydrophobicContact CD1-CG 3.79Å; L219-E241 HydrophobicContact CD2-CB 4.14Å; L219-E241 HydrophobicContact CD2-CG 3.52Å; L219-E241 HydrophobicContact CG-CG 4.23Å; L237-E241 WeakPolarHBondContact O-CG 3.32Å; L237-E241 PolarHBondContact O-N 2.9Å; I238-E241 WeakPolarHBondContact O-CB 3.34Å; I238-E241 PolarHBondContact O-N 3.27Å; I238-E241 VanDerWaalsContact O-N 3.15Å; F239-E241 PolarHBondContact O-N 3.41Å; E241-L243 PolarHBondContact O-N 3.4Å; E241-L243 VanDerWaalsContact O-N 3.16Å; E241-H244 PolarHBondContact O-N 2.9Å; E241-I245 PolarHBondContact O-N 3.49Å; E241-W797 VanDerWaalsContact CD-CZ3 3.5Å; E241-W797 HydrophobicContact CG-CZ3 4.33Å; E241-W797 WeakPolarHBondContact OE1-CZ3 3.32Å
242	L	81.5	Confident	77.9	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-23	172.6	-65.8	179.4	0	0	0	113	I238 F239 H244 I245 V248 K256 L259 A260 L263	I238-L242 HydrophobicContact CG2-CD1 4.3Å; I238-L242 HydrophobicContact CG2-CG 4.31Å; I238-L242 WeakPolarHBondContact O-CG 3.36Å; I238-L242 PolarHBondContact O-N 3.22Å; F239-L242 WeakPolarHBondContact O-CB 3.49Å; F239-L242 PolarHBondContact O-N 2.92Å; F239-L242 VanDerWaalsContact O-N 3.12Å; L242-H244 PolarHBondContact O-N 3.46Å; L242-I245 HydrophobicContact CD2-CD1 3.75Å; L242-I245 PolarHBondContact O-N 3.45Å; L242-V248 HydrophobicContact CB-CG2 4.27Å; L242-V248 HydrophobicContact CD2-CG2 4.23Å; L242-V248 VanDerWaalsContact O-CG2 3.28Å; L242-V248 WeakPolarHBondContact O-CG2 3.36Å; L242-K256 HydrophobicContact CB-CB 4.48Å; L242-K256 VanDerWaalsContact CD1-O 3.22Å; L242-K256 WeakPolarHBondContact CD1-O 3.33Å; L242-L259 HydrophobicContact CD1-CB 3.98Å; L242-A260 HydrophobicContact CD1-CB 4.02Å; L242-L263 HydrophobicContact CD1-CD1 3.71Å; L242-L263 HydrophobicContact CD2-CD1 3.66Å; L242-L263 HydrophobicContact CG-CD1 4.21Å
243	L	71.8	Confident	77.5	Confident	60 Å²	60	55.7 Å²	55.7	31%	0.314	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.8	172.9	-61.6	176.6	0	0	0	112.7	F239 E240 E241 N253 K256	F239-L243 HydrophobicContact CE1-CD1 4.09Å; F239-L243 HydrophobicContact CE1-CD2 4.35Å; F239-L243 HydrophobicContact CE1-CG 4.36Å; F239-L243 HydrophobicContact CE2-CD2 4.23Å; F239-L243 HydrophobicContact CZ-CD1 4.42Å; F239-L243 HydrophobicContact CZ-CD2 3.86Å; F239-L243 HydrophobicContact CZ-CG 4.34Å; F239-L243 PolarHBondContact O-N 3.32Å; E240-L243 WeakPolarHBondContact O-CB 3.2Å; E240-L243 PolarHBondContact O-N 3.05Å; E241-L243 PolarHBondContact O-N 3.4Å; E241-L243 VanDerWaalsContact O-N 3.16Å; L243-N253 WeakPolarHBondContact CD2-OD1 3.43Å; L243-K256 HydrophobicContact CD2-CD 4.05Å
244	H	69.1	Low	77.3	Confident	117 Å²	117	49.3 Å²	49.3	54%	0.542	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-8.5	-174.9	-55.1	95.5	0	0	0	113.3	E240 E241 L242	E240-H244 PolarHBondContact O-CE1 2.92Å; E240-H244 PolarHBondContact O-ND1 2.99Å; E241-H244 PolarHBondContact O-N 2.9Å; L242-H244 PolarHBondContact O-N 3.46Å
245	I	74.8	Confident	77.2	Confident	17 Å²	17	48.6 Å²	48.6	9%	0.087	25%	0.248	C	C	.	.			trans	-83.9	121	179.8	-61.1	-178.9	0	0	0	110.4	E241 L242 A247 V248 A249 I287 W289 L337	E241-I245 PolarHBondContact O-N 3.49Å; L242-I245 HydrophobicContact CD2-CD1 3.75Å; L242-I245 PolarHBondContact O-N 3.45Å; I245-A247 HydrophobicContact CG2-CB 3.99Å; I245-A247 PolarHBondContact O-N 2.95Å; I245-V248 HydrophobicContact CB-CG2 3.72Å; I245-V248 HydrophobicContact CG2-CG2 3.99Å; I245-V248 WeakPolarHBondContact O-CG2 3.41Å; I245-V248 PolarHBondContact O-N 3.35Å; I245-A249 PolarHBondContact O-N 3.27Å; I245-I287 HydrophobicContact CG2-CG2 3.94Å; I245-W289 HydrophobicContact CD1-CE3 4.15Å; I245-W289 HydrophobicContact CD1-CZ3 3.71Å; I245-W289 HydrophobicContact CG1-CZ3 4.31Å; I245-L337 HydrophobicContact CD1-CD1 3.94Å
246	K	71.9	Confident	77	Confident	161 Å²	161	47.2 Å²	47.2	70%	0.7	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-55.6	-45.4	-179.3	-173.2	-175.3	174.3	-166.4	0	113.1	V248 A249	K246-V248 PolarHBondContact O-N 3.06Å; K246-V248 VanDerWaalsContact O-N 3.12Å; K246-A249 WeakPolarHBondContact O-CB 2.86Å; K246-A249 PolarHBondContact O-N 3.44Å; K246-A249 VanDerWaalsContact O-N 3.11Å
247	A	75.2	Confident	77.3	Confident	5 Å²	5	49.6 Å²	49.6	4%	0.041	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-52.7	-33.5	179.4	0	0	0	0	0	114.1	I245 H250 I287 G309 D311	I245-A247 HydrophobicContact CG2-CB 3.99Å; I245-A247 PolarHBondContact O-N 2.95Å; A247-H250 PolarHBondContact O-CE1 2.98Å; A247-H250 PolarHBondContact O-ND1 2.97Å; A247-I287 HydrophobicContact CB-CD1 4.34Å; A247-I287 HydrophobicContact CB-CG1 4.14Å; A247-I287 HydrophobicContact CB-CG2 3.95Å; A247-G309 PolarHBondContact N-O 2.93Å; A247-D311 HydrophobicContact CB-CB 3.68Å
248	V	78.2	Confident	77.6	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-109.9	2.4	-178.4	-68	0	0	0	0	113.1	L242 I245 K246 H250 L251 K256 L259 W285 I287	L242-V248 HydrophobicContact CB-CG2 4.27Å; L242-V248 HydrophobicContact CD2-CG2 4.23Å; L242-V248 VanDerWaalsContact O-CG2 3.28Å; L242-V248 WeakPolarHBondContact O-CG2 3.36Å; I245-V248 HydrophobicContact CB-CG2 3.72Å; I245-V248 HydrophobicContact CG2-CG2 3.99Å; I245-V248 WeakPolarHBondContact O-CG2 3.41Å; I245-V248 PolarHBondContact O-N 3.35Å; K246-V248 PolarHBondContact O-N 3.06Å; K246-V248 VanDerWaalsContact O-N 3.12Å; V248-H250 PolarHBondContact O-N 3.48Å; V248-H250 VanDerWaalsContact O-N 3.14Å; V248-L251 HydrophobicContact CB-CD1 3.85Å; V248-L251 HydrophobicContact CB-CG 4.32Å; V248-L251 HydrophobicContact CG1-CD1 3.67Å; V248-L251 WeakPolarHBondContact O-CB 3.49Å; V248-L251 PolarHBondContact O-N 3.13Å; V248-K256 WeakPolarHBondContact O-CE 3.22Å; V248-K256 PolarHBondContact O-NZ 3.02Å; V248-L259 HydrophobicContact CG1-CD1 4.01Å; V248-W285 HydrophobicContact CG1-CH2 3.66Å; V248-W285 HydrophobicContact CG1-CZ2 4.43Å; V248-I287 HydrophobicContact CG1-CD1 3.75Å
249	A	68.3	Low	77.7	Confident	42 Å²	42	50.2 Å²	50.2	35%	0.347	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-39.6	-174.8	0	0	0	0	0	112.1	I245 K246 L251 K256	I245-A249 PolarHBondContact O-N 3.27Å; K246-A249 WeakPolarHBondContact O-CB 2.86Å; K246-A249 PolarHBondContact O-N 3.44Å; K246-A249 VanDerWaalsContact O-N 3.11Å; A249-L251 VanDerWaalsContact C-N 3.27Å; A249-L251 PolarHBondContact O-N 2.69Å; A249-K256 PolarHBondContact O-NZ 3.42Å
250	H	67.4	Low	78	Confident	137 Å²	137	49.5 Å²	49.5	63%	0.634	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-12.2	179.4	69.4	-82.9	0	0	0	114.8	A247 V248	A247-H250 PolarHBondContact O-CE1 2.98Å; A247-H250 PolarHBondContact O-ND1 2.97Å; V248-H250 PolarHBondContact O-N 3.48Å; V248-H250 VanDerWaalsContact O-N 3.14Å
251	L	76.6	Confident	78.6	Confident	41 Å²	41	46.4 Å²	46.4	22%	0.215	23%	0.232	C	C	.	.	S	Bend	trans	-80.7	147.2	179.8	-56.6	-179.5	0	0	0	111.1	V248 A249 V255 K256 L259 W285	V248-L251 HydrophobicContact CB-CD1 3.85Å; V248-L251 HydrophobicContact CB-CG 4.32Å; V248-L251 HydrophobicContact CG1-CD1 3.67Å; V248-L251 WeakPolarHBondContact O-CB 3.49Å; V248-L251 PolarHBondContact O-N 3.13Å; A249-L251 VanDerWaalsContact C-N 3.27Å; A249-L251 PolarHBondContact O-N 2.69Å; L251-V255 HydrophobicContact CB-CB 4.2Å; L251-V255 HydrophobicContact CB-CG1 3.99Å; L251-V255 HydrophobicContact CD1-CG1 3.78Å; L251-V255 HydrophobicContact CD2-CG1 4.42Å; L251-V255 HydrophobicContact CG-CG1 4.29Å; L251-K256 HydrophobicContact CB-CG 4.32Å; L251-K256 WeakPolarHBondContact O-CE 3.03Å; L251-K256 PolarHBondContact O-NZ 2.97Å; L251-L259 HydrophobicContact CD1-CD1 3.56Å; L251-W285 HydrophobicContact CD1-CH2 4.43Å
252	S	71	Confident	79.3	Confident	27 Å²	27	45 Å²	45	19%	0.189	23%	0.226	C	C	.	.			trans	-62	157.3	175.5	69.7	0	0	0	0	111.4	S254 V255 K256	S252-S254 PolarHBondContact O-N 3.12Å; S252-S254 PolarHBondContact OG-OG 2.94Å; S252-V255 PolarHBondContact O-N 2.78Å; S252-V255 VanDerWaalsContact OG-CG2 3.25Å; S252-V255 WeakPolarHBondContact OG-CG2 3.15Å; S252-V255 PolarHBondContact OG-N 3.22Å; S252-K256 WeakPolarHBondContact O-CG 3.47Å; S252-K256 PolarHBondContact O-N 3.48Å
253	N	75.8	Confident	79.8	Confident	45 Å²	45	44.9 Å²	44.9	24%	0.241	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-29.9	176.5	-69.9	-48.5	0	0	0	112.6	F239 L243 R257 E842	F239-N253 HydrophobicContact CE2-CB 4.36Å; F239-N253 HydrophobicContact CZ-CB 4.29Å; L243-N253 WeakPolarHBondContact CD2-OD1 3.43Å; N253-R257 WeakPolarHBondContact O-CG 3.33Å; N253-R257 PolarHBondContact O-N 3.48Å; N253-E842 PolarHBondContact ND2-OE1 3.41Å
254	S	76.1	Confident	80.9	Confident	21 Å²	21	44.1 Å²	44.1	15%	0.147	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-46.6	174.1	55.5	0	0	0	0	111.8	S252 K256 R257 E258 E369	S252-S254 PolarHBondContact O-N 3.12Å; S252-S254 PolarHBondContact OG-OG 2.94Å; S254-K256 PolarHBondContact O-N 2.91Å; S254-R257 PolarHBondContact O-N 3Å; S254-E258 WeakPolarHBondContact O-CG 3.35Å; S254-E258 PolarHBondContact O-N 3.42Å; S254-E258 VanDerWaalsContact O-N 3.08Å; S254-E369 WeakPolarHBondContact CB-OE1 3.46Å; S254-E369 PolarHBondContact OG-OE1 3.34Å
255	V	83.6	Confident	81.9	Confident	18 Å²	18	39.8 Å²	39.8	11%	0.109	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-45.7	175	173.9	0	0	0	0	110.5	L251 S252 R257 E258 L259 I347 V351	L251-V255 HydrophobicContact CB-CB 4.2Å; L251-V255 HydrophobicContact CB-CG1 3.99Å; L251-V255 HydrophobicContact CD1-CG1 3.78Å; L251-V255 HydrophobicContact CD2-CG1 4.42Å; L251-V255 HydrophobicContact CG-CG1 4.29Å; S252-V255 PolarHBondContact O-N 2.78Å; S252-V255 VanDerWaalsContact OG-CG2 3.25Å; S252-V255 WeakPolarHBondContact OG-CG2 3.15Å; S252-V255 PolarHBondContact OG-N 3.22Å; V255-R257 VanDerWaalsContact C-N 3.29Å; V255-R257 PolarHBondContact O-N 2.89Å; V255-E258 PolarHBondContact O-N 3.27Å; V255-L259 HydrophobicContact CG1-CD1 3.91Å; V255-L259 HydrophobicContact CG1-CG 4.15Å; V255-L259 WeakPolarHBondContact O-CB 3.32Å; V255-L259 VanDerWaalsContact O-CG 3.3Å; V255-L259 WeakPolarHBondContact O-CG 3.28Å; V255-L259 PolarHBondContact O-N 3.25Å; V255-I347 HydrophobicContact CG1-CG2 4.2Å; V255-V351 HydrophobicContact CG2-CG1 4.35Å; V255-V351 HydrophobicContact CG2-CG2 3.6Å
256	K	85.1	Confident	82.8	Confident	13 Å²	13	40.5 Å²	40.5	6%	0.057	20%	0.204	C	C	.	.	H	α-helix	trans	-58.9	-38.3	177.9	-71.8	171.4	-179.4	148.8	0	112.4	F239 L242 L243 V248 A249 L251 S252 S254 L259 A260	F239-K256 HydrophobicContact CD2-CB 3.92Å; F239-K256 HydrophobicContact CE2-CB 3.79Å; L242-K256 HydrophobicContact CB-CB 4.48Å; L242-K256 VanDerWaalsContact CD1-O 3.22Å; L242-K256 WeakPolarHBondContact CD1-O 3.33Å; L243-K256 HydrophobicContact CD2-CD 4.05Å; V248-K256 WeakPolarHBondContact O-CE 3.22Å; V248-K256 PolarHBondContact O-NZ 3.02Å; A249-K256 PolarHBondContact O-NZ 3.42Å; L251-K256 HydrophobicContact CB-CG 4.32Å; L251-K256 WeakPolarHBondContact O-CE 3.03Å; L251-K256 PolarHBondContact O-NZ 2.97Å; S252-K256 WeakPolarHBondContact O-CG 3.47Å; S252-K256 PolarHBondContact O-N 3.48Å; S254-K256 PolarHBondContact O-N 2.91Å; K256-L259 PolarHBondContact O-N 2.73Å; K256-A260 PolarHBondContact O-N 2.96Å
257	R	86.2	Confident	83.8	Confident	146 Å²	146	36.1 Å²	36.1	55%	0.551	19%	0.192	S	C	*	.	H	α-helix	trans	-66.4	-43.8	175	-75.2	-179.5	-178.1	171.9	-1.6	112.6	F239 N253 S254 V255 L259 A260 A261	F239-R257 HydrophobicContact CD2-CB 4.33Å; F239-R257 HydrophobicContact CD2-CG 3.43Å; F239-R257 VanDerWaalsContact CD2-CG 3.43Å; F239-R257 HydrophobicContact CE2-CG 3.57Å; F239-R257 HydrophobicContact CG-CG 4.06Å; F239-R257 HydrophobicContact CZ-CG 4.3Å; N253-R257 WeakPolarHBondContact O-CG 3.33Å; N253-R257 PolarHBondContact O-N 3.48Å; S254-R257 PolarHBondContact O-N 3Å; V255-R257 VanDerWaalsContact C-N 3.29Å; V255-R257 PolarHBondContact O-N 2.89Å; R257-L259 VanDerWaalsContact C-N 3.3Å; R257-L259 PolarHBondContact O-N 2.89Å; R257-A260 WeakPolarHBondContact O-CB 3.44Å; R257-A260 PolarHBondContact O-N 2.79Å; R257-A261 PolarHBondContact O-N 3.41Å
258	E	88.7	Confident	84.7	Confident	48 Å²	48	37.8 Å²	37.8	22%	0.224	20%	0.199	C	C	.	.	H	α-helix	trans	-64.8	-37.9	175.6	-63.1	-68.7	169.5	0	0	111	S254 V255 A261 V262 I347 K354	S254-E258 WeakPolarHBondContact O-CG 3.35Å; S254-E258 PolarHBondContact O-N 3.42Å; S254-E258 VanDerWaalsContact O-N 3.08Å; V255-E258 PolarHBondContact O-N 3.27Å; E258-A261 WeakPolarHBondContact O-CB 3.5Å; E258-A261 PolarHBondContact O-N 3.31Å; E258-V262 PolarHBondContact O-N 2.9Å; E258-I347 HydrophobicContact CB-CD1 4.09Å; E258-I347 HydrophobicContact CB-CG1 3.95Å; E258-I347 HydrophobicContact CB-CG2 4.16Å; E258-K354 IonicContact OE1-NZ 2.74Å; E258-K354 PolarHBondContact OE1-NZ 2.89Å
259	L	90.8	Very high	85.3	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-47.5	172.6	-74.1	175.3	0	0	0	111.5	L242 V248 L251 V255 K256 R257 A261 V262 L263 W285 V339 I347	L242-L259 HydrophobicContact CD1-CB 3.98Å; V248-L259 HydrophobicContact CG1-CD1 4.01Å; L251-L259 HydrophobicContact CD1-CD1 3.56Å; V255-L259 HydrophobicContact CG1-CD1 3.91Å; V255-L259 HydrophobicContact CG1-CG 4.15Å; V255-L259 WeakPolarHBondContact O-CB 3.32Å; V255-L259 VanDerWaalsContact O-CG 3.3Å; V255-L259 WeakPolarHBondContact O-CG 3.28Å; V255-L259 PolarHBondContact O-N 3.25Å; K256-L259 PolarHBondContact O-N 2.73Å; R257-L259 VanDerWaalsContact C-N 3.3Å; R257-L259 PolarHBondContact O-N 2.89Å; L259-A261 PolarHBondContact O-N 3.05Å; L259-A261 VanDerWaalsContact O-N 3.14Å; L259-V262 PolarHBondContact O-N 3.09Å; L259-L263 HydrophobicContact CB-CD1 4.12Å; L259-L263 HydrophobicContact CB-CG 4.35Å; L259-L263 WeakPolarHBondContact O-CB 3.41Å; L259-L263 WeakPolarHBondContact O-CD1 3.3Å; L259-L263 WeakPolarHBondContact O-CG 3.41Å; L259-L263 PolarHBondContact O-N 3.5Å; L259-W285 HydrophobicContact CD1-CZ3 4.4Å; L259-W285 HydrophobicContact CD2-CZ3 4.13Å; L259-V339 HydrophobicContact CD2-CG1 4.42Å; L259-V339 HydrophobicContact CD2-CG2 3.78Å; L259-I347 HydrophobicContact CD2-CD1 3.92Å; L259-I347 HydrophobicContact CG-CD1 4.42Å
260	A	90.4	Very high	86.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-54.6	-35.1	176.7	0	0	0	0	0	112.3	R230 I238 F239 L242 K256 R257	R230-A260 PolarHBondContact NH1-O 3.03Å; I238-A260 HydrophobicContact CB-CB 4.04Å; I238-A260 HydrophobicContact CG2-CB 3.72Å; F239-A260 HydrophobicContact CB-CB 4.17Å; L242-A260 HydrophobicContact CD1-CB 4.02Å; K256-A260 PolarHBondContact O-N 2.96Å; R257-A260 WeakPolarHBondContact O-CB 3.44Å; R257-A260 PolarHBondContact O-N 2.79Å
261	A	90.9	Very high	87.7	Confident	33 Å²	33	42.4 Å²	42.4	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-72.5	-25.1	177	0	0	0	0	0	114.3	P227 L235 R257 E258 L259	P227-A261 VanDerWaalsContact CB-O 3.22Å; P227-A261 WeakPolarHBondContact CB-O 3.25Å; L235-A261 HydrophobicContact CD2-CB 4.21Å; R257-A261 PolarHBondContact O-N 3.41Å; E258-A261 WeakPolarHBondContact O-CB 3.5Å; E258-A261 PolarHBondContact O-N 3.31Å; L259-A261 PolarHBondContact O-N 3.05Å; L259-A261 VanDerWaalsContact O-N 3.14Å
262	V	92.6	Very high	88.4	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-115.7	-19.2	-172.6	-54.1	0	0	0	0	115.4	E258 L259 L264 V339 D343 I347	E258-V262 PolarHBondContact O-N 2.9Å; L259-V262 PolarHBondContact O-N 3.09Å; V262-L264 PolarHBondContact O-N 3.24Å; V262-V339 HydrophobicContact CG2-CG1 4.2Å; V262-D343 HydrophobicContact CB-CB 4.07Å; V262-D343 HydrophobicContact CG1-CB 4.21Å; V262-D343 HydrophobicContact CG2-CB 4.14Å; V262-I347 HydrophobicContact CG1-CD1 4.35Å; V262-I347 HydrophobicContact CG2-CD1 3.54Å
263	L	92.6	Very high	89.6	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	25%	0.246	C	C	.	.			trans	-55	134.8	-174.1	-81.4	159.6	0	0	0	110.8	R230 I238 L242 L259 L337 V339	R230-L263 VanDerWaalsContact CZ-O 3.24Å; R230-L263 PolarHBondContact NH1-O 2.96Å; R230-L263 PolarHBondContact NH2-O 3.37Å; I238-L263 HydrophobicContact CG2-CD1 4.42Å; L242-L263 HydrophobicContact CD1-CD1 3.71Å; L242-L263 HydrophobicContact CD2-CD1 3.66Å; L242-L263 HydrophobicContact CG-CD1 4.21Å; L259-L263 HydrophobicContact CB-CD1 4.12Å; L259-L263 HydrophobicContact CB-CG 4.35Å; L259-L263 WeakPolarHBondContact O-CB 3.41Å; L259-L263 WeakPolarHBondContact O-CD1 3.3Å; L259-L263 WeakPolarHBondContact O-CG 3.41Å; L259-L263 PolarHBondContact O-N 3.5Å; L263-L337 HydrophobicContact CD2-CB 3.85Å; L263-V339 HydrophobicContact CD2-CG2 3.47Å; L263-V339 VanDerWaalsContact CD2-CG2 3.47Å; L263-V339 HydrophobicContact CG-CG2 4.27Å
264	L	93.1	Very high	90.6	Very high	43 Å²	43	44.9 Å²	44.9	23%	0.225	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138	176.1	-62.5	172.8	0	0	0	109.6	P227 V262 L337 R338 D340	P227-L264 HydrophobicContact CG-CD2 3.74Å; V262-L264 PolarHBondContact O-N 3.24Å; L264-L337 CarbonylContact O-C 3.57Å; L264-L337 WeakPolarHBondContact O-CA 3.31Å; L264-R338 HydrophobicContact CB-CB 4.3Å; L264-R338 PolarHBondContact N-O 2.92Å; L264-R338 PolarHBondContact O-N 3.27Å; L264-D340 WeakPolarHBondContact CD1-OD2 3.41Å
265	F	91.8	Very high	91.4	Very high	26 Å²	26	45 Å²	45	11%	0.114	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.8	173.2	-174.8	-98.6	0	0	0	110.3	L223 R224 P267 W289 H335 L337	L223-F265 HydrophobicContact CB-CB 4.07Å; L223-F265 HydrophobicContact CB-CD2 4.13Å; L223-F265 HydrophobicContact CB-CG 4.33Å; L223-F265 HydrophobicContact CD1-CD2 4.46Å; L223-F265 VanDerWaalsContact O-CB 3.3Å; L223-F265 WeakPolarHBondContact O-CB 3.25Å; R224-F265 HydrophobicContact CG-CD1 3.62Å; R224-F265 HydrophobicContact CG-CE1 4.07Å; R224-F265 HydrophobicContact CG-CG 4.23Å; F265-P267 HydrophobicContact CD1-CG 4.3Å; F265-P267 HydrophobicContact CE1-CB 3.93Å; F265-P267 HydrophobicContact CE1-CG 4Å; F265-W289 AromaticContact CE2-CD1 3.89Å; F265-H335 HydrophobicContact CE2-CB 3.92Å; F265-H335 HydrophobicContact CZ-CB 3.83Å; F265-H335 AromaticContact CZ-CD2 3.86Å; F265-H335 AromaticContact CZ-CG 3.69Å; F265-L337 HydrophobicContact CD2-CD2 4.11Å
266	E	93.7	Very high	92	Very high	32 Å²	32	45.2 Å²	45.2	15%	0.15	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	101	-177.7	-169.7	174	133.5	0	0	111	H268 L275 F336 R338	E266-H268 IonicContact OE1-CD2 2.58Å; E266-H268 IonicContact OE1-CE1 2.75Å; E266-H268 IonicContact OE1-NE2 3.82Å; E266-H268 PolarHBondContact OE1-NE2 2.92Å; E266-L275 WeakPolarHBondContact OE1-CD1 3.38Å; E266-F336 HydrophobicContact CB-CB 4.49Å; E266-F336 PolarHBondContact N-O 3Å; E266-F336 PolarHBondContact O-N 3.3Å; E266-R338 WeakPolarHBondContact OE2-CD 3.45Å; E266-R338 IonicContact OE2-CZ 3.22Å; E266-R338 IonicContact OE2-NE 3.32Å; E266-R338 IonicContact OE2-NH1 3.58Å; E266-R338 PolarHBondContact OE2-NH1 3.04Å
267	P	91.9	Very high	92.5	Very high	70 Å²	70	46.9 Å²	46.9	46%	0.455	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	144.7	175.8	34	-31.8	0	0	0	112.1	F265	F265-P267 HydrophobicContact CD1-CG 4.3Å; F265-P267 HydrophobicContact CE1-CB 3.93Å; F265-P267 HydrophobicContact CE1-CG 4Å
268	H	93.3	Very high	92.7	Very high	40 Å²	40	42.6 Å²	42.6	19%	0.185	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	128.1	175.3	-74.9	-86.6	0	0	0	110.1	E266 L275 L329 N333 C334 F336	E266-H268 IonicContact OE1-CD2 2.58Å; E266-H268 IonicContact OE1-CE1 2.75Å; E266-H268 IonicContact OE1-NE2 3.82Å; E266-H268 PolarHBondContact OE1-NE2 2.92Å; H268-L275 WeakPolarHBondContact NE2-CD1 3.48Å; H268-L329 HydrophobicContact CB-CD2 3.36Å; H268-N333 CarbonylContact O-C 3.55Å; H268-N333 WeakPolarHBondContact O-CA 3.28Å; H268-N333 PolarHBondContact O-N 3.47Å; H268-C334 PolarHBondContact N-O 3Å; H268-C334 PolarHBondContact O-N 3.44Å; H268-F336 AromaticContact CD2-CD2 3.78Å; H268-F336 AromaticContact CD2-CE2 3.74Å
269	S	90.6	Very high	92.6	Very high	82 Å²	82	42.7 Å²	42.7	57%	0.573	27%	0.267	S	S	*	.			trans	-85.7	-25.9	-169.5	-47.5	0	0	0	0	114.6	D332 N333	S269-D332 WeakPolarHBondContact O-CA 3.4Å; S269-D332 WeakPolarHBondContact O-CB 3.27Å; S269-N333 PolarHBondContact O-N 2.91Å
270	K	93.4	Very high	92.7	Very high	150 Å²	150	45.9 Å²	45.9	65%	0.652	28%	0.284	S	S	*	.	S	Bend	trans	-117.7	131.4	-166.7	-63.5	-173.6	179.8	-175	0	113.3	T273 D332	K270-T273 WeakPolarHBondContact O-CB 3.21Å; K270-T273 PolarHBondContact O-N 3.09Å; K270-T273 PolarHBondContact O-OG1 3.04Å; K270-D332 WeakPolarHBondContact CA-OD1 3.02Å
271	A	93.4	Very high	92.7	Very high	44 Å²	44	54.7 Å²	54.7	36%	0.364	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	149.2	165.7	0	0	0	0	0	110.6	T273 E331 D332	A271-T273 PolarHBondContact O-N 3.29Å; A271-E331 WeakPolarHBondContact CA-O 3.28Å; A271-D332 WeakPolarHBondContact CB-OD1 3.43Å; A271-D332 PolarHBondContact N-OD1 2.64Å
272	G	91.4	Very high	92.6	Very high	48 Å²	48	53.3 Å²	53.3	50%	0.495	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-5.2	-177	0	0	0	0	0	114.8	V274 I328 L329	G272-V274 PolarHBondContact O-N 2.9Å; G272-I328 WeakPolarHBondContact O-CG2 3.49Å; G272-L329 WeakPolarHBondContact CA-O 3.49Å; G272-L329 PolarHBondContact N-O 3.2Å
273	T	96.1	Very high	92.6	Very high	46 Å²	46	57 Å²	57	28%	0.282	33%	0.333	S	S	.	.			trans	-62	128.8	173.3	-57.8	0	0	0	0	109.9	K270 A271 I328 L329	K270-T273 WeakPolarHBondContact O-CB 3.21Å; K270-T273 PolarHBondContact O-N 3.09Å; K270-T273 PolarHBondContact O-OG1 3.04Å; A271-T273 PolarHBondContact O-N 3.29Å; T273-I328 WeakPolarHBondContact O-CA 3.21Å; T273-L329 WeakPolarHBondContact O-CD1 3.46Å; T273-L329 PolarHBondContact O-N 3.07Å
274	V	95.9	Very high	92.7	Very high	71 Å²	71	57.1 Å²	57.1	43%	0.43	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	118	176.1	-177.1	0	0	0	0	108.8	G272 T326 I328	G272-V274 PolarHBondContact O-N 2.9Å; V274-T326 HydrophobicContact CG1-CG2 3.72Å; V274-I328 HydrophobicContact CG2-CD1 4.46Å; V274-I328 HydrophobicContact CG2-CG1 4.21Å
275	L	94.8	Very high	92.8	Very high	24 Å²	24	55.5 Å²	55.5	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-41.3	-178.6	-163.7	70	0	0	0	111.6	E266 H268 Y286 F312 I327 L329 F336	E266-L275 WeakPolarHBondContact OE1-CD1 3.38Å; H268-L275 WeakPolarHBondContact NE2-CD1 3.48Å; L275-Y286 HydrophobicContact CD1-CE1 4.38Å; L275-Y286 HydrophobicContact CD2-CD1 3.9Å; L275-Y286 HydrophobicContact CD2-CD2 4.36Å; L275-Y286 HydrophobicContact CD2-CE1 3.87Å; L275-Y286 HydrophobicContact CD2-CE2 4.35Å; L275-Y286 HydrophobicContact CD2-CG 4.14Å; L275-Y286 HydrophobicContact CG-CE1 4.27Å; L275-F312 HydrophobicContact CD2-CE2 3.65Å; L275-F312 HydrophobicContact CD2-CZ 3.56Å; L275-I327 HydrophobicContact CB-CB 4.29Å; L275-I327 HydrophobicContact CB-CG2 4.18Å; L275-I327 HydrophobicContact CD2-CG2 4.32Å; L275-I327 PolarHBondContact N-O 2.99Å; L275-L329 HydrophobicContact CB-CD1 4.43Å; L275-F336 HydrophobicContact CD1-CE2 4.47Å
276	F	95.7	Very high	92.9	Very high	22 Å²	22	54.9 Å²	54.9	10%	0.096	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	159.9	166	54.7	-105.4	0	0	0	110	Y286 F312 R323 A325 T326 I327	F276-Y286 HydrophobicContact CD1-CE2 4.04Å; F276-Y286 HydrophobicContact CE1-CD2 4.03Å; F276-Y286 AromaticContact CE1-CE2 3.85Å; F276-Y286 HydrophobicContact CE1-CE2 3.85Å; F276-F312 AromaticContact CE1-CD2 3.92Å; F276-F312 HydrophobicContact CE1-CD2 3.92Å; F276-F312 AromaticContact CE1-CE2 3.74Å; F276-F312 HydrophobicContact CE1-CE2 3.74Å; F276-F312 AromaticContact CZ-CD2 3.84Å; F276-F312 HydrophobicContact CZ-CD2 3.84Å; F276-F312 HydrophobicContact CZ-CE2 4.08Å; F276-R323 HydrophobicContact CD2-CB 4.13Å; F276-R323 HydrophobicContact CD2-CG 3.62Å; F276-R323 HydrophobicContact CE2-CB 4.28Å; F276-R323 HydrophobicContact CE2-CG 3.93Å; F276-R323 HydrophobicContact CG-CG 4.26Å; F276-A325 WeakPolarHBondContact CE2-O 3.49Å; F276-T326 WeakPolarHBondContact O-CA 3.41Å; F276-T326 WeakPolarHBondContact O-CG2 3.25Å; F276-I327 HydrophobicContact CD2-CG1 4.22Å; F276-I327 HydrophobicContact CE1-CB 4.43Å; F276-I327 HydrophobicContact CE1-CG1 3.97Å; F276-I327 HydrophobicContact CE2-CB 4.25Å; F276-I327 HydrophobicContact CE2-CG1 3.44Å; F276-I327 VanDerWaalsContact CE2-CG1 3.44Å; F276-I327 HydrophobicContact CZ-CB 4.17Å; F276-I327 HydrophobicContact CZ-CD1 4.43Å; F276-I327 HydrophobicContact CZ-CG1 3.3Å; F276-I327 PolarHBondContact O-N 2.94Å
277	S	94.5	Very high	92.9	Very high	48 Å²	48	53.4 Å²	53.4	34%	0.336	32%	0.316	S	S	.	.			trans	-102.7	151.7	-179.3	-57.9	0	0	0	0	112.4	G279 D280 R323	S277-G279 PolarHBondContact O-N 3.3Å; S277-D280 WeakPolarHBondContact CA-OD2 3.37Å; S277-D280 WeakPolarHBondContact CB-OD2 3.38Å; S277-D280 PolarHBondContact N-OD2 3.5Å; S277-D280 VanDerWaalsContact O-CB 3.27Å; S277-D280 WeakPolarHBondContact O-CB 3.41Å; S277-D280 VanDerWaalsContact O-CG 3.3Å; S277-D280 PolarHBondContact O-N 3.39Å; S277-D280 VanDerWaalsContact O-N 3.12Å; S277-R323 WeakPolarHBondContact O-CB 3.46Å
278	Q	90.4	Very high	92.7	Very high	56 Å²	56	50.2 Å²	50.2	26%	0.262	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	134.3	167.6	-176.6	174.1	0.3	0	0	109.9	H298 R323 A324 T326	Q278-H298 VanDerWaalsContact CD-CD2 3.45Å; Q278-H298 PolarHBondContact OE1-CD2 3.35Å; Q278-R323 WeakPolarHBondContact CA-O 3.35Å; Q278-R323 WeakPolarHBondContact CG-O 3.42Å; Q278-A324 VanDerWaalsContact CD-O 3.24Å; Q278-A324 PolarHBondContact NE2-O 2.62Å; Q278-T326 PolarHBondContact N-OG1 3.27Å
279	G	87.4	Confident	92.4	Very high	50 Å²	50	49.6 Å²	49.6	52%	0.515	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-14.1	-175.5	0	0	0	0	0	114.7	S277 R323	S277-G279 PolarHBondContact O-N 3.3Å; G279-R323 PolarHBondContact N-O 3.35Å
280	D	92.6	Very high	92.1	Very high	72 Å²	72	48.4 Å²	48.4	39%	0.385	28%	0.275	S	S	.	.	S	Bend	trans	-65.2	158	175	-69.3	-15.7	0	0	0	111.3	S277 P322 R323	S277-D280 WeakPolarHBondContact CA-OD2 3.37Å; S277-D280 WeakPolarHBondContact CB-OD2 3.38Å; S277-D280 PolarHBondContact N-OD2 3.5Å; S277-D280 VanDerWaalsContact O-CB 3.27Å; S277-D280 WeakPolarHBondContact O-CB 3.41Å; S277-D280 VanDerWaalsContact O-CG 3.3Å; S277-D280 PolarHBondContact O-N 3.39Å; S277-D280 VanDerWaalsContact O-N 3.12Å; D280-P322 CarbonylContact O-C 3.48Å; D280-P322 VanDerWaalsContact O-CA 3.31Å; D280-P322 WeakPolarHBondContact O-CA 3.46Å; D280-R323 HydrophobicContact CB-CG 4.05Å; D280-R323 WeakPolarHBondContact O-CG 3.44Å; D280-R323 PolarHBondContact O-N 3.42Å
281	K	90.9	Very high	91.8	Very high	185 Å²	185	41.5 Å²	41.5	80%	0.804	25%	0.247	S	C	*	.	B	Isolated β-bridge	trans	-68	136.1	172.1	-67.3	-177.3	179.5	180	0	110	T283	K281-T283 PolarHBondContact O-N 3.37Å; K281-T283 VanDerWaalsContact O-N 3.13Å
282	G	89	Confident	91.7	Very high	5 Å²	5	39.7 Å²	39.7	5%	0.052	23%	0.232	C	C	.	.			trans	-68.9	106.2	173	0	0	0	0	0	111.9	L317 K341	G282-L317 WeakPolarHBondContact O-CD2 3.48Å; G282-K341 WeakPolarHBondContact O-CD 3.19Å
283	T	92.9	Very high	91.8	Very high	81 Å²	81	37.4 Å²	37.4	50%	0.497	21%	0.208	S	C	.	.			trans	-105.8	-29	-179.1	53.8	0	0	0	0	114.3	K281 K341	K281-T283 PolarHBondContact O-N 3.37Å; K281-T283 VanDerWaalsContact O-N 3.13Å; T283-K341 VanDerWaalsContact O-CB 3.26Å; T283-K341 WeakPolarHBondContact O-CB 3.3Å; T283-K341 PolarHBondContact O-N 2.98Å
284	S	94.3	Very high	91.6	Very high	5 Å²	5	36.7 Å²	36.7	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	157.6	-173.4	-46.6	0	0	0	0	112.9	R323 R338 V339 D340	S284-R323 PolarHBondContact O-NH1 2.89Å; S284-R323 PolarHBondContact O-NH2 3.26Å; S284-R338 VanDerWaalsContact CB-CG 3.5Å; S284-V339 CarbonylContact C-O 3.54Å; S284-V339 VanDerWaalsContact CA-O 3.27Å; S284-V339 WeakPolarHBondContact CA-O 3.45Å; S284-V339 WeakPolarHBondContact CB-O 3.47Å; S284-D340 PolarHBondContact OG-OD1 3.28Å
285	W	94.3	Very high	91.5	Very high	9 Å²	9	34.3 Å²	34.3	3%	0.034	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	142.9	169.4	169.2	57.5	0	0	0	108.7	V248 L251 L259 I287 D311 Q314 L317 R338 V339 F344	V248-W285 HydrophobicContact CG1-CH2 3.66Å; V248-W285 HydrophobicContact CG1-CZ2 4.43Å; L251-W285 HydrophobicContact CD1-CH2 4.43Å; L259-W285 HydrophobicContact CD1-CZ3 4.4Å; L259-W285 HydrophobicContact CD2-CZ3 4.13Å; W285-I287 HydrophobicContact CH2-CD1 3.85Å; W285-I287 HydrophobicContact CH2-CG1 4.22Å; W285-I287 HydrophobicContact CZ2-CD1 4.09Å; W285-I287 HydrophobicContact CZ2-CG1 3.96Å; W285-I287 HydrophobicContact CZ3-CD1 4.32Å; W285-D311 HydrophobicContact CZ2-CB 4.19Å; W285-D311 PolarHBondContact NE1-OD2 3.43Å; W285-Q314 HydrophobicContact CG-CB 4.3Å; W285-L317 HydrophobicContact CB-CD1 3.71Å; W285-R338 CarbonylContact O-C 3.58Å; W285-R338 WeakPolarHBondContact O-CA 3.38Å; W285-V339 HydrophobicContact CE3-CB 4.01Å; W285-V339 HydrophobicContact CE3-CG2 3.73Å; W285-V339 HydrophobicContact CZ3-CG2 4.03Å; W285-V339 PolarHBondContact N-O 2.9Å; W285-V339 PolarHBondContact O-N 3.05Å; W285-F344 HydrophobicContact CE3-CD2 4.41Å
286	Y	94.6	Very high	91.1	Very high	12 Å²	12	35 Å²	35	5%	0.047	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.9	-171.3	-63	-96	0	0	0	111	L275 F276 D311 F312 F336 L337 R338	L275-Y286 HydrophobicContact CD1-CE1 4.38Å; L275-Y286 HydrophobicContact CD2-CD1 3.9Å; L275-Y286 HydrophobicContact CD2-CD2 4.36Å; L275-Y286 HydrophobicContact CD2-CE1 3.87Å; L275-Y286 HydrophobicContact CD2-CE2 4.35Å; L275-Y286 HydrophobicContact CD2-CG 4.14Å; L275-Y286 HydrophobicContact CG-CE1 4.27Å; F276-Y286 HydrophobicContact CD1-CE2 4.04Å; F276-Y286 HydrophobicContact CE1-CD2 4.03Å; F276-Y286 AromaticContact CE1-CE2 3.85Å; F276-Y286 HydrophobicContact CE1-CE2 3.85Å; Y286-D311 CarbonylContact O-C 3.58Å; Y286-D311 WeakPolarHBondContact O-CA 3.38Å; Y286-D311 WeakPolarHBondContact O-CB 3.33Å; Y286-F312 HydrophobicContact CD2-CD2 4.27Å; Y286-F312 AromaticContact CD2-CE2 3.72Å; Y286-F312 HydrophobicContact CD2-CE2 3.72Å; Y286-F312 HydrophobicContact CD2-CZ 4.42Å; Y286-F312 AromaticContact CG-CE2 3.77Å; Y286-F312 HydrophobicContact CG-CE2 3.77Å; Y286-F312 HydrophobicContact CG-CZ 4Å; Y286-F312 PolarHBondContact N-O 2.83Å; Y286-F312 PolarHBondContact O-N 3.17Å; Y286-F336 HydrophobicContact CD1-CB 4.07Å; Y286-F336 HydrophobicContact CD1-CG 4.48Å; Y286-L337 CarbonylContact C-O 3.57Å; Y286-L337 WeakPolarHBondContact CA-O 3.34Å; Y286-R338 HydrophobicContact CD1-CB 4.03Å; Y286-R338 HydrophobicContact CD1-CG 3.92Å; Y286-R338 HydrophobicContact CE1-CB 4.03Å; Y286-R338 VanDerWaalsContact CE1-CD 3.47Å; Y286-R338 HydrophobicContact CE1-CG 3.6Å
287	I	92.6	Very high	90.7	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.4	168.5	-55.9	169	0	0	0	107.4	I245 A247 V248 W285 W289 D311 F336 L337	I245-I287 HydrophobicContact CG2-CG2 3.94Å; A247-I287 HydrophobicContact CB-CD1 4.34Å; A247-I287 HydrophobicContact CB-CG1 4.14Å; A247-I287 HydrophobicContact CB-CG2 3.95Å; V248-I287 HydrophobicContact CG1-CD1 3.75Å; W285-I287 HydrophobicContact CH2-CD1 3.85Å; W285-I287 HydrophobicContact CH2-CG1 4.22Å; W285-I287 HydrophobicContact CZ2-CD1 4.09Å; W285-I287 HydrophobicContact CZ2-CG1 3.96Å; W285-I287 HydrophobicContact CZ3-CD1 4.32Å; I287-W289 PolarHBondContact O-N 3.15Å; I287-D311 HydrophobicContact CG1-CB 4.08Å; I287-F336 CarbonylContact O-C 3.5Å; I287-F336 VanDerWaalsContact O-CA 3.29Å; I287-F336 WeakPolarHBondContact O-CA 3.48Å; I287-L337 HydrophobicContact CB-CB 4.26Å; I287-L337 PolarHBondContact N-O 3.29Å; I287-L337 PolarHBondContact O-N 2.84Å
288	I	88.8	Confident	90.1	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	111.6	179.6	-52.9	179.3	0	0	0	109	G291 V293 L306 H307 G309 D310 F312 F336	I288-G291 WeakPolarHBondContact CG2-O 3.49Å; I288-V293 HydrophobicContact CD1-CG2 3.75Å; I288-L306 HydrophobicContact CD1-CB 3.59Å; I288-H307 WeakPolarHBondContact CD1-O 3.35Å; I288-G309 PolarHBondContact O-N 3.27Å; I288-D310 HydrophobicContact CD1-CB 4.4Å; I288-D310 PolarHBondContact N-O 3.37Å; I288-F312 HydrophobicContact CD1-CD1 4.23Å; I288-F312 HydrophobicContact CD1-CE1 3.94Å; I288-F312 HydrophobicContact CG1-CD1 4.2Å; I288-F312 HydrophobicContact CG1-CE1 3.69Å; I288-F336 HydrophobicContact CG1-CD1 4.14Å; I288-F336 HydrophobicContact CG1-CE1 4.02Å; I288-F336 HydrophobicContact CG2-CE1 4.36Å
289	W	86.4	Confident	89.4	Confident	27 Å²	27	41.4 Å²	41.4	10%	0.102	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-39.1	178.9	-177.3	-108	0	0	0	112.8	R52 L219 L223 I245 F265 I287 H335 L337	R52-W289 VanDerWaalsContact NH1-NE1 3.19Å; L219-W289 HydrophobicContact CD2-CH2 3.58Å; L219-W289 HydrophobicContact CD2-CZ2 3.54Å; L219-W289 HydrophobicContact CG-CZ2 4.38Å; L223-W289 HydrophobicContact CD1-CZ2 4.3Å; I245-W289 HydrophobicContact CD1-CE3 4.15Å; I245-W289 HydrophobicContact CD1-CZ3 3.71Å; I245-W289 HydrophobicContact CG1-CZ3 4.31Å; F265-W289 AromaticContact CE2-CD1 3.89Å; I287-W289 PolarHBondContact O-N 3.15Å; W289-H335 WeakPolarHBondContact CA-O 3.35Å; W289-H335 HydrophobicContact CB-CB 4.12Å; W289-H335 WeakPolarHBondContact CB-O 3.29Å; W289-H335 HydrophobicContact CG-CB 4.47Å; W289-H335 PolarHBondContact N-O 3.45Å; W289-L337 HydrophobicContact CB-CD2 4.5Å; W289-L337 HydrophobicContact CB-CG 4.27Å; W289-L337 HydrophobicContact CE3-CD1 3.95Å; W289-L337 HydrophobicContact CE3-CG 4.35Å; W289-L337 HydrophobicContact CZ3-CD1 4.45Å
290	K	84.1	Confident	88.8	Confident	57 Å²	57	47.4 Å²	47.4	25%	0.248	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	139.1	174.5	-167.7	-176.6	178.4	-177.8	0	109.5	E90 E308 C334 H335	E90-K290 IonicContact OE1-NZ 2.88Å; E90-K290 PolarHBondContact OE1-NZ 3.25Å; K290-E308 VanDerWaalsContact CA-OE1 3.28Å; K290-E308 WeakPolarHBondContact CA-OE1 3.02Å; K290-E308 WeakPolarHBondContact CG-OE1 3.46Å; K290-C334 CarbonylContact O-C 3.59Å; K290-C334 VanDerWaalsContact O-CA 3.29Å; K290-C334 WeakPolarHBondContact O-CA 3.49Å; K290-H335 HydrophobicContact CB-CB 3.85Å; K290-H335 PolarHBondContact N-O 3.27Å; K290-H335 PolarHBondContact O-N 3.24Å
291	G	87.8	Confident	88.4	Confident	6 Å²	6	45.6 Å²	45.6	6%	0.062	25%	0.254	C	S	.	.	S	Bend	trans	87.8	-158.6	175.3	0	0	0	0	0	115.2	I288 E308 E331	I288-G291 WeakPolarHBondContact CG2-O 3.49Å; G291-E308 PolarHBondContact N-OE1 3.41Å; G291-E308 WeakPolarHBondContact O-CG 3.47Å; G291-E308 PolarHBondContact O-N 3.36Å; G291-E331 WeakPolarHBondContact CA-OE1 3.38Å
292	S	91	Very high	88.2	Confident	6 Å²	6	41.4 Å²	41.4	4%	0.042	24%	0.24	C	C	.	.			trans	-148.2	155.6	-171.9	58.6	0	0	0	0	112.9	L306 R330 E331	S292-L306 VanDerWaalsContact CA-O 3.27Å; S292-L306 WeakPolarHBondContact CA-O 3.45Å; S292-L306 VanDerWaalsContact CB-O 3.32Å; S292-L306 WeakPolarHBondContact CB-O 3.44Å; S292-R330 WeakPolarHBondContact O-CB 3.41Å; S292-R330 PolarHBondContact O-N 3.24Å; S292-E331 VanDerWaalsContact CB-OE1 3.26Å; S292-E331 WeakPolarHBondContact CB-OE1 3.29Å; S292-E331 PolarHBondContact N-OE1 3.08Å; S292-E331 PolarHBondContact OG-OE1 2.76Å
293	V	93.8	Very high	88.1	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.1	-178.7	-56.3	0	0	0	0	112	I288 T305 L306 F312 I327 I328 L329 F336	I288-V293 HydrophobicContact CD1-CG2 3.75Å; V293-T305 CarbonylContact O-C 3.49Å; V293-T305 WeakPolarHBondContact O-CA 3.3Å; V293-T305 WeakPolarHBondContact O-CG2 3.4Å; V293-L306 HydrophobicContact CG2-CB 3.93Å; V293-L306 HydrophobicContact CG2-CD1 4.44Å; V293-L306 PolarHBondContact N-O 3.21Å; V293-L306 PolarHBondContact O-N 2.8Å; V293-F312 HydrophobicContact CG2-CD1 4.3Å; V293-F312 HydrophobicContact CG2-CE1 3.9Å; V293-F312 HydrophobicContact CG2-CZ 4.48Å; V293-I327 HydrophobicContact CB-CG2 3.8Å; V293-I327 HydrophobicContact CG1-CG2 4.14Å; V293-I327 HydrophobicContact CG2-CG2 3.83Å; V293-I328 CarbonylContact C-O 3.57Å; V293-I328 WeakPolarHBondContact CA-O 3.48Å; V293-L329 HydrophobicContact CG1-CD1 4.31Å; V293-L329 HydrophobicContact CG1-CG 4.41Å; V293-F336 HydrophobicContact CG1-CE1 3.62Å; V293-F336 HydrophobicContact CG1-CZ 3.54Å
294	N	92.1	Very high	87.8	Confident	30 Å²	30	44.5 Å²	44.5	16%	0.16	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134	173.7	-71	-27.3	0	0	0	110.2	V296 L302 T305 I328 R330	N294-V296 HydrophobicContact CB-CG2 4.42Å; N294-L302 HydrophobicContact CB-CD1 3.58Å; N294-T305 PolarHBondContact OD1-OG1 3.49Å; N294-I328 PolarHBondContact N-O 3.36Å; N294-I328 PolarHBondContact O-N 3.46Å; N294-R330 PolarHBondContact OD1-NH1 2.92Å
295	V	92.8	Very high	87.6	Confident	21 Å²	21	45.7 Å²	45.7	13%	0.127	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.9	173.5	-173	0	0	0	0	109	V303 T304 L306 A325 I327	V295-V303 PolarHBondContact O-N 3.22Å; V295-T304 HydrophobicContact CB-CG2 3.92Å; V295-T304 HydrophobicContact CG2-CG2 3.75Å; V295-T304 PolarHBondContact N-O 2.87Å; V295-L306 HydrophobicContact CG2-CD1 3.83Å; V295-L306 HydrophobicContact CG2-CG 3.87Å; V295-A325 HydrophobicContact CG1-CB 3.61Å; V295-I327 HydrophobicContact CB-CD1 4.19Å; V295-I327 HydrophobicContact CG1-CD1 4.09Å; V295-I327 HydrophobicContact CG2-CD1 3.74Å
296	V	88.2	Confident	87.2	Confident	40 Å²	40	46.8 Å²	46.8	24%	0.242	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.6	-173.8	-175.6	0	0	0	0	110.4	N294 G301 L302 A325 T326 I328	N294-V296 HydrophobicContact CB-CG2 4.42Å; V296-G301 WeakPolarHBondContact CA-O 3.29Å; V296-L302 HydrophobicContact CG2-CD1 4.38Å; V296-A325 CarbonylContact O-C 3.59Å; V296-A325 WeakPolarHBondContact O-CA 3.4Å; V296-A325 WeakPolarHBondContact O-CB 3.25Å; V296-T326 PolarHBondContact N-O 3.19Å; V296-T326 PolarHBondContact O-N 3.42Å; V296-I328 HydrophobicContact CG2-CD1 4.07Å; V296-I328 HydrophobicContact CG2-CG1 4.46Å
297	T	86.1	Confident	86.9	Confident	26 Å²	26	50.4 Å²	50.4	16%	0.16	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.5	175.4	58.6	0	0	0	0	112	G299 K300 G301 V303 A325	T297-G299 PolarHBondContact O-N 3.35Å; T297-K300 PolarHBondContact O-N 3.1Å; T297-K300 WeakPolarHBondContact OG1-CB 3.37Å; T297-G301 PolarHBondContact N-O 3.29Å; T297-G301 PolarHBondContact O-N 3.4Å; T297-V303 HydrophobicContact CG2-CG2 3.83Å; T297-V303 WeakPolarHBondContact OG1-CG2 3.44Å; T297-A325 HydrophobicContact CG2-CB 3.62Å
298	H	83.2	Confident	86.4	Confident	144 Å²	144	53.4 Å²	53.4	67%	0.667	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	125.3	174	-67.3	-62	0	0	0	110.2	Q278 K300	Q278-H298 VanDerWaalsContact CD-CD2 3.45Å; Q278-H298 PolarHBondContact OE1-CD2 3.35Å; H298-K300 PolarHBondContact O-N 2.96Å
299	G	75.2	Confident	85.8	Confident	89 Å²	89	54.3 Å²	54.3	92%	0.918	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	-14.5	178.3	0	0	0	0	0	115.8	T297	T297-G299 PolarHBondContact O-N 3.35Å
300	K	74.2	Confident	85.5	Confident	176 Å²	176	55.3 Å²	55.3	77%	0.765	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-14.7	173.8	-57.2	-178.5	179	179.3	0	114	T297 H298 V303	T297-K300 PolarHBondContact O-N 3.1Å; T297-K300 WeakPolarHBondContact OG1-CB 3.37Å; H298-K300 PolarHBondContact O-N 2.96Å; K300-V303 HydrophobicContact CB-CG2 4.45Å
301	G	84.2	Confident	85.8	Confident	35 Å²	35	54.5 Å²	54.5	36%	0.361	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	72.1	-142	-176.4	0	0	0	0	0	111.5	V296 T297 V303	V296-G301 WeakPolarHBondContact CA-O 3.29Å; T297-G301 PolarHBondContact N-O 3.29Å; T297-G301 PolarHBondContact O-N 3.4Å; G301-V303 PolarHBondContact O-N 2.95Å
302	L	86.2	Confident	85.9	Confident	97 Å²	97	55 Å²	55	51%	0.508	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	116.5	176.7	179.4	65	0	0	0	110.3	N294 V296	N294-L302 HydrophobicContact CB-CD1 3.58Å; V296-L302 HydrophobicContact CG2-CD1 4.38Å
303	V	87.8	Confident	85.7	Confident	80 Å²	80	55.5 Å²	55.5	49%	0.485	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-47.8	-179.2	-178.8	0	0	0	0	111.1	V295 T297 K300 G301	V295-V303 PolarHBondContact O-N 3.22Å; T297-V303 HydrophobicContact CG2-CG2 3.83Å; T297-V303 WeakPolarHBondContact OG1-CG2 3.44Å; K300-V303 HydrophobicContact CB-CG2 4.45Å; G301-V303 PolarHBondContact O-N 2.95Å
304	T	87.1	Confident	85.2	Confident	70 Å²	70	59.4 Å²	59.4	43%	0.429	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	169.2	179.9	-167.4	0	0	0	0	110.7	V295 L306	V295-T304 HydrophobicContact CB-CG2 3.92Å; V295-T304 HydrophobicContact CG2-CG2 3.75Å; V295-T304 PolarHBondContact N-O 2.87Å; T304-L306 HydrophobicContact CG2-CD2 4.28Å
305	T	89.2	Confident	84.4	Confident	31 Å²	31	63.7 Å²	63.7	19%	0.19	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.1	173	-52.4	0	0	0	0	108.8	V293 N294	V293-T305 CarbonylContact O-C 3.49Å; V293-T305 WeakPolarHBondContact O-CA 3.3Å; V293-T305 WeakPolarHBondContact O-CG2 3.4Å; N294-T305 PolarHBondContact OD1-OG1 3.49Å
306	L	86.1	Confident	83.7	Confident	31 Å²	31	63 Å²	63	16%	0.162	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	145.9	176.7	-57	177.5	0	0	0	109.6	I288 S292 V293 V295 T304 D310 F312	I288-L306 HydrophobicContact CD1-CB 3.59Å; S292-L306 VanDerWaalsContact CA-O 3.27Å; S292-L306 WeakPolarHBondContact CA-O 3.45Å; S292-L306 VanDerWaalsContact CB-O 3.32Å; S292-L306 WeakPolarHBondContact CB-O 3.44Å; V293-L306 HydrophobicContact CG2-CB 3.93Å; V293-L306 HydrophobicContact CG2-CD1 4.44Å; V293-L306 PolarHBondContact N-O 3.21Å; V293-L306 PolarHBondContact O-N 2.8Å; V295-L306 HydrophobicContact CG2-CD1 3.83Å; V295-L306 HydrophobicContact CG2-CG 3.87Å; T304-L306 HydrophobicContact CG2-CD2 4.28Å; L306-D310 HydrophobicContact CB-CB 4.08Å; L306-D310 HydrophobicContact CD2-CB 4.41Å; L306-F312 HydrophobicContact CD1-CB 3.8Å; L306-F312 HydrophobicContact CD1-CD1 3.79Å; L306-F312 HydrophobicContact CD1-CG 4.13Å
307	H	87.4	Confident	83.4	Confident	88 Å²	88	61.3 Å²	61.3	41%	0.407	35%	0.352	S	S	.	.			trans	-125.4	177.6	-173.6	-55.9	84.2	0	0	0	111.3	I288 G309 D310	I288-H307 WeakPolarHBondContact CD1-O 3.35Å; H307-G309 PolarHBondContact O-N 3.4Å; H307-D310 PolarHBondContact N-OD2 3.4Å; H307-D310 VanDerWaalsContact O-CB 3.27Å; H307-D310 WeakPolarHBondContact O-CB 3.45Å; H307-D310 PolarHBondContact O-N 2.97Å
308	E	83.4	Confident	83	Confident	65 Å²	65	64.7 Å²	64.7	30%	0.304	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	129.1	176.4	-59.6	-171.8	171.6	0	0	112.8	K290 G291	K290-E308 VanDerWaalsContact CA-OE1 3.28Å; K290-E308 WeakPolarHBondContact CA-OE1 3.02Å; K290-E308 WeakPolarHBondContact CG-OE1 3.46Å; G291-E308 PolarHBondContact N-OE1 3.41Å; G291-E308 WeakPolarHBondContact O-CG 3.47Å; G291-E308 PolarHBondContact O-N 3.36Å
309	G	74.6	Confident	82.6	Confident	22 Å²	22	63.1 Å²	63.1	23%	0.227	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	-13.3	-177.8	0	0	0	0	0	115.4	A247 I288 H307	A247-G309 PolarHBondContact N-O 2.93Å; I288-G309 PolarHBondContact O-N 3.27Å; H307-G309 PolarHBondContact O-N 3.4Å
310	D	81.6	Confident	82.9	Confident	47 Å²	47	64.9 Å²	64.9	25%	0.251	36%	0.357	S	S	.	.			trans	-78.3	161.2	170.7	-63.6	-33.4	0	0	0	111.3	I288 L306 H307	I288-D310 HydrophobicContact CD1-CB 4.4Å; I288-D310 PolarHBondContact N-O 3.37Å; L306-D310 HydrophobicContact CB-CB 4.08Å; L306-D310 HydrophobicContact CD2-CB 4.41Å; H307-D310 PolarHBondContact N-OD2 3.4Å; H307-D310 VanDerWaalsContact O-CB 3.27Å; H307-D310 WeakPolarHBondContact O-CB 3.45Å; H307-D310 PolarHBondContact O-N 2.97Å
311	D	90	Very high	83.1	Confident	41 Å²	41	58.2 Å²	58.2	22%	0.219	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	159.7	176.7	74.7	-79	0	0	0	112.8	A247 W285 Y286 I287	A247-D311 HydrophobicContact CB-CB 3.68Å; W285-D311 HydrophobicContact CZ2-CB 4.19Å; W285-D311 PolarHBondContact NE1-OD2 3.43Å; Y286-D311 CarbonylContact O-C 3.58Å; Y286-D311 WeakPolarHBondContact O-CA 3.38Å; Y286-D311 WeakPolarHBondContact O-CB 3.33Å; I287-D311 HydrophobicContact CG1-CB 4.08Å
312	F	90.6	Very high	83.3	Confident	15 Å²	15	60.8 Å²	60.8	7%	0.066	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	162.1	179.1	59.3	-93.7	0	0	0	113.3	L275 F276 Y286 I288 V293 L306 I327 F336	L275-F312 HydrophobicContact CD2-CE2 3.65Å; L275-F312 HydrophobicContact CD2-CZ 3.56Å; F276-F312 AromaticContact CE1-CD2 3.92Å; F276-F312 HydrophobicContact CE1-CD2 3.92Å; F276-F312 AromaticContact CE1-CE2 3.74Å; F276-F312 HydrophobicContact CE1-CE2 3.74Å; F276-F312 AromaticContact CZ-CD2 3.84Å; F276-F312 HydrophobicContact CZ-CD2 3.84Å; F276-F312 HydrophobicContact CZ-CE2 4.08Å; Y286-F312 HydrophobicContact CD2-CD2 4.27Å; Y286-F312 AromaticContact CD2-CE2 3.72Å; Y286-F312 HydrophobicContact CD2-CE2 3.72Å; Y286-F312 HydrophobicContact CD2-CZ 4.42Å; Y286-F312 AromaticContact CG-CE2 3.77Å; Y286-F312 HydrophobicContact CG-CE2 3.77Å; Y286-F312 HydrophobicContact CG-CZ 4Å; Y286-F312 PolarHBondContact N-O 2.83Å; Y286-F312 PolarHBondContact O-N 3.17Å; I288-F312 HydrophobicContact CD1-CD1 4.23Å; I288-F312 HydrophobicContact CD1-CE1 3.94Å; I288-F312 HydrophobicContact CG1-CD1 4.2Å; I288-F312 HydrophobicContact CG1-CE1 3.69Å; V293-F312 HydrophobicContact CG2-CD1 4.3Å; V293-F312 HydrophobicContact CG2-CE1 3.9Å; V293-F312 HydrophobicContact CG2-CZ 4.48Å; L306-F312 HydrophobicContact CD1-CB 3.8Å; L306-F312 HydrophobicContact CD1-CD1 3.79Å; L306-F312 HydrophobicContact CD1-CG 4.13Å; F312-I327 HydrophobicContact CD2-CD1 4.22Å; F312-I327 HydrophobicContact CD2-CG1 3.89Å; F312-I327 HydrophobicContact CD2-CG2 4.47Å; F312-I327 HydrophobicContact CE2-CB 4.33Å; F312-I327 HydrophobicContact CE2-CG1 3.99Å; F312-I327 HydrophobicContact CE2-CG2 3.87Å; F312-I327 HydrophobicContact CG-CD1 4.46Å; F312-I327 HydrophobicContact CZ-CG2 3.89Å; F312-F336 HydrophobicContact CE1-CD1 4.3Å; F312-F336 HydrophobicContact CE1-CE1 4.15Å; F312-F336 HydrophobicContact CZ-CD1 4.16Å; F312-F336 HydrophobicContact CZ-CE1 4.07Å
313	G	86.1	Confident	83.5	Confident	18 Å²	18	56.5 Å²	56.5	19%	0.186	32%	0.322	C	S	.	.			trans	91.1	-1.6	174.2	0	0	0	0	0	115.5	L315 R323	G313-L315 PolarHBondContact O-N 3.29Å; G313-R323 VanDerWaalsContact CA-NH1 3.26Å; G313-R323 PolarHBondContact O-NH1 3.47Å
314	Q	83.4	Confident	83.3	Confident	81 Å²	81	56.2 Å²	56.2	38%	0.379	33%	0.328	S	S	.	.	H	α-helix	trans	-63	-38.1	179.2	58.3	-172.9	-2.9	0	0	114.2	W285 A316 L317 V318	W285-Q314 HydrophobicContact CG-CB 4.3Å; Q314-A316 VanDerWaalsContact C-N 3.29Å; Q314-A316 PolarHBondContact O-N 3.18Å; Q314-L317 WeakPolarHBondContact O-CB 3.47Å; Q314-L317 PolarHBondContact O-N 3.42Å; Q314-V318 PolarHBondContact O-N 3.24Å; Q314-V318 VanDerWaalsContact O-N 3.17Å
315	L	74.2	Confident	83.4	Confident	121 Å²	121	53.6 Å²	53.6	63%	0.634	31%	0.314	S	S	*	.	H	α-helix	trans	-57.7	-38.8	-174.4	-71.1	168.3	0	0	0	113.5	G313 L317 N319	G313-L315 PolarHBondContact O-N 3.29Å; L315-L317 VanDerWaalsContact C-N 3.29Å; L315-L317 PolarHBondContact O-N 3.1Å; L315-N319 WeakPolarHBondContact O-CB 3.29Å; L315-N319 PolarHBondContact O-N 3.05Å; L315-N319 VanDerWaalsContact O-N 3.12Å
316	A	78	Confident	83.6	Confident	6 Å²	6	53 Å²	53	5%	0.05	31%	0.31	C	S	.	.	H	α-helix	trans	-72.2	-24.7	-179.9	0	0	0	0	0	112.5	Q314 D320 A321	Q314-A316 VanDerWaalsContact C-N 3.29Å; Q314-A316 PolarHBondContact O-N 3.18Å; A316-D320 PolarHBondContact O-N 2.89Å; A316-A321 WeakPolarHBondContact CB-O 3.33Å; A316-A321 PolarHBondContact O-N 3.3Å
317	L	83.3	Confident	84.1	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-76.1	-46.4	175.5	-56.8	-170.8	0	0	0	111.2	G282 W285 Q314 L315 K341 F344	G282-L317 WeakPolarHBondContact O-CD2 3.48Å; W285-L317 HydrophobicContact CB-CD1 3.71Å; Q314-L317 WeakPolarHBondContact O-CB 3.47Å; Q314-L317 PolarHBondContact O-N 3.42Å; L315-L317 VanDerWaalsContact C-N 3.29Å; L315-L317 PolarHBondContact O-N 3.1Å; L317-K341 HydrophobicContact CD2-CB 3.9Å; L317-K341 HydrophobicContact CD2-CD 4.13Å; L317-K341 HydrophobicContact CD2-CG 4.01Å; L317-F344 HydrophobicContact CB-CD1 4.18Å; L317-F344 HydrophobicContact CB-CE1 4.24Å; L317-F344 HydrophobicContact CD1-CB 4.15Å; L317-F344 HydrophobicContact CD1-CD1 4.17Å; L317-F344 HydrophobicContact CD1-CD2 4.1Å; L317-F344 HydrophobicContact CD1-CG 3.88Å
318	V	76.6	Confident	84.5	Confident	97 Å²	97	49.7 Å²	49.7	59%	0.588	30%	0.295	S	S	*	.	H	α-helix	trans	-67.4	-45.4	-176.4	177	0	0	0	0	111.5	Q314 F344	Q314-V318 PolarHBondContact O-N 3.24Å; Q314-V318 VanDerWaalsContact O-N 3.17Å; V318-F344 HydrophobicContact CG2-CE1 4.06Å; V318-F344 HydrophobicContact CG2-CZ 4.04Å
319	N	75.9	Confident	85	Confident	111 Å²	111	46.7 Å²	46.7	59%	0.594	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	2.1	-173.9	-64.4	-23.4	0	0	0	113.9	L315 A321	L315-N319 WeakPolarHBondContact O-CB 3.29Å; L315-N319 PolarHBondContact O-N 3.05Å; L315-N319 VanDerWaalsContact O-N 3.12Å; N319-A321 HydrophobicContact CB-CB 4.02Å; N319-A321 PolarHBondContact O-N 3Å; N319-A321 VanDerWaalsContact O-N 3.12Å
320	D	80.9	Confident	85.8	Confident	126 Å²	126	52.3 Å²	52.3	67%	0.674	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.9	39.5	-169.3	-158.5	26.8	0	0	0	113.2	A316 K341	A316-D320 PolarHBondContact O-N 2.89Å; D320-K341 IonicContact OD1-NZ 3.66Å; D320-K341 PolarHBondContact OD1-NZ 2.98Å
321	A	79	Confident	86.3	Confident	36 Å²	36	54.1 Å²	54.1	30%	0.298	30%	0.303	S	S	.	.			trans	-108.6	158.9	-172.8	0	0	0	0	0	111.7	A316 N319	A316-A321 WeakPolarHBondContact CB-O 3.33Å; A316-A321 PolarHBondContact O-N 3.3Å; N319-A321 HydrophobicContact CB-CB 4.02Å; N319-A321 PolarHBondContact O-N 3Å; N319-A321 VanDerWaalsContact O-N 3.12Å
322	P	87.3	Confident	86.2	Confident	88 Å²	88	56.9 Å²	56.9	57%	0.571	32%	0.317	S	S	*	.	B	Isolated β-bridge	trans	-60.2	155.9	170	-22.4	33.8	0	0	0	112.9	D280 A324	D280-P322 CarbonylContact O-C 3.48Å; D280-P322 VanDerWaalsContact O-CA 3.31Å; D280-P322 WeakPolarHBondContact O-CA 3.46Å; P322-A324 PolarHBondContact O-N 2.87Å
323	R	91.3	Very high	86	Confident	7 Å²	7	59.9 Å²	59.9	3%	0.026	33%	0.334	C	S	.	.			trans	-57.9	128.8	175.1	-67	-61	-168.5	-171	3.5	110.5	F276 S277 Q278 G279 D280 S284 G313 A325	F276-R323 HydrophobicContact CD2-CB 4.13Å; F276-R323 HydrophobicContact CD2-CG 3.62Å; F276-R323 HydrophobicContact CE2-CB 4.28Å; F276-R323 HydrophobicContact CE2-CG 3.93Å; F276-R323 HydrophobicContact CG-CG 4.26Å; S277-R323 WeakPolarHBondContact O-CB 3.46Å; Q278-R323 WeakPolarHBondContact CA-O 3.35Å; Q278-R323 WeakPolarHBondContact CG-O 3.42Å; G279-R323 PolarHBondContact N-O 3.35Å; D280-R323 HydrophobicContact CB-CG 4.05Å; D280-R323 WeakPolarHBondContact O-CG 3.44Å; D280-R323 PolarHBondContact O-N 3.42Å; S284-R323 PolarHBondContact O-NH1 2.89Å; S284-R323 PolarHBondContact O-NH2 3.26Å; G313-R323 VanDerWaalsContact CA-NH1 3.26Å; G313-R323 PolarHBondContact O-NH1 3.47Å; R323-A325 VanDerWaalsContact C-N 3.34Å
324	A	82.9	Confident	86.2	Confident	74 Å²	74	59 Å²	59	61%	0.612	33%	0.325	S	S	*	.	S	Bend	trans	-79.6	-16	179.3	0	0	0	0	0	113.8	Q278 P322	Q278-A324 VanDerWaalsContact CD-O 3.24Å; Q278-A324 PolarHBondContact NE2-O 2.62Å; P322-A324 PolarHBondContact O-N 2.87Å
325	A	90.6	Very high	86.6	Confident	16 Å²	16	56.9 Å²	56.9	13%	0.132	32%	0.315	C	S	.	.	S	Bend	trans	-149.1	157.9	-177.3	0	0	0	0	0	111.2	F276 V295 V296 T297 R323	F276-A325 WeakPolarHBondContact CE2-O 3.49Å; V295-A325 HydrophobicContact CG1-CB 3.61Å; V296-A325 CarbonylContact O-C 3.59Å; V296-A325 WeakPolarHBondContact O-CA 3.4Å; V296-A325 WeakPolarHBondContact O-CB 3.25Å; T297-A325 HydrophobicContact CG2-CB 3.62Å; R323-A325 VanDerWaalsContact C-N 3.34Å
326	T	92.2	Very high	87.5	Confident	18 Å²	18	51.1 Å²	51.1	11%	0.11	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	135.4	169	-60	0	0	0	0	109.1	V274 F276 Q278 V296 I328	V274-T326 HydrophobicContact CG1-CG2 3.72Å; F276-T326 WeakPolarHBondContact O-CA 3.41Å; F276-T326 WeakPolarHBondContact O-CG2 3.25Å; Q278-T326 PolarHBondContact N-OG1 3.27Å; V296-T326 PolarHBondContact N-O 3.19Å; V296-T326 PolarHBondContact O-N 3.42Å; T326-I328 HydrophobicContact CG2-CD1 4.14Å; T326-I328 HydrophobicContact CG2-CG1 3.83Å
327	I	96.9	Very high	88.3	Confident	5 Å²	5	51 Å²	51	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.1	176.7	-59.7	-62.6	0	0	0	109.3	L275 F276 V293 V295 F312	L275-I327 HydrophobicContact CB-CB 4.29Å; L275-I327 HydrophobicContact CB-CG2 4.18Å; L275-I327 HydrophobicContact CD2-CG2 4.32Å; L275-I327 PolarHBondContact N-O 2.99Å; F276-I327 HydrophobicContact CD2-CG1 4.22Å; F276-I327 HydrophobicContact CE1-CB 4.43Å; F276-I327 HydrophobicContact CE1-CG1 3.97Å; F276-I327 HydrophobicContact CE2-CB 4.25Å; F276-I327 HydrophobicContact CE2-CG1 3.44Å; F276-I327 VanDerWaalsContact CE2-CG1 3.44Å; F276-I327 HydrophobicContact CZ-CB 4.17Å; F276-I327 HydrophobicContact CZ-CD1 4.43Å; F276-I327 HydrophobicContact CZ-CG1 3.3Å; F276-I327 PolarHBondContact O-N 2.94Å; V293-I327 HydrophobicContact CB-CG2 3.8Å; V293-I327 HydrophobicContact CG1-CG2 4.14Å; V293-I327 HydrophobicContact CG2-CG2 3.83Å; V295-I327 HydrophobicContact CB-CD1 4.19Å; V295-I327 HydrophobicContact CG1-CD1 4.09Å; V295-I327 HydrophobicContact CG2-CD1 3.74Å; F312-I327 HydrophobicContact CD2-CD1 4.22Å; F312-I327 HydrophobicContact CD2-CG1 3.89Å; F312-I327 HydrophobicContact CD2-CG2 4.47Å; F312-I327 HydrophobicContact CE2-CB 4.33Å; F312-I327 HydrophobicContact CE2-CG1 3.99Å; F312-I327 HydrophobicContact CE2-CG2 3.87Å; F312-I327 HydrophobicContact CG-CD1 4.46Å; F312-I327 HydrophobicContact CZ-CG2 3.89Å
