A0A096M8A3_POEFO Loading...

Solute carrier family 12 member 3

AlphaFold DB , UniProt , Accession A0A096M8A3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 984 aa.

						>A0A096M8A3_POEFO|A0A096M8A3
YQCYGDGNSMTSRPSIALSAYETLDAPPQYDFYANSQAWGRKRRFRPSLHQLHVMLNEDDSRPPMYEEREGDTSEDEDEEKEPPPEPTRFGWVQGVMIRCMLNIWGVILYLRLPWITAQAGIGMTWVIILLSSTITGITGLSTSAIATNGKVKGGGTYFLISRSLGPELGGSIGLIFAFANAVAVAMHTVGFAETVTDLMREHGAVMVDRTNDIRIIGIITVTCLLGISMAGMAWESKAQILFFLVIMVSFASYIVGTIMPASVEKQAKGFFSYKADIFAANFVPDWRGPEGSFFGMFSIFFPSATGILAGANISGDLKNPTVAIPRGTLMAIFWTTFSYLIISATVGSCVVRDASGSLNDTLSPSTPMDACVGLSCQYGWDFTECINNKTCTYGISNYYQSLSMVSAFGPLITAGIFGATLSSALACLVSAPKVFQCLCKDHLYPLIGFFGKGYGKNHEPLRAYLLTYIIAACFIIIAELNAIAPIISNFYLCSYALINFSCFHASITNSPGWRPSFRFYSKWLSLLCAVICVVIMFLLTWWAALIAIGVVFFLLGYTLYKKPDVNWGSSLQASSYNMALNHCVGLNVVEDHVKNYRPQCLVLTGPPSSRPALLDLVNCFTKDLSLMMCGNVVTADSSPSAVEKASSNSHVSWLNQRKIKSFYRGVVAPDLRCGVNMLLQGAGLGRIKPNVLMMGFKKDWRSEPSIAHNYIEILHDAFDLQYGVCVLRMKEGLDVSSPPQSHVNRGFDEGQDSINTISPGSLIRTSTTSSVSVDLEPQHTTVFQKKQGKKTIDIYWLSDDGGLTLLLPYLLTRRKRWARCKVRIFVGAETDKKDEQKEEVLSLIKKFRLGFQDVEVIPDIYQNPQPVNVHHFENMIGRFRVDSNPKQDSDSDPPRQQEKPWMITNQDLERNMAKSLRQIRLNEVLLDYSRDAALIVITMPVGRRGSCPSSLYLAWLDILSRDLRAPVLMVRGNQESVLTFYCQ
					

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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	Y	30.5	Very low	26.6	Very low	276 Å²	276	156.9 Å²	156.9	100%	1.082	85%	0.849	S	S	*	*				0	112.8	0	-101.3	-96.6	0	0	0	108.4
2	Q	27.1	Very low	26.6	Very low	187 Å²	187	153.4 Å²	153.4	87%	0.874	85%	0.845	S	S	*	*			trans	53.6	116.8	160.6	-77.7	170.9	-24.9	0	0	123.4
3	C	28.7	Very low	26.3	Very low	117 Å²	117	160.3 Å²	160.3	79%	0.791	85%	0.851	S	S	*	*			trans	-68	158.8	158	-55.9	0	0	0	0	113.1
4	Y	28.9	Very low	26.4	Very low	244 Å²	244	157 Å²	157	96%	0.957	84%	0.843	S	S	*	*				-157.6	135.4	123.9	-109.4	-81.1	0	0	0	109.1
5	G	26.9	Very low	26.4	Very low	59 Å²	59	154.5 Å²	154.5	61%	0.608	84%	0.842	S	S	*	*			trans	-109.7	170.9	176.1	0	0	0	0	0	112.1
6	D	24.5	Very low	26.6	Very low	178 Å²	178	154.9 Å²	154.9	95%	0.952	84%	0.841	S	S	*	*			trans	-177.1	128.7	150.6	-86.7	-23.3	0	0	0	104.2
7	G	25.7	Very low	26.6	Very low	65 Å²	65	151.4 Å²	151.4	67%	0.67	84%	0.838	S	S	*	*			cis	123.6	86.7	19.8	0	0	0	0	0	108.6
8	N	24	Very low	26.6	Very low	163 Å²	163	151.2 Å²	151.2	87%	0.872	84%	0.835	S	S	*	*			trans	173.5	126.8	135.1	-95.1	-15.2	0	0	0	116.6
9	S	25	Very low	26.6	Very low	103 Å²	103	148.4 Å²	148.4	72%	0.72	83%	0.827	S	S	*	*			trans	46.7	96.7	145.6	70.2	0	0	0	0	120.6	T11	S9-T11 PolarHBondContact O-N 3.06Å
10	M	25.4	Very low	26.7	Very low	195 Å²	195	145.7 Å²	145.7	96%	0.961	82%	0.824	S	S	*	*			trans	-71.7	114.3	152.2	-90.1	-175	152.4	0	0	110.1
11	T	26.5	Very low	27.2	Very low	139 Å²	139	147.1 Å²	147.1	85%	0.853	82%	0.818	S	S	*	*			trans	-83.3	113.6	155.9	36.1	0	0	0	0	107.9	S9	S9-T11 PolarHBondContact O-N 3.06Å
12	S	26.4	Very low	27.3	Very low	115 Å²	115	142.2 Å²	142.2	80%	0.804	80%	0.804	S	S	*	*			trans	-83.2	120.3	172.8	47.5	0	0	0	0	110.1
13	R	23.1	Very low	28.3	Very low	243 Å²	243	135.7 Å²	135.7	92%	0.917	78%	0.778	S	S	*	*			trans	-142.8	154.2	157	-99.9	-168.2	178.7	-178.1	0.7	108.8
14	P	27.6	Very low	29.4	Very low	114 Å²	114	135.7 Å²	135.7	74%	0.74	77%	0.769	S	S	*	*	P	Polyproline II helix		-93.4	156	-116.8	34	-36.3	0	0	0	113.7	I16	P14-I16 PolarHBondContact O-N 3.16Å
15	S	26.1	Very low	30.6	Very low	119 Å²	119	125.6 Å²	125.6	83%	0.832	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-53.8	130.6	169.8	27.2	0	0	0	0	111.8	A17	S15-A17 PolarHBondContact O-N 3.1Å
16	I	30	Very low	32.2	Very low	161 Å²	161	124.5 Å²	124.5	83%	0.826	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-52.7	129.5	173.5	-67.3	165.7	0	0	0	109.8	P14 L18	P14-I16 PolarHBondContact O-N 3.16Å; I16-L18 PolarHBondContact O-N 2.93Å
17	A	25.4	Very low	34.4	Very low	95 Å²	95	118.5 Å²	118.5	79%	0.785	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-53.8	124	176.5	0	0	0	0	0	112.1	S15	S15-A17 PolarHBondContact O-N 3.1Å
18	L	27.4	Very low	36.3	Very low	149 Å²	149	115.8 Å²	115.8	78%	0.78	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-73.8	123.3	164.8	-94.2	115	0	0	0	109.3	I16	I16-L18 PolarHBondContact O-N 2.93Å
19	S	26.9	Very low	38.4	Very low	98 Å²	98	110.5 Å²	110.5	69%	0.685	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-65	141.3	172.2	177.1	0	0	0	0	111.1	Y21	S19-Y21 PolarHBondContact O-N 3.38Å
20	A	28.1	Very low	40.4	Very low	93 Å²	93	108.2 Å²	108.2	77%	0.769	60%	0.604	S	S	*	*	S	Bend	trans	-72.5	28.2	-168.8	0	0	0	0	0	116.4
21	Y	36.3	Very low	42.2	Very low	176 Å²	176	101.3 Å²	101.3	69%	0.69	57%	0.571	S	S	*	*			trans	-139.5	31.1	-169.6	-76.4	-78.4	0	0	0	116.8	S19	S19-Y21 PolarHBondContact O-N 3.38Å
22	E	33.1	Very low	43.9	Very low	173 Å²	173	96 Å²	96	81%	0.808	54%	0.537	S	S	*	.			trans	-101.5	100.5	172.7	-84.7	-175.3	154	0	0	113.2
23	T	47.9	Very low	45.5	Very low	51 Å²	51	90.8 Å²	90.8	31%	0.313	50%	0.499	S	S	.	.			trans	-78.1	131.7	156.4	53.2	0	0	0	0	108.9	D25 K915	T23-D25 PolarHBondContact O-N 3.41Å; T23-K915 HydrophobicContact CG2-CG 4.15Å
24	L	52.8	Low	47	Very low	117 Å²	117	79.7 Å²	79.7	61%	0.613	46%	0.459	S	S	*	.	S	Bend	trans	-57.5	-0.2	178.1	-80.7	163.9	0	0	0	116	L52	L24-L52 HydrophobicContact CB-CD2 4.25Å
25	D	53.9	Low	48.1	Very low	32 Å²	32	79.5 Å²	79.5	17%	0.171	45%	0.452	C	S	.	.			trans	-82.4	113	172.5	-77.3	-58.2	0	0	0	110.2	T23 R972	T23-D25 PolarHBondContact O-N 3.41Å; D25-R972 IonicContact OD1-CZ 3.21Å; D25-R972 IonicContact OD1-NH1 3.83Å; D25-R972 IonicContact OD1-NH2 3.69Å; D25-R972 PolarHBondContact OD1-NH2 3.11Å
26	A	60.7	Low	49	Very low	35 Å²	35	76.9 Å²	76.9	29%	0.289	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-80.8	141.3	178.2	0	0	0	0	0	112.1	F32 D800	A26-F32 HydrophobicContact CB-CE2 4.12Å; A26-F32 HydrophobicContact CB-CZ 4.04Å; A26-D800 PolarHBondContact O-N 2.78Å
27	P	69.6	Low	49.5	Very low	52 Å²	52	78.5 Å²	78.5	34%	0.338	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-67.7	160.8	169.2	30.3	-34.6	0	0	0	110.9	Q29	P27-Q29 PolarHBondContact O-N 3.11Å
28	P	67.4	Low	50.2	Low	9 Å²	9	77.2 Å²	77.2	6%	0.058	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-62	130.4	178.2	26.3	-35	0	0	0	112.2	W797 V827	P28-W797 HydrophobicContact CB-CD2 3.82Å; P28-W797 HydrophobicContact CB-CE3 3.79Å; P28-W797 HydrophobicContact CB-CH2 3.25Å; P28-W797 HydrophobicContact CB-CZ2 3.25Å; P28-W797 HydrophobicContact CB-CZ3 3.51Å; P28-W797 HydrophobicContact CG-CD2 3.69Å; P28-W797 HydrophobicContact CG-CE3 3.61Å; P28-W797 HydrophobicContact CG-CG 4.37Å; P28-W797 HydrophobicContact CG-CH2 4.04Å; P28-W797 HydrophobicContact CG-CZ2 4.11Å; P28-W797 HydrophobicContact CG-CZ3 3.78Å; P28-V827 HydrophobicContact CG-CG1 4.42Å
29	Q	67.6	Low	50.5	Low	51 Å²	51	83.2 Å²	83.2	24%	0.238	44%	0.44	C	S	.	.			trans	-137.5	153.1	-178.5	-71.4	-178.6	-6.9	0	0	111.4	P27 D31 F32	P27-Q29 PolarHBondContact O-N 3.11Å; Q29-D31 VanDerWaalsContact C-N 3.31Å; Q29-D31 PolarHBondContact O-N 3.18Å; Q29-F32 HydrophobicContact CB-CD2 4.01Å; Q29-F32 HydrophobicContact CB-CE2 3.95Å; Q29-F32 HydrophobicContact CG-CE2 4.43Å; Q29-F32 PolarHBondContact O-N 3.1Å
30	Y	65.6	Low	51.4	Low	56 Å²	56	82.4 Å²	82.4	22%	0.22	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-56.6	-40.9	-179.1	177.4	-100.7	0	0	0	113.7	F32 Y33 A34 L844 K847 F981 Y982	Y30-F32 PolarHBondContact O-N 3.08Å; Y30-F32 VanDerWaalsContact O-N 3.15Å; Y30-Y33 PolarHBondContact O-N 3.19Å; Y30-Y33 VanDerWaalsContact O-N 3.12Å; Y30-A34 HydrophobicContact CD1-CB 4.4Å; Y30-A34 HydrophobicContact CE1-CB 3.89Å; Y30-A34 PolarHBondContact O-N 2.81Å; Y30-L844 HydrophobicContact CD2-CD1 4.27Å; Y30-K847 HydrophobicContact CE2-CD 3.96Å; Y30-F981 HydrophobicContact CD2-CZ 4.11Å; Y30-F981 HydrophobicContact CE2-CE1 4.12Å; Y30-F981 AromaticContact CE2-CE2 3.79Å; Y30-F981 HydrophobicContact CE2-CE2 3.79Å; Y30-F981 AromaticContact CE2-CZ 3.33Å; Y30-F981 HydrophobicContact CE2-CZ 3.33Å; Y30-F981 AromaticContact CZ-CE2 3.94Å; Y30-F981 AromaticContact CZ-CZ 3.66Å; Y30-Y982 PolarHBondContact OH-OH 3.15Å
31	D	63.3	Low	52.1	Low	50 Å²	50	87.1 Å²	87.1	27%	0.267	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-65.4	-18.8	-172.9	-68.6	-16.2	0	0	0	113.7	Q29 Y33	Q29-D31 VanDerWaalsContact C-N 3.31Å; Q29-D31 PolarHBondContact O-N 3.18Å; D31-Y33 VanDerWaalsContact C-N 3.29Å; D31-Y33 PolarHBondContact O-N 3.36Å
32	F	63.9	Low	52.2	Low	28 Å²	28	88.6 Å²	88.6	12%	0.123	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-76.5	-14.9	177.1	-59.7	-38.3	0	0	0	113.9	A26 Q29 Y30 R46 D800	A26-F32 HydrophobicContact CB-CE2 4.12Å; A26-F32 HydrophobicContact CB-CZ 4.04Å; Q29-F32 HydrophobicContact CB-CD2 4.01Å; Q29-F32 HydrophobicContact CB-CE2 3.95Å; Q29-F32 HydrophobicContact CG-CE2 4.43Å; Q29-F32 PolarHBondContact O-N 3.1Å; Y30-F32 PolarHBondContact O-N 3.08Å; Y30-F32 VanDerWaalsContact O-N 3.15Å; F32-R46 HydrophobicContact CD1-CB 4.21Å; F32-R46 HydrophobicContact CE1-CB 4.42Å; F32-D800 WeakPolarHBondContact CB-OD2 3.22Å; F32-D800 HydrophobicContact CD2-CB 4.18Å; F32-D800 WeakPolarHBondContact CD2-OD2 3.5Å; F32-D800 HydrophobicContact CE2-CB 4.35Å; F32-D800 WeakPolarHBondContact CG-OD2 3.32Å
33	Y	59.5	Low	52.8	Low	5 Å²	5	87.3 Å²	87.3	2%	0.02	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-5.2	-173.7	-63.5	-82.7	0	0	0	113.3	Y30 D31 W797 D800 G803 L844 F848 F981	Y30-Y33 PolarHBondContact O-N 3.19Å; Y30-Y33 VanDerWaalsContact O-N 3.12Å; D31-Y33 VanDerWaalsContact C-N 3.29Å; D31-Y33 PolarHBondContact O-N 3.36Å; Y33-W797 HydrophobicContact CE2-CZ2 4.37Å; Y33-D800 PolarHBondContact OH-OD1 3.15Å; Y33-G803 PolarHBondContact OH-N 2.85Å; Y33-L844 HydrophobicContact CD2-CD2 4.41Å; Y33-F848 HydrophobicContact CD1-CE1 4.07Å; Y33-F848 AromaticContact CD1-CZ 3.63Å; Y33-F848 HydrophobicContact CD1-CZ 3.63Å; Y33-F848 HydrophobicContact CD2-CZ 4.03Å; Y33-F848 AromaticContact CE1-CZ 3.98Å; Y33-F848 HydrophobicContact CE1-CZ 3.98Å; Y33-F848 HydrophobicContact CE2-CZ 4.39Å; Y33-F848 HydrophobicContact CG-CE1 4.21Å; Y33-F848 AromaticContact CG-CZ 3.64Å; Y33-F848 HydrophobicContact CG-CZ 3.64Å; Y33-F981 VanDerWaalsContact C-CE1 3.45Å; Y33-F981 WeakPolarHBondContact O-CE1 3.32Å
34	A	54.4	Low	52.9	Low	10 Å²	10	92.8 Å²	92.8	8%	0.083	46%	0.457	C	S	.	.			trans	-96	128	179.8	0	0	0	0	0	111.7	Y30 F981 Y982	Y30-A34 HydrophobicContact CD1-CB 4.4Å; Y30-A34 HydrophobicContact CE1-CB 3.89Å; Y30-A34 PolarHBondContact O-N 2.81Å; A34-F981 HydrophobicContact CB-CE2 4.47Å; A34-F981 HydrophobicContact CB-CZ 3.72Å; A34-Y982 HydrophobicContact CB-CE2 4.08Å