328	I	94.7	Very high	88.8	Confident	44 Å²	44	53.6 Å²	53.6	23%	0.226	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	131.2	-176.6	-47.7	-176.6	0	0	0	109.1	G272 T273 V274 V293 N294 V296 T326 R330	G272-I328 WeakPolarHBondContact O-CG2 3.49Å; T273-I328 WeakPolarHBondContact O-CA 3.21Å; V274-I328 HydrophobicContact CG2-CD1 4.46Å; V274-I328 HydrophobicContact CG2-CG1 4.21Å; V293-I328 CarbonylContact C-O 3.57Å; V293-I328 WeakPolarHBondContact CA-O 3.48Å; N294-I328 PolarHBondContact N-O 3.36Å; N294-I328 PolarHBondContact O-N 3.46Å; V296-I328 HydrophobicContact CG2-CD1 4.07Å; V296-I328 HydrophobicContact CG2-CG1 4.46Å; T326-I328 HydrophobicContact CG2-CD1 4.14Å; T326-I328 HydrophobicContact CG2-CG1 3.83Å; I328-R330 PolarHBondContact O-N 3.42Å
329	L	95.6	Very high	89.7	Confident	3 Å²	3	49 Å²	49	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	133.8	176.2	-86.4	65.5	0	0	0	110.8	H268 G272 T273 L275 V293 C334 F336	H268-L329 HydrophobicContact CB-CD2 3.36Å; G272-L329 WeakPolarHBondContact CA-O 3.49Å; G272-L329 PolarHBondContact N-O 3.2Å; T273-L329 WeakPolarHBondContact O-CD1 3.46Å; T273-L329 PolarHBondContact O-N 3.07Å; L275-L329 HydrophobicContact CB-CD1 4.43Å; V293-L329 HydrophobicContact CG1-CD1 4.31Å; V293-L329 HydrophobicContact CG1-CG 4.41Å; L329-C334 HydrophobicContact CD2-CB 3.68Å; L329-C334 HydrophobicContact CG-CB 4.03Å; L329-F336 HydrophobicContact CD1-CE2 4.05Å; L329-F336 HydrophobicContact CD1-CZ 3.93Å; L329-F336 HydrophobicContact CD2-CE2 4.38Å; L329-F336 HydrophobicContact CG-CE2 4.36Å; L329-F336 HydrophobicContact CG-CZ 4.17Å
330	R	91.3	Very high	90.5	Very high	140 Å²	140	45.7 Å²	45.7	53%	0.528	25%	0.247	S	C	.	.			trans	-89.9	-31.3	-179.9	-179	177.5	176.4	85.9	7.6	112.2	S292 N294 I328	S292-R330 WeakPolarHBondContact O-CB 3.41Å; S292-R330 PolarHBondContact O-N 3.24Å; N294-R330 PolarHBondContact OD1-NH1 2.92Å; I328-R330 PolarHBondContact O-N 3.42Å
331	E	90.8	Very high	91	Very high	85 Å²	85	42.1 Å²	42.1	40%	0.397	23%	0.226	S	C	.	.	S	Bend	trans	-133.6	169.7	-177.1	65.4	-163.1	130.1	0	0	112.1	A271 G291 S292 C334	A271-E331 WeakPolarHBondContact CA-O 3.28Å; G291-E331 WeakPolarHBondContact CA-OE1 3.38Å; S292-E331 VanDerWaalsContact CB-OE1 3.26Å; S292-E331 WeakPolarHBondContact CB-OE1 3.29Å; S292-E331 PolarHBondContact N-OE1 3.08Å; S292-E331 PolarHBondContact OG-OE1 2.76Å; E331-C334 PolarHBondContact O-SG 2.97Å; E331-C334 VanDerWaalsContact O-SG 3.4Å
332	D	88.8	Confident	91.6	Very high	98 Å²	98	48.4 Å²	48.4	52%	0.524	25%	0.249	S	C	.	.	S	Bend	trans	-74.9	157.1	176.7	-71.8	-23.2	0	0	0	111	S269 K270 A271 C334	S269-D332 WeakPolarHBondContact O-CA 3.4Å; S269-D332 WeakPolarHBondContact O-CB 3.27Å; K270-D332 WeakPolarHBondContact CA-OD1 3.02Å; A271-D332 WeakPolarHBondContact CB-OD1 3.43Å; A271-D332 PolarHBondContact N-OD1 2.64Å; D332-C334 PolarHBondContact O-N 3.36Å
333	N	86.8	Confident	91.7	Very high	79 Å²	79	45.9 Å²	45.9	42%	0.422	23%	0.23	S	C	.	.	S	Bend	trans	56.5	37.7	175.4	-58.3	-46.5	0	0	0	115.9	H268 S269 H335	H268-N333 CarbonylContact O-C 3.55Å; H268-N333 WeakPolarHBondContact O-CA 3.28Å; H268-N333 PolarHBondContact O-N 3.47Å; S269-N333 PolarHBondContact O-N 2.91Å; N333-H335 PolarHBondContact O-CE1 3.09Å; N333-H335 VanDerWaalsContact O-CE1 3.3Å; N333-H335 PolarHBondContact O-ND1 3.14Å
334	C	89.9	Confident	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	144.7	170.9	-63.2	0	0	0	0	111.8	H268 K290 L329 E331 D332 F336	H268-C334 PolarHBondContact N-O 3Å; H268-C334 PolarHBondContact O-N 3.44Å; K290-C334 CarbonylContact O-C 3.59Å; K290-C334 VanDerWaalsContact O-CA 3.29Å; K290-C334 WeakPolarHBondContact O-CA 3.49Å; L329-C334 HydrophobicContact CD2-CB 3.68Å; L329-C334 HydrophobicContact CG-CB 4.03Å; E331-C334 PolarHBondContact O-SG 2.97Å; E331-C334 VanDerWaalsContact O-SG 3.4Å; D332-C334 PolarHBondContact O-N 3.36Å; C334-F336 HydrophobicContact CB-CE2 3.76Å; C334-F336 HydrophobicContact CB-CZ 3.71Å
335	H	92	Very high	91.5	Very high	36 Å²	36	46.5 Å²	46.5	17%	0.167	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.4	177.6	-58.4	-19.3	0	0	0	109.5	F265 W289 K290 N333	F265-H335 HydrophobicContact CE2-CB 3.92Å; F265-H335 HydrophobicContact CZ-CB 3.83Å; F265-H335 AromaticContact CZ-CD2 3.86Å; F265-H335 AromaticContact CZ-CG 3.69Å; W289-H335 WeakPolarHBondContact CA-O 3.35Å; W289-H335 HydrophobicContact CB-CB 4.12Å; W289-H335 WeakPolarHBondContact CB-O 3.29Å; W289-H335 HydrophobicContact CG-CB 4.47Å; W289-H335 PolarHBondContact N-O 3.45Å; K290-H335 HydrophobicContact CB-CB 3.85Å; K290-H335 PolarHBondContact N-O 3.27Å; K290-H335 PolarHBondContact O-N 3.24Å; N333-H335 PolarHBondContact O-CE1 3.09Å; N333-H335 VanDerWaalsContact O-CE1 3.3Å; N333-H335 PolarHBondContact O-ND1 3.14Å
336	F	93.6	Very high	91.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.3	179.8	-52.8	-83.1	0	0	0	111.2	E266 H268 L275 Y286 I287 I288 V293 F312 L329 C334	E266-F336 HydrophobicContact CB-CB 4.49Å; E266-F336 PolarHBondContact N-O 3Å; E266-F336 PolarHBondContact O-N 3.3Å; H268-F336 AromaticContact CD2-CD2 3.78Å; H268-F336 AromaticContact CD2-CE2 3.74Å; L275-F336 HydrophobicContact CD1-CE2 4.47Å; Y286-F336 HydrophobicContact CD1-CB 4.07Å; Y286-F336 HydrophobicContact CD1-CG 4.48Å; I287-F336 CarbonylContact O-C 3.5Å; I287-F336 VanDerWaalsContact O-CA 3.29Å; I287-F336 WeakPolarHBondContact O-CA 3.48Å; I288-F336 HydrophobicContact CG1-CD1 4.14Å; I288-F336 HydrophobicContact CG1-CE1 4.02Å; I288-F336 HydrophobicContact CG2-CE1 4.36Å; V293-F336 HydrophobicContact CG1-CE1 3.62Å; V293-F336 HydrophobicContact CG1-CZ 3.54Å; F312-F336 HydrophobicContact CE1-CD1 4.3Å; F312-F336 HydrophobicContact CE1-CE1 4.15Å; F312-F336 HydrophobicContact CZ-CD1 4.16Å; F312-F336 HydrophobicContact CZ-CE1 4.07Å; L329-F336 HydrophobicContact CD1-CE2 4.05Å; L329-F336 HydrophobicContact CD1-CZ 3.93Å; L329-F336 HydrophobicContact CD2-CE2 4.38Å; L329-F336 HydrophobicContact CG-CE2 4.36Å; L329-F336 HydrophobicContact CG-CZ 4.17Å; C334-F336 HydrophobicContact CB-CE2 3.76Å; C334-F336 HydrophobicContact CB-CZ 3.71Å
337	L	93.2	Very high	91	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.4	160.9	-49.9	178.7	0	0	0	108.1	L223 I245 L263 L264 F265 Y286 I287 W289	L223-L337 HydrophobicContact CD1-CD2 3.96Å; L223-L337 HydrophobicContact CD2-CD2 3.93Å; L223-L337 HydrophobicContact CG-CD2 4.49Å; I245-L337 HydrophobicContact CD1-CD1 3.94Å; L263-L337 HydrophobicContact CD2-CB 3.85Å; L264-L337 CarbonylContact O-C 3.57Å; L264-L337 WeakPolarHBondContact O-CA 3.31Å; F265-L337 HydrophobicContact CD2-CD2 4.11Å; Y286-L337 CarbonylContact C-O 3.57Å; Y286-L337 WeakPolarHBondContact CA-O 3.34Å; I287-L337 HydrophobicContact CB-CB 4.26Å; I287-L337 PolarHBondContact N-O 3.29Å; I287-L337 PolarHBondContact O-N 2.84Å; W289-L337 HydrophobicContact CB-CD2 4.5Å; W289-L337 HydrophobicContact CB-CG 4.27Å; W289-L337 HydrophobicContact CE3-CD1 3.95Å; W289-L337 HydrophobicContact CE3-CG 4.35Å; W289-L337 HydrophobicContact CZ3-CD1 4.45Å
338	R	95.1	Very high	90	Very high	61 Å²	61	53.8 Å²	53.8	23%	0.23	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.2	-174.9	-171.7	-176.8	87.2	-167.3	8.9	111.1	L264 E266 S284 W285 Y286 D340	L264-R338 HydrophobicContact CB-CB 4.3Å; L264-R338 PolarHBondContact N-O 2.92Å; L264-R338 PolarHBondContact O-N 3.27Å; E266-R338 WeakPolarHBondContact OE2-CD 3.45Å; E266-R338 IonicContact OE2-CZ 3.22Å; E266-R338 IonicContact OE2-NE 3.32Å; E266-R338 IonicContact OE2-NH1 3.58Å; E266-R338 PolarHBondContact OE2-NH1 3.04Å; S284-R338 VanDerWaalsContact CB-CG 3.5Å; W285-R338 CarbonylContact O-C 3.58Å; W285-R338 WeakPolarHBondContact O-CA 3.38Å; Y286-R338 HydrophobicContact CD1-CB 4.03Å; Y286-R338 HydrophobicContact CD1-CG 3.92Å; Y286-R338 HydrophobicContact CE1-CB 4.03Å; Y286-R338 VanDerWaalsContact CE1-CD 3.47Å; Y286-R338 HydrophobicContact CE1-CG 3.6Å; R338-D340 IonicContact CZ-OD1 3.79Å; R338-D340 VanDerWaalsContact CZ-OD1 3.32Å; R338-D340 IonicContact CZ-OD2 3.53Å; R338-D340 IonicContact NE-OD1 3.8Å; R338-D340 PolarHBondContact NE-OD1 3.42Å; R338-D340 IonicContact NE-OD2 3.67Å; R338-D340 IonicContact NH2-OD1 2.93Å; R338-D340 PolarHBondContact NH2-OD1 2.95Å; R338-D340 IonicContact NH2-OD2 2.7Å; R338-D340 PolarHBondContact NH2-OD2 3.33Å
339	V	94.3	Very high	89.1	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.9	168.1	-173.8	0	0	0	0	108.4	L259 V262 L263 S284 W285 D343 F344	L259-V339 HydrophobicContact CD2-CG1 4.42Å; L259-V339 HydrophobicContact CD2-CG2 3.78Å; V262-V339 HydrophobicContact CG2-CG1 4.2Å; L263-V339 HydrophobicContact CD2-CG2 3.47Å; L263-V339 VanDerWaalsContact CD2-CG2 3.47Å; L263-V339 HydrophobicContact CG-CG2 4.27Å; S284-V339 CarbonylContact C-O 3.54Å; S284-V339 VanDerWaalsContact CA-O 3.27Å; S284-V339 WeakPolarHBondContact CA-O 3.45Å; S284-V339 WeakPolarHBondContact CB-O 3.47Å; W285-V339 HydrophobicContact CE3-CB 4.01Å; W285-V339 HydrophobicContact CE3-CG2 3.73Å; W285-V339 HydrophobicContact CZ3-CG2 4.03Å; W285-V339 PolarHBondContact N-O 2.9Å; W285-V339 PolarHBondContact O-N 3.05Å; V339-D343 HydrophobicContact CG1-CB 4.25Å; V339-F344 HydrophobicContact CG1-CB 4.09Å
340	D	94.1	Very high	88.1	Confident	40 Å²	40	60.8 Å²	60.8	21%	0.214	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	152.1	179.8	-71.2	-20.9	0	0	0	111.5	L264 S284 R338 Q342 D343 F344	L264-D340 WeakPolarHBondContact CD1-OD2 3.41Å; S284-D340 PolarHBondContact OG-OD1 3.28Å; R338-D340 IonicContact CZ-OD1 3.79Å; R338-D340 VanDerWaalsContact CZ-OD1 3.32Å; R338-D340 IonicContact CZ-OD2 3.53Å; R338-D340 IonicContact NE-OD1 3.8Å; R338-D340 PolarHBondContact NE-OD1 3.42Å; R338-D340 IonicContact NE-OD2 3.67Å; R338-D340 IonicContact NH2-OD1 2.93Å; R338-D340 PolarHBondContact NH2-OD1 2.95Å; R338-D340 IonicContact NH2-OD2 2.7Å; R338-D340 PolarHBondContact NH2-OD2 3.33Å; D340-Q342 PolarHBondContact O-N 3.45Å; D340-Q342 VanDerWaalsContact O-N 3.13Å; D340-D343 PolarHBondContact O-N 3.33Å; D340-F344 WeakPolarHBondContact O-CB 3.34Å; D340-F344 PolarHBondContact O-N 2.89Å
341	K	91.1	Very high	87.2	Confident	52 Å²	52	55.5 Å²	55.5	23%	0.226	27%	0.265	C	S	.	.	H	α-helix	trans	-54.2	-36.9	-173.7	-175.3	172.5	-173	172.2	0	113.7	G282 T283 L317 D320 N345	G282-K341 WeakPolarHBondContact O-CD 3.19Å; T283-K341 VanDerWaalsContact O-CB 3.26Å; T283-K341 WeakPolarHBondContact O-CB 3.3Å; T283-K341 PolarHBondContact O-N 2.98Å; L317-K341 HydrophobicContact CD2-CB 3.9Å; L317-K341 HydrophobicContact CD2-CD 4.13Å; L317-K341 HydrophobicContact CD2-CG 4.01Å; D320-K341 IonicContact OD1-NZ 3.66Å; D320-K341 PolarHBondContact OD1-NZ 2.98Å; K341-N345 VanDerWaalsContact O-CB 3.3Å; K341-N345 WeakPolarHBondContact O-CB 3.49Å; K341-N345 VanDerWaalsContact O-CG 3.24Å; K341-N345 PolarHBondContact O-N 3.4Å; K341-N345 PolarHBondContact O-ND2 2.75Å
342	Q	90.4	Very high	86.1	Confident	168 Å²	168	57.9 Å²	57.9	79%	0.785	28%	0.275	S	S	*	.	H	α-helix	trans	-66.4	-46.7	179.3	-66.9	-176	8.1	0	0	111.1	D340 R346	D340-Q342 PolarHBondContact O-N 3.45Å; D340-Q342 VanDerWaalsContact O-N 3.13Å; Q342-R346 VanDerWaalsContact O-CB 3.3Å; Q342-R346 WeakPolarHBondContact O-CB 3.39Å; Q342-R346 PolarHBondContact O-N 3.27Å
343	D	90.9	Very high	85.3	Confident	34 Å²	34	56.7 Å²	56.7	18%	0.182	28%	0.279	C	S	.	.	H	α-helix	trans	-68	-41.5	176.6	-66.3	-55.4	0	0	0	111.1	V262 V339 D340 N345 R346 I347	V262-D343 HydrophobicContact CB-CB 4.07Å; V262-D343 HydrophobicContact CG1-CB 4.21Å; V262-D343 HydrophobicContact CG2-CB 4.14Å; V339-D343 HydrophobicContact CG1-CB 4.25Å; D340-D343 PolarHBondContact O-N 3.33Å; D343-N345 PolarHBondContact O-N 3.44Å; D343-R346 PolarHBondContact O-N 2.93Å; D343-R346 IonicContact OD1-CZ 2.94Å; D343-R346 IonicContact OD1-NH1 2.79Å; D343-R346 PolarHBondContact OD1-NH1 2.86Å; D343-R346 IonicContact OD1-NH2 3.33Å; D343-R346 PolarHBondContact OD1-NH2 3.36Å; D343-I347 WeakPolarHBondContact O-CB 3.3Å; D343-I347 WeakPolarHBondContact O-CG1 3.17Å; D343-I347 PolarHBondContact O-N 3.34Å
344	F	86.9	Confident	84.6	Confident	32 Å²	32	54.5 Å²	54.5	14%	0.14	27%	0.266	C	S	.	.	H	α-helix	trans	-54.5	-53.5	174	-176.9	-89.6	0	0	0	110.9	W285 L317 V318 V339 D340 R346 I347 I348	W285-F344 HydrophobicContact CE3-CD2 4.41Å; L317-F344 HydrophobicContact CB-CD1 4.18Å; L317-F344 HydrophobicContact CB-CE1 4.24Å; L317-F344 HydrophobicContact CD1-CB 4.15Å; L317-F344 HydrophobicContact CD1-CD1 4.17Å; L317-F344 HydrophobicContact CD1-CD2 4.1Å; L317-F344 HydrophobicContact CD1-CG 3.88Å; V318-F344 HydrophobicContact CG2-CE1 4.06Å; V318-F344 HydrophobicContact CG2-CZ 4.04Å; V339-F344 HydrophobicContact CG1-CB 4.09Å; D340-F344 WeakPolarHBondContact O-CB 3.34Å; D340-F344 PolarHBondContact O-N 2.89Å; F344-R346 VanDerWaalsContact C-N 3.35Å; F344-R346 PolarHBondContact O-N 3.28Å; F344-I347 PolarHBondContact O-N 2.99Å; F344-I348 HydrophobicContact CD1-CG1 4.43Å; F344-I348 HydrophobicContact CE1-CG1 4.17Å; F344-I348 HydrophobicContact CZ-CG1 4.49Å; F344-I348 WeakPolarHBondContact O-CG1 3.48Å; F344-I348 PolarHBondContact O-N 3.43Å
345	N	83.3	Confident	84	Confident	62 Å²	62	56.3 Å²	56.3	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-66	-35.5	178.8	-72.3	-18	0	0	0	112.6	K341 D343 K349	K341-N345 VanDerWaalsContact O-CB 3.3Å; K341-N345 WeakPolarHBondContact O-CB 3.49Å; K341-N345 VanDerWaalsContact O-CG 3.24Å; K341-N345 PolarHBondContact O-N 3.4Å; K341-N345 PolarHBondContact O-ND2 2.75Å; D343-N345 PolarHBondContact O-N 3.44Å; N345-K349 WeakPolarHBondContact O-CB 3.45Å; N345-K349 VanDerWaalsContact O-CG 3.25Å; N345-K349 WeakPolarHBondContact O-CG 3.31Å; N345-K349 PolarHBondContact O-N 2.93Å
346	R	88.1	Confident	83.4	Confident	106 Å²	106	58.6 Å²	58.6	40%	0.4	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-48	175.1	-176.4	-178.5	72.8	-127.3	-6.3	110.5	Q342 D343 F344 I348 K349 D350	Q342-R346 VanDerWaalsContact O-CB 3.3Å; Q342-R346 WeakPolarHBondContact O-CB 3.39Å; Q342-R346 PolarHBondContact O-N 3.27Å; D343-R346 PolarHBondContact O-N 2.93Å; D343-R346 IonicContact OD1-CZ 2.94Å; D343-R346 IonicContact OD1-NH1 2.79Å; D343-R346 PolarHBondContact OD1-NH1 2.86Å; D343-R346 IonicContact OD1-NH2 3.33Å; D343-R346 PolarHBondContact OD1-NH2 3.36Å; F344-R346 VanDerWaalsContact C-N 3.35Å; F344-R346 PolarHBondContact O-N 3.28Å; R346-I348 VanDerWaalsContact C-N 3.34Å; R346-I348 PolarHBondContact O-N 3.14Å; R346-K349 PolarHBondContact O-N 2.81Å; R346-D350 WeakPolarHBondContact CG-OD2 3.44Å; R346-D350 VanDerWaalsContact O-CB 3.31Å; R346-D350 WeakPolarHBondContact O-CB 3.43Å; R346-D350 VanDerWaalsContact O-CG 3.24Å; R346-D350 PolarHBondContact O-N 2.97Å
347	I	84.1	Confident	82.9	Confident	5 Å²	5	65.3 Å²	65.3	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-46.5	179.7	-68.9	172.4	0	0	0	110.3	V255 E258 L259 V262 D343 F344 K349 D350 V351	V255-I347 HydrophobicContact CG1-CG2 4.2Å; E258-I347 HydrophobicContact CB-CD1 4.09Å; E258-I347 HydrophobicContact CB-CG1 3.95Å; E258-I347 HydrophobicContact CB-CG2 4.16Å; L259-I347 HydrophobicContact CD2-CD1 3.92Å; L259-I347 HydrophobicContact CG-CD1 4.42Å; V262-I347 HydrophobicContact CG1-CD1 4.35Å; V262-I347 HydrophobicContact CG2-CD1 3.54Å; D343-I347 WeakPolarHBondContact O-CB 3.3Å; D343-I347 WeakPolarHBondContact O-CG1 3.17Å; D343-I347 PolarHBondContact O-N 3.34Å; F344-I347 PolarHBondContact O-N 2.99Å; I347-K349 PolarHBondContact O-N 3.39Å; I347-D350 PolarHBondContact O-N 3.47Å; I347-V351 HydrophobicContact CG2-CG2 4.27Å; I347-V351 WeakPolarHBondContact O-CB 3.49Å; I347-V351 WeakPolarHBondContact O-CG2 3.45Å; I347-V351 PolarHBondContact O-N 2.96Å
348	I	75.8	Confident	82.4	Confident	81 Å²	81	68.8 Å²	68.8	42%	0.415	33%	0.332	S	S	.	.	H	α-helix	trans	-59.6	-47.5	176.7	-63.4	-61.8	0	0	0	111.1	F344 R346 D350 V351 E352	F344-I348 HydrophobicContact CD1-CG1 4.43Å; F344-I348 HydrophobicContact CE1-CG1 4.17Å; F344-I348 HydrophobicContact CZ-CG1 4.49Å; F344-I348 WeakPolarHBondContact O-CG1 3.48Å; F344-I348 PolarHBondContact O-N 3.43Å; R346-I348 VanDerWaalsContact C-N 3.34Å; R346-I348 PolarHBondContact O-N 3.14Å; I348-D350 PolarHBondContact O-N 2.77Å; I348-V351 PolarHBondContact O-N 3.19Å; I348-E352 PolarHBondContact O-N 3.28Å
349	K	74.8	Confident	82	Confident	140 Å²	140	71.8 Å²	71.8	61%	0.609	35%	0.349	S	S	*	.	H	α-helix	trans	-63.7	-40	177.8	-74.9	176.8	-179.6	-174.7	0	113.1	N345 R346 I347 V351 E352 A353	N345-K349 WeakPolarHBondContact O-CB 3.45Å; N345-K349 VanDerWaalsContact O-CG 3.25Å; N345-K349 WeakPolarHBondContact O-CG 3.31Å; N345-K349 PolarHBondContact O-N 2.93Å; R346-K349 PolarHBondContact O-N 2.81Å; I347-K349 PolarHBondContact O-N 3.39Å; K349-V351 VanDerWaalsContact C-N 3.35Å; K349-E352 PolarHBondContact O-N 3Å; K349-A353 WeakPolarHBondContact O-CB 3.36Å; K349-A353 PolarHBondContact O-N 2.85Å
350	D	75.8	Confident	81.5	Confident	55 Å²	55	75.7 Å²	75.7	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-69.4	-37.2	-179.9	-75.2	-11.8	0	0	0	110.7	R346 I347 I348 A353 K354	R346-D350 WeakPolarHBondContact CG-OD2 3.44Å; R346-D350 VanDerWaalsContact O-CB 3.31Å; R346-D350 WeakPolarHBondContact O-CB 3.43Å; R346-D350 VanDerWaalsContact O-CG 3.24Å; R346-D350 PolarHBondContact O-N 2.97Å; I347-D350 PolarHBondContact O-N 3.47Å; I348-D350 PolarHBondContact O-N 2.77Å; D350-A353 PolarHBondContact O-N 2.81Å; D350-K354 VanDerWaalsContact O-CB 3.3Å; D350-K354 WeakPolarHBondContact O-CB 3.44Å; D350-K354 WeakPolarHBondContact O-CD 3.32Å; D350-K354 WeakPolarHBondContact O-CG 3.27Å; D350-K354 PolarHBondContact O-N 3.49Å
351	V	70.7	Confident	81.1	Confident	29 Å²	29	82.9 Å²	82.9	18%	0.176	40%	0.399	C	S	.	.	H	α-helix	trans	-66.5	-47	173.4	172.5	0	0	0	0	110.1	V255 I347 I348 K349 A353 K354 T355	V255-V351 HydrophobicContact CG2-CG1 4.35Å; V255-V351 HydrophobicContact CG2-CG2 3.6Å; I347-V351 HydrophobicContact CG2-CG2 4.27Å; I347-V351 WeakPolarHBondContact O-CB 3.49Å; I347-V351 WeakPolarHBondContact O-CG2 3.45Å; I347-V351 PolarHBondContact O-N 2.96Å; I348-V351 PolarHBondContact O-N 3.19Å; K349-V351 VanDerWaalsContact C-N 3.35Å; V351-A353 VanDerWaalsContact C-N 3.33Å; V351-A353 PolarHBondContact O-N 2.99Å; V351-K354 CarbonylContact O-C 3.55Å; V351-K354 PolarHBondContact O-N 2.86Å; V351-T355 VanDerWaalsContact O-CB 3.28Å; V351-T355 WeakPolarHBondContact O-CB 3.29Å; V351-T355 PolarHBondContact O-N 3.41Å; V351-T355 PolarHBondContact O-OG1 2.93Å
352	E	68.5	Low	80.5	Confident	134 Å²	134	83.7 Å²	83.7	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-57.9	-44.5	172.5	-81	-176.2	149.1	0	0	111.7	I348 K349 K354 T355	I348-E352 PolarHBondContact O-N 3.28Å; K349-E352 PolarHBondContact O-N 3Å; E352-K354 VanDerWaalsContact C-N 3.3Å; E352-K354 PolarHBondContact O-N 2.82Å; E352-T355 PolarHBondContact O-N 3.02Å; E352-T355 VanDerWaalsContact O-N 3.08Å
353	A	71.6	Confident	80.1	Confident	73 Å²	73	83.1 Å²	83.1	60%	0.603	42%	0.417	S	S	*	.	H	α-helix	trans	-68.3	-27.4	179.4	0	0	0	0	0	113.6	K349 D350 V351	K349-A353 WeakPolarHBondContact O-CB 3.36Å; K349-A353 PolarHBondContact O-N 2.85Å; D350-A353 PolarHBondContact O-N 2.81Å; V351-A353 VanDerWaalsContact C-N 3.33Å; V351-A353 PolarHBondContact O-N 2.99Å
354	K	72.2	Confident	79.8	Confident	33 Å²	33	83.3 Å²	83.3	14%	0.143	42%	0.419	C	S	.	.	H	α-helix	trans	-84.1	-14.2	173.3	-71.2	166.3	-172.1	167.7	0	112	E258 D350 V351 E352 E369 R370	E258-K354 IonicContact OE1-NZ 2.74Å; E258-K354 PolarHBondContact OE1-NZ 2.89Å; D350-K354 VanDerWaalsContact O-CB 3.3Å; D350-K354 WeakPolarHBondContact O-CB 3.44Å; D350-K354 WeakPolarHBondContact O-CD 3.32Å; D350-K354 WeakPolarHBondContact O-CG 3.27Å; D350-K354 PolarHBondContact O-N 3.49Å; V351-K354 CarbonylContact O-C 3.55Å; V351-K354 PolarHBondContact O-N 2.86Å; E352-K354 VanDerWaalsContact C-N 3.3Å; E352-K354 PolarHBondContact O-N 2.82Å; K354-E369 WeakPolarHBondContact O-CA 3.27Å; K354-R370 PolarHBondContact O-N 3.17Å
355	T	77.9	Confident	79.9	Confident	39 Å²	39	82.5 Å²	82.5	24%	0.239	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.6	-177.3	-57.6	0	0	0	0	110.8	V351 E352 R357 V367 L368	V351-T355 VanDerWaalsContact O-CB 3.28Å; V351-T355 WeakPolarHBondContact O-CB 3.29Å; V351-T355 PolarHBondContact O-N 3.41Å; V351-T355 PolarHBondContact O-OG1 2.93Å; E352-T355 PolarHBondContact O-N 3.02Å; E352-T355 VanDerWaalsContact O-N 3.08Å; T355-R357 HydrophobicContact CG2-CG 4.22Å; T355-V367 HydrophobicContact CG2-CG1 3.49Å; T355-V367 VanDerWaalsContact CG2-CG1 3.49Å; T355-L368 CarbonylContact C-O 3.55Å; T355-L368 WeakPolarHBondContact CA-O 3.47Å
356	M	79.8	Confident	80	Confident	84 Å²	84	79.8 Å²	79.8	41%	0.414	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.9	170.8	175.7	-175.2	-124.7	0	0	108.3	V367 L368 Y388	M356-V367 WeakPolarHBondContact O-CA 3.5Å; M356-L368 HydrophobicContact CB-CB 4.28Å; M356-L368 PolarHBondContact N-O 2.88Å; M356-L368 PolarHBondContact O-N 3.48Å; M356-L368 HydrophobicContact SD-CD1 4.21Å; M356-Y388 HydrophobicContact CB-CD1 4.47Å; M356-Y388 HydrophobicContact CB-CE1 4.14Å
357	R	82.8	Confident	79.9	Confident	141 Å²	141	75.2 Å²	75.2	53%	0.532	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.8	175.1	-64.8	-178	172.3	-173.2	-8.8	108.6	T355 V364 V367	T355-R357 HydrophobicContact CG2-CG 4.22Å; R357-V364 HydrophobicContact CB-CG1 4.17Å; R357-V364 HydrophobicContact CG-CG1 4.42Å; R357-V367 HydrophobicContact CG-CG1 4.32Å; R357-V367 HydrophobicContact CG-CG2 4.28Å
358	L	83	Confident	79.9	Confident	74 Å²	74	75.5 Å²	75.5	39%	0.387	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.3	172.7	-70.9	157	0	0	0	108	V365 L366 L368	L358-V365 HydrophobicContact CB-CG2 4.5Å; L358-V365 WeakPolarHBondContact O-CG2 3.45Å; L358-V365 PolarHBondContact O-N 3.49Å; L358-L366 HydrophobicContact CB-CB 4.17Å; L358-L366 HydrophobicContact CD1-CB 4.08Å; L358-L366 HydrophobicContact CD1-CD2 3.81Å; L358-L366 HydrophobicContact CD1-CG 4.32Å; L358-L366 PolarHBondContact N-O 2.91Å; L358-L366 PolarHBondContact O-N 3.31Å; L358-L368 HydrophobicContact CD1-CD1 4.15Å
359	E	85.4	Confident	80.1	Confident	125 Å²	125	72.7 Å²	72.7	58%	0.584	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.5	-179.1	-66.5	-176.8	-177.8	0	0	111	K363 V364	E359-K363 CarbonylContact C-O 3.47Å; E359-K363 WeakPolarHBondContact CA-O 3.27Å; E359-V364 HydrophobicContact CG-CG2 3.94Å
360	E	83.9	Confident	80.4	Confident	82 Å²	82	70.6 Å²	70.6	38%	0.383	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.7	169.6	-69.7	-174	152.5	0	0	109	G362 K363 V365 K397	E360-G362 PolarHBondContact O-N 2.72Å; E360-G362 VanDerWaalsContact O-N 3.16Å; E360-K363 PolarHBondContact N-O 3.47Å; E360-K363 PolarHBondContact O-N 2.98Å; E360-V365 HydrophobicContact CB-CG1 3.97Å; E360-V365 HydrophobicContact CB-CG2 4.21Å; E360-V365 HydrophobicContact CG-CG1 4.47Å; E360-V365 HydrophobicContact CG-CG2 3.85Å; E360-K397 WeakPolarHBondContact OE1-CE 3.48Å; E360-K397 IonicContact OE1-NZ 2.63Å; E360-K397 PolarHBondContact OE1-NZ 3.39Å; E360-K397 WeakPolarHBondContact OE2-CE 3.41Å; E360-K397 IonicContact OE2-NZ 3.37Å
361	H	86.1	Confident	79.8	Confident	192 Å²	192	70.5 Å²	70.5	89%	0.889	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	35.9	-178.6	-49.9	-65.4	0	0	0	113.8	K363	H361-K363 VanDerWaalsContact C-N 3.28Å; H361-K363 PolarHBondContact O-N 2.73Å
362	G	78.1	Confident	79.1	Confident	68 Å²	68	72.9 Å²	72.9	70%	0.701	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	15.2	-179.8	0	0	0	0	0	114.7	E360	E360-G362 PolarHBondContact O-N 2.72Å; E360-G362 VanDerWaalsContact O-N 3.16Å
363	K	82.9	Confident	78.3	Confident	156 Å²	156	74.2 Å²	74.2	68%	0.678	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.5	172.6	-65.3	-176.7	-179.7	-179.5	0	109.9	E359 E360 H361 V365	E359-K363 CarbonylContact C-O 3.47Å; E359-K363 WeakPolarHBondContact CA-O 3.27Å; E360-K363 PolarHBondContact N-O 3.47Å; E360-K363 PolarHBondContact O-N 2.98Å; H361-K363 VanDerWaalsContact C-N 3.28Å; H361-K363 PolarHBondContact O-N 2.73Å; K363-V365 PolarHBondContact O-N 3.1Å
364	V	84.6	Confident	76.8	Confident	38 Å²	38	74.1 Å²	74.1	23%	0.23	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	125.3	171.3	-175.6	0	0	0	0	108.6	R357 E359 V367 L838	R357-V364 HydrophobicContact CB-CG1 4.17Å; R357-V364 HydrophobicContact CG-CG1 4.42Å; E359-V364 HydrophobicContact CG-CG2 3.94Å; V364-V367 HydrophobicContact CG1-CG2 3.71Å; V364-L838 HydrophobicContact CG1-CD1 4.03Å
365	V	87.7	Confident	74.8	Confident	16 Å²	16	77.8 Å²	77.8	10%	0.097	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	-20.2	-178.9	-65.4	0	0	0	0	113.2	L358 E360 K363 G393 T394 K397	L358-V365 HydrophobicContact CB-CG2 4.5Å; L358-V365 WeakPolarHBondContact O-CG2 3.45Å; L358-V365 PolarHBondContact O-N 3.49Å; E360-V365 HydrophobicContact CB-CG1 3.97Å; E360-V365 HydrophobicContact CB-CG2 4.21Å; E360-V365 HydrophobicContact CG-CG1 4.47Å; E360-V365 HydrophobicContact CG-CG2 3.85Å; K363-V365 PolarHBondContact O-N 3.1Å; V365-G393 CarbonylContact O-C 3.57Å; V365-G393 WeakPolarHBondContact O-CA 3.2Å; V365-T394 HydrophobicContact CB-CG2 4.29Å; V365-T394 HydrophobicContact CG1-CG2 4.43Å; V365-T394 PolarHBondContact O-N 3.15Å; V365-K397 HydrophobicContact CB-CG 3.96Å; V365-K397 HydrophobicContact CG2-CD 4.4Å; V365-K397 HydrophobicContact CG2-CG 3.87Å
366	L	87.3	Confident	72.6	Confident	4 Å²	4	78.7 Å²	78.7	2%	0.021	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	134.4	178.1	-167.2	65.3	0	0	0	110.3	L358 L368 V390 K397 I398 L401	L358-L366 HydrophobicContact CB-CB 4.17Å; L358-L366 HydrophobicContact CD1-CB 4.08Å; L358-L366 HydrophobicContact CD1-CD2 3.81Å; L358-L366 HydrophobicContact CD1-CG 4.32Å; L358-L366 PolarHBondContact N-O 2.91Å; L358-L366 PolarHBondContact O-N 3.31Å; L366-L368 HydrophobicContact CD1-CD2 4.5Å; L366-L368 HydrophobicContact CD2-CD2 4.06Å; L366-L368 HydrophobicContact CD2-CG 4.41Å; L366-L368 HydrophobicContact CG-CD2 3.96Å; L366-L368 HydrophobicContact CG-CG 4.28Å; L366-V390 HydrophobicContact CD1-CG1 3.96Å; L366-K397 HydrophobicContact CB-CB 4.27Å; L366-K397 HydrophobicContact CD1-CB 4.37Å; L366-K397 HydrophobicContact CD2-CB 4.47Å; L366-I398 HydrophobicContact CD1-CG1 4Å; L366-L401 HydrophobicContact CD2-CB 4.16Å; L366-L401 HydrophobicContact CD2-CD2 3.77Å; L366-L401 HydrophobicContact CD2-CG 4.5Å
367	V	84.8	Confident	70.8	Confident	11 Å²	11	81 Å²	81	7%	0.067	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122.5	177.7	-173.4	0	0	0	0	108.3	T355 M356 R357 V364 M391 S392 L838	T355-V367 HydrophobicContact CG2-CG1 3.49Å; T355-V367 VanDerWaalsContact CG2-CG1 3.49Å; M356-V367 WeakPolarHBondContact O-CA 3.5Å; R357-V367 HydrophobicContact CG-CG1 4.32Å; R357-V367 HydrophobicContact CG-CG2 4.28Å; V364-V367 HydrophobicContact CG1-CG2 3.71Å; V367-M391 HydrophobicContact CG1-CB 4.4Å; V367-M391 PolarHBondContact O-N 3.49Å; V367-S392 WeakPolarHBondContact CB-OG 3.33Å; V367-S392 WeakPolarHBondContact CG2-OG 3.46Å; V367-S392 PolarHBondContact N-O 2.91Å; V367-S392 PolarHBondContact O-N 3.26Å; V367-L838 HydrophobicContact CG2-CD1 4.01Å
368	L	83.5	Confident	68.4	Low	10 Å²	10	80 Å²	80	5%	0.052	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.1	-177.7	-57.3	178.8	0	0	0	109.7	T355 M356 L358 L366 Y388 T389 V390 L401	T355-L368 CarbonylContact C-O 3.55Å; T355-L368 WeakPolarHBondContact CA-O 3.47Å; M356-L368 HydrophobicContact CB-CB 4.28Å; M356-L368 PolarHBondContact N-O 2.88Å; M356-L368 PolarHBondContact O-N 3.48Å; M356-L368 HydrophobicContact SD-CD1 4.21Å; L358-L368 HydrophobicContact CD1-CD1 4.15Å; L366-L368 HydrophobicContact CD1-CD2 4.5Å; L366-L368 HydrophobicContact CD2-CD2 4.06Å; L366-L368 HydrophobicContact CD2-CG 4.41Å; L366-L368 HydrophobicContact CG-CD2 3.96Å; L366-L368 HydrophobicContact CG-CG 4.28Å; L368-Y388 HydrophobicContact CB-CD1 4.11Å; L368-Y388 HydrophobicContact CB-CG 4.44Å; L368-T389 CarbonylContact C-O 3.51Å; L368-T389 VanDerWaalsContact CA-O 3.32Å; L368-T389 WeakPolarHBondContact CA-O 3.39Å; L368-V390 HydrophobicContact CD2-CB 4.29Å; L368-V390 HydrophobicContact CD2-CG2 3.85Å; L368-L401 HydrophobicContact CD1-CD2 4.38Å; L368-L401 HydrophobicContact CD2-CD2 3.61Å
369	E	81.8	Confident	65.8	Low	22 Å²	22	86.7 Å²	86.7	10%	0.103	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132	173.8	-176.1	177.8	-145.5	0	0	110.4	S254 K354 A371 Y388 T389 M391	S254-E369 WeakPolarHBondContact CB-OE1 3.46Å; S254-E369 PolarHBondContact OG-OE1 3.34Å; K354-E369 WeakPolarHBondContact O-CA 3.27Å; E369-A371 PolarHBondContact O-N 3.46Å; E369-Y388 CarbonylContact O-C 3.37Å; E369-Y388 WeakPolarHBondContact O-CA 3.41Å; E369-T389 PolarHBondContact N-O 3.33Å; E369-T389 PolarHBondContact O-N 2.91Å; E369-T389 PolarHBondContact O-OG1 2.94Å; E369-M391 HydrophobicContact CB-CG 3.5Å; E369-M391 VanDerWaalsContact CB-CG 3.5Å; E369-M391 HydrophobicContact CB-SD 3.84Å; E369-M391 WeakPolarHBondContact OE2-CE 3.24Å
370	R	79.3	Confident	63.1	Low	97 Å²	97	85.9 Å²	85.9	37%	0.366	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.3	176.3	-169.4	173.3	66.1	-173.5	-1	110.2	K354 S372 Y388	K354-R370 PolarHBondContact O-N 3.17Å; R370-S372 PolarHBondContact O-N 3.27Å; R370-Y388 HydrophobicContact CB-CD1 3.97Å; R370-Y388 HydrophobicContact CB-CE1 3.73Å; R370-Y388 HydrophobicContact CG-CE1 4.28Å
371	A	64.7	Low	60.6	Low	52 Å²	52	87 Å²	87	43%	0.43	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-62.3	125.8	174.7	0	0	0	0	0	110.8	E369 Q373 R387	E369-A371 PolarHBondContact O-N 3.46Å; A371-Q373 PolarHBondContact O-N 2.89Å; A371-R387 WeakPolarHBondContact CB-O 3.33Å; A371-R387 PolarHBondContact N-O 2.97Å
372	S	55.1	Low	58	Low	80 Å²	80	83.2 Å²	83.2	56%	0.559	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-67.3	119.6	169.2	15	0	0	0	0	109	R370 G374	R370-S372 PolarHBondContact O-N 3.27Å; S372-G374 PolarHBondContact O-N 2.84Å; S372-G374 VanDerWaalsContact O-N 3.1Å
373	Q	51.4	Low	55.6	Low	162 Å²	162	86.1 Å²	86.1	76%	0.757	53%	0.525	S	S	*	.			trans	-65.2	110.7	167.5	-72.3	-174.3	3.6	0	0	107.5	A371 A375	A371-Q373 PolarHBondContact O-N 2.89Å; Q373-A375 PolarHBondContact O-N 3.24Å
374	G	40.3	Very low	53.3	Low	70 Å²	70	82.6 Å²	82.6	72%	0.722	53%	0.532	S	S	*	.			trans	-57.9	132.1	163.8	0	0	0	0	0	108.4	S372 G376	S372-G374 PolarHBondContact O-N 2.84Å; S372-G374 VanDerWaalsContact O-N 3.1Å; G374-G376 PolarHBondContact O-N 3.31Å
375	A	30.7	Very low	51.3	Low	110 Å²	110	87.4 Å²	87.4	91%	0.909	55%	0.547	S	S	*	.			trans	-69.9	67.4	176	0	0	0	0	0	110.5	Q373	Q373-A375 PolarHBondContact O-N 3.24Å
376	G	31.2	Very low	49.2	Very low	59 Å²	59	91.5 Å²	91.5	61%	0.608	57%	0.568	S	S	*	*			trans	-81.7	127.2	170.6	0	0	0	0	0	110.2	G374 S378	G374-G376 PolarHBondContact O-N 3.31Å; G376-S378 PolarHBondContact O-N 3.15Å; G376-S378 VanDerWaalsContact O-N 3.14Å
377	P	41.8	Very low	48.2	Very low	131 Å²	131	97.1 Å²	97.1	85%	0.851	59%	0.589	S	S	*	*	S	Bend	trans	-88.6	79.5	-175.5	34.6	-32.2	0	0	0	110.7
378	S	33.2	Very low	47.8	Very low	120 Å²	120	101.1 Å²	101.1	84%	0.839	60%	0.603	S	S	*	*	S	Bend	trans	-176.5	42.8	160.5	64.7	0	0	0	0	115.6	G376	G376-S378 PolarHBondContact O-N 3.15Å; G376-S378 VanDerWaalsContact O-N 3.14Å
379	R	29.3	Very low	47.8	Very low	215 Å²	215	102.9 Å²	102.9	81%	0.811	62%	0.615	S	S	*	*			trans	-158.2	130.3	160.5	-151	165.4	155.8	164.7	-6.4	111.3
380	P	28.5	Very low	48.1	Very low	108 Å²	108	102.1 Å²	102.1	70%	0.701	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-59.6	137.8	174.4	23.8	-30.9	0	0	0	109.3	T382	P380-T382 PolarHBondContact O-N 3.04Å; P380-T382 VanDerWaalsContact O-N 3.14Å
381	P	30.6	Very low	48.4	Very low	107 Å²	107	98.6 Å²	98.6	70%	0.695	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-61.3	119.5	178.6	24.3	-31.2	0	0	0	108.5	P383	P381-P383 WeakPolarHBondContact O-CD 3.42Å
382	T	31.1	Very low	49.6	Very low	112 Å²	112	96.7 Å²	96.7	69%	0.687	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-75.1	118.6	169.4	-22.5	0	0	0	0	106.6	P380 G384	P380-T382 PolarHBondContact O-N 3.04Å; P380-T382 VanDerWaalsContact O-N 3.14Å; T382-G384 PolarHBondContact O-N 3.42Å
383	P	28.1	Very low	51.3	Low	128 Å²	128	92.9 Å²	92.9	83%	0.831	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	127.2	-178.2	26.1	-30.9	0	0	0	109.4	P381	P381-P383 WeakPolarHBondContact O-CD 3.42Å
384	G	34.9	Very low	53.3	Low	82 Å²	82	86.9 Å²	86.9	85%	0.845	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.8	-6.3	159.8	0	0	0	0	0	119.6	T382	T382-G384 PolarHBondContact O-N 3.42Å
385	R	42.7	Very low	55.9	Low	140 Å²	140	84.5 Å²	84.5	53%	0.528	50%	0.502	S	S	.	.			trans	-113.3	75.9	176.9	-148	175.2	178.9	-167.4	-1.5	111	R387 D414	R385-R387 VanDerWaalsContact C-N 3.35Å; R385-R387 HydrophobicContact CB-CG 4.49Å; R385-R387 HydrophobicContact CG-CG 3.96Å; R385-R387 PolarHBondContact O-N 3.48Å; R385-D414 IonicContact CZ-OD1 3.61Å; R385-D414 IonicContact NH1-OD1 2.8Å; R385-D414 PolarHBondContact NH1-OD1 2.77Å; R385-D414 IonicContact NH2-OD1 3.45Å; R385-D414 PolarHBondContact NH2-OD1 3.14Å; R385-D414 IonicContact NH2-OD2 3.59Å
386	N	43.2	Very low	58.9	Low	102 Å²	102	83 Å²	83	55%	0.545	48%	0.477	S	S	.	.			trans	-60.5	100.9	161	-88	-9	0	0	0	107.1	Y388	N386-Y388 HydrophobicContact CB-CD2 4.48Å; N386-Y388 HydrophobicContact CB-CE2 3.92Å; N386-Y388 WeakPolarHBondContact O-CD2 3.26Å; N386-Y388 PolarHBondContact O-N 3.46Å
387	R	65.2	Low	61.7	Low	121 Å²	121	81.8 Å²	81.8	46%	0.457	46%	0.455	S	S	.	.			trans	-83.4	102.4	-174.7	-79.7	170.9	63.3	149.9	-12.6	109.4	A371 R385 P415	A371-R387 WeakPolarHBondContact CB-O 3.33Å; A371-R387 PolarHBondContact N-O 2.97Å; R385-R387 VanDerWaalsContact C-N 3.35Å; R385-R387 HydrophobicContact CB-CG 4.49Å; R385-R387 HydrophobicContact CG-CG 3.96Å; R385-R387 PolarHBondContact O-N 3.48Å; R387-P415 VanDerWaalsContact NH1-CG 3.25Å; R387-P415 VanDerWaalsContact NH2-CG 3.34Å
388	Y	76.9	Confident	64.1	Low	95 Å²	95	75.5 Å²	75.5	37%	0.373	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	146.6	167.9	-68.4	-84.9	0	0	0	110.2	M356 L368 E369 R370 N386	M356-Y388 HydrophobicContact CB-CD1 4.47Å; M356-Y388 HydrophobicContact CB-CE1 4.14Å; L368-Y388 HydrophobicContact CB-CD1 4.11Å; L368-Y388 HydrophobicContact CB-CG 4.44Å; E369-Y388 CarbonylContact O-C 3.37Å; E369-Y388 WeakPolarHBondContact O-CA 3.41Å; R370-Y388 HydrophobicContact CB-CD1 3.97Å; R370-Y388 HydrophobicContact CB-CE1 3.73Å; R370-Y388 HydrophobicContact CG-CE1 4.28Å; N386-Y388 HydrophobicContact CB-CD2 4.48Å; N386-Y388 HydrophobicContact CB-CE2 3.92Å; N386-Y388 WeakPolarHBondContact O-CD2 3.26Å; N386-Y388 PolarHBondContact O-N 3.46Å
389	T	83.6	Confident	67	Low	47 Å²	47	69.8 Å²	69.8	29%	0.288	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.4	173.8	62.5	0	0	0	0	109.2	L368 E369 M391	L368-T389 CarbonylContact C-O 3.51Å; L368-T389 VanDerWaalsContact CA-O 3.32Å; L368-T389 WeakPolarHBondContact CA-O 3.39Å; E369-T389 PolarHBondContact N-O 3.33Å; E369-T389 PolarHBondContact O-N 2.91Å; E369-T389 PolarHBondContact O-OG1 2.94Å; T389-M391 PolarHBondContact O-N 2.9Å
390	V	87.9	Confident	69.8	Low	6 Å²	6	62 Å²	62	4%	0.036	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	125.8	178.7	-174	0	0	0	0	109.5	L366 L368 I398 L401 F419 F841 R845	L366-V390 HydrophobicContact CD1-CG1 3.96Å; L368-V390 HydrophobicContact CD2-CB 4.29Å; L368-V390 HydrophobicContact CD2-CG2 3.85Å; V390-I398 HydrophobicContact CG1-CG1 4.18Å; V390-L401 HydrophobicContact CG2-CD2 3.55Å; V390-F419 HydrophobicContact CG2-CE1 4.24Å; V390-F419 HydrophobicContact CG2-CE2 4.02Å; V390-F419 HydrophobicContact CG2-CZ 3.65Å; V390-F841 HydrophobicContact CB-CB 4.38Å; V390-F841 HydrophobicContact CB-CD1 3.92Å; V390-F841 HydrophobicContact CB-CG 4.32Å; V390-F841 HydrophobicContact CG1-CB 3.79Å; V390-F841 HydrophobicContact CG1-CD1 4.14Å; V390-F841 HydrophobicContact CG1-CG 4.02Å; V390-R845 PolarHBondContact O-NH2 3.4Å
391	M	86.7	Confident	72.7	Confident	24 Å²	24	58.9 Å²	58.9	12%	0.118	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-52.8	175	-60.6	-51.9	-74	0	0	110.4	V367 E369 T389 F841 E842	V367-M391 HydrophobicContact CG1-CB 4.4Å; V367-M391 PolarHBondContact O-N 3.49Å; E369-M391 HydrophobicContact CB-CG 3.5Å; E369-M391 VanDerWaalsContact CB-CG 3.5Å; E369-M391 HydrophobicContact CB-SD 3.84Å; E369-M391 WeakPolarHBondContact OE2-CE 3.24Å; T389-M391 PolarHBondContact O-N 2.9Å; M391-F841 PolarHBondContact O-N 3.13Å; M391-E842 HydrophobicContact CE-CB 4.3Å; M391-E842 HydrophobicContact CE-CG 4.4Å; M391-E842 WeakPolarHBondContact CE-OE2 3.47Å; M391-E842 PolarHBondContact O-N 3.08Å
392	S	89.2	Confident	75.5	Confident	11 Å²	11	53.8 Å²	53.8	8%	0.077	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.7	173.3	63.3	0	0	0	0	112.4	V367 I839	V367-S392 WeakPolarHBondContact CB-OG 3.33Å; V367-S392 WeakPolarHBondContact CG2-OG 3.46Å; V367-S392 PolarHBondContact N-O 2.91Å; V367-S392 PolarHBondContact O-N 3.26Å; S392-I839 CarbonylContact C-O 3.53Å; S392-I839 WeakPolarHBondContact CA-O 3.49Å; S392-I839 VanDerWaalsContact CB-O 3.25Å; S392-I839 WeakPolarHBondContact CB-O 3.28Å
393	G	89.9	Confident	78.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	173.8	175.4	0	0	0	0	0	114	V365 I839	V365-G393 CarbonylContact O-C 3.57Å; V365-G393 WeakPolarHBondContact O-CA 3.2Å; G393-I839 PolarHBondContact N-O 3.43Å; G393-I839 VanDerWaalsContact N-O 3.13Å; G393-I839 VanDerWaalsContact O-CB 3.31Å; G393-I839 WeakPolarHBondContact O-CB 3.4Å; G393-I839 WeakPolarHBondContact O-CG1 3.36Å; G393-I839 PolarHBondContact O-N 3.49Å
394	T	94.3	Very high	80.8	Confident	37 Å²	37	47.4 Å²	47.4	23%	0.227	24%	0.242	C	C	.	.			trans	-72.1	150.3	169.1	62.3	0	0	0	0	110.2	V365 E396 K397 I398 L838	V365-T394 HydrophobicContact CB-CG2 4.29Å; V365-T394 HydrophobicContact CG1-CG2 4.43Å; V365-T394 PolarHBondContact O-N 3.15Å; T394-E396 PolarHBondContact O-N 3.07Å; T394-K397 PolarHBondContact O-N 2.95Å; T394-K397 VanDerWaalsContact O-N 3.14Å; T394-K397 WeakPolarHBondContact OG1-CB 3.49Å; T394-K397 WeakPolarHBondContact OG1-CG 3.35Å; T394-K397 PolarHBondContact OG1-N 3.5Å; T394-I398 VanDerWaalsContact O-CG1 3.31Å; T394-I398 WeakPolarHBondContact O-CG1 3.31Å; T394-I398 PolarHBondContact O-N 3.13Å; T394-L838 HydrophobicContact CG2-CD2 3.75Å
395	P	95.5	Very high	83	Confident	19 Å²	19	45.2 Å²	45.2	12%	0.123	22%	0.216	C	C	.	.	H	α-helix	trans	-50	-43.7	178.3	-28.8	36.4	0	0	0	113.4	L399 F430 M431 I839	P395-L399 PolarHBondContact O-N 3.27Å; P395-L399 VanDerWaalsContact O-N 3.13Å; P395-F430 HydrophobicContact CB-CD2 4.02Å; P395-F430 HydrophobicContact CB-CE2 4.46Å; P395-F430 HydrophobicContact CG-CD2 4.18Å; P395-F430 WeakPolarHBondContact CG-O 3.28Å; P395-M431 HydrophobicContact CB-CB 4.1Å; P395-M431 HydrophobicContact CB-CG 4.08Å; P395-M431 HydrophobicContact CB-SD 4.26Å; P395-I839 HydrophobicContact CG-CD1 4.43Å; P395-I839 HydrophobicContact CG-CG1 4.06Å
396	E	93.1	Very high	84.7	Confident	80 Å²	80	38.8 Å²	38.8	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-45.3	-179.8	-65.4	71.8	-158.5	0	0	111.8	T394 L399 E400 Q435	T394-E396 PolarHBondContact O-N 3.07Å; E396-L399 PolarHBondContact O-N 3.21Å; E396-E400 WeakPolarHBondContact O-CB 3.33Å; E396-E400 PolarHBondContact O-N 3.17Å; E396-Q435 PolarHBondContact OE1-NE2 3.37Å
397	K	90.8	Very high	85.8	Confident	32 Å²	32	35.1 Å²	35.1	14%	0.139	18%	0.179	C	C	.	.	H	α-helix	trans	-71.7	-32.2	-179.1	-75.7	-61.8	-179.4	-170.4	0	113.8	E360 V365 L366 T394 L399 E400 L401	E360-K397 WeakPolarHBondContact OE1-CE 3.48Å; E360-K397 IonicContact OE1-NZ 2.63Å; E360-K397 PolarHBondContact OE1-NZ 3.39Å; E360-K397 WeakPolarHBondContact OE2-CE 3.41Å; E360-K397 IonicContact OE2-NZ 3.37Å; V365-K397 HydrophobicContact CB-CG 3.96Å; V365-K397 HydrophobicContact CG2-CD 4.4Å; V365-K397 HydrophobicContact CG2-CG 3.87Å; L366-K397 HydrophobicContact CB-CB 4.27Å; L366-K397 HydrophobicContact CD1-CB 4.37Å; L366-K397 HydrophobicContact CD2-CB 4.47Å; T394-K397 PolarHBondContact O-N 2.95Å; T394-K397 VanDerWaalsContact O-N 3.14Å; T394-K397 WeakPolarHBondContact OG1-CB 3.49Å; T394-K397 WeakPolarHBondContact OG1-CG 3.35Å; T394-K397 PolarHBondContact OG1-N 3.5Å; K397-L399 VanDerWaalsContact C-N 3.35Å; K397-E400 WeakPolarHBondContact CD-OE2 3.44Å; K397-E400 WeakPolarHBondContact CE-OE2 3.24Å; K397-E400 IonicContact NZ-OE1 3.9Å; K397-E400 PolarHBondContact NZ-OE1 3.45Å; K397-E400 IonicContact NZ-OE2 3.45Å; K397-E400 PolarHBondContact NZ-OE2 3.07Å; K397-E400 PolarHBondContact O-N 3.46Å; K397-L401 WeakPolarHBondContact O-CB 3.49Å; K397-L401 PolarHBondContact O-N 2.9Å
398	I	92.4	Very high	85.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-44.3	171.9	-64.2	170.3	0	0	0	109.9	L366 V390 T394 L402 F419 F423 I839 F841	L366-I398 HydrophobicContact CD1-CG1 4Å; V390-I398 HydrophobicContact CG1-CG1 4.18Å; T394-I398 VanDerWaalsContact O-CG1 3.31Å; T394-I398 WeakPolarHBondContact O-CG1 3.31Å; T394-I398 PolarHBondContact O-N 3.13Å; I398-L402 WeakPolarHBondContact O-CB 3.47Å; I398-L402 PolarHBondContact O-N 2.81Å; I398-F419 HydrophobicContact CG2-CE2 4.21Å; I398-F419 HydrophobicContact CG2-CZ 4.17Å; I398-F423 HydrophobicContact CG2-CD2 3.83Å; I398-F423 HydrophobicContact CG2-CE2 4.07Å; I398-I839 HydrophobicContact CD1-CB 4.03Å; I398-I839 HydrophobicContact CD1-CG2 4.42Å; I398-F841 HydrophobicContact CD1-CB 4.43Å; I398-F841 HydrophobicContact CD1-CD2 4Å; I398-F841 HydrophobicContact CD1-CG 4.5Å; I398-F841 HydrophobicContact CG2-CD2 3.95Å; I398-F841 HydrophobicContact CG2-CE2 3.84Å; I398-F841 HydrophobicContact CG2-CZ 4.45Å
399	L	93.4	Very high	84.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-43.9	176.3	175.3	62.8	0	0	0	112.2	P395 E396 K397 L402 L403 F423 M431 L436 A439 L440 L470	P395-L399 PolarHBondContact O-N 3.27Å; P395-L399 VanDerWaalsContact O-N 3.13Å; E396-L399 PolarHBondContact O-N 3.21Å; K397-L399 VanDerWaalsContact C-N 3.35Å; L399-L402 WeakPolarHBondContact O-CB 3.44Å; L399-L402 PolarHBondContact O-N 3.17Å; L399-L403 HydrophobicContact CD1-CD1 4.32Å; L399-L403 HydrophobicContact CD1-CG 4.27Å; L399-L403 HydrophobicContact CG-CD1 4.29Å; L399-L403 WeakPolarHBondContact O-CG 3.28Å; L399-L403 PolarHBondContact O-N 3.26Å; L399-F423 HydrophobicContact CB-CE2 4.21Å; L399-F423 HydrophobicContact CB-CZ 4.09Å; L399-F423 HydrophobicContact CD1-CE1 4.14Å; L399-F423 HydrophobicContact CD1-CZ 3.89Å; L399-M431 HydrophobicContact CD2-CE 3.9Å; L399-M431 HydrophobicContact CD2-SD 4.31Å; L399-L436 HydrophobicContact CD1-CD1 4.25Å; L399-L436 HydrophobicContact CD2-CD1 4.05Å; L399-A439 HydrophobicContact CD2-CB 3.77Å; L399-L440 HydrophobicContact CD1-CD2 4.12Å; L399-L440 HydrophobicContact CD2-CD2 4.24Å; L399-L470 HydrophobicContact CD1-CD1 3.8Å
400	E	88.8	Confident	82.9	Confident	52 Å²	52	35.8 Å²	35.8	24%	0.243	20%	0.203	C	C	.	.	H	α-helix	trans	-59	-50.2	179	-174.8	177.8	165.1	0	0	111.2	E396 K397 L402 L403 E404	E396-E400 WeakPolarHBondContact O-CB 3.33Å; E396-E400 PolarHBondContact O-N 3.17Å; K397-E400 WeakPolarHBondContact CD-OE2 3.44Å; K397-E400 WeakPolarHBondContact CE-OE2 3.24Å; K397-E400 IonicContact NZ-OE1 3.9Å; K397-E400 PolarHBondContact NZ-OE1 3.45Å; K397-E400 IonicContact NZ-OE2 3.45Å; K397-E400 PolarHBondContact NZ-OE2 3.07Å; K397-E400 PolarHBondContact O-N 3.46Å; E400-L402 VanDerWaalsContact C-N 3.32Å; E400-L402 PolarHBondContact O-N 3.5Å; E400-L403 PolarHBondContact O-N 2.85Å; E400-E404 WeakPolarHBondContact O-CG 3.44Å; E400-E404 PolarHBondContact O-N 2.93Å
401	L	88.1	Confident	81.2	Confident	41 Å²	41	39.1 Å²	39.1	22%	0.215	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-38.2	177.1	-179.7	64.7	0	0	0	112.1	L366 L368 V390 K397 E404 A405 F419	L366-L401 HydrophobicContact CD2-CB 4.16Å; L366-L401 HydrophobicContact CD2-CD2 3.77Å; L366-L401 HydrophobicContact CD2-CG 4.5Å; L368-L401 HydrophobicContact CD1-CD2 4.38Å; L368-L401 HydrophobicContact CD2-CD2 3.61Å; V390-L401 HydrophobicContact CG2-CD2 3.55Å; K397-L401 WeakPolarHBondContact O-CB 3.49Å; K397-L401 PolarHBondContact O-N 2.9Å; L401-E404 PolarHBondContact O-N 3.33Å; L401-A405 VanDerWaalsContact O-CB 3.31Å; L401-A405 WeakPolarHBondContact O-CB 3.5Å; L401-A405 PolarHBondContact O-N 3.29Å; L401-F419 HydrophobicContact CG-CE1 4.47Å
402	L	89	Confident	79.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-48.3	175.3	174.6	62.9	0	0	0	111.1	I398 L399 E400 E404 A405 M406 F419 L420 F423 L470	I398-L402 WeakPolarHBondContact O-CB 3.47Å; I398-L402 PolarHBondContact O-N 2.81Å; L399-L402 WeakPolarHBondContact O-CB 3.44Å; L399-L402 PolarHBondContact O-N 3.17Å; E400-L402 VanDerWaalsContact C-N 3.32Å; E400-L402 PolarHBondContact O-N 3.5Å; L402-E404 VanDerWaalsContact C-N 3.32Å; L402-E404 PolarHBondContact O-N 2.85Å; L402-A405 PolarHBondContact O-N 2.6Å; L402-M406 HydrophobicContact CD1-SD 4.47Å; L402-M406 HydrophobicContact CG-SD 4.31Å; L402-M406 VanDerWaalsContact O-CG 3.27Å; L402-M406 WeakPolarHBondContact O-CG 3.48Å; L402-M406 PolarHBondContact O-N 3.08Å; L402-F419 HydrophobicContact CB-CD1 4.31Å; L402-F419 HydrophobicContact CB-CE1 3.7Å; L402-F419 HydrophobicContact CB-CZ 3.94Å; L402-F419 HydrophobicContact CD1-CB 4.39Å; L402-F419 HydrophobicContact CD1-CD1 3.53Å; L402-F419 HydrophobicContact CD1-CD2 4.5Å; L402-F419 HydrophobicContact CD1-CE1 3.84Å; L402-F419 HydrophobicContact CD1-CG 3.9Å; L402-F419 HydrophobicContact CD1-CZ 4.41Å; L402-F419 HydrophobicContact CG-CE1 4.38Å; L402-L420 HydrophobicContact CD1-CB 4.05Å; L402-L420 HydrophobicContact CD1-CD1 4.37Å; L402-L420 HydrophobicContact CD2-CD1 3.95Å; L402-L420 HydrophobicContact CG-CD1 4.49Å; L402-F423 HydrophobicContact CD2-CB 3.71Å; L402-F423 HydrophobicContact CD2-CD1 3.72Å; L402-F423 HydrophobicContact CD2-CD2 4.11Å; L402-F423 HydrophobicContact CD2-CE1 4.38Å; L402-F423 HydrophobicContact CD2-CG 3.57Å; L402-L470 HydrophobicContact CD2-CD1 3.77Å; L402-L470 HydrophobicContact CG-CD1 4.4Å
403	L	85.9	Confident	77.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-42.9	177.4	-69.3	172.4	0	0	0	111	L399 E400 A405 M406 H443 Q466 I467 L470	L399-L403 HydrophobicContact CD1-CD1 4.32Å; L399-L403 HydrophobicContact CD1-CG 4.27Å; L399-L403 HydrophobicContact CG-CD1 4.29Å; L399-L403 WeakPolarHBondContact O-CG 3.28Å; L399-L403 PolarHBondContact O-N 3.26Å; E400-L403 PolarHBondContact O-N 2.85Å; L403-A405 VanDerWaalsContact C-N 3.34Å; L403-A405 PolarHBondContact O-N 2.97Å; L403-M406 HydrophobicContact CD2-SD 4.49Å; L403-M406 PolarHBondContact O-N 3.27Å; L403-H443 HydrophobicContact CD1-CB 4.45Å; L403-Q466 HydrophobicContact CD2-CB 4.14Å; L403-Q466 PolarHBondContact O-NE2 2.99Å; L403-Q466 PolarHBondContact O-OE1 2.94Å; L403-Q466 VanDerWaalsContact O-OE1 3.09Å; L403-I467 HydrophobicContact CD1-CG1 4.2Å; L403-I467 HydrophobicContact CD2-CG1 4.01Å; L403-L470 HydrophobicContact CD2-CB 4.46Å; L403-L470 HydrophobicContact CD2-CD1 3.97Å
404	E	84.3	Confident	75.9	Confident	106 Å²	106	51.3 Å²	51.3	50%	0.495	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-36.5	177.2	-72.3	175.1	-179	0	0	113.4	E400 L401 L402 M406	E400-E404 WeakPolarHBondContact O-CG 3.44Å; E400-E404 PolarHBondContact O-N 2.93Å; L401-E404 PolarHBondContact O-N 3.33Å; L402-E404 VanDerWaalsContact C-N 3.32Å; L402-E404 PolarHBondContact O-N 2.85Å; E404-M406 VanDerWaalsContact C-N 3.28Å; E404-M406 PolarHBondContact O-N 3.39Å
405	A	81.9	Confident	74.2	Confident	37 Å²	37	51.2 Å²	51.2	31%	0.306	30%	0.298	S	S	.	.	H	α-helix	trans	-70.1	-24.2	178.9	0	0	0	0	0	112.9	L401 L402 L403 G407 T416	L401-A405 VanDerWaalsContact O-CB 3.31Å; L401-A405 WeakPolarHBondContact O-CB 3.5Å; L401-A405 PolarHBondContact O-N 3.29Å; L402-A405 PolarHBondContact O-N 2.6Å; L403-A405 VanDerWaalsContact C-N 3.34Å; L403-A405 PolarHBondContact O-N 2.97Å; A405-G407 PolarHBondContact O-N 3.11Å; A405-T416 HydrophobicContact CB-CG2 3.9Å; A405-T416 WeakPolarHBondContact O-CG2 3.36Å
406	M	78.3	Confident	72.9	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.02	29%	0.294	C	S	.	.			trans	-72.4	87.5	180	-70	170.3	70.3	0	0	111.3	L402 L403 E404 T416 L420 Q466 R469 L470	L402-M406 HydrophobicContact CD1-SD 4.47Å; L402-M406 HydrophobicContact CG-SD 4.31Å; L402-M406 VanDerWaalsContact O-CG 3.27Å; L402-M406 WeakPolarHBondContact O-CG 3.48Å; L402-M406 PolarHBondContact O-N 3.08Å; L403-M406 HydrophobicContact CD2-SD 4.49Å; L403-M406 PolarHBondContact O-N 3.27Å; E404-M406 VanDerWaalsContact C-N 3.28Å; E404-M406 PolarHBondContact O-N 3.39Å; M406-T416 HydrophobicContact CB-CG2 4.48Å; M406-T416 HydrophobicContact CG-CG2 3.85Å; M406-L420 HydrophobicContact CE-CD2 4.16Å; M406-L420 HydrophobicContact SD-CD1 4.37Å; M406-Q466 HydrophobicContact CB-CB 4.44Å; M406-Q466 HydrophobicContact CB-CG 4.05Å; M406-Q466 WeakPolarHBondContact CE-O 3.18Å; M406-Q466 WeakPolarHBondContact O-CG 3.42Å; M406-Q466 PolarHBondContact O-NE2 2.96Å; M406-R469 HydrophobicContact CE-CB 3.63Å; M406-R469 HydrophobicContact CE-CG 3.51Å; M406-L470 HydrophobicContact CE-CB 4.15Å; M406-L470 HydrophobicContact SD-CB 4.34Å
407	G	66.3	Low	72.1	Confident	25 Å²	25	48.9 Å²	48.9	26%	0.258	29%	0.286	S	S	.	.			trans	-74	154	174.7	0	0	0	0	0	113.3	A405 D409 S410 R469	A405-G407 PolarHBondContact O-N 3.11Å; G407-D409 VanDerWaalsContact C-N 3.27Å; G407-D409 PolarHBondContact O-N 3.04Å; G407-S410 PolarHBondContact N-OG 3.29Å; G407-S410 PolarHBondContact O-N 3.39Å; G407-S410 PolarHBondContact O-OG 3.3Å; G407-R469 PolarHBondContact O-NH1 3.4Å
408	P	57.1	Low	71.7	Confident	102 Å²	102	50.8 Å²	50.8	66%	0.662	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.5	-179.7	21.8	-30.6	0	0	0	113.7
409	D	52.9	Low	71.5	Confident	156 Å²	156	52.2 Å²	52.2	83%	0.834	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	23.3	-176	-59.8	-41.7	0	0	0	114.4	G407 S411	G407-D409 VanDerWaalsContact C-N 3.27Å; G407-D409 PolarHBondContact O-N 3.04Å; D409-S411 PolarHBondContact O-N 3.36Å
410	S	54.7	Low	71.3	Confident	20 Å²	20	52.3 Å²	52.3	14%	0.14	31%	0.307	C	S	.	.			trans	-69.5	107.6	-174.3	-50.8	0	0	0	0	111.6	G407 D414 R469	G407-S410 PolarHBondContact N-OG 3.29Å; G407-S410 PolarHBondContact O-N 3.39Å; G407-S410 PolarHBondContact O-OG 3.3Å; S410-D414 WeakPolarHBondContact CB-OD2 3.45Å; S410-D414 PolarHBondContact OG-OD2 3.39Å; S410-R469 PolarHBondContact O-NH2 3.23Å; S410-R469 VanDerWaalsContact O-NH2 3.16Å
411	S	53.1	Low	71.4	Confident	76 Å²	76	51.5 Å²	51.5	53%	0.531	31%	0.307	S	S	.	.			trans	-67.5	161.1	175.6	71.3	0	0	0	0	112.8	D409 H413 D414	D409-S411 PolarHBondContact O-N 3.36Å; S411-H413 PolarHBondContact O-N 3.03Å; S411-D414 VanDerWaalsContact O-CB 3.25Å; S411-D414 WeakPolarHBondContact O-CB 3.37Å; S411-D414 PolarHBondContact O-N 3.4Å
412	A	45.5	Very low	71.6	Confident	92 Å²	92	49.7 Å²	49.7	76%	0.76	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-12.8	179.6	0	0	0	0	0	115.2
413	H	47.4	Very low	71.9	Confident	182 Å²	182	49.7 Å²	49.7	84%	0.843	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	9.9	175.1	-67.4	-56.5	0	0	0	113.4	S411	S411-H413 PolarHBondContact O-N 3.03Å
414	D	60.2	Low	72.3	Confident	16 Å²	16	49.9 Å²	49.9	9%	0.086	30%	0.299	C	S	.	.			trans	-73.5	132.1	177.4	-168.7	34.6	0	0	0	110.1	R385 S410 S411 T416 E417	R385-D414 IonicContact CZ-OD1 3.61Å; R385-D414 IonicContact NH1-OD1 2.8Å; R385-D414 PolarHBondContact NH1-OD1 2.77Å; R385-D414 IonicContact NH2-OD1 3.45Å; R385-D414 PolarHBondContact NH2-OD1 3.14Å; R385-D414 IonicContact NH2-OD2 3.59Å; S410-D414 WeakPolarHBondContact CB-OD2 3.45Å; S410-D414 PolarHBondContact OG-OD2 3.39Å; S411-D414 VanDerWaalsContact O-CB 3.25Å; S411-D414 WeakPolarHBondContact O-CB 3.37Å; S411-D414 PolarHBondContact O-N 3.4Å; D414-T416 PolarHBondContact O-N 3.43Å; D414-T416 WeakPolarHBondContact OD2-CB 3.43Å; D414-T416 PolarHBondContact OD2-OG1 3.35Å; D414-E417 WeakPolarHBondContact O-CB 3.36Å; D414-E417 PolarHBondContact O-N 3.14Å
415	P	60	Low	72.8	Confident	35 Å²	35	45 Å²	45	23%	0.227	28%	0.276	C	S	.	.	H	α-helix	trans	-46.3	-28.3	170.4	20.7	-41.8	0	0	0	116.3	R387 E417 T418 F419	R387-P415 VanDerWaalsContact NH1-CG 3.25Å; R387-P415 VanDerWaalsContact NH2-CG 3.34Å; P415-E417 PolarHBondContact O-N 3.36Å; P415-T418 WeakPolarHBondContact O-CA 3.2Å; P415-T418 WeakPolarHBondContact O-CB 3.28Å; P415-T418 PolarHBondContact O-N 3.18Å; P415-F419 PolarHBondContact O-N 3.28Å
416	T	68.3	Low	73.4	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.043	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-32	-179.8	-41.3	0	0	0	0	111.1	A405 M406 D414 T418 F419 L420	A405-T416 HydrophobicContact CB-CG2 3.9Å; A405-T416 WeakPolarHBondContact O-CG2 3.36Å; M406-T416 HydrophobicContact CB-CG2 4.48Å; M406-T416 HydrophobicContact CG-CG2 3.85Å; D414-T416 PolarHBondContact O-N 3.43Å; D414-T416 WeakPolarHBondContact OD2-CB 3.43Å; D414-T416 PolarHBondContact OD2-OG1 3.35Å; T416-T418 VanDerWaalsContact C-N 3.33Å; T416-F419 PolarHBondContact O-N 3.01Å; T416-L420 VanDerWaalsContact O-CB 3.29Å; T416-L420 WeakPolarHBondContact O-CB 3.26Å; T416-L420 PolarHBondContact O-N 3.29Å
417	E	75.4	Confident	74.2	Confident	44 Å²	44	43 Å²	43	21%	0.206	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-35.6	172.4	-70.3	-62.4	143	0	0	111.9	D414 P415 S421 R469	D414-E417 WeakPolarHBondContact O-CB 3.36Å; D414-E417 PolarHBondContact O-N 3.14Å; P415-E417 PolarHBondContact O-N 3.36Å; E417-S421 VanDerWaalsContact O-CB 3.3Å; E417-S421 WeakPolarHBondContact O-CB 3.05Å; E417-S421 PolarHBondContact O-N 2.76Å; E417-R469 IonicContact OE1-CZ 3.42Å; E417-R469 IonicContact OE1-NE 2.64Å; E417-R469 PolarHBondContact OE1-NE 3.02Å; E417-R469 IonicContact OE1-NH2 3.88Å; E417-R469 PolarHBondContact OE1-NH2 3.3Å
418	T	82.7	Confident	75.4	Confident	72 Å²	72	43.7 Å²	43.7	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-69.4	-42.9	174.8	-52.5	0	0	0	0	110.9	P415 T416 S421 D422	P415-T418 WeakPolarHBondContact O-CA 3.2Å; P415-T418 WeakPolarHBondContact O-CB 3.28Å; P415-T418 PolarHBondContact O-N 3.18Å; T416-T418 VanDerWaalsContact C-N 3.33Å; T418-S421 PolarHBondContact O-N 3.32Å; T418-D422 WeakPolarHBondContact O-CB 3.44Å; T418-D422 PolarHBondContact O-N 2.95Å
419	F	87.4	Confident	77.1	Confident	29 Å²	29	40.5 Å²	40.5	13%	0.127	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-42	176.8	-179.3	-151.2	0	0	0	112.1	V390 I398 L401 L402 P415 T416 D422 F423 F841	V390-F419 HydrophobicContact CG2-CE1 4.24Å; V390-F419 HydrophobicContact CG2-CE2 4.02Å; V390-F419 HydrophobicContact CG2-CZ 3.65Å; I398-F419 HydrophobicContact CG2-CE2 4.21Å; I398-F419 HydrophobicContact CG2-CZ 4.17Å; L401-F419 HydrophobicContact CG-CE1 4.47Å; L402-F419 HydrophobicContact CB-CD1 4.31Å; L402-F419 HydrophobicContact CB-CE1 3.7Å; L402-F419 HydrophobicContact CB-CZ 3.94Å; L402-F419 HydrophobicContact CD1-CB 4.39Å; L402-F419 HydrophobicContact CD1-CD1 3.53Å; L402-F419 HydrophobicContact CD1-CD2 4.5Å; L402-F419 HydrophobicContact CD1-CE1 3.84Å; L402-F419 HydrophobicContact CD1-CG 3.9Å; L402-F419 HydrophobicContact CD1-CZ 4.41Å; L402-F419 HydrophobicContact CG-CE1 4.38Å; P415-F419 PolarHBondContact O-N 3.28Å; T416-F419 PolarHBondContact O-N 3.01Å; F419-D422 PolarHBondContact O-N 3.47Å; F419-F423 WeakPolarHBondContact O-CB 3.34Å; F419-F423 PolarHBondContact O-N 3.21Å; F419-F841 AromaticContact CD2-CE1 3.53Å; F419-F841 HydrophobicContact CD2-CE1 3.53Å; F419-F841 AromaticContact CD2-CZ 3.75Å; F419-F841 HydrophobicContact CD2-CZ 3.75Å; F419-F841 HydrophobicContact CE2-CD1 4.18Å; F419-F841 AromaticContact CE2-CE1 3.38Å; F419-F841 HydrophobicContact CE2-CE1 3.38Å; F419-F841 HydrophobicContact CE2-CE2 4.31Å; F419-F841 AromaticContact CE2-CZ 3.46Å; F419-F841 HydrophobicContact CE2-CZ 3.46Å; F419-F841 VanDerWaalsContact CE2-CZ 3.46Å
420	L	90	Very high	79	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-46.5	173	178.4	59.1	0	0	0	111.2	L402 M406 T416 F423 L424 L470 Q473	L402-L420 HydrophobicContact CD1-CB 4.05Å; L402-L420 HydrophobicContact CD1-CD1 4.37Å; L402-L420 HydrophobicContact CD2-CD1 3.95Å; L402-L420 HydrophobicContact CG-CD1 4.49Å; M406-L420 HydrophobicContact CE-CD2 4.16Å; M406-L420 HydrophobicContact SD-CD1 4.37Å; T416-L420 VanDerWaalsContact O-CB 3.29Å; T416-L420 WeakPolarHBondContact O-CB 3.26Å; T416-L420 PolarHBondContact O-N 3.29Å; L420-F423 PolarHBondContact O-N 3.18Å; L420-L424 HydrophobicContact CD1-CD1 3.81Å; L420-L424 HydrophobicContact CD1-CG 3.97Å; L420-L424 HydrophobicContact CG-CD1 3.97Å; L420-L424 HydrophobicContact CG-CG 4.45Å; L420-L424 WeakPolarHBondContact O-CB 3.36Å; L420-L424 VanDerWaalsContact O-CG 3.28Å; L420-L424 WeakPolarHBondContact O-CG 3.43Å; L420-L424 PolarHBondContact O-N 3.31Å; L420-L470 HydrophobicContact CD1-CB 4.33Å; L420-L470 HydrophobicContact CD1-CD1 4.15Å; L420-L470 HydrophobicContact CD1-CG 3.89Å; L420-Q473 HydrophobicContact CD2-CB 4.13Å; L420-Q473 HydrophobicContact CD2-CG 3.84Å
421	S	90.3	Very high	80.9	Confident	35 Å²	35	32.9 Å²	32.9	25%	0.245	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-43.9	175.8	176.2	0	0	0	0	112.3	E417 T418 F423 L424 L425 R852	E417-S421 VanDerWaalsContact O-CB 3.3Å; E417-S421 WeakPolarHBondContact O-CB 3.05Å; E417-S421 PolarHBondContact O-N 2.76Å; T418-S421 PolarHBondContact O-N 3.32Å; S421-F423 VanDerWaalsContact C-N 3.34Å; S421-F423 PolarHBondContact O-N 3.37Å; S421-L424 PolarHBondContact O-N 3.36Å; S421-L425 WeakPolarHBondContact O-CB 3.44Å; S421-L425 WeakPolarHBondContact O-CG 3.4Å; S421-L425 PolarHBondContact O-N 2.92Å; S421-R852 PolarHBondContact OG-NH1 3.44Å
422	D	92.7	Very high	82.8	Confident	3 Å²	3	32.7 Å²	32.7	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-57	-49	176.3	-68.7	-24.2	0	0	0	110.7	T418 F419 T426 F841 R845 A848 R852	T418-D422 WeakPolarHBondContact O-CB 3.44Å; T418-D422 PolarHBondContact O-N 2.95Å; F419-D422 PolarHBondContact O-N 3.47Å; D422-T426 PolarHBondContact O-N 3.49Å; D422-T426 PolarHBondContact O-OG1 3.35Å; D422-F841 HydrophobicContact CB-CE1 4.11Å; D422-F841 HydrophobicContact CB-CZ 3.93Å; D422-R845 WeakPolarHBondContact OD2-CG 3.41Å; D422-R845 IonicContact OD2-NE 3.61Å; D422-A848 HydrophobicContact CB-CB 4.25Å; D422-A848 WeakPolarHBondContact OD1-CB 3.4Å; D422-R852 IonicContact OD1-CZ 3.7Å; D422-R852 IonicContact OD1-NH1 3.31Å; D422-R852 PolarHBondContact OD1-NH1 3.02Å; D422-R852 IonicContact OD1-NH2 2.92Å; D422-R852 PolarHBondContact OD1-NH2 2.91Å
423	F	95.3	Very high	84.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-52.5	178.1	-176.9	-88.9	0	0	0	111.4	I398 L399 L402 F419 L420 S421 L425 T426 H427 F430 M431 L436 F841	I398-F423 HydrophobicContact CG2-CD2 3.83Å; I398-F423 HydrophobicContact CG2-CE2 4.07Å; L399-F423 HydrophobicContact CB-CE2 4.21Å; L399-F423 HydrophobicContact CB-CZ 4.09Å; L399-F423 HydrophobicContact CD1-CE1 4.14Å; L399-F423 HydrophobicContact CD1-CZ 3.89Å; L402-F423 HydrophobicContact CD2-CB 3.71Å; L402-F423 HydrophobicContact CD2-CD1 3.72Å; L402-F423 HydrophobicContact CD2-CD2 4.11Å; L402-F423 HydrophobicContact CD2-CE1 4.38Å; L402-F423 HydrophobicContact CD2-CG 3.57Å; F419-F423 WeakPolarHBondContact O-CB 3.34Å; F419-F423 PolarHBondContact O-N 3.21Å; L420-F423 PolarHBondContact O-N 3.18Å; S421-F423 VanDerWaalsContact C-N 3.34Å; S421-F423 PolarHBondContact O-N 3.37Å; F423-L425 PolarHBondContact O-N 2.95Å; F423-T426 CarbonylContact O-C 3.59Å; F423-T426 PolarHBondContact O-N 3.19Å; F423-T426 VanDerWaalsContact O-N 3.14Å; F423-H427 HydrophobicContact CD1-CB 4.32Å; F423-H427 HydrophobicContact CE1-CB 4.02Å; F423-H427 HydrophobicContact CZ-CB 4.29Å; F423-H427 WeakPolarHBondContact O-CA 3.18Å; F423-H427 VanDerWaalsContact O-CB 3.32Å; F423-H427 WeakPolarHBondContact O-CB 3.46Å; F423-H427 PolarHBondContact O-N 2.97Å; F423-F430 HydrophobicContact CD2-CE2 4.34Å; F423-F430 AromaticContact CD2-CZ 3.79Å; F423-F430 HydrophobicContact CD2-CZ 3.79Å; F423-F430 AromaticContact CE2-CE2 3.85Å; F423-F430 HydrophobicContact CE2-CE2 3.85Å; F423-F430 AromaticContact CE2-CZ 3.74Å; F423-F430 HydrophobicContact CE2-CZ 3.74Å; F423-M431 HydrophobicContact CZ-SD 4.04Å; F423-L436 HydrophobicContact CE1-CD1 3.97Å; F423-L436 HydrophobicContact CZ-CD1 4.07Å; F423-F841 HydrophobicContact CB-CZ 4.38Å; F423-F841 HydrophobicContact CD2-CE2 4.46Å
424	L	94.8	Very high	87.1	Confident	5 Å²	5	22.8 Å²	22.8	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-34.5	-175.1	-68.6	177.9	0	0	0	113.5	L420 S421 T426 H427 L470 Q473 W474 L477 Y478	L420-L424 HydrophobicContact CD1-CD1 3.81Å; L420-L424 HydrophobicContact CD1-CG 3.97Å; L420-L424 HydrophobicContact CG-CD1 3.97Å; L420-L424 HydrophobicContact CG-CG 4.45Å; L420-L424 WeakPolarHBondContact O-CB 3.36Å; L420-L424 VanDerWaalsContact O-CG 3.28Å; L420-L424 WeakPolarHBondContact O-CG 3.43Å; L420-L424 PolarHBondContact O-N 3.31Å; S421-L424 PolarHBondContact O-N 3.36Å; L424-T426 VanDerWaalsContact C-N 3.3Å; L424-H427 PolarHBondContact O-CD2 3.01Å; L424-L470 HydrophobicContact CD2-CD2 4.26Å; L424-L470 HydrophobicContact CD2-CG 4.46Å; L424-Q473 HydrophobicContact CD1-CB 3.61Å; L424-W474 HydrophobicContact CD2-CB 3.77Å; L424-W474 HydrophobicContact CD2-CG 4.16Å; L424-L477 HydrophobicContact CB-CD2 3.73Å; L424-Y478 WeakPolarHBondContact O-CE2 3.43Å; L424-Y478 PolarHBondContact O-OH 3.03Å; L424-Y478 VanDerWaalsContact O-OH 3.07Å
425	L	94.4	Very high	88.8	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-70.3	-27.5	176.2	-75.7	167.9	0	0	0	112.5	S421 F423 L477 Q685 V686 I689 A848 R852	S421-L425 WeakPolarHBondContact O-CB 3.44Å; S421-L425 WeakPolarHBondContact O-CG 3.4Å; S421-L425 PolarHBondContact O-N 2.92Å; F423-L425 PolarHBondContact O-N 2.95Å; L425-L477 HydrophobicContact CD2-CD1 3.98Å; L425-L477 HydrophobicContact CD2-CD2 4.01Å; L425-L477 HydrophobicContact CG-CD2 4.22Å; L425-Q685 HydrophobicContact CD2-CB 4.06Å; L425-V686 HydrophobicContact CD2-CG1 4.06Å; L425-I689 HydrophobicContact CB-CD1 4.13Å; L425-I689 WeakPolarHBondContact O-CD1 3.43Å; L425-A848 HydrophobicContact CB-CB 4.24Å; L425-A848 HydrophobicContact CD1-CB 4.09Å; L425-R852 HydrophobicContact CD1-CG 3.81Å
426	T	95.1	Very high	90.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-117.5	-5.4	-170.2	61.4	0	0	0	0	114.8	D422 F423 L424 R428 V429 F430 I689 M844 A848	D422-T426 PolarHBondContact O-N 3.49Å; D422-T426 PolarHBondContact O-OG1 3.35Å; F423-T426 CarbonylContact O-C 3.59Å; F423-T426 PolarHBondContact O-N 3.19Å; F423-T426 VanDerWaalsContact O-N 3.14Å; L424-T426 VanDerWaalsContact C-N 3.3Å; T426-R428 PolarHBondContact O-N 2.7Å; T426-R428 VanDerWaalsContact O-N 3.08Å; T426-V429 VanDerWaalsContact O-CB 3.27Å; T426-V429 WeakPolarHBondContact O-CB 3.37Å; T426-V429 VanDerWaalsContact O-CG2 3.29Å; T426-V429 WeakPolarHBondContact O-CG2 3.42Å; T426-V429 PolarHBondContact O-N 2.99Å; T426-F430 WeakPolarHBondContact O-CD1 3.47Å; T426-F430 WeakPolarHBondContact O-CE1 3.38Å; T426-I689 HydrophobicContact CG2-CD1 4.1Å; T426-M844 HydrophobicContact CG2-CB 4.1Å; T426-M844 WeakPolarHBondContact CG2-O 3.42Å; T426-M844 HydrophobicContact CG2-SD 4.36Å; T426-A848 HydrophobicContact CG2-CB 4.1Å
427	H	94.8	Very high	91.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.1	-36.5	-173.4	82.4	80.5	0	0	0	112	F423 L424 V429 F430 M431 W474 Y478	F423-H427 HydrophobicContact CD1-CB 4.32Å; F423-H427 HydrophobicContact CE1-CB 4.02Å; F423-H427 HydrophobicContact CZ-CB 4.29Å; F423-H427 WeakPolarHBondContact O-CA 3.18Å; F423-H427 VanDerWaalsContact O-CB 3.32Å; F423-H427 WeakPolarHBondContact O-CB 3.46Å; F423-H427 PolarHBondContact O-N 2.97Å; L424-H427 PolarHBondContact O-CD2 3.01Å; H427-V429 PolarHBondContact O-N 3.44Å; H427-F430 HydrophobicContact CB-CZ 4.39Å; H427-F430 PolarHBondContact O-N 2.89Å; H427-M431 CarbonylContact C-O 3.54Å; H427-M431 PolarHBondContact ND1-O 2.95Å; H427-M431 CarbonylContact O-C 3.55Å; H427-M431 VanDerWaalsContact O-CA 3.3Å; H427-M431 WeakPolarHBondContact O-CA 3.49Å; H427-M431 PolarHBondContact O-N 3.35Å; H427-W474 AromaticContact CE1-NE1 3.99Å; H427-W474 AromaticContact NE2-CD1 3.86Å; H427-W474 AromaticContact NE2-NE1 3.21Å; H427-W474 PolarHBondContact NE2-NE1 3.26Å; H427-Y478 AromaticContact NE2-CE2 3.85Å; H427-Y478 AromaticContact NE2-CZ 3.72Å; H427-Y478 PolarHBondContact NE2-OH 3.05Å
428	R	91.7	Very high	92.8	Very high	39 Å²	39	24.3 Å²	24.3	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-17.9	179.7	-71	-154	179.9	-165	-10	114.2	T426 S433 D485 Y690	T426-R428 PolarHBondContact O-N 2.7Å; T426-R428 VanDerWaalsContact O-N 3.08Å; R428-S433 PolarHBondContact NH2-OG 2.86Å; R428-D485 IonicContact NH2-OD2 2.74Å; R428-D485 PolarHBondContact NH2-OD2 2.9Å; R428-Y690 HydrophobicContact CB-CE1 4.41Å; R428-Y690 WeakPolarHBondContact CD-OH 3.23Å
429	V	92.3	Very high	93.4	Very high	35 Å²	35	21.6 Å²	21.6	21%	0.212	14%	0.136	C	C	.	.	H	α-helix	trans	-73.4	-32.2	177	-173.1	0	0	0	0	111.8	T426 H427 I689 L693 T833 M844	T426-V429 VanDerWaalsContact O-CB 3.27Å; T426-V429 WeakPolarHBondContact O-CB 3.37Å; T426-V429 VanDerWaalsContact O-CG2 3.29Å; T426-V429 WeakPolarHBondContact O-CG2 3.42Å; T426-V429 PolarHBondContact O-N 2.99Å; H427-V429 PolarHBondContact O-N 3.44Å; V429-I689 HydrophobicContact CG2-CG2 3.98Å; V429-L693 HydrophobicContact CB-CD1 4.44Å; V429-L693 HydrophobicContact CG1-CD1 4.22Å; V429-L693 HydrophobicContact CG1-CD2 4.3Å; V429-L693 HydrophobicContact CG2-CD1 3.57Å; V429-T833 HydrophobicContact CG1-CG2 4.16Å; V429-M844 HydrophobicContact CB-SD 4.12Å; V429-M844 HydrophobicContact CG1-CE 4.16Å; V429-M844 HydrophobicContact CG1-SD 4.1Å; V429-M844 HydrophobicContact CG2-SD 4.5Å
430	F	93.2	Very high	93.7	Very high	17 Å²	17	20.2 Å²	20.2	8%	0.075	13%	0.13	C	C	.	.	H	α-helix	trans	-132.5	-14.5	-170.6	65.5	-96	0	0	0	115.2	P395 F423 T426 H427 I839 F841 M844	P395-F430 HydrophobicContact CB-CD2 4.02Å; P395-F430 HydrophobicContact CB-CE2 4.46Å; P395-F430 HydrophobicContact CG-CD2 4.18Å; P395-F430 WeakPolarHBondContact CG-O 3.28Å; F423-F430 HydrophobicContact CD2-CE2 4.34Å; F423-F430 AromaticContact CD2-CZ 3.79Å; F423-F430 HydrophobicContact CD2-CZ 3.79Å; F423-F430 AromaticContact CE2-CE2 3.85Å; F423-F430 HydrophobicContact CE2-CE2 3.85Å; F423-F430 AromaticContact CE2-CZ 3.74Å; F423-F430 HydrophobicContact CE2-CZ 3.74Å; T426-F430 WeakPolarHBondContact O-CD1 3.47Å; T426-F430 WeakPolarHBondContact O-CE1 3.38Å; H427-F430 HydrophobicContact CB-CZ 4.39Å; H427-F430 PolarHBondContact O-N 2.89Å; F430-I839 HydrophobicContact CB-CB 4.42Å; F430-I839 HydrophobicContact CB-CD1 3.52Å; F430-I839 HydrophobicContact CB-CG1 3.73Å; F430-I839 HydrophobicContact CB-CG2 3.8Å; F430-I839 HydrophobicContact CD1-CG2 3.96Å; F430-I839 HydrophobicContact CD2-CG1 4.12Å; F430-I839 HydrophobicContact CD2-CG2 4.29Å; F430-I839 HydrophobicContact CG-CD1 4.43Å; F430-I839 HydrophobicContact CG-CG1 4.11Å; F430-I839 HydrophobicContact CG-CG2 3.76Å; F430-F841 HydrophobicContact CE1-CE2 4.36Å; F430-F841 HydrophobicContact CZ-CE2 4.21Å; F430-M844 HydrophobicContact CD1-CG 4.14Å; F430-M844 HydrophobicContact CD1-SD 4.08Å; F430-M844 HydrophobicContact CE1-CG 4.14Å; F430-M844 HydrophobicContact CE1-SD 4.48Å
431	M	94.4	Very high	93.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-143.5	85.3	-178.9	-161.2	-180	-159.1	0	0	109.4	P395 L399 F423 H427 Q435 L436 A439	P395-M431 HydrophobicContact CB-CB 4.1Å; P395-M431 HydrophobicContact CB-CG 4.08Å; P395-M431 HydrophobicContact CB-SD 4.26Å; L399-M431 HydrophobicContact CD2-CE 3.9Å; L399-M431 HydrophobicContact CD2-SD 4.31Å; F423-M431 HydrophobicContact CZ-SD 4.04Å; H427-M431 CarbonylContact C-O 3.54Å; H427-M431 PolarHBondContact ND1-O 2.95Å; H427-M431 CarbonylContact O-C 3.55Å; H427-M431 VanDerWaalsContact O-CA 3.3Å; H427-M431 WeakPolarHBondContact O-CA 3.49Å; H427-M431 PolarHBondContact O-N 3.35Å; M431-Q435 HydrophobicContact CE-CG 4Å; M431-Q435 HydrophobicContact CG-CB 4.07Å; M431-Q435 HydrophobicContact CG-CG 3.94Å; M431-L436 HydrophobicContact CG-CB 4.21Å; M431-L436 HydrophobicContact SD-CB 4.2Å; M431-L436 HydrophobicContact SD-CD1 3.94Å; M431-A439 HydrophobicContact CE-CB 3.56Å
432	P	92	Very high	94	Very high	71 Å²	71	26.7 Å²	26.7	46%	0.461	16%	0.157	S	C	.	.			trans	-54.2	157.1	178.8	-25.6	35.1	0	0	0	112.6	A434 Q435 L436	P432-A434 PolarHBondContact O-N 2.69Å; P432-Q435 PolarHBondContact O-N 3.36Å; P432-L436 PolarHBondContact O-N 3.05Å
433	S	91.5	Very high	93.9	Very high	10 Å²	10	28 Å²	28	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-49.3	-40.6	-178	-58.5	0	0	0	0	112.5	R428 Q435 L436 C437 D485	R428-S433 PolarHBondContact NH2-OG 2.86Å; S433-Q435 PolarHBondContact O-N 3.3Å; S433-L436 PolarHBondContact O-N 3.39Å; S433-C437 VanDerWaalsContact O-CB 3.24Å; S433-C437 WeakPolarHBondContact O-CB 3.29Å; S433-C437 PolarHBondContact O-N 3.32Å; S433-C437 PolarHBondContact O-SG 2.83Å; S433-D485 WeakPolarHBondContact CB-OD2 3.34Å; S433-D485 PolarHBondContact OG-OD2 2.94Å
434	A	92.7	Very high	93.6	Very high	57 Å²	57	28.3 Å²	28.3	47%	0.471	16%	0.164	S	C	.	.	H	α-helix	trans	-61.5	-43.2	178.7	0	0	0	0	0	113.7	P432 A438 V487	P432-A434 PolarHBondContact O-N 2.69Å; A434-A438 VanDerWaalsContact O-CB 3.29Å; A434-A438 WeakPolarHBondContact O-CB 3.41Å; A434-A438 PolarHBondContact O-N 3.33Å; A434-A438 VanDerWaalsContact O-N 3.12Å; A434-V487 HydrophobicContact CB-CG1 4.05Å
435	Q	95.4	Very high	93.3	Very high	67 Å²	67	33 Å²	33	31%	0.313	19%	0.186	S	C	.	.	H	α-helix	trans	-70.4	-44.2	177.6	-171.5	-179.2	6.1	0	0	111	E396 M431 P432 S433 A438 A439	E396-Q435 PolarHBondContact OE1-NE2 3.37Å; M431-Q435 HydrophobicContact CE-CG 4Å; M431-Q435 HydrophobicContact CG-CB 4.07Å; M431-Q435 HydrophobicContact CG-CG 3.94Å; P432-Q435 PolarHBondContact O-N 3.36Å; S433-Q435 PolarHBondContact O-N 3.3Å; Q435-A438 PolarHBondContact O-N 2.61Å; Q435-A439 WeakPolarHBondContact O-CB 3.49Å; Q435-A439 PolarHBondContact O-N 3.5Å
436	L	95.8	Very high	93	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-51.1	177.4	176.8	61.8	0	0	0	111.5	L399 F423 M431 P432 S433 A438 A439 L440	L399-L436 HydrophobicContact CD1-CD1 4.25Å; L399-L436 HydrophobicContact CD2-CD1 4.05Å; F423-L436 HydrophobicContact CE1-CD1 3.97Å; F423-L436 HydrophobicContact CZ-CD1 4.07Å; M431-L436 HydrophobicContact CG-CB 4.21Å; M431-L436 HydrophobicContact SD-CB 4.2Å; M431-L436 HydrophobicContact SD-CD1 3.94Å; P432-L436 PolarHBondContact O-N 3.05Å; S433-L436 PolarHBondContact O-N 3.39Å; L436-A438 VanDerWaalsContact C-N 3.33Å; L436-A438 PolarHBondContact O-N 2.97Å; L436-A439 PolarHBondContact O-N 3.16Å; L436-L440 HydrophobicContact CD1-CD1 3.93Å; L436-L440 HydrophobicContact CD1-CG 4.03Å; L436-L440 HydrophobicContact CG-CD1 3.97Å; L436-L440 HydrophobicContact CG-CG 4.44Å; L436-L440 WeakPolarHBondContact O-CB 3.38Å; L436-L440 VanDerWaalsContact O-CG 3.31Å; L436-L440 WeakPolarHBondContact O-CG 3.37Å; L436-L440 PolarHBondContact O-N 3Å
437	C	95.9	Very high	92.4	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-41.4	179.6	-71.2	0	0	0	0	111.9	S433 L441 F491	S433-C437 VanDerWaalsContact O-CB 3.24Å; S433-C437 WeakPolarHBondContact O-CB 3.29Å; S433-C437 PolarHBondContact O-N 3.32Å; S433-C437 PolarHBondContact O-SG 2.83Å; C437-L441 WeakPolarHBondContact O-CG 3.47Å; C437-L441 PolarHBondContact O-N 3.29Å; C437-L441 VanDerWaalsContact O-N 3.1Å; C437-F491 HydrophobicContact CB-CB 3.78Å; C437-F491 HydrophobicContact CB-CD1 4.39Å; C437-F491 HydrophobicContact CB-CD2 3.72Å; C437-F491 HydrophobicContact CB-CE2 4.42Å; C437-F491 HydrophobicContact CB-CG 3.7Å; C437-F491 VanDerWaalsContact SG-CG 3.53Å
438	A	95.6	Very high	91.8	Very high	61 Å²	61	44 Å²	44	50%	0.504	25%	0.247	S	C	.	.	H	α-helix	trans	-63.9	-45.9	175.8	0	0	0	0	0	112	A434 Q435 L436 L441 H442	A434-A438 VanDerWaalsContact O-CB 3.29Å; A434-A438 WeakPolarHBondContact O-CB 3.41Å; A434-A438 PolarHBondContact O-N 3.33Å; A434-A438 VanDerWaalsContact O-N 3.12Å; Q435-A438 PolarHBondContact O-N 2.61Å; L436-A438 VanDerWaalsContact C-N 3.33Å; L436-A438 PolarHBondContact O-N 2.97Å; A438-L441 PolarHBondContact O-N 2.95Å; A438-H442 WeakPolarHBondContact O-CB 3.41Å; A438-H442 PolarHBondContact O-N 3Å
439	A	95.3	Very high	90.9	Very high	15 Å²	15	47 Å²	47	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-63.4	-42.7	178.7	0	0	0	0	0	112.2	L399 M431 Q435 L436 L441 H442 H443	L399-A439 HydrophobicContact CD2-CB 3.77Å; M431-A439 HydrophobicContact CE-CB 3.56Å; Q435-A439 WeakPolarHBondContact O-CB 3.49Å; Q435-A439 PolarHBondContact O-N 3.5Å; L436-A439 PolarHBondContact O-N 3.16Å; A439-L441 PolarHBondContact O-N 2.85Å; A439-H442 WeakPolarHBondContact O-CB 3.27Å; A439-H442 PolarHBondContact O-N 3.37Å; A439-H443 PolarHBondContact O-CD2 2.98Å; A439-H443 PolarHBondContact O-N 3.44Å
440	L	95.4	Very high	90.2	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-41.6	176.5	-70.4	173.7	0	0	0	112	L399 L436 H442 H443 F444 I467 L470 V471 F491	L399-L440 HydrophobicContact CD1-CD2 4.12Å; L399-L440 HydrophobicContact CD2-CD2 4.24Å; L436-L440 HydrophobicContact CD1-CD1 3.93Å; L436-L440 HydrophobicContact CD1-CG 4.03Å; L436-L440 HydrophobicContact CG-CD1 3.97Å; L436-L440 HydrophobicContact CG-CG 4.44Å; L436-L440 WeakPolarHBondContact O-CB 3.38Å; L436-L440 VanDerWaalsContact O-CG 3.31Å; L436-L440 WeakPolarHBondContact O-CG 3.37Å; L436-L440 PolarHBondContact O-N 3Å; L440-H442 VanDerWaalsContact C-N 3.35Å; L440-H443 PolarHBondContact O-N 3.37Å; L440-F444 WeakPolarHBondContact O-CB 3.32Å; L440-F444 PolarHBondContact O-N 3.09Å; L440-I467 HydrophobicContact CD2-CG2 4.32Å; L440-L470 HydrophobicContact CD1-CD2 4.03Å; L440-L470 HydrophobicContact CD2-CD2 4.18Å; L440-V471 HydrophobicContact CD1-CG2 3.99Å; L440-F491 HydrophobicContact CB-CE2 3.94Å; L440-F491 HydrophobicContact CB-CZ 3.93Å; L440-F491 HydrophobicContact CD1-CE1 4.43Å; L440-F491 HydrophobicContact CD1-CZ 3.89Å
441	L	93.7	Very high	89.7	Confident	36 Å²	36	49 Å²	49	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-40	173.8	-74.7	175.8	0	0	0	111.8	C437 A438 A439 F444 H445 F491 L498	C437-L441 WeakPolarHBondContact O-CG 3.47Å; C437-L441 PolarHBondContact O-N 3.29Å; C437-L441 VanDerWaalsContact O-N 3.1Å; A438-L441 PolarHBondContact O-N 2.95Å; A439-L441 PolarHBondContact O-N 2.85Å; L441-F444 PolarHBondContact O-N 3.1Å; L441-H445 PolarHBondContact O-N 2.94Å; L441-H445 PolarHBondContact O-ND1 3.06Å; L441-F491 HydrophobicContact CD1-CD2 3.99Å; L441-F491 HydrophobicContact CD2-CD2 4.05Å; L441-F491 HydrophobicContact CD2-CE2 3.93Å; L441-F491 HydrophobicContact CG-CD2 3.69Å; L441-F491 HydrophobicContact CG-CE2 3.72Å; L441-L498 HydrophobicContact CD2-CD1 4.18Å
442	H	93.1	Very high	89.3	Confident	137 Å²	137	51.7 Å²	51.7	63%	0.634	33%	0.332	S	S	*	.	H	α-helix	trans	-60.8	-49	176.3	-179.2	-94.1	0	0	0	111	A438 A439 L440 F444 H445 A446	A438-H442 WeakPolarHBondContact O-CB 3.41Å; A438-H442 PolarHBondContact O-N 3Å; A439-H442 WeakPolarHBondContact O-CB 3.27Å; A439-H442 PolarHBondContact O-N 3.37Å; L440-H442 VanDerWaalsContact C-N 3.35Å; H442-F444 VanDerWaalsContact C-N 3.29Å; H442-F444 PolarHBondContact O-N 3.41Å; H442-H445 PolarHBondContact O-N 2.9Å; H442-A446 PolarHBondContact O-N 3.47Å
443	H	89.4	Confident	88.9	Confident	30 Å²	30	56.2 Å²	56.2	14%	0.139	35%	0.347	C	S	.	.	H	α-helix	trans	-64.9	-29.2	176	-75.5	-68.4	0	0	0	113.6	L403 A439 L440 H445 A446 I467	L403-H443 HydrophobicContact CD1-CB 4.45Å; A439-H443 PolarHBondContact O-CD2 2.98Å; A439-H443 PolarHBondContact O-N 3.44Å; L440-H443 PolarHBondContact O-N 3.37Å; H443-H445 VanDerWaalsContact C-N 3.33Å; H443-A446 PolarHBondContact O-N 2.85Å; H443-I467 HydrophobicContact CB-CD1 3.9Å
444	F	89.5	Confident	88.5	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-68.5	-33	177.6	-168.4	-87	0	0	0	112.8	L440 L441 H442 R464 I467 L495 L498 V499 L505	L440-F444 WeakPolarHBondContact O-CB 3.32Å; L440-F444 PolarHBondContact O-N 3.09Å; L441-F444 PolarHBondContact O-N 3.1Å; H442-F444 VanDerWaalsContact C-N 3.29Å; H442-F444 PolarHBondContact O-N 3.41Å; F444-R464 HydrophobicContact CD2-CB 4.3Å; F444-R464 HydrophobicContact CD2-CG 3.83Å; F444-R464 HydrophobicContact CE1-CG 4.48Å; F444-R464 HydrophobicContact CE2-CB 3.92Å; F444-R464 HydrophobicContact CE2-CG 3.66Å; F444-R464 HydrophobicContact CG-CG 4.32Å; F444-R464 HydrophobicContact CZ-CG 4.01Å; F444-R464 PolarHBondContact O-NE 2.96Å; F444-I467 HydrophobicContact CB-CD1 4Å; F444-I467 HydrophobicContact CD2-CD1 4.25Å; F444-I467 HydrophobicContact CD2-CG2 4.29Å; F444-L495 HydrophobicContact CD2-CD1 3.85Å; F444-L495 HydrophobicContact CE2-CD1 3.83Å; F444-L495 HydrophobicContact CG-CD1 4.37Å; F444-L495 HydrophobicContact CZ-CD1 4.36Å; F444-L498 HydrophobicContact CD1-CD1 4.1Å; F444-L498 HydrophobicContact CE1-CB 3.89Å; F444-L498 HydrophobicContact CE1-CD1 4.15Å; F444-L498 HydrophobicContact CZ-CB 4.3Å; F444-V499 HydrophobicContact CE2-CG2 4.43Å; F444-V499 HydrophobicContact CZ-CG2 4.28Å; F444-L505 HydrophobicContact CZ-CD1 4.27Å
445	H	89.3	Confident	88	Confident	104 Å²	104	65.4 Å²	65.4	48%	0.481	38%	0.379	S	S	.	.	H	α-helix	trans	-92.9	-8	177.7	-61.2	109.1	0	0	0	113.7	L441 H442 H443 E447	L441-H445 PolarHBondContact O-N 2.94Å; L441-H445 PolarHBondContact O-ND1 3.06Å; H442-H445 PolarHBondContact O-N 2.9Å; H443-H445 VanDerWaalsContact C-N 3.33Å; H445-E447 PolarHBondContact O-N 2.72Å
446	A	86.3	Confident	87.5	Confident	42 Å²	42	66.9 Å²	66.9	35%	0.347	38%	0.382	S	S	.	.			trans	-66.2	130.4	-176.9	0	0	0	0	0	111.8	H442 H443	H442-A446 PolarHBondContact O-N 3.47Å; H443-A446 PolarHBondContact O-N 2.85Å
447	E	83.1	Confident	86.8	Confident	158 Å²	158	69.6 Å²	69.6	74%	0.738	40%	0.4	S	S	*	.			trans	-108.9	137.7	175.5	-65.7	-169.6	168.5	0	0	111	H445 I460	H445-E447 PolarHBondContact O-N 2.72Å; E447-I460 HydrophobicContact CG-CD1 4.3Å
448	P	82.3	Confident	86.2	Confident	32 Å²	32	72.4 Å²	72.4	21%	0.208	42%	0.418	C	S	.	.			trans	-69	130.7	178	27.1	-33.3	0	0	0	111.5	G450 R456 Y459	P448-G450 VanDerWaalsContact C-N 3.26Å; P448-G450 PolarHBondContact O-N 2.97Å; P448-R456 HydrophobicContact CG-CB 3.9Å; P448-R456 HydrophobicContact CG-CG 3.79Å; P448-R456 PolarHBondContact O-NE 2.72Å; P448-Y459 HydrophobicContact CB-CD1 3.98Å; P448-Y459 HydrophobicContact CB-CE1 4.25Å; P448-Y459 HydrophobicContact CG-CD1 3.79Å; P448-Y459 HydrophobicContact CG-CE1 4.43Å; P448-Y459 HydrophobicContact CG-CG 4.44Å
449	A	73.5	Confident	85.7	Confident	103 Å²	103	74.8 Å²	74.8	85%	0.851	41%	0.414	S	S	*	.	S	Bend	trans	-66.5	-21.7	-176.5	0	0	0	0	0	114.3	R456	A449-R456 PolarHBondContact O-NH2 2.96Å; A449-R456 VanDerWaalsContact O-NH2 3.13Å
450	G	77.3	Confident	85.2	Confident	49 Å²	49	75.4 Å²	75.4	51%	0.505	42%	0.415	S	S	.	.	S	Bend	trans	-132.7	174.2	-177.6	0	0	0	0	0	113.5	P448 R456	P448-G450 VanDerWaalsContact C-N 3.26Å; P448-G450 PolarHBondContact O-N 2.97Å; G450-R456 PolarHBondContact O-NE 2.72Å
451	G	82.2	Confident	84.6	Confident	46 Å²	46	77 Å²	77	47%	0.474	43%	0.426	S	S	.	.	S	Bend	trans	102.7	163.9	177.2	0	0	0	0	0	115	R456	G451-R456 PolarHBondContact O-NE 3.41Å
452	S	86.1	Confident	84.1	Confident	56 Å²	56	78.3 Å²	78.3	39%	0.392	43%	0.433	S	S	.	.			trans	-66.8	156.5	173.2	64.9	0	0	0	0	111.5	Q454 E455 R456	S452-Q454 PolarHBondContact O-N 3.07Å; S452-Q454 VanDerWaalsContact O-N 3.14Å; S452-E455 WeakPolarHBondContact CB-OE2 3.38Å; S452-E455 PolarHBondContact N-OE2 3.4Å; S452-E455 PolarHBondContact O-N 3.21Å; S452-E455 WeakPolarHBondContact OG-CB 3.42Å; S452-E455 WeakPolarHBondContact OG-CG 3.43Å; S452-E455 PolarHBondContact OG-N 2.85Å; S452-E455 PolarHBondContact OG-OE2 2.87Å; S452-R456 WeakPolarHBondContact O-CG 3.46Å; S452-R456 PolarHBondContact O-N 3.26Å
453	E	83.2	Confident	83.7	Confident	166 Å²	166	72.3 Å²	72.3	78%	0.776	41%	0.405	S	S	*	.	H	α-helix	trans	-55.2	-34.9	180	-167.3	179.1	-180	0	0	112.8	S457	E453-S457 WeakPolarHBondContact O-CB 3.31Å; E453-S457 PolarHBondContact O-N 3.34Å; E453-S457 PolarHBondContact O-OG 3.28Å
454	Q	83.2	Confident	83.7	Confident	138 Å²	138	73.7 Å²	73.7	65%	0.645	41%	0.409	S	S	*	.	H	α-helix	trans	-70.1	-43.5	176.4	-173.4	61.3	27.6	0	0	112.6	S452 S457 T458	S452-Q454 PolarHBondContact O-N 3.07Å; S452-Q454 VanDerWaalsContact O-N 3.14Å; Q454-S457 PolarHBondContact O-N 3.18Å; Q454-T458 WeakPolarHBondContact O-CB 3.39Å; Q454-T458 PolarHBondContact O-N 3.46Å; Q454-T458 PolarHBondContact O-OG1 3.17Å
455	E	83	Confident	83.4	Confident	121 Å²	121	76.1 Å²	76.1	57%	0.565	42%	0.421	S	S	*	.	H	α-helix	trans	-65.3	-42.5	176.2	-72.7	163.3	155.5	0	0	111.1	S452 T458 Y459	S452-E455 WeakPolarHBondContact CB-OE2 3.38Å; S452-E455 PolarHBondContact N-OE2 3.4Å; S452-E455 PolarHBondContact O-N 3.21Å; S452-E455 WeakPolarHBondContact OG-CB 3.42Å; S452-E455 WeakPolarHBondContact OG-CG 3.43Å; S452-E455 PolarHBondContact OG-N 2.85Å; S452-E455 PolarHBondContact OG-OE2 2.87Å; E455-T458 PolarHBondContact O-N 3.49Å; E455-Y459 WeakPolarHBondContact O-CB 3.47Å; E455-Y459 PolarHBondContact O-N 2.93Å
456	R	83.8	Confident	83.3	Confident	99 Å²	99	72.8 Å²	72.8	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-60.4	-47.9	175.8	-66.1	-171.9	170.2	146.8	-6.2	111.4	P448 A449 G450 G451 S452 T458 Y459 I460	P448-R456 HydrophobicContact CG-CB 3.9Å; P448-R456 HydrophobicContact CG-CG 3.79Å; P448-R456 PolarHBondContact O-NE 2.72Å; A449-R456 PolarHBondContact O-NH2 2.96Å; A449-R456 VanDerWaalsContact O-NH2 3.13Å; G450-R456 PolarHBondContact O-NE 2.72Å; G451-R456 PolarHBondContact O-NE 3.41Å; S452-R456 WeakPolarHBondContact O-CG 3.46Å; S452-R456 PolarHBondContact O-N 3.26Å; R456-T458 VanDerWaalsContact C-N 3.3Å; R456-T458 PolarHBondContact O-N 2.95Å; R456-Y459 PolarHBondContact O-N 3.42Å; R456-I460 WeakPolarHBondContact O-CB 3.49Å; R456-I460 VanDerWaalsContact O-CG1 3.24Å; R456-I460 WeakPolarHBondContact O-CG1 3.4Å; R456-I460 PolarHBondContact O-N 2.91Å
457	S	82.5	Confident	83.4	Confident	57 Å²	57	70.8 Å²	70.8	40%	0.399	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-39.5	177.3	-63.6	0	0	0	0	112.4	E453 Q454 C461	E453-S457 WeakPolarHBondContact O-CB 3.31Å; E453-S457 PolarHBondContact O-N 3.34Å; E453-S457 PolarHBondContact O-OG 3.28Å; Q454-S457 PolarHBondContact O-N 3.18Å; S457-C461 VanDerWaalsContact O-CB 3.28Å; S457-C461 WeakPolarHBondContact O-CB 3.32Å; S457-C461 PolarHBondContact O-N 2.97Å
458	T	83.4	Confident	83.6	Confident	64 Å²	64	63.4 Å²	63.4	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-69.3	-45.1	178.5	-54.7	0	0	0	0	111.3	Q454 E455 R456 C461 N462	Q454-T458 WeakPolarHBondContact O-CB 3.39Å; Q454-T458 PolarHBondContact O-N 3.46Å; Q454-T458 PolarHBondContact O-OG1 3.17Å; E455-T458 PolarHBondContact O-N 3.49Å; R456-T458 VanDerWaalsContact C-N 3.3Å; R456-T458 PolarHBondContact O-N 2.95Å; T458-C461 PolarHBondContact O-N 2.95Å; T458-N462 WeakPolarHBondContact O-CB 3.48Å; T458-N462 VanDerWaalsContact O-CG 3.24Å; T458-N462 PolarHBondContact O-N 3.28Å
459	Y	84.2	Confident	83.7	Confident	110 Å²	110	64.3 Å²	64.3	43%	0.431	35%	0.354	S	S	.	.	H	α-helix	trans	-60.1	-48.8	176.2	176.2	-93.3	0	0	0	111.9	P448 E455 R456 C461 N462 K463	P448-Y459 HydrophobicContact CB-CD1 3.98Å; P448-Y459 HydrophobicContact CB-CE1 4.25Å; P448-Y459 HydrophobicContact CG-CD1 3.79Å; P448-Y459 HydrophobicContact CG-CE1 4.43Å; P448-Y459 HydrophobicContact CG-CG 4.44Å; E455-Y459 WeakPolarHBondContact O-CB 3.47Å; E455-Y459 PolarHBondContact O-N 2.93Å; R456-Y459 PolarHBondContact O-N 3.42Å; Y459-C461 VanDerWaalsContact C-N 3.33Å; Y459-C461 PolarHBondContact O-N 3.23Å; Y459-N462 PolarHBondContact O-N 3.5Å; Y459-K463 WeakPolarHBondContact O-CB 3.49Å; Y459-K463 PolarHBondContact O-N 3.36Å
460	I	85.1	Confident	84.5	Confident	29 Å²	29	59.4 Å²	59.4	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-45.9	178	-68.1	165.6	0	0	0	110.2	E447 R456 K463 R464	E447-I460 HydrophobicContact CG-CD1 4.3Å; R456-I460 WeakPolarHBondContact O-CB 3.49Å; R456-I460 VanDerWaalsContact O-CG1 3.24Å; R456-I460 WeakPolarHBondContact O-CG1 3.4Å; R456-I460 PolarHBondContact O-N 2.91Å; I460-K463 PolarHBondContact O-N 3.1Å; I460-R464 HydrophobicContact CG2-CG 4.44Å; I460-R464 WeakPolarHBondContact O-CB 3.45Å; I460-R464 VanDerWaalsContact O-CG 3.28Å; I460-R464 WeakPolarHBondContact O-CG 3.29Å; I460-R464 PolarHBondContact O-N 3.37Å
461	C	82.9	Confident	85.2	Confident	33 Å²	33	57 Å²	57	22%	0.223	29%	0.289	C	S	.	.	H	α-helix	trans	-56.8	-53.6	176.5	-171.4	0	0	0	0	110.6	S457 T458 Y459 K463 R464 Q465	S457-C461 VanDerWaalsContact O-CB 3.28Å; S457-C461 WeakPolarHBondContact O-CB 3.32Å; S457-C461 PolarHBondContact O-N 2.97Å; T458-C461 PolarHBondContact O-N 2.95Å; Y459-C461 VanDerWaalsContact C-N 3.33Å; Y459-C461 PolarHBondContact O-N 3.23Å; C461-K463 PolarHBondContact O-N 3.18Å; C461-R464 PolarHBondContact O-N 3.41Å; C461-Q465 VanDerWaalsContact O-CG 3.29Å; C461-Q465 WeakPolarHBondContact O-CG 3.41Å; C461-Q465 PolarHBondContact O-N 2.78Å
462	N	83.1	Confident	85.3	Confident	65 Å²	65	55.5 Å²	55.5	35%	0.348	27%	0.271	S	S	.	.	H	α-helix	trans	-58.9	-46	-179.2	-70.2	-12.1	0	0	0	112.3	T458 Y459 R464 Q465 Q466	T458-N462 WeakPolarHBondContact O-CB 3.48Å; T458-N462 VanDerWaalsContact O-CG 3.24Å; T458-N462 PolarHBondContact O-N 3.28Å; Y459-N462 PolarHBondContact O-N 3.5Å; N462-R464 VanDerWaalsContact C-N 3.34Å; N462-R464 PolarHBondContact O-N 3.45Å; N462-Q465 WeakPolarHBondContact O-CB 3.21Å; N462-Q465 PolarHBondContact O-N 3.08Å; N462-Q466 VanDerWaalsContact O-CG 3.32Å; N462-Q466 WeakPolarHBondContact O-CG 3.2Å; N462-Q466 PolarHBondContact O-N 3.12Å
463	K	85	Confident	85.3	Confident	11 Å²	11	56.2 Å²	56.2	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-42.8	178.8	-164.6	71.5	170.7	-171.4	0	111.5	Y459 I460 C461 Q466 I467	Y459-K463 WeakPolarHBondContact O-CB 3.49Å; Y459-K463 PolarHBondContact O-N 3.36Å; I460-K463 PolarHBondContact O-N 3.1Å; C461-K463 PolarHBondContact O-N 3.18Å; K463-Q466 WeakPolarHBondContact O-CB 3.46Å; K463-Q466 PolarHBondContact O-N 3.16Å; K463-I467 HydrophobicContact CG-CD1 4.45Å; K463-I467 WeakPolarHBondContact O-CG1 3.39Å; K463-I467 PolarHBondContact O-N 3.2Å
464	R	88.9	Confident	85.6	Confident	58 Å²	58	48.3 Å²	48.3	22%	0.219	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-40.8	175.1	-70.4	-179.5	-179.4	168.6	3.5	111.6	F444 I460 C461 N462 Q466 I467 L468 D502 L505	F444-R464 HydrophobicContact CD2-CB 4.3Å; F444-R464 HydrophobicContact CD2-CG 3.83Å; F444-R464 HydrophobicContact CE1-CG 4.48Å; F444-R464 HydrophobicContact CE2-CB 3.92Å; F444-R464 HydrophobicContact CE2-CG 3.66Å; F444-R464 HydrophobicContact CG-CG 4.32Å; F444-R464 HydrophobicContact CZ-CG 4.01Å; F444-R464 PolarHBondContact O-NE 2.96Å; I460-R464 HydrophobicContact CG2-CG 4.44Å; I460-R464 WeakPolarHBondContact O-CB 3.45Å; I460-R464 VanDerWaalsContact O-CG 3.28Å; I460-R464 WeakPolarHBondContact O-CG 3.29Å; I460-R464 PolarHBondContact O-N 3.37Å; C461-R464 PolarHBondContact O-N 3.41Å; N462-R464 VanDerWaalsContact C-N 3.34Å; N462-R464 PolarHBondContact O-N 3.45Å; R464-Q466 PolarHBondContact O-N 3.17Å; R464-I467 PolarHBondContact O-N 3.36Å; R464-L468 VanDerWaalsContact O-CG 3.24Å; R464-L468 WeakPolarHBondContact O-CG 3.49Å; R464-L468 PolarHBondContact O-N 3.31Å; R464-D502 IonicContact NH1-OD2 2.7Å; R464-L505 HydrophobicContact CB-CD1 4.08Å; R464-L505 HydrophobicContact CB-CD2 4.14Å
465	Q	83.6	Confident	85.8	Confident	58 Å²	58	42.6 Å²	42.6	27%	0.271	21%	0.205	S	C	.	.	H	α-helix	trans	-61.7	-42.2	175.2	-66.5	-176.1	-4.5	0	0	112.5	C461 N462 L468 R469 L505 L508	C461-Q465 VanDerWaalsContact O-CG 3.29Å; C461-Q465 WeakPolarHBondContact O-CG 3.41Å; C461-Q465 PolarHBondContact O-N 2.78Å; N462-Q465 WeakPolarHBondContact O-CB 3.21Å; N462-Q465 PolarHBondContact O-N 3.08Å; Q465-L468 PolarHBondContact O-N 2.95Å; Q465-R469 PolarHBondContact O-N 3.38Å; Q465-L505 HydrophobicContact CG-CD2 4.21Å; Q465-L508 HydrophobicContact CB-CD2 4.08Å; Q465-L508 HydrophobicContact CG-CD2 3.41Å; Q465-L508 VanDerWaalsContact CG-CD2 3.41Å
466	Q	86.3	Confident	85.8	Confident	33 Å²	33	38 Å²	38	15%	0.154	19%	0.189	C	C	.	.	H	α-helix	trans	-60.6	-45.9	175.8	-69.6	166.3	-21.9	0	0	111.6	L403 M406 N462 K463 R464 L468 R469 L470	L403-Q466 HydrophobicContact CD2-CB 4.14Å; L403-Q466 PolarHBondContact O-NE2 2.99Å; L403-Q466 PolarHBondContact O-OE1 2.94Å; L403-Q466 VanDerWaalsContact O-OE1 3.09Å; M406-Q466 HydrophobicContact CB-CB 4.44Å; M406-Q466 HydrophobicContact CB-CG 4.05Å; M406-Q466 WeakPolarHBondContact CE-O 3.18Å; M406-Q466 WeakPolarHBondContact O-CG 3.42Å; M406-Q466 PolarHBondContact O-NE2 2.96Å; N462-Q466 VanDerWaalsContact O-CG 3.32Å; N462-Q466 WeakPolarHBondContact O-CG 3.2Å; N462-Q466 PolarHBondContact O-N 3.12Å; K463-Q466 WeakPolarHBondContact O-CB 3.46Å; K463-Q466 PolarHBondContact O-N 3.16Å; R464-Q466 PolarHBondContact O-N 3.17Å; Q466-L468 VanDerWaalsContact C-N 3.34Å; Q466-L468 PolarHBondContact O-N 3.12Å; Q466-R469 PolarHBondContact O-N 3.36Å; Q466-L470 PolarHBondContact O-N 2.93Å
467	I	90	Very high	86	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-59.5	-45.7	175.7	-68.1	165.5	0	0	0	110.5	L403 L440 H443 F444 K463 R464 R469 L470 V471	L403-I467 HydrophobicContact CD1-CG1 4.2Å; L403-I467 HydrophobicContact CD2-CG1 4.01Å; L440-I467 HydrophobicContact CD2-CG2 4.32Å; H443-I467 HydrophobicContact CB-CD1 3.9Å; F444-I467 HydrophobicContact CB-CD1 4Å; F444-I467 HydrophobicContact CD2-CD1 4.25Å; F444-I467 HydrophobicContact CD2-CG2 4.29Å; K463-I467 HydrophobicContact CG-CD1 4.45Å; K463-I467 WeakPolarHBondContact O-CG1 3.39Å; K463-I467 PolarHBondContact O-N 3.2Å; R464-I467 PolarHBondContact O-N 3.36Å; I467-R469 VanDerWaalsContact C-N 3.33Å; I467-R469 PolarHBondContact O-N 2.86Å; I467-L470 PolarHBondContact O-N 3.38Å; I467-V471 HydrophobicContact CG2-CG2 4.26Å; I467-V471 WeakPolarHBondContact O-CB 3.13Å; I467-V471 VanDerWaalsContact O-CG2 3.3Å; I467-V471 WeakPolarHBondContact O-CG2 3.36Å; I467-V471 PolarHBondContact O-N 3.1Å
468	L	86.6	Confident	86.1	Confident	2 Å²	2	32 Å²	32	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-64.4	-37.1	179.6	-66.9	172.8	0	0	0	112.5	R464 Q465 Q466 S472 L495 V499 L505 L509 W541	R464-L468 VanDerWaalsContact O-CG 3.24Å; R464-L468 WeakPolarHBondContact O-CG 3.49Å; R464-L468 PolarHBondContact O-N 3.31Å; Q465-L468 PolarHBondContact O-N 2.95Å; Q466-L468 VanDerWaalsContact C-N 3.34Å; Q466-L468 PolarHBondContact O-N 3.12Å; L468-S472 VanDerWaalsContact O-CB 3.25Å; L468-S472 WeakPolarHBondContact O-CB 3.36Å; L468-S472 PolarHBondContact O-N 3.23Å; L468-L495 HydrophobicContact CD2-CD1 4.47Å; L468-L495 HydrophobicContact CD2-CD2 4.19Å; L468-L495 HydrophobicContact CD2-CG 4.37Å; L468-V499 HydrophobicContact CD1-CG2 4.23Å; L468-V499 HydrophobicContact CD2-CG2 3.61Å; L468-L505 HydrophobicContact CD1-CB 4.34Å; L468-L505 HydrophobicContact CD1-CD2 4.08Å; L468-L509 HydrophobicContact CB-CD2 4.37Å; L468-L509 HydrophobicContact CD1-CD2 4.4Å; L468-L509 HydrophobicContact CD1-CG 4.26Å; L468-L509 HydrophobicContact CD2-CD1 4.48Å; L468-L509 HydrophobicContact CD2-CD2 4.33Å; L468-W541 HydrophobicContact CD2-CH2 4.06Å; L468-W541 HydrophobicContact CD2-CZ2 3.78Å
469	R	84.6	Confident	86.1	Confident	51 Å²	51	29.7 Å²	29.7	19%	0.192	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-46.4	173.5	-179	177.8	179.7	158.7	10.7	111.2	M406 G407 S410 E417 Q465 Q466 I467 S472 Q473	M406-R469 HydrophobicContact CE-CB 3.63Å; M406-R469 HydrophobicContact CE-CG 3.51Å; G407-R469 PolarHBondContact O-NH1 3.4Å; S410-R469 PolarHBondContact O-NH2 3.23Å; S410-R469 VanDerWaalsContact O-NH2 3.16Å; E417-R469 IonicContact OE1-CZ 3.42Å; E417-R469 IonicContact OE1-NE 2.64Å; E417-R469 PolarHBondContact OE1-NE 3.02Å; E417-R469 IonicContact OE1-NH2 3.88Å; E417-R469 PolarHBondContact OE1-NH2 3.3Å; Q465-R469 PolarHBondContact O-N 3.38Å; Q466-R469 PolarHBondContact O-N 3.36Å; I467-R469 VanDerWaalsContact C-N 3.33Å; I467-R469 PolarHBondContact O-N 2.86Å; R469-S472 PolarHBondContact O-N 3.25Å; R469-Q473 WeakPolarHBondContact O-CG 3.28Å; R469-Q473 PolarHBondContact O-N 3Å
470	L	90.3	Very high	85.7	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.6	-49.1	177.6	-177	154.9	0	0	0	110.8	L399 L402 L403 M406 L420 L424 L440 Q466 I467 S472 Q473 W474	L399-L470 HydrophobicContact CD1-CD1 3.8Å; L402-L470 HydrophobicContact CD2-CD1 3.77Å; L402-L470 HydrophobicContact CG-CD1 4.4Å; L403-L470 HydrophobicContact CD2-CB 4.46Å; L403-L470 HydrophobicContact CD2-CD1 3.97Å; M406-L470 HydrophobicContact CE-CB 4.15Å; M406-L470 HydrophobicContact SD-CB 4.34Å; L420-L470 HydrophobicContact CD1-CB 4.33Å; L420-L470 HydrophobicContact CD1-CD1 4.15Å; L420-L470 HydrophobicContact CD1-CG 3.89Å; L424-L470 HydrophobicContact CD2-CD2 4.26Å; L424-L470 HydrophobicContact CD2-CG 4.46Å; L440-L470 HydrophobicContact CD1-CD2 4.03Å; L440-L470 HydrophobicContact CD2-CD2 4.18Å; Q466-L470 PolarHBondContact O-N 2.93Å; I467-L470 PolarHBondContact O-N 3.38Å; L470-S472 VanDerWaalsContact C-N 3.3Å; L470-S472 PolarHBondContact O-N 3.3Å; L470-Q473 PolarHBondContact O-N 3.47Å; L470-W474 WeakPolarHBondContact O-CB 3.42Å; L470-W474 PolarHBondContact O-N 3.49Å
471	V	91	Very high	85.6	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-38.4	178.2	173.2	0	0	0	0	111	L440 I467 Q473 W474 V475 F491 L492 L495 W541	L440-V471 HydrophobicContact CD1-CG2 3.99Å; I467-V471 HydrophobicContact CG2-CG2 4.26Å; I467-V471 WeakPolarHBondContact O-CB 3.13Å; I467-V471 VanDerWaalsContact O-CG2 3.3Å; I467-V471 WeakPolarHBondContact O-CG2 3.36Å; I467-V471 PolarHBondContact O-N 3.1Å; V471-Q473 PolarHBondContact O-N 2.97Å; V471-W474 PolarHBondContact O-N 3.44Å; V471-V475 HydrophobicContact CG1-CG2 4.25Å; V471-V475 WeakPolarHBondContact O-CB 3.35Å; V471-V475 VanDerWaalsContact O-CG2 3.27Å; V471-V475 WeakPolarHBondContact O-CG2 3.32Å; V471-V475 PolarHBondContact O-N 3.07Å; V471-F491 HydrophobicContact CG1-CE1 4.27Å; V471-F491 HydrophobicContact CG2-CE1 3.93Å; V471-F491 HydrophobicContact CG2-CZ 3.92Å; V471-L492 HydrophobicContact CG1-CD2 3.61Å; V471-L495 HydrophobicContact CB-CD2 4.28Å; V471-L495 HydrophobicContact CG1-CD2 3.92Å; V471-L495 HydrophobicContact CG2-CD2 4Å; V471-W541 HydrophobicContact CG1-CE3 4.3Å; V471-W541 HydrophobicContact CG1-CH2 4.23Å; V471-W541 HydrophobicContact CG1-CZ3 4.02Å
472	S	84.3	Confident	85.6	Confident	13 Å²	13	26.4 Å²	26.4	9%	0.091	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-42.1	175.3	-171.8	0	0	0	0	112.2	L468 R469 L470 A476 R516	L468-S472 VanDerWaalsContact O-CB 3.25Å; L468-S472 WeakPolarHBondContact O-CB 3.36Å; L468-S472 PolarHBondContact O-N 3.23Å; R469-S472 PolarHBondContact O-N 3.25Å; L470-S472 VanDerWaalsContact C-N 3.3Å; L470-S472 PolarHBondContact O-N 3.3Å; S472-A476 WeakPolarHBondContact O-CB 3.45Å; S472-A476 PolarHBondContact O-N 3.44Å; S472-R516 VanDerWaalsContact OG-CZ 3.31Å; S472-R516 PolarHBondContact OG-NE 3Å
473	Q	85.9	Confident	85.3	Confident	71 Å²	71	26.6 Å²	26.6	33%	0.332	14%	0.138	S	C	.	.	H	α-helix	trans	-71.4	-35.1	176.5	-67.9	-61.3	-20.7	0	0	112.1	L420 L424 R469 L470 V471 A476 L477	L420-Q473 HydrophobicContact CD2-CB 4.13Å; L420-Q473 HydrophobicContact CD2-CG 3.84Å; L424-Q473 HydrophobicContact CD1-CB 3.61Å; R469-Q473 WeakPolarHBondContact O-CG 3.28Å; R469-Q473 PolarHBondContact O-N 3Å; L470-Q473 PolarHBondContact O-N 3.47Å; V471-Q473 PolarHBondContact O-N 2.97Å; Q473-A476 PolarHBondContact O-N 2.99Å; Q473-L477 WeakPolarHBondContact O-CB 3.46Å; Q473-L477 PolarHBondContact O-N 3.07Å
474	W	90.8	Very high	85	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-45.2	173.4	-177.6	58.4	0	0	0	112	L424 H427 L470 V471 L477 Y478 L482 A488 F491 L492	L424-W474 HydrophobicContact CD2-CB 3.77Å; L424-W474 HydrophobicContact CD2-CG 4.16Å; H427-W474 AromaticContact CE1-NE1 3.99Å; H427-W474 AromaticContact NE2-CD1 3.86Å; H427-W474 AromaticContact NE2-NE1 3.21Å; H427-W474 PolarHBondContact NE2-NE1 3.26Å; L470-W474 WeakPolarHBondContact O-CB 3.42Å; L470-W474 PolarHBondContact O-N 3.49Å; V471-W474 PolarHBondContact O-N 3.44Å; W474-L477 PolarHBondContact O-N 3.16Å; W474-Y478 AromaticContact CD1-CD2 3.46Å; W474-Y478 VanDerWaalsContact CD1-CD2 3.46Å; W474-Y478 AromaticContact CD1-CE2 3.57Å; W474-Y478 HydrophobicContact CG-CD2 4.39Å; W474-Y478 AromaticContact NE1-CD2 3.61Å; W474-Y478 AromaticContact NE1-CE2 3.65Å; W474-Y478 WeakPolarHBondContact O-CD2 3.37Å; W474-Y478 PolarHBondContact O-N 2.93Å; W474-L482 HydrophobicContact CD2-CD1 4.08Å; W474-L482 HydrophobicContact CD2-CD2 4.37Å; W474-L482 HydrophobicContact CE3-CD1 3.93Å; W474-L482 HydrophobicContact CH2-CD1 4.3Å; W474-L482 HydrophobicContact CH2-CD2 3.84Å; W474-L482 HydrophobicContact CZ2-CD1 4.41Å; W474-L482 HydrophobicContact CZ2-CD2 3.44Å; W474-L482 VanDerWaalsContact CZ2-CD2 3.44Å; W474-L482 HydrophobicContact CZ3-CD1 4.05Å; W474-L482 HydrophobicContact CZ3-CD2 4.41Å; W474-A488 HydrophobicContact CH2-CB 3.52Å; W474-A488 HydrophobicContact CZ2-CB 4.2Å; W474-A488 HydrophobicContact CZ3-CB 4.38Å; W474-F491 HydrophobicContact CZ3-CD1 4.09Å; W474-F491 HydrophobicContact CZ3-CE1 4.21Å; W474-L492 HydrophobicContact CZ3-CD2 4.29Å; W474-L492 HydrophobicContact CZ3-CG 4.39Å
475	V	87.4	Confident	84.8	Confident	18 Å²	18	28 Å²	28	11%	0.109	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-39.9	175.6	172.4	0	0	0	0	111.4	V471 G479 L482 L492 W541 L542	V471-V475 HydrophobicContact CG1-CG2 4.25Å; V471-V475 WeakPolarHBondContact O-CB 3.35Å; V471-V475 VanDerWaalsContact O-CG2 3.27Å; V471-V475 WeakPolarHBondContact O-CG2 3.32Å; V471-V475 PolarHBondContact O-N 3.07Å; V475-G479 VanDerWaalsContact O-CA 3.27Å; V475-G479 WeakPolarHBondContact O-CA 3.25Å; V475-G479 PolarHBondContact O-N 3.47Å; V475-L482 HydrophobicContact CB-CD1 4.32Å; V475-L482 HydrophobicContact CG2-CD1 3.87Å; V475-L492 HydrophobicContact CG2-CD1 4.06Å; V475-L492 HydrophobicContact CG2-CD2 3.83Å; V475-W541 HydrophobicContact CG2-CE3 4.36Å; V475-L542 HydrophobicContact CG1-CD2 4.47Å
476	A	82.9	Confident	85	Confident	26 Å²	26	30 Å²	30	22%	0.215	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-45.9	174.6	0	0	0	0	0	111.5	S472 Q473	S472-A476 WeakPolarHBondContact O-CB 3.45Å; S472-A476 PolarHBondContact O-N 3.44Å; Q473-A476 PolarHBondContact O-N 2.99Å
477	L	87	Confident	85.2	Confident	25 Å²	25	31.4 Å²	31.4	13%	0.131	18%	0.182	C	C	.	.	H	α-helix	trans	-67.1	-47.4	-178.4	177	64.1	0	0	0	112.9	L424 L425 Q473 W474 H684	L424-L477 HydrophobicContact CB-CD2 3.73Å; L425-L477 HydrophobicContact CD2-CD1 3.98Å; L425-L477 HydrophobicContact CD2-CD2 4.01Å; L425-L477 HydrophobicContact CG-CD2 4.22Å; Q473-L477 WeakPolarHBondContact O-CB 3.46Å; Q473-L477 PolarHBondContact O-N 3.07Å; W474-L477 PolarHBondContact O-N 3.16Å; L477-H684 PolarHBondContact O-CE1 3.3Å; L477-H684 VanDerWaalsContact O-CE1 3.26Å; L477-H684 PolarHBondContact O-NE2 3.11Å
478	Y	85.5	Confident	85.2	Confident	3 Å²	3	31.3 Å²	31.3	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-89.8	-23.4	-173.8	-77.5	-100.2	0	0	0	113.2	L424 H427 W474 S480 M481 L482 V686	L424-Y478 WeakPolarHBondContact O-CE2 3.43Å; L424-Y478 PolarHBondContact O-OH 3.03Å; L424-Y478 VanDerWaalsContact O-OH 3.07Å; H427-Y478 AromaticContact NE2-CE2 3.85Å; H427-Y478 AromaticContact NE2-CZ 3.72Å; H427-Y478 PolarHBondContact NE2-OH 3.05Å; W474-Y478 AromaticContact CD1-CD2 3.46Å; W474-Y478 VanDerWaalsContact CD1-CD2 3.46Å; W474-Y478 AromaticContact CD1-CE2 3.57Å; W474-Y478 HydrophobicContact CG-CD2 4.39Å; W474-Y478 AromaticContact NE1-CD2 3.61Å; W474-Y478 AromaticContact NE1-CE2 3.65Å; W474-Y478 WeakPolarHBondContact O-CD2 3.37Å; W474-Y478 PolarHBondContact O-N 2.93Å; Y478-S480 PolarHBondContact O-N 3.36Å; Y478-S480 VanDerWaalsContact O-N 3.15Å; Y478-M481 HydrophobicContact CD1-CE 3.62Å; Y478-M481 HydrophobicContact CE1-CE 4.4Å; Y478-M481 HydrophobicContact CG-CE 4.14Å; Y478-M481 WeakPolarHBondContact O-CB 3.19Å; Y478-M481 WeakPolarHBondContact O-CE 3.31Å; Y478-M481 PolarHBondContact O-N 3.05Å; Y478-L482 HydrophobicContact CD1-CD2 4.39Å; Y478-L482 HydrophobicContact CG-CD2 4.06Å; Y478-L482 HydrophobicContact CG-CG 4.48Å; Y478-V686 HydrophobicContact CE1-CG1 4.39Å; Y478-V686 HydrophobicContact CE1-CG2 4.45Å
479	G	83.3	Confident	85.4	Confident	17 Å²	17	32.9 Å²	32.9	18%	0.175	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	45.7	-118.6	176.5	0	0	0	0	0	112.8	V475 M481 L482	V475-G479 VanDerWaalsContact O-CA 3.27Å; V475-G479 WeakPolarHBondContact O-CA 3.25Å; V475-G479 PolarHBondContact O-N 3.47Å; G479-M481 PolarHBondContact O-N 3.15Å; G479-L482 PolarHBondContact O-N 3.43Å
480	S	75.9	Confident	85.8	Confident	53 Å²	53	32.6 Å²	32.6	37%	0.371	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-64.9	-22.4	-175.5	67.4	0	0	0	0	114.9	Y478 L482 H483	Y478-S480 PolarHBondContact O-N 3.36Å; Y478-S480 VanDerWaalsContact O-N 3.15Å; S480-L482 PolarHBondContact O-N 3.34Å; S480-H483 WeakPolarHBondContact O-CB 3.39Å; S480-H483 PolarHBondContact O-N 3.42Å
481	M	81.6	Confident	86	Confident	49 Å²	49	32.9 Å²	32.9	24%	0.241	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-65.1	-27.5	178.8	-65.8	-175.3	-69.8	0	0	112.4	Y478 G479 H483 T484 H684 V686	Y478-M481 HydrophobicContact CD1-CE 3.62Å; Y478-M481 HydrophobicContact CE1-CE 4.4Å; Y478-M481 HydrophobicContact CG-CE 4.14Å; Y478-M481 WeakPolarHBondContact O-CB 3.19Å; Y478-M481 WeakPolarHBondContact O-CE 3.31Å; Y478-M481 PolarHBondContact O-N 3.05Å; G479-M481 PolarHBondContact O-N 3.15Å; M481-H483 VanDerWaalsContact C-N 3.27Å; M481-H483 PolarHBondContact O-N 3.21Å; M481-T484 PolarHBondContact O-N 3.04Å; M481-T484 PolarHBondContact O-OG1 3.32Å; M481-H684 HydrophobicContact CE-CB 4.45Å; M481-H684 WeakPolarHBondContact CE-CD2 3.29Å; M481-H684 WeakPolarHBondContact CE-CE1 3.37Å; M481-H684 VanDerWaalsContact CE-CG 3.46Å; M481-H684 WeakPolarHBondContact CE-ND1 3.19Å; M481-H684 WeakPolarHBondContact CE-NE2 3.29Å; M481-V686 HydrophobicContact CE-CG2 4.04Å; M481-V686 HydrophobicContact SD-CG2 4.37Å
482	L	84	Confident	86	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-68.4	-26.4	177.8	-62.3	-177.5	0	0	0	112.7	W474 V475 Y478 G479 S480 T484 D485 A488 T489 L492	W474-L482 HydrophobicContact CD2-CD1 4.08Å; W474-L482 HydrophobicContact CD2-CD2 4.37Å; W474-L482 HydrophobicContact CE3-CD1 3.93Å; W474-L482 HydrophobicContact CH2-CD1 4.3Å; W474-L482 HydrophobicContact CH2-CD2 3.84Å; W474-L482 HydrophobicContact CZ2-CD1 4.41Å; W474-L482 HydrophobicContact CZ2-CD2 3.44Å; W474-L482 VanDerWaalsContact CZ2-CD2 3.44Å; W474-L482 HydrophobicContact CZ3-CD1 4.05Å; W474-L482 HydrophobicContact CZ3-CD2 4.41Å; V475-L482 HydrophobicContact CB-CD1 4.32Å; V475-L482 HydrophobicContact CG2-CD1 3.87Å; Y478-L482 HydrophobicContact CD1-CD2 4.39Å; Y478-L482 HydrophobicContact CG-CD2 4.06Å; Y478-L482 HydrophobicContact CG-CG 4.48Å; G479-L482 PolarHBondContact O-N 3.43Å; S480-L482 PolarHBondContact O-N 3.34Å; L482-T484 PolarHBondContact O-N 2.98Å; L482-D485 PolarHBondContact O-N 2.83Å; L482-D485 VanDerWaalsContact O-N 3.17Å; L482-A488 HydrophobicContact CB-CB 4.37Å; L482-A488 HydrophobicContact CD2-CB 4.1Å; L482-T489 PolarHBondContact O-OG1 3.5Å; L482-L492 HydrophobicContact CD1-CD1 4.36Å
483	H	77.3	Confident	86.2	Confident	70 Å²	70	38.1 Å²	38.1	32%	0.324	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-64.9	-27.7	175.9	-69.9	-75.9	0	0	0	112.7	S480 M481 D485 L542	S480-H483 WeakPolarHBondContact O-CB 3.39Å; S480-H483 PolarHBondContact O-N 3.42Å; M481-H483 VanDerWaalsContact C-N 3.27Å; M481-H483 PolarHBondContact O-N 3.21Å; H483-D485 VanDerWaalsContact C-N 3.32Å; H483-L542 VanDerWaalsContact CE1-CB 3.49Å; H483-L542 WeakPolarHBondContact CE1-CB 3.44Å
484	T	77.6	Confident	86.5	Confident	73 Å²	73	40.1 Å²	40.1	45%	0.448	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-82.4	-13.1	178.5	61.5	0	0	0	0	112.9	M481 L482 P486	M481-T484 PolarHBondContact O-N 3.04Å; M481-T484 PolarHBondContact O-OG1 3.32Å; L482-T484 PolarHBondContact O-N 2.98Å; T484-P486 WeakPolarHBondContact O-CD 3.42Å
485	D	84.5	Confident	86.5	Confident	24 Å²	24	40.1 Å²	40.1	13%	0.128	23%	0.229	C	C	.	.			trans	-96.9	108.9	178.6	-177.5	-21.1	0	0	0	109.5	R428 S433 L482 H483 V487 A488 T489	R428-D485 IonicContact NH2-OD2 2.74Å; R428-D485 PolarHBondContact NH2-OD2 2.9Å; S433-D485 WeakPolarHBondContact CB-OD2 3.34Å; S433-D485 PolarHBondContact OG-OD2 2.94Å; L482-D485 PolarHBondContact O-N 2.83Å; L482-D485 VanDerWaalsContact O-N 3.17Å; H483-D485 VanDerWaalsContact C-N 3.32Å; D485-V487 PolarHBondContact O-N 2.88Å; D485-V487 WeakPolarHBondContact OD1-CB 3.36Å; D485-V487 PolarHBondContact OD1-N 2.84Å; D485-A488 HydrophobicContact CB-CB 3.8Å; D485-A488 PolarHBondContact O-N 2.82Å; D485-A488 PolarHBondContact OD1-N 2.9Å; D485-A488 VanDerWaalsContact OD1-N 3.12Å; D485-T489 PolarHBondContact O-N 2.85Å; D485-T489 PolarHBondContact O-OG1 2.81Å
486	P	88.1	Confident	86.4	Confident	101 Å²	101	39.9 Å²	39.9	66%	0.656	23%	0.228	S	C	*	.	H	α-helix	trans	-65.9	-28.7	-177.3	26.5	-34	0	0	0	112.2	T484 S490	T484-P486 WeakPolarHBondContact O-CD 3.42Å; P486-S490 WeakPolarHBondContact O-CB 3.46Å; P486-S490 PolarHBondContact O-N 2.9Å
487	V	91.3	Very high	86.6	Confident	62 Å²	62	43 Å²	43	38%	0.376	24%	0.241	S	C	.	.	H	α-helix	trans	-72.2	-45.6	179.6	-175.7	0	0	0	0	110	A434 D485 T489 S490 F491	A434-V487 HydrophobicContact CB-CG1 4.05Å; D485-V487 PolarHBondContact O-N 2.88Å; D485-V487 WeakPolarHBondContact OD1-CB 3.36Å; D485-V487 PolarHBondContact OD1-N 2.84Å; V487-T489 PolarHBondContact O-N 2.76Å; V487-S490 PolarHBondContact O-N 2.95Å; V487-F491 WeakPolarHBondContact O-CB 3.44Å; V487-F491 PolarHBondContact O-N 3.31Å
488	A	90.4	Very high	86.6	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-45.9	174	0	0	0	0	0	111.6	W474 L482 D485 F491 L492	W474-A488 HydrophobicContact CH2-CB 3.52Å; W474-A488 HydrophobicContact CZ2-CB 4.2Å; W474-A488 HydrophobicContact CZ3-CB 4.38Å; L482-A488 HydrophobicContact CB-CB 4.37Å; L482-A488 HydrophobicContact CD2-CB 4.1Å; D485-A488 HydrophobicContact CB-CB 3.8Å; D485-A488 PolarHBondContact O-N 2.82Å; D485-A488 PolarHBondContact OD1-N 2.9Å; D485-A488 VanDerWaalsContact OD1-N 3.12Å; A488-F491 PolarHBondContact O-N 3.47Å; A488-L492 VanDerWaalsContact O-CG 3.32Å; A488-L492 WeakPolarHBondContact O-CG 3.43Å; A488-L492 PolarHBondContact O-N 3.09Å