35	N	49.8	Very low	52.7	Low	110 Å²	110	94.7 Å²	94.7	59%	0.588	46%	0.461	S	S	*	.			trans	-94.4	-0.2	176	-84.5	-5	0	0	0	114.4
36	S	46.1	Very low	53	Low	63 Å²	63	95.3 Å²	95.3	44%	0.441	46%	0.461	S	S	.	.	S	Bend	trans	-96.6	128.1	-176.8	58.5	0	0	0	0	113	A38	S36-A38 PolarHBondContact O-N 3.41Å
37	Q	40.8	Very low	52.6	Low	195 Å²	195	95.4 Å²	95.4	91%	0.911	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-69.1	116.8	168.5	-80.3	-174.3	-2.2	0	0	110.4
38	A	39.9	Very low	52	Low	68 Å²	68	95.2 Å²	95.2	56%	0.562	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-85.6	123.2	161.7	0	0	0	0	0	108.6	S36 G40 R41	S36-A38 PolarHBondContact O-N 3.41Å; A38-G40 PolarHBondContact O-N 3.49Å; A38-G40 VanDerWaalsContact O-N 3.17Å; A38-R41 PolarHBondContact O-N 2.01Å
39	W	33.3	Very low	51.6	Low	276 Å²	276	94.9 Å²	94.9	100%	1.045	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	119.8	-179.4	-135.3	-52.6	0	0	0	109.9
40	G	46.5	Very low	50.9	Low	80 Å²	80	97.3 Å²	97.3	83%	0.825	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.7	-6.6	173.9	0	0	0	0	0	118	A38	A38-G40 PolarHBondContact O-N 3.49Å; A38-G40 VanDerWaalsContact O-N 3.17Å
41	R	42.6	Very low	50.5	Low	193 Å²	193	101 Å²	101	73%	0.728	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-98.6	126.5	171.5	-85.1	-171.6	178	-172.8	0.2	111.8	A38 R43	A38-R41 PolarHBondContact O-N 2.01Å; R41-R43 PolarHBondContact O-N 3.01Å
42	K	37.4	Very low	50.1	Low	206 Å²	206	99.2 Å²	99.2	90%	0.896	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-65.9	118	169.1	-82	-177	176.6	179.3	0	109.4
43	R	46.6	Very low	49.6	Very low	147 Å²	147	98.1 Å²	98.1	56%	0.555	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-65.9	129.5	178.1	-171.2	177.6	-175.8	-178.3	2.6	110.5	R41	R41-R43 PolarHBondContact O-N 3.01Å
44	R	49.3	Very low	49.1	Very low	166 Å²	166	101.5 Å²	101.5	63%	0.626	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-90.5	132.7	168.8	-65.8	-179.6	176.9	-174.7	-3.2	108.7
45	F	49.3	Very low	48.3	Very low	157 Å²	157	109.4 Å²	109.4	69%	0.689	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-96.7	139.1	177.4	-71.6	-85.3	0	0	0	110
46	R	58.8	Low	47.6	Very low	45 Å²	45	111.8 Å²	111.8	17%	0.17	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-67.7	128.5	169.5	-174.9	-170.8	-73.3	159.3	-2.5	108	F32 D800 Q975	F32-R46 HydrophobicContact CD1-CB 4.21Å; F32-R46 HydrophobicContact CE1-CB 4.42Å; R46-D800 IonicContact CZ-OD1 2.72Å; R46-D800 IonicContact CZ-OD2 2.81Å; R46-D800 IonicContact NE-OD2 2.87Å; R46-D800 PolarHBondContact NE-OD2 3.4Å; R46-D800 VanDerWaalsContact NH2-CG 3.29Å; R46-D800 IonicContact NH2-OD1 3.5Å; R46-D800 PolarHBondContact NH2-OD1 3.36Å; R46-D800 IonicContact NH2-OD2 3.25Å; R46-D800 PolarHBondContact NH2-OD2 3.42Å; R46-Q975 WeakPolarHBondContact CD-O 3.36Å; R46-Q975 VanDerWaalsContact NH1-C 3.32Å; R46-Q975 PolarHBondContact NH1-O 3.22Å
47	P	53.1	Low	46.9	Very low	37 Å²	37	115.9 Å²	115.9	24%	0.24	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-64.5	136.4	173	25.1	-31	0	0	0	109.9	Q51 L52	P47-Q51 HydrophobicContact CB-CB 4.48Å; P47-L52 HydrophobicContact CB-CD2 4.2Å; P47-L52 HydrophobicContact CB-CG 4.17Å; P47-L52 HydrophobicContact CG-CD1 4.38Å; P47-L52 HydrophobicContact CG-CD2 3.94Å; P47-L52 HydrophobicContact CG-CG 4.18Å
48	S	56.7	Low	46.3	Very low	47 Å²	47	115.2 Å²	115.2	33%	0.329	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-65.7	155.8	177.5	71.9	0	0	0	0	110.7	H50 Q51 L52	S48-H50 PolarHBondContact O-N 2.54Å; S48-Q51 VanDerWaalsContact N-OE1 3.07Å; S48-Q51 WeakPolarHBondContact O-CB 3.44Å; S48-Q51 PolarHBondContact O-N 2.99Å; S48-Q51 WeakPolarHBondContact OG-CG 3.41Å; S48-Q51 PolarHBondContact OG-N 3.12Å; S48-L52 PolarHBondContact O-N 2.93Å; S48-L52 VanDerWaalsContact O-N 3.09Å
49	L	58.8	Low	45.6	Very low	3 Å²	3	119.4 Å²	119.4	2%	0.016	57%	0.569	C	S	.	*	H	α-helix	trans	-56.3	-35.7	177.2	-174.7	63.3	0	0	0	111.4	L52 H53 F719 Q975	L49-L52 PolarHBondContact O-N 3.04Å; L49-H53 WeakPolarHBondContact O-CB 3.44Å; L49-H53 PolarHBondContact O-N 2.85Å; L49-F719 HydrophobicContact CD1-CB 4.49Å; L49-F719 HydrophobicContact CD1-CD1 4.15Å; L49-F719 HydrophobicContact CD1-CG 4.36Å; L49-F719 HydrophobicContact CD2-CB 3.81Å; L49-F719 HydrophobicContact CD2-CD1 3.76Å; L49-F719 HydrophobicContact CD2-CG 4.14Å; L49-F719 VanDerWaalsContact CD2-O 3.27Å; L49-F719 WeakPolarHBondContact CD2-O 3.35Å; L49-F719 HydrophobicContact CG-CB 4.14Å; L49-F719 HydrophobicContact CG-CD1 4.42Å; L49-Q975 HydrophobicContact CB-CG 4.35Å
50	H	53.9	Low	45.4	Very low	102 Å²	102	113.5 Å²	113.5	47%	0.472	56%	0.557	S	S	.	*	H	α-helix	trans	-64.7	-41.9	174.3	-168.2	70.6	0	0	0	113.1	S48 L52 H53 V54	S48-H50 PolarHBondContact O-N 2.54Å; H50-L52 VanDerWaalsContact C-N 3.31Å; H50-L52 PolarHBondContact O-N 3.07Å; H50-H53 PolarHBondContact O-N 2.03Å; H50-H53 VanDerWaalsContact O-N 3.09Å; H50-V54 PolarHBondContact O-N 3.25Å
51	Q	55.8	Low	44.4	Very low	134 Å²	134	114.1 Å²	114.1	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-67.6	-27.5	176.4	-77.1	172.2	-18.8	0	0	113.5	P47 S48 H53	P47-Q51 HydrophobicContact CB-CB 4.48Å; S48-Q51 VanDerWaalsContact N-OE1 3.07Å; S48-Q51 WeakPolarHBondContact O-CB 3.44Å; S48-Q51 PolarHBondContact O-N 2.99Å; S48-Q51 WeakPolarHBondContact OG-CG 3.41Å; S48-Q51 PolarHBondContact OG-N 3.12Å; Q51-H53 VanDerWaalsContact C-N 3.26Å
52	L	56.6	Low	43.6	Very low	11 Å²	11	116.5 Å²	116.5	6%	0.058	56%	0.558	C	S	.	*	H	α-helix	trans	-75.9	-17.4	173.3	-69.9	171	0	0	0	112.6	L24 P47 S48 L49 H50 R944	L24-L52 HydrophobicContact CB-CD2 4.25Å; P47-L52 HydrophobicContact CB-CD2 4.2Å; P47-L52 HydrophobicContact CB-CG 4.17Å; P47-L52 HydrophobicContact CG-CD1 4.38Å; P47-L52 HydrophobicContact CG-CD2 3.94Å; P47-L52 HydrophobicContact CG-CG 4.18Å; S48-L52 PolarHBondContact O-N 2.93Å; S48-L52 VanDerWaalsContact O-N 3.09Å; L49-L52 PolarHBondContact O-N 3.04Å; H50-L52 VanDerWaalsContact C-N 3.31Å; H50-L52 PolarHBondContact O-N 3.07Å; L52-R944 WeakPolarHBondContact O-CG 3.27Å; L52-R944 PolarHBondContact O-NE 3.4Å
53	H	52.4	Low	43.7	Very low	5 Å²	5	112 Å²	112	2%	0.023	55%	0.55	C	S	.	.	H	α-helix	trans	-104	-30.3	-165.6	-165.8	-150.8	0	0	0	114.5	L49 H50 Q51 H716 D720	L49-H53 WeakPolarHBondContact O-CB 3.44Å; L49-H53 PolarHBondContact O-N 2.85Å; H50-H53 PolarHBondContact O-N 2.03Å; H50-H53 VanDerWaalsContact O-N 3.09Å; Q51-H53 VanDerWaalsContact C-N 3.26Å; H53-H716 AromaticContact CD2-ND1 3.84Å; H53-H716 AromaticContact CE1-ND1 3.7Å; H53-H716 AromaticContact NE2-CE1 3.67Å; H53-H716 AromaticContact NE2-CG 3.61Å; H53-H716 AromaticContact NE2-ND1 2.83Å; H53-H716 PolarHBondContact NE2-ND1 2.5Å; H53-D720 IonicContact CE1-OD1 3.77Å; H53-D720 PolarHBondContact CE1-OD1 3.32Å; H53-D720 IonicContact CE1-OD2 3.09Å; H53-D720 IonicContact ND1-OD1 2.75Å; H53-D720 PolarHBondContact ND1-OD1 3.31Å
54	V	49.5	Very low	42.8	Very low	76 Å²	76	111.5 Å²	111.5	46%	0.461	57%	0.566	S	S	.	*			trans	-125.5	143.3	-170.8	-179.8	0	0	0	0	112.5	H50	H50-V54 PolarHBondContact O-N 3.25Å
55	M	38	Very low	41.5	Very low	176 Å²	176	111.1 Å²	111.1	87%	0.867	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-92.9	124.6	168.2	-164.7	176.8	-177.4	0	0	108.8	N57	M55-N57 PolarHBondContact O-N 3.37Å
56	L	33.3	Very low	40.4	Very low	160 Å²	160	112.5 Å²	112.5	84%	0.838	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-74	119.2	178	-78.9	156.9	0	0	0	110.1
57	N	31.7	Very low	38.8	Very low	150 Å²	150	118.8 Å²	118.8	80%	0.802	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-103.6	130.9	148.7	-80	-10.8	0	0	0	106.8	M55	M55-N57 PolarHBondContact O-N 3.37Å
58	E	28.8	Very low	37.5	Very low	181 Å²	181	125.3 Å²	125.3	85%	0.846	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-77.2	164.9	170.5	-74.1	-180	146.7	0	0	110.9
59	D	26.2	Very low	36	Very low	156 Å²	156	135.2 Å²	135.2	83%	0.834	66%	0.664	S	S	*	*			trans	87	126.1	-173.3	-59.9	-18.7	0	0	0	114.2
60	D	27.5	Very low	34.5	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	71%	0.707	S	S	*	*			cis	-159.9	-176.8	19.3	-153.6	-11.6	0	0	0	111.3
61	S	26.4	Very low	33.1	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	72%	0.724	S	S	*	*			trans	-99.8	141.9	-149.1	-41.8	0	0	0	0	116.4
62	R	26.5	Very low	31.6	Very low	243 Å²	243	144.3 Å²	144.3	92%	0.917	73%	0.733	S	S	*	*			trans	54.2	154.7	138.7	-73.4	-173.6	-174.3	-178.9	3.5	123
63	P	39.2	Very low	30.1	Very low	111 Å²	111	149.6 Å²	149.6	72%	0.721	77%	0.766	S	S	*	*			trans	-103.7	175.5	-158.5	41	-32.5	0	0	0	114.2
64	P	26.6	Very low	28.8	Very low	137 Å²	137	155.2 Å²	155.2	89%	0.89	81%	0.806	S	S	*	*			trans	-127	173.2	148.3	31.5	-14.6	0	0	0	114.3
65	M	23.5	Very low	27.7	Very low	158 Å²	158	160 Å²	160	78%	0.778	82%	0.823	S	S	*	*			trans	-133.8	154.4	-154.7	-148.8	-177.8	39.7	0	0	110.3
66	Y	26.1	Very low	27.1	Very low	187 Å²	187	158.3 Å²	158.3	73%	0.733	82%	0.817	S	S	*	*			trans	67.7	148.8	168.5	-73.5	-86.6	0	0	0	117.5
67	E	24.4	Very low	26.8	Very low	177 Å²	177	159.5 Å²	159.5	83%	0.827	82%	0.819	S	S	*	*			cis	-163.6	170.8	34.9	-145.5	165.3	-141.7	0	0	112.8
68	E	26.4	Very low	26.6	Very low	173 Å²	173	160.2 Å²	160.2	81%	0.808	82%	0.822	S	S	*	*			trans	-68.9	164.1	-175	-67.1	169.2	147.2	0	0	116.9
69	R	25	Very low	26.6	Very low	255 Å²	255	161 Å²	161	96%	0.962	83%	0.826	S	S	*	*			trans	-164.5	141.3	132.3	-107.6	174	-166.5	-170.7	3.8	114.1
70	E	27.1	Very low	26.8	Very low	199 Å²	199	162.2 Å²	162.2	93%	0.93	83%	0.827	S	S	*	*			trans	-79.8	166.4	179.4	-62.5	175.5	140.3	0	0	114.4
71	G	24.8	Very low	26.9	Very low	80 Å²	80	164.7 Å²	164.7	83%	0.825	83%	0.83	S	S	*	*			trans	169.9	83.7	163.8	0	0	0	0	0	117.1
72	D	24	Very low	27.3	Very low	152 Å²	152	169.4 Å²	169.4	81%	0.813	84%	0.842	S	S	*	*			trans	15.2	138.6	148.5	-95.8	-14.2	0	0	0	127.5
73	T	24.1	Very low	27.7	Very low	122 Å²	122	162.9 Å²	162.9	75%	0.748	83%	0.831	S	S	*	*			trans	45.9	129.5	139.5	53.3	0	0	0	0	124.7
74	S	25.7	Very low	27.7	Very low	123 Å²	123	162.7 Å²	162.7	86%	0.86	83%	0.83	S	S	*	*				-174.6	148.5	105.9	62.1	0	0	0	0	113.5
75	E	26.5	Very low	28.3	Very low	176 Å²	176	162.5 Å²	162.5	82%	0.822	83%	0.829	S	S	*	*			trans	-79.9	165.4	-176.9	-61.5	168.9	148.7	0	0	113.6
76	D	25.8	Very low	29.1	Very low	141 Å²	141	160.8 Å²	160.8	75%	0.754	82%	0.819	S	S	*	*			trans	159	99.8	137.4	-76.9	-14.7	0	0	0	110
77	E	27.4	Very low	30.1	Very low	184 Å²	184	157 Å²	157	86%	0.86	82%	0.818	S	S	*	*				93.3	98.8	89.3	-80.5	-166	177.1	0	0	113.2
78	D	27.3	Very low	31.4	Very low	165 Å²	165	155.5 Å²	155.5	88%	0.882	82%	0.82	S	S	*	*			trans	-79.2	116.7	172.4	-78.1	-49.6	0	0	0	110.9	E80	D78-E80 PolarHBondContact O-N 3.42Å
79	E	28.6	Very low	33.6	Very low	198 Å²	198	152 Å²	152	93%	0.925	80%	0.8	S	S	*	*			trans	-75.2	97.7	171.2	-77.2	-172.5	158.5	0	0	111.7
80	E	29.3	Very low	36.1	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76.8	117.2	164.6	-81.5	-169.1	154.5	0	0	111	D78 E82	D78-E80 PolarHBondContact O-N 3.42Å; E80-E82 PolarHBondContact O-N 3.17Å
81	K	30.5	Very low	38.9	Very low	204 Å²	204	134.8 Å²	134.8	89%	0.887	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-67.8	124.1	172.7	-76.4	173.6	176	170.8	0	112
82	E	34.5	Very low	42	Very low	191 Å²	191	135.7 Å²	135.7	89%	0.893	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-71.8	135.7	171.6	-72.8	-167.3	154.4	0	0	112.7	E80	E80-E82 PolarHBondContact O-N 3.17Å
83	P	35.9	Very low	45.1	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-82.6	158.9	172.5	32.3	-31.7	0	0	0	112.6
84	P	39.2	Very low	48	Very low	107 Å²	107	129.5 Å²	129.5	70%	0.695	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-66	162.9	-171.4	25.6	-34.8	0	0	0	114.3	E86	P84-E86 PolarHBondContact O-N 2.99Å
85	P	37.9	Very low	50.7	Low	133 Å²	133	123.7 Å²	123.7	86%	0.864	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-62.7	118.1	-171	24	-33.8	0	0	0	112.3
86	E	40.6	Very low	53.8	Low	121 Å²	121	115.3 Å²	115.3	57%	0.565	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-77.1	151.8	178.6	-75.8	178	136.2	0	0	112.2	P84 R89	P84-E86 PolarHBondContact O-N 2.99Å; E86-R89 VanDerWaalsContact CD-CZ 3.43Å; E86-R89 IonicContact OE1-CZ 3.47Å; E86-R89 IonicContact OE1-NH1 3.54Å; E86-R89 IonicContact OE1-NH2 3.56Å; E86-R89 PolarHBondContact OE1-NH2 3.31Å; E86-R89 IonicContact OE2-CZ 3.51Å; E86-R89 IonicContact OE2-NE 2.75Å; E86-R89 IonicContact OE2-NH1 2.88Å; E86-R89 PolarHBondContact OE2-NH1 3.42Å; E86-R89 IonicContact OE2-NH2 2.92Å; E86-R89 PolarHBondContact OE2-NH2 2.91Å
87	P	47.5	Very low	57	Low	109 Å²	109	110 Å²	110	71%	0.708	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-60.1	161.6	-179	24.6	-34.4	0	0	0	112.7	R89	P87-R89 WeakPolarHBondContact O-CG 3.5Å; P87-R89 PolarHBondContact O-N 3.45Å
88	T	51.7	Low	60.1	Low	144 Å²	144	102.5 Å²	102.5	88%	0.883	54%	0.537	S	S	*	.			trans	-53.9	94	-178	42.5	0	0	0	0	113.1
89	R	71.5	Confident	63	Low	100 Å²	100	95.9 Å²	95.9	38%	0.377	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-79.3	146	179	-74.4	179.7	164.7	160.2	9.4	112.9	E86 P87 D317 L318 K319	E86-R89 VanDerWaalsContact CD-CZ 3.43Å; E86-R89 IonicContact OE1-CZ 3.47Å; E86-R89 IonicContact OE1-NH1 3.54Å; E86-R89 IonicContact OE1-NH2 3.56Å; E86-R89 PolarHBondContact OE1-NH2 3.31Å; E86-R89 IonicContact OE2-CZ 3.51Å; E86-R89 IonicContact OE2-NE 2.75Å; E86-R89 IonicContact OE2-NH1 2.88Å; E86-R89 PolarHBondContact OE2-NH1 3.42Å; E86-R89 IonicContact OE2-NH2 2.92Å; E86-R89 PolarHBondContact OE2-NH2 2.91Å; P87-R89 WeakPolarHBondContact O-CG 3.5Å; P87-R89 PolarHBondContact O-N 3.45Å; R89-D317 CarbonylContact C-O 3.44Å; R89-D317 WeakPolarHBondContact CA-O 3.49Å; R89-D317 WeakPolarHBondContact CB-O 3.39Å; R89-L318 WeakPolarHBondContact CD-O 3.24Å; R89-K319 HydrophobicContact CB-CB 4.1Å
90	F	78.9	Confident	66.1	Low	54 Å²	54	86.5 Å²	86.5	24%	0.237	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-76.1	145.8	-178.3	-62.3	-72.7	0	0	0	112.9	Q94 I314 D317 L318 K319	F90-Q94 HydrophobicContact CD1-CG 4.18Å; F90-I314 HydrophobicContact CD2-CD1 4.48Å; F90-D317 HydrophobicContact CD2-CB 4.07Å; F90-D317 HydrophobicContact CE2-CB 4.4Å; F90-D317 PolarHBondContact N-O 3.17Å; F90-L318 HydrophobicContact CB-CD2 4.34Å; F90-K319 PolarHBondContact O-N 2.87Å
91	G	84.9	Confident	69.1	Low	39 Å²	39	78.4 Å²	78.4	40%	0.402	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-78	173.2	169	0	0	0	0	0	112.9	V93 G95	G91-V93 PolarHBondContact O-N 3.49Å; G91-G95 WeakPolarHBondContact O-CA 2.85Å; G91-G95 PolarHBondContact O-N 3.23Å
92	W	90.1	Very high	72	Confident	99 Å²	99	68.9 Å²	68.9	38%	0.375	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-32.2	-175.2	72.3	-89.3	0	0	0	114.4	V96 M97 A324 R327	W92-V96 WeakPolarHBondContact O-CB 3.32Å; W92-V96 PolarHBondContact O-N 3.37Å; W92-V96 VanDerWaalsContact O-N 3.1Å; W92-M97 HydrophobicContact CE3-CB 4.41Å; W92-M97 HydrophobicContact CH2-SD 4.41Å; W92-M97 HydrophobicContact CZ3-CB 4.32Å; W92-M97 HydrophobicContact CZ3-SD 3.86Å; W92-M97 PolarHBondContact O-N 3.39Å; W92-A324 HydrophobicContact CB-CB 3.56Å; W92-R327 HydrophobicContact CE3-CB 4.25Å
93	V	89.3	Confident	74.6	Confident	58 Å²	58	60.4 Å²	60.4	35%	0.352	34%	0.337	S	S	.	.	I	π-helix	trans	-67.1	-58.5	177.9	170.3	0	0	0	0	110.5	G91 M97 I98	G91-V93 PolarHBondContact O-N 3.49Å; V93-M97 HydrophobicContact CG1-CE 3.89Å; V93-M97 HydrophobicContact CG2-CE 4.44Å; V93-M97 WeakPolarHBondContact O-CB 3.14Å; V93-M97 PolarHBondContact O-N 3.42Å; V93-I98 HydrophobicContact CG1-CD1 4.22Å; V93-I98 HydrophobicContact CG1-CG1 4.44Å; V93-I98 WeakPolarHBondContact O-CG1 3.45Å; V93-I98 PolarHBondContact O-N 3.1Å
94	Q	84.4	Confident	77.3	Confident	86 Å²	86	55.4 Å²	55.4	40%	0.402	31%	0.305	S	S	.	.	I	π-helix	trans	-72.3	-41.1	-176.4	-173.3	-178.5	-4.9	0	0	112.3	F90 I241	F90-Q94 HydrophobicContact CD1-CG 4.18Å; Q94-I241 HydrophobicContact CG-CD1 4.39Å
95	G	84.1	Confident	79.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-81.5	-29.5	-174.6	0	0	0	0	0	114.4	G91 R99 I314	G91-G95 WeakPolarHBondContact O-CA 2.85Å; G91-G95 PolarHBondContact O-N 3.23Å; G95-R99 WeakPolarHBondContact O-CD 2.92Å; G95-I314 WeakPolarHBondContact O-CD1 3.46Å
96	V	91	Very high	82.2	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-119.8	-58.8	-175.2	-175.3	0	0	0	0	111.2	W92 R99 C100 L318 A324 I325	W92-V96 WeakPolarHBondContact O-CB 3.32Å; W92-V96 PolarHBondContact O-N 3.37Å; W92-V96 VanDerWaalsContact O-N 3.1Å; V96-R99 PolarHBondContact O-N 3.19Å; V96-C100 WeakPolarHBondContact O-CB 2.95Å; V96-C100 PolarHBondContact O-N 3.17Å; V96-C100 PolarHBondContact O-SG 3.08Å; V96-C100 VanDerWaalsContact O-SG 3.34Å; V96-L318 HydrophobicContact CG2-CD1 3.54Å; V96-L318 HydrophobicContact CG2-CD2 3.75Å; V96-L318 HydrophobicContact CG2-CG 4.32Å; V96-A324 HydrophobicContact CG2-CB 4.07Å; V96-I325 HydrophobicContact CG2-CG1 4.49Å
97	M	93.1	Very high	84.5	Confident	31 Å²	31	38.8 Å²	38.8	15%	0.153	21%	0.207	C	C	.	.	I	π-helix	trans	-61.7	-54.4	-171.2	-170.4	179.6	68.3	0	0	112.4	W92 V93 R99 C100 M101 M331 A332	W92-M97 HydrophobicContact CE3-CB 4.41Å; W92-M97 HydrophobicContact CH2-SD 4.41Å; W92-M97 HydrophobicContact CZ3-CB 4.32Å; W92-M97 HydrophobicContact CZ3-SD 3.86Å; W92-M97 PolarHBondContact O-N 3.39Å; V93-M97 HydrophobicContact CG1-CE 3.89Å; V93-M97 HydrophobicContact CG2-CE 4.44Å; V93-M97 WeakPolarHBondContact O-CB 3.14Å; V93-M97 PolarHBondContact O-N 3.42Å; M97-R99 VanDerWaalsContact C-N 3.33Å; M97-R99 PolarHBondContact O-N 3.35Å; M97-C100 PolarHBondContact O-N 3.24Å; M97-M101 HydrophobicContact CG-CG 4.46Å; M97-M101 HydrophobicContact CG-SD 3.74Å; M97-M101 WeakPolarHBondContact O-CB 3.06Å; M97-M101 VanDerWaalsContact O-CG 3.25Å; M97-M101 WeakPolarHBondContact O-CG 3.08Å; M97-M101 PolarHBondContact O-N 3Å; M97-M101 HydrophobicContact SD-SD 4.37Å; M97-M331 HydrophobicContact CG-CB 4.49Å; M97-M331 HydrophobicContact SD-CB 3.98Å; M97-A332 HydrophobicContact CG-CB 4.3Å
98	I	91.1	Very high	86.6	Confident	25 Å²	25	33.8 Å²	33.8	13%	0.128	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-42.8	-179.5	-68.2	177.7	0	0	0	110.9	V93 M101 L102 F244	V93-I98 HydrophobicContact CG1-CD1 4.22Å; V93-I98 HydrophobicContact CG1-CG1 4.44Å; V93-I98 WeakPolarHBondContact O-CG1 3.45Å; V93-I98 PolarHBondContact O-N 3.1Å; I98-M101 PolarHBondContact O-N 2.99Å; I98-L102 HydrophobicContact CG2-CD1 3.93Å; I98-L102 HydrophobicContact CG2-CG 4.35Å; I98-L102 WeakPolarHBondContact O-CB 3.36Å; I98-L102 WeakPolarHBondContact O-CG 3.44Å; I98-L102 PolarHBondContact O-N 2.78Å; I98-F244 HydrophobicContact CG1-CE2 4.39Å; I98-F244 HydrophobicContact CG1-CZ 4.42Å; I98-F244 HydrophobicContact CG2-CB 4.07Å; I98-F244 HydrophobicContact CG2-CD2 3.82Å; I98-F244 HydrophobicContact CG2-CE2 4.41Å; I98-F244 HydrophobicContact CG2-CG 3.9Å
99	R	89.6	Confident	88.5	Confident	27 Å²	27	26.9 Å²	26.9	10%	0.102	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-45.6	177.9	-74.8	-164.5	171.5	-122	-5.3	112.6	G95 V96 M97 N103 E236 Q240	G95-R99 WeakPolarHBondContact O-CD 2.92Å; V96-R99 PolarHBondContact O-N 3.19Å; M97-R99 VanDerWaalsContact C-N 3.33Å; M97-R99 PolarHBondContact O-N 3.35Å; R99-N103 WeakPolarHBondContact O-CB 3.17Å; R99-N103 PolarHBondContact O-N 3.03Å; R99-E236 IonicContact CZ-OE1 3.12Å; R99-E236 IonicContact CZ-OE2 2.85Å; R99-E236 IonicContact NH1-OE1 2.67Å; R99-E236 PolarHBondContact NH1-OE1 2.82Å; R99-E236 IonicContact NH1-OE2 2.92Å; R99-E236 IonicContact NH2-OE1 2.78Å; R99-E236 PolarHBondContact NH2-OE1 3.46Å; R99-E236 IonicContact NH2-OE2 3.5Å; R99-E236 PolarHBondContact NH2-OE2 3.19Å; R99-Q240 VanDerWaalsContact NE-OE1 3.12Å
100	C	92.8	Very high	89.4	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.4	-43	176.1	-70.1	0	0	0	0	111	V96 M97 L102 N103 I104 I308 G311 A332	V96-C100 WeakPolarHBondContact O-CB 2.95Å; V96-C100 PolarHBondContact O-N 3.17Å; V96-C100 PolarHBondContact O-SG 3.08Å; V96-C100 VanDerWaalsContact O-SG 3.34Å; M97-C100 PolarHBondContact O-N 3.24Å; C100-L102 PolarHBondContact O-N 2.89Å; C100-N103 PolarHBondContact O-N 3.2Å; C100-I104 HydrophobicContact CB-CD1 4.48Å; C100-I104 WeakPolarHBondContact O-CB 3.48Å; C100-I104 WeakPolarHBondContact O-CD1 3.29Å; C100-I104 WeakPolarHBondContact O-CG1 3.49Å; C100-I104 PolarHBondContact O-N 2.96Å; C100-I308 PolarHBondContact SG-O 2.88Å; C100-G311 PolarHBondContact SG-N 3.26Å; C100-A332 HydrophobicContact CB-CB 3.53Å
101	M	93.4	Very high	89.9	Confident	12 Å²	12	19.7 Å²	19.7	6%	0.059	10%	0.103	C	C	.	.	H	α-helix	trans	-62.1	-44	178.4	-70.2	172.8	69	0	0	112.3	M97 I98 N103 I104 W105 F244 A332 W335 T336	M97-M101 HydrophobicContact CG-CG 4.46Å; M97-M101 HydrophobicContact CG-SD 3.74Å; M97-M101 WeakPolarHBondContact O-CB 3.06Å; M97-M101 VanDerWaalsContact O-CG 3.25Å; M97-M101 WeakPolarHBondContact O-CG 3.08Å; M97-M101 PolarHBondContact O-N 3Å; M97-M101 HydrophobicContact SD-SD 4.37Å; I98-M101 PolarHBondContact O-N 2.99Å; M101-N103 VanDerWaalsContact C-N 3.27Å; M101-N103 PolarHBondContact O-N 2.97Å; M101-I104 PolarHBondContact O-N 3.2Å; M101-W105 HydrophobicContact CB-CE3 4.19Å; M101-W105 HydrophobicContact CB-CZ3 4.12Å; M101-W105 HydrophobicContact CE-CH2 3.07Å; M101-W105 HydrophobicContact CE-CZ2 3.6Å; M101-W105 HydrophobicContact CE-CZ3 3.69Å; M101-W105 WeakPolarHBondContact O-CB 3.48Å; M101-W105 PolarHBondContact O-N 3.26Å; M101-F244 HydrophobicContact CE-CE2 4.15Å; M101-A332 HydrophobicContact CG-CB 3.69Å; M101-W335 HydrophobicContact CE-CB 4.11Å; M101-T336 HydrophobicContact CB-CG2 4.31Å; M101-T336 HydrophobicContact CG-CG2 4.06Å