489	T	89.1	Confident	86.7	Confident	34 Å²	34	43.8 Å²	43.8	21%	0.209	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-46.1	-179.5	-57.9	0	0	0	0	111.7	L482 D485 V487 F491 L492 Q493	L482-T489 PolarHBondContact O-OG1 3.5Å; D485-T489 PolarHBondContact O-N 2.85Å; D485-T489 PolarHBondContact O-OG1 2.81Å; V487-T489 PolarHBondContact O-N 2.76Å; T489-F491 VanDerWaalsContact C-N 3.33Å; T489-F491 PolarHBondContact O-N 2.81Å; T489-L492 PolarHBondContact O-N 3.49Å; T489-Q493 WeakPolarHBondContact O-CG 3.29Å; T489-Q493 PolarHBondContact O-N 3.39Å
490	S	93.3	Very high	86.5	Confident	46 Å²	46	44.9 Å²	44.9	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-40.7	176.1	-175.6	0	0	0	0	112.2	P486 V487 K494	P486-S490 WeakPolarHBondContact O-CB 3.46Å; P486-S490 PolarHBondContact O-N 2.9Å; V487-S490 PolarHBondContact O-N 2.95Å; S490-K494 WeakPolarHBondContact O-CG 3.49Å; S490-K494 PolarHBondContact O-N 3.24Å
491	F	94.9	Very high	86.8	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.022	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-48.7	175.9	164.6	-99.5	0	0	0	112.2	C437 L440 L441 V471 W474 V487 A488 T489 Q493 K494 L495	C437-F491 HydrophobicContact CB-CB 3.78Å; C437-F491 HydrophobicContact CB-CD1 4.39Å; C437-F491 HydrophobicContact CB-CD2 3.72Å; C437-F491 HydrophobicContact CB-CE2 4.42Å; C437-F491 HydrophobicContact CB-CG 3.7Å; C437-F491 VanDerWaalsContact SG-CG 3.53Å; L440-F491 HydrophobicContact CB-CE2 3.94Å; L440-F491 HydrophobicContact CB-CZ 3.93Å; L440-F491 HydrophobicContact CD1-CE1 4.43Å; L440-F491 HydrophobicContact CD1-CZ 3.89Å; L441-F491 HydrophobicContact CD1-CD2 3.99Å; L441-F491 HydrophobicContact CD2-CD2 4.05Å; L441-F491 HydrophobicContact CD2-CE2 3.93Å; L441-F491 HydrophobicContact CG-CD2 3.69Å; L441-F491 HydrophobicContact CG-CE2 3.72Å; V471-F491 HydrophobicContact CG1-CE1 4.27Å; V471-F491 HydrophobicContact CG2-CE1 3.93Å; V471-F491 HydrophobicContact CG2-CZ 3.92Å; W474-F491 HydrophobicContact CZ3-CD1 4.09Å; W474-F491 HydrophobicContact CZ3-CE1 4.21Å; V487-F491 WeakPolarHBondContact O-CB 3.44Å; V487-F491 PolarHBondContact O-N 3.31Å; A488-F491 PolarHBondContact O-N 3.47Å; T489-F491 VanDerWaalsContact C-N 3.33Å; T489-F491 PolarHBondContact O-N 2.81Å; F491-Q493 VanDerWaalsContact C-N 3.3Å; F491-Q493 PolarHBondContact O-N 3.1Å; F491-K494 PolarHBondContact O-N 2.93Å; F491-L495 HydrophobicContact CE1-CD2 4.18Å; F491-L495 HydrophobicContact CZ-CD2 3.97Å; F491-L495 WeakPolarHBondContact O-CB 3.4Å; F491-L495 PolarHBondContact O-N 3.39Å
492	L	90.9	Very high	86.7	Confident	4 Å²	4	52 Å²	52	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-63.6	-36.3	-179.1	-70.4	172.1	0	0	0	112.1	V471 W474 V475 L482 A488 T489 S496 W541 L542	V471-L492 HydrophobicContact CG1-CD2 3.61Å; W474-L492 HydrophobicContact CZ3-CD2 4.29Å; W474-L492 HydrophobicContact CZ3-CG 4.39Å; V475-L492 HydrophobicContact CG2-CD1 4.06Å; V475-L492 HydrophobicContact CG2-CD2 3.83Å; L482-L492 HydrophobicContact CD1-CD1 4.36Å; A488-L492 VanDerWaalsContact O-CG 3.32Å; A488-L492 WeakPolarHBondContact O-CG 3.43Å; A488-L492 PolarHBondContact O-N 3.09Å; T489-L492 PolarHBondContact O-N 3.49Å; L492-S496 VanDerWaalsContact O-CB 3.31Å; L492-S496 WeakPolarHBondContact O-CB 3.46Å; L492-S496 PolarHBondContact O-N 3.27Å; L492-W541 HydrophobicContact CB-CB 4.48Å; L492-W541 HydrophobicContact CD2-CB 4.39Å; L492-W541 HydrophobicContact CD2-CG 4.32Å; L492-L542 HydrophobicContact CD1-CD1 3.59Å; L492-L542 HydrophobicContact CD1-CG 4Å
493	Q	89.4	Confident	86.3	Confident	120 Å²	120	55.5 Å²	55.5	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-63	-52	172.5	-73.3	172.2	-12	0	0	111.4	T489 F491 L495 S496 D497	T489-Q493 WeakPolarHBondContact O-CG 3.29Å; T489-Q493 PolarHBondContact O-N 3.39Å; F491-Q493 VanDerWaalsContact C-N 3.3Å; F491-Q493 PolarHBondContact O-N 3.1Å; Q493-L495 VanDerWaalsContact C-N 3.32Å; Q493-L495 PolarHBondContact O-N 3.43Å; Q493-S496 VanDerWaalsContact O-CB 3.31Å; Q493-S496 WeakPolarHBondContact O-CB 3.46Å; Q493-S496 PolarHBondContact O-N 2.85Å; Q493-S496 VanDerWaalsContact O-N 3.16Å; Q493-D497 PolarHBondContact O-N 2.83Å
494	K	91.5	Very high	86.2	Confident	112 Å²	112	61.6 Å²	61.6	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-58.1	-43.8	177.4	-72.5	170.9	-178.1	171.2	0	112.1	S490 F491 D497 L498	S490-K494 WeakPolarHBondContact O-CG 3.49Å; S490-K494 PolarHBondContact O-N 3.24Å; F491-K494 PolarHBondContact O-N 2.93Å; K494-D497 PolarHBondContact O-N 3.07Å; K494-L498 VanDerWaalsContact O-CG 3.3Å; K494-L498 WeakPolarHBondContact O-CG 3.3Å; K494-L498 PolarHBondContact O-N 3.18Å
495	L	90.2	Very high	86.1	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-65	-40.4	178.2	-174	66.8	0	0	0	111.5	F444 L468 V471 F491 Q493 D497 L498 V499 W541	F444-L495 HydrophobicContact CD2-CD1 3.85Å; F444-L495 HydrophobicContact CE2-CD1 3.83Å; F444-L495 HydrophobicContact CG-CD1 4.37Å; F444-L495 HydrophobicContact CZ-CD1 4.36Å; L468-L495 HydrophobicContact CD2-CD1 4.47Å; L468-L495 HydrophobicContact CD2-CD2 4.19Å; L468-L495 HydrophobicContact CD2-CG 4.37Å; V471-L495 HydrophobicContact CB-CD2 4.28Å; V471-L495 HydrophobicContact CG1-CD2 3.92Å; V471-L495 HydrophobicContact CG2-CD2 4Å; F491-L495 HydrophobicContact CE1-CD2 4.18Å; F491-L495 HydrophobicContact CZ-CD2 3.97Å; F491-L495 WeakPolarHBondContact O-CB 3.4Å; F491-L495 PolarHBondContact O-N 3.39Å; Q493-L495 VanDerWaalsContact C-N 3.32Å; Q493-L495 PolarHBondContact O-N 3.43Å; L495-D497 VanDerWaalsContact C-N 3.34Å; L495-D497 PolarHBondContact O-N 3.44Å; L495-L498 PolarHBondContact O-N 2.85Å; L495-V499 HydrophobicContact CD1-CG2 4.44Å; L495-V499 HydrophobicContact CG-CG2 4.44Å; L495-V499 VanDerWaalsContact O-CG2 3.3Å; L495-V499 WeakPolarHBondContact O-CG2 3.47Å; L495-V499 PolarHBondContact O-N 2.86Å; L495-W541 HydrophobicContact CD2-CZ2 4.38Å
496	S	86.3	Confident	85.4	Confident	13 Å²	13	58.3 Å²	58.3	9%	0.091	31%	0.307	C	S	.	.	H	α-helix	trans	-57.1	-46.8	173.7	-175.6	0	0	0	0	111.9	L492 Q493 L498 V499 G500 P539	L492-S496 VanDerWaalsContact O-CB 3.31Å; L492-S496 WeakPolarHBondContact O-CB 3.46Å; L492-S496 PolarHBondContact O-N 3.27Å; Q493-S496 VanDerWaalsContact O-CB 3.31Å; Q493-S496 WeakPolarHBondContact O-CB 3.46Å; Q493-S496 PolarHBondContact O-N 2.85Å; Q493-S496 VanDerWaalsContact O-N 3.16Å; S496-L498 VanDerWaalsContact C-N 3.33Å; S496-L498 PolarHBondContact O-N 3.3Å; S496-V499 PolarHBondContact O-N 2.85Å; S496-G500 PolarHBondContact O-N 3.25Å; S496-P539 PolarHBondContact OG-O 3.45Å
497	D	87	Confident	84.6	Confident	92 Å²	92	57.8 Å²	57.8	49%	0.492	30%	0.298	S	S	.	.	H	α-helix	trans	-64.2	-39.1	179.1	-67.8	-20.3	0	0	0	112	Q493 K494 L495 R501	Q493-D497 PolarHBondContact O-N 2.83Å; K494-D497 PolarHBondContact O-N 3.07Å; L495-D497 VanDerWaalsContact C-N 3.34Å; L495-D497 PolarHBondContact O-N 3.44Å; D497-R501 WeakPolarHBondContact O-CG 3.23Å; D497-R501 PolarHBondContact O-N 3.5Å
498	L	87.5	Confident	83.4	Confident	44 Å²	44	56.7 Å²	56.7	23%	0.23	29%	0.29	C	S	.	.	H	α-helix	trans	-66.3	-43.6	177	-71.4	170.8	0	0	0	112	L441 F444 K494 L495 S496 R501	L441-L498 HydrophobicContact CD2-CD1 4.18Å; F444-L498 HydrophobicContact CD1-CD1 4.1Å; F444-L498 HydrophobicContact CE1-CB 3.89Å; F444-L498 HydrophobicContact CE1-CD1 4.15Å; F444-L498 HydrophobicContact CZ-CB 4.3Å; K494-L498 VanDerWaalsContact O-CG 3.3Å; K494-L498 WeakPolarHBondContact O-CG 3.3Å; K494-L498 PolarHBondContact O-N 3.18Å; L495-L498 PolarHBondContact O-N 2.85Å; S496-L498 VanDerWaalsContact C-N 3.33Å; S496-L498 PolarHBondContact O-N 3.3Å; L498-R501 PolarHBondContact O-N 3.49Å
499	V	85.7	Confident	82.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-71.4	-36.1	178.6	179.4	0	0	0	0	111.7	F444 L468 L495 S496 R501 D502 L505 S506 L509	F444-V499 HydrophobicContact CE2-CG2 4.43Å; F444-V499 HydrophobicContact CZ-CG2 4.28Å; L468-V499 HydrophobicContact CD1-CG2 4.23Å; L468-V499 HydrophobicContact CD2-CG2 3.61Å; L495-V499 HydrophobicContact CD1-CG2 4.44Å; L495-V499 HydrophobicContact CG-CG2 4.44Å; L495-V499 VanDerWaalsContact O-CG2 3.3Å; L495-V499 WeakPolarHBondContact O-CG2 3.47Å; L495-V499 PolarHBondContact O-N 2.86Å; S496-V499 PolarHBondContact O-N 2.85Å; V499-R501 PolarHBondContact O-N 3.3Å; V499-R501 VanDerWaalsContact O-N 3.17Å; V499-D502 CarbonylContact O-C 3.51Å; V499-D502 PolarHBondContact O-N 3.33Å; V499-L505 HydrophobicContact CG1-CB 3.68Å; V499-S506 PolarHBondContact O-OG 3.28Å; V499-L509 HydrophobicContact CB-CD1 4.09Å; V499-L509 HydrophobicContact CG1-CD1 3.32Å; V499-L509 HydrophobicContact CG1-CG 4.27Å; V499-L509 HydrophobicContact CG2-CD1 4.33Å
500	G	80.6	Confident	80.9	Confident	40 Å²	40	62.6 Å²	62.6	41%	0.412	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-22.2	176.8	0	0	0	0	0	113.8	S496	S496-G500 PolarHBondContact O-N 3.25Å
501	R	81.9	Confident	79.4	Confident	208 Å²	208	67.4 Å²	67.4	79%	0.785	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.1	174.1	-66.4	169.2	-169.2	-160.5	2.4	113.4	D497 L498 V499	D497-R501 WeakPolarHBondContact O-CG 3.23Å; D497-R501 PolarHBondContact O-N 3.5Å; L498-R501 PolarHBondContact O-N 3.49Å; V499-R501 PolarHBondContact O-N 3.3Å; V499-R501 VanDerWaalsContact O-N 3.17Å
502	D	79.9	Confident	77.5	Confident	44 Å²	44	69.7 Å²	69.7	24%	0.235	34%	0.337	C	S	.	.			trans	-113.8	108.3	-179.1	-171.7	-27.9	0	0	0	110.8	R464 V499 R504 L505 S506	R464-D502 IonicContact NH1-OD2 2.7Å; V499-D502 CarbonylContact O-C 3.51Å; V499-D502 PolarHBondContact O-N 3.33Å; D502-R504 VanDerWaalsContact C-N 3.27Å; D502-R504 PolarHBondContact O-N 3.44Å; D502-R504 WeakPolarHBondContact OD1-CB 3.21Å; D502-R504 PolarHBondContact OD1-N 2.98Å; D502-L505 HydrophobicContact CB-CB 4.18Å; D502-L505 HydrophobicContact CB-CD1 3.94Å; D502-L505 HydrophobicContact CB-CG 4.17Å; D502-L505 PolarHBondContact O-N 3.42Å; D502-L505 PolarHBondContact OD1-N 2.92Å; D502-L505 WeakPolarHBondContact OD2-CD1 3.49Å; D502-S506 WeakPolarHBondContact O-CB 3.24Å; D502-S506 PolarHBondContact O-N 3.29Å; D502-S506 PolarHBondContact O-OG 3.49Å
503	A	74.6	Confident	75.6	Confident	73 Å²	73	73.7 Å²	73.7	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-62.5	-30.3	-177.4	0	0	0	0	0	113.3	N507	A503-N507 PolarHBondContact O-N 3.43Å; A503-N507 PolarHBondContact O-ND2 3.11Å
504	R	75.8	Confident	73.5	Confident	198 Å²	198	71 Å²	71	75%	0.747	35%	0.345	S	S	*	.	H	α-helix	trans	-71.7	-45	-179.6	-63.9	179.6	178.8	179.7	0.8	110.6	D502 N507 L508	D502-R504 VanDerWaalsContact C-N 3.27Å; D502-R504 PolarHBondContact O-N 3.44Å; D502-R504 WeakPolarHBondContact OD1-CB 3.21Å; D502-R504 PolarHBondContact OD1-N 2.98Å; R504-N507 PolarHBondContact O-N 3.24Å; R504-L508 PolarHBondContact O-N 2.98Å
505	L	74.6	Confident	71.3	Confident	3 Å²	3	72.1 Å²	72.1	2%	0.016	35%	0.352	C	S	.	.	H	α-helix	trans	-70.2	-36.7	177.9	-63.6	176.3	0	0	0	112.1	F444 R464 Q465 L468 V499 D502 N507 L508 L509	F444-L505 HydrophobicContact CZ-CD1 4.27Å; R464-L505 HydrophobicContact CB-CD1 4.08Å; R464-L505 HydrophobicContact CB-CD2 4.14Å; Q465-L505 HydrophobicContact CG-CD2 4.21Å; L468-L505 HydrophobicContact CD1-CB 4.34Å; L468-L505 HydrophobicContact CD1-CD2 4.08Å; V499-L505 HydrophobicContact CG1-CB 3.68Å; D502-L505 HydrophobicContact CB-CB 4.18Å; D502-L505 HydrophobicContact CB-CD1 3.94Å; D502-L505 HydrophobicContact CB-CG 4.17Å; D502-L505 PolarHBondContact O-N 3.42Å; D502-L505 PolarHBondContact OD1-N 2.92Å; D502-L505 WeakPolarHBondContact OD2-CD1 3.49Å; L505-N507 VanDerWaalsContact C-N 3.32Å; L505-N507 PolarHBondContact O-N 2.62Å; L505-L508 PolarHBondContact O-N 3.09Å; L505-L509 PolarHBondContact O-N 2.87Å
506	S	71.3	Confident	69.2	Low	24 Å²	24	74.3 Å²	74.3	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-61.4	-37.6	175.6	-71.3	0	0	0	0	112.9	V499 D502 R510	V499-S506 PolarHBondContact O-OG 3.28Å; D502-S506 WeakPolarHBondContact O-CB 3.24Å; D502-S506 PolarHBondContact O-N 3.29Å; D502-S506 PolarHBondContact O-OG 3.49Å; S506-R510 PolarHBondContact O-N 2.79Å
507	N	70.3	Confident	67.1	Low	91 Å²	91	80.7 Å²	80.7	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-70.8	-41.4	175.5	-72.5	-18.7	0	0	0	111.9	A503 R504 L505 L509 R510 E511	A503-N507 PolarHBondContact O-N 3.43Å; A503-N507 PolarHBondContact O-ND2 3.11Å; R504-N507 PolarHBondContact O-N 3.24Å; L505-N507 VanDerWaalsContact C-N 3.32Å; L505-N507 PolarHBondContact O-N 2.62Å; N507-L509 PolarHBondContact O-N 2.83Å; N507-R510 WeakPolarHBondContact O-CB 3.42Å; N507-R510 PolarHBondContact O-N 3.39Å; N507-R510 VanDerWaalsContact O-N 3.15Å; N507-E511 PolarHBondContact O-N 2.94Å
508	L	65.9	Low	64.7	Low	39 Å²	39	85.3 Å²	85.3	20%	0.204	39%	0.392	C	S	.	.	H	α-helix	trans	-62.9	-42.2	177.2	-167.4	79	0	0	0	112.6	Q465 R504 L505 R510 E511 Q512	Q465-L508 HydrophobicContact CB-CD2 4.08Å; Q465-L508 HydrophobicContact CG-CD2 3.41Å; Q465-L508 VanDerWaalsContact CG-CD2 3.41Å; R504-L508 PolarHBondContact O-N 2.98Å; L505-L508 PolarHBondContact O-N 3.09Å; L508-R510 VanDerWaalsContact C-N 3.25Å; L508-R510 PolarHBondContact O-N 2.68Å; L508-E511 PolarHBondContact O-N 3.2Å; L508-Q512 PolarHBondContact O-N 3.4Å; L508-Q512 VanDerWaalsContact O-N 3.09Å
509	L	64.3	Low	62.3	Low	3 Å²	3	88.4 Å²	88.4	2%	0.016	41%	0.406	C	S	.	.	H	α-helix	trans	-60.5	-36.7	174.4	-82.5	179.1	0	0	0	112.4	L468 V499 L505 N507 Q512 W513 R516 P539 W541	L468-L509 HydrophobicContact CB-CD2 4.37Å; L468-L509 HydrophobicContact CD1-CD2 4.4Å; L468-L509 HydrophobicContact CD1-CG 4.26Å; L468-L509 HydrophobicContact CD2-CD1 4.48Å; L468-L509 HydrophobicContact CD2-CD2 4.33Å; V499-L509 HydrophobicContact CB-CD1 4.09Å; V499-L509 HydrophobicContact CG1-CD1 3.32Å; V499-L509 HydrophobicContact CG1-CG 4.27Å; V499-L509 HydrophobicContact CG2-CD1 4.33Å; L505-L509 PolarHBondContact O-N 2.87Å; N507-L509 PolarHBondContact O-N 2.83Å; L509-Q512 PolarHBondContact O-N 3.13Å; L509-W513 PolarHBondContact O-N 2.94Å; L509-R516 VanDerWaalsContact CD2-NH2 3.34Å; L509-P539 HydrophobicContact CD1-CB 4.38Å; L509-W541 HydrophobicContact CD1-CZ2 3.85Å; L509-W541 HydrophobicContact CD2-CH2 3.43Å; L509-W541 VanDerWaalsContact CD2-CH2 3.43Å; L509-W541 HydrophobicContact CD2-CZ2 3.61Å; L509-W541 HydrophobicContact CD2-CZ3 4.36Å; L509-W541 HydrophobicContact CG-CZ2 4.44Å
510	R	63.2	Low	60	Low	154 Å²	154	93.1 Å²	93.1	58%	0.581	43%	0.428	S	S	*	.	H	α-helix	trans	-67.9	-38.6	178.5	-169.1	-174.3	-59.7	-115	-1.3	111.6	S506 N507 L508 W513	S506-R510 PolarHBondContact O-N 2.79Å; N507-R510 WeakPolarHBondContact O-CB 3.42Å; N507-R510 PolarHBondContact O-N 3.39Å; N507-R510 VanDerWaalsContact O-N 3.15Å; L508-R510 VanDerWaalsContact C-N 3.25Å; L508-R510 PolarHBondContact O-N 2.68Å; R510-W513 WeakPolarHBondContact O-CB 3.32Å; R510-W513 PolarHBondContact O-N 3.25Å
511	E	61.4	Low	57.8	Low	147 Å²	147	99.6 Å²	99.6	69%	0.687	44%	0.439	S	S	*	.	H	α-helix	trans	-70.3	-32.8	176.5	-71.8	-177.2	170.6	0	0	113.1	N507 L508 W513 P514	N507-E511 PolarHBondContact O-N 2.94Å; L508-E511 PolarHBondContact O-N 3.2Å; E511-W513 VanDerWaalsContact C-N 3.35Å; E511-P514 WeakPolarHBondContact O-CD 3.39Å
512	Q	56.2	Low	55.7	Low	54 Å²	54	94.7 Å²	94.7	25%	0.252	43%	0.428	S	S	.	.	S	Bend	trans	-81.6	-8.3	175.8	-66.9	-174.8	1.7	0	0	114	L508 L509 P514	L508-Q512 PolarHBondContact O-N 3.4Å; L508-Q512 VanDerWaalsContact O-N 3.09Å; L509-Q512 PolarHBondContact O-N 3.13Å; Q512-P514 VanDerWaalsContact C-CD 3.5Å
513	W	50.8	Low	53.7	Low	88 Å²	88	96.5 Å²	96.5	33%	0.333	44%	0.435	S	S	.	.	H	α-helix	trans	-67.6	-34.7	-178.5	-151.6	-98.3	0	0	0	115.9	L509 R510 E511 E515 R516 V540	L509-W513 PolarHBondContact O-N 2.94Å; R510-W513 WeakPolarHBondContact O-CB 3.32Å; R510-W513 PolarHBondContact O-N 3.25Å; E511-W513 VanDerWaalsContact C-N 3.35Å; W513-E515 VanDerWaalsContact C-N 3.33Å; W513-E515 PolarHBondContact O-N 3.49Å; W513-R516 VanDerWaalsContact CE3-CZ 3.48Å; W513-R516 VanDerWaalsContact CZ3-NH1 3.29Å; W513-R516 WeakPolarHBondContact O-CB 3.3Å; W513-R516 PolarHBondContact O-N 3.1Å; W513-V540 WeakPolarHBondContact CH2-O 3.47Å
514	P	44.8	Very low	51.8	Low	62 Å²	62	97.2 Å²	97.2	40%	0.403	43%	0.429	S	S	.	.	H	α-helix	trans	-64.4	-30.6	178.8	-21.4	34	0	0	0	114.3	E511 Q512 R517	E511-P514 WeakPolarHBondContact O-CD 3.39Å; Q512-P514 VanDerWaalsContact C-CD 3.5Å; P514-R517 PolarHBondContact O-N 3.46Å
515	E	44.8	Very low	49.9	Very low	137 Å²	137	90.6 Å²	90.6	64%	0.64	42%	0.422	S	S	*	.	H	α-helix	trans	-71	-35.2	177.6	-68	-179.4	166.8	0	0	111.8	W513 R517 R518 H519	W513-E515 VanDerWaalsContact C-N 3.33Å; W513-E515 PolarHBondContact O-N 3.49Å; E515-R517 VanDerWaalsContact C-N 3.3Å; E515-R517 PolarHBondContact O-N 2.99Å; E515-R518 PolarHBondContact O-N 3.39Å; E515-H519 PolarHBondContact O-N 2.9Å; E515-H519 VanDerWaalsContact O-N 3.13Å
516	R	47.2	Very low	47.8	Very low	46 Å²	46	96.4 Å²	96.4	17%	0.174	46%	0.462	C	S	.	.	H	α-helix	trans	-58.7	-39.9	173.3	-55	-178.9	-151.6	-152.4	2.6	112	S472 L509 W513 R518 H519 H520	S472-R516 VanDerWaalsContact OG-CZ 3.31Å; S472-R516 PolarHBondContact OG-NE 3Å; L509-R516 VanDerWaalsContact CD2-NH2 3.34Å; W513-R516 VanDerWaalsContact CE3-CZ 3.48Å; W513-R516 VanDerWaalsContact CZ3-NH1 3.29Å; W513-R516 WeakPolarHBondContact O-CB 3.3Å; W513-R516 PolarHBondContact O-N 3.1Å; R516-R518 VanDerWaalsContact C-N 3.26Å; R516-R518 PolarHBondContact O-N 3.39Å; R516-H519 PolarHBondContact O-N 2.91Å; R516-H520 WeakPolarHBondContact O-CB 3.35Å; R516-H520 PolarHBondContact O-N 2.98Å
517	R	40.6	Very low	46	Very low	148 Å²	148	97.8 Å²	97.8	56%	0.558	48%	0.48	S	S	*	.	H	α-helix	trans	-68.5	-17.7	175.5	-72.5	-169.9	-70.6	-162.1	-3.5	114	P514 E515 R521	P514-R517 PolarHBondContact O-N 3.46Å; E515-R517 VanDerWaalsContact C-N 3.3Å; E515-R517 PolarHBondContact O-N 2.99Å; R517-R521 PolarHBondContact O-NE 3.16Å
518	R	38.1	Very low	44	Very low	188 Å²	188	102.3 Å²	102.3	71%	0.709	50%	0.504	S	S	*	.	H	α-helix	trans	-86	-40.6	173	-72.1	-171.9	-174.3	-173.8	2.9	111.1	E515 R516 R521 L522	E515-R518 PolarHBondContact O-N 3.39Å; R516-R518 VanDerWaalsContact C-N 3.26Å; R516-R518 PolarHBondContact O-N 3.39Å; R518-R521 PolarHBondContact O-N 3.03Å; R518-L522 PolarHBondContact O-N 2.94Å
519	H	37.4	Very low	42.2	Very low	110 Å²	110	103.7 Å²	103.7	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-67.4	-42.6	175.3	-87.6	-97.8	0	0	0	112.9	E515 R516 R521 L522 E523	E515-H519 PolarHBondContact O-N 2.9Å; E515-H519 VanDerWaalsContact O-N 3.13Å; R516-H519 PolarHBondContact O-N 2.91Å; H519-R521 PolarHBondContact O-N 3.32Å; H519-L522 PolarHBondContact O-N 3.25Å; H519-E523 PolarHBondContact O-N 3.13Å
520	H	36.9	Very low	40.4	Very low	99 Å²	99	108.7 Å²	108.7	46%	0.458	56%	0.557	S	S	.	*	H	α-helix	trans	-60.9	-29.1	175	-125.5	48.1	0	0	0	113.6	R516 L522 N524	R516-H520 WeakPolarHBondContact O-CB 3.35Å; R516-H520 PolarHBondContact O-N 2.98Å; H520-L522 VanDerWaalsContact C-N 3.33Å; H520-N524 PolarHBondContact O-N 3.43Å
521	R	33.4	Very low	38.8	Very low	175 Å²	175	106 Å²	106	66%	0.66	56%	0.559	S	S	*	*	H	α-helix	trans	-76.2	-18.9	175.7	-92.9	-173.2	-78.2	-157.1	-1.3	113.8	R517 R518 H519	R517-R521 PolarHBondContact O-NE 3.16Å; R518-R521 PolarHBondContact O-N 3.03Å; H519-R521 PolarHBondContact O-N 3.32Å
522	L	37.5	Very low	37.3	Very low	106 Å²	106	108.3 Å²	108.3	56%	0.555	57%	0.57	S	S	*	*	H	α-helix	trans	-89.5	-27.4	177.1	-137.5	82.4	0	0	0	111.7	R518 H519 H520	R518-L522 PolarHBondContact O-N 2.94Å; H519-L522 PolarHBondContact O-N 3.25Å; H520-L522 VanDerWaalsContact C-N 3.33Å
523	E	38.3	Very low	36	Very low	81 Å²	81	111.6 Å²	111.6	38%	0.379	59%	0.587	S	S	.	*	H	α-helix	trans	-87	-33.2	-179.7	-73.6	178.3	153.1	0	0	113.8	H519	H519-E523 PolarHBondContact O-N 3.13Å
524	N	34.9	Very low	35	Very low	88 Å²	88	116.9 Å²	116.9	47%	0.471	61%	0.612	S	S	.	*	S	Bend	trans	-105.4	96.2	176	-68.6	-20.7	0	0	0	109.5	H520 C526	H520-N524 PolarHBondContact O-N 3.43Å; N524-C526 PolarHBondContact O-N 3.23Å
525	G	35.3	Very low	34.4	Very low	59 Å²	59	118.4 Å²	118.4	61%	0.608	63%	0.63	S	S	*	*			trans	-53.2	135.6	172.7	0	0	0	0	0	112
526	C	32.1	Very low	33.9	Very low	126 Å²	126	120.9 Å²	120.9	85%	0.851	63%	0.633	S	S	*	*			trans	68.8	91.2	164.4	-139.5	0	0	0	0	117.7	N524	N524-C526 PolarHBondContact O-N 3.23Å
527	G	31.6	Very low	33.5	Very low	53 Å²	53	125.2 Å²	125.2	55%	0.546	66%	0.66	S	S	.	*			trans	-160.4	101.4	160.2	0	0	0	0	0	112.1	A529	G527-A529 PolarHBondContact O-N 3.07Å
528	N	28.4	Very low	33.5	Very low	186 Å²	186	123.5 Å²	123.5	100%	0.995	66%	0.661	S	S	*	*			trans	-83.3	28.7	171.9	-90.2	-4.4	0	0	0	112.6
529	A	29.2	Very low	33.7	Very low	68 Å²	68	116 Å²	116	56%	0.562	64%	0.637	S	S	*	*			trans	-108.6	111.6	173.9	0	0	0	0	0	108.9	G527 P531	G527-A529 PolarHBondContact O-N 3.07Å; A529-P531 VanDerWaalsContact O-CD 3.29Å; A529-P531 WeakPolarHBondContact O-CD 3.25Å
530	S	25.4	Very low	34.5	Very low	108 Å²	108	113.5 Å²	113.5	76%	0.755	63%	0.629	S	S	*	*			trans	-68.4	117.7	162.7	53.8	0	0	0	0	108.6	Q532	S530-Q532 PolarHBondContact O-N 2.63Å; S530-Q532 VanDerWaalsContact O-N 3.1Å
531	P	31.5	Very low	35.3	Very low	98 Å²	98	109.6 Å²	109.6	64%	0.636	61%	0.61	S	S	*	*			trans	-71.9	109.5	167.9	-6.1	23.2	0	0	0	106.8	A529 M533	A529-P531 VanDerWaalsContact O-CD 3.29Å; A529-P531 WeakPolarHBondContact O-CD 3.25Å; P531-M533 PolarHBondContact O-N 2.94Å
532	Q	29.6	Very low	36	Very low	195 Å²	195	102.5 Å²	102.5	91%	0.911	59%	0.585	S	S	*	*			trans	-70.6	80.5	162.5	-97.1	-172.1	-14.9	0	0	107.9	S530	S530-Q532 PolarHBondContact O-N 2.63Å; S530-Q532 VanDerWaalsContact O-N 3.1Å
533	M	29.1	Very low	36.5	Very low	123 Å²	123	101.6 Å²	101.6	61%	0.606	59%	0.586	S	S	*	*			trans	-90.6	116.5	173.9	-138.1	175.1	-177.2	0	0	108.6	P531 A535 E547	P531-M533 PolarHBondContact O-N 2.94Å; M533-A535 PolarHBondContact O-N 3.45Å; M533-E547 HydrophobicContact CE-CG 4.5Å
534	K	29.7	Very low	36.6	Very low	198 Å²	198	102.4 Å²	102.4	86%	0.861	59%	0.593	S	S	*	*			trans	-52.5	132.8	174.7	-69.1	176.8	178.8	175.6	0	109.4	R536	K534-R536 PolarHBondContact O-N 3.06Å
535	A	31.3	Very low	37	Very low	94 Å²	94	106.8 Å²	106.8	78%	0.777	61%	0.61	S	S	*	*			trans	-53.8	99.5	-179.2	0	0	0	0	0	111.5	M533	M533-A535 PolarHBondContact O-N 3.45Å
536	R	34.8	Very low	36.9	Very low	189 Å²	189	110.8 Å²	110.8	71%	0.713	62%	0.618	S	S	*	*			trans	-78.5	127	162.1	-87.7	-175.3	169.5	-179.7	-1.3	107.6	K534 L538	K534-R536 PolarHBondContact O-N 3.06Å; R536-L538 PolarHBondContact O-N 2.77Å
537	N	38.3	Very low	37	Very low	138 Å²	138	110 Å²	110	74%	0.738	60%	0.602	S	S	*	*	S	Bend	trans	-74.5	15.2	-174.7	-75.8	-27.9	0	0	0	114.9
538	L	40.1	Very low	37	Very low	112 Å²	112	113.1 Å²	113.1	59%	0.586	61%	0.612	S	S	*	*	S	Bend	trans	-123	132.6	-177.8	-138.7	75.8	0	0	0	110.7	R536 V540	R536-L538 PolarHBondContact O-N 2.77Å; L538-V540 PolarHBondContact O-N 3.16Å
539	P	43.1	Very low	37.4	Very low	29 Å²	29	110.2 Å²	110.2	19%	0.188	60%	0.596	C	S	.	*			trans	-72.1	89.9	178.7	27.8	-32.5	0	0	0	110.8	S496 L509 W541	S496-P539 PolarHBondContact OG-O 3.45Å; L509-P539 HydrophobicContact CD1-CB 4.38Å; P539-W541 PolarHBondContact O-N 3.44Å
540	V	54.3	Low	37.5	Very low	59 Å²	59	111.8 Å²	111.8	36%	0.358	60%	0.601	S	S	.	*			trans	-85.5	107.7	177	-171.3	0	0	0	0	109.3	W513 L538 L542	W513-V540 WeakPolarHBondContact CH2-O 3.47Å; L538-V540 PolarHBondContact O-N 3.16Å; V540-L542 WeakPolarHBondContact CG1-O 3.35Å; V540-L542 PolarHBondContact O-N 3.29Å
541	W	53.8	Low	37.9	Very low	16 Å²	16	109.4 Å²	109.4	6%	0.061	59%	0.594	C	S	.	*	S	Bend	trans	-61	-26.2	178.6	-68	91.9	0	0	0	114.2	L468 V471 V475 L492 L495 L509 P539	L468-W541 HydrophobicContact CD2-CH2 4.06Å; L468-W541 HydrophobicContact CD2-CZ2 3.78Å; V471-W541 HydrophobicContact CG1-CE3 4.3Å; V471-W541 HydrophobicContact CG1-CH2 4.23Å; V471-W541 HydrophobicContact CG1-CZ3 4.02Å; V475-W541 HydrophobicContact CG2-CE3 4.36Å; L492-W541 HydrophobicContact CB-CB 4.48Å; L492-W541 HydrophobicContact CD2-CB 4.39Å; L492-W541 HydrophobicContact CD2-CG 4.32Å; L495-W541 HydrophobicContact CD2-CZ2 4.38Å; L509-W541 HydrophobicContact CD1-CZ2 3.85Å; L509-W541 HydrophobicContact CD2-CH2 3.43Å; L509-W541 VanDerWaalsContact CD2-CH2 3.43Å; L509-W541 HydrophobicContact CD2-CZ2 3.61Å; L509-W541 HydrophobicContact CD2-CZ3 4.36Å; L509-W541 HydrophobicContact CG-CZ2 4.44Å; P539-W541 PolarHBondContact O-N 3.44Å
542	L	48.4	Very low	38.4	Very low	26 Å²	26	110.3 Å²	110.3	14%	0.136	60%	0.602	C	S	.	*	S	Bend	trans	-136.7	111.7	-174.5	-75.3	178.7	0	0	0	108.8	V475 H483 L492 V540	V475-L542 HydrophobicContact CG1-CD2 4.47Å; H483-L542 VanDerWaalsContact CE1-CB 3.49Å; H483-L542 WeakPolarHBondContact CE1-CB 3.44Å; L492-L542 HydrophobicContact CD1-CD1 3.59Å; L492-L542 HydrophobicContact CD1-CG 4Å; V540-L542 WeakPolarHBondContact CG1-O 3.35Å; V540-L542 PolarHBondContact O-N 3.29Å
543	P	47.5	Very low	39.4	Very low	87 Å²	87	104.8 Å²	104.8	57%	0.565	59%	0.585	S	S	*	*			trans	-57.4	152	-179.2	21.6	-29.6	0	0	0	112.2
544	N	40.7	Very low	41	Very low	99 Å²	99	101.7 Å²	101.7	53%	0.529	58%	0.575	S	S	.	*			trans	-60	146.8	175.5	-87.1	4.9	0	0	0	110.6	D546	N544-D546 PolarHBondContact O-N 3.25Å
545	Q	43.1	Very low	43.4	Very low	179 Å²	179	93.3 Å²	93.3	84%	0.836	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-8.1	-178.4	-66.7	-169.9	6.3	0	0	115.2	E547	Q545-E547 PolarHBondContact O-N 3.45Å
546	D	33.6	Very low	45.9	Very low	143 Å²	143	90.6 Å²	90.6	77%	0.765	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-1.5	-169.9	-64.7	-36.1	0	0	0	115.4	N544 P548	N544-D546 PolarHBondContact O-N 3.25Å; D546-P548 WeakPolarHBondContact O-CD 3.36Å
547	E	33.4	Very low	48.3	Very low	109 Å²	109	86.2 Å²	86.2	51%	0.509	50%	0.498	S	S	.	.	S	Bend	trans	-98.5	110.1	168.1	-82.9	-157.6	161.8	0	0	110.5	M533 Q545 L549	M533-E547 HydrophobicContact CE-CG 4.5Å; Q545-E547 PolarHBondContact O-N 3.45Å; E547-L549 PolarHBondContact O-N 3.29Å; E547-L549 VanDerWaalsContact O-N 3.08Å
548	P	31.5	Very low	50.3	Low	119 Å²	119	81.3 Å²	81.3	77%	0.773	47%	0.473	S	S	*	.			trans	-63.3	115.4	171.2	19.8	-21.4	0	0	0	108.3	D546 P550	D546-P548 WeakPolarHBondContact O-CD 3.36Å; P548-P550 WeakPolarHBondContact O-CD 3.31Å; P548-P550 VanDerWaalsContact O-N 3.16Å
549	L	36.1	Very low	52.1	Low	125 Å²	125	78.7 Å²	78.7	65%	0.654	47%	0.473	S	S	*	.			trans	-53.5	120.2	173.8	-79.3	156.2	0	0	0	108.6	E547 G551	E547-L549 PolarHBondContact O-N 3.29Å; E547-L549 VanDerWaalsContact O-N 3.08Å; L549-G551 PolarHBondContact O-N 3.42Å; L549-G551 VanDerWaalsContact O-N 3.13Å
550	P	31.3	Very low	54.1	Low	102 Å²	102	80.3 Å²	80.3	66%	0.662	48%	0.48	S	S	*	.			trans	-74.1	110	-178.4	12.5	-4.8	0	0	0	109.5	P548	P548-P550 WeakPolarHBondContact O-CD 3.31Å; P548-P550 VanDerWaalsContact O-N 3.16Å
551	G	34.5	Very low	55.6	Low	58 Å²	58	84.6 Å²	84.6	60%	0.598	49%	0.494	S	S	*	.	S	Bend	trans	95.4	114.4	159.7	0	0	0	0	0	116.9	L549	L549-G551 PolarHBondContact O-N 3.42Å; L549-G551 VanDerWaalsContact O-N 3.13Å
552	S	42.4	Very low	57.2	Low	116 Å²	116	84.9 Å²	84.9	81%	0.811	50%	0.497	S	S	*	.			trans	64.7	60.2	146.7	-173.4	0	0	0	0	119.1
553	S	50.3	Low	59.1	Low	79 Å²	79	87 Å²	87	55%	0.552	51%	0.512	S	S	*	.			trans	-110.4	99.6	158.4	-171.1	0	0	0	0	110	A555	S553-A555 PolarHBondContact O-N 2.97Å
554	C	62.1	Low	61.2	Low	59 Å²	59	82.9 Å²	82.9	40%	0.399	49%	0.485	S	S	.	.			trans	-78.8	14.9	171.8	-162.4	0	0	0	0	112.1	R708	C554-R708 PolarHBondContact O-NH1 2.85Å; C554-R708 PolarHBondContact SG-NH1 2.66Å
555	A	81.2	Confident	63.6	Low	22 Å²	22	80.8 Å²	80.8	18%	0.182	47%	0.474	C	S	.	.			trans	-82.7	126.5	-174.7	0	0	0	0	0	110.8	S553 N705	S553-A555 PolarHBondContact O-N 2.97Å; A555-N705 WeakPolarHBondContact CA-OD1 3.49Å
556	I	84.4	Confident	65.9	Low	37 Å²	37	72.3 Å²	72.3	19%	0.19	44%	0.435	C	S	.	.			trans	-79.1	129.2	177.9	-55.7	169	0	0	0	108.5	V580 A704 N705	I556-V580 HydrophobicContact CG2-CB 4.19Å; I556-V580 HydrophobicContact CG2-CG1 4.41Å; I556-V580 HydrophobicContact CG2-CG2 3.76Å; I556-A704 HydrophobicContact CB-CB 4.16Å; I556-A704 HydrophobicContact CD1-CB 4.09Å; I556-A704 HydrophobicContact CG2-CB 4.03Å; I556-N705 PolarHBondContact N-OD1 3.45Å; I556-N705 PolarHBondContact O-ND2 3.35Å
557	R	84.6	Confident	68.8	Low	97 Å²	97	65.6 Å²	65.6	37%	0.366	40%	0.399	S	S	.	.			trans	-111.2	158.4	-178	-54.6	177.2	-177.8	178.8	0.4	110.9	G559 D560 V580	R557-G559 PolarHBondContact O-N 3.17Å; R557-G559 VanDerWaalsContact O-N 3.16Å; R557-D560 PolarHBondContact N-OD2 3.35Å; R557-D560 WeakPolarHBondContact O-CB 3.3Å; R557-D560 PolarHBondContact O-N 3.35Å; R557-V580 VanDerWaalsContact O-CG1 3.23Å; R557-V580 WeakPolarHBondContact O-CG1 3.5Å
558	V	80.4	Confident	71.5	Confident	35 Å²	35	62.8 Å²	62.8	21%	0.212	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-35.5	-178.8	175.8	0	0	0	0	113.1	T581 T702	V558-T581 HydrophobicContact CG1-CG2 3.9Å; V558-T702 HydrophobicContact CG2-CG2 3.68Å
559	G	77.1	Confident	74.1	Confident	56 Å²	56	60.3 Å²	60.3	58%	0.577	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-5.6	-179.7	0	0	0	0	0	115.1	R557	R557-G559 PolarHBondContact O-N 3.17Å; R557-G559 VanDerWaalsContact O-N 3.16Å
560	D	85.3	Confident	76.6	Confident	63 Å²	63	60 Å²	60	34%	0.337	37%	0.37	S	S	.	.			trans	-73.6	141.2	-177.1	-62.9	-13.4	0	0	0	110.1	R557 P579 V580	R557-D560 PolarHBondContact N-OD2 3.35Å; R557-D560 WeakPolarHBondContact O-CB 3.3Å; R557-D560 PolarHBondContact O-N 3.35Å; D560-P579 CarbonylContact O-C 3.6Å; D560-P579 WeakPolarHBondContact O-CA 3.35Å; D560-V580 PolarHBondContact O-N 3.38Å
561	K	86.7	Confident	79.5	Confident	150 Å²	150	57.7 Å²	57.7	65%	0.652	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.1	171.3	-65.1	-173.4	179.5	-172.9	0	109.5	L578	K561-L578 CarbonylContact C-O 3.56Å; K561-L578 VanDerWaalsContact CA-O 3.29Å; K561-L578 WeakPolarHBondContact CA-O 3.4Å
562	V	86.6	Confident	82.2	Confident	22 Å²	22	57.2 Å²	57.2	13%	0.133	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.6	178.4	-60.4	0	0	0	0	110	Y564 L578 V580	V562-Y564 HydrophobicContact CG2-CD2 4.03Å; V562-Y564 HydrophobicContact CG2-CE2 3.51Å; V562-Y564 WeakPolarHBondContact O-CD2 3.42Å; V562-Y564 PolarHBondContact O-N 3.18Å; V562-L578 PolarHBondContact N-O 2.97Å; V562-L578 PolarHBondContact O-N 3.26Å; V562-V580 HydrophobicContact CG1-CB 4.25Å; V562-V580 HydrophobicContact CG1-CG2 4.28Å; V562-V580 HydrophobicContact CG2-CB 4.45Å
563	P	88.6	Confident	84.5	Confident	69 Å²	69	55.1 Å²	55.1	45%	0.448	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	130.7	172.3	27.1	-32.6	0	0	0	110.7	T575 L576	P563-T575 HydrophobicContact CB-CG2 3.77Å; P563-L576 CarbonylContact C-O 3.53Å; P563-L576 WeakPolarHBondContact CA-O 3.27Å
564	Y	90.6	Very high	86.4	Confident	1 Å²	1	54.3 Å²	54.3	0%	0.004	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	98.4	167.5	-80.1	-111.6	0	0	0	107.6	V562 I566 T575 L576 L578 P579 V587 V622 A623 L632	V562-Y564 HydrophobicContact CG2-CD2 4.03Å; V562-Y564 HydrophobicContact CG2-CE2 3.51Å; V562-Y564 WeakPolarHBondContact O-CD2 3.42Å; V562-Y564 PolarHBondContact O-N 3.18Å; Y564-I566 PolarHBondContact O-N 2.74Å; Y564-T575 WeakPolarHBondContact O-CA 3.33Å; Y564-L576 PolarHBondContact N-O 2.83Å; Y564-L576 PolarHBondContact O-N 3.24Å; Y564-L578 HydrophobicContact CD2-CB 3.77Å; Y564-L578 HydrophobicContact CD2-CD1 4.26Å; Y564-L578 HydrophobicContact CD2-CG 4.36Å; Y564-L578 HydrophobicContact CE2-CB 3.73Å; Y564-L578 HydrophobicContact CG-CD1 4.26Å; Y564-P579 PolarHBondContact OH-O 2.74Å; Y564-V587 HydrophobicContact CD1-CG2 3.88Å; Y564-V587 HydrophobicContact CE1-CG2 3.71Å; Y564-V622 HydrophobicContact CD1-CG2 4.45Å; Y564-V622 HydrophobicContact CE1-CG2 3.76Å; Y564-A623 HydrophobicContact CD1-CB 3.72Å; Y564-A623 HydrophobicContact CD2-CB 4.09Å; Y564-A623 HydrophobicContact CE1-CB 3.48Å; Y564-A623 VanDerWaalsContact CE1-CB 3.48Å; Y564-A623 HydrophobicContact CE2-CB 3.88Å; Y564-A623 HydrophobicContact CG-CB 4Å; Y564-L632 HydrophobicContact CD1-CD1 4.17Å
565	D	91.2	Very high	87.8	Confident	56 Å²	56	55 Å²	55	30%	0.299	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112	174.8	-62.9	-24.3	0	0	0	109.2	V573 T575	D565-V573 HydrophobicContact CB-CG1 3.87Å; D565-T575 WeakPolarHBondContact OD1-CB 3.29Å; D565-T575 VanDerWaalsContact OD1-CG2 3.27Å; D565-T575 WeakPolarHBondContact OD1-CG2 3.4Å; D565-T575 PolarHBondContact OD1-OG1 3.18Å
566	I	92.7	Very high	88.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.8	-174.1	-59.5	176.4	0	0	0	108.4	Y564 L574 L576 V587 L591 L603 L632 V634	Y564-I566 PolarHBondContact O-N 2.74Å; I566-L574 PolarHBondContact N-O 2.87Å; I566-L574 PolarHBondContact O-N 3.28Å; I566-L576 HydrophobicContact CD1-CD1 4.07Å; I566-V587 HydrophobicContact CD1-CG1 3.59Å; I566-L591 HydrophobicContact CD1-CD1 3.84Å; I566-L591 HydrophobicContact CD1-CD2 4.06Å; I566-L591 HydrophobicContact CD1-CG 4.16Å; I566-L591 HydrophobicContact CG2-CD1 4.5Å; I566-L603 HydrophobicContact CG2-CD1 4.35Å; I566-L632 HydrophobicContact CG1-CB 4.43Å; I566-V634 HydrophobicContact CG2-CB 4.11Å; I566-V634 HydrophobicContact CG2-CG2 3.44Å; I566-V634 VanDerWaalsContact CG2-CG2 3.44Å
567	C	92.9	Very high	88.6	Confident	2 Å²	2	58 Å²	58	1%	0.014	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	138.6	179.4	-61.5	0	0	0	0	111.1	S572 L632 F633 V634	C567-S572 CarbonylContact C-O 3.55Å; C567-S572 WeakPolarHBondContact CA-O 3.25Å; C567-L632 WeakPolarHBondContact CB-O 3.45Å; C567-L632 PolarHBondContact N-O 2.98Å; C567-F633 HydrophobicContact CB-CD1 3.44Å; C567-F633 VanDerWaalsContact CB-CD1 3.44Å; C567-F633 HydrophobicContact CB-CD2 4.02Å; C567-F633 HydrophobicContact CB-CE1 3.34Å; C567-F633 HydrophobicContact CB-CE2 3.94Å; C567-F633 HydrophobicContact CB-CG 3.8Å; C567-F633 HydrophobicContact CB-CZ 3.61Å; C567-F633 WeakPolarHBondContact O-CA 3.45Å; C567-V634 PolarHBondContact O-N 3.1Å; C567-V634 VanDerWaalsContact O-N 3.1Å
568	L	90.1	Very high	88.9	Confident	50 Å²	50	54.5 Å²	54.5	26%	0.262	31%	0.31	S	S	.	.			trans	-89.2	165.3	166.8	-63.7	-172.8	0	0	0	110.4	D570 H571 S572 L574	L568-D570 VanDerWaalsContact CB-OD1 3.25Å; L568-D570 WeakPolarHBondContact CB-OD1 3.47Å; L568-D570 PolarHBondContact O-N 2.8Å; L568-D570 VanDerWaalsContact O-N 3.12Å; L568-H571 PolarHBondContact O-N 3.2Å; L568-S572 WeakPolarHBondContact CD1-OG 3.36Å; L568-S572 PolarHBondContact N-O 3.04Å; L568-L574 HydrophobicContact CD1-CD1 4.08Å; L568-L574 HydrophobicContact CD2-CD1 4.21Å; L568-L574 HydrophobicContact CG-CD1 4.23Å
569	P	87.7	Confident	89.4	Confident	67 Å²	67	55.4 Å²	55.4	44%	0.435	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-23.2	178.2	-26.3	36.2	0	0	0	114.3	H571 V635 L643	P569-H571 VanDerWaalsContact C-N 3.27Å; P569-H571 PolarHBondContact O-N 3.4Å; P569-V635 HydrophobicContact CG-CG2 4.15Å; P569-L643 HydrophobicContact CB-CD2 4.17Å; P569-L643 HydrophobicContact CG-CD2 4.31Å
570	D	88.5	Confident	89.9	Confident	117 Å²	117	52.8 Å²	52.8	63%	0.626	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	7.9	175.3	72	-11	0	0	0	114.1	L568 S572	L568-D570 VanDerWaalsContact CB-OD1 3.25Å; L568-D570 WeakPolarHBondContact CB-OD1 3.47Å; L568-D570 PolarHBondContact O-N 2.8Å; L568-D570 VanDerWaalsContact O-N 3.12Å; D570-S572 PolarHBondContact O-N 3.04Å; D570-S572 VanDerWaalsContact OD1-CB 3.31Å; D570-S572 WeakPolarHBondContact OD1-CB 3.31Å; D570-S572 PolarHBondContact OD1-N 3.25Å; D570-S572 PolarHBondContact OD1-OG 3.37Å; D570-S572 PolarHBondContact OD2-OG 2.88Å
571	H	91	Very high	90	Very high	54 Å²	54	50.8 Å²	50.8	25%	0.25	28%	0.279	C	S	.	.	S	Bend	trans	68.6	7.1	-177.6	-58	175.4	0	0	0	115.4	L568 P569 T644 P647	L568-H571 PolarHBondContact O-N 3.2Å; P569-H571 VanDerWaalsContact C-N 3.27Å; P569-H571 PolarHBondContact O-N 3.4Å; H571-T644 PolarHBondContact NE2-O 3.12Å; H571-T644 PolarHBondContact NE2-OG1 2.88Å; H571-P647 WeakPolarHBondContact ND1-CD 3.15Å
572	S	91.1	Very high	90.1	Very high	48 Å²	48	43.7 Å²	43.7	34%	0.336	25%	0.249	S	C	.	.			trans	-67.6	148.2	167.2	66.1	0	0	0	0	110.9	C567 L568 D570	C567-S572 CarbonylContact C-O 3.55Å; C567-S572 WeakPolarHBondContact CA-O 3.25Å; L568-S572 WeakPolarHBondContact CD1-OG 3.36Å; L568-S572 PolarHBondContact N-O 3.04Å; D570-S572 PolarHBondContact O-N 3.04Å; D570-S572 VanDerWaalsContact OD1-CB 3.31Å; D570-S572 WeakPolarHBondContact OD1-CB 3.31Å; D570-S572 PolarHBondContact OD1-N 3.25Å; D570-S572 PolarHBondContact OD1-OG 3.37Å; D570-S572 PolarHBondContact OD2-OG 2.88Å
573	V	90.9	Very high	90.3	Very high	73 Å²	73	43.1 Å²	43.1	44%	0.442	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.9	-175.1	-177.1	0	0	0	0	110.2	D565	D565-V573 HydrophobicContact CB-CG1 3.87Å
574	L	90.9	Very high	90.4	Very high	61 Å²	61	40.1 Å²	40.1	32%	0.319	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125	169.3	-82.5	158.2	0	0	0	109.3	I566 L568	I566-L574 PolarHBondContact N-O 2.87Å; I566-L574 PolarHBondContact O-N 3.28Å; L568-L574 HydrophobicContact CD1-CD1 4.08Å; L568-L574 HydrophobicContact CD2-CD1 4.21Å; L568-L574 HydrophobicContact CG-CD1 4.23Å
575	T	91.9	Very high	90.4	Very high	74 Å²	74	46.7 Å²	46.7	45%	0.454	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	115	178.6	-59.4	0	0	0	0	110.5	P563 Y564 D565	P563-T575 HydrophobicContact CB-CG2 3.77Å; Y564-T575 WeakPolarHBondContact O-CA 3.33Å; D565-T575 WeakPolarHBondContact OD1-CB 3.29Å; D565-T575 VanDerWaalsContact OD1-CG2 3.27Å; D565-T575 WeakPolarHBondContact OD1-CG2 3.4Å; D565-T575 PolarHBondContact OD1-OG1 3.18Å
576	L	90.7	Very high	90.5	Very high	16 Å²	16	48.4 Å²	48.4	8%	0.084	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.3	173.8	-61.1	-179	0	0	0	111.6	P563 Y564 I566 L578 A590 L591	P563-L576 CarbonylContact C-O 3.53Å; P563-L576 WeakPolarHBondContact CA-O 3.27Å; Y564-L576 PolarHBondContact N-O 2.83Å; Y564-L576 PolarHBondContact O-N 3.24Å; I566-L576 HydrophobicContact CD1-CD1 4.07Å; L576-L578 HydrophobicContact CB-CD1 4.13Å; L576-L578 HydrophobicContact CB-CG 4.09Å; L576-L578 HydrophobicContact CD1-CD1 4.2Å; L576-A590 HydrophobicContact CD1-CB 3.9Å; L576-L591 HydrophobicContact CD1-CD2 3.63Å; L576-L591 HydrophobicContact CD1-CG 3.65Å; L576-L591 HydrophobicContact CG-CD2 4.25Å
577	Q	91.9	Very high	90.4	Very high	106 Å²	106	48.4 Å²	48.4	50%	0.495	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	97	174.8	-69.6	-64.2	-29.6	0	0	110.5
578	L	91.1	Very high	90.4	Very high	23 Å²	23	49.7 Å²	49.7	12%	0.12	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	156.7	-173.7	-61.5	173.8	0	0	0	111.3	K561 V562 Y564 L576 A582 V587 A590	K561-L578 CarbonylContact C-O 3.56Å; K561-L578 VanDerWaalsContact CA-O 3.29Å; K561-L578 WeakPolarHBondContact CA-O 3.4Å; V562-L578 PolarHBondContact N-O 2.97Å; V562-L578 PolarHBondContact O-N 3.26Å; Y564-L578 HydrophobicContact CD2-CB 3.77Å; Y564-L578 HydrophobicContact CD2-CD1 4.26Å; Y564-L578 HydrophobicContact CD2-CG 4.36Å; Y564-L578 HydrophobicContact CE2-CB 3.73Å; Y564-L578 HydrophobicContact CG-CD1 4.26Å; L576-L578 HydrophobicContact CB-CD1 4.13Å; L576-L578 HydrophobicContact CB-CG 4.09Å; L576-L578 HydrophobicContact CD1-CD1 4.2Å; L578-A582 HydrophobicContact CB-CB 4Å; L578-V587 HydrophobicContact CD1-CB 4.12Å; L578-V587 HydrophobicContact CD1-CG1 4.33Å; L578-V587 HydrophobicContact CD1-CG2 3.69Å; L578-A590 HydrophobicContact CD1-CB 4.34Å; L578-A590 HydrophobicContact CD2-CB 3.89Å
579	P	89.3	Confident	90.4	Very high	55 Å²	55	50 Å²	50	36%	0.357	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	146.6	173.3	-25.1	34.4	0	0	0	112.2	D560 Y564 T581 A582	D560-P579 CarbonylContact O-C 3.6Å; D560-P579 WeakPolarHBondContact O-CA 3.35Å; Y564-P579 PolarHBondContact OH-O 2.74Å; P579-T581 PolarHBondContact O-N 2.88Å; P579-T581 VanDerWaalsContact O-N 3.12Å; P579-A582 WeakPolarHBondContact O-CB 3.4Å; P579-A582 PolarHBondContact O-N 3.32Å
580	V	87.5	Confident	90.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.8	177.8	73.3	0	0	0	0	112.4	I556 R557 D560 V562 G621 T624 T702 A704	I556-V580 HydrophobicContact CG2-CB 4.19Å; I556-V580 HydrophobicContact CG2-CG1 4.41Å; I556-V580 HydrophobicContact CG2-CG2 3.76Å; R557-V580 VanDerWaalsContact O-CG1 3.23Å; R557-V580 WeakPolarHBondContact O-CG1 3.5Å; D560-V580 PolarHBondContact O-N 3.38Å; V562-V580 HydrophobicContact CG1-CB 4.25Å; V562-V580 HydrophobicContact CG1-CG2 4.28Å; V562-V580 HydrophobicContact CG2-CB 4.45Å; V580-G621 VanDerWaalsContact O-CA 3.23Å; V580-G621 WeakPolarHBondContact O-CA 3.24Å; V580-T624 HydrophobicContact CG2-CG2 3.51Å; V580-T702 HydrophobicContact CG1-CG2 4.5Å; V580-A704 HydrophobicContact CG2-CB 4Å
581	T	87.4	Confident	90.6	Very high	21 Å²	21	42.4 Å²	42.4	13%	0.129	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	9.1	179	53	0	0	0	0	114	V558 P579 S583 R620	V558-T581 HydrophobicContact CG1-CG2 3.9Å; P579-T581 PolarHBondContact O-N 2.88Å; P579-T581 VanDerWaalsContact O-N 3.12Å; T581-S583 PolarHBondContact O-N 3.4Å; T581-R620 WeakPolarHBondContact O-CB 3.07Å; T581-R620 WeakPolarHBondContact O-CG 3.22Å
582	A	89.4	Confident	90.3	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.017	24%	0.24	C	C	.	.			trans	-54.4	135.4	-179	0	0	0	0	0	111.4	L578 P579 E586 V587 R620 G621	L578-A582 HydrophobicContact CB-CB 4Å; P579-A582 WeakPolarHBondContact O-CB 3.4Å; P579-A582 PolarHBondContact O-N 3.32Å; A582-E586 WeakPolarHBondContact CA-OE2 3.37Å; A582-V587 HydrophobicContact CB-CG2 4.41Å; A582-R620 WeakPolarHBondContact O-CA 3.44Å; A582-G621 PolarHBondContact O-N 2.93Å; A582-G621 VanDerWaalsContact O-N 3.08Å
583	S	90.3	Very high	89.8	Confident	10 Å²	10	47.9 Å²	47.9	7%	0.07	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-81.2	157.3	174.7	60.8	0	0	0	0	111.6	T581 R585 E586 V587 A619	T581-S583 PolarHBondContact O-N 3.4Å; S583-R585 PolarHBondContact O-N 3.48Å; S583-E586 PolarHBondContact N-OE2 2.95Å; S583-E586 PolarHBondContact O-N 3.19Å; S583-E586 VanDerWaalsContact OG-CG 3.28Å; S583-E586 WeakPolarHBondContact OG-CG 3.36Å; S583-E586 PolarHBondContact OG-N 3.48Å; S583-E586 PolarHBondContact OG-OE2 2.85Å; S583-V587 WeakPolarHBondContact O-CG2 3.31Å; S583-V587 PolarHBondContact O-N 3.04Å; S583-A619 CarbonylContact C-O 3.56Å; S583-A619 WeakPolarHBondContact CA-O 3.42Å
584	V	91.1	Very high	89.1	Confident	6 Å²	6	49 Å²	49	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-55.8	-37.8	173.5	174.7	0	0	0	0	111	E586 V587 M588 L603 L615 Q616 A619 V622	V584-E586 PolarHBondContact O-N 3.43Å; V584-V587 PolarHBondContact O-N 3.47Å; V584-M588 HydrophobicContact CG1-CG 4.17Å; V584-M588 WeakPolarHBondContact O-CB 3.47Å; V584-M588 WeakPolarHBondContact O-CG 3.32Å; V584-M588 PolarHBondContact O-N 3.15Å; V584-L603 HydrophobicContact CG1-CB 3.95Å; V584-L603 HydrophobicContact CG1-CD2 3.98Å; V584-L603 HydrophobicContact CG2-CD2 4.16Å; V584-L615 HydrophobicContact CG2-CB 3.88Å; V584-L615 HydrophobicContact CG2-CD1 4.45Å; V584-Q616 WeakPolarHBondContact CB-O 3.47Å; V584-Q616 VanDerWaalsContact CG2-O 3.3Å; V584-Q616 WeakPolarHBondContact CG2-O 3.12Å; V584-A619 HydrophobicContact CG2-CB 4.1Å; V584-A619 PolarHBondContact N-O 3.01Å; V584-V622 HydrophobicContact CG2-CG1 3.79Å; V584-V622 HydrophobicContact CG2-CG2 4.47Å
585	R	91.5	Very high	87.6	Confident	138 Å²	138	54.4 Å²	54.4	52%	0.521	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-44	172.5	-78	-175.7	-173.1	137	17.8	113.1	S583 M588 A589 P617 D618	S583-R585 PolarHBondContact O-N 3.48Å; R585-M588 PolarHBondContact O-N 3.27Å; R585-A589 VanDerWaalsContact O-CB 3.26Å; R585-A589 WeakPolarHBondContact O-CB 3.5Å; R585-A589 PolarHBondContact O-N 3.28Å; R585-P617 HydrophobicContact CG-CB 3.66Å; R585-P617 WeakPolarHBondContact CG-O 3.24Å; R585-P617 PolarHBondContact N-O 3.29Å; R585-D618 IonicContact CZ-OD1 3.92Å; R585-D618 IonicContact CZ-OD2 3.23Å; R585-D618 IonicContact NE-OD1 2.73Å; R585-D618 IonicContact NH1-OD1 3.73Å; R585-D618 PolarHBondContact NH1-OD1 2.86Å; R585-D618 IonicContact NH1-OD2 3.81Å; R585-D618 IonicContact NH2-OD1 2.85Å; R585-D618 PolarHBondContact NH2-OD1 3.43Å; R585-D618 IonicContact NH2-OD2 3.72Å; R585-D618 PolarHBondContact NH2-OD2 2.98Å
586	E	91.8	Very high	86.2	Confident	93 Å²	93	54.7 Å²	54.7	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-68.8	-38	178.7	-72.1	157.6	161.9	0	0	111.5	A582 S583 V584 A589 A590	A582-E586 WeakPolarHBondContact CA-OE2 3.37Å; S583-E586 PolarHBondContact N-OE2 2.95Å; S583-E586 PolarHBondContact O-N 3.19Å; S583-E586 VanDerWaalsContact OG-CG 3.28Å; S583-E586 WeakPolarHBondContact OG-CG 3.36Å; S583-E586 PolarHBondContact OG-N 3.48Å; S583-E586 PolarHBondContact OG-OE2 2.85Å; V584-E586 PolarHBondContact O-N 3.43Å; E586-A589 PolarHBondContact O-N 2.87Å; E586-A590 WeakPolarHBondContact O-CB 3.44Å; E586-A590 PolarHBondContact O-N 2.98Å
587	V	92	Very high	85	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-49.5	173.4	177.2	0	0	0	0	110.6	Y564 I566 L578 A582 S583 V584 A589 A590 L591 L603	Y564-V587 HydrophobicContact CD1-CG2 3.88Å; Y564-V587 HydrophobicContact CE1-CG2 3.71Å; I566-V587 HydrophobicContact CD1-CG1 3.59Å; L578-V587 HydrophobicContact CD1-CB 4.12Å; L578-V587 HydrophobicContact CD1-CG1 4.33Å; L578-V587 HydrophobicContact CD1-CG2 3.69Å; A582-V587 HydrophobicContact CB-CG2 4.41Å; S583-V587 WeakPolarHBondContact O-CG2 3.31Å; S583-V587 PolarHBondContact O-N 3.04Å; V584-V587 PolarHBondContact O-N 3.47Å; V587-A589 VanDerWaalsContact C-N 3.32Å; V587-A589 PolarHBondContact O-N 3.22Å; V587-A590 PolarHBondContact O-N 2.99Å; V587-L591 HydrophobicContact CG1-CD1 4.37Å; V587-L591 WeakPolarHBondContact O-CG 3.12Å; V587-L591 PolarHBondContact O-N 3.22Å; V587-L603 HydrophobicContact CG1-CD2 4.12Å
588	M	91.8	Very high	83.7	Confident	30 Å²	30	55.7 Å²	55.7	15%	0.148	31%	0.314	C	S	.	.	H	α-helix	trans	-66.2	-34.4	179	-65.8	-62.4	-78.6	0	0	112.3	V584 R585 L591 A592 W597 Q601 L603 V634	V584-M588 HydrophobicContact CG1-CG 4.17Å; V584-M588 WeakPolarHBondContact O-CB 3.47Å; V584-M588 WeakPolarHBondContact O-CG 3.32Å; V584-M588 PolarHBondContact O-N 3.15Å; R585-M588 PolarHBondContact O-N 3.27Å; M588-L591 PolarHBondContact O-N 2.87Å; M588-L591 HydrophobicContact SD-CD1 4.06Å; M588-A592 PolarHBondContact O-N 3.47Å; M588-W597 HydrophobicContact CE-CH2 3.44Å; M588-W597 VanDerWaalsContact CE-CH2 3.44Å; M588-W597 HydrophobicContact CE-CZ2 3.61Å; M588-W597 HydrophobicContact SD-CH2 3.89Å; M588-W597 HydrophobicContact SD-CZ2 4.45Å; M588-Q601 HydrophobicContact CE-CB 4.3Å; M588-Q601 WeakPolarHBondContact CE-O 3.46Å; M588-L603 HydrophobicContact SD-CB 3.88Å; M588-V634 HydrophobicContact SD-CG2 4.26Å
589	A	91	Very high	82.6	Confident	56 Å²	56	64.6 Å²	64.6	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-68.3	-35.8	174.6	0	0	0	0	0	112.4	R585 E586 V587 A592	R585-A589 VanDerWaalsContact O-CB 3.26Å; R585-A589 WeakPolarHBondContact O-CB 3.5Å; R585-A589 PolarHBondContact O-N 3.28Å; E586-A589 PolarHBondContact O-N 2.87Å; V587-A589 VanDerWaalsContact C-N 3.32Å; V587-A589 PolarHBondContact O-N 3.22Å; A589-A592 PolarHBondContact O-N 2.78Å
590	A	90.8	Very high	82	Confident	20 Å²	20	64.5 Å²	64.5	17%	0.165	36%	0.36	C	S	.	.	H	α-helix	trans	-67.6	-41.6	174	0	0	0	0	0	111.5	L576 L578 E586 V587 A592 Q593	L576-A590 HydrophobicContact CD1-CB 3.9Å; L578-A590 HydrophobicContact CD1-CB 4.34Å; L578-A590 HydrophobicContact CD2-CB 3.89Å; E586-A590 WeakPolarHBondContact O-CB 3.44Å; E586-A590 PolarHBondContact O-N 2.98Å; V587-A590 PolarHBondContact O-N 2.99Å; A590-A592 VanDerWaalsContact C-N 3.31Å; A590-A592 PolarHBondContact O-N 2.89Å; A590-Q593 WeakPolarHBondContact O-CB 3.49Å; A590-Q593 PolarHBondContact O-N 3.3Å
591	L	88.3	Confident	82	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-64.8	-32.4	174.9	-71.7	168.1	0	0	0	113.5	I566 L576 V587 M588 Q593 E594 W597 V634	I566-L591 HydrophobicContact CD1-CD1 3.84Å; I566-L591 HydrophobicContact CD1-CD2 4.06Å; I566-L591 HydrophobicContact CD1-CG 4.16Å; I566-L591 HydrophobicContact CG2-CD1 4.5Å; L576-L591 HydrophobicContact CD1-CD2 3.63Å; L576-L591 HydrophobicContact CD1-CG 3.65Å; L576-L591 HydrophobicContact CG-CD2 4.25Å; V587-L591 HydrophobicContact CG1-CD1 4.37Å; V587-L591 WeakPolarHBondContact O-CG 3.12Å; V587-L591 PolarHBondContact O-N 3.22Å; M588-L591 PolarHBondContact O-N 2.87Å; M588-L591 HydrophobicContact SD-CD1 4.06Å; L591-Q593 PolarHBondContact O-N 3.43Å; L591-Q593 VanDerWaalsContact O-N 3.15Å; L591-E594 WeakPolarHBondContact O-CB 3.43Å; L591-E594 PolarHBondContact O-N 3.26Å; L591-W597 HydrophobicContact CB-CE3 3.84Å; L591-W597 HydrophobicContact CB-CH2 3.68Å; L591-W597 HydrophobicContact CB-CZ3 3.3Å; L591-W597 HydrophobicContact CD1-CH2 3.95Å; L591-W597 HydrophobicContact CD1-CZ3 3.87Å; L591-W597 HydrophobicContact CG-CZ3 4.15Å; L591-V634 HydrophobicContact CD1-CG2 3.63Å
592	A	84.6	Confident	82.1	Confident	50 Å²	50	68 Å²	68	41%	0.413	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.1	177.1	0	0	0	0	0	114	M588 A589 A590 W597	M588-A592 PolarHBondContact O-N 3.47Å; A589-A592 PolarHBondContact O-N 2.78Å; A590-A592 VanDerWaalsContact C-N 3.31Å; A590-A592 PolarHBondContact O-N 2.89Å; A592-W597 HydrophobicContact CB-CD2 4.27Å; A592-W597 HydrophobicContact CB-CG 4.15Å
593	Q	80.8	Confident	82.3	Confident	167 Å²	167	68.1 Å²	68.1	78%	0.78	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-10.9	174	-61.1	179.3	8.8	0	0	112.6	A590 L591	A590-Q593 WeakPolarHBondContact O-CB 3.49Å; A590-Q593 PolarHBondContact O-N 3.3Å; L591-Q593 PolarHBondContact O-N 3.43Å; L591-Q593 VanDerWaalsContact O-N 3.15Å
594	E	77.1	Confident	82.4	Confident	97 Å²	97	67.8 Å²	67.8	45%	0.453	38%	0.376	S	S	.	.	S	Bend	trans	-86.2	147.8	177.1	-61.1	-66.5	148.5	0	0	111.1	L591 G596	L591-E594 WeakPolarHBondContact O-CB 3.43Å; L591-E594 PolarHBondContact O-N 3.26Å; E594-G596 PolarHBondContact O-N 3Å
595	D	58.5	Low	82.5	Confident	174 Å²	174	68.5 Å²	68.5	93%	0.93	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	131.1	-178.4	-76.8	-38.6	0	0	0	111.6
596	G	62.6	Low	82.6	Confident	79 Å²	79	62 Å²	62	81%	0.814	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	104	6.9	177.2	0	0	0	0	0	116	E594	E594-G596 PolarHBondContact O-N 3Å
597	W	65.8	Low	82.6	Confident	75 Å²	75	59.1 Å²	59.1	28%	0.284	34%	0.342	S	S	.	.			trans	-68	134.6	-178.5	-170.5	-101.8	0	0	0	114.5	M588 L591 A592 Q601 V634	M588-W597 HydrophobicContact CE-CH2 3.44Å; M588-W597 VanDerWaalsContact CE-CH2 3.44Å; M588-W597 HydrophobicContact CE-CZ2 3.61Å; M588-W597 HydrophobicContact SD-CH2 3.89Å; M588-W597 HydrophobicContact SD-CZ2 4.45Å; L591-W597 HydrophobicContact CB-CE3 3.84Å; L591-W597 HydrophobicContact CB-CH2 3.68Å; L591-W597 HydrophobicContact CB-CZ3 3.3Å; L591-W597 HydrophobicContact CD1-CH2 3.95Å; L591-W597 HydrophobicContact CD1-CZ3 3.87Å; L591-W597 HydrophobicContact CG-CZ3 4.15Å; A592-W597 HydrophobicContact CB-CD2 4.27Å; A592-W597 HydrophobicContact CB-CG 4.15Å; W597-Q601 HydrophobicContact CH2-CB 4.37Å; W597-Q601 HydrophobicContact CZ2-CB 4.44Å; W597-V634 HydrophobicContact CH2-CG1 4Å; W597-V634 HydrophobicContact CZ3-CG1 3.95Å
598	T	65.4	Low	82.6	Confident	69 Å²	69	59.5 Å²	59.5	42%	0.423	35%	0.345	S	S	.	.			trans	-111.1	131.5	172.1	48.8	0	0	0	0	111	G600 Q601	T598-G600 PolarHBondContact O-N 3.16Å; T598-Q601 PolarHBondContact OG1-NE2 2.74Å; T598-Q601 VanDerWaalsContact OG1-NE2 3.15Å
599	K	66.9	Low	82.5	Confident	210 Å²	210	59.9 Å²	59.9	91%	0.913	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	122.4	177.8	-75.5	-176.7	178.1	178	0	109.8
600	G	77.8	Confident	82.3	Confident	53 Å²	53	58.5 Å²	58.5	55%	0.546	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	119.9	-2.2	173.7	0	0	0	0	0	115.7	T598 P637	T598-G600 PolarHBondContact O-N 3.16Å; G600-P637 VanDerWaalsContact O-CD 3.25Å; G600-P637 WeakPolarHBondContact O-CD 3.18Å
601	Q	86.7	Confident	82.3	Confident	42 Å²	42	59.9 Å²	59.9	20%	0.196	35%	0.349	C	S	.	.			trans	-66.2	154.2	173.7	-67.6	-178.1	-25	0	0	112.1	M588 W597 T598 V634 V635 N636	M588-Q601 HydrophobicContact CE-CB 4.3Å; M588-Q601 WeakPolarHBondContact CE-O 3.46Å; W597-Q601 HydrophobicContact CH2-CB 4.37Å; W597-Q601 HydrophobicContact CZ2-CB 4.44Å; T598-Q601 PolarHBondContact OG1-NE2 2.74Å; T598-Q601 VanDerWaalsContact OG1-NE2 3.15Å; Q601-V634 HydrophobicContact CB-CG1 3.81Å; Q601-V634 HydrophobicContact CG-CG1 4.41Å; Q601-V635 WeakPolarHBondContact CA-O 3.49Å; Q601-N636 WeakPolarHBondContact CG-OD1 3.46Å
602	V	90	Very high	82.3	Confident	53 Å²	53	61.2 Å²	61.2	32%	0.321	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.1	179.6	-69.1	0	0	0	0	110.6	V604 V635 P637	V602-V604 HydrophobicContact CG2-CG1 3.93Å; V602-V635 HydrophobicContact CG2-CG1 4.37Å; V602-V635 WeakPolarHBondContact CG2-O 3.49Å; V602-V635 PolarHBondContact N-O 3.25Å; V602-V635 PolarHBondContact O-N 3.33Å; V602-V635 VanDerWaalsContact O-N 3.17Å; V602-P637 HydrophobicContact CG1-CG 3.92Å; V602-P637 HydrophobicContact CG2-CG 4.07Å
603	L	92.9	Very high	82.5	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121	171.8	-168.2	69.6	0	0	0	108.9	I566 V584 V587 M588 L615 V622 L632 F633 V634	I566-L603 HydrophobicContact CG2-CD1 4.35Å; V584-L603 HydrophobicContact CG1-CB 3.95Å; V584-L603 HydrophobicContact CG1-CD2 3.98Å; V584-L603 HydrophobicContact CG2-CD2 4.16Å; V587-L603 HydrophobicContact CG1-CD2 4.12Å; M588-L603 HydrophobicContact SD-CB 3.88Å; L603-L615 HydrophobicContact CD2-CD1 3.9Å; L603-L615 HydrophobicContact CG-CD1 4.06Å; L603-L615 PolarHBondContact O-N 3.17Å; L603-V622 HydrophobicContact CD2-CG2 4.37Å; L603-L632 HydrophobicContact CD1-CB 4.24Å; L603-L632 HydrophobicContact CD2-CD2 4.48Å; L603-L632 HydrophobicContact CG-CD2 4.49Å; L603-F633 WeakPolarHBondContact CA-O 3.2Å; L603-V634 HydrophobicContact CD1-CG2 3.43Å; L603-V634 VanDerWaalsContact CD1-CG2 3.43Å
604	V	93.4	Very high	82.9	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.8	178.2	-52.7	0	0	0	0	109.9	V602 V606 I613 L632 F633 V635 V640 L643	V602-V604 HydrophobicContact CG2-CG1 3.93Å; V604-V606 HydrophobicContact CG2-CG2 4.12Å; V604-I613 CarbonylContact C-O 3.58Å; V604-I613 WeakPolarHBondContact CA-O 3.3Å; V604-L632 CarbonylContact O-C 3.59Å; V604-L632 WeakPolarHBondContact O-CA 3.41Å; V604-F633 HydrophobicContact CG2-CB 3.67Å; V604-F633 PolarHBondContact N-O 3.39Å; V604-F633 PolarHBondContact O-N 3.11Å; V604-V635 HydrophobicContact CG1-CG1 3.96Å; V604-V635 HydrophobicContact CG2-CG1 3.89Å; V604-V640 HydrophobicContact CG1-CG2 4.32Å; V604-L643 HydrophobicContact CG2-CD1 3.66Å
605	K	93.1	Very high	83.5	Confident	22 Å²	22	55.2 Å²	55.2	10%	0.096	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.8	171.7	-173.7	-179	75.1	151.6	0	108.5	A612 I613 L615 L626 E630 R631 L632	K605-A612 CarbonylContact O-C 3.55Å; K605-A612 WeakPolarHBondContact O-CA 3.33Å; K605-I613 PolarHBondContact N-O 2.95Å; K605-I613 PolarHBondContact O-N 3.29Å; K605-L615 HydrophobicContact CB-CD1 4.47Å; K605-L615 HydrophobicContact CB-CD2 4.2Å; K605-L615 HydrophobicContact CB-CG 4.4Å; K605-L626 HydrophobicContact CD-CD2 3.64Å; K605-L626 HydrophobicContact CG-CD2 3.77Å; K605-E630 HydrophobicContact CD-CB 4.39Å; K605-E630 WeakPolarHBondContact CD-OE2 3.31Å; K605-E630 VanDerWaalsContact CE-OE1 3.31Å; K605-E630 WeakPolarHBondContact CE-OE1 3.36Å; K605-E630 VanDerWaalsContact CE-OE2 3.25Å; K605-E630 WeakPolarHBondContact CE-OE2 3.43Å; K605-E630 HydrophobicContact CG-CB 4.2Å; K605-E630 IonicContact NZ-OE1 3.59Å; K605-E630 PolarHBondContact NZ-OE1 3.25Å; K605-E630 IonicContact NZ-OE2 3.45Å; K605-E630 PolarHBondContact NZ-OE2 2.81Å; K605-R631 WeakPolarHBondContact CA-O 3.27Å; K605-L632 HydrophobicContact CB-CD2 4.46Å
606	V	93.4	Very high	84.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.6	-179.2	-176.1	0	0	0	0	109.3	V604 D611 A612 E630 R631 F633 L643 Q649	V604-V606 HydrophobicContact CG2-CG2 4.12Å; V606-D611 WeakPolarHBondContact CA-O 3.3Å; V606-A612 HydrophobicContact CG2-CB 4Å; V606-E630 WeakPolarHBondContact O-CA 3.25Å; V606-R631 PolarHBondContact N-O 2.91Å; V606-R631 PolarHBondContact O-N 2.78Å; V606-F633 HydrophobicContact CB-CD2 3.65Å; V606-F633 HydrophobicContact CB-CE2 3.68Å; V606-F633 HydrophobicContact CG1-CE2 4.31Å; V606-F633 HydrophobicContact CG2-CB 4.21Å; V606-F633 HydrophobicContact CG2-CD2 3.35Å; V606-F633 HydrophobicContact CG2-CE2 3.83Å; V606-F633 HydrophobicContact CG2-CG 3.91Å; V606-L643 HydrophobicContact CG2-CD1 4.11Å; V606-Q649 PolarHBondContact O-NE2 3.2Å
607	N	91.9	Very high	86.1	Confident	33 Å²	33	52.5 Å²	52.5	18%	0.176	31%	0.306	C	S	.	.			trans	-91.8	173.8	176.3	74.4	11.7	0	0	0	112.5	A609 G610 D611 E630	N607-A609 PolarHBondContact O-N 3.29Å; N607-A609 WeakPolarHBondContact OD1-CA 3.25Å; N607-A609 WeakPolarHBondContact OD1-CB 3.48Å; N607-A609 PolarHBondContact OD1-N 3.18Å; N607-G610 PolarHBondContact O-N 3.22Å; N607-G610 VanDerWaalsContact O-N 3.1Å; N607-G610 PolarHBondContact OD1-N 3.02Å; N607-D611 PolarHBondContact N-O 2.96Å; N607-D611 WeakPolarHBondContact ND2-CB 3.21Å; N607-D611 PolarHBondContact ND2-OD2 3.37Å; N607-D611 PolarHBondContact OD1-N 2.92Å; N607-E630 HydrophobicContact CB-CG 4.08Å
608	S	92.1	Very high	87.2	Confident	8 Å²	8	53.5 Å²	53.5	6%	0.056	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-9.3	178	57	0	0	0	0	114.8	Q649 D911 N912	S608-Q649 WeakPolarHBondContact CB-O 3.37Å; S608-D911 WeakPolarHBondContact CB-OD1 3.46Å; S608-D911 PolarHBondContact OG-OD1 3.45Å; S608-N912 PolarHBondContact O-ND2 3.47Å
609	A	89.3	Confident	88.1	Confident	39 Å²	39	51.7 Å²	51.7	32%	0.322	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.6	173.3	0	0	0	0	0	113.2	N607	N607-A609 PolarHBondContact O-N 3.29Å; N607-A609 WeakPolarHBondContact OD1-CA 3.25Å; N607-A609 WeakPolarHBondContact OD1-CB 3.48Å; N607-A609 PolarHBondContact OD1-N 3.18Å
610	G	87.9	Confident	89	Confident	26 Å²	26	45.3 Å²	45.3	27%	0.268	28%	0.279	S	S	.	.			trans	89.8	5.5	-175.7	0	0	0	0	0	114.6	N607 A612 P645	N607-G610 PolarHBondContact O-N 3.22Å; N607-G610 VanDerWaalsContact O-N 3.1Å; N607-G610 PolarHBondContact OD1-N 3.02Å; G610-A612 PolarHBondContact O-N 3.43Å; G610-P645 VanDerWaalsContact CA-CG 3.49Å
611	D	89.1	Confident	89.2	Confident	50 Å²	50	43.3 Å²	43.3	27%	0.267	26%	0.258	S	S	.	.			trans	-74.5	124.9	173.6	-49.7	-58.3	0	0	0	109.4	V606 N607	V606-D611 WeakPolarHBondContact CA-O 3.3Å; N607-D611 PolarHBondContact N-O 2.96Å; N607-D611 WeakPolarHBondContact ND2-CB 3.21Å; N607-D611 PolarHBondContact ND2-OD2 3.37Å; N607-D611 PolarHBondContact OD1-N 2.92Å
612	A	89.8	Confident	89.1	Confident	33 Å²	33	41.6 Å²	41.6	27%	0.273	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.5	178.4	0	0	0	0	0	111.3	K605 V606 G610 V640	K605-A612 CarbonylContact O-C 3.55Å; K605-A612 WeakPolarHBondContact O-CA 3.33Å; V606-A612 HydrophobicContact CG2-CB 4Å; G610-A612 PolarHBondContact O-N 3.43Å; A612-V640 HydrophobicContact CB-CG1 3.88Å
613	I	89	Confident	88.7	Confident	96 Å²	96	40 Å²	40	49%	0.492	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.2	179.8	-58.8	175.9	0	0	0	109.5	V604 K605	V604-I613 CarbonylContact C-O 3.58Å; V604-I613 WeakPolarHBondContact CA-O 3.3Å; K605-I613 PolarHBondContact N-O 2.95Å; K605-I613 PolarHBondContact O-N 3.29Å
614	G	89.1	Confident	88.1	Confident	50 Å²	50	41.2 Å²	41.2	52%	0.515	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.2	173.5	0	0	0	0	0	112.5
615	L	88.9	Confident	87.6	Confident	41 Å²	41	43.8 Å²	43.8	22%	0.215	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-91.5	138.5	179.6	-61.6	176.9	0	0	0	111.2	V584 L603 K605 V622 L632	V584-L615 HydrophobicContact CG2-CB 3.88Å; V584-L615 HydrophobicContact CG2-CD1 4.45Å; L603-L615 HydrophobicContact CD2-CD1 3.9Å; L603-L615 HydrophobicContact CG-CD1 4.06Å; L603-L615 PolarHBondContact O-N 3.17Å; K605-L615 HydrophobicContact CB-CD1 4.47Å; K605-L615 HydrophobicContact CB-CD2 4.2Å; K605-L615 HydrophobicContact CB-CG 4.4Å; L615-V622 HydrophobicContact CD1-CB 4.12Å; L615-V622 HydrophobicContact CD1-CG1 4.09Å; L615-V622 HydrophobicContact CD1-CG2 4.46Å; L615-L632 HydrophobicContact CD1-CD2 3.59Å
616	Q	89	Confident	87.2	Confident	142 Å²	142	44 Å²	44	66%	0.664	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-68.6	140.7	178.6	-67.7	-61.9	-26.3	0	0	110.9	V584 D618 A619	V584-Q616 WeakPolarHBondContact CB-O 3.47Å; V584-Q616 VanDerWaalsContact CG2-O 3.3Å; V584-Q616 WeakPolarHBondContact CG2-O 3.12Å; Q616-D618 PolarHBondContact O-N 3.12Å; Q616-D618 VanDerWaalsContact O-N 3.13Å; Q616-A619 HydrophobicContact CB-CB 4.38Å; Q616-A619 VanDerWaalsContact O-CB 3.26Å; Q616-A619 WeakPolarHBondContact O-CB 3.46Å; Q616-A619 PolarHBondContact O-N 2.98Å
617	P	87.8	Confident	86.8	Confident	55 Å²	55	45.3 Å²	45.3	36%	0.357	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.9	-177.1	-26.1	34.3	0	0	0	114.2	R585	R585-P617 HydrophobicContact CG-CB 3.66Å; R585-P617 WeakPolarHBondContact CG-O 3.24Å; R585-P617 PolarHBondContact N-O 3.29Å
618	D	87.1	Confident	86.5	Confident	95 Å²	95	44.5 Å²	44.5	51%	0.508	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.2	-179.1	-67.1	-57	0	0	0	113.6	R585 Q616	R585-D618 IonicContact CZ-OD1 3.92Å; R585-D618 IonicContact CZ-OD2 3.23Å; R585-D618 IonicContact NE-OD1 2.73Å; R585-D618 IonicContact NH1-OD1 3.73Å; R585-D618 PolarHBondContact NH1-OD1 2.86Å; R585-D618 IonicContact NH1-OD2 3.81Å; R585-D618 IonicContact NH2-OD1 2.85Å; R585-D618 PolarHBondContact NH2-OD1 3.43Å; R585-D618 IonicContact NH2-OD2 3.72Å; R585-D618 PolarHBondContact NH2-OD2 2.98Å; Q616-D618 PolarHBondContact O-N 3.12Å; Q616-D618 VanDerWaalsContact O-N 3.13Å
619	A	84.9	Confident	86.5	Confident	32 Å²	32	45.4 Å²	45.4	26%	0.264	28%	0.284	S	S	.	.			trans	-66.3	138.6	175.8	0	0	0	0	0	110.5	S583 V584 Q616 V622	S583-A619 CarbonylContact C-O 3.56Å; S583-A619 WeakPolarHBondContact CA-O 3.42Å; V584-A619 HydrophobicContact CG2-CB 4.1Å; V584-A619 PolarHBondContact N-O 3.01Å; Q616-A619 HydrophobicContact CB-CB 4.38Å; Q616-A619 VanDerWaalsContact O-CB 3.26Å; Q616-A619 WeakPolarHBondContact O-CB 3.46Å; Q616-A619 PolarHBondContact O-N 2.98Å; A619-V622 HydrophobicContact CB-CG1 4.15Å
620	R	85.4	Confident	86.6	Confident	76 Å²	76	45 Å²	45	29%	0.287	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-121.4	155.2	-175.6	-71.9	-177	170.7	-141.7	-13.9	111.3	T581 A582 V622 R699 D700	T581-R620 WeakPolarHBondContact O-CB 3.07Å; T581-R620 WeakPolarHBondContact O-CG 3.22Å; A582-R620 WeakPolarHBondContact O-CA 3.44Å; R620-V622 VanDerWaalsContact C-N 3.25Å; R620-V622 PolarHBondContact O-N 2.96Å; R620-R699 PolarHBondContact NH1-O 3.2Å; R620-D700 IonicContact NH1-OD1 2.65Å
621	G	82.4	Confident	86.9	Confident	10 Å²	10	47.8 Å²	47.8	10%	0.103	28%	0.278	C	S	.	.			trans	66.1	28.3	175.5	0	0	0	0	0	114	V580 A582 A623 T624 S625	V580-G621 VanDerWaalsContact O-CA 3.23Å; V580-G621 WeakPolarHBondContact O-CA 3.24Å; A582-G621 PolarHBondContact O-N 2.93Å; A582-G621 VanDerWaalsContact O-N 3.08Å; G621-A623 PolarHBondContact O-N 2.63Å; G621-T624 PolarHBondContact O-N 2.85Å; G621-T624 VanDerWaalsContact O-N 3.16Å; G621-T624 PolarHBondContact O-OG1 2.8Å; G621-T624 VanDerWaalsContact O-OG1 3.1Å; G621-S625 PolarHBondContact O-N 3.47Å; G621-S625 PolarHBondContact O-OG 3.49Å
622	V	85.5	Confident	87.1	Confident	6 Å²	6	45.5 Å²	45.5	4%	0.036	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.3	-171.4	-62.9	0	0	0	0	112.3	Y564 V584 L603 L615 A619 R620 S625 L626 L632	Y564-V622 HydrophobicContact CD1-CG2 4.45Å; Y564-V622 HydrophobicContact CE1-CG2 3.76Å; V584-V622 HydrophobicContact CG2-CG1 3.79Å; V584-V622 HydrophobicContact CG2-CG2 4.47Å; L603-V622 HydrophobicContact CD2-CG2 4.37Å; L615-V622 HydrophobicContact CD1-CB 4.12Å; L615-V622 HydrophobicContact CD1-CG1 4.09Å; L615-V622 HydrophobicContact CD1-CG2 4.46Å; A619-V622 HydrophobicContact CB-CG1 4.15Å; R620-V622 VanDerWaalsContact C-N 3.25Å; R620-V622 PolarHBondContact O-N 2.96Å; V622-S625 WeakPolarHBondContact CA-OG 3.49Å; V622-S625 PolarHBondContact O-N 2.78Å; V622-S625 PolarHBondContact O-OG 2.85Å; V622-L626 WeakPolarHBondContact O-CG 3.39Å; V622-L632 HydrophobicContact CG2-CD1 4.17Å
623	A	81.6	Confident	87.3	Confident	21 Å²	21	43.9 Å²	43.9	17%	0.174	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-38.1	177.3	0	0	0	0	0	113.7	Y564 G621	Y564-A623 HydrophobicContact CD1-CB 3.72Å; Y564-A623 HydrophobicContact CD2-CB 4.09Å; Y564-A623 HydrophobicContact CE1-CB 3.48Å; Y564-A623 VanDerWaalsContact CE1-CB 3.48Å; Y564-A623 HydrophobicContact CE2-CB 3.88Å; Y564-A623 HydrophobicContact CG-CB 4Å; G621-A623 PolarHBondContact O-N 2.63Å
624	T	80.1	Confident	87.4	Confident	29 Å²	29	39.4 Å²	39.4	18%	0.178	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-24	179.5	59.9	0	0	0	0	112.5	V580 G621 L626 A704 E707	V580-T624 HydrophobicContact CG2-CG2 3.51Å; G621-T624 PolarHBondContact O-N 2.85Å; G621-T624 VanDerWaalsContact O-N 3.16Å; G621-T624 PolarHBondContact O-OG1 2.8Å; G621-T624 VanDerWaalsContact O-OG1 3.1Å; T624-L626 VanDerWaalsContact C-N 3.33Å; T624-L626 PolarHBondContact O-N 3.22Å; T624-A704 HydrophobicContact CG2-CB 3.78Å; T624-E707 VanDerWaalsContact C-OE2 3.32Å; T624-E707 PolarHBondContact OG1-OE2 3.45Å
625	S	81.8	Confident	87.5	Confident	56 Å²	56	37.1 Å²	37.1	39%	0.392	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	1.2	-179.4	74.1	0	0	0	0	115.1	G621 V622 E707	G621-S625 PolarHBondContact O-N 3.47Å; G621-S625 PolarHBondContact O-OG 3.49Å; V622-S625 WeakPolarHBondContact CA-OG 3.49Å; V622-S625 PolarHBondContact O-N 2.78Å; V622-S625 PolarHBondContact O-OG 2.85Å; S625-E707 PolarHBondContact N-OE2 2.83Å
626	L	84.8	Confident	87.6	Confident	25 Å²	25	37.3 Å²	37.3	13%	0.131	21%	0.207	C	C	.	.			trans	-65	139	178.5	-65.7	177.4	0	0	0	111.6	K605 V622 T624 E630 L632 R711	K605-L626 HydrophobicContact CD-CD2 3.64Å; K605-L626 HydrophobicContact CG-CD2 3.77Å; V622-L626 WeakPolarHBondContact O-CG 3.39Å; T624-L626 VanDerWaalsContact C-N 3.33Å; T624-L626 PolarHBondContact O-N 3.22Å; L626-E630 HydrophobicContact CB-CB 4.34Å; L626-E630 HydrophobicContact CD2-CB 4.25Å; L626-L632 HydrophobicContact CD1-CG 4.23Å; L626-L632 HydrophobicContact CD2-CD2 3.9Å; L626-L632 HydrophobicContact CD2-CG 4.12Å; L626-R711 PolarHBondContact O-NH1 3.02Å
627	G	84.9	Confident	87.5	Confident	28 Å²	28	34 Å²	34	29%	0.289	20%	0.198	S	C	.	.			trans	-63.7	172.4	164.9	0	0	0	0	0	112.2	N629 E630 R711	G627-N629 PolarHBondContact O-N 2.87Å; G627-E630 WeakPolarHBondContact CA-OE2 3.38Å; G627-E630 PolarHBondContact N-OE2 3.36Å; G627-E630 PolarHBondContact O-N 3.4Å; G627-R711 PolarHBondContact O-NH1 3.49Å
628	L	86.6	Confident	87.4	Confident	17 Å²	17	39.9 Å²	39.9	9%	0.089	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-59.9	-168.4	-67.8	171.3	0	0	0	113.1	R711 N714 E715 Y718 V909 D911	L628-R711 HydrophobicContact CD2-CG 3.72Å; L628-R711 PolarHBondContact O-NH2 3.48Å; L628-N714 HydrophobicContact CD1-CB 3.88Å; L628-N714 HydrophobicContact CD2-CB 4.41Å; L628-N714 HydrophobicContact CG-CB 4.23Å; L628-E715 HydrophobicContact CD2-CB 3.7Å; L628-E715 HydrophobicContact CD2-CG 4.42Å; L628-Y718 HydrophobicContact CD1-CD2 3.5Å; L628-Y718 HydrophobicContact CD1-CE2 4.23Å; L628-Y718 HydrophobicContact CD1-CG 4.25Å; L628-V909 HydrophobicContact CD1-CG2 4.03Å; L628-D911 HydrophobicContact CB-CB 4.18Å; L628-D911 HydrophobicContact CD1-CB 3.99Å
629	N	91.1	Very high	87.3	Confident	26 Å²	26	38.9 Å²	38.9	14%	0.139	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	26.7	178.8	-62.6	-34.9	0	0	0	112	G627 Q649 V909 D911	G627-N629 PolarHBondContact O-N 2.87Å; N629-Q649 HydrophobicContact CB-CB 4.33Å; N629-Q649 WeakPolarHBondContact CB-O 3.31Å; N629-Q649 WeakPolarHBondContact O-CB 3.32Å; N629-Q649 VanDerWaalsContact O-CG 3.24Å; N629-Q649 WeakPolarHBondContact O-CG 3.37Å; N629-Q649 PolarHBondContact O-NE2 3.23Å; N629-V909 PolarHBondContact ND2-O 2.88Å; N629-D911 WeakPolarHBondContact CB-OD1 3.49Å; N629-D911 WeakPolarHBondContact CB-OD2 3.32Å; N629-D911 PolarHBondContact N-OD2 3.25Å; N629-D911 VanDerWaalsContact ND2-CG 3.28Å; N629-D911 PolarHBondContact ND2-OD1 3.46Å
630	E	92	Very high	87.4	Confident	32 Å²	32	38.8 Å²	38.8	15%	0.15	21%	0.209	C	C	.	.			trans	-80.5	144.3	174.2	-65.6	-174.1	145.8	0	0	110.9	K605 V606 N607 L626 G627	K605-E630 HydrophobicContact CD-CB 4.39Å; K605-E630 WeakPolarHBondContact CD-OE2 3.31Å; K605-E630 VanDerWaalsContact CE-OE1 3.31Å; K605-E630 WeakPolarHBondContact CE-OE1 3.36Å; K605-E630 VanDerWaalsContact CE-OE2 3.25Å; K605-E630 WeakPolarHBondContact CE-OE2 3.43Å; K605-E630 HydrophobicContact CG-CB 4.2Å; K605-E630 IonicContact NZ-OE1 3.59Å; K605-E630 PolarHBondContact NZ-OE1 3.25Å; K605-E630 IonicContact NZ-OE2 3.45Å; K605-E630 PolarHBondContact NZ-OE2 2.81Å; V606-E630 WeakPolarHBondContact O-CA 3.25Å; N607-E630 HydrophobicContact CB-CG 4.08Å; L626-E630 HydrophobicContact CB-CB 4.34Å; L626-E630 HydrophobicContact CD2-CB 4.25Å; G627-E630 WeakPolarHBondContact CA-OE2 3.38Å; G627-E630 PolarHBondContact N-OE2 3.36Å; G627-E630 PolarHBondContact O-N 3.4Å
631	R	93	Very high	87.4	Confident	83 Å²	83	43.8 Å²	43.8	31%	0.313	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	153.5	176.7	-65.6	-68.1	-172.7	-173.5	4	110.3	K605 V606 F633 Q649	K605-R631 WeakPolarHBondContact CA-O 3.27Å; V606-R631 PolarHBondContact N-O 2.91Å; V606-R631 PolarHBondContact O-N 2.78Å; R631-F633 HydrophobicContact CB-CD2 4.29Å; R631-F633 HydrophobicContact CB-CE2 3.83Å; R631-Q649 HydrophobicContact CB-CG 4.44Å; R631-Q649 HydrophobicContact CG-CG 3.58Å
632	L	94	Very high	87.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	136	172.5	-65.2	174.5	0	0	0	108.8	Y564 I566 C567 L603 V604 K605 L615 V622 L626	Y564-L632 HydrophobicContact CD1-CD1 4.17Å; I566-L632 HydrophobicContact CG1-CB 4.43Å; C567-L632 WeakPolarHBondContact CB-O 3.45Å; C567-L632 PolarHBondContact N-O 2.98Å; L603-L632 HydrophobicContact CD1-CB 4.24Å; L603-L632 HydrophobicContact CD2-CD2 4.48Å; L603-L632 HydrophobicContact CG-CD2 4.49Å; V604-L632 CarbonylContact O-C 3.59Å; V604-L632 WeakPolarHBondContact O-CA 3.41Å; K605-L632 HydrophobicContact CB-CD2 4.46Å; L615-L632 HydrophobicContact CD1-CD2 3.59Å; V622-L632 HydrophobicContact CG2-CD1 4.17Å; L626-L632 HydrophobicContact CD1-CG 4.23Å; L626-L632 HydrophobicContact CD2-CD2 3.9Å; L626-L632 HydrophobicContact CD2-CG 4.12Å
633	F	93.9	Very high	87.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.5	174.8	-76.8	-103.8	0	0	0	110	C567 L603 V604 V606 R631 L643 H646	C567-F633 HydrophobicContact CB-CD1 3.44Å; C567-F633 VanDerWaalsContact CB-CD1 3.44Å; C567-F633 HydrophobicContact CB-CD2 4.02Å; C567-F633 HydrophobicContact CB-CE1 3.34Å; C567-F633 HydrophobicContact CB-CE2 3.94Å; C567-F633 HydrophobicContact CB-CG 3.8Å; C567-F633 HydrophobicContact CB-CZ 3.61Å; C567-F633 WeakPolarHBondContact O-CA 3.45Å; L603-F633 WeakPolarHBondContact CA-O 3.2Å; V604-F633 HydrophobicContact CG2-CB 3.67Å; V604-F633 PolarHBondContact N-O 3.39Å; V604-F633 PolarHBondContact O-N 3.11Å; V606-F633 HydrophobicContact CB-CD2 3.65Å; V606-F633 HydrophobicContact CB-CE2 3.68Å; V606-F633 HydrophobicContact CG1-CE2 4.31Å; V606-F633 HydrophobicContact CG2-CB 4.21Å; V606-F633 HydrophobicContact CG2-CD2 3.35Å; V606-F633 HydrophobicContact CG2-CE2 3.83Å; V606-F633 HydrophobicContact CG2-CG 3.91Å; R631-F633 HydrophobicContact CB-CD2 4.29Å; R631-F633 HydrophobicContact CB-CE2 3.83Å; F633-L643 HydrophobicContact CB-CD1 4.22Å; F633-L643 HydrophobicContact CD1-CD2 4.03Å; F633-H646 HydrophobicContact CZ-CB 4.18Å
634	V	92	Very high	88.4	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	126	168.7	172.7	0	0	0	0	108.7	I566 C567 M588 L591 W597 Q601 L603	I566-V634 HydrophobicContact CG2-CB 4.11Å; I566-V634 HydrophobicContact CG2-CG2 3.44Å; I566-V634 VanDerWaalsContact CG2-CG2 3.44Å; C567-V634 PolarHBondContact O-N 3.1Å; C567-V634 VanDerWaalsContact O-N 3.1Å; M588-V634 HydrophobicContact SD-CG2 4.26Å; L591-V634 HydrophobicContact CD1-CG2 3.63Å; W597-V634 HydrophobicContact CH2-CG1 4Å; W597-V634 HydrophobicContact CZ3-CG1 3.95Å; Q601-V634 HydrophobicContact CB-CG1 3.81Å; Q601-V634 HydrophobicContact CG-CG1 4.41Å; L603-V634 HydrophobicContact CD1-CG2 3.43Å; L603-V634 VanDerWaalsContact CD1-CG2 3.43Å
635	V	91.3	Very high	89	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	157.6	-170.9	68.3	0	0	0	0	110.5	P569 Q601 V602 V604 E639 V640 L643	P569-V635 HydrophobicContact CG-CG2 4.15Å; Q601-V635 WeakPolarHBondContact CA-O 3.49Å; V602-V635 HydrophobicContact CG2-CG1 4.37Å; V602-V635 WeakPolarHBondContact CG2-O 3.49Å; V602-V635 PolarHBondContact N-O 3.25Å; V602-V635 PolarHBondContact O-N 3.33Å; V602-V635 VanDerWaalsContact O-N 3.17Å; V604-V635 HydrophobicContact CG1-CG1 3.96Å; V604-V635 HydrophobicContact CG2-CG1 3.89Å; V635-E639 HydrophobicContact CG2-CB 3.63Å; V635-V640 HydrophobicContact CG1-CG2 3.66Å; V635-L643 HydrophobicContact CB-CD1 4.09Å; V635-L643 HydrophobicContact CB-CD2 4.42Å; V635-L643 HydrophobicContact CG1-CD1 3.82Å; V635-L643 HydrophobicContact CG2-CD1 4.23Å; V635-L643 HydrophobicContact CG2-CD2 4.12Å; V635-L643 HydrophobicContact CG2-CG 4.17Å
636	N	89.5	Confident	89.6	Confident	45 Å²	45	52.4 Å²	52.4	24%	0.241	27%	0.269	C	S	.	.			trans	-69.4	141.9	167.6	-65	-55.8	0	0	0	109.9	Q601 Q638 E639 V640	Q601-N636 WeakPolarHBondContact CG-OD1 3.46Å; N636-Q638 PolarHBondContact O-N 3.03Å; N636-E639 HydrophobicContact CB-CB 4.48Å; N636-E639 HydrophobicContact CB-CG 4.31Å; N636-E639 WeakPolarHBondContact CB-OE2 3.49Å; N636-E639 PolarHBondContact ND2-OE1 3.34Å; N636-E639 PolarHBondContact ND2-OE2 3.26Å; N636-E639 PolarHBondContact O-N 3.45Å; N636-V640 PolarHBondContact O-N 3.01Å
637	P	87	Confident	89.9	Confident	74 Å²	74	54.8 Å²	54.8	48%	0.481	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-26.9	179.7	-28.5	34.4	0	0	0	114.9	G600 V602 V640	G600-P637 VanDerWaalsContact O-CD 3.25Å; G600-P637 WeakPolarHBondContact O-CD 3.18Å; V602-P637 HydrophobicContact CG1-CG 3.92Å; V602-P637 HydrophobicContact CG2-CG 4.07Å; P637-V640 WeakPolarHBondContact O-CG2 3.23Å
638	Q	85.9	Confident	90	Very high	177 Å²	177	58.5 Å²	58.5	83%	0.827	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-27.4	-179.8	-62.3	171	6.1	0	0	112.9	N636	N636-Q638 PolarHBondContact O-N 3.03Å
639	E	86.3	Confident	90.2	Very high	74 Å²	74	57.8 Å²	57.8	35%	0.346	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	0.4	-173.6	-66.6	164.5	176.7	0	0	112.2	V635 N636 H641 E642	V635-E639 HydrophobicContact CG2-CB 3.63Å; N636-E639 HydrophobicContact CB-CB 4.48Å; N636-E639 HydrophobicContact CB-CG 4.31Å; N636-E639 WeakPolarHBondContact CB-OE2 3.49Å; N636-E639 PolarHBondContact ND2-OE1 3.34Å; N636-E639 PolarHBondContact ND2-OE2 3.26Å; N636-E639 PolarHBondContact O-N 3.45Å; E639-H641 PolarHBondContact O-N 3.34Å; E639-H641 VanDerWaalsContact O-N 3.14Å; E639-E642 WeakPolarHBondContact O-CB 3.39Å; E639-E642 PolarHBondContact O-N 3.39Å
640	V	86.7	Confident	90.3	Very high	31 Å²	31	61.2 Å²	61.2	19%	0.188	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-56.4	-34.5	-178.9	177.5	0	0	0	0	111.9	V604 A612 V635 N636 P637 E642	V604-V640 HydrophobicContact CG1-CG2 4.32Å; A612-V640 HydrophobicContact CB-CG1 3.88Å; V635-V640 HydrophobicContact CG1-CG2 3.66Å; N636-V640 PolarHBondContact O-N 3.01Å; P637-V640 WeakPolarHBondContact O-CG2 3.23Å; V640-E642 VanDerWaalsContact C-N 3.27Å; V640-E642 PolarHBondContact O-N 3.44Å
641	H	85.6	Confident	90.3	Very high	181 Å²	181	60.7 Å²	60.7	84%	0.838	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-74.7	-14	179.7	-61.5	-52.4	0	0	0	114.1	E639	E639-H641 PolarHBondContact O-N 3.34Å; E639-H641 VanDerWaalsContact O-N 3.14Å
642	E	88.3	Confident	90.3	Very high	153 Å²	153	58.1 Å²	58.1	72%	0.715	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-94.4	-9.9	-179.7	-57.5	-176.8	171.9	0	0	112.2	E639 V640 T644	E639-E642 WeakPolarHBondContact O-CB 3.39Å; E639-E642 PolarHBondContact O-N 3.39Å; V640-E642 VanDerWaalsContact C-N 3.27Å; V640-E642 PolarHBondContact O-N 3.44Å; E642-T644 PolarHBondContact O-N 2.59Å
643	L	90.2	Very high	90.2	Very high	18 Å²	18	64.2 Å²	64.2	9%	0.094	35%	0.348	C	S	.	.			trans	-63.7	136.3	179.4	-73.1	178	0	0	0	111.8	P569 V604 V606 F633 V635	P569-L643 HydrophobicContact CB-CD2 4.17Å; P569-L643 HydrophobicContact CG-CD2 4.31Å; V604-L643 HydrophobicContact CG2-CD1 3.66Å; V606-L643 HydrophobicContact CG2-CD1 4.11Å; F633-L643 HydrophobicContact CB-CD1 4.22Å; F633-L643 HydrophobicContact CD1-CD2 4.03Å; V635-L643 HydrophobicContact CB-CD1 4.09Å; V635-L643 HydrophobicContact CB-CD2 4.42Å; V635-L643 HydrophobicContact CG1-CD1 3.82Å; V635-L643 HydrophobicContact CG2-CD1 4.23Å; V635-L643 HydrophobicContact CG2-CD2 4.12Å; V635-L643 HydrophobicContact CG2-CG 4.17Å
644	T	91.9	Very high	90	Very high	78 Å²	78	69.8 Å²	69.8	48%	0.479	38%	0.382	S	S	.	.			trans	-116.5	148.3	172	54.6	0	0	0	0	109.9	H571 E642 H646	H571-T644 PolarHBondContact NE2-O 3.12Å; H571-T644 PolarHBondContact NE2-OG1 2.88Å; E642-T644 PolarHBondContact O-N 2.59Å; T644-H646 PolarHBondContact O-N 3Å
645	P	92.9	Very high	89.8	Confident	27 Å²	27	70.9 Å²	70.9	18%	0.175	39%	0.393	C	S	.	.			trans	-55.6	139.9	173.4	-23.9	33.1	0	0	0	111.5	G610 Q649 L650	G610-P645 VanDerWaalsContact CA-CG 3.49Å; P645-Q649 HydrophobicContact CB-CB 4.26Å; P645-L650 HydrophobicContact CB-CD2 4.32Å
646	H	93	Very high	89.6	Confident	27 Å²	27	72.4 Å²	72.4	13%	0.125	40%	0.404	C	S	.	.			trans	-61.6	142.7	169.7	-178.4	-77.9	0	0	0	109.7	F633 T644 D648 Q649	F633-H646 HydrophobicContact CZ-CB 4.18Å; T644-H646 PolarHBondContact O-N 3Å; H646-D648 VanDerWaalsContact C-N 3.27Å; H646-D648 IonicContact CE1-OD2 2.6Å; H646-D648 PolarHBondContact CE1-OD2 3.33Å; H646-D648 WeakPolarHBondContact ND1-CB 3.43Å; H646-D648 PolarHBondContact ND1-N 3.39Å; H646-D648 VanDerWaalsContact ND1-N 3.14Å; H646-D648 IonicContact ND1-OD2 2.97Å; H646-D648 PolarHBondContact O-N 3.03Å; H646-D648 VanDerWaalsContact O-N 3.13Å; H646-Q649 HydrophobicContact CB-CG 4.09Å; H646-Q649 WeakPolarHBondContact O-CA 3.35Å; H646-Q649 VanDerWaalsContact O-CB 3.23Å; H646-Q649 WeakPolarHBondContact O-CB 3.35Å; H646-Q649 PolarHBondContact O-N 3.24Å
647	P	91	Very high	89.2	Confident	74 Å²	74	71.2 Å²	71.2	48%	0.481	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-50.7	-41.8	-176.6	-30.9	35.6	0	0	0	114.5	H571 Q649 L650	H571-P647 WeakPolarHBondContact ND1-CD 3.15Å; P647-Q649 PolarHBondContact O-N 2.88Å; P647-Q649 VanDerWaalsContact O-N 3.15Å; P647-L650 WeakPolarHBondContact O-CB 3.37Å; P647-L650 PolarHBondContact O-N 3.06Å; P647-L650 VanDerWaalsContact O-N 3.09Å
648	D	88.6	Confident	88.8	Confident	107 Å²	107	75.9 Å²	75.9	57%	0.572	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-60.6	-21.6	176.3	-68.1	-13.9	0	0	0	114.5	H646 L650	H646-D648 VanDerWaalsContact C-N 3.27Å; H646-D648 IonicContact CE1-OD2 2.6Å; H646-D648 PolarHBondContact CE1-OD2 3.33Å; H646-D648 WeakPolarHBondContact ND1-CB 3.43Å; H646-D648 PolarHBondContact ND1-N 3.39Å; H646-D648 VanDerWaalsContact ND1-N 3.14Å; H646-D648 IonicContact ND1-OD2 2.97Å; H646-D648 PolarHBondContact O-N 3.03Å; H646-D648 VanDerWaalsContact O-N 3.13Å; D648-L650 VanDerWaalsContact C-N 3.29Å
649	Q	90.9	Very high	88.6	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.005	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-73.8	-21.3	177.6	-59.9	-175.7	-98.2	0	0	112.7	V606 S608 N629 R631 P645 H646 P647 G651	V606-Q649 PolarHBondContact O-NE2 3.2Å; S608-Q649 WeakPolarHBondContact CB-O 3.37Å; N629-Q649 HydrophobicContact CB-CB 4.33Å; N629-Q649 WeakPolarHBondContact CB-O 3.31Å; N629-Q649 WeakPolarHBondContact O-CB 3.32Å; N629-Q649 VanDerWaalsContact O-CG 3.24Å; N629-Q649 WeakPolarHBondContact O-CG 3.37Å; N629-Q649 PolarHBondContact O-NE2 3.23Å; R631-Q649 HydrophobicContact CB-CG 4.44Å; R631-Q649 HydrophobicContact CG-CG 3.58Å; P645-Q649 HydrophobicContact CB-CB 4.26Å; H646-Q649 HydrophobicContact CB-CG 4.09Å; H646-Q649 WeakPolarHBondContact O-CA 3.35Å; H646-Q649 VanDerWaalsContact O-CB 3.23Å; H646-Q649 WeakPolarHBondContact O-CB 3.35Å; H646-Q649 PolarHBondContact O-N 3.24Å; P647-Q649 PolarHBondContact O-N 2.88Å; P647-Q649 VanDerWaalsContact O-N 3.15Å; Q649-G651 PolarHBondContact O-N 3.4Å
650	L	91.9	Very high	88.5	Confident	98 Å²	98	66 Å²	66	51%	0.513	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-72.6	-14.4	-177.7	-58	178.5	0	0	0	112.4	P645 P647 D648	P645-L650 HydrophobicContact CB-CD2 4.32Å; P647-L650 WeakPolarHBondContact O-CB 3.37Å; P647-L650 PolarHBondContact O-N 3.06Å; P647-L650 VanDerWaalsContact O-N 3.09Å; D648-L650 VanDerWaalsContact C-N 3.29Å
651	G	91.9	Very high	88.4	Confident	22 Å²	22	68.2 Å²	68.2	23%	0.227	39%	0.391	C	S	.	.			trans	80.2	-173.2	-178.9	0	0	0	0	0	113	Q649	Q649-G651 PolarHBondContact O-N 3.4Å
652	P	94.1	Very high	88.3	Confident	28 Å²	28	64.8 Å²	64.8	18%	0.182	38%	0.379	C	S	.	.			trans	-73.3	144.2	-177.2	29.9	-35	0	0	0	112.4	T722 L726 K908 I910	P652-T722 HydrophobicContact CG-CG2 3.79Å; P652-L726 HydrophobicContact CB-CD1 4.39Å; P652-L726 HydrophobicContact CG-CD1 4.11Å; P652-K908 HydrophobicContact CB-CB 4.49Å; P652-K908 HydrophobicContact CG-CB 4.22Å; P652-I910 HydrophobicContact CG-CG1 4.41Å
653	T	91.9	Very high	88.3	Confident	131 Å²	131	58.8 Å²	58.8	80%	0.804	35%	0.352	S	S	*	.	S	Bend	trans	-94.2	-15.3	172	53.5	0	0	0	0	113.3
654	V	89.7	Confident	88.3	Confident	117 Å²	117	60.3 Å²	60.3	71%	0.709	37%	0.365	S	S	*	.	S	Bend	trans	-125.3	130.9	-179.5	-175.1	0	0	0	0	108.9
655	G	86.4	Confident	88.4	Confident	24 Å²	24	57.2 Å²	57.2	25%	0.247	35%	0.347	C	S	.	.			trans	-75.5	168.7	177.7	0	0	0	0	0	112.9
656	S	87.1	Confident	88.4	Confident	34 Å²	34	62.2 Å²	62.2	24%	0.238	37%	0.366	C	S	.	.			trans	-113.4	22	-179.6	66.3	0	0	0	0	113.4	E658 G659 L660 E723 Y903	S656-E658 VanDerWaalsContact C-N 3.31Å; S656-E658 PolarHBondContact O-N 2.96Å; S656-G659 PolarHBondContact O-N 2.73Å; S656-L660 PolarHBondContact O-N 3.44Å; S656-E723 PolarHBondContact N-OE1 3.07Å; S656-E723 PolarHBondContact N-OE2 2.91Å; S656-E723 PolarHBondContact OG-OE1 3.36Å; S656-E723 PolarHBondContact OG-OE2 3.37Å; S656-Y903 WeakPolarHBondContact OG-CE2 3.44Å; S656-Y903 PolarHBondContact OG-OH 2.89Å
657	A	81.8	Confident	88.3	Confident	19 Å²	19	65 Å²	65	16%	0.157	38%	0.381	C	S	.	.	H	α-helix	trans	-51.2	-42.5	-177.4	0	0	0	0	0	114	G659 L660 D661 E723 L736	A657-G659 PolarHBondContact O-N 3.02Å; A657-L660 WeakPolarHBondContact O-CB 3.45Å; A657-L660 PolarHBondContact O-N 3.43Å; A657-D661 PolarHBondContact O-N 3.37Å; A657-E723 PolarHBondContact N-OE2 3.27Å; A657-L736 HydrophobicContact CB-CD2 4.19Å
658	E	79.7	Confident	88.4	Confident	172 Å²	172	61.6 Å²	61.6	80%	0.804	36%	0.359	S	S	*	.	H	α-helix	trans	-63.1	-41.9	178.9	-63.1	-174.6	172.8	0	0	112.3	S656 D661	S656-E658 VanDerWaalsContact C-N 3.31Å; S656-E658 PolarHBondContact O-N 2.96Å; E658-D661 PolarHBondContact O-N 2.98Å
659	G	80.9	Confident	88.7	Confident	41 Å²	41	56.5 Å²	56.5	42%	0.423	33%	0.332	S	S	.	.	H	α-helix	trans	-69.2	-38.3	175.3	0	0	0	0	0	111.8	S656 A657 D661 L662	S656-G659 PolarHBondContact O-N 2.73Å; A657-G659 PolarHBondContact O-N 3.02Å; G659-D661 VanDerWaalsContact C-N 3.33Å; G659-D661 PolarHBondContact O-N 2.7Å; G659-L662 PolarHBondContact O-N 3.32Å
660	L	85.1	Confident	88.8	Confident	4 Å²	4	57 Å²	57	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-61.7	-41.3	175.4	-74.9	174.7	0	0	0	111.2	S656 A657 L662 V663 L668 W719 E723 L736 K739 Y903	S656-L660 PolarHBondContact O-N 3.44Å; A657-L660 WeakPolarHBondContact O-CB 3.45Å; A657-L660 PolarHBondContact O-N 3.43Å; L660-L662 PolarHBondContact O-N 3.38Å; L660-V663 PolarHBondContact O-N 3.13Å; L660-L668 HydrophobicContact CD2-CD2 4.36Å; L660-W719 HydrophobicContact CD1-CZ2 4.33Å; L660-W719 HydrophobicContact CD2-CZ2 3.94Å; L660-E723 HydrophobicContact CD1-CB 4.46Å; L660-E723 HydrophobicContact CD1-CG 3.94Å; L660-L736 HydrophobicContact CD1-CD1 4.03Å; L660-K739 VanDerWaalsContact C-NZ 3.34Å; L660-K739 VanDerWaalsContact O-CE 3.24Å; L660-K739 WeakPolarHBondContact O-CE 3.5Å; L660-K739 PolarHBondContact O-NZ 2.83Å; L660-Y903 HydrophobicContact CD2-CD1 4.47Å; L660-Y903 HydrophobicContact CD2-CE1 3.56Å; L660-Y903 WeakPolarHBondContact CD2-OH 3.29Å; L660-Y903 HydrophobicContact CG-CE1 4.46Å
661	D	82.9	Confident	88.7	Confident	77 Å²	77	53 Å²	53	41%	0.412	32%	0.316	S	S	.	.	H	α-helix	trans	-56.7	-31.5	-179.9	-81.3	-17.8	0	0	0	114	A657 E658 G659 V663 K739	A657-D661 PolarHBondContact O-N 3.37Å; E658-D661 PolarHBondContact O-N 2.98Å; G659-D661 VanDerWaalsContact C-N 3.33Å; G659-D661 PolarHBondContact O-N 2.7Å; D661-V663 VanDerWaalsContact C-N 3.27Å; D661-V663 PolarHBondContact O-N 2.92Å; D661-K739 PolarHBondContact O-NZ 3.11Å
662	L	84.9	Confident	88.8	Confident	109 Å²	109	52 Å²	52	57%	0.571	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-19.1	177.8	-60.5	174.9	0	0	0	113.9	G659 L660	G659-L662 PolarHBondContact O-N 3.32Å; L660-L662 PolarHBondContact O-N 3.38Å
663	V	87.1	Confident	88.8	Confident	26 Å²	26	51.1 Å²	51.1	16%	0.158	30%	0.3	C	S	.	.	S	Bend	trans	-102	134.9	-177.1	-177	0	0	0	0	110.7	L660 D661 D667 L668 K739 T900	L660-V663 PolarHBondContact O-N 3.13Å; D661-V663 VanDerWaalsContact C-N 3.27Å; D661-V663 PolarHBondContact O-N 2.92Å; V663-D667 HydrophobicContact CG1-CB 4.33Å; V663-L668 HydrophobicContact CG1-CB 4.24Å; V663-K739 WeakPolarHBondContact O-CE 3.47Å; V663-K739 PolarHBondContact O-NZ 3.21Å; V663-T900 HydrophobicContact CG1-CG2 3.57Å; V663-T900 HydrophobicContact CG2-CG2 4.15Å
664	S	91.5	Very high	88.7	Confident	51 Å²	51	48.8 Å²	48.8	36%	0.357	28%	0.282	S	S	.	.			trans	-73.1	148	176.4	88.1	0	0	0	0	111.6	K666 D667 L668	S664-K666 PolarHBondContact O-N 3.28Å; S664-D667 WeakPolarHBondContact CB-OD2 3.46Å; S664-D667 PolarHBondContact O-N 2.7Å; S664-D667 PolarHBondContact OG-N 2.93Å; S664-D667 PolarHBondContact OG-OD2 3.36Å; S664-L668 WeakPolarHBondContact O-CB 3.36Å; S664-L668 PolarHBondContact O-N 3.49Å
665	A	93.3	Very high	88.6	Confident	12 Å²	12	44.8 Å²	44.8	10%	0.099	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-28.3	176.6	0	0	0	0	0	112.7	A669 K739 K742 L743	A665-A669 WeakPolarHBondContact O-CB 3.31Å; A665-A669 PolarHBondContact O-N 2.92Å; A665-K739 HydrophobicContact CB-CG 4.27Å; A665-K742 HydrophobicContact CB-CB 4.01Å; A665-L743 WeakPolarHBondContact O-CD1 3.21Å
666	K	92.9	Very high	88.9	Confident	133 Å²	133	43.7 Å²	43.7	58%	0.578	24%	0.244	S	C	*	.	H	α-helix	trans	-72.5	-43.1	176.8	-176.4	179.6	178.3	179.2	0	111.8	S664 L668 A669 G670	S664-K666 PolarHBondContact O-N 3.28Å; K666-L668 VanDerWaalsContact C-N 3.34Å; K666-A669 PolarHBondContact O-N 3.39Å; K666-G670 PolarHBondContact O-N 3.44Å
667	D	90.2	Very high	89.2	Confident	84 Å²	84	43.2 Å²	43.2	45%	0.449	24%	0.237	S	C	.	.	H	α-helix	trans	-66.9	-40.8	177.6	-62.5	-42.3	0	0	0	110.7	V663 S664 G670 Q671	V663-D667 HydrophobicContact CG1-CB 4.33Å; S664-D667 WeakPolarHBondContact CB-OD2 3.46Å; S664-D667 PolarHBondContact O-N 2.7Å; S664-D667 PolarHBondContact OG-N 2.93Å; S664-D667 PolarHBondContact OG-OD2 3.36Å; D667-G670 PolarHBondContact O-N 2.93Å; D667-Q671 WeakPolarHBondContact O-CG 3.4Å; D667-Q671 PolarHBondContact O-N 3.48Å
668	L	92.7	Very high	89.5	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-46.3	173.9	-170.9	56.6	0	0	0	111.4	L660 V663 S664 K666 G670 Q671 L672 W719 L743 V904	L660-L668 HydrophobicContact CD2-CD2 4.36Å; V663-L668 HydrophobicContact CG1-CB 4.24Å; S664-L668 WeakPolarHBondContact O-CB 3.36Å; S664-L668 PolarHBondContact O-N 3.49Å; K666-L668 VanDerWaalsContact C-N 3.34Å; L668-G670 VanDerWaalsContact C-N 3.33Å; L668-G670 PolarHBondContact O-N 3.07Å; L668-Q671 PolarHBondContact O-N 3.34Å; L668-L672 HydrophobicContact CG-CD1 4.41Å; L668-L672 WeakPolarHBondContact O-CB 3.35Å; L668-L672 VanDerWaalsContact O-CG 3.28Å; L668-L672 WeakPolarHBondContact O-CG 3.29Å; L668-L672 PolarHBondContact O-N 3.27Å; L668-W719 HydrophobicContact CD1-CH2 4.46Å; L668-W719 HydrophobicContact CD2-CH2 3.8Å; L668-W719 HydrophobicContact CD2-CZ2 4.31Å; L668-W719 HydrophobicContact CG-CH2 4.35Å; L668-L743 HydrophobicContact CB-CD1 3.93Å; L668-L743 HydrophobicContact CD2-CD1 4.13Å; L668-L743 HydrophobicContact CD2-CD2 4.06Å; L668-L743 HydrophobicContact CG-CD1 3.86Å; L668-L743 HydrophobicContact CG-CD2 4.37Å; L668-V904 HydrophobicContact CD1-CG2 3.58Å
669	A	95.6	Very high	90	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.7	-44.9	173.6	0	0	0	0	0	111.9	A665 K666 Q671 L672 T673 L743 H746 L747 Q750	A665-A669 WeakPolarHBondContact O-CB 3.31Å; A665-A669 PolarHBondContact O-N 2.92Å; K666-A669 PolarHBondContact O-N 3.39Å; A669-Q671 PolarHBondContact O-N 3.02Å; A669-L672 PolarHBondContact O-N 3.29Å; A669-T673 WeakPolarHBondContact O-CB 3.12Å; A669-T673 PolarHBondContact O-N 3.31Å; A669-T673 PolarHBondContact O-OG1 3.4Å; A669-L743 HydrophobicContact CB-CD1 3.88Å; A669-H746 HydrophobicContact CB-CB 3.61Å; A669-L747 HydrophobicContact CB-CD2 4.09Å; A669-L747 HydrophobicContact CB-CG 4.18Å; A669-Q750 VanDerWaalsContact C-OE1 3.26Å; A669-Q750 PolarHBondContact O-OE1 3.39Å; A669-Q750 VanDerWaalsContact O-OE1 3.07Å
670	G	92.6	Very high	90.5	Very high	12 Å²	12	34.6 Å²	34.6	12%	0.124	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-45.1	177.7	0	0	0	0	0	113	K666 D667 L668 T673 D674	K666-G670 PolarHBondContact O-N 3.44Å; D667-G670 PolarHBondContact O-N 2.93Å; L668-G670 VanDerWaalsContact C-N 3.33Å; L668-G670 PolarHBondContact O-N 3.07Å; G670-T673 PolarHBondContact O-N 2.83Å; G670-D674 WeakPolarHBondContact O-CB 3.41Å; G670-D674 VanDerWaalsContact O-CG 3.23Å; G670-D674 PolarHBondContact O-N 2.84Å
671	Q	90	Very high	90.8	Very high	13 Å²	13	38.6 Å²	38.6	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-68	-40.3	178	-64.7	-63	-4.9	0	0	112.8	D667 L668 A669 D674 H675 T900 V904	D667-Q671 WeakPolarHBondContact O-CG 3.4Å; D667-Q671 PolarHBondContact O-N 3.48Å; L668-Q671 PolarHBondContact O-N 3.34Å; A669-Q671 PolarHBondContact O-N 3.02Å; Q671-D674 PolarHBondContact O-N 3.09Å; Q671-H675 WeakPolarHBondContact O-CB 3.25Å; Q671-H675 PolarHBondContact O-N 2.9Å; Q671-T900 HydrophobicContact CG-CG2 4.1Å; Q671-V904 HydrophobicContact CB-CG2 4.21Å
672	L	93.4	Very high	91.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-50.2	173.7	-71.7	176.6	0	0	0	110.6	L668 A669 D674 H675 D676 L716 L743 L747 V904	L668-L672 HydrophobicContact CG-CD1 4.41Å; L668-L672 WeakPolarHBondContact O-CB 3.35Å; L668-L672 VanDerWaalsContact O-CG 3.28Å; L668-L672 WeakPolarHBondContact O-CG 3.29Å; L668-L672 PolarHBondContact O-N 3.27Å; A669-L672 PolarHBondContact O-N 3.29Å; L672-D674 PolarHBondContact O-N 3.08Å; L672-H675 PolarHBondContact O-N 2.95Å; L672-D676 WeakPolarHBondContact O-CB 3.19Å; L672-D676 PolarHBondContact O-N 3.39Å; L672-D676 VanDerWaalsContact O-OD2 3.07Å; L672-L716 HydrophobicContact CD2-CD1 4.33Å; L672-L716 HydrophobicContact CD2-CD2 3.57Å; L672-L743 HydrophobicContact CD1-CD1 4.08Å; L672-L743 HydrophobicContact CD1-CD2 4.05Å; L672-L743 HydrophobicContact CD1-CG 4.41Å; L672-L747 HydrophobicContact CB-CD2 4.12Å; L672-L747 HydrophobicContact CD1-CD1 4.32Å; L672-L747 HydrophobicContact CD1-CD2 4.41Å; L672-V904 HydrophobicContact CD2-CG1 3.66Å; L672-V904 HydrophobicContact CG-CG1 4.41Å
673	T	94.5	Very high	91.3	Very high	10 Å²	10	30.6 Å²	30.6	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-41.8	179.9	-62.4	0	0	0	0	112.6	A669 G670 D676 W677 Q750 N752	A669-T673 WeakPolarHBondContact O-CB 3.12Å; A669-T673 PolarHBondContact O-N 3.31Å; A669-T673 PolarHBondContact O-OG1 3.4Å; G670-T673 PolarHBondContact O-N 2.83Å; T673-D676 PolarHBondContact O-N 2.78Å; T673-W677 WeakPolarHBondContact O-CB 3.42Å; T673-W677 PolarHBondContact O-N 2.86Å; T673-Q750 HydrophobicContact CG2-CB 4.47Å; T673-Q750 PolarHBondContact OG1-OE1 2.84Å; T673-N752 WeakPolarHBondContact CA-ND2 3.08Å; T673-N752 HydrophobicContact CG2-CB 4.1Å; T673-N752 WeakPolarHBondContact OG1-CB 3.19Å; T673-N752 PolarHBondContact OG1-ND2 3.43Å
674	D	89.6	Confident	91.5	Very high	82 Å²	82	31.4 Å²	31.4	44%	0.439	17%	0.17	S	C	.	.	H	α-helix	trans	-63.1	-43.2	176.5	-71.8	-14.8	0	0	0	111.8	G670 Q671 L672 S678 R869	G670-D674 WeakPolarHBondContact O-CB 3.41Å; G670-D674 VanDerWaalsContact O-CG 3.23Å; G670-D674 PolarHBondContact O-N 2.84Å; Q671-D674 PolarHBondContact O-N 3.09Å; L672-D674 PolarHBondContact O-N 3.08Å; D674-S678 PolarHBondContact O-N 3.49Å; D674-R869 IonicContact OD2-CZ 3.94Å; D674-R869 IonicContact OD2-NH1 2.66Å; D674-R869 PolarHBondContact OD2-NH1 3.47Å
675	H	88.8	Confident	91.4	Very high	34 Å²	34	29.7 Å²	29.7	16%	0.157	16%	0.157	C	C	.	.	H	α-helix	trans	-66	-45.9	176.9	-174.8	65.6	0	0	0	112	Q671 L672 W677 S678 L679	Q671-H675 WeakPolarHBondContact O-CB 3.25Å; Q671-H675 PolarHBondContact O-N 2.9Å; L672-H675 PolarHBondContact O-N 2.95Å; H675-W677 VanDerWaalsContact C-N 3.3Å; H675-W677 PolarHBondContact O-N 2.88Å; H675-S678 WeakPolarHBondContact O-CB 3.5Å; H675-S678 PolarHBondContact O-N 3.31Å; H675-S678 VanDerWaalsContact O-N 3.09Å; H675-L679 PolarHBondContact O-N 3.47Å
676	D	93.4	Very high	91.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-36.5	179.9	-62.3	-27.3	0	0	0	111.1	L672 T673 S678 L679 F680 F709 R712 N752 S755 I814	L672-D676 WeakPolarHBondContact O-CB 3.19Å; L672-D676 PolarHBondContact O-N 3.39Å; L672-D676 VanDerWaalsContact O-OD2 3.07Å; T673-D676 PolarHBondContact O-N 2.78Å; D676-S678 VanDerWaalsContact C-N 3.35Å; D676-L679 PolarHBondContact O-N 2.92Å; D676-F680 WeakPolarHBondContact O-CB 3.45Å; D676-F680 PolarHBondContact O-N 3.18Å; D676-F709 HydrophobicContact CB-CE2 4.16Å; D676-F709 WeakPolarHBondContact O-CE2 3.42Å; D676-R712 IonicContact OD1-NE 2.97Å; D676-R712 PolarHBondContact OD1-NE 3.09Å; D676-N752 PolarHBondContact OD2-ND2 2.98Å; D676-S755 WeakPolarHBondContact OD2-CB 3.48Å; D676-S755 PolarHBondContact OD2-OG 3.2Å; D676-I814 HydrophobicContact CB-CD1 3.81Å
677	W	92.4	Very high	91.2	Very high	24 Å²	24	23.1 Å²	23.1	9%	0.091	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-40.5	171.9	-90.7	114.8	0	0	0	112.5	T673 H675 F680 N681 P812 I814 R858	T673-W677 WeakPolarHBondContact O-CB 3.42Å; T673-W677 PolarHBondContact O-N 2.86Å; H675-W677 VanDerWaalsContact C-N 3.3Å; H675-W677 PolarHBondContact O-N 2.88Å; W677-F680 AromaticContact CE3-CD1 3.92Å; W677-F680 HydrophobicContact CE3-CD1 3.92Å; W677-F680 HydrophobicContact CH2-CD1 4.35Å; W677-F680 HydrophobicContact CH2-CE1 4.37Å; W677-F680 AromaticContact CZ3-CD1 3.68Å; W677-F680 HydrophobicContact CZ3-CD1 3.68Å; W677-F680 HydrophobicContact CZ3-CE1 4.01Å; W677-F680 PolarHBondContact O-N 2.9Å; W677-N681 VanDerWaalsContact O-CB 3.25Å; W677-N681 WeakPolarHBondContact O-CB 3.42Å; W677-N681 PolarHBondContact O-N 2.86Å; W677-N681 PolarHBondContact O-ND2 3.13Å; W677-P812 HydrophobicContact CH2-CB 3.63Å; W677-P812 HydrophobicContact CZ2-CB 3.66Å; W677-I814 HydrophobicContact CD2-CD1 3.93Å; W677-I814 HydrophobicContact CD2-CG1 3.95Å; W677-I814 HydrophobicContact CE3-CG1 4.41Å; W677-I814 HydrophobicContact CG-CD1 3.91Å; W677-I814 HydrophobicContact CG-CG1 4.45Å; W677-I814 HydrophobicContact CH2-CG1 4.17Å; W677-I814 HydrophobicContact CZ2-CD1 4.46Å; W677-I814 HydrophobicContact CZ2-CG1 3.67Å; W677-R858 HydrophobicContact CZ3-CG 4.08Å
678	S	88.6	Confident	91.3	Very high	46 Å²	46	19.1 Å²	19.1	32%	0.322	11%	0.105	S	C	.	.	H	α-helix	trans	-62	-46.3	176.6	-179.8	0	0	0	0	111.7	D674 H675 D676 S682	D674-S678 PolarHBondContact O-N 3.49Å; H675-S678 WeakPolarHBondContact O-CB 3.5Å; H675-S678 PolarHBondContact O-N 3.31Å; H675-S678 VanDerWaalsContact O-N 3.09Å; D676-S678 VanDerWaalsContact C-N 3.35Å; S678-S682 PolarHBondContact O-N 3.08Å; S678-S682 PolarHBondContact O-OG 3.17Å
679	L	89.3	Confident	91.3	Very high	6 Å²	6	19 Å²	19	3%	0.031	10%	0.104	C	C	.	.	H	α-helix	trans	-66.2	-45.4	176.2	-63.7	-178.8	0	0	0	111.7	H675 D676 N681 S682 I683 R708 F709 R712	H675-L679 PolarHBondContact O-N 3.47Å; D676-L679 PolarHBondContact O-N 2.92Å; L679-N681 VanDerWaalsContact C-N 3.34Å; L679-N681 PolarHBondContact O-N 2.89Å; L679-S682 VanDerWaalsContact O-CB 3.31Å; L679-S682 WeakPolarHBondContact O-CB 3.3Å; L679-S682 PolarHBondContact O-N 2.7Å; L679-I683 PolarHBondContact O-N 2.96Å; L679-R708 HydrophobicContact CD2-CG 4.17Å; L679-R708 VanDerWaalsContact CD2-CZ 3.43Å; L679-R708 VanDerWaalsContact CD2-NE 3.34Å; L679-F709 HydrophobicContact CB-CD2 3.62Å; L679-F709 HydrophobicContact CB-CE2 4.29Å; L679-F709 HydrophobicContact CD1-CD2 4.38Å; L679-R712 HydrophobicContact CD1-CB 3.93Å; L679-R712 HydrophobicContact CD1-CG 3.96Å
680	F	92.4	Very high	91	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.4	-37.4	-179.3	-174.6	-118.3	0	0	0	112.9	D676 W677 S682 I683 F709 I814 P815 M817 L854 C857 R858	D676-F680 WeakPolarHBondContact O-CB 3.45Å; D676-F680 PolarHBondContact O-N 3.18Å; W677-F680 AromaticContact CE3-CD1 3.92Å; W677-F680 HydrophobicContact CE3-CD1 3.92Å; W677-F680 HydrophobicContact CH2-CD1 4.35Å; W677-F680 HydrophobicContact CH2-CE1 4.37Å; W677-F680 AromaticContact CZ3-CD1 3.68Å; W677-F680 HydrophobicContact CZ3-CD1 3.68Å; W677-F680 HydrophobicContact CZ3-CE1 4.01Å; W677-F680 PolarHBondContact O-N 2.9Å; F680-S682 VanDerWaalsContact C-N 3.26Å; F680-S682 PolarHBondContact O-N 2.88Å; F680-I683 HydrophobicContact CD2-CD1 4.06Å; F680-I683 PolarHBondContact O-N 3.44Å; F680-F709 HydrophobicContact CB-CD2 4.4Å; F680-F709 HydrophobicContact CB-CE2 3.92Å; F680-F709 HydrophobicContact CB-CZ 4.22Å; F680-F709 HydrophobicContact CD2-CE1 4.17Å; F680-F709 HydrophobicContact CD2-CZ 4.12Å; F680-I814 HydrophobicContact CD1-CG1 4.32Å; F680-I814 HydrophobicContact CD2-CG2 4.35Å; F680-I814 HydrophobicContact CG-CG2 4.37Å; F680-P815 HydrophobicContact CE2-CG 4.39Å; F680-P815 HydrophobicContact CZ-CG 4.18Å; F680-M817 HydrophobicContact CE2-CG 4.3Å; F680-M817 HydrophobicContact CE2-SD 3.81Å; F680-L854 HydrophobicContact CD2-CD1 4.19Å; F680-L854 HydrophobicContact CE2-CD1 3.25Å; F680-L854 HydrophobicContact CE2-CG 4.31Å; F680-L854 HydrophobicContact CZ-CD1 3.55Å; F680-L854 HydrophobicContact CZ-CG 4.23Å; F680-C857 HydrophobicContact CE1-CB 4.36Å; F680-C857 HydrophobicContact CZ-CB 4.22Å; F680-R858 HydrophobicContact CD1-CG 3.92Å; F680-R858 HydrophobicContact CE1-CG 3.38Å; F680-R858 HydrophobicContact CZ-CG 4.21Å
681	N	90.1	Very high	90.8	Very high	87 Å²	87	23.4 Å²	23.4	47%	0.465	12%	0.118	S	C	.	.	H	α-helix	trans	-71.3	-22	174.2	-72.5	-22.9	0	0	0	112.8	W677 L679 I683	W677-N681 VanDerWaalsContact O-CB 3.25Å; W677-N681 WeakPolarHBondContact O-CB 3.42Å; W677-N681 PolarHBondContact O-N 2.86Å; W677-N681 PolarHBondContact O-ND2 3.13Å; L679-N681 VanDerWaalsContact C-N 3.34Å; L679-N681 PolarHBondContact O-N 2.89Å; N681-I683 VanDerWaalsContact C-N 3.26Å; N681-I683 PolarHBondContact O-N 2.6Å
682	S	89.1	Confident	90.7	Very high	16 Å²	16	23 Å²	23	11%	0.112	12%	0.117	C	C	.	.	H	α-helix	trans	-75.5	-15.9	175.2	-56.5	0	0	0	0	112.6	S678 L679 F680 H684 N705	S678-S682 PolarHBondContact O-N 3.08Å; S678-S682 PolarHBondContact O-OG 3.17Å; L679-S682 VanDerWaalsContact O-CB 3.31Å; L679-S682 WeakPolarHBondContact O-CB 3.3Å; L679-S682 PolarHBondContact O-N 2.7Å; F680-S682 VanDerWaalsContact C-N 3.26Å; F680-S682 PolarHBondContact O-N 2.88Å; S682-H684 PolarHBondContact O-N 2.91Å; S682-N705 WeakPolarHBondContact O-CB 3.24Å; S682-N705 PolarHBondContact O-ND2 2.95Å
683	I	90.3	Very high	90.2	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	12%	0.12	C	C	.	.			trans	-77.4	121	179.2	-53.7	171.3	0	0	0	110.2	L679 F680 N681 E687 L688 N705 L706 F709 L854 R858	L679-I683 PolarHBondContact O-N 2.96Å; F680-I683 HydrophobicContact CD2-CD1 4.06Å; F680-I683 PolarHBondContact O-N 3.44Å; N681-I683 VanDerWaalsContact C-N 3.26Å; N681-I683 PolarHBondContact O-N 2.6Å; I683-E687 HydrophobicContact CG2-CB 4.34Å; I683-L688 HydrophobicContact CG2-CD1 3.92Å; I683-N705 HydrophobicContact CG1-CB 4.35Å; I683-L706 HydrophobicContact CD1-CD1 4.16Å; I683-L706 HydrophobicContact CG2-CB 4.19Å; I683-L706 HydrophobicContact CG2-CD1 4.38Å; I683-F709 HydrophobicContact CD1-CB 3.67Å; I683-F709 HydrophobicContact CD1-CD1 3.93Å; I683-F709 HydrophobicContact CD1-CG 3.78Å; I683-F709 HydrophobicContact CG1-CB 4.39Å; I683-L854 HydrophobicContact CB-CD2 4.45Å; I683-L854 HydrophobicContact CG2-CD2 4.05Å; I683-R858 PolarHBondContact O-NH1 2.83Å
684	H	90.1	Very high	89.3	Confident	43 Å²	43	24.1 Å²	24.1	20%	0.199	13%	0.127	C	C	.	.			trans	-78.5	142.7	169.8	-161.6	-80.3	0	0	0	111.5	L477 M481 S682 V686 E687	L477-H684 PolarHBondContact O-CE1 3.3Å; L477-H684 VanDerWaalsContact O-CE1 3.26Å; L477-H684 PolarHBondContact O-NE2 3.11Å; M481-H684 HydrophobicContact CE-CB 4.45Å; M481-H684 WeakPolarHBondContact CE-CD2 3.29Å; M481-H684 WeakPolarHBondContact CE-CE1 3.37Å; M481-H684 VanDerWaalsContact CE-CG 3.46Å; M481-H684 WeakPolarHBondContact CE-ND1 3.19Å; M481-H684 WeakPolarHBondContact CE-NE2 3.29Å; S682-H684 PolarHBondContact O-N 2.91Å; H684-V686 WeakPolarHBondContact ND1-CG2 3.34Å; H684-V686 PolarHBondContact ND1-N 2.92Å; H684-V686 PolarHBondContact O-N 3.07Å; H684-V686 VanDerWaalsContact O-N 3.17Å; H684-E687 HydrophobicContact CB-CG 4.09Å; H684-E687 PolarHBondContact N-OE1 3.18Å; H684-E687 VanDerWaalsContact O-CB 3.3Å; H684-E687 WeakPolarHBondContact O-CB 3.43Å; H684-E687 PolarHBondContact O-N 3.25Å
685	Q	90.5	Very high	88	Confident	15 Å²	15	24.6 Å²	24.6	7%	0.07	14%	0.135	C	C	.	.	H	α-helix	trans	-57.1	-36.9	-175.7	-64	178.9	67.2	0	0	113.5	L425 E687 L688 L854 H855	L425-Q685 HydrophobicContact CD2-CB 4.06Å; Q685-E687 VanDerWaalsContact C-N 3.27Å; Q685-E687 PolarHBondContact O-N 3.06Å; Q685-L688 PolarHBondContact O-N 3.29Å; Q685-L854 HydrophobicContact CG-CD2 4.15Å; Q685-H855 HydrophobicContact CG-CB 4.38Å
686	V	91.3	Very high	86.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-71.3	-18.5	179.1	-61.9	0	0	0	0	113.5	L425 Y478 M481 H684 L688 I689 Y690	L425-V686 HydrophobicContact CD2-CG1 4.06Å; Y478-V686 HydrophobicContact CE1-CG1 4.39Å; Y478-V686 HydrophobicContact CE1-CG2 4.45Å; M481-V686 HydrophobicContact CE-CG2 4.04Å; M481-V686 HydrophobicContact SD-CG2 4.37Å; H684-V686 WeakPolarHBondContact ND1-CG2 3.34Å; H684-V686 PolarHBondContact ND1-N 2.92Å; H684-V686 PolarHBondContact O-N 3.07Å; H684-V686 VanDerWaalsContact O-N 3.17Å; V686-L688 PolarHBondContact O-N 3.29Å; V686-I689 WeakPolarHBondContact O-CB 3.47Å; V686-I689 PolarHBondContact O-N 2.92Å; V686-I689 VanDerWaalsContact O-N 3.09Å; V686-Y690 HydrophobicContact CB-CE1 4.13Å; V686-Y690 HydrophobicContact CB-CE2 3.92Å; V686-Y690 HydrophobicContact CG2-CD2 4.35Å; V686-Y690 HydrophobicContact CG2-CE2 3.52Å; V686-Y690 WeakPolarHBondContact O-CD1 3.48Å; V686-Y690 WeakPolarHBondContact O-CD2 3.32Å; V686-Y690 PolarHBondContact O-N 3.06Å
687	E	91.1	Very high	85.2	Confident	8 Å²	8	36 Å²	36	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-33.1	175.5	-69.4	-178.6	-123.2	0	0	111.4	I683 H684 Q685 I689 Y690 Y691 N705 L706	I683-E687 HydrophobicContact CG2-CB 4.34Å; H684-E687 HydrophobicContact CB-CG 4.09Å; H684-E687 PolarHBondContact N-OE1 3.18Å; H684-E687 VanDerWaalsContact O-CB 3.3Å; H684-E687 WeakPolarHBondContact O-CB 3.43Å; H684-E687 PolarHBondContact O-N 3.25Å; Q685-E687 VanDerWaalsContact C-N 3.27Å; Q685-E687 PolarHBondContact O-N 3.06Å; E687-I689 VanDerWaalsContact C-N 3.31Å; E687-I689 PolarHBondContact O-N 3.21Å; E687-Y690 PolarHBondContact O-N 3.42Å; E687-Y691 WeakPolarHBondContact O-CB 3.47Å; E687-Y691 PolarHBondContact O-N 3.32Å; E687-N705 PolarHBondContact OE1-ND2 3.3Å; E687-N705 WeakPolarHBondContact OE2-CB 3.35Å; E687-N705 PolarHBondContact OE2-N 3.12Å; E687-L706 HydrophobicContact CB-CB 4.21Å; E687-L706 HydrophobicContact CB-CD2 4.43Å; E687-L706 PolarHBondContact OE2-N 3.42Å
688	L	91.8	Very high	84	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-38.2	176.4	-74.9	76.2	0	0	0	111.8	I683 Q685 V686 A692 L706 M817 L820 L821 M824 L854	I683-L688 HydrophobicContact CG2-CD1 3.92Å; Q685-L688 PolarHBondContact O-N 3.29Å; V686-L688 PolarHBondContact O-N 3.29Å; L688-A692 WeakPolarHBondContact O-CB 3.44Å; L688-A692 PolarHBondContact O-N 2.93Å; L688-A692 VanDerWaalsContact O-N 3.16Å; L688-L706 HydrophobicContact CG-CD2 4.36Å; L688-M817 HydrophobicContact CD2-CE 4.31Å; L688-L820 HydrophobicContact CD2-CD2 3.47Å; L688-L820 VanDerWaalsContact CD2-CD2 3.47Å; L688-L820 HydrophobicContact CD2-CG 3.99Å; L688-L821 HydrophobicContact CG-CD2 4.39Å; L688-M824 HydrophobicContact CB-CE 4.26Å; L688-L854 HydrophobicContact CD1-CD1 4.3Å; L688-L854 HydrophobicContact CD1-CD2 3.75Å; L688-L854 HydrophobicContact CD1-CG 4.48Å
689	I	91.7	Very high	82.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-69.4	-47.6	178	-65.5	168.3	0	0	0	108.9	L425 T426 V429 V686 E687 Y691 A692 L693 M824 M847 A851	L425-I689 HydrophobicContact CB-CD1 4.13Å; L425-I689 WeakPolarHBondContact O-CD1 3.43Å; T426-I689 HydrophobicContact CG2-CD1 4.1Å; V429-I689 HydrophobicContact CG2-CG2 3.98Å; V686-I689 WeakPolarHBondContact O-CB 3.47Å; V686-I689 PolarHBondContact O-N 2.92Å; V686-I689 VanDerWaalsContact O-N 3.09Å; E687-I689 VanDerWaalsContact C-N 3.31Å; E687-I689 PolarHBondContact O-N 3.21Å; I689-Y691 VanDerWaalsContact C-N 3.32Å; I689-Y691 PolarHBondContact O-N 3.42Å; I689-A692 PolarHBondContact O-N 3.09Å; I689-L693 HydrophobicContact CG2-CD1 3.91Å; I689-L693 HydrophobicContact CG2-CG 4.49Å; I689-L693 VanDerWaalsContact O-CG 3.27Å; I689-L693 WeakPolarHBondContact O-CG 3.46Å; I689-L693 PolarHBondContact O-N 3.45Å; I689-M824 HydrophobicContact CB-CE 4.37Å; I689-M824 HydrophobicContact CG1-CE 3.72Å; I689-M847 HydrophobicContact CB-CE 4.42Å; I689-M847 HydrophobicContact CG2-CE 3.9Å; I689-A851 HydrophobicContact CD1-CB 4.14Å; I689-A851 HydrophobicContact CG1-CB 4.28Å