102	L	90.7	Very high	90.3	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-61.1	-35.6	176.4	-76.5	172.4	0	0	0	113	I98 C100 Q240 F243 F244 I247 S424	I98-L102 HydrophobicContact CG2-CD1 3.93Å; I98-L102 HydrophobicContact CG2-CG 4.35Å; I98-L102 WeakPolarHBondContact O-CB 3.36Å; I98-L102 WeakPolarHBondContact O-CG 3.44Å; I98-L102 PolarHBondContact O-N 2.78Å; C100-L102 PolarHBondContact O-N 2.89Å; L102-Q240 HydrophobicContact CD1-CB 3.69Å; L102-Q240 HydrophobicContact CD1-CG 4.01Å; L102-Q240 VanDerWaalsContact CD1-O 3.31Å; L102-Q240 WeakPolarHBondContact CD1-O 3.5Å; L102-F243 HydrophobicContact CD2-CB 4.48Å; L102-F244 HydrophobicContact CD1-CB 4.27Å; L102-F244 HydrophobicContact CD2-CB 3.94Å; L102-F244 HydrophobicContact CD2-CD2 4.22Å; L102-F244 HydrophobicContact CG-CB 4.3Å; L102-F244 HydrophobicContact CG-CD2 4.26Å; L102-I247 HydrophobicContact CD2-CD1 3.62Å; L102-S424 PolarHBondContact O-OG 2.93Å
103	N	89.4	Confident	90.5	Very high	12 Å²	12	13.5 Å²	13.5	6%	0.064	7%	0.068	C	C	.	.	H	α-helix	trans	-85	-21.9	-177.8	-148.3	34.6	0	0	0	113	R99 C100 M101 A310	R99-N103 WeakPolarHBondContact O-CB 3.17Å; R99-N103 PolarHBondContact O-N 3.03Å; C100-N103 PolarHBondContact O-N 3.2Å; M101-N103 VanDerWaalsContact C-N 3.27Å; M101-N103 PolarHBondContact O-N 2.97Å; N103-A310 HydrophobicContact CB-CB 3.97Å
104	I	93.2	Very high	90.7	Very high	3 Å²	3	10.8 Å²	10.8	2%	0.015	5%	0.051	C	C	.	.	H	α-helix	trans	-79	-47.3	171.4	-66.7	163.7	0	0	0	109.2	C100 M101 G106 S304 T306 I308 A332 T336 Y340	C100-I104 HydrophobicContact CB-CD1 4.48Å; C100-I104 WeakPolarHBondContact O-CB 3.48Å; C100-I104 WeakPolarHBondContact O-CD1 3.29Å; C100-I104 WeakPolarHBondContact O-CG1 3.49Å; C100-I104 PolarHBondContact O-N 2.96Å; M101-I104 PolarHBondContact O-N 3.2Å; I104-G106 VanDerWaalsContact C-N 3.27Å; I104-G106 PolarHBondContact O-N 3.44Å; I104-S304 WeakPolarHBondContact CG2-O 3.28Å; I104-T306 WeakPolarHBondContact CG1-O 3.32Å; I104-I308 HydrophobicContact CD1-CG2 4.35Å; I104-A332 HydrophobicContact CD1-CB 4.41Å; I104-T336 HydrophobicContact CB-CG2 3.89Å; I104-T336 HydrophobicContact CD1-CG2 4.11Å; I104-T336 HydrophobicContact CG2-CG2 3.6Å; I104-Y340 HydrophobicContact CG2-CE2 4.01Å; I104-Y340 PolarHBondContact O-OH 3.48Å
105	W	92.3	Very high	91.1	Very high	8 Å²	8	7.7 Å²	7.7	3%	0.03	4%	0.036	C	C	.	.	S	Bend	trans	-70.8	79.5	174.4	-69	-29.5	0	0	0	112.2	M101 L109 F244 I247 M248 F251 T336 S339 A420	M101-W105 HydrophobicContact CB-CE3 4.19Å; M101-W105 HydrophobicContact CB-CZ3 4.12Å; M101-W105 HydrophobicContact CE-CH2 3.07Å; M101-W105 HydrophobicContact CE-CZ2 3.6Å; M101-W105 HydrophobicContact CE-CZ3 3.69Å; M101-W105 WeakPolarHBondContact O-CB 3.48Å; M101-W105 PolarHBondContact O-N 3.26Å; W105-L109 HydrophobicContact CB-CD2 4.34Å; W105-L109 HydrophobicContact CG-CD2 4.13Å; W105-F244 HydrophobicContact CH2-CE2 4.35Å; W105-F244 HydrophobicContact CZ3-CD2 4.16Å; W105-F244 AromaticContact CZ3-CE2 3.71Å; W105-F244 HydrophobicContact CZ3-CE2 3.71Å; W105-I247 HydrophobicContact CD2-CG2 4.47Å; W105-I247 HydrophobicContact CE3-CG2 3.87Å; W105-I247 HydrophobicContact CZ3-CG2 4.21Å; W105-M248 HydrophobicContact CE3-CE 4.18Å; W105-M248 HydrophobicContact CH2-CE 3.16Å; W105-M248 HydrophobicContact CH2-SD 4.22Å; W105-M248 HydrophobicContact CZ2-CE 4.17Å; W105-M248 HydrophobicContact CZ3-CE 3.19Å; W105-M248 HydrophobicContact CZ3-SD 4.46Å; W105-F251 AromaticContact CD2-CE2 3.99Å; W105-F251 HydrophobicContact CD2-CE2 3.99Å; W105-F251 HydrophobicContact CD2-CZ 4.13Å; W105-F251 AromaticContact CE2-CE2 3.69Å; W105-F251 HydrophobicContact CE3-CE2 4.21Å; W105-F251 HydrophobicContact CG-CZ 4.37Å; W105-F251 AromaticContact CH2-CE2 3.87Å; W105-F251 HydrophobicContact CH2-CE2 3.87Å; W105-F251 AromaticContact CZ2-CE2 3.65Å; W105-F251 HydrophobicContact CZ2-CE2 3.65Å; W105-F251 HydrophobicContact CZ2-CZ 4.46Å; W105-F251 HydrophobicContact CZ3-CE2 4.16Å; W105-T336 HydrophobicContact CD2-CG2 4.41Å; W105-T336 HydrophobicContact CG-CG2 4.49Å; W105-T336 HydrophobicContact CZ2-CG2 4.37Å; W105-S339 PolarHBondContact NE1-OG 3.01Å; W105-A420 WeakPolarHBondContact O-CB 3.47Å
106	G	86.8	Confident	91.6	Very high	3 Å²	3	7.7 Å²	7.7	3%	0.031	4%	0.036	C	C	.	.			trans	-97.3	-164.2	175.8	0	0	0	0	0	114.3	I104 I108 L109	I104-G106 VanDerWaalsContact C-N 3.27Å; I104-G106 PolarHBondContact O-N 3.44Å; G106-I108 VanDerWaalsContact C-N 3.26Å; G106-I108 PolarHBondContact O-N 3.02Å; G106-L109 WeakPolarHBondContact O-CB 3.43Å; G106-L109 PolarHBondContact O-N 3.32Å
107	V	88.3	Confident	91.7	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.006	4%	0.036	C	C	.	.	H	α-helix	trans	-55.6	-39.1	178.4	64.6	0	0	0	0	113.2	L109 Y110 L111 G191 T421 L481	V107-L109 PolarHBondContact O-N 3.5Å; V107-Y110 PolarHBondContact O-N 3.16Å; V107-Y110 VanDerWaalsContact O-N 3.13Å; V107-L111 HydrophobicContact CG2-CB 4.31Å; V107-L111 HydrophobicContact CG2-CD1 3.43Å; V107-L111 VanDerWaalsContact CG2-CD1 3.43Å; V107-L111 HydrophobicContact CG2-CG 3.95Å; V107-L111 PolarHBondContact O-N 3.09Å; V107-G191 VanDerWaalsContact CG2-CA 3.44Å; V107-T421 HydrophobicContact CB-CG2 3.79Å; V107-T421 HydrophobicContact CG2-CG2 4.07Å; V107-L481 HydrophobicContact CG1-CD1 4.13Å; V107-L481 HydrophobicContact CG1-CD2 4.05Å; V107-L481 HydrophobicContact CG2-CD2 4.16Å
108	I	91.3	Very high	91.7	Very high	3 Å²	3	6.3 Å²	6.3	2%	0.015	3%	0.029	C	C	.	.	H	α-helix	trans	-60.3	-35.1	-172.3	-68.8	159.2	0	0	0	110.8	G106 Y110 R112 L113 I116 M187 I300 F301 P303	G106-I108 VanDerWaalsContact C-N 3.26Å; G106-I108 PolarHBondContact O-N 3.02Å; I108-Y110 VanDerWaalsContact C-N 3.28Å; I108-Y110 PolarHBondContact O-N 2.89Å; I108-R112 HydrophobicContact CG2-CB 4.09Å; I108-R112 CarbonylContact O-C 3.54Å; I108-R112 WeakPolarHBondContact O-CA 3.41Å; I108-R112 PolarHBondContact O-N 3.15Å; I108-L113 PolarHBondContact O-N 3.41Å; I108-I116 HydrophobicContact CG2-CD1 4.42Å; I108-M187 HydrophobicContact CD1-SD 4.29Å; I108-I300 WeakPolarHBondContact CD1-O 3.49Å; I108-F301 HydrophobicContact CG2-CD2 4.34Å; I108-P303 HydrophobicContact CD1-CB 3.7Å; I108-P303 HydrophobicContact CD1-CG 4.09Å
109	L	92	Very high	91.7	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-55.3	-44.9	179	175.7	61.6	0	0	0	112.4	W105 G106 V107 L113 F251 Y340 I343	W105-L109 HydrophobicContact CB-CD2 4.34Å; W105-L109 HydrophobicContact CG-CD2 4.13Å; G106-L109 WeakPolarHBondContact O-CB 3.43Å; G106-L109 PolarHBondContact O-N 3.32Å; V107-L109 PolarHBondContact O-N 3.5Å; L109-L113 HydrophobicContact CD1-CD2 3.84Å; L109-L113 WeakPolarHBondContact O-CB 3.46Å; L109-F251 HydrophobicContact CD2-CE1 3.49Å; L109-F251 VanDerWaalsContact CD2-CE1 3.49Å; L109-F251 HydrophobicContact CD2-CZ 3.31Å; L109-F251 HydrophobicContact CG-CE1 4.48Å; L109-Y340 HydrophobicContact CB-CE1 3.89Å; L109-Y340 HydrophobicContact CD1-CD1 3.38Å; L109-Y340 HydrophobicContact CD1-CE1 3.31Å; L109-Y340 HydrophobicContact CD2-CE1 4.44Å; L109-Y340 HydrophobicContact CG-CE1 4.04Å; L109-I343 HydrophobicContact CD1-CD1 3.71Å
110	Y	91.5	Very high	91.9	Very high	2 Å²	2	4 Å²	4	1%	0.008	2%	0.019	C	C	.	.	H	α-helix	trans	-90.4	-42.2	-173.1	-72.8	-82.6	0	0	0	112.9	V107 I108 S250 F251 L403 I413 I417 A420	V107-Y110 PolarHBondContact O-N 3.16Å; V107-Y110 VanDerWaalsContact O-N 3.13Å; I108-Y110 VanDerWaalsContact C-N 3.28Å; I108-Y110 PolarHBondContact O-N 2.89Å; Y110-S250 WeakPolarHBondContact CE1-OG 3.45Å; Y110-S250 PolarHBondContact OH-OG 2.96Å; Y110-F251 HydrophobicContact CE1-CE1 4.16Å; Y110-F251 HydrophobicContact CE2-CE1 4.28Å; Y110-F251 AromaticContact CZ-CE1 3.65Å; Y110-F251 VanDerWaalsContact OH-CE1 3.24Å; Y110-F251 WeakPolarHBondContact OH-CE1 3.33Å; Y110-L403 HydrophobicContact CD1-CD2 3.7Å; Y110-L403 HydrophobicContact CE1-CD2 4.22Å; Y110-I413 HydrophobicContact CD1-CG2 3.88Å; Y110-I413 HydrophobicContact CE1-CG2 4.11Å; Y110-I417 HydrophobicContact CD1-CG1 3.92Å; Y110-I417 HydrophobicContact CD2-CG1 4.05Å; Y110-I417 HydrophobicContact CG-CD1 4.47Å; Y110-I417 HydrophobicContact CG-CG1 3.58Å; Y110-A420 HydrophobicContact CD2-CB 4.34Å; Y110-A420 HydrophobicContact CE2-CB 4.02Å
111	L	89.1	Confident	92	Very high	1 Å²	1	4 Å²	4	1%	0.005	2%	0.019	C	C	.	.	H	α-helix	trans	-95.8	-23.7	-170.7	-62.6	-173.9	0	0	0	114.3	V107 Y400 Q401 I417	V107-L111 HydrophobicContact CG2-CB 4.31Å; V107-L111 HydrophobicContact CG2-CD1 3.43Å; V107-L111 VanDerWaalsContact CG2-CD1 3.43Å; V107-L111 HydrophobicContact CG2-CG 3.95Å; V107-L111 PolarHBondContact O-N 3.09Å; L111-Y400 WeakPolarHBondContact O-CB 3.45Å; L111-Y400 WeakPolarHBondContact O-CD1 3.26Å; L111-Q401 HydrophobicContact CD2-CG 4.11Å; L111-I417 HydrophobicContact CD2-CD1 4.08Å
112	R	93.1	Very high	92.1	Very high	7 Å²	7	3.4 Å²	3.4	3%	0.026	2%	0.016	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-26.4	-170	-64.6	-61.8	-174.4	-90.8	-5.4	114	I108 W115 I116 E194 Y400 L481 N482	I108-R112 HydrophobicContact CG2-CB 4.09Å; I108-R112 CarbonylContact O-C 3.54Å; I108-R112 WeakPolarHBondContact O-CA 3.41Å; I108-R112 PolarHBondContact O-N 3.15Å; R112-W115 WeakPolarHBondContact O-CB 3.31Å; R112-W115 PolarHBondContact O-N 3.05Å; R112-W115 VanDerWaalsContact O-N 3.15Å; R112-I116 HydrophobicContact CB-CD1 4.31Å; R112-I116 WeakPolarHBondContact O-CD1 3.22Å; R112-I116 VanDerWaalsContact O-CG1 3.28Å; R112-I116 WeakPolarHBondContact O-CG1 3.36Å; R112-I116 PolarHBondContact O-N 3.04Å; R112-E194 IonicContact CZ-OE1 3.51Å; R112-E194 IonicContact CZ-OE2 3.3Å; R112-E194 IonicContact NH1-OE1 3.38Å; R112-E194 PolarHBondContact NH1-OE1 3.19Å; R112-E194 IonicContact NH1-OE2 2.9Å; R112-E194 VanDerWaalsContact NH2-CD 3.34Å; R112-E194 IonicContact NH2-OE1 3.81Å; R112-E194 PolarHBondContact NH2-OE1 2.79Å; R112-E194 IonicContact NH2-OE2 2.84Å; R112-E194 PolarHBondContact NH2-OE2 3.05Å; R112-Y400 VanDerWaalsContact NH1-CD2 3.34Å; R112-L481 HydrophobicContact CG-CD2 4.13Å; R112-N482 PolarHBondContact NE-OD1 3.33Å