690	Y	89.4	Confident	82.2	Confident	11 Å²	11	47.5 Å²	47.5	4%	0.043	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-41	-179.5	-56.5	-19.3	0	0	0	112	R428 V686 E687 A692 L693 G694 L698 V701	R428-Y690 HydrophobicContact CB-CE1 4.41Å; R428-Y690 WeakPolarHBondContact CD-OH 3.23Å; V686-Y690 HydrophobicContact CB-CE1 4.13Å; V686-Y690 HydrophobicContact CB-CE2 3.92Å; V686-Y690 HydrophobicContact CG2-CD2 4.35Å; V686-Y690 HydrophobicContact CG2-CE2 3.52Å; V686-Y690 WeakPolarHBondContact O-CD1 3.48Å; V686-Y690 WeakPolarHBondContact O-CD2 3.32Å; V686-Y690 PolarHBondContact O-N 3.06Å; E687-Y690 PolarHBondContact O-N 3.42Å; Y690-A692 PolarHBondContact O-N 2.8Å; Y690-L693 PolarHBondContact O-N 2.65Å; Y690-G694 PolarHBondContact O-N 3.46Å; Y690-L698 HydrophobicContact CD1-CD1 3.17Å; Y690-L698 HydrophobicContact CE1-CD1 3.65Å; Y690-L698 HydrophobicContact CG-CD1 3.85Å; Y690-V701 HydrophobicContact CD2-CB 3.6Å; Y690-V701 HydrophobicContact CD2-CG1 3.91Å; Y690-V701 HydrophobicContact CD2-CG2 3.74Å; Y690-V701 HydrophobicContact CE2-CB 3.77Å; Y690-V701 HydrophobicContact CE2-CG1 3.61Å; Y690-V701 HydrophobicContact CE2-CG2 4.33Å; Y690-V701 HydrophobicContact CG-CB 4.25Å; Y690-V701 HydrophobicContact CG-CG1 4.47Å; Y690-V701 HydrophobicContact CG-CG2 3.89Å
691	Y	88.4	Confident	81.7	Confident	93 Å²	93	48.7 Å²	48.7	37%	0.365	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-44.1	176	-173.8	-90.4	0	0	0	111.9	E687 I689 L693 G694 L706 E707 L821	E687-Y691 WeakPolarHBondContact O-CB 3.47Å; E687-Y691 PolarHBondContact O-N 3.32Å; I689-Y691 VanDerWaalsContact C-N 3.32Å; I689-Y691 PolarHBondContact O-N 3.42Å; Y691-L693 PolarHBondContact O-N 3.04Å; Y691-G694 PolarHBondContact O-N 3.36Å; Y691-L706 HydrophobicContact CD1-CD2 4.44Å; Y691-L706 HydrophobicContact CD2-CD2 4.17Å; Y691-L706 HydrophobicContact CG-CD2 3.82Å; Y691-E707 HydrophobicContact CD2-CG 4.45Å; Y691-E707 HydrophobicContact CE2-CG 4.18Å; Y691-L821 HydrophobicContact CD1-CD1 4.46Å; Y691-L821 HydrophobicContact CD1-CD2 3.91Å; Y691-L821 HydrophobicContact CE1-CD1 4.17Å; Y691-L821 HydrophobicContact CE1-CD2 4.39Å
692	A	88.1	Confident	81.4	Confident	6 Å²	6	45.5 Å²	45.5	5%	0.05	23%	0.226	C	C	.	.	H	α-helix	trans	-67.7	-32	179.2	0	0	0	0	0	113.6	L688 I689 Y690 M824 H828 M847	L688-A692 WeakPolarHBondContact O-CB 3.44Å; L688-A692 PolarHBondContact O-N 2.93Å; L688-A692 VanDerWaalsContact O-N 3.16Å; I689-A692 PolarHBondContact O-N 3.09Å; Y690-A692 PolarHBondContact O-N 2.8Å; A692-M824 HydrophobicContact CB-CB 3.98Å; A692-M824 HydrophobicContact CB-CE 4.4Å; A692-H828 PolarHBondContact O-CD2 3.46Å; A692-M847 HydrophobicContact CB-CE 4.16Å
693	L	84.3	Confident	81.4	Confident	13 Å²	13	45.9 Å²	45.9	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-76.6	-27.8	175	-63.1	169.9	0	0	0	112.4	V429 I689 Y690 Y691 H697 L698 H828 M847	V429-L693 HydrophobicContact CB-CD1 4.44Å; V429-L693 HydrophobicContact CG1-CD1 4.22Å; V429-L693 HydrophobicContact CG1-CD2 4.3Å; V429-L693 HydrophobicContact CG2-CD1 3.57Å; I689-L693 HydrophobicContact CG2-CD1 3.91Å; I689-L693 HydrophobicContact CG2-CG 4.49Å; I689-L693 VanDerWaalsContact O-CG 3.27Å; I689-L693 WeakPolarHBondContact O-CG 3.46Å; I689-L693 PolarHBondContact O-N 3.45Å; Y690-L693 PolarHBondContact O-N 2.65Å; Y691-L693 PolarHBondContact O-N 3.04Å; L693-H697 HydrophobicContact CB-CB 4.38Å; L693-H697 PolarHBondContact O-CE1 2.59Å; L693-H697 PolarHBondContact O-ND1 2.84Å; L693-L698 HydrophobicContact CD1-CD1 3.96Å; L693-H828 VanDerWaalsContact CD2-CE1 3.41Å; L693-H828 WeakPolarHBondContact CD2-CE1 3.4Å; L693-H828 WeakPolarHBondContact CD2-ND1 3.3Å; L693-M847 HydrophobicContact CD2-CE 4.33Å; L693-M847 HydrophobicContact CG-CE 4.41Å
694	G	74.1	Confident	81.3	Confident	21 Å²	21	45.9 Å²	45.9	22%	0.216	23%	0.227	C	C	.	.			trans	80.2	168.2	-178.8	0	0	0	0	0	114.9	Y690 Y691 Q696 H697	Y690-G694 PolarHBondContact O-N 3.46Å; Y691-G694 PolarHBondContact O-N 3.36Å; G694-Q696 VanDerWaalsContact C-N 3.26Å; G694-Q696 PolarHBondContact O-N 2.88Å; G694-Q696 VanDerWaalsContact O-N 3.15Å; G694-H697 PolarHBondContact O-N 3.38Å
695	P	62.9	Low	81.3	Confident	92 Å²	92	44.2 Å²	44.2	60%	0.597	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.9	-166.8	-20.4	32.1	0	0	0	115.1	H697	P695-H697 VanDerWaalsContact C-N 3.34Å
696	Q	60.6	Low	81.3	Confident	151 Å²	151	43.5 Å²	43.5	71%	0.706	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-24.8	-174.1	-60.9	-172.4	11.3	0	0	112.9	G694	G694-Q696 VanDerWaalsContact C-N 3.26Å; G694-Q696 PolarHBondContact O-N 2.88Å; G694-Q696 VanDerWaalsContact O-N 3.15Å
697	H	61.6	Low	81.1	Confident	123 Å²	123	45.1 Å²	45.1	57%	0.569	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-25.7	-173.2	-64.8	97.2	0	0	0	113.4	L693 G694 P695	L693-H697 HydrophobicContact CB-CB 4.38Å; L693-H697 PolarHBondContact O-CE1 2.59Å; L693-H697 PolarHBondContact O-ND1 2.84Å; G694-H697 PolarHBondContact O-N 3.38Å; P695-H697 VanDerWaalsContact C-N 3.34Å
698	L	67.4	Low	81	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.152	24%	0.238	C	C	.	.			trans	-136.3	101.1	-174.7	-64.3	171.8	0	0	0	110.4	Y690 L693 V701	Y690-L698 HydrophobicContact CD1-CD1 3.17Å; Y690-L698 HydrophobicContact CE1-CD1 3.65Å; Y690-L698 HydrophobicContact CG-CD1 3.85Å; L693-L698 HydrophobicContact CD1-CD1 3.96Å; L698-V701 HydrophobicContact CB-CG1 4.28Å; L698-V701 HydrophobicContact CB-CG2 3.49Å; L698-V701 VanDerWaalsContact CB-CG2 3.49Å; L698-V701 HydrophobicContact CD1-CG2 4.27Å
699	R	66.6	Low	80.9	Confident	169 Å²	169	48.7 Å²	48.7	64%	0.638	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-29.5	-173.3	-65.7	-175.9	179.6	-169.3	-1.6	113.8	R620	R620-R699 PolarHBondContact NH1-O 3.2Å
700	D	73.9	Confident	80.9	Confident	119 Å²	119	50.1 Å²	50.1	64%	0.636	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.6	30.2	-169.9	-53.4	-37.4	0	0	0	113	R620	R620-D700 IonicContact NH1-OD1 2.65Å
701	V	82.3	Confident	80.7	Confident	24 Å²	24	54 Å²	54	15%	0.145	26%	0.259	C	S	.	.			trans	-126.9	155.4	179.1	-56.1	0	0	0	0	110.7	Y690 L698	Y690-V701 HydrophobicContact CD2-CB 3.6Å; Y690-V701 HydrophobicContact CD2-CG1 3.91Å; Y690-V701 HydrophobicContact CD2-CG2 3.74Å; Y690-V701 HydrophobicContact CE2-CB 3.77Å; Y690-V701 HydrophobicContact CE2-CG1 3.61Å; Y690-V701 HydrophobicContact CE2-CG2 4.33Å; Y690-V701 HydrophobicContact CG-CB 4.25Å; Y690-V701 HydrophobicContact CG-CG1 4.47Å; Y690-V701 HydrophobicContact CG-CG2 3.89Å; L698-V701 HydrophobicContact CB-CG1 4.28Å; L698-V701 HydrophobicContact CB-CG2 3.49Å; L698-V701 VanDerWaalsContact CB-CG2 3.49Å; L698-V701 HydrophobicContact CD1-CG2 4.27Å
702	T	84.3	Confident	80.9	Confident	20 Å²	20	49.8 Å²	49.8	12%	0.123	24%	0.242	C	C	.	.			trans	-121.1	144.8	173.7	-175.9	0	0	0	0	109.9	V558 V580 A704	V558-T702 HydrophobicContact CG2-CG2 3.68Å; V580-T702 HydrophobicContact CG1-CG2 4.5Å; T702-A704 VanDerWaalsContact OG1-CB 3.31Å; T702-A704 WeakPolarHBondContact OG1-CB 3.31Å; T702-A704 PolarHBondContact OG1-N 3.04Å
703	T	89.6	Confident	81.1	Confident	25 Å²	25	49.8 Å²	49.8	15%	0.153	24%	0.241	C	C	.	.			trans	-114.5	15.2	172.9	43	0	0	0	0	111.3	N705 L706 E707	T703-N705 VanDerWaalsContact C-N 3.31Å; T703-N705 PolarHBondContact O-N 3.23Å; T703-L706 PolarHBondContact O-N 3.46Å; T703-E707 WeakPolarHBondContact O-CG 3.28Å; T703-E707 PolarHBondContact O-N 3.23Å; T703-E707 PolarHBondContact OG1-OE1 3.18Å
704	A	87.9	Confident	81.4	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-35.2	-170.7	0	0	0	0	0	113.9	I556 V580 T624 T702 R708	I556-A704 HydrophobicContact CB-CB 4.16Å; I556-A704 HydrophobicContact CD1-CB 4.09Å; I556-A704 HydrophobicContact CG2-CB 4.03Å; V580-A704 HydrophobicContact CG2-CB 4Å; T624-A704 HydrophobicContact CG2-CB 3.78Å; T702-A704 VanDerWaalsContact OG1-CB 3.31Å; T702-A704 WeakPolarHBondContact OG1-CB 3.31Å; T702-A704 PolarHBondContact OG1-N 3.04Å; A704-R708 WeakPolarHBondContact O-CB 3.38Å; A704-R708 PolarHBondContact O-N 3.09Å
705	N	89.6	Confident	82.4	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.043	25%	0.253	C	S	.	.	H	α-helix	trans	-71.6	-42.4	180	-57.3	-60.1	0	0	0	110.8	A555 I556 S682 I683 E687 T703 R708 F709	A555-N705 WeakPolarHBondContact CA-OD1 3.49Å; I556-N705 PolarHBondContact N-OD1 3.45Å; I556-N705 PolarHBondContact O-ND2 3.35Å; S682-N705 WeakPolarHBondContact O-CB 3.24Å; S682-N705 PolarHBondContact O-ND2 2.95Å; I683-N705 HydrophobicContact CG1-CB 4.35Å; E687-N705 PolarHBondContact OE1-ND2 3.3Å; E687-N705 WeakPolarHBondContact OE2-CB 3.35Å; E687-N705 PolarHBondContact OE2-N 3.12Å; T703-N705 VanDerWaalsContact C-N 3.31Å; T703-N705 PolarHBondContact O-N 3.23Å; N705-R708 PolarHBondContact O-N 3.3Å; N705-F709 PolarHBondContact O-N 3.43Å
706	L	90.4	Very high	83.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.4	-46.6	173.1	179	59.1	0	0	0	111.8	I683 E687 L688 Y691 T703 R708 F709 M710 M817 L821	I683-L706 HydrophobicContact CD1-CD1 4.16Å; I683-L706 HydrophobicContact CG2-CB 4.19Å; I683-L706 HydrophobicContact CG2-CD1 4.38Å; E687-L706 HydrophobicContact CB-CB 4.21Å; E687-L706 HydrophobicContact CB-CD2 4.43Å; E687-L706 PolarHBondContact OE2-N 3.42Å; L688-L706 HydrophobicContact CG-CD2 4.36Å; Y691-L706 HydrophobicContact CD1-CD2 4.44Å; Y691-L706 HydrophobicContact CD2-CD2 4.17Å; Y691-L706 HydrophobicContact CG-CD2 3.82Å; T703-L706 PolarHBondContact O-N 3.46Å; L706-R708 VanDerWaalsContact C-N 3.34Å; L706-R708 PolarHBondContact O-N 2.79Å; L706-F709 PolarHBondContact O-N 2.91Å; L706-M710 HydrophobicContact CD1-CG 4.31Å; L706-M710 WeakPolarHBondContact O-CG 3.43Å; L706-M710 PolarHBondContact O-N 2.88Å; L706-M817 HydrophobicContact CD1-CE 3.82Å; L706-L821 HydrophobicContact CD1-CD1 4.34Å; L706-L821 HydrophobicContact CD1-CD2 4.37Å; L706-L821 HydrophobicContact CD2-CD2 3.89Å
707	E	87.9	Confident	85.5	Confident	34 Å²	34	42.1 Å²	42.1	16%	0.159	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-43.8	176.8	-75.8	168.7	-166.6	0	0	111.7	T624 S625 Y691 T703 F709 M710 R711	T624-E707 VanDerWaalsContact C-OE2 3.32Å; T624-E707 PolarHBondContact OG1-OE2 3.45Å; S625-E707 PolarHBondContact N-OE2 2.83Å; Y691-E707 HydrophobicContact CD2-CG 4.45Å; Y691-E707 HydrophobicContact CE2-CG 4.18Å; T703-E707 WeakPolarHBondContact O-CG 3.28Å; T703-E707 PolarHBondContact O-N 3.23Å; T703-E707 PolarHBondContact OG1-OE1 3.18Å; E707-F709 VanDerWaalsContact C-N 3.33Å; E707-F709 PolarHBondContact O-N 3.02Å; E707-M710 PolarHBondContact O-N 3.47Å; E707-R711 WeakPolarHBondContact O-CB 3.41Å; E707-R711 PolarHBondContact O-N 3.47Å
708	R	87.6	Confident	87.2	Confident	84 Å²	84	37.7 Å²	37.7	32%	0.317	17%	0.172	S	C	.	.	H	α-helix	trans	-59.8	-41.9	174.6	-177.4	178.6	178.4	-164.7	-1.9	112.1	C554 L679 A704 N705 L706 R711 R712	C554-R708 PolarHBondContact O-NH1 2.85Å; C554-R708 PolarHBondContact SG-NH1 2.66Å; L679-R708 HydrophobicContact CD2-CG 4.17Å; L679-R708 VanDerWaalsContact CD2-CZ 3.43Å; L679-R708 VanDerWaalsContact CD2-NE 3.34Å; A704-R708 WeakPolarHBondContact O-CB 3.38Å; A704-R708 PolarHBondContact O-N 3.09Å; N705-R708 PolarHBondContact O-N 3.3Å; L706-R708 VanDerWaalsContact C-N 3.34Å; L706-R708 PolarHBondContact O-N 2.79Å; R708-R711 PolarHBondContact O-N 3.49Å; R708-R712 PolarHBondContact O-N 3.39Å
709	F	91.1	Very high	88.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.9	-37.6	176.6	-169.8	-106.3	0	0	0	112.6	D676 L679 F680 I683 N705 L706 E707 R712 F713 N754 I814 M817	D676-F709 HydrophobicContact CB-CE2 4.16Å; D676-F709 WeakPolarHBondContact O-CE2 3.42Å; L679-F709 HydrophobicContact CB-CD2 3.62Å; L679-F709 HydrophobicContact CB-CE2 4.29Å; L679-F709 HydrophobicContact CD1-CD2 4.38Å; F680-F709 HydrophobicContact CB-CD2 4.4Å; F680-F709 HydrophobicContact CB-CE2 3.92Å; F680-F709 HydrophobicContact CB-CZ 4.22Å; F680-F709 HydrophobicContact CD2-CE1 4.17Å; F680-F709 HydrophobicContact CD2-CZ 4.12Å; I683-F709 HydrophobicContact CD1-CB 3.67Å; I683-F709 HydrophobicContact CD1-CD1 3.93Å; I683-F709 HydrophobicContact CD1-CG 3.78Å; I683-F709 HydrophobicContact CG1-CB 4.39Å; N705-F709 PolarHBondContact O-N 3.43Å; L706-F709 PolarHBondContact O-N 2.91Å; E707-F709 VanDerWaalsContact C-N 3.33Å; E707-F709 PolarHBondContact O-N 3.02Å; F709-R712 WeakPolarHBondContact O-CB 3.29Å; F709-R712 PolarHBondContact O-N 3.44Å; F709-F713 PolarHBondContact O-N 3.13Å; F709-N754 HydrophobicContact CE1-CB 4.36Å; F709-N754 WeakPolarHBondContact CE1-ND2 3.4Å; F709-N754 HydrophobicContact CZ-CB 4.15Å; F709-N754 WeakPolarHBondContact CZ-ND2 3.45Å; F709-I814 HydrophobicContact CE1-CG2 4.43Å; F709-I814 HydrophobicContact CZ-CG2 3.72Å; F709-M817 HydrophobicContact CD1-CB 4.27Å; F709-M817 HydrophobicContact CD1-CG 3.84Å; F709-M817 HydrophobicContact CE1-CB 4.01Å; F709-M817 HydrophobicContact CE1-CG 3.4Å
710	M	89.8	Confident	90	Very high	29 Å²	29	28.4 Å²	28.4	14%	0.143	14%	0.135	C	C	.	.	H	α-helix	trans	-69.7	-37.5	175.1	-68.5	-57.6	-61.7	0	0	112.2	L706 E707 R712 F713 N714 M817 P818 L821	L706-M710 HydrophobicContact CD1-CG 4.31Å; L706-M710 WeakPolarHBondContact O-CG 3.43Å; L706-M710 PolarHBondContact O-N 2.88Å; E707-M710 PolarHBondContact O-N 3.47Å; M710-R712 VanDerWaalsContact C-N 3.3Å; M710-R712 PolarHBondContact O-N 3.49Å; M710-F713 WeakPolarHBondContact O-CB 3.29Å; M710-F713 PolarHBondContact O-N 3.14Å; M710-N714 PolarHBondContact O-N 3.31Å; M710-M817 HydrophobicContact SD-CB 3.96Å; M710-P818 HydrophobicContact CE-CB 4.17Å; M710-P818 HydrophobicContact CE-CG 3.71Å; M710-P818 HydrophobicContact SD-CG 4.46Å; M710-L821 HydrophobicContact CE-CD1 3.76Å; M710-L821 HydrophobicContact CG-CD1 3.77Å; M710-L821 HydrophobicContact SD-CD1 3.48Å; M710-L821 WeakPolarHBondContact SD-CD1 3.48Å
711	R	87.3	Confident	91.1	Very high	92 Å²	92	22.8 Å²	22.8	35%	0.347	11%	0.105	S	C	.	.	H	α-helix	trans	-59.4	-42.7	171.5	-176	179.1	171.6	115.1	1.3	111	L626 G627 L628 E707 R708 F713 N714 E715	L626-R711 PolarHBondContact O-NH1 3.02Å; G627-R711 PolarHBondContact O-NH1 3.49Å; L628-R711 HydrophobicContact CD2-CG 3.72Å; L628-R711 PolarHBondContact O-NH2 3.48Å; E707-R711 WeakPolarHBondContact O-CB 3.41Å; E707-R711 PolarHBondContact O-N 3.47Å; R708-R711 PolarHBondContact O-N 3.49Å; R711-F713 VanDerWaalsContact C-N 3.31Å; R711-F713 PolarHBondContact O-N 2.82Å; R711-N714 PolarHBondContact O-N 3.37Å; R711-E715 WeakPolarHBondContact O-CB 3.39Å; R711-E715 PolarHBondContact O-N 3.28Å
712	R	91.1	Very high	91.8	Very high	5 Å²	5	21.6 Å²	21.6	2%	0.019	10%	0.098	C	C	.	.	H	α-helix	trans	-58.4	-39.1	174.6	177.1	57	172.1	-167.3	-6.7	113	D676 L679 R708 F709 M710 E715 L716 V904	D676-R712 IonicContact OD1-NE 2.97Å; D676-R712 PolarHBondContact OD1-NE 3.09Å; L679-R712 HydrophobicContact CD1-CB 3.93Å; L679-R712 HydrophobicContact CD1-CG 3.96Å; R708-R712 PolarHBondContact O-N 3.39Å; F709-R712 WeakPolarHBondContact O-CB 3.29Å; F709-R712 PolarHBondContact O-N 3.44Å; M710-R712 VanDerWaalsContact C-N 3.3Å; M710-R712 PolarHBondContact O-N 3.49Å; R712-E715 WeakPolarHBondContact CD-OE2 3.14Å; R712-E715 IonicContact CZ-OE2 3.79Å; R712-E715 IonicContact NE-OE2 3.26Å; R712-E715 IonicContact NH1-OE2 3.8Å; R712-E715 PolarHBondContact NH1-OE2 3.42Å; R712-E715 WeakPolarHBondContact O-CB 3.38Å; R712-E715 PolarHBondContact O-N 3.06Å; R712-L716 WeakPolarHBondContact O-CG 3.34Å; R712-L716 PolarHBondContact O-N 2.77Å; R712-V904 PolarHBondContact NH1-O 3.15Å; R712-V904 VanDerWaalsContact NH1-O 3.13Å; R712-V904 PolarHBondContact NH2-O 2.82Å
713	F	93.5	Very high	92.4	Very high	7 Å²	7	21 Å²	21	3%	0.031	9%	0.094	C	C	.	.	H	α-helix	trans	-58.5	-49.3	174.7	-179.9	-85	0	0	0	111.6	F709 M710 R711 L716 Q717 N754 F757 A758 F761 F816 P818	F709-F713 PolarHBondContact O-N 3.13Å; M710-F713 WeakPolarHBondContact O-CB 3.29Å; M710-F713 PolarHBondContact O-N 3.14Å; R711-F713 VanDerWaalsContact C-N 3.31Å; R711-F713 PolarHBondContact O-N 2.82Å; F713-L716 PolarHBondContact O-N 3.01Å; F713-Q717 PolarHBondContact O-N 2.88Å; F713-Q717 VanDerWaalsContact O-N 3.12Å; F713-N754 WeakPolarHBondContact CD2-O 3.3Å; F713-N754 VanDerWaalsContact CE2-O 3.27Å; F713-N754 WeakPolarHBondContact CE2-O 3.41Å; F713-F757 HydrophobicContact CE2-CB 3.95Å; F713-F757 HydrophobicContact CZ-CB 4.3Å; F713-A758 HydrophobicContact CD2-CB 3.74Å; F713-A758 HydrophobicContact CE2-CB 3.75Å; F713-A758 HydrophobicContact CG-CB 4.16Å; F713-A758 HydrophobicContact CZ-CB 4.15Å; F713-A758 WeakPolarHBondContact O-CB 3.34Å; F713-F761 AromaticContact CE1-CD2 3.83Å; F713-F761 HydrophobicContact CE1-CD2 3.83Å; F713-F761 HydrophobicContact CE1-CE2 4.21Å; F713-F761 AromaticContact CZ-CD2 3.49Å; F713-F761 HydrophobicContact CZ-CD2 3.49Å; F713-F761 VanDerWaalsContact CZ-CD2 3.49Å; F713-F761 AromaticContact CZ-CE2 3.72Å; F713-F761 HydrophobicContact CZ-CE2 3.72Å; F713-F816 HydrophobicContact CE2-CD2 4.05Å; F713-F816 AromaticContact CE2-CE2 3.72Å; F713-F816 HydrophobicContact CE2-CE2 3.72Å; F713-F816 AromaticContact CZ-CE2 3.73Å; F713-F816 HydrophobicContact CZ-CE2 3.73Å; F713-P818 HydrophobicContact CD1-CG 4.23Å; F713-P818 HydrophobicContact CD2-CG 4.12Å; F713-P818 HydrophobicContact CE1-CG 4.21Å; F713-P818 HydrophobicContact CE2-CG 4.08Å; F713-P818 HydrophobicContact CG-CG 4.21Å; F713-P818 HydrophobicContact CZ-CG 4.14Å
714	N	90.7	Very high	92.7	Very high	67 Å²	67	20 Å²	20	36%	0.358	9%	0.087	S	C	.	.	H	α-helix	trans	-65.5	-40.3	178.7	-67.7	-34.9	0	0	0	111.6	L628 M710 R711 L716 Q717 Y718	L628-N714 HydrophobicContact CD1-CB 3.88Å; L628-N714 HydrophobicContact CD2-CB 4.41Å; L628-N714 HydrophobicContact CG-CB 4.23Å; M710-N714 PolarHBondContact O-N 3.31Å; R711-N714 PolarHBondContact O-N 3.37Å; N714-L716 VanDerWaalsContact C-N 3.33Å; N714-L716 PolarHBondContact O-N 3.15Å; N714-Q717 WeakPolarHBondContact O-CB 3.21Å; N714-Q717 PolarHBondContact O-N 3.25Å; N714-Y718 HydrophobicContact CB-CD2 4.49Å; N714-Y718 VanDerWaalsContact O-CD2 3.27Å; N714-Y718 WeakPolarHBondContact O-CD2 3.27Å; N714-Y718 PolarHBondContact O-N 3.48Å
715	E	93.4	Very high	93.2	Very high	36 Å²	36	20.1 Å²	20.1	17%	0.168	9%	0.088	C	C	.	.	H	α-helix	trans	-55.6	-48.8	177.2	-174.9	-175.6	-134.5	0	0	110.8	L628 R711 R712 Q717 Y718 W719 L907 V909	L628-E715 HydrophobicContact CD2-CB 3.7Å; L628-E715 HydrophobicContact CD2-CG 4.42Å; R711-E715 WeakPolarHBondContact O-CB 3.39Å; R711-E715 PolarHBondContact O-N 3.28Å; R712-E715 WeakPolarHBondContact CD-OE2 3.14Å; R712-E715 IonicContact CZ-OE2 3.79Å; R712-E715 IonicContact NE-OE2 3.26Å; R712-E715 IonicContact NH1-OE2 3.8Å; R712-E715 PolarHBondContact NH1-OE2 3.42Å; R712-E715 WeakPolarHBondContact O-CB 3.38Å; R712-E715 PolarHBondContact O-N 3.06Å; E715-Q717 PolarHBondContact O-N 3.25Å; E715-Y718 PolarHBondContact O-N 3.41Å; E715-W719 WeakPolarHBondContact O-CB 3.36Å; E715-W719 PolarHBondContact O-N 3.35Å; E715-L907 HydrophobicContact CG-CB 4.04Å; E715-L907 HydrophobicContact CG-CD1 4.3Å; E715-V909 HydrophobicContact CG-CG1 4.32Å
716	L	95.2	Very high	93.5	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.6	-39	178	-68.6	178.3	0	0	0	112.9	L672 R712 F713 N714 W719 V720 S755 A758 L907	L672-L716 HydrophobicContact CD2-CD1 4.33Å; L672-L716 HydrophobicContact CD2-CD2 3.57Å; R712-L716 WeakPolarHBondContact O-CG 3.34Å; R712-L716 PolarHBondContact O-N 2.77Å; F713-L716 PolarHBondContact O-N 3.01Å; N714-L716 VanDerWaalsContact C-N 3.33Å; N714-L716 PolarHBondContact O-N 3.15Å; L716-W719 HydrophobicContact CD2-CE3 4Å; L716-W719 HydrophobicContact CD2-CZ3 4.28Å; L716-V720 WeakPolarHBondContact O-CG2 3.3Å; L716-V720 PolarHBondContact O-N 2.94Å; L716-S755 VanDerWaalsContact CD1-OG 3.27Å; L716-S755 WeakPolarHBondContact CD1-OG 3.43Å; L716-A758 HydrophobicContact CB-CB 3.8Å; L716-L907 HydrophobicContact CD2-CD1 3.67Å
717	Q	94.8	Very high	93.8	Very high	13 Å²	13	21.4 Å²	21.4	6%	0.061	10%	0.096	C	C	.	.	H	α-helix	trans	-60	-50.1	175.9	-179.4	-171.2	-53.7	0	0	111.3	F713 N714 E715 A758 F761 G762	F713-Q717 PolarHBondContact O-N 2.88Å; F713-Q717 VanDerWaalsContact O-N 3.12Å; N714-Q717 WeakPolarHBondContact O-CB 3.21Å; N714-Q717 PolarHBondContact O-N 3.25Å; E715-Q717 PolarHBondContact O-N 3.25Å; Q717-A758 WeakPolarHBondContact CA-O 3.49Å; Q717-F761 HydrophobicContact CG-CB 3.93Å; Q717-G762 WeakPolarHBondContact O-CA 3.2Å
718	Y	96.1	Very high	94	Very high	30 Å²	30	24.2 Å²	24.2	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-75.2	-28.8	-178.4	-77.4	-70.3	0	0	0	112.8	L628 N714 E715 A721 T722 I910 D911 L916	L628-Y718 HydrophobicContact CD1-CD2 3.5Å; L628-Y718 HydrophobicContact CD1-CE2 4.23Å; L628-Y718 HydrophobicContact CD1-CG 4.25Å; N714-Y718 HydrophobicContact CB-CD2 4.49Å; N714-Y718 VanDerWaalsContact O-CD2 3.27Å; N714-Y718 WeakPolarHBondContact O-CD2 3.27Å; N714-Y718 PolarHBondContact O-N 3.48Å; E715-Y718 PolarHBondContact O-N 3.41Å; Y718-A721 PolarHBondContact O-N 3.25Å; Y718-T722 VanDerWaalsContact O-CB 3.27Å; Y718-T722 WeakPolarHBondContact O-CB 3.48Å; Y718-T722 PolarHBondContact O-N 3.38Å; Y718-T722 PolarHBondContact O-OG1 3.22Å; Y718-I910 WeakPolarHBondContact CD1-O 3.45Å; Y718-D911 HydrophobicContact CD1-CB 4.44Å; Y718-D911 HydrophobicContact CD2-CB 4.21Å; Y718-D911 HydrophobicContact CE2-CB 4.35Å; Y718-D911 HydrophobicContact CG-CB 4.24Å; Y718-L916 HydrophobicContact CD1-CD1 3.82Å; Y718-L916 HydrophobicContact CE1-CD1 4.11Å
719	W	96.7	Very high	94.3	Very high	3 Å²	3	24.2 Å²	24.2	1%	0.011	13%	0.126	C	C	.	.	H	α-helix	trans	-59	-46.4	172.6	166.3	63.3	0	0	0	111.9	L660 L668 E715 L716 A721 T722 E723 F740 L743 Y903 L907 V909	L660-W719 HydrophobicContact CD1-CZ2 4.33Å; L660-W719 HydrophobicContact CD2-CZ2 3.94Å; L668-W719 HydrophobicContact CD1-CH2 4.46Å; L668-W719 HydrophobicContact CD2-CH2 3.8Å; L668-W719 HydrophobicContact CD2-CZ2 4.31Å; L668-W719 HydrophobicContact CG-CH2 4.35Å; E715-W719 WeakPolarHBondContact O-CB 3.36Å; E715-W719 PolarHBondContact O-N 3.35Å; L716-W719 HydrophobicContact CD2-CE3 4Å; L716-W719 HydrophobicContact CD2-CZ3 4.28Å; W719-A721 VanDerWaalsContact C-N 3.33Å; W719-A721 PolarHBondContact O-N 3.06Å; W719-T722 PolarHBondContact O-N 2.7Å; W719-E723 WeakPolarHBondContact O-CB 3.44Å; W719-E723 WeakPolarHBondContact O-CG 3.27Å; W719-E723 PolarHBondContact O-N 3.08Å; W719-F740 HydrophobicContact CD2-CE1 4.43Å; W719-F740 HydrophobicContact CE3-CE1 4.14Å; W719-F740 HydrophobicContact CH2-CD1 4.4Å; W719-F740 AromaticContact CH2-CE1 3.53Å; W719-F740 HydrophobicContact CH2-CE1 3.53Å; W719-F740 HydrophobicContact CH2-CZ 4.4Å; W719-F740 AromaticContact CZ2-CE1 3.81Å; W719-F740 HydrophobicContact CZ2-CE1 3.81Å; W719-F740 HydrophobicContact CZ2-CZ 4.25Å; W719-F740 HydrophobicContact CZ3-CD1 4.39Å; W719-F740 AromaticContact CZ3-CE1 3.69Å; W719-F740 HydrophobicContact CZ3-CE1 3.69Å; W719-L743 HydrophobicContact CH2-CD2 3.93Å; W719-L743 HydrophobicContact CZ3-CD2 3.88Å; W719-Y903 HydrophobicContact CZ2-CE1 4.27Å; W719-Y903 PolarHBondContact NE1-OH 2.72Å; W719-Y903 VanDerWaalsContact NE1-OH 3.07Å; W719-L907 HydrophobicContact CB-CD1 4.29Å; W719-L907 HydrophobicContact CD2-CD1 4.15Å; W719-L907 HydrophobicContact CD2-CD2 4.43Å; W719-L907 HydrophobicContact CE3-CD1 4.5Å; W719-L907 HydrophobicContact CG-CD1 4.05Å; W719-L907 HydrophobicContact CG-CD2 4.31Å; W719-V909 HydrophobicContact CB-CG1 3.64Å
720	V	96.9	Very high	94.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.3	-46.5	176.4	172	0	0	0	0	111.3	L716 L724 F740 V759 L763	L716-V720 WeakPolarHBondContact O-CG2 3.3Å; L716-V720 PolarHBondContact O-N 2.94Å; V720-L724 HydrophobicContact CG1-CD1 4.06Å; V720-L724 WeakPolarHBondContact O-CG 3.48Å; V720-L724 PolarHBondContact O-N 3.22Å; V720-F740 HydrophobicContact CG1-CD1 4.47Å; V720-F740 HydrophobicContact CG1-CD2 3.96Å; V720-F740 HydrophobicContact CG1-CE2 4.23Å; V720-F740 HydrophobicContact CG1-CG 4.09Å; V720-F740 HydrophobicContact CG2-CD1 3.84Å; V720-F740 HydrophobicContact CG2-CE1 3.86Å; V720-F740 HydrophobicContact CG2-CG 4.28Å; V720-F740 HydrophobicContact CG2-CZ 4.29Å; V720-V759 HydrophobicContact CG2-CB 4.38Å; V720-V759 HydrophobicContact CG2-CG1 4.13Å; V720-V759 HydrophobicContact CG2-CG2 4.21Å; V720-L763 HydrophobicContact CG1-CD2 3.84Å; V720-L763 HydrophobicContact CG1-CG 4.15Å
721	A	96.6	Very high	94.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67	-40.9	179.3	0	0	0	0	0	112.2	Y718 W719 L724 C725 I768 L916	Y718-A721 PolarHBondContact O-N 3.25Å; W719-A721 VanDerWaalsContact C-N 3.33Å; W719-A721 PolarHBondContact O-N 3.06Å; A721-L724 PolarHBondContact O-N 2.64Å; A721-C725 WeakPolarHBondContact O-CB 3.42Å; A721-C725 PolarHBondContact O-N 3.01Å; A721-C725 PolarHBondContact O-SG 2.82Å; A721-I768 HydrophobicContact CB-CD1 4.44Å; A721-I768 HydrophobicContact CB-CG1 4.19Å; A721-L916 HydrophobicContact CB-CD1 4.03Å; A721-L916 HydrophobicContact CB-CD2 4.44Å
722	T	97.2	Very high	94.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.4	-52.4	178.7	-60.2	0	0	0	0	110.9	P652 Y718 W719 L724 C725 L726 I910	P652-T722 HydrophobicContact CG-CG2 3.79Å; Y718-T722 VanDerWaalsContact O-CB 3.27Å; Y718-T722 WeakPolarHBondContact O-CB 3.48Å; Y718-T722 PolarHBondContact O-N 3.38Å; Y718-T722 PolarHBondContact O-OG1 3.22Å; W719-T722 PolarHBondContact O-N 2.7Å; T722-L724 VanDerWaalsContact C-N 3.31Å; T722-L724 PolarHBondContact O-N 3.44Å; T722-C725 PolarHBondContact O-N 3.37Å; T722-L726 HydrophobicContact CG2-CD1 3.65Å; T722-L726 HydrophobicContact CG2-CG 4.33Å; T722-L726 WeakPolarHBondContact O-CB 3.36Å; T722-L726 VanDerWaalsContact O-CG 3.32Å; T722-L726 WeakPolarHBondContact O-CG 3.39Å; T722-L726 PolarHBondContact O-N 3.03Å; T722-I910 HydrophobicContact CG2-CB 4.35Å; T722-I910 HydrophobicContact CG2-CD1 4.12Å; T722-I910 HydrophobicContact CG2-CG1 3.9Å; T722-I910 PolarHBondContact OG1-N 3.21Å; T722-I910 PolarHBondContact OG1-O 2.91Å
723	E	96.9	Very high	95	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-36.2	-177.7	-71.7	-64.2	154.7	0	0	112.6	S656 A657 L660 W719 C727 L736 F740	S656-E723 PolarHBondContact N-OE1 3.07Å; S656-E723 PolarHBondContact N-OE2 2.91Å; S656-E723 PolarHBondContact OG-OE1 3.36Å; S656-E723 PolarHBondContact OG-OE2 3.37Å; A657-E723 PolarHBondContact N-OE2 3.27Å; L660-E723 HydrophobicContact CD1-CB 4.46Å; L660-E723 HydrophobicContact CD1-CG 3.94Å; W719-E723 WeakPolarHBondContact O-CB 3.44Å; W719-E723 WeakPolarHBondContact O-CG 3.27Å; W719-E723 PolarHBondContact O-N 3.08Å; E723-C727 WeakPolarHBondContact O-CB 3.47Å; E723-C727 PolarHBondContact O-N 3.39Å; E723-L736 HydrophobicContact CB-CD2 4.1Å; E723-L736 WeakPolarHBondContact O-CD2 3.46Å; E723-F740 HydrophobicContact CB-CE2 4.14Å; E723-F740 HydrophobicContact CB-CZ 4.01Å; E723-F740 HydrophobicContact CG-CZ 4.42Å
724	L	96.9	Very high	95.2	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-73	-40.8	176.5	-72.2	169.6	0	0	0	112.5	V720 A721 T722 L726 C727 R733 L736 L737 F740 L763 I768	V720-L724 HydrophobicContact CG1-CD1 4.06Å; V720-L724 WeakPolarHBondContact O-CG 3.48Å; V720-L724 PolarHBondContact O-N 3.22Å; A721-L724 PolarHBondContact O-N 2.64Å; T722-L724 VanDerWaalsContact C-N 3.31Å; T722-L724 PolarHBondContact O-N 3.44Å; L724-L726 VanDerWaalsContact C-N 3.34Å; L724-C727 PolarHBondContact O-N 3.01Å; L724-R733 HydrophobicContact CD2-CG 4.2Å; L724-R733 VanDerWaalsContact O-CD 3.3Å; L724-R733 WeakPolarHBondContact O-CD 3.21Å; L724-L736 HydrophobicContact CD2-CB 4.19Å; L724-L736 HydrophobicContact CD2-CD2 4.07Å; L724-L736 HydrophobicContact CD2-CG 3.94Å; L724-L737 HydrophobicContact CD1-CD1 4.14Å; L724-L737 HydrophobicContact CD2-CB 3.98Å; L724-F740 HydrophobicContact CD1-CD2 4.15Å; L724-F740 HydrophobicContact CD1-CE2 4.45Å; L724-F740 HydrophobicContact CD2-CD2 4.32Å; L724-F740 HydrophobicContact CD2-CE2 4.43Å; L724-F740 HydrophobicContact CG-CD2 4.12Å; L724-F740 HydrophobicContact CG-CE2 4.04Å; L724-L763 HydrophobicContact CD1-CD2 4.19Å; L724-I768 HydrophobicContact CB-CD1 3.56Å; L724-I768 HydrophobicContact CD1-CD1 4.07Å; L724-I768 HydrophobicContact CD1-CG1 4.18Å; L724-I768 HydrophobicContact CD1-CG2 3.62Å; L724-I768 HydrophobicContact CG-CD1 4.47Å
725	C	97.3	Very high	95.4	Very high	4 Å²	4	26.7 Å²	26.7	3%	0.027	16%	0.156	C	C	.	.	H	α-helix	trans	-71.4	-25.8	177.3	-75.4	0	0	0	0	113.2	A721 T722 C727 L916 L919 L923	A721-C725 WeakPolarHBondContact O-CB 3.42Å; A721-C725 PolarHBondContact O-N 3.01Å; A721-C725 PolarHBondContact O-SG 2.82Å; T722-C725 PolarHBondContact O-N 3.37Å; C725-C727 VanDerWaalsContact C-N 3.34Å; C725-L916 HydrophobicContact CB-CD2 4.28Å; C725-L916 PolarHBondContact SG-O 3.48Å; C725-L919 HydrophobicContact CB-CB 3.97Å; C725-L919 HydrophobicContact CB-CD1 4.22Å; C725-L923 WeakPolarHBondContact O-CD1 3.27Å
726	L	96.8	Very high	95.5	Very high	28 Å²	28	25.1 Å²	25.1	15%	0.147	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	6.8	175.8	-64.8	179	0	0	0	113.4	P652 T722 L724 P728 I910 L919	P652-L726 HydrophobicContact CB-CD1 4.39Å; P652-L726 HydrophobicContact CG-CD1 4.11Å; T722-L726 HydrophobicContact CG2-CD1 3.65Å; T722-L726 HydrophobicContact CG2-CG 4.33Å; T722-L726 WeakPolarHBondContact O-CB 3.36Å; T722-L726 VanDerWaalsContact O-CG 3.32Å; T722-L726 WeakPolarHBondContact O-CG 3.39Å; T722-L726 PolarHBondContact O-N 3.03Å; L724-L726 VanDerWaalsContact C-N 3.34Å; L726-P728 WeakPolarHBondContact O-CD 3.36Å; L726-I910 HydrophobicContact CD1-CD1 4.29Å; L726-I910 HydrophobicContact CD2-CD1 4.32Å; L726-I910 HydrophobicContact CG-CD1 4.41Å; L726-L919 HydrophobicContact CD2-CD1 3.99Å
727	C	95.5	Very high	95.6	Very high	8 Å²	8	25.1 Å²	25.1	5%	0.054	15%	0.149	C	C	.	.			trans	-100	95.3	175.5	-168.3	0	0	0	0	110.3	E723 L724 C725 V729 R733 L736	E723-C727 WeakPolarHBondContact O-CB 3.47Å; E723-C727 PolarHBondContact O-N 3.39Å; L724-C727 PolarHBondContact O-N 3.01Å; C725-C727 VanDerWaalsContact C-N 3.34Å; C727-V729 PolarHBondContact O-N 3.41Å; C727-R733 HydrophobicContact CB-CB 4.05Å; C727-R733 HydrophobicContact CB-CG 4.13Å; C727-R733 WeakPolarHBondContact O-CD 3.43Å; C727-R733 PolarHBondContact O-NH1 3.4Å; C727-R733 VanDerWaalsContact SG-CA 3.6Å; C727-R733 PolarHBondContact SG-N 3.48Å; C727-R733 VanDerWaalsContact SG-N 3.44Å; C727-L736 HydrophobicContact CB-CD2 4.3Å
728	P	93.1	Very high	95.8	Very high	93 Å²	93	29.4 Å²	29.4	60%	0.604	17%	0.165	S	C	*	.			trans	-68.3	-35.4	-169.8	24.9	-34	0	0	0	113.3	L726 R733 L923	L726-P728 WeakPolarHBondContact O-CD 3.36Å; P728-R733 PolarHBondContact O-NH1 2.66Å; P728-L923 HydrophobicContact CB-CD2 4.48Å
729	V	92.8	Very high	95.8	Very high	83 Å²	83	29.3 Å²	29.3	50%	0.503	17%	0.165	S	C	.	.	S	Bend	trans	-84.8	124.1	-172.5	-170.2	0	0	0	0	110.8	C727 G731 P732 R733	C727-V729 PolarHBondContact O-N 3.41Å; V729-G731 VanDerWaalsContact C-N 3.32Å; V729-G731 PolarHBondContact O-N 3.3Å; V729-P732 HydrophobicContact CB-CG 4Å; V729-P732 VanDerWaalsContact CG1-CD 3.49Å; V729-P732 HydrophobicContact CG1-CG 4.1Å; V729-P732 WeakPolarHBondContact O-CD 3.33Å; V729-R733 VanDerWaalsContact O-CB 3.29Å; V729-R733 WeakPolarHBondContact O-CB 3.41Å; V729-R733 PolarHBondContact O-N 2.95Å
730	P	91.8	Very high	95.9	Very high	46 Å²	46	29.3 Å²	29.3	30%	0.299	17%	0.165	S	C	.	.	H	α-helix	trans	-60.1	-33.9	-175.3	-26.1	33.2	0	0	0	115.4	A734	P730-A734 WeakPolarHBondContact O-CB 3.49Å; P730-A734 PolarHBondContact O-N 2.95Å
731	G	93.3	Very high	95.9	Very high	27 Å²	27	29.3 Å²	29.3	28%	0.278	17%	0.165	S	C	.	.	H	α-helix	trans	-63.9	-62.2	179.3	0	0	0	0	0	112.6	V729 R733 A734 Q735	V729-G731 VanDerWaalsContact C-N 3.32Å; V729-G731 PolarHBondContact O-N 3.3Å; G731-R733 VanDerWaalsContact C-N 3.27Å; G731-R733 PolarHBondContact O-N 3.47Å; G731-A734 PolarHBondContact O-N 3.5Å; G731-Q735 PolarHBondContact O-N 3.14Å; G731-Q735 VanDerWaalsContact O-N 3.16Å
732	P	94.1	Very high	96	Very high	53 Å²	53	33.1 Å²	33.1	34%	0.344	18%	0.182	S	C	.	.	H	α-helix	trans	-54.2	-40.1	171.7	-28.3	36.8	0	0	0	113.1	V729 A734 Q735 L736	V729-P732 HydrophobicContact CB-CG 4Å; V729-P732 VanDerWaalsContact CG1-CD 3.49Å; V729-P732 HydrophobicContact CG1-CG 4.1Å; V729-P732 WeakPolarHBondContact O-CD 3.33Å; P732-A734 PolarHBondContact O-N 3.01Å; P732-Q735 WeakPolarHBondContact O-CA 3.47Å; P732-Q735 WeakPolarHBondContact O-CB 3.42Å; P732-Q735 PolarHBondContact O-N 3.06Å; P732-L736 PolarHBondContact O-N 3.05Å
733	R	96.2	Very high	96.1	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-59.8	-42.4	176.9	-170.8	171.2	57.2	-119	11.9	112.5	L724 C727 P728 V729 G731 Q735 L736 L737 T774 E924	L724-R733 HydrophobicContact CD2-CG 4.2Å; L724-R733 VanDerWaalsContact O-CD 3.3Å; L724-R733 WeakPolarHBondContact O-CD 3.21Å; C727-R733 HydrophobicContact CB-CB 4.05Å; C727-R733 HydrophobicContact CB-CG 4.13Å; C727-R733 WeakPolarHBondContact O-CD 3.43Å; C727-R733 PolarHBondContact O-NH1 3.4Å; C727-R733 VanDerWaalsContact SG-CA 3.6Å; C727-R733 PolarHBondContact SG-N 3.48Å; C727-R733 VanDerWaalsContact SG-N 3.44Å; P728-R733 PolarHBondContact O-NH1 2.66Å; V729-R733 VanDerWaalsContact O-CB 3.29Å; V729-R733 WeakPolarHBondContact O-CB 3.41Å; V729-R733 PolarHBondContact O-N 2.95Å; G731-R733 VanDerWaalsContact C-N 3.27Å; G731-R733 PolarHBondContact O-N 3.47Å; R733-Q735 VanDerWaalsContact C-N 3.33Å; R733-Q735 PolarHBondContact O-N 3.31Å; R733-L736 PolarHBondContact O-N 3.4Å; R733-L737 WeakPolarHBondContact O-CB 3.33Å; R733-L737 PolarHBondContact O-N 3.44Å; R733-T774 HydrophobicContact CB-CG2 4.39Å; R733-T774 HydrophobicContact CG-CG2 3.91Å; R733-T774 PolarHBondContact NE-OG1 3.37Å; R733-T774 PolarHBondContact NH2-OG1 3.13Å; R733-E924 IonicContact CZ-OE1 3.79Å; R733-E924 IonicContact NE-OE1 3.89Å; R733-E924 IonicContact NH2-OE1 2.87Å; R733-E924 PolarHBondContact NH2-OE1 3.02Å
734	A	96.4	Very high	96.1	Very high	8 Å²	8	32.8 Å²	32.8	7%	0.066	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-32.6	174.5	0	0	0	0	0	112.7	P730 G731 P732 R738 T774 R777 L778	P730-A734 WeakPolarHBondContact O-CB 3.49Å; P730-A734 PolarHBondContact O-N 2.95Å; G731-A734 PolarHBondContact O-N 3.5Å; P732-A734 PolarHBondContact O-N 3.01Å; A734-R738 WeakPolarHBondContact O-CB 3.18Å; A734-R738 PolarHBondContact O-N 3.41Å; A734-T774 HydrophobicContact CB-CG2 4.17Å; A734-R777 HydrophobicContact CB-CB 3.83Å; A734-L778 WeakPolarHBondContact O-CD2 3.34Å
735	Q	95.3	Very high	96.2	Very high	118 Å²	118	33.9 Å²	33.9	55%	0.551	19%	0.189	S	C	*	.	H	α-helix	trans	-68.3	-41.3	173.9	-64.9	179.2	9.4	0	0	111.7	G731 P732 R733 R738 K739	G731-Q735 PolarHBondContact O-N 3.14Å; G731-Q735 VanDerWaalsContact O-N 3.16Å; P732-Q735 WeakPolarHBondContact O-CA 3.47Å; P732-Q735 WeakPolarHBondContact O-CB 3.42Å; P732-Q735 PolarHBondContact O-N 3.06Å; R733-Q735 VanDerWaalsContact C-N 3.33Å; R733-Q735 PolarHBondContact O-N 3.31Å; Q735-R738 WeakPolarHBondContact O-CB 3.44Å; Q735-R738 PolarHBondContact O-N 3.47Å; Q735-K739 WeakPolarHBondContact O-CB 3.4Å; Q735-K739 PolarHBondContact O-N 2.85Å
736	L	96.6	Very high	96.2	Very high	2 Å²	2	36 Å²	36	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-44	174.5	-176.9	59.2	0	0	0	111.5	A657 L660 E723 L724 C727 P732 R733 R738 K739 F740	A657-L736 HydrophobicContact CB-CD2 4.19Å; L660-L736 HydrophobicContact CD1-CD1 4.03Å; E723-L736 HydrophobicContact CB-CD2 4.1Å; E723-L736 WeakPolarHBondContact O-CD2 3.46Å; L724-L736 HydrophobicContact CD2-CB 4.19Å; L724-L736 HydrophobicContact CD2-CD2 4.07Å; L724-L736 HydrophobicContact CD2-CG 3.94Å; C727-L736 HydrophobicContact CB-CD2 4.3Å; P732-L736 PolarHBondContact O-N 3.05Å; R733-L736 PolarHBondContact O-N 3.4Å; L736-R738 PolarHBondContact O-N 3.12Å; L736-K739 WeakPolarHBondContact O-CA 3.42Å; L736-K739 VanDerWaalsContact O-CB 3.24Å; L736-K739 WeakPolarHBondContact O-CB 3.33Å; L736-K739 PolarHBondContact O-N 3.18Å; L736-F740 HydrophobicContact CD1-CD2 4.25Å; L736-F740 HydrophobicContact CD1-CE2 3.68Å; L736-F740 HydrophobicContact CD1-CZ 4.05Å; L736-F740 HydrophobicContact CD2-CE2 4.25Å; L736-F740 HydrophobicContact CG-CD2 4.11Å; L736-F740 HydrophobicContact CG-CE2 3.67Å; L736-F740 HydrophobicContact CG-CZ 4.48Å; L736-F740 WeakPolarHBondContact O-CD2 3.27Å; L736-F740 PolarHBondContact O-N 3.02Å
737	L	97.6	Very high	96.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-47.5	173.2	179	57.8	0	0	0	111.6	L724 R733 K739 F740 I741 L763 T774 W775 L778	L724-L737 HydrophobicContact CD1-CD1 4.14Å; L724-L737 HydrophobicContact CD2-CB 3.98Å; R733-L737 WeakPolarHBondContact O-CB 3.33Å; R733-L737 PolarHBondContact O-N 3.44Å; L737-K739 PolarHBondContact O-N 3.48Å; L737-F740 PolarHBondContact O-N 2.93Å; L737-I741 HydrophobicContact CD1-CD1 4.42Å; L737-I741 HydrophobicContact CG-CD1 4.29Å; L737-I741 WeakPolarHBondContact O-CG1 3.35Å; L737-I741 PolarHBondContact O-N 2.99Å; L737-L763 HydrophobicContact CD1-CD2 3.44Å; L737-L763 VanDerWaalsContact CD1-CD2 3.44Å; L737-T774 HydrophobicContact CD2-CG2 3.85Å; L737-W775 HydrophobicContact CD1-CH2 3.9Å; L737-W775 HydrophobicContact CD1-CZ2 3.98Å; L737-W775 HydrophobicContact CD1-CZ3 4.35Å; L737-W775 HydrophobicContact CD2-CD2 3.77Å; L737-W775 HydrophobicContact CD2-CE3 3.9Å; L737-W775 HydrophobicContact CD2-CG 4.28Å; L737-W775 HydrophobicContact CD2-CH2 4.33Å; L737-W775 HydrophobicContact CD2-CZ2 4.21Å; L737-W775 HydrophobicContact CD2-CZ3 4.18Å; L737-L778 HydrophobicContact CB-CD2 4.42Å; L737-L778 HydrophobicContact CD2-CD1 3.69Å; L737-L778 HydrophobicContact CD2-CD2 4.28Å; L737-L778 HydrophobicContact CD2-CG 4.12Å; L737-L778 HydrophobicContact CG-CD1 3.99Å; L737-L778 HydrophobicContact CG-CD2 4.26Å
738	R	97.4	Very high	96.3	Very high	103 Å²	103	38.5 Å²	38.5	39%	0.389	21%	0.208	S	C	.	.	H	α-helix	trans	-58	-37.3	173.2	176.4	178.2	-173.8	-158.4	2.6	112.2	A734 Q735 L736 K742 L778 V782	A734-R738 WeakPolarHBondContact O-CB 3.18Å; A734-R738 PolarHBondContact O-N 3.41Å; Q735-R738 WeakPolarHBondContact O-CB 3.44Å; Q735-R738 PolarHBondContact O-N 3.47Å; L736-R738 PolarHBondContact O-N 3.12Å; R738-K742 WeakPolarHBondContact O-CG 3.37Å; R738-K742 PolarHBondContact O-N 3.45Å; R738-K742 VanDerWaalsContact O-N 3.14Å; R738-L778 HydrophobicContact CB-CD2 3.92Å; R738-V782 HydrophobicContact CB-CG1 4.36Å; R738-V782 HydrophobicContact CG-CG1 4.04Å; R738-V782 HydrophobicContact CG-CG2 3.97Å
739	K	96.9	Very high	96.4	Very high	27 Å²	27	41.1 Å²	41.1	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-44.8	178.6	-166.3	-176.4	-164.6	123.6	0	111.4	L660 D661 V663 A665 Q735 L736 L737 K742 L743	L660-K739 VanDerWaalsContact C-NZ 3.34Å; L660-K739 VanDerWaalsContact O-CE 3.24Å; L660-K739 WeakPolarHBondContact O-CE 3.5Å; L660-K739 PolarHBondContact O-NZ 2.83Å; D661-K739 PolarHBondContact O-NZ 3.11Å; V663-K739 WeakPolarHBondContact O-CE 3.47Å; V663-K739 PolarHBondContact O-NZ 3.21Å; A665-K739 HydrophobicContact CB-CG 4.27Å; Q735-K739 WeakPolarHBondContact O-CB 3.4Å; Q735-K739 PolarHBondContact O-N 2.85Å; L736-K739 WeakPolarHBondContact O-CA 3.42Å; L736-K739 VanDerWaalsContact O-CB 3.24Å; L736-K739 WeakPolarHBondContact O-CB 3.33Å; L736-K739 PolarHBondContact O-N 3.18Å; L737-K739 PolarHBondContact O-N 3.48Å; K739-K742 WeakPolarHBondContact O-CB 3.49Å; K739-K742 PolarHBondContact O-N 2.9Å; K739-L743 WeakPolarHBondContact O-CB 3.23Å; K739-L743 PolarHBondContact O-N 3.25Å
740	F	98.3	Very high	96.5	Very high	3 Å²	3	38.9 Å²	38.9	1%	0.013	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-37.8	176.1	-73.4	-52.9	0	0	0	113.1	W719 V720 E723 L724 L736 L737 K742 L743 A744 V759 L763	W719-F740 HydrophobicContact CD2-CE1 4.43Å; W719-F740 HydrophobicContact CE3-CE1 4.14Å; W719-F740 HydrophobicContact CH2-CD1 4.4Å; W719-F740 AromaticContact CH2-CE1 3.53Å; W719-F740 HydrophobicContact CH2-CE1 3.53Å; W719-F740 HydrophobicContact CH2-CZ 4.4Å; W719-F740 AromaticContact CZ2-CE1 3.81Å; W719-F740 HydrophobicContact CZ2-CE1 3.81Å; W719-F740 HydrophobicContact CZ2-CZ 4.25Å; W719-F740 HydrophobicContact CZ3-CD1 4.39Å; W719-F740 AromaticContact CZ3-CE1 3.69Å; W719-F740 HydrophobicContact CZ3-CE1 3.69Å; V720-F740 HydrophobicContact CG1-CD1 4.47Å; V720-F740 HydrophobicContact CG1-CD2 3.96Å; V720-F740 HydrophobicContact CG1-CE2 4.23Å; V720-F740 HydrophobicContact CG1-CG 4.09Å; V720-F740 HydrophobicContact CG2-CD1 3.84Å; V720-F740 HydrophobicContact CG2-CE1 3.86Å; V720-F740 HydrophobicContact CG2-CG 4.28Å; V720-F740 HydrophobicContact CG2-CZ 4.29Å; E723-F740 HydrophobicContact CB-CE2 4.14Å; E723-F740 HydrophobicContact CB-CZ 4.01Å; E723-F740 HydrophobicContact CG-CZ 4.42Å; L724-F740 HydrophobicContact CD1-CD2 4.15Å; L724-F740 HydrophobicContact CD1-CE2 4.45Å; L724-F740 HydrophobicContact CD2-CD2 4.32Å; L724-F740 HydrophobicContact CD2-CE2 4.43Å; L724-F740 HydrophobicContact CG-CD2 4.12Å; L724-F740 HydrophobicContact CG-CE2 4.04Å; L736-F740 HydrophobicContact CD1-CD2 4.25Å; L736-F740 HydrophobicContact CD1-CE2 3.68Å; L736-F740 HydrophobicContact CD1-CZ 4.05Å; L736-F740 HydrophobicContact CD2-CE2 4.25Å; L736-F740 HydrophobicContact CG-CD2 4.11Å; L736-F740 HydrophobicContact CG-CE2 3.67Å; L736-F740 HydrophobicContact CG-CZ 4.48Å; L736-F740 WeakPolarHBondContact O-CD2 3.27Å; L736-F740 PolarHBondContact O-N 3.02Å; L737-F740 PolarHBondContact O-N 2.93Å; F740-K742 VanDerWaalsContact C-N 3.32Å; F740-K742 PolarHBondContact O-N 3.08Å; F740-L743 HydrophobicContact CD1-CD2 3.96Å; F740-L743 HydrophobicContact CE1-CD2 4.42Å; F740-L743 WeakPolarHBondContact O-CB 3.48Å; F740-L743 PolarHBondContact O-N 3.42Å; F740-A744 PolarHBondContact O-N 3.2Å; F740-V759 HydrophobicContact CB-CG1 4.36Å; F740-L763 HydrophobicContact CB-CD1 4.48Å; F740-L763 HydrophobicContact CB-CD2 3.85Å; F740-L763 HydrophobicContact CB-CG 4.48Å
741	I	98.3	Very high	96.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-42.1	173.4	-65.5	164.3	0	0	0	110.8	L737 A745 L763 W775 L778 V782 L785 Y786 L789	L737-I741 HydrophobicContact CD1-CD1 4.42Å; L737-I741 HydrophobicContact CG-CD1 4.29Å; L737-I741 WeakPolarHBondContact O-CG1 3.35Å; L737-I741 PolarHBondContact O-N 2.99Å; I741-A745 PolarHBondContact O-N 3.01Å; I741-A745 VanDerWaalsContact O-N 3.15Å; I741-L763 HydrophobicContact CG1-CD1 3.85Å; I741-W775 HydrophobicContact CD1-CZ3 4.21Å; I741-L778 HydrophobicContact CD1-CD1 3.8Å; I741-V782 HydrophobicContact CB-CG1 4.29Å; I741-V782 HydrophobicContact CD1-CG1 3.75Å; I741-V782 HydrophobicContact CG2-CG1 4.09Å; I741-L785 HydrophobicContact CG2-CB 4.44Å; I741-L785 HydrophobicContact CG2-CD2 3.96Å; I741-L785 HydrophobicContact CG2-CG 4.02Å; I741-Y786 HydrophobicContact CD1-CD2 4.44Å; I741-Y786 HydrophobicContact CD1-CG 4.48Å; I741-Y786 HydrophobicContact CG1-CD2 4.14Å; I741-L789 HydrophobicContact CG2-CD1 4.5Å
742	K	97.9	Very high	96.9	Very high	81 Å²	81	38 Å²	38	35%	0.352	18%	0.179	S	C	.	.	H	α-helix	trans	-67.2	-37.9	174.5	-71.7	176.9	178.1	-177.5	0	112.5	A665 R738 K739 F740 A745 H746	A665-K742 HydrophobicContact CB-CB 4.01Å; R738-K742 WeakPolarHBondContact O-CG 3.37Å; R738-K742 PolarHBondContact O-N 3.45Å; R738-K742 VanDerWaalsContact O-N 3.14Å; K739-K742 WeakPolarHBondContact O-CB 3.49Å; K739-K742 PolarHBondContact O-N 2.9Å; F740-K742 VanDerWaalsContact C-N 3.32Å; F740-K742 PolarHBondContact O-N 3.08Å; K742-A745 WeakPolarHBondContact O-CB 3.27Å; K742-A745 PolarHBondContact O-N 3.04Å; K742-H746 PolarHBondContact O-CD2 2.96Å; K742-H746 VanDerWaalsContact O-CD2 3.24Å; K742-H746 PolarHBondContact O-N 3.13Å
743	L	98.1	Very high	97	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.3	-49.6	175.4	179.9	65.8	0	0	0	110.4	A665 L668 A669 L672 W719 K739 F740 A745 H746 L747 V759	A665-L743 WeakPolarHBondContact O-CD1 3.21Å; L668-L743 HydrophobicContact CB-CD1 3.93Å; L668-L743 HydrophobicContact CD2-CD1 4.13Å; L668-L743 HydrophobicContact CD2-CD2 4.06Å; L668-L743 HydrophobicContact CG-CD1 3.86Å; L668-L743 HydrophobicContact CG-CD2 4.37Å; A669-L743 HydrophobicContact CB-CD1 3.88Å; L672-L743 HydrophobicContact CD1-CD1 4.08Å; L672-L743 HydrophobicContact CD1-CD2 4.05Å; L672-L743 HydrophobicContact CD1-CG 4.41Å; W719-L743 HydrophobicContact CH2-CD2 3.93Å; W719-L743 HydrophobicContact CZ3-CD2 3.88Å; K739-L743 WeakPolarHBondContact O-CB 3.23Å; K739-L743 PolarHBondContact O-N 3.25Å; F740-L743 HydrophobicContact CD1-CD2 3.96Å; F740-L743 HydrophobicContact CE1-CD2 4.42Å; F740-L743 WeakPolarHBondContact O-CB 3.48Å; F740-L743 PolarHBondContact O-N 3.42Å; L743-A745 VanDerWaalsContact C-N 3.32Å; L743-A745 PolarHBondContact O-N 3.33Å; L743-H746 PolarHBondContact O-N 2.99Å; L743-L747 HydrophobicContact CD1-CD1 4.44Å; L743-L747 HydrophobicContact CG-CD1 4.01Å; L743-L747 WeakPolarHBondContact O-CG 3.38Å; L743-L747 PolarHBondContact O-N 3.37Å; L743-V759 HydrophobicContact CD2-CG2 4.07Å
744	A	98.4	Very high	97	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.2	-44	175.8	0	0	0	0	0	112	F740 H746 L747 K748 F756 V759 M760 L789	F740-A744 PolarHBondContact O-N 3.2Å; A744-H746 PolarHBondContact O-N 3.48Å; A744-L747 PolarHBondContact O-N 3.41Å; A744-K748 PolarHBondContact O-N 2.59Å; A744-F756 HydrophobicContact CB-CD2 3.96Å; A744-F756 HydrophobicContact CB-CE2 4.25Å; A744-F756 VanDerWaalsContact O-CD2 3.31Å; A744-F756 WeakPolarHBondContact O-CD2 3.49Å; A744-V759 HydrophobicContact CB-CB 4.43Å; A744-V759 HydrophobicContact CB-CG1 3.95Å; A744-M760 HydrophobicContact CB-CG 4.2Å; A744-M760 HydrophobicContact CB-SD 3.84Å; A744-L789 HydrophobicContact CB-CD1 4Å
745	A	97.5	Very high	97.1	Very high	26 Å²	26	35.4 Å²	35.4	22%	0.215	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-43.7	176.4	0	0	0	0	0	112.6	I741 K742 L743 K748 E749 L785 L789	I741-A745 PolarHBondContact O-N 3.01Å; I741-A745 VanDerWaalsContact O-N 3.15Å; K742-A745 WeakPolarHBondContact O-CB 3.27Å; K742-A745 PolarHBondContact O-N 3.04Å; L743-A745 VanDerWaalsContact C-N 3.32Å; L743-A745 PolarHBondContact O-N 3.33Å; A745-K748 PolarHBondContact O-N 2.97Å; A745-E749 PolarHBondContact O-N 2.95Å; A745-L785 HydrophobicContact CB-CD1 4.32Å; A745-L785 HydrophobicContact CB-CD2 4.25Å; A745-L789 HydrophobicContact CB-CD1 4.25Å
746	H	98	Very high	97.3	Very high	48 Å²	48	29.8 Å²	29.8	22%	0.222	14%	0.136	C	C	.	.	H	α-helix	trans	-69.2	-38.5	177.3	-73	-51.8	0	0	0	113.1	A669 K742 L743 A744 K748 E749 Q750	A669-H746 HydrophobicContact CB-CB 3.61Å; K742-H746 PolarHBondContact O-CD2 2.96Å; K742-H746 VanDerWaalsContact O-CD2 3.24Å; K742-H746 PolarHBondContact O-N 3.13Å; L743-H746 PolarHBondContact O-N 2.99Å; A744-H746 PolarHBondContact O-N 3.48Å; H746-K748 VanDerWaalsContact C-N 3.32Å; H746-K748 PolarHBondContact O-N 3.34Å; H746-E749 IonicContact ND1-OE2 3.26Å; H746-E749 PolarHBondContact ND1-OE2 3.44Å; H746-E749 WeakPolarHBondContact O-CB 3.42Å; H746-E749 PolarHBondContact O-N 3.14Å; H746-Q750 WeakPolarHBondContact O-CB 3.48Å; H746-Q750 VanDerWaalsContact O-CG 3.27Å; H746-Q750 WeakPolarHBondContact O-CG 2.97Å; H746-Q750 PolarHBondContact O-N 3.06Å
747	L	98.1	Very high	97.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-42.5	175.2	-71.4	167.8	0	0	0	111.3	A669 L672 L743 A744 Q750 K751 N752 F756 V759	A669-L747 HydrophobicContact CB-CD2 4.09Å; A669-L747 HydrophobicContact CB-CG 4.18Å; L672-L747 HydrophobicContact CB-CD2 4.12Å; L672-L747 HydrophobicContact CD1-CD1 4.32Å; L672-L747 HydrophobicContact CD1-CD2 4.41Å; L743-L747 HydrophobicContact CD1-CD1 4.44Å; L743-L747 HydrophobicContact CG-CD1 4.01Å; L743-L747 WeakPolarHBondContact O-CG 3.38Å; L743-L747 PolarHBondContact O-N 3.37Å; A744-L747 PolarHBondContact O-N 3.41Å; L747-Q750 CarbonylContact O-C 3.21Å; L747-Q750 PolarHBondContact O-N 3.1Å; L747-K751 PolarHBondContact O-N 3.36Å; L747-N752 HydrophobicContact CD2-CB 4.32Å; L747-N752 PolarHBondContact O-N 3.12Å; L747-F756 HydrophobicContact CB-CB 4.03Å; L747-V759 HydrophobicContact CD1-CG2 3.94Å
748	K	96.1	Very high	97.3	Very high	89 Å²	89	29.8 Å²	29.8	39%	0.387	14%	0.135	S	C	.	.	H	α-helix	trans	-62.3	-44.6	173.6	-177	-171.9	166.8	-166.4	0	111.9	A744 A745 H746 Q750 K751 L753 F756 L789 L792	A744-K748 PolarHBondContact O-N 2.59Å; A745-K748 PolarHBondContact O-N 2.97Å; H746-K748 VanDerWaalsContact C-N 3.32Å; H746-K748 PolarHBondContact O-N 3.34Å; K748-Q750 VanDerWaalsContact C-N 3.28Å; K748-Q750 PolarHBondContact O-N 3.45Å; K748-K751 PolarHBondContact O-N 3.49Å; K748-L753 HydrophobicContact CG-CD2 4.3Å; K748-F756 HydrophobicContact CB-CD2 3.93Å; K748-F756 HydrophobicContact CB-CE2 4.4Å; K748-F756 HydrophobicContact CB-CG 4.16Å; K748-L789 HydrophobicContact CD-CD2 3.89Å; K748-L792 HydrophobicContact CD-CD1 3.76Å
749	E	94.7	Very high	97.3	Very high	147 Å²	147	24.9 Å²	24.9	69%	0.687	12%	0.117	S	C	*	.	H	α-helix	trans	-60	-38.5	176.5	-175.4	-179.5	-162.7	0	0	111.9	A745 H746 K751	A745-E749 PolarHBondContact O-N 2.95Å; H746-E749 IonicContact ND1-OE2 3.26Å; H746-E749 PolarHBondContact ND1-OE2 3.44Å; H746-E749 WeakPolarHBondContact O-CB 3.42Å; H746-E749 PolarHBondContact O-N 3.14Å; E749-K751 PolarHBondContact O-N 2.99Å
750	Q	94.9	Very high	97.4	Very high	37 Å²	37	23.6 Å²	23.6	17%	0.173	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	3.8	175.9	-69.1	174.2	-5.3	0	0	113.9	A669 T673 H746 L747 K748 N752 L865	A669-Q750 VanDerWaalsContact C-OE1 3.26Å; A669-Q750 PolarHBondContact O-OE1 3.39Å; A669-Q750 VanDerWaalsContact O-OE1 3.07Å; T673-Q750 HydrophobicContact CG2-CB 4.47Å; T673-Q750 PolarHBondContact OG1-OE1 2.84Å; H746-Q750 WeakPolarHBondContact O-CB 3.48Å; H746-Q750 VanDerWaalsContact O-CG 3.27Å; H746-Q750 WeakPolarHBondContact O-CG 2.97Å; H746-Q750 PolarHBondContact O-N 3.06Å; L747-Q750 CarbonylContact O-C 3.21Å; L747-Q750 PolarHBondContact O-N 3.1Å; K748-Q750 VanDerWaalsContact C-N 3.28Å; K748-Q750 PolarHBondContact O-N 3.45Å; Q750-N752 PolarHBondContact O-N 3.45Å; Q750-L865 HydrophobicContact CG-CD1 4.22Å
751	K	96	Very high	97.2	Very high	53 Å²	53	25.6 Å²	25.6	23%	0.23	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	23.9	-175.1	-53.4	178.1	178.8	-179.8	0	113.6	L747 K748 E749 L753 L809 S810 P812 V813 I814	L747-K751 PolarHBondContact O-N 3.36Å; K748-K751 PolarHBondContact O-N 3.49Å; E749-K751 PolarHBondContact O-N 2.99Å; K751-L753 PolarHBondContact O-N 3.38Å; K751-L809 HydrophobicContact CG-CD2 4.43Å; K751-S810 PolarHBondContact NZ-O 3.26Å; K751-S810 PolarHBondContact NZ-OG 2.98Å; K751-P812 VanDerWaalsContact CD-O 3.28Å; K751-P812 WeakPolarHBondContact CD-O 3.36Å; K751-V813 HydrophobicContact CB-CB 4.27Å; K751-V813 HydrophobicContact CB-CG2 4.15Å; K751-V813 WeakPolarHBondContact O-CG2 3.25Å; K751-I814 PolarHBondContact O-N 3.26Å
752	N	97.4	Very high	97	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-90.7	79	167.9	-175.8	-4.4	0	0	0	109	T673 D676 L747 Q750 N754 S755 F756 I814	T673-N752 WeakPolarHBondContact CA-ND2 3.08Å; T673-N752 HydrophobicContact CG2-CB 4.1Å; T673-N752 WeakPolarHBondContact OG1-CB 3.19Å; T673-N752 PolarHBondContact OG1-ND2 3.43Å; D676-N752 PolarHBondContact OD2-ND2 2.98Å; L747-N752 HydrophobicContact CD2-CB 4.32Å; L747-N752 PolarHBondContact O-N 3.12Å; Q750-N752 PolarHBondContact O-N 3.45Å; N752-N754 VanDerWaalsContact C-N 3.35Å; N752-S755 PolarHBondContact OD1-N 3.4Å; N752-F756 WeakPolarHBondContact O-CB 3.38Å; N752-F756 PolarHBondContact O-N 3.42Å; N752-I814 HydrophobicContact CB-CD1 4.47Å
753	L	97.4	Very high	96.8	Very high	9 Å²	9	21.7 Å²	21.7	5%	0.047	10%	0.103	C	C	.	.	H	α-helix	trans	-72.9	-31.3	-175.9	-54.8	-177.9	0	0	0	111.2	K748 K751 S755 F756 F757 Y802 L806 L809 V813 I814	K748-L753 HydrophobicContact CG-CD2 4.3Å; K751-L753 PolarHBondContact O-N 3.38Å; L753-S755 PolarHBondContact O-N 3Å; L753-F756 WeakPolarHBondContact O-CB 3.46Å; L753-F756 PolarHBondContact O-N 3.5Å; L753-F757 HydrophobicContact CB-CD2 4.47Å; L753-F757 HydrophobicContact CB-CE2 4.5Å; L753-F757 WeakPolarHBondContact O-CD2 3.49Å; L753-F757 PolarHBondContact O-N 2.93Å; L753-Y802 HydrophobicContact CB-CE2 4.38Å; L753-Y802 HydrophobicContact CD1-CE2 3.73Å; L753-L806 HydrophobicContact CD1-CD1 4.06Å; L753-L809 HydrophobicContact CD1-CD1 3.86Å; L753-V813 HydrophobicContact CD1-CG2 4.11Å; L753-V813 HydrophobicContact CG-CG2 4.26Å; L753-I814 WeakPolarHBondContact CA-O 3.45Å; L753-I814 VanDerWaalsContact CB-O 3.32Å; L753-I814 WeakPolarHBondContact CB-O 3.45Å; L753-I814 PolarHBondContact N-O 2.83Å
754	N	96.8	Very high	96.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-55.9	-54.8	177.5	-164.5	67.1	0	0	0	112	F709 F713 N752 F757 A758 I814 P815 M817	F709-N754 HydrophobicContact CE1-CB 4.36Å; F709-N754 WeakPolarHBondContact CE1-ND2 3.4Å; F709-N754 HydrophobicContact CZ-CB 4.15Å; F709-N754 WeakPolarHBondContact CZ-ND2 3.45Å; F713-N754 WeakPolarHBondContact CD2-O 3.3Å; F713-N754 VanDerWaalsContact CE2-O 3.27Å; F713-N754 WeakPolarHBondContact CE2-O 3.41Å; N752-N754 VanDerWaalsContact C-N 3.35Å; N754-F757 PolarHBondContact O-N 2.96Å; N754-A758 PolarHBondContact O-N 3.32Å; N754-I814 HydrophobicContact CB-CG2 3.66Å; N754-I814 PolarHBondContact N-O 3.25Å; N754-P815 WeakPolarHBondContact CB-O 3.33Å; N754-M817 PolarHBondContact OD1-N 2.94Å
755	S	98.1	Very high	96.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-76.6	-27.3	-177.7	-64.2	0	0	0	0	112.7	D676 L716 N752 L753 A758 V759	D676-S755 WeakPolarHBondContact OD2-CB 3.48Å; D676-S755 PolarHBondContact OD2-OG 3.2Å; L716-S755 VanDerWaalsContact CD1-OG 3.27Å; L716-S755 WeakPolarHBondContact CD1-OG 3.43Å; N752-S755 PolarHBondContact OD1-N 3.4Å; L753-S755 PolarHBondContact O-N 3Å; S755-A758 PolarHBondContact O-N 3.23Å; S755-V759 WeakPolarHBondContact O-CG2 3.38Å; S755-V759 PolarHBondContact O-N 3.1Å