113	L	93.6	Very high	92.3	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-56.8	-47.3	177.7	-179	65.7	0	0	0	112.7	I108 L109 W115 I116 T117 T125 I129 F301 Y340 I343	I108-L113 PolarHBondContact O-N 3.41Å; L109-L113 HydrophobicContact CD1-CD2 3.84Å; L109-L113 WeakPolarHBondContact O-CB 3.46Å; L113-W115 VanDerWaalsContact C-N 3.27Å; L113-W115 PolarHBondContact O-N 3.21Å; L113-I116 PolarHBondContact O-N 2.93Å; L113-T117 PolarHBondContact O-N 3.19Å; L113-T117 PolarHBondContact O-OG1 3.42Å; L113-T125 HydrophobicContact CD1-CG2 4.26Å; L113-I129 HydrophobicContact CD1-CD1 4.33Å; L113-F301 HydrophobicContact CD1-CD2 4.36Å; L113-F301 HydrophobicContact CD1-CE2 4Å; L113-Y340 HydrophobicContact CD2-CD1 4Å; L113-I343 HydrophobicContact CD2-CB 4Å; L113-I343 HydrophobicContact CD2-CG2 3.79Å
114	P	93.7	Very high	92.5	Very high	1 Å²	1	6.6 Å²	6.6	1%	0.006	4%	0.036	C	C	.	.	H	α-helix	trans	-59.6	-39.6	176.1	-26.5	37.7	0	0	0	113.3	T117 A118 V347 L403	P114-T117 CarbonylContact O-C 3.48Å; P114-T117 WeakPolarHBondContact O-CB 3.48Å; P114-T117 PolarHBondContact O-N 2.88Å; P114-A118 PolarHBondContact O-N 3.25Å; P114-V347 HydrophobicContact CB-CG1 4.39Å; P114-V347 HydrophobicContact CB-CG2 4.21Å; P114-V347 HydrophobicContact CG-CG2 4.49Å; P114-L403 HydrophobicContact CB-CD1 4.33Å; P114-L403 HydrophobicContact CG-CD1 3.01Å
115	W	93.1	Very high	92.6	Very high	21 Å²	21	6.5 Å²	6.5	8%	0.08	4%	0.035	C	C	.	.	H	α-helix	trans	-68.6	-41.9	-179.9	176.3	79.1	0	0	0	111.1	R112 L113 T117 A118 Q119 M297 I300 S397 Y400	R112-W115 WeakPolarHBondContact O-CB 3.31Å; R112-W115 PolarHBondContact O-N 3.05Å; R112-W115 VanDerWaalsContact O-N 3.15Å; L113-W115 VanDerWaalsContact C-N 3.27Å; L113-W115 PolarHBondContact O-N 3.21Å; W115-T117 VanDerWaalsContact C-N 3.32Å; W115-T117 PolarHBondContact O-N 3.24Å; W115-A118 VanDerWaalsContact O-CB 3.31Å; W115-A118 WeakPolarHBondContact O-CB 3.48Å; W115-A118 PolarHBondContact O-N 3.38Å; W115-A118 VanDerWaalsContact O-N 3.13Å; W115-Q119 HydrophobicContact CD2-CG 4.37Å; W115-Q119 HydrophobicContact CZ2-CG 4.3Å; W115-Q119 VanDerWaalsContact O-CG 3.26Å; W115-Q119 WeakPolarHBondContact O-CG 3.26Å; W115-Q119 PolarHBondContact O-N 2.74Å; W115-Q119 VanDerWaalsContact O-N 3.07Å; W115-M297 HydrophobicContact CE3-SD 4.05Å; W115-M297 HydrophobicContact CH2-CE 3.46Å; W115-M297 VanDerWaalsContact CH2-CE 3.46Å; W115-M297 HydrophobicContact CH2-SD 3.69Å; W115-M297 HydrophobicContact CZ2-CE 3.98Å; W115-M297 HydrophobicContact CZ3-CE 3.86Å; W115-M297 HydrophobicContact CZ3-SD 3.4Å; W115-M297 WeakPolarHBondContact CZ3-SD 3.28Å; W115-I300 HydrophobicContact CH2-CD1 3.97Å; W115-I300 HydrophobicContact CZ3-CD1 3.72Å; W115-S397 PolarHBondContact NE1-O 3.43Å; W115-Y400 HydrophobicContact CB-CD1 3.99Å; W115-Y400 HydrophobicContact CB-CE1 4.05Å; W115-Y400 AromaticContact CD1-CE1 3.58Å; W115-Y400 AromaticContact CD2-CE1 3.92Å; W115-Y400 HydrophobicContact CD2-CE1 3.92Å; W115-Y400 HydrophobicContact CG-CD1 4.03Å; W115-Y400 AromaticContact CG-CE1 3.58Å; W115-Y400 HydrophobicContact CG-CE1 3.58Å; W115-Y400 AromaticContact NE1-CE1 3.89Å
116	I	93.8	Very high	92.8	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.8	-44.4	171.4	-67.3	158	0	0	0	110	I108 R112 L113 A118 Q119 A120 T125 I128 M297 I300 F301	I108-I116 HydrophobicContact CG2-CD1 4.42Å; R112-I116 HydrophobicContact CB-CD1 4.31Å; R112-I116 WeakPolarHBondContact O-CD1 3.22Å; R112-I116 VanDerWaalsContact O-CG1 3.28Å; R112-I116 WeakPolarHBondContact O-CG1 3.36Å; R112-I116 PolarHBondContact O-N 3.04Å; L113-I116 PolarHBondContact O-N 2.93Å; I116-A118 VanDerWaalsContact C-N 3.28Å; I116-A118 PolarHBondContact O-N 2.84Å; I116-Q119 PolarHBondContact O-N 2.91Å; I116-A120 WeakPolarHBondContact O-CB 3.32Å; I116-A120 PolarHBondContact O-N 3.28Å; I116-T125 HydrophobicContact CG2-CG2 4.09Å; I116-I128 HydrophobicContact CG2-CD1 4.46Å; I116-M297 HydrophobicContact CG1-SD 4.15Å; I116-M297 HydrophobicContact CG2-CB 4.17Å; I116-I300 HydrophobicContact CD1-CG2 4.46Å; I116-F301 HydrophobicContact CD1-CB 3.9Å; I116-F301 HydrophobicContact CD1-CD2 4.06Å; I116-F301 HydrophobicContact CD1-CG 4.47Å
117	T	94.2	Very high	93.3	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.2	-36.9	174.8	-54	0	0	0	0	112.3	L113 P114 W115 G121 I122 T125 S344 V347	L113-T117 PolarHBondContact O-N 3.19Å; L113-T117 PolarHBondContact O-OG1 3.42Å; P114-T117 CarbonylContact O-C 3.48Å; P114-T117 WeakPolarHBondContact O-CB 3.48Å; P114-T117 PolarHBondContact O-N 2.88Å; W115-T117 VanDerWaalsContact C-N 3.32Å; W115-T117 PolarHBondContact O-N 3.24Å; T117-G121 CarbonylContact O-C 3.52Å; T117-G121 WeakPolarHBondContact O-CA 3.39Å; T117-G121 PolarHBondContact O-N 3.36Å; T117-I122 HydrophobicContact CG2-CG1 3.94Å; T117-T125 WeakPolarHBondContact CA-OG1 3.43Å; T117-S344 WeakPolarHBondContact CG2-O 3.12Å; T117-S344 WeakPolarHBondContact CG2-OG 3.45Å; T117-S344 PolarHBondContact OG1-OG 3.23Å; T117-V347 HydrophobicContact CG2-CG1 4.33Å
118	A	92.3	Very high	93.7	Very high	2 Å²	2	14 Å²	14	2%	0.017	7%	0.071	C	C	.	.	H	α-helix	trans	-63.8	-45.5	176.7	0	0	0	0	0	112.2	P114 W115 I116 R353 I396	P114-A118 PolarHBondContact O-N 3.25Å; W115-A118 VanDerWaalsContact O-CB 3.31Å; W115-A118 WeakPolarHBondContact O-CB 3.48Å; W115-A118 PolarHBondContact O-N 3.38Å; W115-A118 VanDerWaalsContact O-N 3.13Å; I116-A118 VanDerWaalsContact C-N 3.28Å; I116-A118 PolarHBondContact O-N 2.84Å; A118-R353 PolarHBondContact O-NE 3.01Å; A118-R353 PolarHBondContact O-NH2 3.35Å; A118-I396 HydrophobicContact CB-CB 4.09Å; A118-I396 HydrophobicContact CB-CD1 3.49Å; A118-I396 VanDerWaalsContact CB-CD1 3.49Å; A118-I396 HydrophobicContact CB-CG1 3.46Å; A118-I396 VanDerWaalsContact CB-CG1 3.46Å
119	Q	92.7	Very high	93.9	Very high	4 Å²	4	14 Å²	14	2%	0.019	7%	0.071	C	C	.	.	H	α-helix	trans	-75.6	-54.2	-175.1	-65	-68.3	-33.3	0	0	112.1	W115 I116 P285 D286 W287 R288 M297 S397	W115-Q119 HydrophobicContact CD2-CG 4.37Å; W115-Q119 HydrophobicContact CZ2-CG 4.3Å; W115-Q119 VanDerWaalsContact O-CG 3.26Å; W115-Q119 WeakPolarHBondContact O-CG 3.26Å; W115-Q119 PolarHBondContact O-N 2.74Å; W115-Q119 VanDerWaalsContact O-N 3.07Å; I116-Q119 PolarHBondContact O-N 2.91Å; Q119-P285 WeakPolarHBondContact O-CA 3.44Å; Q119-D286 WeakPolarHBondContact CA-O 3.48Å; Q119-D286 CarbonylContact O-C 3.57Å; Q119-D286 VanDerWaalsContact O-C 3.28Å; Q119-D286 PolarHBondContact O-N 3.01Å; Q119-D286 PolarHBondContact OE1-O 3.49Å; Q119-W287 HydrophobicContact CB-CE3 4.39Å; Q119-R288 PolarHBondContact OE1-O 3.39Å; Q119-M297 HydrophobicContact CB-CE 3.88Å; Q119-M297 HydrophobicContact CB-CG 4.38Å; Q119-M297 HydrophobicContact CB-SD 4.15Å; Q119-M297 HydrophobicContact CG-CE 3.8Å; Q119-M297 HydrophobicContact CG-SD 4.31Å; Q119-S397 PolarHBondContact NE2-OG 3.46Å
120	A	93.2	Very high	94.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-81.8	-16.8	-177.5	0	0	0	0	0	112.5	I116 M124 I128 P285 W287	I116-A120 WeakPolarHBondContact O-CB 3.32Å; I116-A120 PolarHBondContact O-N 3.28Å; A120-M124 HydrophobicContact CB-CB 4.05Å; A120-M124 VanDerWaalsContact O-CB 3.29Å; A120-M124 WeakPolarHBondContact O-CB 3.42Å; A120-I128 HydrophobicContact CB-CD1 4.2Å; A120-P285 VanDerWaalsContact O-CA 3.27Å; A120-P285 WeakPolarHBondContact O-CA 3.32Å; A120-P285 VanDerWaalsContact O-CB 3.27Å; A120-P285 WeakPolarHBondContact O-CB 3.28Å; A120-W287 HydrophobicContact CB-CH2 3.54Å; A120-W287 HydrophobicContact CB-CZ2 4.45Å; A120-W287 HydrophobicContact CB-CZ3 3.8Å
121	G	94.4	Very high	94.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	74.3	164.5	-167.7	0	0	0	0	0	111.8	T117 G123 T125 N282	T117-G121 CarbonylContact O-C 3.52Å; T117-G121 WeakPolarHBondContact O-CA 3.39Å; T117-G121 PolarHBondContact O-N 3.36Å; G121-G123 VanDerWaalsContact C-N 3.34Å; G121-G123 PolarHBondContact O-N 3.21Å; G121-T125 VanDerWaalsContact O-CB 3.24Å; G121-T125 WeakPolarHBondContact O-CB 3.5Å; G121-T125 PolarHBondContact O-N 3.49Å; G121-T125 PolarHBondContact O-OG1 3.35Å; G121-N282 CarbonylContact C-O 3.59Å; G121-N282 WeakPolarHBondContact CA-O 3.48Å
122	I	95.1	Very high	94.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.7	-45.4	-176.1	-59.1	169.3	0	0	0	110.8	T117 T125 W126 F279 N282 F283	T117-I122 HydrophobicContact CG2-CG1 3.94Å; I122-T125 PolarHBondContact O-N 3.07Å; I122-W126 HydrophobicContact CG2-CZ2 4.42Å; I122-W126 PolarHBondContact O-N 3.49Å; I122-W126 VanDerWaalsContact O-N 3.07Å; I122-F279 HydrophobicContact CD1-CD2 3.45Å; I122-F279 VanDerWaalsContact CD1-CD2 3.45Å; I122-F279 HydrophobicContact CD1-CE2 3.59Å; I122-F279 HydrophobicContact CD1-CG 4.32Å; I122-F279 HydrophobicContact CG2-CE2 4.35Å; I122-N282 HydrophobicContact CD1-CB 4.25Å; I122-N282 HydrophobicContact CG1-CB 4.46Å; I122-N282 PolarHBondContact N-O 2.99Å; I122-F283 HydrophobicContact CB-CD2 4.36Å; I122-F283 PolarHBondContact N-O 2.95Å
123	G	94.5	Very high	94.8	Very high	17 Å²	17	21.1 Å²	21.1	18%	0.175	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-53.1	-176.2	0	0	0	0	0	113	G121 T125 W126 V127 F283	G121-G123 VanDerWaalsContact C-N 3.34Å; G121-G123 PolarHBondContact O-N 3.21Å; G123-T125 VanDerWaalsContact C-N 3.33Å; G123-T125 PolarHBondContact O-N 3.49Å; G123-W126 WeakPolarHBondContact O-CB 3.42Å; G123-W126 PolarHBondContact O-N 3.07Å; G123-V127 PolarHBondContact O-N 3.01Å; G123-F283 PolarHBondContact N-O 3.33Å
124	M	94.9	Very high	94.9	Very high	66 Å²	66	24.9 Å²	24.9	33%	0.325	13%	0.134	S	C	.	.	H	α-helix	trans	-71.8	-28.3	180	-62.5	-64.7	-66.2	0	0	112.4	A120 W126 V127 I128 P285 F294	A120-M124 HydrophobicContact CB-CB 4.05Å; A120-M124 VanDerWaalsContact O-CB 3.29Å; A120-M124 WeakPolarHBondContact O-CB 3.42Å; M124-W126 VanDerWaalsContact C-N 3.32Å; M124-W126 PolarHBondContact O-N 3.25Å; M124-V127 WeakPolarHBondContact O-CB 3.47Å; M124-V127 PolarHBondContact O-N 3.08Å; M124-V127 VanDerWaalsContact O-N 3.15Å; M124-I128 WeakPolarHBondContact O-CG1 3.28Å; M124-I128 PolarHBondContact O-N 3.04Å; M124-P285 HydrophobicContact CG-CG 4.44Å; M124-F294 HydrophobicContact CE-CD2 3.39Å; M124-F294 HydrophobicContact CE-CE2 3.55Å; M124-F294 HydrophobicContact CE-CG 4.39Å
125	T	95.7	Very high	95	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-41	173.1	-59.2	0	0	0	0	111.2	L113 I116 T117 G121 I122 G123 V127 I128 I129 S344	L113-T125 HydrophobicContact CD1-CG2 4.26Å; I116-T125 HydrophobicContact CG2-CG2 4.09Å; T117-T125 WeakPolarHBondContact CA-OG1 3.43Å; G121-T125 VanDerWaalsContact O-CB 3.24Å; G121-T125 WeakPolarHBondContact O-CB 3.5Å; G121-T125 PolarHBondContact O-N 3.49Å; G121-T125 PolarHBondContact O-OG1 3.35Å; I122-T125 PolarHBondContact O-N 3.07Å; G123-T125 VanDerWaalsContact C-N 3.33Å; G123-T125 PolarHBondContact O-N 3.49Å; T125-V127 VanDerWaalsContact C-N 3.3Å; T125-V127 PolarHBondContact O-N 3.25Å; T125-I128 WeakPolarHBondContact O-CB 3.42Å; T125-I128 PolarHBondContact O-N 2.96Å; T125-I129 HydrophobicContact CG2-CD1 3.89Å; T125-I129 HydrophobicContact CG2-CG1 4.44Å; T125-I129 VanDerWaalsContact O-CG1 3.29Å; T125-I129 WeakPolarHBondContact O-CG1 3.47Å; T125-I129 PolarHBondContact O-N 2.94Å; T125-S344 WeakPolarHBondContact CG2-OG 3.41Å
126	W	96.4	Very high	95.1	Very high	99 Å²	99	24.1 Å²	24.1	38%	0.375	13%	0.131	S	C	.	.	H	α-helix	trans	-61.2	-39	172.3	-74.1	6.3	0	0	0	112.3	I122 G123 M124 I128 I129 L130 L341 A345	I122-W126 HydrophobicContact CG2-CZ2 4.42Å; I122-W126 PolarHBondContact O-N 3.49Å; I122-W126 VanDerWaalsContact O-N 3.07Å; G123-W126 WeakPolarHBondContact O-CB 3.42Å; G123-W126 PolarHBondContact O-N 3.07Å; M124-W126 VanDerWaalsContact C-N 3.32Å; M124-W126 PolarHBondContact O-N 3.25Å; W126-I128 PolarHBondContact O-N 3.19Å; W126-I129 PolarHBondContact O-N 3.21Å; W126-L130 VanDerWaalsContact O-CB 3.31Å; W126-L130 WeakPolarHBondContact O-CB 3.43Å; W126-L130 WeakPolarHBondContact O-CG 3.29Å; W126-L130 PolarHBondContact O-N 3.2Å; W126-L341 HydrophobicContact CB-CD2 3.97Å; W126-L341 VanDerWaalsContact CD1-CD2 3.49Å; W126-L341 HydrophobicContact CD2-CD2 4.17Å; W126-L341 HydrophobicContact CG-CD2 3.62Å; W126-L341 PolarHBondContact NE1-O 3.37Å; W126-A345 HydrophobicContact CZ2-CB 3.87Å
127	V	96.6	Very high	95.2	Very high	71 Å²	71	25 Å²	25	43%	0.43	14%	0.139	S	C	.	.	H	α-helix	trans	-61.5	-43.2	173.8	177.8	0	0	0	0	111.2	G123 M124 T125 L130 L131 F294	G123-V127 PolarHBondContact O-N 3.01Å; M124-V127 WeakPolarHBondContact O-CB 3.47Å; M124-V127 PolarHBondContact O-N 3.08Å; M124-V127 VanDerWaalsContact O-N 3.15Å; T125-V127 VanDerWaalsContact C-N 3.3Å; T125-V127 PolarHBondContact O-N 3.25Å; V127-L130 PolarHBondContact O-N 3.19Å; V127-L131 WeakPolarHBondContact O-CB 3.43Å; V127-L131 PolarHBondContact O-N 3.45Å; V127-F294 HydrophobicContact CG1-CE2 4.17Å; V127-F294 HydrophobicContact CG1-CZ 4.12Å
128	I	96	Very high	95.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-45.8	176.5	-68.5	169.1	0	0	0	111	I116 A120 M124 T125 W126 S132 F294 M297 F298 F301	I116-I128 HydrophobicContact CG2-CD1 4.46Å; A120-I128 HydrophobicContact CB-CD1 4.2Å; M124-I128 WeakPolarHBondContact O-CG1 3.28Å; M124-I128 PolarHBondContact O-N 3.04Å; T125-I128 WeakPolarHBondContact O-CB 3.42Å; T125-I128 PolarHBondContact O-N 2.96Å; W126-I128 PolarHBondContact O-N 3.19Å; I128-S132 WeakPolarHBondContact O-CB 3.39Å; I128-S132 PolarHBondContact O-N 3.27Å; I128-S132 PolarHBondContact O-OG 2.9Å; I128-F294 HydrophobicContact CD1-CD2 4.23Å; I128-F294 HydrophobicContact CD1-CE2 4.17Å; I128-F294 HydrophobicContact CG1-CD2 4.05Å; I128-F294 HydrophobicContact CG1-CE2 3.5Å; I128-F294 VanDerWaalsContact CG1-CE2 3.5Å; I128-F294 HydrophobicContact CG1-CZ 3.93Å; I128-M297 HydrophobicContact CD1-CB 3.88Å; I128-F298 HydrophobicContact CG2-CB 4.36Å; I128-F298 HydrophobicContact CG2-CD2 4.12Å; I128-F301 HydrophobicContact CG2-CB 3.79Å; I128-F301 HydrophobicContact CG2-CD1 3.62Å; I128-F301 HydrophobicContact CG2-CE1 4.48Å; I128-F301 HydrophobicContact CG2-CG 3.8Å
129	I	96.6	Very high	95.5	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-49.1	178.4	-67	162.5	0	0	0	110.5	L113 T125 W126 S132 S133 F301 T337 L341	L113-I129 HydrophobicContact CD1-CD1 4.33Å; T125-I129 HydrophobicContact CG2-CD1 3.89Å; T125-I129 HydrophobicContact CG2-CG1 4.44Å; T125-I129 VanDerWaalsContact O-CG1 3.29Å; T125-I129 WeakPolarHBondContact O-CG1 3.47Å; T125-I129 PolarHBondContact O-N 2.94Å; W126-I129 PolarHBondContact O-N 3.21Å; I129-S132 PolarHBondContact O-N 3.37Å; I129-S133 VanDerWaalsContact O-CB 3.28Å; I129-S133 WeakPolarHBondContact O-CB 3.42Å; I129-S133 PolarHBondContact O-N 3.39Å; I129-F301 HydrophobicContact CB-CE1 4.33Å; I129-F301 HydrophobicContact CB-CZ 4.22Å; I129-F301 HydrophobicContact CG1-CE1 3.95Å; I129-F301 HydrophobicContact CG1-CE2 3.93Å; I129-F301 HydrophobicContact CG1-CZ 3.51Å; I129-F301 HydrophobicContact CG2-CZ 4.42Å; I129-T337 HydrophobicContact CG2-CG2 3.93Å; I129-L341 HydrophobicContact CB-CD2 4.13Å; I129-L341 HydrophobicContact CD1-CD2 4.07Å; I129-L341 HydrophobicContact CG2-CD2 3.9Å; I129-L341 HydrophobicContact CG2-CG 4.13Å
130	L	96.3	Very high	95.6	Very high	87 Å²	87	25.4 Å²	25.4	46%	0.455	14%	0.141	S	C	.	.	H	α-helix	trans	-67.1	-38.4	-178.2	-70.7	173.5	0	0	0	112.3	W126 V127 S133 T134 L341	W126-L130 VanDerWaalsContact O-CB 3.31Å; W126-L130 WeakPolarHBondContact O-CB 3.43Å; W126-L130 WeakPolarHBondContact O-CG 3.29Å; W126-L130 PolarHBondContact O-N 3.2Å; V127-L130 PolarHBondContact O-N 3.19Å; L130-S133 PolarHBondContact O-N 3.2Å; L130-T134 WeakPolarHBondContact O-CB 3.47Å; L130-T134 PolarHBondContact O-N 2.77Å; L130-T134 PolarHBondContact O-OG1 2.97Å; L130-L341 HydrophobicContact CD2-CD1 4.36Å
131	L	95.8	Very high	95.7	Very high	50 Å²	50	26.9 Å²	26.9	26%	0.262	15%	0.149	S	C	.	.	H	α-helix	trans	-61.4	-47.5	173.9	178.7	60.7	0	0	0	110.7	V127 T134 I135 F298 I536	V127-L131 WeakPolarHBondContact O-CB 3.43Å; V127-L131 PolarHBondContact O-N 3.45Å; L131-T134 PolarHBondContact O-N 3.18Å; L131-I135 HydrophobicContact CD1-CD1 4.44Å; L131-I135 HydrophobicContact CG-CD1 4.37Å; L131-I135 WeakPolarHBondContact O-CG1 3.35Å; L131-I135 PolarHBondContact O-N 2.84Å; L131-I135 VanDerWaalsContact O-N 3.1Å; L131-F298 HydrophobicContact CB-CE2 4.34Å; L131-F298 HydrophobicContact CD2-CD2 3.94Å; L131-F298 HydrophobicContact CD2-CE2 3.68Å; L131-F298 HydrophobicContact CG-CD2 4.49Å; L131-F298 HydrophobicContact CG-CE2 3.84Å; L131-I536 HydrophobicContact CD1-CD1 4.44Å; L131-I536 HydrophobicContact CD2-CD1 4.23Å; L131-I536 HydrophobicContact CG-CD1 4.46Å
132	S	95.7	Very high	95.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-44.8	177.9	-56.2	0	0	0	0	111.6	I128 I129 T134 I135 T136 F298	I128-S132 WeakPolarHBondContact O-CB 3.39Å; I128-S132 PolarHBondContact O-N 3.27Å; I128-S132 PolarHBondContact O-OG 2.9Å; I129-S132 PolarHBondContact O-N 3.37Å; S132-T134 VanDerWaalsContact C-N 3.31Å; S132-T134 PolarHBondContact O-N 2.98Å; S132-I135 PolarHBondContact O-N 3.49Å; S132-T136 WeakPolarHBondContact O-CG2 3.31Å; S132-T136 PolarHBondContact O-N 3.42Å; S132-T136 PolarHBondContact O-OG1 2.91Å; S132-T136 VanDerWaalsContact O-OG1 3.06Å; S132-F298 VanDerWaalsContact OG-CE2 3.31Å; S132-F298 WeakPolarHBondContact OG-CE2 3.43Å
133	S	95.6	Very high	95.6	Very high	23 Å²	23	27.4 Å²	27.4	16%	0.161	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-34.4	176.8	-172.1	0	0	0	0	112.6	I129 L130 T136 G137 T337	I129-S133 VanDerWaalsContact O-CB 3.28Å; I129-S133 WeakPolarHBondContact O-CB 3.42Å; I129-S133 PolarHBondContact O-N 3.39Å; L130-S133 PolarHBondContact O-N 3.2Å; S133-T136 WeakPolarHBondContact CA-OG1 3.49Å; S133-T136 PolarHBondContact O-OG1 3.49Å; S133-G137 WeakPolarHBondContact O-CA 3.17Å; S133-G137 PolarHBondContact O-N 3.37Å; S133-T337 WeakPolarHBondContact CB-OG1 3.48Å; S133-T337 WeakPolarHBondContact OG-CG2 3.3Å; S133-T337 PolarHBondContact OG-OG1 3.4Å
134	T	95.7	Very high	95.5	Very high	79 Å²	79	26.7 Å²	26.7	49%	0.485	15%	0.145	S	C	.	.	H	α-helix	trans	-67.7	-45	175.6	-58	0	0	0	0	111	L130 L131 S132 G137 I138	L130-T134 WeakPolarHBondContact O-CB 3.47Å; L130-T134 PolarHBondContact O-N 2.77Å; L130-T134 PolarHBondContact O-OG1 2.97Å; L131-T134 PolarHBondContact O-N 3.18Å; S132-T134 VanDerWaalsContact C-N 3.31Å; S132-T134 PolarHBondContact O-N 2.98Å; T134-G137 PolarHBondContact O-N 3.14Å; T134-I138 HydrophobicContact CG2-CD1 3.9Å; T134-I138 HydrophobicContact CG2-CG1 4.49Å; T134-I138 VanDerWaalsContact O-CG1 3.28Å; T134-I138 WeakPolarHBondContact O-CG1 3.34Å; T134-I138 PolarHBondContact O-N 3.5Å
135	I	96.3	Very high	95.4	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.015	13%	0.129	C	C	.	.	H	α-helix	trans	-60.2	-48.8	177	-67.7	164.5	0	0	0	110.5	L131 S132 T139 F298 F302 L493 Y496 I532 C533 I536	L131-I135 HydrophobicContact CD1-CD1 4.44Å; L131-I135 HydrophobicContact CG-CD1 4.37Å; L131-I135 WeakPolarHBondContact O-CG1 3.35Å; L131-I135 PolarHBondContact O-N 2.84Å; L131-I135 VanDerWaalsContact O-N 3.1Å; S132-I135 PolarHBondContact O-N 3.49Å; I135-T139 WeakPolarHBondContact O-CB 3.48Å; I135-T139 PolarHBondContact O-N 2.69Å; I135-T139 PolarHBondContact O-OG1 2.87Å; I135-F298 HydrophobicContact CD1-CZ 4.08Å; I135-F302 HydrophobicContact CB-CE2 4.48Å; I135-F302 HydrophobicContact CD1-CE2 4.28Å; I135-F302 HydrophobicContact CG2-CE2 4.14Å; I135-F302 HydrophobicContact CG2-CZ 4.31Å; I135-L493 HydrophobicContact CD1-CD2 4.44Å; I135-L493 HydrophobicContact CG2-CD2 4.42Å; I135-Y496 HydrophobicContact CG2-CD2 4.48Å; I135-I532 HydrophobicContact CD1-CG2 4.34Å; I135-I532 HydrophobicContact CG1-CG2 4.3Å; I135-C533 VanDerWaalsContact CG2-SG 3.58Å; I135-I536 HydrophobicContact CD1-CD1 3.53Å
136	T	95.7	Very high	95.2	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.018	13%	0.13	C	C	.	.	H	α-helix	trans	-73.8	-33.1	-177.6	58.4	0	0	0	0	111.8	S132 S133 T139 G140 A305 I308 Y496	S132-T136 WeakPolarHBondContact O-CG2 3.31Å; S132-T136 PolarHBondContact O-N 3.42Å; S132-T136 PolarHBondContact O-OG1 2.91Å; S132-T136 VanDerWaalsContact O-OG1 3.06Å; S133-T136 WeakPolarHBondContact CA-OG1 3.49Å; S133-T136 PolarHBondContact O-OG1 3.49Å; T136-T139 PolarHBondContact O-N 3.38Å; T136-G140 PolarHBondContact O-N 3.33Å; T136-A305 HydrophobicContact CG2-CB 4.02Å; T136-A305 VanDerWaalsContact CG2-O 3.29Å; T136-A305 WeakPolarHBondContact CG2-O 3.42Å; T136-I308 WeakPolarHBondContact O-CD1 3.41Å; T136-Y496 HydrophobicContact CG2-CE2 4.16Å
137	G	95.9	Very high	94.9	Very high	17 Å²	17	19 Å²	19	18%	0.175	11%	0.113	C	C	.	.	H	α-helix	trans	-61.4	-51.9	172.4	0	0	0	0	0	112.1	S133 T134 T139 G140 L141	S133-G137 WeakPolarHBondContact O-CA 3.17Å; S133-G137 PolarHBondContact O-N 3.37Å; T134-G137 PolarHBondContact O-N 3.14Å; G137-T139 VanDerWaalsContact C-N 3.33Å; G137-T139 PolarHBondContact O-N 3.4Å; G137-G140 CarbonylContact O-C 3.56Å; G137-G140 WeakPolarHBondContact O-CA 3.34Å; G137-G140 PolarHBondContact O-N 3.44Å; G137-G140 VanDerWaalsContact O-N 3.1Å; G137-L141 WeakPolarHBondContact O-CG 3.46Å; G137-L141 PolarHBondContact O-N 3.03Å