756	F	98.4	Very high	96	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55	-51.1	165.5	160	-101.9	0	0	0	111.2	A744 L747 K748 N752 L753 V759 M760 L789 L792 L793	A744-F756 HydrophobicContact CB-CD2 3.96Å; A744-F756 HydrophobicContact CB-CE2 4.25Å; A744-F756 VanDerWaalsContact O-CD2 3.31Å; A744-F756 WeakPolarHBondContact O-CD2 3.49Å; L747-F756 HydrophobicContact CB-CB 4.03Å; K748-F756 HydrophobicContact CB-CD2 3.93Å; K748-F756 HydrophobicContact CB-CE2 4.4Å; K748-F756 HydrophobicContact CB-CG 4.16Å; N752-F756 WeakPolarHBondContact O-CB 3.38Å; N752-F756 PolarHBondContact O-N 3.42Å; L753-F756 WeakPolarHBondContact O-CB 3.46Å; L753-F756 PolarHBondContact O-N 3.5Å; F756-V759 PolarHBondContact O-N 3.11Å; F756-M760 HydrophobicContact CD2-CG 3.95Å; F756-M760 HydrophobicContact CE1-CG 4.41Å; F756-M760 HydrophobicContact CE2-CG 3.45Å; F756-M760 VanDerWaalsContact CE2-CG 3.45Å; F756-M760 HydrophobicContact CE2-SD 4.1Å; F756-M760 HydrophobicContact CZ-CG 3.72Å; F756-M760 WeakPolarHBondContact O-CB 3.49Å; F756-M760 VanDerWaalsContact O-CG 3.28Å; F756-M760 WeakPolarHBondContact O-CG 3.35Å; F756-M760 PolarHBondContact O-N 2.95Å; F756-L789 HydrophobicContact CE2-CB 3.97Å; F756-L789 HydrophobicContact CE2-CD1 4.36Å; F756-L789 HydrophobicContact CE2-CD2 3.82Å; F756-L789 HydrophobicContact CE2-CG 4.25Å; F756-L789 HydrophobicContact CZ-CB 4.22Å; F756-L789 HydrophobicContact CZ-CD2 4.41Å; F756-L792 HydrophobicContact CE1-CB 3.98Å; F756-L792 HydrophobicContact CE1-CD1 3.79Å; F756-L792 HydrophobicContact CZ-CB 4.17Å; F756-L792 HydrophobicContact CZ-CD1 3.78Å; F756-L793 HydrophobicContact CZ-CD1 4.48Å
757	F	98	Very high	95.8	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-64.9	-40.1	178.1	-84	-74.3	0	0	0	112.2	F713 L753 N754 V759 M760 F761 L792 L793 Y802 F816	F713-F757 HydrophobicContact CE2-CB 3.95Å; F713-F757 HydrophobicContact CZ-CB 4.3Å; L753-F757 HydrophobicContact CB-CD2 4.47Å; L753-F757 HydrophobicContact CB-CE2 4.5Å; L753-F757 WeakPolarHBondContact O-CD2 3.49Å; L753-F757 PolarHBondContact O-N 2.93Å; N754-F757 PolarHBondContact O-N 2.96Å; F757-V759 PolarHBondContact O-N 2.84Å; F757-M760 PolarHBondContact O-N 3.47Å; F757-F761 WeakPolarHBondContact O-CB 3.46Å; F757-F761 WeakPolarHBondContact O-CG 3.16Å; F757-F761 PolarHBondContact O-N 3.28Å; F757-L792 WeakPolarHBondContact CE1-O 3.08Å; F757-L792 HydrophobicContact CZ-CB 4.19Å; F757-L792 WeakPolarHBondContact CZ-O 3.25Å; F757-L793 HydrophobicContact CD1-CD1 4.47Å; F757-L793 HydrophobicContact CD1-CG 4.07Å; F757-L793 HydrophobicContact CE1-CD1 4.33Å; F757-L793 HydrophobicContact CE1-CG 3.98Å; F757-Y802 AromaticContact CE2-CD2 3.43Å; F757-Y802 HydrophobicContact CE2-CD2 3.43Å; F757-Y802 VanDerWaalsContact CE2-CD2 3.43Å; F757-Y802 AromaticContact CE2-CE2 3.62Å; F757-Y802 HydrophobicContact CE2-CE2 3.62Å; F757-Y802 HydrophobicContact CE2-CG 4.28Å; F757-Y802 AromaticContact CZ-CD2 3.6Å; F757-Y802 HydrophobicContact CZ-CD2 3.6Å; F757-Y802 HydrophobicContact CZ-CE2 4.26Å; F757-Y802 HydrophobicContact CZ-CG 4.11Å; F757-F816 HydrophobicContact CB-CD2 3.69Å; F757-F816 HydrophobicContact CB-CE2 3.81Å; F757-F816 HydrophobicContact CB-CG 4.37Å; F757-F816 HydrophobicContact CD2-CB 3.65Å; F757-F816 HydrophobicContact CD2-CD1 4.13Å; F757-F816 AromaticContact CD2-CD2 3.77Å; F757-F816 HydrophobicContact CD2-CD2 3.77Å; F757-F816 HydrophobicContact CD2-CE2 4.5Å; F757-F816 AromaticContact CD2-CG 3.58Å; F757-F816 HydrophobicContact CD2-CG 3.58Å; F757-F816 HydrophobicContact CE2-CB 3.86Å; F757-F816 HydrophobicContact CE2-CD1 4.22Å; F757-F816 AromaticContact CE2-CG 4Å; F757-F816 HydrophobicContact CE2-CG 4Å; F757-F816 HydrophobicContact CG-CB 4.47Å; F757-F816 HydrophobicContact CG-CD1 4.32Å; F757-F816 AromaticContact CG-CD2 3.76Å; F757-F816 HydrophobicContact CG-CD2 3.76Å; F757-F816 HydrophobicContact CG-CE2 4.05Å; F757-F816 AromaticContact CG-CG 3.94Å; F757-F816 HydrophobicContact CG-CG 3.94Å; F757-F816 HydrophobicContact CG-CZ 4.48Å; F757-F816 HydrophobicContact CZ-CD1 4.42Å
758	A	96.4	Very high	95.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-57.7	-48.4	176.5	0	0	0	0	0	111.7	F713 L716 Q717 N754 S755 F761 G762	F713-A758 HydrophobicContact CD2-CB 3.74Å; F713-A758 HydrophobicContact CE2-CB 3.75Å; F713-A758 HydrophobicContact CG-CB 4.16Å; F713-A758 HydrophobicContact CZ-CB 4.15Å; F713-A758 WeakPolarHBondContact O-CB 3.34Å; L716-A758 HydrophobicContact CB-CB 3.8Å; Q717-A758 WeakPolarHBondContact CA-O 3.49Å; N754-A758 PolarHBondContact O-N 3.32Å; S755-A758 PolarHBondContact O-N 3.23Å; A758-F761 PolarHBondContact O-N 3.3Å; A758-G762 PolarHBondContact O-N 2.7Å
759	V	98.3	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.7	-44.3	177.1	173.3	0	0	0	0	111	V720 F740 L743 A744 L747 S755 F756 F757 F761 G762 L763	V720-V759 HydrophobicContact CG2-CB 4.38Å; V720-V759 HydrophobicContact CG2-CG1 4.13Å; V720-V759 HydrophobicContact CG2-CG2 4.21Å; F740-V759 HydrophobicContact CB-CG1 4.36Å; L743-V759 HydrophobicContact CD2-CG2 4.07Å; A744-V759 HydrophobicContact CB-CB 4.43Å; A744-V759 HydrophobicContact CB-CG1 3.95Å; L747-V759 HydrophobicContact CD1-CG2 3.94Å; S755-V759 WeakPolarHBondContact O-CG2 3.38Å; S755-V759 PolarHBondContact O-N 3.1Å; F756-V759 PolarHBondContact O-N 3.11Å; F757-V759 PolarHBondContact O-N 2.84Å; V759-F761 VanDerWaalsContact C-N 3.35Å; V759-F761 PolarHBondContact O-N 3.4Å; V759-G762 PolarHBondContact O-N 3.27Å; V759-G762 VanDerWaalsContact O-N 3.14Å; V759-L763 HydrophobicContact CG1-CD1 4.32Å; V759-L763 HydrophobicContact CG1-CG 4.49Å; V759-L763 WeakPolarHBondContact O-CG 3.42Å; V759-L763 PolarHBondContact O-N 2.82Å
760	M	97.4	Very high	95.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.4	-36.2	179	-70.6	-60.8	-61.9	0	0	112.8	A744 F756 F757 L763 S764 Y786 L789 E790 L793	A744-M760 HydrophobicContact CB-CG 4.2Å; A744-M760 HydrophobicContact CB-SD 3.84Å; F756-M760 HydrophobicContact CD2-CG 3.95Å; F756-M760 HydrophobicContact CE1-CG 4.41Å; F756-M760 HydrophobicContact CE2-CG 3.45Å; F756-M760 VanDerWaalsContact CE2-CG 3.45Å; F756-M760 HydrophobicContact CE2-SD 4.1Å; F756-M760 HydrophobicContact CZ-CG 3.72Å; F756-M760 WeakPolarHBondContact O-CB 3.49Å; F756-M760 VanDerWaalsContact O-CG 3.28Å; F756-M760 WeakPolarHBondContact O-CG 3.35Å; F756-M760 PolarHBondContact O-N 2.95Å; F757-M760 PolarHBondContact O-N 3.47Å; M760-L763 PolarHBondContact O-N 2.8Å; M760-L763 HydrophobicContact SD-CD1 4.11Å; M760-S764 WeakPolarHBondContact O-CB 3.28Å; M760-S764 PolarHBondContact O-N 3.42Å; M760-S764 PolarHBondContact O-OG 3.2Å; M760-Y786 HydrophobicContact CE-CD2 3.76Å; M760-Y786 HydrophobicContact CE-CE2 3.53Å; M760-Y786 HydrophobicContact SD-CD2 4.39Å; M760-Y786 HydrophobicContact SD-CE2 4.37Å; M760-L789 HydrophobicContact CE-CB 3.72Å; M760-L789 HydrophobicContact SD-CB 3.87Å; M760-L789 HydrophobicContact SD-CD1 4.14Å; M760-E790 HydrophobicContact CE-CB 4.25Å; M760-L793 HydrophobicContact CB-CD1 3.75Å; M760-L793 HydrophobicContact CB-CD2 3.9Å; M760-L793 HydrophobicContact CB-CG 4.38Å; M760-L793 HydrophobicContact CE-CD1 3.96Å; M760-L793 HydrophobicContact CG-CD1 4.05Å
761	F	94.4	Very high	95.4	Very high	45 Å²	45	16.2 Å²	16.2	20%	0.197	8%	0.083	C	C	.	.	H	α-helix	trans	-68.9	-34.3	172.1	-73.4	-18.7	0	0	0	112.5	F713 Q717 F757 A758 V759 S764 N765 L793 F816	F713-F761 AromaticContact CE1-CD2 3.83Å; F713-F761 HydrophobicContact CE1-CD2 3.83Å; F713-F761 HydrophobicContact CE1-CE2 4.21Å; F713-F761 AromaticContact CZ-CD2 3.49Å; F713-F761 HydrophobicContact CZ-CD2 3.49Å; F713-F761 VanDerWaalsContact CZ-CD2 3.49Å; F713-F761 AromaticContact CZ-CE2 3.72Å; F713-F761 HydrophobicContact CZ-CE2 3.72Å; Q717-F761 HydrophobicContact CG-CB 3.93Å; F757-F761 WeakPolarHBondContact O-CB 3.46Å; F757-F761 WeakPolarHBondContact O-CG 3.16Å; F757-F761 PolarHBondContact O-N 3.28Å; A758-F761 PolarHBondContact O-N 3.3Å; V759-F761 VanDerWaalsContact C-N 3.35Å; V759-F761 PolarHBondContact O-N 3.4Å; F761-S764 PolarHBondContact O-N 3.49Å; F761-N765 PolarHBondContact O-N 3.19Å; F761-N765 VanDerWaalsContact O-N 3.08Å; F761-L793 HydrophobicContact CD1-CD2 3.47Å; F761-L793 VanDerWaalsContact CD1-CD2 3.47Å; F761-L793 HydrophobicContact CE1-CD2 3.53Å; F761-L793 HydrophobicContact CE1-CG 4.18Å; F761-F816 HydrophobicContact CE2-CE2 4.03Å; F761-F816 AromaticContact CE2-CZ 3.75Å; F761-F816 HydrophobicContact CE2-CZ 3.75Å; F761-F816 HydrophobicContact CZ-CE2 4.48Å; F761-F816 AromaticContact CZ-CZ 3.85Å; F761-F816 HydrophobicContact CZ-CZ 3.85Å
762	G	94	Very high	95.3	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.5	-44.8	171.5	0	0	0	0	0	112	Q717 A758 V759 S764 N765	Q717-G762 WeakPolarHBondContact O-CA 3.2Å; A758-G762 PolarHBondContact O-N 2.7Å; V759-G762 PolarHBondContact O-N 3.27Å; V759-G762 VanDerWaalsContact O-N 3.14Å; G762-S764 VanDerWaalsContact C-N 3.34Å; G762-S764 PolarHBondContact O-N 2.49Å; G762-N765 WeakPolarHBondContact O-CB 3.49Å; G762-N765 PolarHBondContact O-N 3.04Å
763	L	94.8	Very high	95.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.2	-35.8	176.2	-67.9	178.5	0	0	0	113.2	V720 L724 L737 F740 I741 V759 M760 N765 Y786	V720-L763 HydrophobicContact CG1-CD2 3.84Å; V720-L763 HydrophobicContact CG1-CG 4.15Å; L724-L763 HydrophobicContact CD1-CD2 4.19Å; L737-L763 HydrophobicContact CD1-CD2 3.44Å; L737-L763 VanDerWaalsContact CD1-CD2 3.44Å; F740-L763 HydrophobicContact CB-CD1 4.48Å; F740-L763 HydrophobicContact CB-CD2 3.85Å; F740-L763 HydrophobicContact CB-CG 4.48Å; I741-L763 HydrophobicContact CG1-CD1 3.85Å; V759-L763 HydrophobicContact CG1-CD1 4.32Å; V759-L763 HydrophobicContact CG1-CG 4.49Å; V759-L763 WeakPolarHBondContact O-CG 3.42Å; V759-L763 PolarHBondContact O-N 2.82Å; M760-L763 PolarHBondContact O-N 2.8Å; M760-L763 HydrophobicContact SD-CD1 4.11Å; L763-N765 VanDerWaalsContact C-N 3.28Å; L763-N765 PolarHBondContact O-N 3.02Å; L763-Y786 HydrophobicContact CB-CE2 3.96Å; L763-Y786 HydrophobicContact CD1-CD2 4.19Å; L763-Y786 HydrophobicContact CD1-CE2 4.08Å
764	S	92.3	Very high	95	Very high	40 Å²	40	21.1 Å²	21.1	28%	0.28	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	2.2	-179.2	-45.7	0	0	0	0	112.7	M760 F761 G762 Y786	M760-S764 WeakPolarHBondContact O-CB 3.28Å; M760-S764 PolarHBondContact O-N 3.42Å; M760-S764 PolarHBondContact O-OG 3.2Å; F761-S764 PolarHBondContact O-N 3.49Å; G762-S764 VanDerWaalsContact C-N 3.34Å; G762-S764 PolarHBondContact O-N 2.49Å; S764-Y786 PolarHBondContact OG-OH 3.05Å
765	N	92.8	Very high	94.9	Very high	14 Å²	14	22.9 Å²	22.9	8%	0.075	12%	0.122	C	C	.	.	S	Bend	trans	-58.9	141	176.8	-172.8	-56.1	0	0	0	110.2	F761 G762 L763 A767 I768 S769 Q913	F761-N765 PolarHBondContact O-N 3.19Å; F761-N765 VanDerWaalsContact O-N 3.08Å; G762-N765 WeakPolarHBondContact O-CB 3.49Å; G762-N765 PolarHBondContact O-N 3.04Å; L763-N765 VanDerWaalsContact C-N 3.28Å; L763-N765 PolarHBondContact O-N 3.02Å; N765-A767 PolarHBondContact O-N 3.37Å; N765-A767 VanDerWaalsContact O-N 3.13Å; N765-A767 WeakPolarHBondContact OD1-CB 3.2Å; N765-A767 PolarHBondContact OD1-N 3.46Å; N765-I768 HydrophobicContact CB-CG1 4.29Å; N765-I768 PolarHBondContact O-N 2.9Å; N765-S769 PolarHBondContact O-N 3.07Å; N765-S769 PolarHBondContact O-OG 3.41Å; N765-Q913 PolarHBondContact ND2-OE1 2.74Å; N765-Q913 PolarHBondContact OD1-NE2 3.48Å; N765-Q913 PolarHBondContact OD1-OE1 3.42Å
766	S	91.8	Very high	94.6	Very high	15 Å²	15	29.3 Å²	29.3	11%	0.105	15%	0.152	C	C	.	.	H	α-helix	trans	-54.6	-30.1	177.8	64	0	0	0	0	114.5	I768 S769 R770 Q913	S766-I768 VanDerWaalsContact C-N 3.31Å; S766-S769 WeakPolarHBondContact CA-OG 3.28Å; S766-R770 WeakPolarHBondContact O-CG 3.38Å; S766-Q913 PolarHBondContact OG-NE2 2.8Å
767	A	92.8	Very high	94.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-72.2	-23.9	175.4	0	0	0	0	0	112.7	N765 L916 S920	N765-A767 PolarHBondContact O-N 3.37Å; N765-A767 VanDerWaalsContact O-N 3.13Å; N765-A767 WeakPolarHBondContact OD1-CB 3.2Å; N765-A767 PolarHBondContact OD1-N 3.46Å; A767-L916 HydrophobicContact CB-CB 4.11Å; A767-S920 WeakPolarHBondContact O-CB 3.24Å; A767-S920 PolarHBondContact O-OG 3.41Å
768	I	96.6	Very high	94.3	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-100.8	-45.5	-177.3	-56.4	-49.7	0	0	0	111.5	A721 L724 N765 S766 R770 L771 W775	A721-I768 HydrophobicContact CB-CD1 4.44Å; A721-I768 HydrophobicContact CB-CG1 4.19Å; L724-I768 HydrophobicContact CB-CD1 3.56Å; L724-I768 HydrophobicContact CD1-CD1 4.07Å; L724-I768 HydrophobicContact CD1-CG1 4.18Å; L724-I768 HydrophobicContact CD1-CG2 3.62Å; L724-I768 HydrophobicContact CG-CD1 4.47Å; N765-I768 HydrophobicContact CB-CG1 4.29Å; N765-I768 PolarHBondContact O-N 2.9Å; S766-I768 VanDerWaalsContact C-N 3.31Å; I768-R770 PolarHBondContact O-N 2.89Å; I768-R770 VanDerWaalsContact O-N 3.13Å; I768-L771 HydrophobicContact CD1-CD1 4.29Å; I768-L771 WeakPolarHBondContact O-CB 3.36Å; I768-L771 PolarHBondContact O-N 3.46Å; I768-L771 VanDerWaalsContact O-N 3.08Å; I768-W775 HydrophobicContact CG2-CZ2 4.23Å; I768-W775 PolarHBondContact O-NE1 3.35Å
769	S	92.1	Very high	94.2	Very high	58 Å²	58	39.8 Å²	39.8	41%	0.406	20%	0.2	S	C	.	.	H	α-helix	trans	-58.2	-25.9	178.6	50.9	0	0	0	0	113.4	N765 S766	N765-S769 PolarHBondContact O-N 3.07Å; N765-S769 PolarHBondContact O-OG 3.41Å; S766-S769 WeakPolarHBondContact CA-OG 3.28Å
770	R	93.9	Very high	93.6	Very high	101 Å²	101	43.2 Å²	43.2	38%	0.381	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.9	177.8	77.9	-179.9	-52	-77	-4.2	115.7	S766 I768 A772 S920 E924	S766-R770 WeakPolarHBondContact O-CG 3.38Å; I768-R770 PolarHBondContact O-N 2.89Å; I768-R770 VanDerWaalsContact O-N 3.13Å; R770-A772 PolarHBondContact O-N 3.31Å; R770-S920 VanDerWaalsContact CD-OG 3.29Å; R770-S920 WeakPolarHBondContact CD-OG 3.34Å; R770-S920 WeakPolarHBondContact CG-OG 3.48Å; R770-E924 PolarHBondContact NH1-O 3.42Å
771	L	93.9	Very high	93.1	Very high	2 Å²	2	52 Å²	52	1%	0.01	25%	0.253	C	S	.	.			trans	-76.7	64.3	-175.8	-60.5	176.1	0	0	0	111.5	I768 H773 T774 W775 L923 E924	I768-L771 HydrophobicContact CD1-CD1 4.29Å; I768-L771 WeakPolarHBondContact O-CB 3.36Å; I768-L771 PolarHBondContact O-N 3.46Å; I768-L771 VanDerWaalsContact O-N 3.08Å; L771-H773 VanDerWaalsContact C-N 3.3Å; L771-H773 PolarHBondContact O-N 3.24Å; L771-T774 WeakPolarHBondContact O-CA 3.48Å; L771-T774 WeakPolarHBondContact O-CB 3.32Å; L771-T774 PolarHBondContact O-N 3Å; L771-W775 PolarHBondContact O-N 3.33Å; L771-L923 HydrophobicContact CD2-CB 4.37Å; L771-E924 WeakPolarHBondContact CA-OE2 3.39Å; L771-E924 HydrophobicContact CD2-CB 3.96Å; L771-E924 HydrophobicContact CD2-CG 4Å
772	A	93.2	Very high	93	Very high	49 Å²	49	50.3 Å²	50.3	41%	0.405	25%	0.247	S	C	.	.	H	α-helix	trans	-53.1	-44.6	-171.4	0	0	0	0	0	112.7	R770 T774 W775 E776 E924	R770-A772 PolarHBondContact O-N 3.31Å; A772-T774 PolarHBondContact O-N 3.21Å; A772-W775 PolarHBondContact O-N 3.03Å; A772-W775 VanDerWaalsContact O-N 3.16Å; A772-E776 WeakPolarHBondContact O-CB 3.1Å; A772-E776 VanDerWaalsContact O-CG 3.3Å; A772-E776 WeakPolarHBondContact O-CG 3.25Å; A772-E776 PolarHBondContact O-N 3.26Å; A772-E924 PolarHBondContact N-OE2 2.84Å; A772-E924 VanDerWaalsContact N-OE2 3.12Å
773	H	92.6	Very high	92.7	Very high	114 Å²	114	54.7 Å²	54.7	53%	0.528	26%	0.264	S	S	.	.	H	α-helix	trans	-67.1	-28.2	-179.7	-63.7	-53.6	0	0	0	112.5	L771 E776 R777 E924	L771-H773 VanDerWaalsContact C-N 3.3Å; L771-H773 PolarHBondContact O-N 3.24Å; H773-E776 IonicContact ND1-OE2 3.92Å; H773-R777 WeakPolarHBondContact O-CD 3.47Å; H773-R777 VanDerWaalsContact O-CG 3.25Å; H773-R777 WeakPolarHBondContact O-CG 3.36Å; H773-E924 WeakPolarHBondContact CB-OE2 3.45Å; H773-E924 IonicContact CD2-OE2 3.69Å; H773-E924 IonicContact CG-OE2 2.76Å; H773-E924 PolarHBondContact N-OE2 3.22Å
774	T	95.5	Very high	92.2	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-73.2	-43.3	173.1	-59.3	0	0	0	0	111.3	R733 A734 L737 L771 A772 R777 E924	R733-T774 HydrophobicContact CB-CG2 4.39Å; R733-T774 HydrophobicContact CG-CG2 3.91Å; R733-T774 PolarHBondContact NE-OG1 3.37Å; R733-T774 PolarHBondContact NH2-OG1 3.13Å; A734-T774 HydrophobicContact CB-CG2 4.17Å; L737-T774 HydrophobicContact CD2-CG2 3.85Å; L771-T774 WeakPolarHBondContact O-CA 3.48Å; L771-T774 WeakPolarHBondContact O-CB 3.32Å; L771-T774 PolarHBondContact O-N 3Å; A772-T774 PolarHBondContact O-N 3.21Å; T774-R777 PolarHBondContact O-N 3.41Å; T774-E924 PolarHBondContact N-OE1 2.95Å; T774-E924 PolarHBondContact OG1-OE1 3.31Å
775	W	94.6	Very high	91.9	Very high	37 Å²	37	61.2 Å²	61.2	14%	0.14	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-39.6	179.3	-75.2	103.7	0	0	0	112.8	L737 I741 I768 L771 A772 R777 L778 Y786	L737-W775 HydrophobicContact CD1-CH2 3.9Å; L737-W775 HydrophobicContact CD1-CZ2 3.98Å; L737-W775 HydrophobicContact CD1-CZ3 4.35Å; L737-W775 HydrophobicContact CD2-CD2 3.77Å; L737-W775 HydrophobicContact CD2-CE3 3.9Å; L737-W775 HydrophobicContact CD2-CG 4.28Å; L737-W775 HydrophobicContact CD2-CH2 4.33Å; L737-W775 HydrophobicContact CD2-CZ2 4.21Å; L737-W775 HydrophobicContact CD2-CZ3 4.18Å; I741-W775 HydrophobicContact CD1-CZ3 4.21Å; I768-W775 HydrophobicContact CG2-CZ2 4.23Å; I768-W775 PolarHBondContact O-NE1 3.35Å; L771-W775 PolarHBondContact O-N 3.33Å; A772-W775 PolarHBondContact O-N 3.03Å; A772-W775 VanDerWaalsContact O-N 3.16Å; W775-R777 VanDerWaalsContact C-N 3.26Å; W775-R777 PolarHBondContact O-N 3.35Å; W775-L778 HydrophobicContact CE3-CD1 3.64Å; W775-L778 HydrophobicContact CZ3-CD1 3.99Å; W775-L778 WeakPolarHBondContact O-CB 3.43Å; W775-L778 PolarHBondContact O-N 3.44Å; W775-L778 VanDerWaalsContact O-N 3.13Å; W775-Y786 HydrophobicContact CH2-CD1 4.23Å; W775-Y786 HydrophobicContact CH2-CD2 4.2Å; W775-Y786 AromaticContact CH2-CE1 3.95Å; W775-Y786 HydrophobicContact CH2-CE1 3.95Å; W775-Y786 AromaticContact CH2-CE2 3.93Å; W775-Y786 HydrophobicContact CH2-CE2 3.93Å; W775-Y786 HydrophobicContact CH2-CG 4.34Å; W775-Y786 AromaticContact CH2-CZ 3.79Å; W775-Y786 AromaticContact CZ3-CD1 3.91Å; W775-Y786 HydrophobicContact CZ3-CD1 3.91Å; W775-Y786 HydrophobicContact CZ3-CD2 4.35Å; W775-Y786 HydrophobicContact CZ3-CE1 4.03Å; W775-Y786 HydrophobicContact CZ3-CE2 4.47Å; W775-Y786 HydrophobicContact CZ3-CG 4.07Å
776	E	93.2	Very high	91.9	Very high	135 Å²	135	61.7 Å²	61.7	63%	0.631	29%	0.29	S	S	*	.	H	α-helix	trans	-62.1	-32.1	177.2	-75.3	170.9	178.9	0	0	112.8	A772 H773 L778	A772-E776 WeakPolarHBondContact O-CB 3.1Å; A772-E776 VanDerWaalsContact O-CG 3.3Å; A772-E776 WeakPolarHBondContact O-CG 3.25Å; A772-E776 PolarHBondContact O-N 3.26Å; H773-E776 IonicContact ND1-OE2 3.92Å; E776-L778 PolarHBondContact O-N 3Å
777	R	95.5	Very high	91.5	Very high	156 Å²	156	63.5 Å²	63.5	59%	0.589	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-9.8	177.5	-73.4	172.1	-177.9	-111	0.4	113.6	A734 H773 T774 W775	A734-R777 HydrophobicContact CB-CB 3.83Å; H773-R777 WeakPolarHBondContact O-CD 3.47Å; H773-R777 VanDerWaalsContact O-CG 3.25Å; H773-R777 WeakPolarHBondContact O-CG 3.36Å; T774-R777 PolarHBondContact O-N 3.41Å; W775-R777 VanDerWaalsContact C-N 3.26Å; W775-R777 PolarHBondContact O-N 3.35Å
778	L	94.8	Very high	90.9	Very high	6 Å²	6	65.2 Å²	65.2	3%	0.031	32%	0.317	C	S	.	.	S	Bend	trans	-74.4	136	177.7	-66.1	-179.7	0	0	0	111.6	A734 L737 R738 I741 W775 E776 H780 V782 R783	A734-L778 WeakPolarHBondContact O-CD2 3.34Å; L737-L778 HydrophobicContact CB-CD2 4.42Å; L737-L778 HydrophobicContact CD2-CD1 3.69Å; L737-L778 HydrophobicContact CD2-CD2 4.28Å; L737-L778 HydrophobicContact CD2-CG 4.12Å; L737-L778 HydrophobicContact CG-CD1 3.99Å; L737-L778 HydrophobicContact CG-CD2 4.26Å; R738-L778 HydrophobicContact CB-CD2 3.92Å; I741-L778 HydrophobicContact CD1-CD1 3.8Å; W775-L778 HydrophobicContact CE3-CD1 3.64Å; W775-L778 HydrophobicContact CZ3-CD1 3.99Å; W775-L778 WeakPolarHBondContact O-CB 3.43Å; W775-L778 PolarHBondContact O-N 3.44Å; W775-L778 VanDerWaalsContact O-N 3.13Å; E776-L778 PolarHBondContact O-N 3Å; L778-H780 PolarHBondContact O-N 3.43Å; L778-V782 HydrophobicContact CD1-CG1 4.49Å; L778-V782 HydrophobicContact CD2-CG1 4.48Å; L778-R783 HydrophobicContact CB-CG 3.88Å; L778-R783 HydrophobicContact CD1-CG 4.4Å
779	P	93.3	Very high	90.5	Very high	61 Å²	61	65.4 Å²	65.4	40%	0.396	32%	0.318	S	S	.	.			trans	-56.4	141.6	171.4	-23.5	32.7	0	0	0	111.6	K781 V782 R783	P779-K781 PolarHBondContact O-N 3.17Å; P779-K781 VanDerWaalsContact O-N 3.13Å; P779-V782 HydrophobicContact CB-CG2 4.22Å; P779-V782 HydrophobicContact CG-CG2 4.28Å; P779-V782 WeakPolarHBondContact O-CA 3.27Å; P779-V782 WeakPolarHBondContact O-CB 3.43Å; P779-V782 PolarHBondContact O-N 3.3Å; P779-R783 PolarHBondContact O-N 3.27Å; P779-R783 VanDerWaalsContact O-N 3.17Å
780	H	86.3	Confident	90.2	Very high	71 Å²	71	66.8 Å²	66.8	33%	0.329	32%	0.318	S	S	.	.	H	α-helix	trans	-52.1	-40.3	-178.5	-179.9	73.1	0	0	0	113.1	H197 L778 V782 R783 K784	H197-H780 AromaticContact CE1-CD2 3.77Å; H197-H780 AromaticContact CE1-NE2 3.48Å; H197-H780 PolarHBondContact CE1-NE2 3.11Å; H197-H780 AromaticContact ND1-CE1 3.91Å; H197-H780 AromaticContact ND1-NE2 3.55Å; L778-H780 PolarHBondContact O-N 3.43Å; H780-V782 PolarHBondContact O-N 3.06Å; H780-R783 PolarHBondContact O-N 2.96Å; H780-R783 VanDerWaalsContact O-N 3.15Å; H780-K784 PolarHBondContact O-N 2.88Å
781	K	86.8	Confident	89.5	Confident	184 Å²	184	68.2 Å²	68.2	80%	0.8	32%	0.323	S	S	*	.	H	α-helix	trans	-57	-34.6	174.8	-175.9	174.2	-179	173.9	0	113.5	P779 L785	P779-K781 PolarHBondContact O-N 3.17Å; P779-K781 VanDerWaalsContact O-N 3.13Å; K781-L785 PolarHBondContact O-N 2.89Å
782	V	91.7	Very high	88.9	Confident	10 Å²	10	68.9 Å²	68.9	6%	0.061	33%	0.327	C	S	.	.	H	α-helix	trans	-77.6	-39.3	178.5	180	0	0	0	0	110.5	R738 I741 L778 P779 H780 L785 Y786	R738-V782 HydrophobicContact CB-CG1 4.36Å; R738-V782 HydrophobicContact CG-CG1 4.04Å; R738-V782 HydrophobicContact CG-CG2 3.97Å; I741-V782 HydrophobicContact CB-CG1 4.29Å; I741-V782 HydrophobicContact CD1-CG1 3.75Å; I741-V782 HydrophobicContact CG2-CG1 4.09Å; L778-V782 HydrophobicContact CD1-CG1 4.49Å; L778-V782 HydrophobicContact CD2-CG1 4.48Å; P779-V782 HydrophobicContact CB-CG2 4.22Å; P779-V782 HydrophobicContact CG-CG2 4.28Å; P779-V782 WeakPolarHBondContact O-CA 3.27Å; P779-V782 WeakPolarHBondContact O-CB 3.43Å; P779-V782 PolarHBondContact O-N 3.3Å; H780-V782 PolarHBondContact O-N 3.06Å; V782-L785 WeakPolarHBondContact O-CB 3.27Å; V782-L785 PolarHBondContact O-N 2.96Å; V782-Y786 PolarHBondContact O-N 3.42Å
783	R	89.1	Confident	88.5	Confident	93 Å²	93	67.6 Å²	67.6	35%	0.351	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-47.9	173.1	-68.3	-167.6	-79.8	134.3	-8.9	111.4	L778 P779 H780 L785 Y786 S787	L778-R783 HydrophobicContact CB-CG 3.88Å; L778-R783 HydrophobicContact CD1-CG 4.4Å; P779-R783 PolarHBondContact O-N 3.27Å; P779-R783 VanDerWaalsContact O-N 3.17Å; H780-R783 PolarHBondContact O-N 2.96Å; H780-R783 VanDerWaalsContact O-N 3.15Å; R783-L785 VanDerWaalsContact C-N 3.27Å; R783-L785 PolarHBondContact O-N 3.26Å; R783-Y786 WeakPolarHBondContact O-CB 3.48Å; R783-Y786 PolarHBondContact O-N 3.05Å; R783-S787 PolarHBondContact O-N 2.99Å; R783-S787 PolarHBondContact O-OG 2.95Å
784	K	82.9	Confident	87.7	Confident	115 Å²	115	64.7 Å²	64.7	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-58.3	-37	174.2	-169.9	167.9	-171.8	160.7	0	112.8	E200 H780 A788	E200-K784 IonicContact OE1-NZ 2.87Å; E200-K784 PolarHBondContact OE1-NZ 3.5Å; H780-K784 PolarHBondContact O-N 2.88Å; K784-A788 VanDerWaalsContact O-CB 3.32Å; K784-A788 WeakPolarHBondContact O-CB 3.41Å; K784-A788 PolarHBondContact O-N 3.34Å
785	L	87.3	Confident	86.8	Confident	61 Å²	61	68 Å²	68	32%	0.319	32%	0.323	S	S	.	.	H	α-helix	trans	-64.8	-46.4	173.7	176.5	61.7	0	0	0	111.4	I741 A745 K781 V782 R783 A788 L789	I741-L785 HydrophobicContact CG2-CB 4.44Å; I741-L785 HydrophobicContact CG2-CD2 3.96Å; I741-L785 HydrophobicContact CG2-CG 4.02Å; A745-L785 HydrophobicContact CB-CD1 4.32Å; A745-L785 HydrophobicContact CB-CD2 4.25Å; K781-L785 PolarHBondContact O-N 2.89Å; V782-L785 WeakPolarHBondContact O-CB 3.27Å; V782-L785 PolarHBondContact O-N 2.96Å; R783-L785 VanDerWaalsContact C-N 3.27Å; R783-L785 PolarHBondContact O-N 3.26Å; L785-A788 PolarHBondContact O-N 3.02Å; L785-L789 HydrophobicContact CD1-CD1 4.38Å; L785-L789 HydrophobicContact CD1-CG 4.31Å; L785-L789 HydrophobicContact CG-CD1 4.31Å; L785-L789 WeakPolarHBondContact O-CG 3.5Å; L785-L789 PolarHBondContact O-N 3.33Å
786	Y	91.9	Very high	85.3	Confident	24 Å²	24	67.5 Å²	67.5	9%	0.094	33%	0.325	C	S	.	.	H	α-helix	trans	-58.8	-51.2	176.9	175.1	-103.9	0	0	0	111.8	I741 M760 L763 S764 W775 V782 R783 A788 L789 E790	I741-Y786 HydrophobicContact CD1-CD2 4.44Å; I741-Y786 HydrophobicContact CD1-CG 4.48Å; I741-Y786 HydrophobicContact CG1-CD2 4.14Å; M760-Y786 HydrophobicContact CE-CD2 3.76Å; M760-Y786 HydrophobicContact CE-CE2 3.53Å; M760-Y786 HydrophobicContact SD-CD2 4.39Å; M760-Y786 HydrophobicContact SD-CE2 4.37Å; L763-Y786 HydrophobicContact CB-CE2 3.96Å; L763-Y786 HydrophobicContact CD1-CD2 4.19Å; L763-Y786 HydrophobicContact CD1-CE2 4.08Å; S764-Y786 PolarHBondContact OG-OH 3.05Å; W775-Y786 HydrophobicContact CH2-CD1 4.23Å; W775-Y786 HydrophobicContact CH2-CD2 4.2Å; W775-Y786 AromaticContact CH2-CE1 3.95Å; W775-Y786 HydrophobicContact CH2-CE1 3.95Å; W775-Y786 AromaticContact CH2-CE2 3.93Å; W775-Y786 HydrophobicContact CH2-CE2 3.93Å; W775-Y786 HydrophobicContact CH2-CG 4.34Å; W775-Y786 AromaticContact CH2-CZ 3.79Å; W775-Y786 AromaticContact CZ3-CD1 3.91Å; W775-Y786 HydrophobicContact CZ3-CD1 3.91Å; W775-Y786 HydrophobicContact CZ3-CD2 4.35Å; W775-Y786 HydrophobicContact CZ3-CE1 4.03Å; W775-Y786 HydrophobicContact CZ3-CE2 4.47Å; W775-Y786 HydrophobicContact CZ3-CG 4.07Å; V782-Y786 PolarHBondContact O-N 3.42Å; R783-Y786 WeakPolarHBondContact O-CB 3.48Å; R783-Y786 PolarHBondContact O-N 3.05Å; Y786-A788 PolarHBondContact O-N 3.21Å; Y786-L789 CarbonylContact O-C 3.38Å; Y786-L789 WeakPolarHBondContact O-CA 3.48Å; Y786-L789 WeakPolarHBondContact O-CB 3.31Å; Y786-L789 PolarHBondContact O-N 3.31Å; Y786-E790 WeakPolarHBondContact O-CB 3.13Å; Y786-E790 PolarHBondContact O-N 3.21Å
787	S	84.3	Confident	83.6	Confident	54 Å²	54	64.7 Å²	64.7	38%	0.378	31%	0.309	S	S	.	.	H	α-helix	trans	-59	-35.6	177.1	-47.9	0	0	0	0	112.2	R783 E790 R791	R783-S787 PolarHBondContact O-N 2.99Å; R783-S787 PolarHBondContact O-OG 2.95Å; S787-E790 PolarHBondContact O-N 3.32Å; S787-R791 PolarHBondContact O-N 2.8Å
788	A	80.3	Confident	82.4	Confident	35 Å²	35	59.9 Å²	59.9	29%	0.289	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-34.7	175.2	0	0	0	0	0	113.3	K784 L785 Y786	K784-A788 VanDerWaalsContact O-CB 3.32Å; K784-A788 WeakPolarHBondContact O-CB 3.41Å; K784-A788 PolarHBondContact O-N 3.34Å; L785-A788 PolarHBondContact O-N 3.02Å; Y786-A788 PolarHBondContact O-N 3.21Å
789	L	87.1	Confident	81.5	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-75	-38.9	175	-65.4	176	0	0	0	111.4	I741 A744 A745 K748 F756 M760 L785 Y786 R791 L792	I741-L789 HydrophobicContact CG2-CD1 4.5Å; A744-L789 HydrophobicContact CB-CD1 4Å; A745-L789 HydrophobicContact CB-CD1 4.25Å; K748-L789 HydrophobicContact CD-CD2 3.89Å; F756-L789 HydrophobicContact CE2-CB 3.97Å; F756-L789 HydrophobicContact CE2-CD1 4.36Å; F756-L789 HydrophobicContact CE2-CD2 3.82Å; F756-L789 HydrophobicContact CE2-CG 4.25Å; F756-L789 HydrophobicContact CZ-CB 4.22Å; F756-L789 HydrophobicContact CZ-CD2 4.41Å; M760-L789 HydrophobicContact CE-CB 3.72Å; M760-L789 HydrophobicContact SD-CB 3.87Å; M760-L789 HydrophobicContact SD-CD1 4.14Å; L785-L789 HydrophobicContact CD1-CD1 4.38Å; L785-L789 HydrophobicContact CD1-CG 4.31Å; L785-L789 HydrophobicContact CG-CD1 4.31Å; L785-L789 WeakPolarHBondContact O-CG 3.5Å; L785-L789 PolarHBondContact O-N 3.33Å; Y786-L789 CarbonylContact O-C 3.38Å; Y786-L789 WeakPolarHBondContact O-CA 3.48Å; Y786-L789 WeakPolarHBondContact O-CB 3.31Å; Y786-L789 PolarHBondContact O-N 3.31Å; L789-R791 PolarHBondContact O-N 3.31Å; L789-L792 WeakPolarHBondContact O-CB 3.17Å; L789-L792 PolarHBondContact O-N 3.3Å; L789-L792 VanDerWaalsContact O-N 3.11Å
790	E	86.9	Confident	80.6	Confident	87 Å²	87	62 Å²	62	41%	0.407	30%	0.296	S	S	.	.	H	α-helix	trans	-58.7	-33	-179	-169.4	177.3	-155.5	0	0	113.1	M760 Y786 S787 L792 L793	M760-E790 HydrophobicContact CE-CB 4.25Å; Y786-E790 WeakPolarHBondContact O-CB 3.13Å; Y786-E790 PolarHBondContact O-N 3.21Å; S787-E790 PolarHBondContact O-N 3.32Å; E790-L792 PolarHBondContact O-N 2.97Å; E790-L793 VanDerWaalsContact O-CB 3.29Å; E790-L793 WeakPolarHBondContact O-CB 3.46Å; E790-L793 PolarHBondContact O-N 3.42Å
791	R	79.6	Confident	80	Confident	130 Å²	130	61.5 Å²	61.5	49%	0.491	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-54.5	-25.5	175.1	-73.3	-176.7	-69.6	147.7	-5.3	114.6	S787 L789 L793 V801	S787-R791 PolarHBondContact O-N 2.8Å; L789-R791 PolarHBondContact O-N 3.31Å; R791-L793 VanDerWaalsContact C-N 3.26Å; R791-L793 PolarHBondContact O-N 3.47Å; R791-V801 WeakPolarHBondContact O-CG1 3.32Å
792	L	81.4	Confident	79.9	Confident	16 Å²	16	53.1 Å²	53.1	8%	0.084	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-73.9	-17	175.8	-77.6	163.7	0	0	0	113.3	K748 F756 F757 L789 E790 D794 V801 A805	K748-L792 HydrophobicContact CD-CD1 3.76Å; F756-L792 HydrophobicContact CE1-CB 3.98Å; F756-L792 HydrophobicContact CE1-CD1 3.79Å; F756-L792 HydrophobicContact CZ-CB 4.17Å; F756-L792 HydrophobicContact CZ-CD1 3.78Å; F757-L792 WeakPolarHBondContact CE1-O 3.08Å; F757-L792 HydrophobicContact CZ-CB 4.19Å; F757-L792 WeakPolarHBondContact CZ-O 3.25Å; L789-L792 WeakPolarHBondContact O-CB 3.17Å; L789-L792 PolarHBondContact O-N 3.3Å; L789-L792 VanDerWaalsContact O-N 3.11Å; E790-L792 PolarHBondContact O-N 2.97Å; L792-D794 VanDerWaalsContact C-N 3.32Å; L792-V801 HydrophobicContact CD2-CG1 4.28Å; L792-A805 HydrophobicContact CD2-CB 3.83Å
793	L	84.4	Confident	79.5	Confident	23 Å²	23	56.3 Å²	56.3	12%	0.12	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-82.9	-8.8	179.1	-71	82.3	0	0	0	112.9	F756 F757 M760 F761 E790 R791 P795	F756-L793 HydrophobicContact CZ-CD1 4.48Å; F757-L793 HydrophobicContact CD1-CD1 4.47Å; F757-L793 HydrophobicContact CD1-CG 4.07Å; F757-L793 HydrophobicContact CE1-CD1 4.33Å; F757-L793 HydrophobicContact CE1-CG 3.98Å; M760-L793 HydrophobicContact CB-CD1 3.75Å; M760-L793 HydrophobicContact CB-CD2 3.9Å; M760-L793 HydrophobicContact CB-CG 4.38Å; M760-L793 HydrophobicContact CE-CD1 3.96Å; M760-L793 HydrophobicContact CG-CD1 4.05Å; F761-L793 HydrophobicContact CD1-CD2 3.47Å; F761-L793 VanDerWaalsContact CD1-CD2 3.47Å; F761-L793 HydrophobicContact CE1-CD2 3.53Å; F761-L793 HydrophobicContact CE1-CG 4.18Å; E790-L793 VanDerWaalsContact O-CB 3.29Å; E790-L793 WeakPolarHBondContact O-CB 3.46Å; E790-L793 PolarHBondContact O-N 3.42Å; R791-L793 VanDerWaalsContact C-N 3.26Å; R791-L793 PolarHBondContact O-N 3.47Å; L793-P795 VanDerWaalsContact O-CD 3.32Å; L793-P795 WeakPolarHBondContact O-CD 3.44Å; L793-P795 VanDerWaalsContact O-N 3.17Å
794	D	74.6	Confident	78.9	Confident	52 Å²	52	55.5 Å²	55.5	28%	0.278	27%	0.274	S	S	.	.			trans	-56.6	117.2	-177.1	-175.8	2.8	0	0	0	111.5	L792 S796 H799 V801	L792-D794 VanDerWaalsContact C-N 3.32Å; D794-S796 VanDerWaalsContact C-N 3.28Å; D794-S796 PolarHBondContact O-N 2.99Å; D794-S796 WeakPolarHBondContact OD1-CB 3.31Å; D794-S796 PolarHBondContact OD1-N 3.47Å; D794-S796 PolarHBondContact OD1-OG 2.92Å; D794-H799 WeakPolarHBondContact O-CA 3.12Å; D794-V801 HydrophobicContact CB-CG2 4.43Å
795	P	76.1	Confident	78.8	Confident	73 Å²	73	51.7 Å²	51.7	47%	0.474	26%	0.264	S	S	.	.			trans	-78.9	-10.2	178.9	33.2	-35.9	0	0	0	113.4	L793 N798 H799	L793-P795 VanDerWaalsContact O-CD 3.32Å; L793-P795 WeakPolarHBondContact O-CD 3.44Å; L793-P795 VanDerWaalsContact O-N 3.17Å; P795-N798 PolarHBondContact O-N 3.05Å; P795-H799 PolarHBondContact O-N 3.25Å
796	S	63.4	Low	78.8	Confident	26 Å²	26	50.1 Å²	50.1	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-55.3	140.4	-176.4	-53.6	0	0	0	0	111.3	Q212 D794 N798 H799 R800	Q212-S796 PolarHBondContact NE2-OG 3.19Å; Q212-S796 VanDerWaalsContact NE2-OG 3.09Å; D794-S796 VanDerWaalsContact C-N 3.28Å; D794-S796 PolarHBondContact O-N 2.99Å; D794-S796 WeakPolarHBondContact OD1-CB 3.31Å; D794-S796 PolarHBondContact OD1-N 3.47Å; D794-S796 PolarHBondContact OD1-OG 2.92Å; S796-N798 VanDerWaalsContact C-N 3.32Å; S796-N798 PolarHBondContact O-N 3.04Å; S796-H799 PolarHBondContact O-N 3.29Å; S796-R800 PolarHBondContact O-N 3.23Å
797	W	57.7	Low	78.4	Confident	75 Å²	75	53.1 Å²	53.1	28%	0.284	29%	0.285	S	S	.	.	H	α-helix	trans	53.4	47.1	179.6	-58.5	88.7	0	0	0	112.7	P215 D216 E241 H799 R800	P215-W797 HydrophobicContact CB-CD2 4.17Å; P215-W797 HydrophobicContact CB-CE3 4.37Å; P215-W797 HydrophobicContact CB-CH2 3.78Å; P215-W797 HydrophobicContact CB-CZ2 3.55Å; P215-W797 HydrophobicContact CB-CZ3 4.13Å; P215-W797 HydrophobicContact CG-CZ2 4.24Å; D216-W797 HydrophobicContact CB-CH2 4.38Å; D216-W797 HydrophobicContact CB-CZ2 4.04Å; E241-W797 VanDerWaalsContact CD-CZ3 3.5Å; E241-W797 HydrophobicContact CG-CZ3 4.33Å; E241-W797 WeakPolarHBondContact OE1-CZ3 3.32Å; W797-H799 PolarHBondContact O-N 3.27Å; W797-R800 HydrophobicContact CB-CB 3.84Å; W797-R800 WeakPolarHBondContact O-CB 3.38Å; W797-R800 PolarHBondContact O-N 2.98Å
798	N	70	Confident	78.3	Confident	56 Å²	56	58.2 Å²	58.2	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	53.9	52	-178.5	-171.3	12.6	0	0	0	112.8	P795 S796 R800 R803	P795-N798 PolarHBondContact O-N 3.05Å; S796-N798 VanDerWaalsContact C-N 3.32Å; S796-N798 PolarHBondContact O-N 3.04Å; N798-R800 PolarHBondContact O-N 2.91Å; N798-R803 PolarHBondContact ND2-NH2 3.25Å; N798-R803 WeakPolarHBondContact O-CD 3.34Å; N798-R803 PolarHBondContact O-NE 3.23Å; N798-R803 PolarHBondContact OD1-NH2 3.29Å
799	H	76.4	Confident	78.6	Confident	19 Å²	19	59.3 Å²	59.3	9%	0.088	30%	0.301	C	S	.	.	H	α-helix	trans	57.9	41.3	-179	-59.3	-90.9	0	0	0	113.8	D794 P795 S796 W797 V801 Y802 R803 L819	D794-H799 WeakPolarHBondContact O-CA 3.12Å; P795-H799 PolarHBondContact O-N 3.25Å; S796-H799 PolarHBondContact O-N 3.29Å; W797-H799 PolarHBondContact O-N 3.27Å; H799-V801 VanDerWaalsContact C-N 3.28Å; H799-V801 PolarHBondContact O-N 2.98Å; H799-Y802 PolarHBondContact O-N 2.95Å; H799-Y802 VanDerWaalsContact O-N 3.11Å; H799-R803 WeakPolarHBondContact O-CG 3.48Å; H799-R803 PolarHBondContact O-N 3.26Å; H799-L819 HydrophobicContact CB-CD2 3.7Å; H799-L819 VanDerWaalsContact CD2-CD1 3.46Å; H799-L819 WeakPolarHBondContact CD2-CD1 3.46Å
800	R	73.8	Confident	78.6	Confident	92 Å²	92	62.5 Å²	62.5	35%	0.347	32%	0.324	S	S	.	.	H	α-helix	trans	-53.3	-41.7	-175.5	-177.7	173.5	-178.3	170.6	2	113.4	S796 W797 N798 Y802 R803 L804	S796-R800 PolarHBondContact O-N 3.23Å; W797-R800 HydrophobicContact CB-CB 3.84Å; W797-R800 WeakPolarHBondContact O-CB 3.38Å; W797-R800 PolarHBondContact O-N 2.98Å; N798-R800 PolarHBondContact O-N 2.91Å; R800-Y802 PolarHBondContact O-N 3.13Å; R800-R803 PolarHBondContact O-N 2.96Å; R800-L804 HydrophobicContact CG-CD1 3.85Å; R800-L804 HydrophobicContact CG-CG 4.18Å; R800-L804 WeakPolarHBondContact O-CB 3.31Å; R800-L804 VanDerWaalsContact O-CG 3.28Å; R800-L804 WeakPolarHBondContact O-CG 3.46Å; R800-L804 PolarHBondContact O-N 3.16Å
801	V	75	Confident	78.6	Confident	61 Å²	61	59 Å²	59	37%	0.37	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-46.3	-179.6	-176.4	0	0	0	0	110.8	R791 L792 D794 H799 A805	R791-V801 WeakPolarHBondContact O-CG1 3.32Å; L792-V801 HydrophobicContact CD2-CG1 4.28Å; D794-V801 HydrophobicContact CB-CG2 4.43Å; H799-V801 VanDerWaalsContact C-N 3.28Å; H799-V801 PolarHBondContact O-N 2.98Å; V801-A805 WeakPolarHBondContact O-CB 3.33Å; V801-A805 PolarHBondContact O-N 2.87Å; V801-A805 VanDerWaalsContact O-N 3.08Å
802	Y	84.7	Confident	79.2	Confident	7 Å²	7	54.2 Å²	54.2	3%	0.027	30%	0.295	C	S	.	.	H	α-helix	trans	-64	-47.7	174.9	166.2	-104.1	0	0	0	112	L753 F757 H799 R800 L804 A805 L806 F816 L819	L753-Y802 HydrophobicContact CB-CE2 4.38Å; L753-Y802 HydrophobicContact CD1-CE2 3.73Å; F757-Y802 AromaticContact CE2-CD2 3.43Å; F757-Y802 HydrophobicContact CE2-CD2 3.43Å; F757-Y802 VanDerWaalsContact CE2-CD2 3.43Å; F757-Y802 AromaticContact CE2-CE2 3.62Å; F757-Y802 HydrophobicContact CE2-CE2 3.62Å; F757-Y802 HydrophobicContact CE2-CG 4.28Å; F757-Y802 AromaticContact CZ-CD2 3.6Å; F757-Y802 HydrophobicContact CZ-CD2 3.6Å; F757-Y802 HydrophobicContact CZ-CE2 4.26Å; F757-Y802 HydrophobicContact CZ-CG 4.11Å; H799-Y802 PolarHBondContact O-N 2.95Å; H799-Y802 VanDerWaalsContact O-N 3.11Å; R800-Y802 PolarHBondContact O-N 3.13Å; Y802-L804 VanDerWaalsContact C-N 3.35Å; Y802-L804 PolarHBondContact O-N 3.34Å; Y802-A805 WeakPolarHBondContact O-CB 3.29Å; Y802-A805 PolarHBondContact O-N 3.29Å; Y802-A805 VanDerWaalsContact O-N 3.09Å; Y802-L806 HydrophobicContact CE1-CD2 4.25Å; Y802-L806 HydrophobicContact CE2-CB 4.49Å; Y802-L806 PolarHBondContact O-N 3.02Å; Y802-F816 HydrophobicContact CE1-CB 4.12Å; Y802-F816 HydrophobicContact CE2-CB 3.86Å; Y802-F816 PolarHBondContact OH-N 3.4Å; Y802-L819 HydrophobicContact CD1-CD2 3.46Å; Y802-L819 VanDerWaalsContact CD1-CD2 3.46Å; Y802-L819 HydrophobicContact CE1-CD2 3.66Å
803	R	83.6	Confident	79.8	Confident	78 Å²	78	53.7 Å²	53.7	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-42.2	-178.1	-68.1	-172.1	-171.9	-89.1	1.4	112.1	N798 H799 R800 A805 L806 A807 D823	N798-R803 PolarHBondContact ND2-NH2 3.25Å; N798-R803 WeakPolarHBondContact O-CD 3.34Å; N798-R803 PolarHBondContact O-NE 3.23Å; N798-R803 PolarHBondContact OD1-NH2 3.29Å; H799-R803 WeakPolarHBondContact O-CG 3.48Å; H799-R803 PolarHBondContact O-N 3.26Å; R800-R803 PolarHBondContact O-N 2.96Å; R803-A805 VanDerWaalsContact C-N 3.34Å; R803-L806 PolarHBondContact O-N 2.97Å; R803-A807 WeakPolarHBondContact O-CB 3.3Å; R803-A807 PolarHBondContact O-N 3.02Å; R803-D823 IonicContact CZ-OD1 3.69Å; R803-D823 IonicContact CZ-OD2 3.14Å; R803-D823 IonicContact NH1-OD2 3.99Å; R803-D823 PolarHBondContact NH1-OD2 3.03Å; R803-D823 VanDerWaalsContact NH2-CG 3.26Å; R803-D823 IonicContact NH2-OD1 2.6Å; R803-D823 PolarHBondContact NH2-OD1 3.35Å; R803-D823 IonicContact NH2-OD2 2.69Å; R803-D823 PolarHBondContact NH2-OD2 2.57Å
804	L	75.5	Confident	80.3	Confident	76 Å²	76	52.6 Å²	52.6	40%	0.398	29%	0.287	S	S	.	.	H	α-helix	trans	-65.2	-36.7	174.3	-71	175.8	0	0	0	112.3	R800 Y802 K808	R800-L804 HydrophobicContact CG-CD1 3.85Å; R800-L804 HydrophobicContact CG-CG 4.18Å; R800-L804 WeakPolarHBondContact O-CB 3.31Å; R800-L804 VanDerWaalsContact O-CG 3.28Å; R800-L804 WeakPolarHBondContact O-CG 3.46Å; R800-L804 PolarHBondContact O-N 3.16Å; Y802-L804 VanDerWaalsContact C-N 3.35Å; Y802-L804 PolarHBondContact O-N 3.34Å; L804-K808 WeakPolarHBondContact O-CG 3.48Å; L804-K808 PolarHBondContact O-N 3.46Å
805	A	81.1	Confident	81.3	Confident	34 Å²	34	50.1 Å²	50.1	28%	0.281	27%	0.273	S	S	.	.	H	α-helix	trans	-66.2	-46.5	174.8	0	0	0	0	0	111.2	L792 V801 Y802 R803 A807 K808 L809	L792-A805 HydrophobicContact CD2-CB 3.83Å; V801-A805 WeakPolarHBondContact O-CB 3.33Å; V801-A805 PolarHBondContact O-N 2.87Å; V801-A805 VanDerWaalsContact O-N 3.08Å; Y802-A805 WeakPolarHBondContact O-CB 3.29Å; Y802-A805 PolarHBondContact O-N 3.29Å; Y802-A805 VanDerWaalsContact O-N 3.09Å; R803-A805 VanDerWaalsContact C-N 3.34Å; A805-A807 PolarHBondContact O-N 3.49Å; A805-K808 PolarHBondContact O-N 3.43Å; A805-L809 WeakPolarHBondContact O-CG 3.43Å; A805-L809 PolarHBondContact O-N 2.85Å
806	L	87.6	Confident	82.3	Confident	28 Å²	28	47.1 Å²	47.1	15%	0.147	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-44	177.8	-176.7	67.8	0	0	0	111.8	L753 Y802 R803 K808 L809 V813 M853	L753-L806 HydrophobicContact CD1-CD1 4.06Å; Y802-L806 HydrophobicContact CE1-CD2 4.25Å; Y802-L806 HydrophobicContact CE2-CB 4.49Å; Y802-L806 PolarHBondContact O-N 3.02Å; R803-L806 PolarHBondContact O-N 2.97Å; L806-K808 PolarHBondContact O-N 3.34Å; L806-L809 PolarHBondContact O-N 3.43Å; L806-V813 HydrophobicContact CD1-CG1 4.28Å; L806-V813 HydrophobicContact CD1-CG2 3.97Å; L806-M853 HydrophobicContact CD2-SD 4.36Å
807	A	82.9	Confident	83.6	Confident	87 Å²	87	45.9 Å²	45.9	72%	0.719	24%	0.244	S	C	*	.	H	α-helix	trans	-62.1	-24.2	179.1	0	0	0	0	0	113.7	R803 A805	R803-A807 WeakPolarHBondContact O-CB 3.3Å; R803-A807 PolarHBondContact O-N 3.02Å; A805-A807 PolarHBondContact O-N 3.49Å
808	K	82.4	Confident	85.3	Confident	162 Å²	162	43.9 Å²	43.9	70%	0.704	24%	0.241	S	C	*	.	H	α-helix	trans	-84.8	-14.2	176	-70.2	174.7	-178.2	-176.1	0	113.3	L804 A805 L806	L804-K808 WeakPolarHBondContact O-CG 3.48Å; L804-K808 PolarHBondContact O-N 3.46Å; A805-K808 PolarHBondContact O-N 3.43Å; L806-K808 PolarHBondContact O-N 3.34Å
809	L	86.7	Confident	86.1	Confident	57 Å²	57	41.4 Å²	41.4	30%	0.298	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-87.6	132.3	-179.4	-65.2	173.5	0	0	0	110.2	K751 L753 A805 L806 V813	K751-L809 HydrophobicContact CG-CD2 4.43Å; L753-L809 HydrophobicContact CD1-CD1 3.86Å; A805-L809 WeakPolarHBondContact O-CG 3.43Å; A805-L809 PolarHBondContact O-N 2.85Å; L806-L809 PolarHBondContact O-N 3.43Å; L809-V813 HydrophobicContact CD1-CG2 4.23Å
810	S	86.3	Confident	86.7	Confident	73 Å²	73	40.8 Å²	40.8	51%	0.51	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-79.5	143.9	165.3	54.1	0	0	0	0	110.7	K751	K751-S810 PolarHBondContact NZ-O 3.26Å; K751-S810 PolarHBondContact NZ-OG 2.98Å
811	P	87.8	Confident	87.4	Confident	15 Å²	15	36.9 Å²	36.9	10%	0.097	21%	0.211	C	C	.	.	S	Bend	trans	-56.2	153.2	167.4	-19.9	30.5	0	0	0	111.4	H856 H860	P811-H856 VanDerWaalsContact CB-O 3.25Å; P811-H856 WeakPolarHBondContact CB-O 3.48Å; P811-H856 WeakPolarHBondContact CG-O 3.46Å; P811-H860 PolarHBondContact O-CD2 3.07Å
812	P	91.6	Very high	87.9	Confident	29 Å²	29	35.8 Å²	35.8	19%	0.188	20%	0.201	C	C	.	.	S	Bend	cis	-78.7	143.4	3.3	29	-29.4	0	0	0	113.1	W677 K751 C857 H860 P862	W677-P812 HydrophobicContact CH2-CB 3.63Å; W677-P812 HydrophobicContact CZ2-CB 3.66Å; K751-P812 VanDerWaalsContact CD-O 3.28Å; K751-P812 WeakPolarHBondContact CD-O 3.36Å; P812-C857 WeakPolarHBondContact CA-O 3.47Å; P812-H860 WeakPolarHBondContact CB-O 3.32Å; P812-P862 HydrophobicContact CG-CB 4.48Å
813	V	94.2	Very high	87.7	Confident	5 Å²	5	37 Å²	37	3%	0.03	21%	0.208	C	C	.	.			trans	-148.4	139.2	178.7	58.8	0	0	0	0	109.5	K751 L753 L806 L809 P815 C857	K751-V813 HydrophobicContact CB-CB 4.27Å; K751-V813 HydrophobicContact CB-CG2 4.15Å; K751-V813 WeakPolarHBondContact O-CG2 3.25Å; L753-V813 HydrophobicContact CD1-CG2 4.11Å; L753-V813 HydrophobicContact CG-CG2 4.26Å; L806-V813 HydrophobicContact CD1-CG1 4.28Å; L806-V813 HydrophobicContact CD1-CG2 3.97Å; L809-V813 HydrophobicContact CD1-CG2 4.23Å; V813-P815 WeakPolarHBondContact O-CD 3.33Å; V813-C857 HydrophobicContact CG1-CB 4.01Å; V813-C857 PolarHBondContact N-O 2.78Å; V813-C857 VanDerWaalsContact O-CB 3.31Å; V813-C857 WeakPolarHBondContact O-CB 3.35Å
814	I	95.9	Very high	87.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-94.9	109.9	167	-53.9	-177.9	0	0	0	107	D676 W677 F680 F709 K751 N752 L753 N754	D676-I814 HydrophobicContact CB-CD1 3.81Å; W677-I814 HydrophobicContact CD2-CD1 3.93Å; W677-I814 HydrophobicContact CD2-CG1 3.95Å; W677-I814 HydrophobicContact CE3-CG1 4.41Å; W677-I814 HydrophobicContact CG-CD1 3.91Å; W677-I814 HydrophobicContact CG-CG1 4.45Å; W677-I814 HydrophobicContact CH2-CG1 4.17Å; W677-I814 HydrophobicContact CZ2-CD1 4.46Å; W677-I814 HydrophobicContact CZ2-CG1 3.67Å; F680-I814 HydrophobicContact CD1-CG1 4.32Å; F680-I814 HydrophobicContact CD2-CG2 4.35Å; F680-I814 HydrophobicContact CG-CG2 4.37Å; F709-I814 HydrophobicContact CE1-CG2 4.43Å; F709-I814 HydrophobicContact CZ-CG2 3.72Å; K751-I814 PolarHBondContact O-N 3.26Å; N752-I814 HydrophobicContact CB-CD1 4.47Å; L753-I814 WeakPolarHBondContact CA-O 3.45Å; L753-I814 VanDerWaalsContact CB-O 3.32Å; L753-I814 WeakPolarHBondContact CB-O 3.45Å; L753-I814 PolarHBondContact N-O 2.83Å; N754-I814 HydrophobicContact CB-CG2 3.66Å; N754-I814 PolarHBondContact N-O 3.25Å
815	P	95.6	Very high	88.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.182	C	C	.	.			trans	-74	169	-176.7	33.2	-36.1	0	0	0	111.4	F680 N754 V813 M817 M853	F680-P815 HydrophobicContact CE2-CG 4.39Å; F680-P815 HydrophobicContact CZ-CG 4.18Å; N754-P815 WeakPolarHBondContact CB-O 3.33Å; V813-P815 WeakPolarHBondContact O-CD 3.33Å; P815-M817 VanDerWaalsContact C-N 3.33Å; P815-M817 HydrophobicContact CG-SD 3.88Å; P815-M817 PolarHBondContact O-N 2.9Å; P815-M853 HydrophobicContact CB-CE 4.37Å
816	F	95.3	Very high	88.1	Confident	10 Å²	10	33.3 Å²	33.3	4%	0.044	19%	0.186	C	C	.	.			trans	-73.4	89.1	171.8	179.3	-144.1	0	0	0	108.8	F713 F757 F761 Y802 P818 L819 L820	F713-F816 HydrophobicContact CE2-CD2 4.05Å; F713-F816 AromaticContact CE2-CE2 3.72Å; F713-F816 HydrophobicContact CE2-CE2 3.72Å; F713-F816 AromaticContact CZ-CE2 3.73Å; F713-F816 HydrophobicContact CZ-CE2 3.73Å; F757-F816 HydrophobicContact CB-CD2 3.69Å; F757-F816 HydrophobicContact CB-CE2 3.81Å; F757-F816 HydrophobicContact CB-CG 4.37Å; F757-F816 HydrophobicContact CD2-CB 3.65Å; F757-F816 HydrophobicContact CD2-CD1 4.13Å; F757-F816 AromaticContact CD2-CD2 3.77Å; F757-F816 HydrophobicContact CD2-CD2 3.77Å; F757-F816 HydrophobicContact CD2-CE2 4.5Å; F757-F816 AromaticContact CD2-CG 3.58Å; F757-F816 HydrophobicContact CD2-CG 3.58Å; F757-F816 HydrophobicContact CE2-CB 3.86Å; F757-F816 HydrophobicContact CE2-CD1 4.22Å; F757-F816 AromaticContact CE2-CG 4Å; F757-F816 HydrophobicContact CE2-CG 4Å; F757-F816 HydrophobicContact CG-CB 4.47Å; F757-F816 HydrophobicContact CG-CD1 4.32Å; F757-F816 AromaticContact CG-CD2 3.76Å; F757-F816 HydrophobicContact CG-CD2 3.76Å; F757-F816 HydrophobicContact CG-CE2 4.05Å; F757-F816 AromaticContact CG-CG 3.94Å; F757-F816 HydrophobicContact CG-CG 3.94Å; F757-F816 HydrophobicContact CG-CZ 4.48Å; F757-F816 HydrophobicContact CZ-CD1 4.42Å; F761-F816 HydrophobicContact CE2-CE2 4.03Å; F761-F816 AromaticContact CE2-CZ 3.75Å; F761-F816 HydrophobicContact CE2-CZ 3.75Å; F761-F816 HydrophobicContact CZ-CE2 4.48Å; F761-F816 AromaticContact CZ-CZ 3.85Å; F761-F816 HydrophobicContact CZ-CZ 3.85Å; Y802-F816 HydrophobicContact CE1-CB 4.12Å; Y802-F816 HydrophobicContact CE2-CB 3.86Å; Y802-F816 PolarHBondContact OH-N 3.4Å; F816-P818 HydrophobicContact CD2-CB 4.32Å; F816-P818 HydrophobicContact CD2-CG 3.97Å; F816-P818 HydrophobicContact CE2-CB 3.69Å; F816-P818 HydrophobicContact CE2-CG 3.49Å; F816-P818 VanDerWaalsContact CE2-CG 3.49Å; F816-P818 HydrophobicContact CZ-CB 3.89Å; F816-P818 HydrophobicContact CZ-CG 4.2Å; F816-L819 HydrophobicContact CD1-CB 3.43Å; F816-L819 VanDerWaalsContact CD1-CB 3.43Å; F816-L819 HydrophobicContact CD1-CD2 4.19Å; F816-L819 HydrophobicContact CD1-CG 4.46Å; F816-L819 HydrophobicContact CE1-CB 3.74Å; F816-L819 HydrophobicContact CG-CB 4.2Å; F816-L819 PolarHBondContact O-N 3.21Å; F816-L819 VanDerWaalsContact O-N 3.13Å; F816-L820 PolarHBondContact O-N 3.31Å
817	M	92.4	Very high	87.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-38.3	-171.6	-76.2	-60.1	-70.8	0	0	114.6	F680 L688 L706 F709 M710 N754 P815 L819 L820 L821 L854	F680-M817 HydrophobicContact CE2-CG 4.3Å; F680-M817 HydrophobicContact CE2-SD 3.81Å; L688-M817 HydrophobicContact CD2-CE 4.31Å; L706-M817 HydrophobicContact CD1-CE 3.82Å; F709-M817 HydrophobicContact CD1-CB 4.27Å; F709-M817 HydrophobicContact CD1-CG 3.84Å; F709-M817 HydrophobicContact CE1-CB 4.01Å; F709-M817 HydrophobicContact CE1-CG 3.4Å; M710-M817 HydrophobicContact SD-CB 3.96Å; N754-M817 PolarHBondContact OD1-N 2.94Å; P815-M817 VanDerWaalsContact C-N 3.33Å; P815-M817 HydrophobicContact CG-SD 3.88Å; P815-M817 PolarHBondContact O-N 2.9Å; M817-L819 VanDerWaalsContact C-N 3.26Å; M817-L819 PolarHBondContact O-N 2.93Å; M817-L820 HydrophobicContact CE-CD2 4.15Å; M817-L820 WeakPolarHBondContact O-CB 3.48Å; M817-L820 PolarHBondContact O-N 2.93Å; M817-L820 VanDerWaalsContact O-N 3.1Å; M817-L820 HydrophobicContact SD-CD2 3.82Å; M817-L821 PolarHBondContact O-N 3.3Å; M817-L854 HydrophobicContact CE-CD1 3.88Å; M817-L854 HydrophobicContact SD-CD1 3.98Å
818	P	92	Very high	87.8	Confident	32 Å²	32	30.7 Å²	30.7	21%	0.208	16%	0.159	C	C	.	.	H	α-helix	trans	-53.8	-38.6	173.4	-27.9	32.7	0	0	0	114.4	M710 F713 F816 L821 K822	M710-P818 HydrophobicContact CE-CB 4.17Å; M710-P818 HydrophobicContact CE-CG 3.71Å; M710-P818 HydrophobicContact SD-CG 4.46Å; F713-P818 HydrophobicContact CD1-CG 4.23Å; F713-P818 HydrophobicContact CD2-CG 4.12Å; F713-P818 HydrophobicContact CE1-CG 4.21Å; F713-P818 HydrophobicContact CE2-CG 4.08Å; F713-P818 HydrophobicContact CG-CG 4.21Å; F713-P818 HydrophobicContact CZ-CG 4.14Å; F816-P818 HydrophobicContact CD2-CB 4.32Å; F816-P818 HydrophobicContact CD2-CG 3.97Å; F816-P818 HydrophobicContact CE2-CB 3.69Å; F816-P818 HydrophobicContact CE2-CG 3.49Å; F816-P818 VanDerWaalsContact CE2-CG 3.49Å; F816-P818 HydrophobicContact CZ-CB 3.89Å; F816-P818 HydrophobicContact CZ-CG 4.2Å; P818-L821 PolarHBondContact O-N 3.37Å; P818-K822 WeakPolarHBondContact O-CB 3.42Å; P818-K822 PolarHBondContact O-N 3.2Å
819	L	87.7	Confident	87.7	Confident	5 Å²	5	26.6 Å²	26.6	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-72.6	-35.7	177.6	-179.1	59.6	0	0	0	112.2	H799 Y802 F816 M817 K822 D823	H799-L819 HydrophobicContact CB-CD2 3.7Å; H799-L819 VanDerWaalsContact CD2-CD1 3.46Å; H799-L819 WeakPolarHBondContact CD2-CD1 3.46Å; Y802-L819 HydrophobicContact CD1-CD2 3.46Å; Y802-L819 VanDerWaalsContact CD1-CD2 3.46Å; Y802-L819 HydrophobicContact CE1-CD2 3.66Å; F816-L819 HydrophobicContact CD1-CB 3.43Å; F816-L819 VanDerWaalsContact CD1-CB 3.43Å; F816-L819 HydrophobicContact CD1-CD2 4.19Å; F816-L819 HydrophobicContact CD1-CG 4.46Å; F816-L819 HydrophobicContact CE1-CB 3.74Å; F816-L819 HydrophobicContact CG-CB 4.2Å; F816-L819 PolarHBondContact O-N 3.21Å; F816-L819 VanDerWaalsContact O-N 3.13Å; M817-L819 VanDerWaalsContact C-N 3.26Å; M817-L819 PolarHBondContact O-N 2.93Å; L819-K822 HydrophobicContact CD1-CD 3.94Å; L819-K822 WeakPolarHBondContact O-CB 3.38Å; L819-K822 PolarHBondContact O-N 3.03Å; L819-D823 PolarHBondContact O-N 3.39Å
820	L	88.3	Confident	87	Confident	5 Å²	5	26.4 Å²	26.4	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-42.3	173.3	178.4	55.9	0	0	0	111.7	L688 F816 M817 D823 M824 A850 M853	L688-L820 HydrophobicContact CD2-CD2 3.47Å; L688-L820 VanDerWaalsContact CD2-CD2 3.47Å; L688-L820 HydrophobicContact CD2-CG 3.99Å; F816-L820 PolarHBondContact O-N 3.31Å; M817-L820 HydrophobicContact CE-CD2 4.15Å; M817-L820 WeakPolarHBondContact O-CB 3.48Å; M817-L820 PolarHBondContact O-N 2.93Å; M817-L820 VanDerWaalsContact O-N 3.1Å; M817-L820 HydrophobicContact SD-CD2 3.82Å; L820-D823 PolarHBondContact O-N 2.9Å; L820-M824 WeakPolarHBondContact O-CG 3.36Å; L820-M824 PolarHBondContact O-N 3.26Å; L820-A850 HydrophobicContact CD1-CB 4.16Å; L820-M853 HydrophobicContact CB-CE 3.87Å; L820-M853 HydrophobicContact CD1-CE 3.33Å; L820-M853 HydrophobicContact CD1-SD 4.39Å; L820-M853 HydrophobicContact CD2-CE 3.45Å; L820-M853 VanDerWaalsContact CD2-CE 3.45Å; L820-M853 HydrophobicContact CG-CE 3.69Å
821	L	88.9	Confident	86.6	Confident	10 Å²	10	24.9 Å²	24.9	5%	0.052	14%	0.14	C	C	.	.	H	α-helix	trans	-67	-38.5	176.2	-67.3	173.5	0	0	0	111.5	L688 Y691 L706 M710 M817 P818 D823 M824 T825	L688-L821 HydrophobicContact CG-CD2 4.39Å; Y691-L821 HydrophobicContact CD1-CD1 4.46Å; Y691-L821 HydrophobicContact CD1-CD2 3.91Å; Y691-L821 HydrophobicContact CE1-CD1 4.17Å; Y691-L821 HydrophobicContact CE1-CD2 4.39Å; L706-L821 HydrophobicContact CD1-CD1 4.34Å; L706-L821 HydrophobicContact CD1-CD2 4.37Å; L706-L821 HydrophobicContact CD2-CD2 3.89Å; M710-L821 HydrophobicContact CE-CD1 3.76Å; M710-L821 HydrophobicContact CG-CD1 3.77Å; M710-L821 HydrophobicContact SD-CD1 3.48Å; M710-L821 WeakPolarHBondContact SD-CD1 3.48Å; M817-L821 PolarHBondContact O-N 3.3Å; P818-L821 PolarHBondContact O-N 3.37Å; L821-D823 VanDerWaalsContact C-N 3.35Å; L821-D823 PolarHBondContact O-N 3.28Å; L821-M824 WeakPolarHBondContact O-CB 3.31Å; L821-M824 PolarHBondContact O-N 2.95Å; L821-T825 PolarHBondContact O-N 3.47Å; L821-T825 PolarHBondContact O-OG1 2.58Å; L821-T825 VanDerWaalsContact O-OG1 3.1Å