138	I	96.6	Very high	94.6	Very high	15 Å²	15	16.4 Å²	16.4	8%	0.077	10%	0.097	C	C	.	.	H	α-helix	trans	-62.5	-42.3	176.5	-63.2	167.2	0	0	0	110.7	T134 G140 L141 S142 L525 C529	T134-I138 HydrophobicContact CG2-CD1 3.9Å; T134-I138 HydrophobicContact CG2-CG1 4.49Å; T134-I138 VanDerWaalsContact O-CG1 3.28Å; T134-I138 WeakPolarHBondContact O-CG1 3.34Å; T134-I138 PolarHBondContact O-N 3.5Å; I138-G140 VanDerWaalsContact C-N 3.26Å; I138-G140 PolarHBondContact O-N 3.3Å; I138-L141 WeakPolarHBondContact O-CB 3.34Å; I138-L141 PolarHBondContact O-N 3.46Å; I138-L141 VanDerWaalsContact O-N 3.1Å; I138-S142 PolarHBondContact O-N 3.3Å; I138-S142 PolarHBondContact O-OG 2.95Å; I138-L525 HydrophobicContact CD1-CD1 3.68Å; I138-L525 HydrophobicContact CD1-CG 3.95Å; I138-L525 HydrophobicContact CG1-CD1 4.1Å; I138-L525 HydrophobicContact CG1-CD2 4.07Å; I138-L525 HydrophobicContact CG1-CG 3.89Å; I138-L525 HydrophobicContact CG2-CD2 4.43Å; I138-L525 HydrophobicContact CG2-CG 3.89Å; I138-C529 HydrophobicContact CB-CB 3.97Å; I138-C529 HydrophobicContact CD1-CB 4.04Å; I138-C529 HydrophobicContact CG2-CB 3.46Å; I138-C529 VanDerWaalsContact CG2-CB 3.46Å
139	T	95.9	Very high	94.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.5	-34.1	175.5	-52.5	0	0	0	0	111.8	I135 T136 G137 S142 T143 I308 Y496 I499 N500	I135-T139 WeakPolarHBondContact O-CB 3.48Å; I135-T139 PolarHBondContact O-N 2.69Å; I135-T139 PolarHBondContact O-OG1 2.87Å; T136-T139 PolarHBondContact O-N 3.38Å; G137-T139 VanDerWaalsContact C-N 3.33Å; G137-T139 PolarHBondContact O-N 3.4Å; T139-S142 PolarHBondContact O-N 2.97Å; T139-T143 WeakPolarHBondContact O-CB 3.5Å; T139-T143 PolarHBondContact O-N 2.91Å; T139-T143 PolarHBondContact O-OG1 3.37Å; T139-I308 HydrophobicContact CG2-CD1 3.96Å; T139-Y496 HydrophobicContact CG2-CD1 3.73Å; T139-Y496 HydrophobicContact CG2-CE1 4.37Å; T139-Y496 HydrophobicContact CG2-CG 3.86Å; T139-I499 HydrophobicContact CG2-CG2 4.42Å; T139-N500 PolarHBondContact OG1-ND2 2.88Å
140	G	95.1	Very high	93.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-39.1	171.5	0	0	0	0	0	112.6	T136 G137 I138 T143 S144	T136-G140 PolarHBondContact O-N 3.33Å; G137-G140 CarbonylContact O-C 3.56Å; G137-G140 WeakPolarHBondContact O-CA 3.34Å; G137-G140 PolarHBondContact O-N 3.44Å; G137-G140 VanDerWaalsContact O-N 3.1Å; I138-G140 VanDerWaalsContact C-N 3.26Å; I138-G140 PolarHBondContact O-N 3.3Å; G140-T143 PolarHBondContact O-N 3.49Å; G140-S144 WeakPolarHBondContact O-CB 3.38Å; G140-S144 PolarHBondContact O-N 3.06Å; G140-S144 PolarHBondContact O-OG 2.91Å
141	L	95.1	Very high	92.1	Very high	32 Å²	32	24.6 Å²	24.6	17%	0.168	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-44.6	172.3	-59.2	173.4	0	0	0	111.3	G137 I138 T143 S144 A145 L330 F518 F520 L525	G137-L141 WeakPolarHBondContact O-CG 3.46Å; G137-L141 PolarHBondContact O-N 3.03Å; I138-L141 WeakPolarHBondContact O-CB 3.34Å; I138-L141 PolarHBondContact O-N 3.46Å; I138-L141 VanDerWaalsContact O-N 3.1Å; L141-T143 PolarHBondContact O-N 3Å; L141-S144 WeakPolarHBondContact O-CB 3.46Å; L141-S144 PolarHBondContact O-N 3.06Å; L141-A145 PolarHBondContact O-N 3.29Å; L141-L330 HydrophobicContact CD2-CD1 4Å; L141-L330 HydrophobicContact CD2-CD2 4.03Å; L141-F518 HydrophobicContact CB-CE1 4.45Å; L141-F518 HydrophobicContact CD2-CE1 3.63Å; L141-F518 HydrophobicContact CD2-CZ 4.09Å; L141-F520 HydrophobicContact CD2-CB 4.11Å; L141-L525 HydrophobicContact CD1-CD2 4.01Å
142	S	95.1	Very high	90.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.6	-41	175.6	-64.5	0	0	0	0	112.1	I138 T139 S144 A145 I146 N500 S526	I138-S142 PolarHBondContact O-N 3.3Å; I138-S142 PolarHBondContact O-OG 2.95Å; T139-S142 PolarHBondContact O-N 2.97Å; S142-S144 VanDerWaalsContact C-N 3.32Å; S142-S144 PolarHBondContact O-N 3.34Å; S142-A145 WeakPolarHBondContact O-CB 3.34Å; S142-A145 PolarHBondContact O-N 3.36Å; S142-I146 WeakPolarHBondContact O-CG1 3.42Å; S142-I146 PolarHBondContact O-N 3Å; S142-N500 VanDerWaalsContact CB-OD1 3.25Å; S142-N500 WeakPolarHBondContact CB-OD1 3.4Å; S142-N500 PolarHBondContact OG-OD1 3.31Å; S142-S526 PolarHBondContact OG-OG 2.84Å
143	T	92.5	Very high	88.9	Confident	11 Å²	11	30.7 Å²	30.7	7%	0.067	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-37.3	175.2	-55.5	0	0	0	0	111.2	T139 G140 L141 A145 I146 A147 L309	T139-T143 WeakPolarHBondContact O-CB 3.5Å; T139-T143 PolarHBondContact O-N 2.91Å; T139-T143 PolarHBondContact O-OG1 3.37Å; G140-T143 PolarHBondContact O-N 3.49Å; L141-T143 PolarHBondContact O-N 3Å; T143-A145 VanDerWaalsContact C-N 3.33Å; T143-I146 PolarHBondContact O-N 2.82Å; T143-A147 WeakPolarHBondContact O-CB 3.35Å; T143-A147 PolarHBondContact O-N 2.68Å; T143-L309 HydrophobicContact CG2-CD2 3.49Å; T143-L309 VanDerWaalsContact CG2-CD2 3.49Å
144	S	92.9	Very high	87.3	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-65.4	-37.2	174.4	-60.1	0	0	0	0	111.8	G140 L141 S142 A147 T148 P326	G140-S144 WeakPolarHBondContact O-CB 3.38Å; G140-S144 PolarHBondContact O-N 3.06Å; G140-S144 PolarHBondContact O-OG 2.91Å; L141-S144 WeakPolarHBondContact O-CB 3.46Å; L141-S144 PolarHBondContact O-N 3.06Å; S142-S144 VanDerWaalsContact C-N 3.32Å; S142-S144 PolarHBondContact O-N 3.34Å; S144-A147 PolarHBondContact O-N 3.44Å; S144-T148 WeakPolarHBondContact O-CB 3.28Å; S144-T148 WeakPolarHBondContact O-CG2 3.28Å; S144-T148 PolarHBondContact O-N 2.95Å; S144-T148 PolarHBondContact O-OG1 2.85Å; S144-P326 WeakPolarHBondContact OG-CA 3.34Å; S144-P326 WeakPolarHBondContact OG-CB 3.46Å
145	A	92.9	Very high	85.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-43.2	172.2	0	0	0	0	0	111.6	L141 S142 T143 T148 N149 W514 P516 Y521	L141-A145 PolarHBondContact O-N 3.29Å; S142-A145 WeakPolarHBondContact O-CB 3.34Å; S142-A145 PolarHBondContact O-N 3.36Å; T143-A145 VanDerWaalsContact C-N 3.33Å; A145-T148 PolarHBondContact O-N 2.8Å; A145-T148 PolarHBondContact O-OG1 2.9Å; A145-T148 VanDerWaalsContact O-OG1 3.11Å; A145-N149 PolarHBondContact O-N 3.03Å; A145-W514 HydrophobicContact CB-CH2 4.36Å; A145-W514 HydrophobicContact CB-CZ2 4.3Å; A145-P516 HydrophobicContact CB-CB 3.81Å; A145-Y521 HydrophobicContact CB-CD1 4.13Å; A145-Y521 HydrophobicContact CB-CD2 3.51Å; A145-Y521 HydrophobicContact CB-CE2 3.99Å; A145-Y521 HydrophobicContact CB-CG 3.59Å
146	I	91.4	Very high	85.1	Confident	4 Å²	4	30 Å²	30	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-48.8	174	-64.5	166.8	0	0	0	110.7	S142 T143 T148 N149 L160 I161 L165 I499 W514	S142-I146 WeakPolarHBondContact O-CG1 3.42Å; S142-I146 PolarHBondContact O-N 3Å; T143-I146 PolarHBondContact O-N 2.82Å; I146-T148 PolarHBondContact O-N 2.8Å; I146-N149 WeakPolarHBondContact O-CB 3.44Å; I146-N149 PolarHBondContact O-N 3.27Å; I146-L160 HydrophobicContact CG2-CB 4.3Å; I146-L160 WeakPolarHBondContact CG2-O 3.4Å; I146-I161 HydrophobicContact CD1-CG1 4.38Å; I146-L165 HydrophobicContact CD1-CD1 4.03Å; I146-I499 HydrophobicContact CD1-CG2 4.02Å; I146-W514 HydrophobicContact CG1-CH2 3.85Å; I146-W514 HydrophobicContact CG1-CZ3 4.05Å
147	A	89.8	Confident	84.5	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-66.4	-18.7	-177.6	0	0	0	0	0	113.8	T143 S144 V152 I325	T143-A147 WeakPolarHBondContact O-CB 3.35Å; T143-A147 PolarHBondContact O-N 2.68Å; S144-A147 PolarHBondContact O-N 3.44Å; A147-V152 VanDerWaalsContact O-CG2 3.24Å; A147-V152 WeakPolarHBondContact O-CG2 3.49Å; A147-I325 HydrophobicContact CB-CB 4.13Å; A147-I325 HydrophobicContact CB-CD1 4.04Å; A147-I325 HydrophobicContact CB-CG2 3.98Å
148	T	89.5	Confident	84	Confident	15 Å²	15	29.2 Å²	29.2	9%	0.092	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-0	176	54.4	0	0	0	0	113.1	S144 A145 I146 G150 T322 P326 S517 F518	S144-T148 WeakPolarHBondContact O-CB 3.28Å; S144-T148 WeakPolarHBondContact O-CG2 3.28Å; S144-T148 PolarHBondContact O-N 2.95Å; S144-T148 PolarHBondContact O-OG1 2.85Å; A145-T148 PolarHBondContact O-N 2.8Å; A145-T148 PolarHBondContact O-OG1 2.9Å; A145-T148 VanDerWaalsContact O-OG1 3.11Å; I146-T148 PolarHBondContact O-N 2.8Å; T148-G150 PolarHBondContact O-N 2.85Å; T148-T322 WeakPolarHBondContact CG2-O 3.4Å; T148-P326 HydrophobicContact CG2-CG 4.24Å; T148-S517 WeakPolarHBondContact CB-OG 3.28Å; T148-F518 HydrophobicContact CG2-CB 4.16Å; T148-F518 WeakPolarHBondContact OG1-CB 3.41Å; T148-F518 PolarHBondContact OG1-N 3.07Å
149	N	86.6	Confident	83.4	Confident	19 Å²	19	31 Å²	31	10%	0.102	18%	0.181	C	C	.	.	S	Bend	trans	-87.1	85.9	177.6	-171.4	38.3	0	0	0	110.8	A145 I146 G513 W514 R515	A145-N149 PolarHBondContact O-N 3.03Å; I146-N149 WeakPolarHBondContact O-CB 3.44Å; I146-N149 PolarHBondContact O-N 3.27Å; N149-G513 PolarHBondContact ND2-O 3.13Å; N149-G513 PolarHBondContact OD1-O 3.39Å; N149-W514 HydrophobicContact CB-CE3 4.46Å; N149-W514 HydrophobicContact CB-CZ3 4.42Å; N149-R515 PolarHBondContact OD1-N 2.78Å
150	G	77.6	Confident	82.8	Confident	49 Å²	49	31.6 Å²	31.6	51%	0.505	18%	0.184	S	C	.	.	S	Bend	trans	87.8	-174.8	179.1	0	0	0	0	0	114.7	T148 V152	T148-G150 PolarHBondContact O-N 2.85Å; G150-V152 PolarHBondContact O-N 3.45Å
151	K	72.4	Confident	82.3	Confident	195 Å²	195	32 Å²	32	85%	0.848	19%	0.187	S	C	*	.			trans	-78.4	113.7	177.6	-75.9	-173.3	178.1	178	0	109.8	K153	K151-K153 PolarHBondContact O-N 3.21Å; K151-K153 VanDerWaalsContact O-N 3.1Å
152	V	67.4	Low	81.8	Confident	26 Å²	26	30.5 Å²	30.5	16%	0.158	18%	0.179	C	C	.	.			trans	-71	101.8	173.7	177.7	0	0	0	0	109.2	A147 G150 L160 P321 T322	A147-V152 VanDerWaalsContact O-CG2 3.24Å; A147-V152 WeakPolarHBondContact O-CG2 3.49Å; G150-V152 PolarHBondContact O-N 3.45Å; V152-L160 HydrophobicContact CB-CD2 3.96Å; V152-L160 HydrophobicContact CG1-CD2 3.4Å; V152-L160 VanDerWaalsContact CG1-CD2 3.4Å; V152-L160 HydrophobicContact CG1-CG 4.18Å; V152-L160 HydrophobicContact CG2-CD2 3.45Å; V152-L160 VanDerWaalsContact CG2-CD2 3.45Å; V152-P321 HydrophobicContact CB-CB 4.05Å; V152-P321 HydrophobicContact CB-CG 3.67Å; V152-P321 HydrophobicContact CG1-CB 3.87Å; V152-P321 HydrophobicContact CG1-CG 3.84Å; V152-P321 HydrophobicContact CG2-CB 4.46Å; V152-P321 HydrophobicContact CG2-CG 4.41Å; V152-T322 HydrophobicContact CG2-CG2 4.2Å
153	K	57.7	Low	81.3	Confident	152 Å²	152	35.3 Å²	35.3	66%	0.661	20%	0.197	S	C	*	.			trans	-82.5	150.5	166.5	-64.8	-172.1	177.5	-174.9	0	109.3	K151 G155 F159	K151-K153 PolarHBondContact O-N 3.21Å; K151-K153 VanDerWaalsContact O-N 3.1Å; K153-G155 PolarHBondContact O-N 2.93Å; K153-F159 HydrophobicContact CB-CE1 4.22Å
154	G	60.7	Low	80.8	Confident	52 Å²	52	35.7 Å²	35.7	54%	0.536	20%	0.2	S	C	.	.	S	Bend	trans	-55	135.1	-177.4	0	0	0	0	0	112.7
155	G	65.9	Low	80.2	Confident	28 Å²	28	35.8 Å²	35.8	29%	0.289	20%	0.2	S	C	.	.	S	Bend	trans	168	-5.4	-176.5	0	0	0	0	0	116.5	K153 F159	K153-G155 PolarHBondContact O-N 2.93Å; G155-F159 VanDerWaalsContact C-CB 3.47Å; G155-F159 VanDerWaalsContact O-CB 3.27Å; G155-F159 WeakPolarHBondContact O-CB 3.39Å