822	K	85	Confident	86.4	Confident	39 Å²	39	31.2 Å²	31.2	17%	0.17	17%	0.168	C	C	.	.	H	α-helix	trans	-54.3	-52.3	169.9	-178.3	-169	175.2	-174.8	0	110.4	M48 P818 L819 M824 T825 F826	M48-K822 HydrophobicContact CE-CD 3.81Å; M48-K822 HydrophobicContact CE-CG 4.48Å; M48-K822 HydrophobicContact SD-CD 4.18Å; M48-K822 PolarHBondContact SD-NZ 2.78Å; P818-K822 WeakPolarHBondContact O-CB 3.42Å; P818-K822 PolarHBondContact O-N 3.2Å; L819-K822 HydrophobicContact CD1-CD 3.94Å; L819-K822 WeakPolarHBondContact O-CB 3.38Å; L819-K822 PolarHBondContact O-N 3.03Å; K822-M824 VanDerWaalsContact C-N 3.29Å; K822-M824 PolarHBondContact O-N 2.85Å; K822-T825 PolarHBondContact O-N 3.46Å; K822-F826 HydrophobicContact CD-CE2 4.24Å; K822-F826 HydrophobicContact CG-CD2 3.65Å; K822-F826 HydrophobicContact CG-CE2 3.64Å; K822-F826 VanDerWaalsContact O-CD2 3.3Å; K822-F826 WeakPolarHBondContact O-CD2 3.45Å; K822-F826 PolarHBondContact O-N 3.34Å
823	D	81.8	Confident	86.2	Confident	33 Å²	33	31.8 Å²	31.8	18%	0.176	17%	0.171	C	C	.	.	H	α-helix	trans	-56	-44.6	178.6	-68.7	-13.4	0	0	0	111.3	R803 L819 L820 L821 F826 I827	R803-D823 IonicContact CZ-OD1 3.69Å; R803-D823 IonicContact CZ-OD2 3.14Å; R803-D823 IonicContact NH1-OD2 3.99Å; R803-D823 PolarHBondContact NH1-OD2 3.03Å; R803-D823 VanDerWaalsContact NH2-CG 3.26Å; R803-D823 IonicContact NH2-OD1 2.6Å; R803-D823 PolarHBondContact NH2-OD1 3.35Å; R803-D823 IonicContact NH2-OD2 2.69Å; R803-D823 PolarHBondContact NH2-OD2 2.57Å; L819-D823 PolarHBondContact O-N 3.39Å; L820-D823 PolarHBondContact O-N 2.9Å; L821-D823 VanDerWaalsContact C-N 3.35Å; L821-D823 PolarHBondContact O-N 3.28Å; D823-F826 PolarHBondContact O-N 3.07Å; D823-I827 WeakPolarHBondContact O-CD1 3.4Å; D823-I827 WeakPolarHBondContact O-CG1 3.41Å; D823-I827 PolarHBondContact O-N 3.35Å
824	M	85.4	Confident	85.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-44	177	-71.9	-69.3	-70.9	0	0	113.3	L688 I689 A692 L820 L821 K822 I827 H828 M847 A850	L688-M824 HydrophobicContact CB-CE 4.26Å; I689-M824 HydrophobicContact CB-CE 4.37Å; I689-M824 HydrophobicContact CG1-CE 3.72Å; A692-M824 HydrophobicContact CB-CB 3.98Å; A692-M824 HydrophobicContact CB-CE 4.4Å; L820-M824 WeakPolarHBondContact O-CG 3.36Å; L820-M824 PolarHBondContact O-N 3.26Å; L821-M824 WeakPolarHBondContact O-CB 3.31Å; L821-M824 PolarHBondContact O-N 2.95Å; K822-M824 VanDerWaalsContact C-N 3.29Å; K822-M824 PolarHBondContact O-N 2.85Å; M824-I827 PolarHBondContact O-N 3.13Å; M824-H828 PolarHBondContact O-N 3.17Å; M824-M847 HydrophobicContact CE-CB 4.23Å; M824-M847 HydrophobicContact CE-CE 3.88Å; M824-A850 HydrophobicContact CG-CB 4.17Å; M824-A850 HydrophobicContact SD-CB 3.31Å; M824-A850 WeakPolarHBondContact SD-CB 3.42Å
825	T	82	Confident	85.3	Confident	22 Å²	22	39 Å²	39	14%	0.135	21%	0.211	C	C	.	.	H	α-helix	trans	-64.5	-45.4	177.3	-60.2	0	0	0	0	111.1	L41 L821 K822 I827 H828 E829	L41-T825 HydrophobicContact CD1-CG2 4.27Å; L821-T825 PolarHBondContact O-N 3.47Å; L821-T825 PolarHBondContact O-OG1 2.58Å; L821-T825 VanDerWaalsContact O-OG1 3.1Å; K822-T825 PolarHBondContact O-N 3.46Å; T825-I827 VanDerWaalsContact C-N 3.32Å; T825-I827 PolarHBondContact O-N 2.83Å; T825-H828 PolarHBondContact O-N 2.89Å; T825-E829 HydrophobicContact CG2-CG 4.28Å; T825-E829 VanDerWaalsContact CG2-OE1 3.25Å; T825-E829 WeakPolarHBondContact CG2-OE1 3.28Å; T825-E829 WeakPolarHBondContact O-CG 3.39Å; T825-E829 PolarHBondContact O-N 3.24Å
826	F	79.7	Confident	84.7	Confident	87 Å²	87	45.1 Å²	45.1	38%	0.382	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-37.6	176.6	-89	-90.9	0	0	0	112.3	L45 K822 D823 H828 G830	L45-F826 HydrophobicContact CD2-CE2 4.32Å; L45-F826 HydrophobicContact CD2-CZ 4.46Å; K822-F826 HydrophobicContact CD-CE2 4.24Å; K822-F826 HydrophobicContact CG-CD2 3.65Å; K822-F826 HydrophobicContact CG-CE2 3.64Å; K822-F826 VanDerWaalsContact O-CD2 3.3Å; K822-F826 WeakPolarHBondContact O-CD2 3.45Å; K822-F826 PolarHBondContact O-N 3.34Å; D823-F826 PolarHBondContact O-N 3.07Å; F826-H828 VanDerWaalsContact C-N 3.32Å; F826-G830 WeakPolarHBondContact O-CA 3.17Å; F826-G830 PolarHBondContact O-N 3.43Å
827	I	79.6	Confident	84.4	Confident	24 Å²	24	51.9 Å²	51.9	12%	0.123	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-43.7	172	-67.7	163.5	0	0	0	110.3	D823 M824 T825 N831 M846 M847 A850	D823-I827 WeakPolarHBondContact O-CD1 3.4Å; D823-I827 WeakPolarHBondContact O-CG1 3.41Å; D823-I827 PolarHBondContact O-N 3.35Å; M824-I827 PolarHBondContact O-N 3.13Å; T825-I827 VanDerWaalsContact C-N 3.32Å; T825-I827 PolarHBondContact O-N 2.83Å; I827-N831 WeakPolarHBondContact O-CB 3.45Å; I827-N831 PolarHBondContact O-N 3.09Å; I827-N831 PolarHBondContact O-ND2 3.18Å; I827-M846 HydrophobicContact CD1-CB 4.25Å; I827-M846 HydrophobicContact CG1-CB 4.41Å; I827-M846 HydrophobicContact CG1-CE 4.16Å; I827-M846 HydrophobicContact CG2-CB 3.69Å; I827-M846 HydrophobicContact CG2-CE 4.46Å; I827-M847 HydrophobicContact CG2-CG 3.61Å; I827-A850 HydrophobicContact CD1-CB 4.29Å
828	H	85	Confident	84.3	Confident	36 Å²	36	52.3 Å²	52.3	17%	0.167	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-46.5	-178	179.8	63.8	0	0	0	112.9	A692 L693 M824 T825 F826 N831 K843	A692-H828 PolarHBondContact O-CD2 3.46Å; L693-H828 VanDerWaalsContact CD2-CE1 3.41Å; L693-H828 WeakPolarHBondContact CD2-CE1 3.4Å; L693-H828 WeakPolarHBondContact CD2-ND1 3.3Å; M824-H828 PolarHBondContact O-N 3.17Å; T825-H828 PolarHBondContact O-N 2.89Å; F826-H828 VanDerWaalsContact C-N 3.32Å; H828-N831 VanDerWaalsContact O-O 3.05Å; H828-K843 PolarHBondContact ND1-NZ 3.17Å; H828-K843 VanDerWaalsContact ND1-NZ 3.16Å; H828-K843 PolarHBondContact O-NZ 3.48Å
829	E	80	Confident	84.4	Confident	77 Å²	77	51.5 Å²	51.5	36%	0.36	27%	0.272	S	S	.	.	H	α-helix	trans	-77.9	-36.9	-176.5	-68.8	174.9	-178.4	0	0	112.5	L41 L45 T825 N831	L41-E829 VanDerWaalsContact CD2-OE1 3.31Å; L41-E829 WeakPolarHBondContact CD2-OE1 3.37Å; L41-E829 WeakPolarHBondContact CG-OE1 3.36Å; L45-E829 VanDerWaalsContact CD1-OE1 3.3Å; L45-E829 WeakPolarHBondContact CD1-OE1 3.45Å; L45-E829 VanDerWaalsContact CD1-OE2 3.28Å; L45-E829 WeakPolarHBondContact CD1-OE2 3.4Å; T825-E829 HydrophobicContact CG2-CG 4.28Å; T825-E829 VanDerWaalsContact CG2-OE1 3.25Å; T825-E829 WeakPolarHBondContact CG2-OE1 3.28Å; T825-E829 WeakPolarHBondContact O-CG 3.39Å; T825-E829 PolarHBondContact O-N 3.24Å; E829-N831 VanDerWaalsContact C-N 3.3Å; E829-N831 PolarHBondContact O-N 3.06Å
830	G	73.3	Confident	84.5	Confident	53 Å²	53	52 Å²	52	55%	0.546	28%	0.275	S	S	.	.	H	α-helix	trans	-77.7	-10.9	-178.4	0	0	0	0	0	114.6	F826	F826-G830 WeakPolarHBondContact O-CA 3.17Å; F826-G830 PolarHBondContact O-N 3.43Å
831	N	77.6	Confident	84.7	Confident	41 Å²	41	51.8 Å²	51.8	22%	0.219	27%	0.274	C	S	.	.	S	Bend	trans	-132	126.8	-176.5	-57.8	-87.8	0	0	0	110.7	I827 H828 E829 K843	I827-N831 WeakPolarHBondContact O-CB 3.45Å; I827-N831 PolarHBondContact O-N 3.09Å; I827-N831 PolarHBondContact O-ND2 3.18Å; H828-N831 VanDerWaalsContact O-O 3.05Å; E829-N831 VanDerWaalsContact C-N 3.3Å; E829-N831 PolarHBondContact O-N 3.06Å; N831-K843 HydrophobicContact CB-CB 4.07Å; N831-K843 HydrophobicContact CB-CD 3.99Å; N831-K843 HydrophobicContact CB-CG 3.93Å; N831-K843 VanDerWaalsContact O-CD 3.28Å; N831-K843 WeakPolarHBondContact O-CD 3.35Å; N831-K843 WeakPolarHBondContact O-CE 3.43Å; N831-K843 PolarHBondContact O-NZ 2.82Å
832	H	82.4	Confident	84.6	Confident	148 Å²	148	53 Å²	53	69%	0.685	28%	0.28	S	S	*	.			trans	-68.2	138.6	174.9	-63.5	-68.4	0	0	0	111.4	L834 N840	H832-L834 VanDerWaalsContact C-N 3.27Å; H832-L834 WeakPolarHBondContact CB-O 3.46Å; H832-L834 PolarHBondContact O-N 3.4Å; H832-N840 WeakPolarHBondContact O-CB 3.41Å; H832-N840 PolarHBondContact O-ND2 3.43Å
833	T	88.4	Confident	84.7	Confident	40 Å²	40	51.3 Å²	51.3	25%	0.245	27%	0.272	C	S	.	.	S	Bend	trans	-68.1	-30	175.7	-56.1	0	0	0	0	111.8	V429 N840 K843 M844	V429-T833 HydrophobicContact CG1-CG2 4.16Å; T833-N840 WeakPolarHBondContact O-CB 3.47Å; T833-N840 PolarHBondContact O-N 3.2Å; T833-K843 PolarHBondContact OG1-NZ 3.13Å; T833-M844 HydrophobicContact CG2-CE 3.93Å
834	L	88	Confident	85.3	Confident	95 Å²	95	49.7 Å²	49.7	50%	0.497	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.3	175.9	-63.7	172.9	0	0	0	110	H832 L838 I839	H832-L834 VanDerWaalsContact C-N 3.27Å; H832-L834 WeakPolarHBondContact CB-O 3.46Å; H832-L834 PolarHBondContact O-N 3.4Å; L834-L838 CarbonylContact C-O 3.59Å; L834-L838 VanDerWaalsContact CA-O 3.26Å; L834-L838 WeakPolarHBondContact CA-O 3.32Å; L834-I839 HydrophobicContact CD2-CD1 3.54Å
835	V	82.6	Confident	85.5	Confident	62 Å²	62	52.9 Å²	52.9	38%	0.376	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.5	171.7	175.1	0	0	0	0	106.8	N837 L838 N840	V835-N837 PolarHBondContact O-N 3.06Å; V835-L838 PolarHBondContact N-O 2.92Å; V835-L838 WeakPolarHBondContact O-CB 3.36Å; V835-L838 PolarHBondContact O-N 3.33Å; V835-N840 HydrophobicContact CG2-CB 3.98Å
836	E	84.1	Confident	85.7	Confident	129 Å²	129	54.5 Å²	54.5	60%	0.603	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	38.5	-175.5	-59	-179.8	171.6	0	0	113.2	L838	E836-L838 PolarHBondContact O-N 3.19Å
837	N	87.8	Confident	86.3	Confident	152 Å²	152	50.4 Å²	50.4	81%	0.813	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	10.3	-173.8	-56	-46.4	0	0	0	115.7	V835	V835-N837 PolarHBondContact O-N 3.06Å
838	L	90.4	Very high	86.8	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	151	173.1	-59.9	177.1	0	0	0	110.6	V364 V367 T394 L834 V835 E836 N840	V364-L838 HydrophobicContact CG1-CD1 4.03Å; V367-L838 HydrophobicContact CG2-CD1 4.01Å; T394-L838 HydrophobicContact CG2-CD2 3.75Å; L834-L838 CarbonylContact C-O 3.59Å; L834-L838 VanDerWaalsContact CA-O 3.26Å; L834-L838 WeakPolarHBondContact CA-O 3.32Å; V835-L838 PolarHBondContact N-O 2.92Å; V835-L838 WeakPolarHBondContact O-CB 3.36Å; V835-L838 PolarHBondContact O-N 3.33Å; E836-L838 PolarHBondContact O-N 3.19Å; L838-N840 PolarHBondContact O-N 3.22Å
839	I	94.3	Very high	87	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.077	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	123.7	175.6	-54.5	-51	0	0	0	108.7	S392 G393 P395 I398 F430 L834 F841 M844	S392-I839 CarbonylContact C-O 3.53Å; S392-I839 WeakPolarHBondContact CA-O 3.49Å; S392-I839 VanDerWaalsContact CB-O 3.25Å; S392-I839 WeakPolarHBondContact CB-O 3.28Å; G393-I839 PolarHBondContact N-O 3.43Å; G393-I839 VanDerWaalsContact N-O 3.13Å; G393-I839 VanDerWaalsContact O-CB 3.31Å; G393-I839 WeakPolarHBondContact O-CB 3.4Å; G393-I839 WeakPolarHBondContact O-CG1 3.36Å; G393-I839 PolarHBondContact O-N 3.49Å; P395-I839 HydrophobicContact CG-CD1 4.43Å; P395-I839 HydrophobicContact CG-CG1 4.06Å; I398-I839 HydrophobicContact CD1-CB 4.03Å; I398-I839 HydrophobicContact CD1-CG2 4.42Å; F430-I839 HydrophobicContact CB-CB 4.42Å; F430-I839 HydrophobicContact CB-CD1 3.52Å; F430-I839 HydrophobicContact CB-CG1 3.73Å; F430-I839 HydrophobicContact CB-CG2 3.8Å; F430-I839 HydrophobicContact CD1-CG2 3.96Å; F430-I839 HydrophobicContact CD2-CG1 4.12Å; F430-I839 HydrophobicContact CD2-CG2 4.29Å; F430-I839 HydrophobicContact CG-CD1 4.43Å; F430-I839 HydrophobicContact CG-CG1 4.11Å; F430-I839 HydrophobicContact CG-CG2 3.76Å; L834-I839 HydrophobicContact CD2-CD1 3.54Å; I839-F841 PolarHBondContact O-N 3.21Å; I839-M844 HydrophobicContact CG2-CG 4.24Å
840	N	90.4	Very high	87.3	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	94.2	172.2	-177	-7.9	0	0	0	109.9	H832 T833 V835 L838 E842 K843 M844	H832-N840 WeakPolarHBondContact O-CB 3.41Å; H832-N840 PolarHBondContact O-ND2 3.43Å; T833-N840 WeakPolarHBondContact O-CB 3.47Å; T833-N840 PolarHBondContact O-N 3.2Å; V835-N840 HydrophobicContact CG2-CB 3.98Å; L838-N840 PolarHBondContact O-N 3.22Å; N840-E842 VanDerWaalsContact C-N 3.3Å; N840-E842 WeakPolarHBondContact OD1-CB 3.43Å; N840-E842 PolarHBondContact OD1-N 2.96Å; N840-E842 VanDerWaalsContact OD1-N 3.17Å; N840-K843 HydrophobicContact CB-CB 4.2Å; N840-K843 WeakPolarHBondContact O-CB 3.41Å; N840-K843 PolarHBondContact O-N 3.48Å; N840-K843 PolarHBondContact OD1-N 2.87Å; N840-K843 VanDerWaalsContact OD1-N 3.09Å; N840-M844 WeakPolarHBondContact O-CG 3.44Å; N840-M844 PolarHBondContact O-N 3.43Å
841	F	91.9	Very high	88.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-77.3	-17.8	-178.5	-157.2	-97.3	0	0	0	112.5	V390 M391 I398 F419 D422 F423 F430 I839 M844 R845	V390-F841 HydrophobicContact CB-CB 4.38Å; V390-F841 HydrophobicContact CB-CD1 3.92Å; V390-F841 HydrophobicContact CB-CG 4.32Å; V390-F841 HydrophobicContact CG1-CB 3.79Å; V390-F841 HydrophobicContact CG1-CD1 4.14Å; V390-F841 HydrophobicContact CG1-CG 4.02Å; M391-F841 PolarHBondContact O-N 3.13Å; I398-F841 HydrophobicContact CD1-CB 4.43Å; I398-F841 HydrophobicContact CD1-CD2 4Å; I398-F841 HydrophobicContact CD1-CG 4.5Å; I398-F841 HydrophobicContact CG2-CD2 3.95Å; I398-F841 HydrophobicContact CG2-CE2 3.84Å; I398-F841 HydrophobicContact CG2-CZ 4.45Å; F419-F841 AromaticContact CD2-CE1 3.53Å; F419-F841 HydrophobicContact CD2-CE1 3.53Å; F419-F841 AromaticContact CD2-CZ 3.75Å; F419-F841 HydrophobicContact CD2-CZ 3.75Å; F419-F841 HydrophobicContact CE2-CD1 4.18Å; F419-F841 AromaticContact CE2-CE1 3.38Å; F419-F841 HydrophobicContact CE2-CE1 3.38Å; F419-F841 HydrophobicContact CE2-CE2 4.31Å; F419-F841 AromaticContact CE2-CZ 3.46Å; F419-F841 HydrophobicContact CE2-CZ 3.46Å; F419-F841 VanDerWaalsContact CE2-CZ 3.46Å; D422-F841 HydrophobicContact CB-CE1 4.11Å; D422-F841 HydrophobicContact CB-CZ 3.93Å; F423-F841 HydrophobicContact CB-CZ 4.38Å; F423-F841 HydrophobicContact CD2-CE2 4.46Å; F430-F841 HydrophobicContact CE1-CE2 4.36Å; F430-F841 HydrophobicContact CZ-CE2 4.21Å; I839-F841 PolarHBondContact O-N 3.21Å; F841-M844 HydrophobicContact CD2-CB 4.01Å; F841-M844 HydrophobicContact CD2-CG 4.15Å; F841-M844 HydrophobicContact CE2-CB 4.21Å; F841-M844 HydrophobicContact CG-CB 4.4Å; F841-M844 PolarHBondContact O-N 3.38Å; F841-R845 WeakPolarHBondContact O-CB 3.33Å; F841-R845 PolarHBondContact O-N 3.13Å
842	E	86.5	Confident	88.6	Confident	35 Å²	35	52.1 Å²	52.1	16%	0.164	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-46.6	168.5	-170.9	176.5	-165.6	0	0	110.5	N253 M391 N840 M844 R845 M846	N253-E842 PolarHBondContact ND2-OE1 3.41Å; M391-E842 HydrophobicContact CE-CB 4.3Å; M391-E842 HydrophobicContact CE-CG 4.4Å; M391-E842 WeakPolarHBondContact CE-OE2 3.47Å; M391-E842 PolarHBondContact O-N 3.08Å; N840-E842 VanDerWaalsContact C-N 3.3Å; N840-E842 WeakPolarHBondContact OD1-CB 3.43Å; N840-E842 PolarHBondContact OD1-N 2.96Å; N840-E842 VanDerWaalsContact OD1-N 3.17Å; E842-M844 VanDerWaalsContact C-N 3.33Å; E842-M844 PolarHBondContact O-N 3.49Å; E842-R845 WeakPolarHBondContact O-CB 3.38Å; E842-R845 PolarHBondContact O-N 2.87Å; E842-M846 WeakPolarHBondContact O-CG 3.4Å; E842-M846 PolarHBondContact O-N 3.15Å
843	K	87.8	Confident	88.8	Confident	3 Å²	3	47.5 Å²	47.5	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-56.8	-46.6	172	179.3	-175.5	-174.2	168	0	111.5	H828 N831 T833 N840 R845 M846 M847	H828-K843 PolarHBondContact ND1-NZ 3.17Å; H828-K843 VanDerWaalsContact ND1-NZ 3.16Å; H828-K843 PolarHBondContact O-NZ 3.48Å; N831-K843 HydrophobicContact CB-CB 4.07Å; N831-K843 HydrophobicContact CB-CD 3.99Å; N831-K843 HydrophobicContact CB-CG 3.93Å; N831-K843 VanDerWaalsContact O-CD 3.28Å; N831-K843 WeakPolarHBondContact O-CD 3.35Å; N831-K843 WeakPolarHBondContact O-CE 3.43Å; N831-K843 PolarHBondContact O-NZ 2.82Å; T833-K843 PolarHBondContact OG1-NZ 3.13Å; N840-K843 HydrophobicContact CB-CB 4.2Å; N840-K843 WeakPolarHBondContact O-CB 3.41Å; N840-K843 PolarHBondContact O-N 3.48Å; N840-K843 PolarHBondContact OD1-N 2.87Å; N840-K843 VanDerWaalsContact OD1-N 3.09Å; K843-R845 VanDerWaalsContact C-N 3.33Å; K843-R845 PolarHBondContact O-N 3.26Å; K843-M846 WeakPolarHBondContact O-CB 3.43Å; K843-M846 PolarHBondContact O-N 3.4Å; K843-M847 HydrophobicContact CG-SD 4.47Å; K843-M847 WeakPolarHBondContact O-CG 3.44Å; K843-M847 PolarHBondContact O-N 3.16Å
844	M	93.8	Very high	88.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-45.3	178.8	-62.2	-50.4	118.2	0	0	111.4	T426 V429 F430 T833 I839 N840 F841 E842 M846 M847 A848	T426-M844 HydrophobicContact CG2-CB 4.1Å; T426-M844 WeakPolarHBondContact CG2-O 3.42Å; T426-M844 HydrophobicContact CG2-SD 4.36Å; V429-M844 HydrophobicContact CB-SD 4.12Å; V429-M844 HydrophobicContact CG1-CE 4.16Å; V429-M844 HydrophobicContact CG1-SD 4.1Å; V429-M844 HydrophobicContact CG2-SD 4.5Å; F430-M844 HydrophobicContact CD1-CG 4.14Å; F430-M844 HydrophobicContact CD1-SD 4.08Å; F430-M844 HydrophobicContact CE1-CG 4.14Å; F430-M844 HydrophobicContact CE1-SD 4.48Å; T833-M844 HydrophobicContact CG2-CE 3.93Å; I839-M844 HydrophobicContact CG2-CG 4.24Å; N840-M844 WeakPolarHBondContact O-CG 3.44Å; N840-M844 PolarHBondContact O-N 3.43Å; F841-M844 HydrophobicContact CD2-CB 4.01Å; F841-M844 HydrophobicContact CD2-CG 4.15Å; F841-M844 HydrophobicContact CE2-CB 4.21Å; F841-M844 HydrophobicContact CG-CB 4.4Å; F841-M844 PolarHBondContact O-N 3.38Å; E842-M844 VanDerWaalsContact C-N 3.33Å; E842-M844 PolarHBondContact O-N 3.49Å; M844-M846 VanDerWaalsContact C-N 3.35Å; M844-M846 PolarHBondContact O-N 3.23Å; M844-M847 PolarHBondContact O-N 3.47Å; M844-A848 WeakPolarHBondContact O-CB 3.38Å; M844-A848 PolarHBondContact O-N 3.22Å
845	R	90.7	Very high	88.6	Confident	66 Å²	66	44.5 Å²	44.5	25%	0.249	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-41.2	175.7	-177.4	-177.4	-55.8	136.2	10.9	112.4	V390 D422 F841 E842 K843 A848 R849	V390-R845 PolarHBondContact O-NH2 3.4Å; D422-R845 WeakPolarHBondContact OD2-CG 3.41Å; D422-R845 IonicContact OD2-NE 3.61Å; F841-R845 WeakPolarHBondContact O-CB 3.33Å; F841-R845 PolarHBondContact O-N 3.13Å; E842-R845 WeakPolarHBondContact O-CB 3.38Å; E842-R845 PolarHBondContact O-N 2.87Å; K843-R845 VanDerWaalsContact C-N 3.33Å; K843-R845 PolarHBondContact O-N 3.26Å; R845-A848 PolarHBondContact O-N 3.22Å; R845-R849 WeakPolarHBondContact O-CB 3.47Å; R845-R849 PolarHBondContact O-N 3.23Å
846	M	86.4	Confident	88.7	Confident	57 Å²	57	46.8 Å²	46.8	28%	0.281	21%	0.214	S	C	.	.	H	α-helix	trans	-61.8	-47.6	176.3	-67.8	170.7	76	0	0	111.4	I827 E842 K843 M844 R849 A850	I827-M846 HydrophobicContact CD1-CB 4.25Å; I827-M846 HydrophobicContact CG1-CB 4.41Å; I827-M846 HydrophobicContact CG1-CE 4.16Å; I827-M846 HydrophobicContact CG2-CB 3.69Å; I827-M846 HydrophobicContact CG2-CE 4.46Å; E842-M846 WeakPolarHBondContact O-CG 3.4Å; E842-M846 PolarHBondContact O-N 3.15Å; K843-M846 WeakPolarHBondContact O-CB 3.43Å; K843-M846 PolarHBondContact O-N 3.4Å; M844-M846 VanDerWaalsContact C-N 3.35Å; M844-M846 PolarHBondContact O-N 3.23Å; M846-R849 PolarHBondContact O-N 2.99Å; M846-A850 PolarHBondContact O-N 3.26Å
847	M	90.5	Very high	88.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-44.8	177	-66.5	-172.9	78.6	0	0	111.9	I689 A692 L693 M824 I827 K843 M844 R849 A850 A851	I689-M847 HydrophobicContact CB-CE 4.42Å; I689-M847 HydrophobicContact CG2-CE 3.9Å; A692-M847 HydrophobicContact CB-CE 4.16Å; L693-M847 HydrophobicContact CD2-CE 4.33Å; L693-M847 HydrophobicContact CG-CE 4.41Å; M824-M847 HydrophobicContact CE-CB 4.23Å; M824-M847 HydrophobicContact CE-CE 3.88Å; I827-M847 HydrophobicContact CG2-CG 3.61Å; K843-M847 HydrophobicContact CG-SD 4.47Å; K843-M847 WeakPolarHBondContact O-CG 3.44Å; K843-M847 PolarHBondContact O-N 3.16Å; M844-M847 PolarHBondContact O-N 3.47Å; M847-R849 VanDerWaalsContact C-N 3.34Å; M847-R849 PolarHBondContact O-N 2.99Å; M847-A850 PolarHBondContact O-N 3.06Å; M847-A851 PolarHBondContact O-N 3.05Å
848	A	91.3	Very high	88.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-39.2	177.8	0	0	0	0	0	112.4	D422 L425 T426 M844 R845 A851 R852	D422-A848 HydrophobicContact CB-CB 4.25Å; D422-A848 WeakPolarHBondContact OD1-CB 3.4Å; L425-A848 HydrophobicContact CB-CB 4.24Å; L425-A848 HydrophobicContact CD1-CB 4.09Å; T426-A848 HydrophobicContact CG2-CB 4.1Å; M844-A848 WeakPolarHBondContact O-CB 3.38Å; M844-A848 PolarHBondContact O-N 3.22Å; R845-A848 PolarHBondContact O-N 3.22Å; A848-A851 PolarHBondContact O-N 3.21Å; A848-R852 WeakPolarHBondContact O-CB 3.49Å; A848-R852 WeakPolarHBondContact O-CG 3.5Å; A848-R852 PolarHBondContact O-N 3.38Å
849	R	88.4	Confident	88.1	Confident	193 Å²	193	37.3 Å²	37.3	73%	0.728	17%	0.167	S	C	*	.	H	α-helix	trans	-60.9	-45	176	-177.9	-179.7	-179.7	-174.1	-0.9	111.7	R845 M846 M847 R852 M853	R845-R849 WeakPolarHBondContact O-CB 3.47Å; R845-R849 PolarHBondContact O-N 3.23Å; M846-R849 PolarHBondContact O-N 2.99Å; M847-R849 VanDerWaalsContact C-N 3.34Å; M847-R849 PolarHBondContact O-N 2.99Å; R849-R852 PolarHBondContact O-N 3.44Å; R849-M853 PolarHBondContact O-N 3.36Å
850	A	86.9	Confident	86.7	Confident	14 Å²	14	41.7 Å²	41.7	12%	0.116	19%	0.187	C	C	.	.	H	α-helix	trans	-67.1	-41.5	177.1	0	0	0	0	0	111.7	L820 M824 I827 M846 M847 R852 M853	L820-A850 HydrophobicContact CD1-CB 4.16Å; M824-A850 HydrophobicContact CG-CB 4.17Å; M824-A850 HydrophobicContact SD-CB 3.31Å; M824-A850 WeakPolarHBondContact SD-CB 3.42Å; I827-A850 HydrophobicContact CD1-CB 4.29Å; M846-A850 PolarHBondContact O-N 3.26Å; M847-A850 PolarHBondContact O-N 3.06Å; A850-R852 PolarHBondContact O-N 3.31Å; A850-M853 WeakPolarHBondContact O-CB 3.4Å; A850-M853 PolarHBondContact O-N 3.14Å; A850-M853 VanDerWaalsContact O-N 3.13Å
851	A	89.5	Confident	85	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-40.2	174.3	0	0	0	0	0	113	I689 M847 A848 M853 L854	I689-A851 HydrophobicContact CD1-CB 4.14Å; I689-A851 HydrophobicContact CG1-CB 4.28Å; M847-A851 PolarHBondContact O-N 3.05Å; A848-A851 PolarHBondContact O-N 3.21Å; A851-M853 PolarHBondContact O-N 3.28Å; A851-L854 WeakPolarHBondContact O-CB 3.29Å; A851-L854 PolarHBondContact O-N 3.23Å; A851-L854 VanDerWaalsContact O-N 3.07Å
852	R	88.4	Confident	83.1	Confident	60 Å²	60	49.6 Å²	49.6	23%	0.226	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-24.2	175.6	-81.5	-168.7	-67.4	-90.2	-2.2	113.6	S421 D422 L425 A848 R849 A850 L854 H855 H856	S421-R852 PolarHBondContact OG-NH1 3.44Å; D422-R852 IonicContact OD1-CZ 3.7Å; D422-R852 IonicContact OD1-NH1 3.31Å; D422-R852 PolarHBondContact OD1-NH1 3.02Å; D422-R852 IonicContact OD1-NH2 2.92Å; D422-R852 PolarHBondContact OD1-NH2 2.91Å; L425-R852 HydrophobicContact CD1-CG 3.81Å; A848-R852 WeakPolarHBondContact O-CB 3.49Å; A848-R852 WeakPolarHBondContact O-CG 3.5Å; A848-R852 PolarHBondContact O-N 3.38Å; R849-R852 PolarHBondContact O-N 3.44Å; A850-R852 PolarHBondContact O-N 3.31Å; R852-L854 PolarHBondContact O-N 3.39Å; R852-H855 PolarHBondContact O-N 3.03Å; R852-H855 VanDerWaalsContact O-N 3.09Å; R852-H856 PolarHBondContact O-N 3.24Å
853	M	86.4	Confident	81.3	Confident	52 Å²	52	53.8 Å²	53.8	26%	0.256	26%	0.261	S	S	.	.	H	α-helix	trans	-58.1	-37.6	173.8	-166.9	-178.1	75.2	0	0	110.8	L806 P815 L820 R849 A850 A851 H855 H856 C857	L806-M853 HydrophobicContact CD2-SD 4.36Å; P815-M853 HydrophobicContact CB-CE 4.37Å; L820-M853 HydrophobicContact CB-CE 3.87Å; L820-M853 HydrophobicContact CD1-CE 3.33Å; L820-M853 HydrophobicContact CD1-SD 4.39Å; L820-M853 HydrophobicContact CD2-CE 3.45Å; L820-M853 VanDerWaalsContact CD2-CE 3.45Å; L820-M853 HydrophobicContact CG-CE 3.69Å; R849-M853 PolarHBondContact O-N 3.36Å; A850-M853 WeakPolarHBondContact O-CB 3.4Å; A850-M853 PolarHBondContact O-N 3.14Å; A850-M853 VanDerWaalsContact O-N 3.13Å; A851-M853 PolarHBondContact O-N 3.28Å; M853-H855 VanDerWaalsContact C-N 3.33Å; M853-H855 PolarHBondContact O-N 3.03Å; M853-H856 PolarHBondContact O-N 3.17Å; M853-C857 WeakPolarHBondContact O-CB 3.24Å; M853-C857 PolarHBondContact O-N 3.15Å; M853-C857 PolarHBondContact O-SG 3.44Å
854	L	87.2	Confident	79.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.7	-43.9	174.7	-167.3	84.3	0	0	0	111.7	F680 I683 Q685 L688 M817 A851 R852 R858	F680-L854 HydrophobicContact CD2-CD1 4.19Å; F680-L854 HydrophobicContact CE2-CD1 3.25Å; F680-L854 HydrophobicContact CE2-CG 4.31Å; F680-L854 HydrophobicContact CZ-CD1 3.55Å; F680-L854 HydrophobicContact CZ-CG 4.23Å; I683-L854 HydrophobicContact CB-CD2 4.45Å; I683-L854 HydrophobicContact CG2-CD2 4.05Å; Q685-L854 HydrophobicContact CG-CD2 4.15Å; L688-L854 HydrophobicContact CD1-CD1 4.3Å; L688-L854 HydrophobicContact CD1-CD2 3.75Å; L688-L854 HydrophobicContact CD1-CG 4.48Å; M817-L854 HydrophobicContact CE-CD1 3.88Å; M817-L854 HydrophobicContact SD-CD1 3.98Å; A851-L854 WeakPolarHBondContact O-CB 3.29Å; A851-L854 PolarHBondContact O-N 3.23Å; A851-L854 VanDerWaalsContact O-N 3.07Å; R852-L854 PolarHBondContact O-N 3.39Å; L854-R858 WeakPolarHBondContact O-CG 3.44Å; L854-R858 PolarHBondContact O-NE 3.24Å
855	H	84.9	Confident	77.2	Confident	71 Å²	71	65.9 Å²	65.9	33%	0.329	33%	0.33	S	S	.	.	H	α-helix	trans	-68.5	-43.4	177.4	-175.4	78.4	0	0	0	112.2	Q685 R852 M853 C857 R858 S859	Q685-H855 HydrophobicContact CG-CB 4.38Å; R852-H855 PolarHBondContact O-N 3.03Å; R852-H855 VanDerWaalsContact O-N 3.09Å; M853-H855 VanDerWaalsContact C-N 3.33Å; M853-H855 PolarHBondContact O-N 3.03Å; H855-C857 VanDerWaalsContact C-N 3.3Å; H855-C857 PolarHBondContact O-N 3.33Å; H855-R858 CarbonylContact O-C 3.41Å; H855-R858 PolarHBondContact O-N 2.87Å; H855-S859 PolarHBondContact O-N 2.92Å
856	H	86.1	Confident	74.7	Confident	110 Å²	110	65 Å²	65	51%	0.509	33%	0.334	S	S	.	.	H	α-helix	trans	-58	-43.1	176.5	-178.5	65.5	0	0	0	112	P811 R852 M853 R858 S859	P811-H856 VanDerWaalsContact CB-O 3.25Å; P811-H856 WeakPolarHBondContact CB-O 3.48Å; P811-H856 WeakPolarHBondContact CG-O 3.46Å; R852-H856 PolarHBondContact O-N 3.24Å; M853-H856 PolarHBondContact O-N 3.17Å; H856-R858 PolarHBondContact O-N 3.26Å; H856-R858 VanDerWaalsContact O-N 3.1Å; H856-S859 PolarHBondContact O-N 3.01Å; H856-S859 PolarHBondContact O-OG 2.88Å; H856-S859 VanDerWaalsContact O-OG 3.11Å
857	C	87.5	Confident	72.3	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.02	36%	0.359	C	S	.	.	H	α-helix	trans	-58.7	-23	176.4	-73.8	0	0	0	0	114	F680 P812 V813 M853 H855	F680-C857 HydrophobicContact CE1-CB 4.36Å; F680-C857 HydrophobicContact CZ-CB 4.22Å; P812-C857 WeakPolarHBondContact CA-O 3.47Å; V813-C857 HydrophobicContact CG1-CB 4.01Å; V813-C857 PolarHBondContact N-O 2.78Å; V813-C857 VanDerWaalsContact O-CB 3.31Å; V813-C857 WeakPolarHBondContact O-CB 3.35Å; M853-C857 WeakPolarHBondContact O-CB 3.24Å; M853-C857 PolarHBondContact O-N 3.15Å; M853-C857 PolarHBondContact O-SG 3.44Å; H855-C857 VanDerWaalsContact C-N 3.3Å; H855-C857 PolarHBondContact O-N 3.33Å
858	R	85.6	Confident	69.9	Low	50 Å²	50	75.2 Å²	75.2	19%	0.189	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-0.8	-176.8	-59.4	179.6	-65.8	179	7.5	114	W677 F680 I683 L854 H855 H856 H860	W677-R858 HydrophobicContact CZ3-CG 4.08Å; F680-R858 HydrophobicContact CD1-CG 3.92Å; F680-R858 HydrophobicContact CE1-CG 3.38Å; F680-R858 HydrophobicContact CZ-CG 4.21Å; I683-R858 PolarHBondContact O-NH1 2.83Å; L854-R858 WeakPolarHBondContact O-CG 3.44Å; L854-R858 PolarHBondContact O-NE 3.24Å; H855-R858 CarbonylContact O-C 3.41Å; H855-R858 PolarHBondContact O-N 2.87Å; H856-R858 PolarHBondContact O-N 3.26Å; H856-R858 VanDerWaalsContact O-N 3.1Å; R858-H860 PolarHBondContact O-N 2.97Å
859	S	75.4	Confident	67.6	Low	37 Å²	37	79.6 Å²	79.6	26%	0.259	41%	0.413	S	S	.	.	S	Bend	trans	-69.9	-7.5	-165.3	69.5	0	0	0	0	115.8	H855 H856	H855-S859 PolarHBondContact O-N 2.92Å; H856-S859 PolarHBondContact O-N 3.01Å; H856-S859 PolarHBondContact O-OG 2.88Å; H856-S859 VanDerWaalsContact O-OG 3.11Å
860	H	64.2	Low	64.9	Low	108 Å²	108	74.4 Å²	74.4	50%	0.5	41%	0.405	S	S	.	.	S	Bend	trans	-123.2	140.3	175.8	-72.2	-59.3	0	0	0	110.1	P811 P812 R858	P811-H860 PolarHBondContact O-CD2 3.07Å; P812-H860 WeakPolarHBondContact CB-O 3.32Å; R858-H860 PolarHBondContact O-N 2.97Å
861	N	54.7	Low	62.3	Low	120 Å²	120	83.4 Å²	83.4	64%	0.642	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-61.2	133.3	177.3	-78.1	-32.5	0	0	0	110.6	V863	N861-V863 PolarHBondContact O-N 2.99Å; N861-V863 VanDerWaalsContact O-N 3.16Å
862	P	53.9	Low	59.7	Low	63 Å²	63	88 Å²	88	41%	0.409	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-61.3	119.4	169.3	24	-29.1	0	0	0	108.6	P812 P864	P812-P862 HydrophobicContact CG-CB 4.48Å; P862-P864 WeakPolarHBondContact O-CD 3.38Å
863	V	48.3	Very low	57	Low	123 Å²	123	89.9 Å²	89.9	75%	0.745	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-66.7	120.3	173.5	178.6	0	0	0	0	107.3	N861 L865	N861-V863 PolarHBondContact O-N 2.99Å; N861-V863 VanDerWaalsContact O-N 3.16Å; V863-L865 PolarHBondContact O-N 3.07Å
864	P	47.6	Very low	54.5	Low	108 Å²	108	95.3 Å²	95.3	70%	0.701	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-60.2	124	178.2	-20.2	30.9	0	0	0	109.9	P862 S866	P862-P864 WeakPolarHBondContact O-CD 3.38Å; P864-S866 PolarHBondContact O-N 2.78Å
865	L	47.6	Very low	51.9	Low	149 Å²	149	101.7 Å²	101.7	78%	0.78	54%	0.544	S	S	*	.	S	Bend	trans	-72.5	10.5	-175.9	-74.7	169.3	0	0	0	114.5	Q750 V863	Q750-L865 HydrophobicContact CG-CD1 4.22Å; V863-L865 PolarHBondContact O-N 3.07Å
866	S	38.9	Very low	49.8	Very low	47 Å²	47	106 Å²	106	33%	0.329	56%	0.564	S	S	.	*			trans	-164.6	146.2	163.7	64	0	0	0	0	113.3	P864 L868	P864-S866 PolarHBondContact O-N 2.78Å; S866-L868 PolarHBondContact O-N 3.26Å
867	P	34.7	Very low	47.1	Very low	122 Å²	122	109.5 Å²	109.5	79%	0.792	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-10.9	177.1	-15.8	29.3	0	0	0	114.9	S870	P867-S870 PolarHBondContact O-OG 2.91Å
868	L	39.7	Very low	44.2	Very low	150 Å²	150	116.8 Å²	116.8	79%	0.785	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-12.5	-173	-73.3	166.3	0	0	0	114	S866	S866-L868 PolarHBondContact O-N 3.26Å
869	R	43.4	Very low	41.6	Very low	92 Å²	92	119.4 Å²	119.4	35%	0.347	65%	0.646	S	S	.	*	G	3₁₀ helix	trans	-88.1	-11.1	-177.5	-78.7	-170.1	-179.3	-177.4	-1.3	115.2	D674 R871 V872	D674-R869 IonicContact OD2-CZ 3.94Å; D674-R869 IonicContact OD2-NH1 2.66Å; D674-R869 PolarHBondContact OD2-NH1 3.47Å; R869-R871 PolarHBondContact O-N 3.36Å; R869-R871 VanDerWaalsContact O-N 3.16Å; R869-V872 PolarHBondContact O-N 2.82Å
870	S	31.5	Very low	39.5	Very low	83 Å²	83	126.7 Å²	126.7	58%	0.58	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-65.6	-16.1	177.1	57.7	0	0	0	0	113.9	P867	P867-S870 PolarHBondContact O-OG 2.91Å
871	R	32.9	Very low	38	Very low	203 Å²	203	127.6 Å²	127.6	77%	0.766	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-85.4	-14.6	178.9	-69.8	-172.9	-174.6	-178.3	1.6	114.8	R869	R869-R871 PolarHBondContact O-N 3.36Å; R869-R871 VanDerWaalsContact O-N 3.16Å
872	V	35.4	Very low	36.6	Very low	98 Å²	98	126.5 Å²	126.5	59%	0.594	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-79.9	-27.9	-176.8	-176.5	0	0	0	0	111.7	R869 H874 L875	R869-V872 PolarHBondContact O-N 2.82Å; V872-H874 PolarHBondContact O-N 3.38Å; V872-H874 VanDerWaalsContact O-N 3.15Å; V872-L875 PolarHBondContact O-N 2.94Å
873	S	31.7	Very low	35.4	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-65.3	-15.7	176.2	-47.1	0	0	0	0	113.8
874	H	33	Very low	34.7	Very low	166 Å²	166	136.7 Å²	136.7	77%	0.769	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-97.1	-2.1	179.4	-76	-70.2	0	0	0	114.5	V872	V872-H874 PolarHBondContact O-N 3.38Å; V872-H874 VanDerWaalsContact O-N 3.15Å
875	L	32	Very low	33.8	Very low	134 Å²	134	136.5 Å²	136.5	70%	0.702	73%	0.725	S	S	*	*	S	Bend	trans	-96	-0.7	175.4	-74.3	166.2	0	0	0	113.1	V872	V872-L875 PolarHBondContact O-N 2.94Å
876	H	41.4	Very low	33.1	Very low	161 Å²	161	135.6 Å²	135.6	75%	0.745	73%	0.726	S	S	*	*	S	Bend	trans	-87.8	-0.5	-170.5	-151.6	-61.7	0	0	0	114.5
877	E	29.8	Very low	32.5	Very low	185 Å²	185	139 Å²	139	86%	0.864	75%	0.748	S	S	*	*	S	Bend	trans	-94.9	-17.8	176.3	-82	-175.6	148.7	0	0	114.6
878	D	27.2	Very low	32.1	Very low	156 Å²	156	138.2 Å²	138.2	83%	0.834	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-96.2	8.1	-172.6	-87.9	-19.5	0	0	0	115.7	Q880	D878-Q880 PolarHBondContact O-N 3.3Å
879	S	30.9	Very low	31.7	Very low	104 Å²	104	140 Å²	140	73%	0.727	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-86.5	4	179.3	-69.4	0	0	0	0	115.3
880	Q	30.5	Very low	31.1	Very low	190 Å²	190	144 Å²	144	89%	0.888	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-89.4	2.7	178	-87.6	-171	-10.7	0	0	115.6	D878	D878-Q880 PolarHBondContact O-N 3.3Å
881	V	32.2	Very low	31.1	Very low	128 Å²	128	145.9 Å²	145.9	78%	0.776	79%	0.786	S	S	*	*			trans	-139.5	76.5	173	-166.2	0	0	0	0	111.4
882	A	27	Very low	31	Very low	96 Å²	96	144.2 Å²	144.2	79%	0.793	79%	0.791	S	S	*	*			trans	-123.6	101.9	162.8	0	0	0	0	0	109.4
883	R	27.8	Very low	30.8	Very low	227 Å²	227	144.4 Å²	144.4	86%	0.857	80%	0.797	S	S	*	*			trans	-54.8	143.4	171.2	-70.7	174.9	179.7	151.2	0	110.2	S885	R883-S885 PolarHBondContact O-N 3.42Å
884	I	33.2	Very low	31.1	Very low	174 Å²	174	144.9 Å²	144.9	89%	0.892	80%	0.796	S	S	*	*			trans	-42.3	112.6	166.3	-59.8	164.5	0	0	0	108.8
885	S	28.7	Very low	31.9	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	80%	0.798	S	S	*	*			trans	-140.1	114.5	170.8	-171.9	0	0	0	0	108.7	R883 C887	R883-S885 PolarHBondContact O-N 3.42Å; S885-C887 PolarHBondContact O-N 2.98Å
886	T	33.7	Very low	33.1	Very low	130 Å²	130	143.1 Å²	143.1	80%	0.798	78%	0.781	S	S	*	*			trans	-70.2	104.7	177.8	45.4	0	0	0	0	110.1
887	C	24.8	Very low	34	Very low	118 Å²	118	139.5 Å²	139.5	80%	0.797	77%	0.772	S	S	*	*			trans	-146.6	125.4	162.6	-86.2	0	0	0	0	110.6	S885	S885-C887 PolarHBondContact O-N 2.98Å
888	S	26.3	Very low	35.5	Very low	106 Å²	106	134 Å²	134	74%	0.741	76%	0.757	S	S	*	*			trans	-16.2	130.1	178.3	56.2	0	0	0	0	120.4	Q890	S888-Q890 PolarHBondContact O-N 3.49Å
889	E	31.6	Very low	37.3	Very low	188 Å²	188	129.2 Å²	129.2	88%	0.879	74%	0.736	S	S	*	*	S	Bend	trans	-55.5	93	150	-65.6	-178.4	152.6	0	0	110.8
890	Q	31.2	Very low	38.8	Very low	175 Å²	175	125 Å²	125	82%	0.818	71%	0.707	S	S	*	*			trans	-176.2	137.9	152.4	-100.4	153.1	30.6	0	0	107.8	S888	S888-Q890 PolarHBondContact O-N 3.49Å
891	S	31	Very low	40.4	Very low	123 Å²	123	121.9 Å²	121.9	86%	0.86	69%	0.687	S	S	*	*			trans	76.8	66.9	178.1	78.6	0	0	0	0	118.1
892	L	31.2	Very low	42.1	Very low	168 Å²	168	117.9 Å²	117.9	88%	0.88	67%	0.667	S	S	*	*			trans	-97.9	120.8	145.3	-77.6	168.7	0	0	0	108.5	T894	L892-T894 PolarHBondContact O-N 2.96Å
893	S	31.4	Very low	44.4	Very low	102 Å²	102	116.5 Å²	116.5	71%	0.713	64%	0.642	S	S	*	*			trans	-51.2	119.6	173.6	165.2	0	0	0	0	111.2	R895	S893-R895 PolarHBondContact O-N 2.96Å
894	T	38.3	Very low	46.6	Very low	109 Å²	109	105.9 Å²	105.9	67%	0.669	60%	0.602	S	S	*	*	S	Bend	trans	-72.4	19.2	-171.5	38.1	0	0	0	0	115.5	L892	L892-T894 PolarHBondContact O-N 2.96Å
895	R	49.9	Very low	48.4	Very low	215 Å²	215	101 Å²	101	81%	0.811	58%	0.576	S	S	*	*			trans	-133.9	45.5	177	-81.3	-171.5	175.6	173.8	1.5	112.9	S893	S893-R895 PolarHBondContact O-N 2.96Å
896	S	57.1	Low	50.6	Low	47 Å²	47	103.6 Å²	103.6	33%	0.329	58%	0.576	S	S	.	*			trans	-92.9	131.3	171.4	81.5	0	0	0	0	110.5	A898 S899 T900	S896-A898 PolarHBondContact O-N 3.23Å; S896-S899 PolarHBondContact O-N 2.95Å; S896-S899 PolarHBondContact O-OG 3.16Å; S896-S899 PolarHBondContact OG-N 3.4Å; S896-S899 VanDerWaalsContact OG-N 3.07Å; S896-S899 PolarHBondContact OG-OG 2.66Å; S896-T900 PolarHBondContact O-N 2.93Å
897	P	60.3	Low	53.1	Low	86 Å²	86	98.2 Å²	98.2	56%	0.558	54%	0.542	S	S	*	.	H	α-helix	trans	-53.3	-24.6	169.7	-28	35.4	0	0	0	113.5	W901	P897-W901 VanDerWaalsContact O-CB 3.27Å; P897-W901 WeakPolarHBondContact O-CB 3.27Å; P897-W901 PolarHBondContact O-N 3.45Å
898	A	60.9	Low	56.1	Low	68 Å²	68	100.3 Å²	100.3	56%	0.562	54%	0.538	S	S	*	.	H	α-helix	trans	-67.4	-39.3	174.9	0	0	0	0	0	112.9	S896 W901 A902	S896-A898 PolarHBondContact O-N 3.23Å; A898-W901 PolarHBondContact O-N 3.49Å; A898-A902 WeakPolarHBondContact O-CB 3.43Å; A898-A902 PolarHBondContact O-N 2.66Å
899	S	64.6	Low	59.3	Low	56 Å²	56	95.5 Å²	95.5	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-42.3	176.5	63.8	0	0	0	0	112.3	S896 W901 A902 Y903	S896-S899 PolarHBondContact O-N 2.95Å; S896-S899 PolarHBondContact O-OG 3.16Å; S896-S899 PolarHBondContact OG-N 3.4Å; S896-S899 VanDerWaalsContact OG-N 3.07Å; S896-S899 PolarHBondContact OG-OG 2.66Å; S899-W901 VanDerWaalsContact C-N 3.34Å; S899-A902 PolarHBondContact O-N 3.06Å; S899-Y903 PolarHBondContact O-N 3.42Å
900	T	62.7	Low	62.4	Low	17 Å²	17	86.8 Å²	86.8	10%	0.104	46%	0.463	C	S	.	.	H	α-helix	trans	-64.2	-39.9	173.6	-50.7	0	0	0	0	111.6	V663 Q671 S896 Y903 V904	V663-T900 HydrophobicContact CG1-CG2 3.57Å; V663-T900 HydrophobicContact CG2-CG2 4.15Å; Q671-T900 HydrophobicContact CG-CG2 4.1Å; S896-T900 PolarHBondContact O-N 2.93Å; T900-Y903 PolarHBondContact O-N 3.06Å; T900-V904 VanDerWaalsContact O-CG2 3.27Å; T900-V904 WeakPolarHBondContact O-CG2 3.5Å; T900-V904 PolarHBondContact O-N 3.04Å
901	W	65.3	Low	65.3	Low	124 Å²	124	79.6 Å²	79.6	47%	0.47	43%	0.43	S	S	.	.	H	α-helix	trans	-64.1	-45.7	176.9	-177.3	92.3	0	0	0	111.9	P897 A898 S899 Y903 V904 Q905	P897-W901 VanDerWaalsContact O-CB 3.27Å; P897-W901 WeakPolarHBondContact O-CB 3.27Å; P897-W901 PolarHBondContact O-N 3.45Å; A898-W901 PolarHBondContact O-N 3.49Å; S899-W901 VanDerWaalsContact C-N 3.34Å; W901-Y903 VanDerWaalsContact C-N 3.33Å; W901-Y903 PolarHBondContact O-N 3.26Å; W901-V904 PolarHBondContact O-N 3.43Å; W901-Q905 HydrophobicContact CD2-CG 4.44Å; W901-Q905 VanDerWaalsContact CH2-CD 3.49Å; W901-Q905 WeakPolarHBondContact O-CG 3.49Å; W901-Q905 PolarHBondContact O-N 3.27Å
902	A	66.4	Low	68.3	Low	44 Å²	44	75.2 Å²	75.2	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-60.6	-41.7	176.7	0	0	0	0	0	112	A898 S899 Q905 Q906	A898-A902 WeakPolarHBondContact O-CB 3.43Å; A898-A902 PolarHBondContact O-N 2.66Å; S899-A902 PolarHBondContact O-N 3.06Å; A902-Q905 PolarHBondContact O-N 3.1Å; A902-Q906 PolarHBondContact O-N 3.37Å
903	Y	76.6	Confident	71.2	Confident	67 Å²	67	68.1 Å²	68.1	26%	0.263	36%	0.36	S	S	.	.	H	α-helix	trans	-60.9	-47.7	174.9	174.9	-92	0	0	0	112.4	S656 L660 W719 S899 T900 W901 Q905 Q906 L907	S656-Y903 WeakPolarHBondContact OG-CE2 3.44Å; S656-Y903 PolarHBondContact OG-OH 2.89Å; L660-Y903 HydrophobicContact CD2-CD1 4.47Å; L660-Y903 HydrophobicContact CD2-CE1 3.56Å; L660-Y903 WeakPolarHBondContact CD2-OH 3.29Å; L660-Y903 HydrophobicContact CG-CE1 4.46Å; W719-Y903 HydrophobicContact CZ2-CE1 4.27Å; W719-Y903 PolarHBondContact NE1-OH 2.72Å; W719-Y903 VanDerWaalsContact NE1-OH 3.07Å; S899-Y903 PolarHBondContact O-N 3.42Å; T900-Y903 PolarHBondContact O-N 3.06Å; W901-Y903 VanDerWaalsContact C-N 3.33Å; W901-Y903 PolarHBondContact O-N 3.26Å; Y903-Q905 PolarHBondContact O-N 2.92Å; Y903-Q906 PolarHBondContact O-N 3.26Å; Y903-L907 HydrophobicContact CD1-CD2 4.27Å; Y903-L907 HydrophobicContact CE1-CD2 3.77Å
904	V	73.9	Confident	74.2	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.018	35%	0.349	C	S	.	.	H	α-helix	trans	-65	-24.1	-177.3	168.7	0	0	0	0	113.3	L668 Q671 L672 R712 T900 W901	L668-V904 HydrophobicContact CD1-CG2 3.58Å; Q671-V904 HydrophobicContact CB-CG2 4.21Å; L672-V904 HydrophobicContact CD2-CG1 3.66Å; L672-V904 HydrophobicContact CG-CG1 4.41Å; R712-V904 PolarHBondContact NH1-O 3.15Å; R712-V904 VanDerWaalsContact NH1-O 3.13Å; R712-V904 PolarHBondContact NH2-O 2.82Å; T900-V904 VanDerWaalsContact O-CG2 3.27Å; T900-V904 WeakPolarHBondContact O-CG2 3.5Å; T900-V904 PolarHBondContact O-N 3.04Å; W901-V904 PolarHBondContact O-N 3.43Å
905	Q	70.3	Confident	76.9	Confident	73 Å²	73	67 Å²	67	34%	0.341	33%	0.33	S	S	.	.	H	α-helix	trans	-84.5	-16.6	178.6	-73.4	-165.9	-16.2	0	0	114.7	W901 A902 Y903	W901-Q905 HydrophobicContact CD2-CG 4.44Å; W901-Q905 VanDerWaalsContact CH2-CD 3.49Å; W901-Q905 WeakPolarHBondContact O-CG 3.49Å; W901-Q905 PolarHBondContact O-N 3.27Å; A902-Q905 PolarHBondContact O-N 3.1Å; Y903-Q905 PolarHBondContact O-N 2.92Å
906	Q	75.6	Confident	79.1	Confident	156 Å²	156	56.8 Å²	56.8	73%	0.729	29%	0.292	S	S	*	.	S	Bend	trans	-129.4	51.5	-173.1	-62.7	-176.2	-3.3	0	0	110.5	A902 Y903 K908	A902-Q906 PolarHBondContact O-N 3.37Å; Y903-Q906 PolarHBondContact O-N 3.26Å; Q906-K908 PolarHBondContact O-N 3.2Å
907	L	86.1	Confident	80.9	Confident	17 Å²	17	55.3 Å²	55.3	9%	0.089	28%	0.281	C	S	.	.			trans	-68.4	124.5	176.8	-61.2	179.8	0	0	0	109.3	E715 L716 W719 Y903 V909	E715-L907 HydrophobicContact CG-CB 4.04Å; E715-L907 HydrophobicContact CG-CD1 4.3Å; L716-L907 HydrophobicContact CD2-CD1 3.67Å; W719-L907 HydrophobicContact CB-CD1 4.29Å; W719-L907 HydrophobicContact CD2-CD1 4.15Å; W719-L907 HydrophobicContact CD2-CD2 4.43Å; W719-L907 HydrophobicContact CE3-CD1 4.5Å; W719-L907 HydrophobicContact CG-CD1 4.05Å; W719-L907 HydrophobicContact CG-CD2 4.31Å; Y903-L907 HydrophobicContact CD1-CD2 4.27Å; Y903-L907 HydrophobicContact CE1-CD2 3.77Å; L907-V909 HydrophobicContact CB-CG1 4.41Å
908	K	87.9	Confident	82.6	Confident	162 Å²	162	56.1 Å²	56.1	70%	0.704	27%	0.273	S	S	*	.			trans	-100.2	130.9	168.7	-66	-170.7	177.6	-172.1	0	108.4	P652 Q906	P652-K908 HydrophobicContact CB-CB 4.49Å; P652-K908 HydrophobicContact CG-CB 4.22Å; Q906-K908 PolarHBondContact O-N 3.2Å
909	V	94	Very high	84.4	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.03	25%	0.252	C	S	.	.			trans	-135.7	151	-171.8	-54.4	0	0	0	0	111.3	L628 N629 E715 W719 L907	L628-V909 HydrophobicContact CD1-CG2 4.03Å; N629-V909 PolarHBondContact ND2-O 2.88Å; E715-V909 HydrophobicContact CG-CG1 4.32Å; W719-V909 HydrophobicContact CB-CG1 3.64Å; L907-V909 HydrophobicContact CB-CG1 4.41Å
910	I	95.3	Very high	85.9	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	23%	0.233	C	C	.	.			trans	-92.2	112.5	165.4	-56.2	172.2	0	0	0	106.6	P652 Y718 T722 L726 N912 E915 L916 L919	P652-I910 HydrophobicContact CG-CG1 4.41Å; Y718-I910 WeakPolarHBondContact CD1-O 3.45Å; T722-I910 HydrophobicContact CG2-CB 4.35Å; T722-I910 HydrophobicContact CG2-CD1 4.12Å; T722-I910 HydrophobicContact CG2-CG1 3.9Å; T722-I910 PolarHBondContact OG1-N 3.21Å; T722-I910 PolarHBondContact OG1-O 2.91Å; L726-I910 HydrophobicContact CD1-CD1 4.29Å; L726-I910 HydrophobicContact CD2-CD1 4.32Å; L726-I910 HydrophobicContact CG-CD1 4.41Å; I910-N912 HydrophobicContact CG2-CB 4.38Å; I910-E915 HydrophobicContact CG2-CB 4.16Å; I910-E915 HydrophobicContact CG2-CG 4.02Å; I910-L916 HydrophobicContact CB-CD2 3.93Å; I910-L916 HydrophobicContact CB-CG 4.39Å; I910-L916 HydrophobicContact CD1-CD2 4.49Å; I910-L916 HydrophobicContact CG2-CD2 4.04Å; I910-L916 HydrophobicContact CG2-CG 4.04Å; I910-L919 HydrophobicContact CD1-CD1 3.84Å
911	D	93.1	Very high	87.5	Confident	24 Å²	24	57.3 Å²	57.3	13%	0.128	25%	0.254	C	S	.	.			trans	-96.6	-8.3	175.8	66.2	-18	0	0	0	112.9	S608 L628 N629 Y718 Q913	S608-D911 WeakPolarHBondContact CB-OD1 3.46Å; S608-D911 PolarHBondContact OG-OD1 3.45Å; L628-D911 HydrophobicContact CB-CB 4.18Å; L628-D911 HydrophobicContact CD1-CB 3.99Å; N629-D911 WeakPolarHBondContact CB-OD1 3.49Å; N629-D911 WeakPolarHBondContact CB-OD2 3.32Å; N629-D911 PolarHBondContact N-OD2 3.25Å; N629-D911 VanDerWaalsContact ND2-CG 3.28Å; N629-D911 PolarHBondContact ND2-OD1 3.46Å; Y718-D911 HydrophobicContact CD1-CB 4.44Å; Y718-D911 HydrophobicContact CD2-CB 4.21Å; Y718-D911 HydrophobicContact CE2-CB 4.35Å; Y718-D911 HydrophobicContact CG-CB 4.24Å; D911-Q913 PolarHBondContact O-N 2.69Å; D911-Q913 VanDerWaalsContact O-N 3.16Å
912	N	94.1	Very high	89	Confident	31 Å²	31	57.1 Å²	57.1	17%	0.166	26%	0.259	C	S	.	.			trans	-74.1	103.2	174.2	-174.1	-23.4	0	0	0	111	S608 I910 R914 E915 L916	S608-N912 PolarHBondContact O-ND2 3.47Å; I910-N912 HydrophobicContact CG2-CB 4.38Å; N912-R914 VanDerWaalsContact C-N 3.26Å; N912-R914 PolarHBondContact O-N 3.01Å; N912-R914 WeakPolarHBondContact OD1-CB 3.37Å; N912-R914 PolarHBondContact OD1-N 3.19Å; N912-E915 HydrophobicContact CB-CB 4Å; N912-E915 WeakPolarHBondContact O-CB 3.33Å; N912-E915 PolarHBondContact O-N 3.07Å; N912-E915 VanDerWaalsContact O-N 3.11Å; N912-E915 PolarHBondContact OD1-N 3.2Å; N912-L916 PolarHBondContact O-N 3Å
913	Q	92.4	Very high	90.3	Very high	20 Å²	20	57 Å²	57	9%	0.093	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-29	-179	-174.2	60.1	46.3	0	0	113.6	N765 S766 D911 E915 S917	N765-Q913 PolarHBondContact ND2-OE1 2.74Å; N765-Q913 PolarHBondContact OD1-NE2 3.48Å; N765-Q913 PolarHBondContact OD1-OE1 3.42Å; S766-Q913 PolarHBondContact OG-NE2 2.8Å; D911-Q913 PolarHBondContact O-N 2.69Å; D911-Q913 VanDerWaalsContact O-N 3.16Å; Q913-E915 VanDerWaalsContact C-N 3.33Å; Q913-S917 PolarHBondContact NE2-OG 2.99Å; Q913-S917 WeakPolarHBondContact O-CB 3.42Å; Q913-S917 PolarHBondContact O-N 2.57Å; Q913-S917 PolarHBondContact O-OG 3.07Å
914	R	93.5	Very high	91.1	Very high	130 Å²	130	54.5 Å²	54.5	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-66.7	-41.4	176.2	-60.6	-173.4	-166.5	166.6	12.5	110.2	N912 S917 R918	N912-R914 VanDerWaalsContact C-N 3.26Å; N912-R914 PolarHBondContact O-N 3.01Å; N912-R914 WeakPolarHBondContact OD1-CB 3.37Å; N912-R914 PolarHBondContact OD1-N 3.19Å; R914-S917 PolarHBondContact O-N 3Å; R914-R918 PolarHBondContact O-N 3.2Å
915	E	95.1	Very high	91.8	Very high	58 Å²	58	61.8 Å²	61.8	27%	0.271	29%	0.29	S	S	.	.	H	α-helix	trans	-66.9	-46.7	178.1	-178.9	59.1	-171.7	0	0	111.9	I910 N912 Q913 S917 R918 L919	I910-E915 HydrophobicContact CG2-CB 4.16Å; I910-E915 HydrophobicContact CG2-CG 4.02Å; N912-E915 HydrophobicContact CB-CB 4Å; N912-E915 WeakPolarHBondContact O-CB 3.33Å; N912-E915 PolarHBondContact O-N 3.07Å; N912-E915 VanDerWaalsContact O-N 3.11Å; N912-E915 PolarHBondContact OD1-N 3.2Å; Q913-E915 VanDerWaalsContact C-N 3.33Å; E915-S917 PolarHBondContact O-N 2.99Å; E915-R918 WeakPolarHBondContact O-CB 3.29Å; E915-R918 PolarHBondContact O-N 3.49Å; E915-R918 IonicContact OE1-CZ 3.8Å; E915-R918 IonicContact OE1-NE 3.26Å; E915-R918 PolarHBondContact OE1-NE 3.34Å; E915-R918 IonicContact OE1-NH2 3.65Å; E915-R918 PolarHBondContact OE1-NH2 3.36Å; E915-R918 IonicContact OE2-CZ 3.83Å; E915-R918 IonicContact OE2-NE 3.71Å; E915-R918 PolarHBondContact OE2-NE 3.37Å; E915-R918 IonicContact OE2-NH2 3.82Å; E915-L919 HydrophobicContact CG-CD1 4.39Å; E915-L919 WeakPolarHBondContact O-CG 3.27Å; E915-L919 PolarHBondContact O-N 2.6Å
916	L	95.4	Very high	92.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.9	-39.3	173.5	-68.1	173.7	0	0	0	112.3	Y718 A721 C725 A767 I910 N912 S920	Y718-L916 HydrophobicContact CD1-CD1 3.82Å; Y718-L916 HydrophobicContact CE1-CD1 4.11Å; A721-L916 HydrophobicContact CB-CD1 4.03Å; A721-L916 HydrophobicContact CB-CD2 4.44Å; C725-L916 HydrophobicContact CB-CD2 4.28Å; C725-L916 PolarHBondContact SG-O 3.48Å; A767-L916 HydrophobicContact CB-CB 4.11Å; I910-L916 HydrophobicContact CB-CD2 3.93Å; I910-L916 HydrophobicContact CB-CG 4.39Å; I910-L916 HydrophobicContact CD1-CD2 4.49Å; I910-L916 HydrophobicContact CG2-CD2 4.04Å; I910-L916 HydrophobicContact CG2-CG 4.04Å; N912-L916 PolarHBondContact O-N 3Å; L916-S920 VanDerWaalsContact O-CB 3.28Å; L916-S920 WeakPolarHBondContact O-CB 3.41Å; L916-S920 PolarHBondContact O-N 3.23Å
917	S	95.6	Very high	93.8	Very high	16 Å²	16	56.3 Å²	56.3	11%	0.112	26%	0.264	C	S	.	.	H	α-helix	trans	-70.6	-34.7	178	-55.2	0	0	0	0	112.2	Q913 R914 E915 R921	Q913-S917 PolarHBondContact NE2-OG 2.99Å; Q913-S917 WeakPolarHBondContact O-CB 3.42Å; Q913-S917 PolarHBondContact O-N 2.57Å; Q913-S917 PolarHBondContact O-OG 3.07Å; R914-S917 PolarHBondContact O-N 3Å; E915-S917 PolarHBondContact O-N 2.99Å; S917-R921 VanDerWaalsContact O-CG 3.3Å; S917-R921 WeakPolarHBondContact O-CG 3.43Å; S917-R921 PolarHBondContact O-N 3.49Å
918	R	96.9	Very high	94.2	Very high	102 Å²	102	58.4 Å²	58.4	39%	0.385	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-54.2	173.3	-174.8	-170	70.1	79.7	1.1	110.2	R914 E915 S920 R921 E922	R914-R918 PolarHBondContact O-N 3.2Å; E915-R918 WeakPolarHBondContact O-CB 3.29Å; E915-R918 PolarHBondContact O-N 3.49Å; E915-R918 IonicContact OE1-CZ 3.8Å; E915-R918 IonicContact OE1-NE 3.26Å; E915-R918 PolarHBondContact OE1-NE 3.34Å; E915-R918 IonicContact OE1-NH2 3.65Å; E915-R918 PolarHBondContact OE1-NH2 3.36Å; E915-R918 IonicContact OE2-CZ 3.83Å; E915-R918 IonicContact OE2-NE 3.71Å; E915-R918 PolarHBondContact OE2-NE 3.37Å; E915-R918 IonicContact OE2-NH2 3.82Å; R918-S920 VanDerWaalsContact C-N 3.31Å; R918-S920 PolarHBondContact O-N 3.41Å; R918-R921 PolarHBondContact O-N 2.68Å; R918-R921 VanDerWaalsContact O-N 3.12Å; R918-E922 IonicContact CZ-OE1 3.78Å; R918-E922 IonicContact CZ-OE2 2.74Å; R918-E922 IonicContact NH1-OE1 2.84Å; R918-E922 PolarHBondContact NH1-OE1 3.25Å; R918-E922 IonicContact NH1-OE2 3.42Å; R918-E922 PolarHBondContact NH1-OE2 3.15Å; R918-E922 PolarHBondContact O-N 3.3Å
919	L	96.9	Very high	94.6	Very high	22 Å²	22	52.4 Å²	52.4	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-55.4	-45.9	177.5	-68.1	172.7	0	0	0	111.5	C725 L726 I910 E915 R921 E922 L923	C725-L919 HydrophobicContact CB-CB 3.97Å; C725-L919 HydrophobicContact CB-CD1 4.22Å; L726-L919 HydrophobicContact CD2-CD1 3.99Å; I910-L919 HydrophobicContact CD1-CD1 3.84Å; E915-L919 HydrophobicContact CG-CD1 4.39Å; E915-L919 WeakPolarHBondContact O-CG 3.27Å; E915-L919 PolarHBondContact O-N 2.6Å; L919-R921 VanDerWaalsContact C-N 3.34Å; L919-R921 PolarHBondContact O-N 3.05Å; L919-E922 WeakPolarHBondContact O-CB 3.49Å; L919-E922 PolarHBondContact O-N 3.16Å; L919-E922 VanDerWaalsContact O-N 3.1Å; L919-L923 WeakPolarHBondContact O-CG 3.04Å; L919-L923 PolarHBondContact O-N 3.07Å
920	S	97.1	Very high	94.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-41.7	177.3	173	0	0	0	0	113.6	A767 R770 L916 R918 E922 L923 E924	A767-S920 WeakPolarHBondContact O-CB 3.24Å; A767-S920 PolarHBondContact O-OG 3.41Å; R770-S920 VanDerWaalsContact CD-OG 3.29Å; R770-S920 WeakPolarHBondContact CD-OG 3.34Å; R770-S920 WeakPolarHBondContact CG-OG 3.48Å; L916-S920 VanDerWaalsContact O-CB 3.28Å; L916-S920 WeakPolarHBondContact O-CB 3.41Å; L916-S920 PolarHBondContact O-N 3.23Å; R918-S920 VanDerWaalsContact C-N 3.31Å; R918-S920 PolarHBondContact O-N 3.41Å; S920-E922 VanDerWaalsContact C-N 3.32Å; S920-L923 PolarHBondContact O-N 2.96Å; S920-E924 PolarHBondContact O-N 3.24Å
921	R	96.2	Very high	94.5	Very high	144 Å²	144	58.7 Å²	58.7	54%	0.543	28%	0.278	S	S	.	.	H	α-helix	trans	-69.5	-30.1	176.1	-70.5	168.5	-177.6	175.4	-2.5	112.5	S917 R918 L919 L923 E924 P925	S917-R921 VanDerWaalsContact O-CG 3.3Å; S917-R921 WeakPolarHBondContact O-CG 3.43Å; S917-R921 PolarHBondContact O-N 3.49Å; R918-R921 PolarHBondContact O-N 2.68Å; R918-R921 VanDerWaalsContact O-N 3.12Å; L919-R921 VanDerWaalsContact C-N 3.34Å; L919-R921 PolarHBondContact O-N 3.05Å; R921-L923 VanDerWaalsContact C-N 3.34Å; R921-E924 CarbonylContact O-C 3.6Å; R921-P925 WeakPolarHBondContact O-CA 3.42Å; R921-P925 VanDerWaalsContact O-N 3.15Å
922	E	95.8	Very high	94.6	Very high	121 Å²	121	61.1 Å²	61.1	57%	0.565	29%	0.289	S	S	*	.	H	α-helix	trans	-72.1	-31.7	174.5	-72.7	171	-173.5	0	0	112	R918 L919 S920	R918-E922 IonicContact CZ-OE1 3.78Å; R918-E922 IonicContact CZ-OE2 2.74Å; R918-E922 IonicContact NH1-OE1 2.84Å; R918-E922 PolarHBondContact NH1-OE1 3.25Å; R918-E922 IonicContact NH1-OE2 3.42Å; R918-E922 PolarHBondContact NH1-OE2 3.15Å; R918-E922 PolarHBondContact O-N 3.3Å; L919-E922 WeakPolarHBondContact O-CB 3.49Å; L919-E922 PolarHBondContact O-N 3.16Å; L919-E922 VanDerWaalsContact O-N 3.1Å; S920-E922 VanDerWaalsContact C-N 3.32Å
923	L	95.3	Very high	94.7	Very high	40 Å²	40	63.5 Å²	63.5	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-71.6	-44.8	174	-65.6	-177.8	0	0	0	112.7	C725 P728 L771 L919 S920 R921	C725-L923 WeakPolarHBondContact O-CD1 3.27Å; P728-L923 HydrophobicContact CB-CD2 4.48Å; L771-L923 HydrophobicContact CD2-CB 4.37Å; L919-L923 WeakPolarHBondContact O-CG 3.04Å; L919-L923 PolarHBondContact O-N 3.07Å; S920-L923 PolarHBondContact O-N 2.96Å; R921-L923 VanDerWaalsContact C-N 3.34Å
924	E	93.5	Very high	94.9	Very high	15 Å²	15	67.1 Å²	67.1	7%	0.07	32%	0.315	C	S	.	.			trans	-141.6	91.9	-177.9	-65.3	-176.3	-152.6	0	0	109.5	R733 R770 L771 A772 H773 T774 S920 R921	R733-E924 IonicContact CZ-OE1 3.79Å; R733-E924 IonicContact NE-OE1 3.89Å; R733-E924 IonicContact NH2-OE1 2.87Å; R733-E924 PolarHBondContact NH2-OE1 3.02Å; R770-E924 PolarHBondContact NH1-O 3.42Å; L771-E924 WeakPolarHBondContact CA-OE2 3.39Å; L771-E924 HydrophobicContact CD2-CB 3.96Å; L771-E924 HydrophobicContact CD2-CG 4Å; A772-E924 PolarHBondContact N-OE2 2.84Å; A772-E924 VanDerWaalsContact N-OE2 3.12Å; H773-E924 WeakPolarHBondContact CB-OE2 3.45Å; H773-E924 IonicContact CD2-OE2 3.69Å; H773-E924 IonicContact CG-OE2 2.76Å; H773-E924 PolarHBondContact N-OE2 3.22Å; T774-E924 PolarHBondContact N-OE1 2.95Å; T774-E924 PolarHBondContact OG1-OE1 3.31Å; S920-E924 PolarHBondContact O-N 3.24Å; R921-E924 CarbonylContact O-C 3.6Å
925	P	87.3	Confident	95	Very high	157 Å²	157	61.4 Å²	61.4	100%	1.019	30%	0.299	S	S	*	.			trans	-61.7	0	-174.1	19.5	-29.4	0	0	0	114.2	R921	R921-P925 WeakPolarHBondContact O-CA 3.42Å; R921-P925 VanDerWaalsContact O-N 3.15Å

Retrieved 925 of 925 residues in 227.4 ms (Link to these results)

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