156	G	80.9	Confident	79.7	Confident	9 Å²	9	35.8 Å²	35.8	9%	0.093	20%	0.2	C	C	.	.	H	α-helix	trans	78.9	-170.5	176.5	0	0	0	0	0	114.6	Y158 F159 L160 A312 N313 S315	G156-Y158 PolarHBondContact O-N 3.15Å; G156-F159 PolarHBondContact O-N 3.4Å; G156-L160 WeakPolarHBondContact O-CG 3.31Å; G156-L160 PolarHBondContact O-N 3.26Å; G156-L160 VanDerWaalsContact O-N 3.1Å; G156-A312 CarbonylContact C-O 3.59Å; G156-A312 WeakPolarHBondContact CA-O 3.38Å; G156-N313 VanDerWaalsContact CA-O 3.23Å; G156-N313 WeakPolarHBondContact CA-O 3.43Å; G156-S315 VanDerWaalsContact CA-OG 3.31Å; G156-S315 WeakPolarHBondContact CA-OG 3.39Å; G156-S315 PolarHBondContact N-OG 3.14Å
157	T	82	Confident	79.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-42.7	-173.2	-58.2	0	0	0	0	112.9	F159 L160 I161 F177 L309 A312 N313	T157-F159 PolarHBondContact O-N 3.27Å; T157-L160 WeakPolarHBondContact O-CB 3.5Å; T157-L160 PolarHBondContact O-N 2.81Å; T157-I161 HydrophobicContact CG2-CD1 3.67Å; T157-I161 HydrophobicContact CG2-CG1 4.4Å; T157-I161 VanDerWaalsContact O-CG1 3.23Å; T157-I161 WeakPolarHBondContact O-CG1 3.38Å; T157-I161 PolarHBondContact O-N 3.34Å; T157-F177 HydrophobicContact CG2-CE1 4.4Å; T157-L309 HydrophobicContact CG2-CB 4.22Å; T157-L309 HydrophobicContact CG2-CD1 4.13Å; T157-L309 HydrophobicContact CG2-CD2 4.23Å; T157-L309 HydrophobicContact CG2-CG 4.41Å; T157-L309 PolarHBondContact OG1-O 2.93Å; T157-A312 PolarHBondContact N-O 3.37Å; T157-A312 WeakPolarHBondContact OG1-CB 3.43Å; T157-N313 WeakPolarHBondContact CB-OD1 3.27Å; T157-N313 WeakPolarHBondContact OG1-CA 3.45Å; T157-N313 PolarHBondContact OG1-N 3.49Å; T157-N313 VanDerWaalsContact OG1-N 3.08Å; T157-N313 PolarHBondContact OG1-OD1 3.01Å
158	Y	86.6	Confident	79	Confident	3 Å²	3	36.7 Å²	36.7	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-42.2	179.6	164.1	-99.2	0	0	0	112.1	G156 L160 I161 S162 G170 C438 L439 D442 L444	G156-Y158 PolarHBondContact O-N 3.15Å; Y158-L160 VanDerWaalsContact C-N 3.33Å; Y158-L160 PolarHBondContact O-N 2.69Å; Y158-I161 PolarHBondContact O-N 3.41Å; Y158-S162 WeakPolarHBondContact O-CB 3.46Å; Y158-S162 PolarHBondContact O-N 3.25Å; Y158-S162 PolarHBondContact O-OG 3.28Å; Y158-S162 VanDerWaalsContact O-OG 3.13Å; Y158-G170 WeakPolarHBondContact CE2-O 3.36Å; Y158-C438 HydrophobicContact CD1-CB 3.5Å; Y158-C438 VanDerWaalsContact CD1-CB 3.5Å; Y158-C438 HydrophobicContact CE1-CB 3.92Å; Y158-L439 HydrophobicContact CD2-CD1 4.44Å; Y158-L439 HydrophobicContact CE1-CB 4.29Å; Y158-L439 HydrophobicContact CE2-CB 4.25Å; Y158-L439 HydrophobicContact CE2-CD1 3.52Å; Y158-D442 WeakPolarHBondContact CE1-OD2 3.27Å; Y158-D442 VanDerWaalsContact CZ-OD2 3.27Å; Y158-D442 PolarHBondContact OH-OD2 3.35Å; Y158-L444 WeakPolarHBondContact OH-CD1 3.47Å
159	F	83.2	Confident	78.8	Confident	53 Å²	53	36.6 Å²	36.6	23%	0.232	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-41.8	177.7	-174.5	-93.9	0	0	0	111.7	K153 G155 G156 T157 I161 S162 R163	K153-F159 HydrophobicContact CB-CE1 4.22Å; G155-F159 VanDerWaalsContact C-CB 3.47Å; G155-F159 VanDerWaalsContact O-CB 3.27Å; G155-F159 WeakPolarHBondContact O-CB 3.39Å; G156-F159 PolarHBondContact O-N 3.4Å; T157-F159 PolarHBondContact O-N 3.27Å; F159-I161 PolarHBondContact O-N 3.06Å; F159-S162 PolarHBondContact O-OG 3.31Å; F159-R163 HydrophobicContact CD1-CG 4.2Å; F159-R163 HydrophobicContact CD2-CG 4.11Å; F159-R163 HydrophobicContact CE1-CG 4.01Å; F159-R163 HydrophobicContact CE2-CG 3.93Å; F159-R163 HydrophobicContact CG-CG 4.24Å; F159-R163 HydrophobicContact CZ-CG 3.87Å; F159-R163 VanDerWaalsContact O-CB 3.31Å; F159-R163 WeakPolarHBondContact O-CB 3.35Å; F159-R163 WeakPolarHBondContact O-CG 3.32Å; F159-R163 PolarHBondContact O-N 3.43Å; F159-R163 VanDerWaalsContact O-N 3.13Å
160	L	82.5	Confident	78.8	Confident	12 Å²	12	35.7 Å²	35.7	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-56.2	-49.2	172.9	-79.5	170.9	0	0	0	111.8	I146 V152 G156 T157 Y158 S164 A312 I325	I146-L160 HydrophobicContact CG2-CB 4.3Å; I146-L160 WeakPolarHBondContact CG2-O 3.4Å; V152-L160 HydrophobicContact CB-CD2 3.96Å; V152-L160 HydrophobicContact CG1-CD2 3.4Å; V152-L160 VanDerWaalsContact CG1-CD2 3.4Å; V152-L160 HydrophobicContact CG1-CG 4.18Å; V152-L160 HydrophobicContact CG2-CD2 3.45Å; V152-L160 VanDerWaalsContact CG2-CD2 3.45Å; G156-L160 WeakPolarHBondContact O-CG 3.31Å; G156-L160 PolarHBondContact O-N 3.26Å; G156-L160 VanDerWaalsContact O-N 3.1Å; T157-L160 WeakPolarHBondContact O-CB 3.5Å; T157-L160 PolarHBondContact O-N 2.81Å; Y158-L160 VanDerWaalsContact C-N 3.33Å; Y158-L160 PolarHBondContact O-N 2.69Å; L160-S164 WeakPolarHBondContact O-CB 3.26Å; L160-S164 PolarHBondContact O-N 2.89Å; L160-S164 PolarHBondContact O-OG 2.9Å; L160-S164 VanDerWaalsContact O-OG 3.14Å; L160-A312 HydrophobicContact CD1-CB 4.21Å; L160-I325 HydrophobicContact CD1-CD1 3.99Å
161	I	86.2	Confident	79.4	Confident	9 Å²	9	33.4 Å²	33.4	5%	0.046	18%	0.175	C	C	.	.	H	α-helix	trans	-69	-48.1	-176.9	-65.6	171	0	0	0	111.2	I146 T157 Y158 F159 R163 S164 L165 I173 I499	I146-I161 HydrophobicContact CD1-CG1 4.38Å; T157-I161 HydrophobicContact CG2-CD1 3.67Å; T157-I161 HydrophobicContact CG2-CG1 4.4Å; T157-I161 VanDerWaalsContact O-CG1 3.23Å; T157-I161 WeakPolarHBondContact O-CG1 3.38Å; T157-I161 PolarHBondContact O-N 3.34Å; Y158-I161 PolarHBondContact O-N 3.41Å; F159-I161 PolarHBondContact O-N 3.06Å; I161-R163 PolarHBondContact O-N 2.92Å; I161-S164 PolarHBondContact O-N 2.87Å; I161-L165 HydrophobicContact CG2-CD1 3.76Å; I161-L165 WeakPolarHBondContact O-CB 3.48Å; I161-L165 WeakPolarHBondContact O-CG 3.36Å; I161-L165 PolarHBondContact O-N 2.93Å; I161-I173 HydrophobicContact CD1-CG2 3.89Å; I161-I173 HydrophobicContact CG2-CB 4.21Å; I161-I173 HydrophobicContact CG2-CD1 3.74Å; I161-I173 HydrophobicContact CG2-CG2 4.11Å; I161-I499 HydrophobicContact CD1-CD1 4.23Å; I161-I499 HydrophobicContact CD1-CG1 4.35Å
162	S	84.8	Confident	80.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.5	-34.8	-173.9	68.3	0	0	0	0	113.1	Y158 F159 G166	Y158-S162 WeakPolarHBondContact O-CB 3.46Å; Y158-S162 PolarHBondContact O-N 3.25Å; Y158-S162 PolarHBondContact O-OG 3.28Å; Y158-S162 VanDerWaalsContact O-OG 3.13Å; F159-S162 PolarHBondContact O-OG 3.31Å; S162-G166 CarbonylContact O-C 3.54Å; S162-G166 VanDerWaalsContact O-CA 3.3Å; S162-G166 WeakPolarHBondContact O-CA 2.95Å; S162-G166 PolarHBondContact O-N 3.15Å
163	R	83.9	Confident	81.4	Confident	100 Å²	100	23 Å²	23	38%	0.377	13%	0.128	S	C	.	.	H	α-helix	trans	-79	-26.8	179.2	-60.3	-63.2	167.1	146.8	-3.8	113.5	F159 I161 D442 W568	F159-R163 HydrophobicContact CD1-CG 4.2Å; F159-R163 HydrophobicContact CD2-CG 4.11Å; F159-R163 HydrophobicContact CE1-CG 4.01Å; F159-R163 HydrophobicContact CE2-CG 3.93Å; F159-R163 HydrophobicContact CG-CG 4.24Å; F159-R163 HydrophobicContact CZ-CG 3.87Å; F159-R163 VanDerWaalsContact O-CB 3.31Å; F159-R163 WeakPolarHBondContact O-CB 3.35Å; F159-R163 WeakPolarHBondContact O-CG 3.32Å; F159-R163 PolarHBondContact O-N 3.43Å; F159-R163 VanDerWaalsContact O-N 3.13Å; I161-R163 PolarHBondContact O-N 2.92Å; R163-D442 IonicContact NH2-OD1 3.96Å; R163-W568 VanDerWaalsContact NH2-CE2 3.27Å; R163-W568 VanDerWaalsContact NH2-CZ2 3.31Å
164	S	81.9	Confident	82.9	Confident	20 Å²	20	15.9 Å²	15.9	14%	0.14	10%	0.098	C	C	.	.	H	α-helix	trans	-86.2	-32	176	-63	0	0	0	0	113.7	L160 I161	L160-S164 WeakPolarHBondContact O-CB 3.26Å; L160-S164 PolarHBondContact O-N 2.89Å; L160-S164 PolarHBondContact O-OG 2.9Å; L160-S164 VanDerWaalsContact O-OG 3.14Å; I161-S164 PolarHBondContact O-N 2.87Å
165	L	80.3	Confident	84.4	Confident	2 Å²	2	15.5 Å²	15.5	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-109.9	-16.8	-170	-57	170.8	0	0	0	113.7	I146 I161 L169 I173 A506 W514	I146-L165 HydrophobicContact CD1-CD1 4.03Å; I161-L165 HydrophobicContact CG2-CD1 3.76Å; I161-L165 WeakPolarHBondContact O-CB 3.48Å; I161-L165 WeakPolarHBondContact O-CG 3.36Å; I161-L165 PolarHBondContact O-N 2.93Å; L165-L169 HydrophobicContact CB-CB 4.44Å; L165-I173 HydrophobicContact CD1-CD1 4.39Å; L165-A506 HydrophobicContact CD2-CB 4.12Å; L165-W514 HydrophobicContact CD2-CE3 4.04Å; L165-W514 HydrophobicContact CD2-CH2 4.22Å; L165-W514 HydrophobicContact CD2-CZ3 3.61Å
166	G	82.1	Confident	85.6	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.			trans	102	166.7	-177.8	0	0	0	0	0	113.5	S162 E168 G170	S162-G166 CarbonylContact O-C 3.54Å; S162-G166 VanDerWaalsContact O-CA 3.3Å; S162-G166 WeakPolarHBondContact O-CA 2.95Å; S162-G166 PolarHBondContact O-N 3.15Å; G166-E168 PolarHBondContact O-N 3.11Å; G166-G170 PolarHBondContact O-N 3.48Å
167	P	82.9	Confident	86.1	Confident	7 Å²	7	14.7 Å²	14.7	5%	0.045	7%	0.07	C	C	.	.	H	α-helix	trans	-66.8	-32.6	-174.7	25.2	-33.3	0	0	0	114	G171 L444 W568	P167-G171 PolarHBondContact O-N 3.39Å; P167-L444 HydrophobicContact CB-CD1 4.49Å; P167-L444 HydrophobicContact CB-CD2 3.73Å; P167-W568 HydrophobicContact CB-CE3 3.73Å; P167-W568 HydrophobicContact CB-CH2 4.48Å; P167-W568 HydrophobicContact CB-CZ3 3.62Å; P167-W568 HydrophobicContact CG-CE3 4.31Å
168	E	83.5	Confident	86.6	Confident	18 Å²	18	14.9 Å²	14.9	8%	0.084	7%	0.072	C	C	.	.	H	α-helix	trans	-68.7	-48.3	-175.1	-52.3	96.1	165.8	0	0	111.7	G166 S172 L556 L560 S570 L572	G166-E168 PolarHBondContact O-N 3.11Å; E168-S172 PolarHBondContact O-OG 2.88Å; E168-L556 HydrophobicContact CB-CD1 4.37Å; E168-L560 HydrophobicContact CG-CD2 4.28Å; E168-S570 VanDerWaalsContact CD-OG 3.28Å; E168-S570 PolarHBondContact OE1-OG 2.81Å; E168-S570 WeakPolarHBondContact OE2-CB 3.41Å; E168-S570 PolarHBondContact OE2-OG 3.39Å; E168-L572 HydrophobicContact CB-CD1 4.05Å; E168-L572 HydrophobicContact CG-CD1 3.97Å
169	L	86.1	Confident	86.9	Confident	13 Å²	13	18 Å²	18	7%	0.068	9%	0.085	C	C	.	.	H	α-helix	trans	-77.1	-43.4	178.7	-66.2	170.7	0	0	0	111.1	L165 G171 S172 I173 L556	L165-L169 HydrophobicContact CB-CB 4.44Å; L169-G171 PolarHBondContact O-N 3.34Å; L169-S172 PolarHBondContact O-N 3.22Å; L169-I173 WeakPolarHBondContact O-CD1 3.47Å; L169-I173 VanDerWaalsContact O-CG1 3.27Å; L169-I173 WeakPolarHBondContact O-CG1 3.47Å; L169-I173 PolarHBondContact O-N 3.28Å; L169-L556 HydrophobicContact CD2-CD1 3.79Å
170	G	87.3	Confident	87.4	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-42.8	179.4	0	0	0	0	0	113.2	Y158 G166 S172 G174	Y158-G170 WeakPolarHBondContact CE2-O 3.36Å; G166-G170 PolarHBondContact O-N 3.48Å; G170-S172 PolarHBondContact O-N 3.18Å; G170-G174 PolarHBondContact O-N 3.28Å
171	G	88.4	Confident	87.8	Confident	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63.2	-40.6	178.8	0	0	0	0	0	113.1	P167 L169 L175	P167-G171 PolarHBondContact O-N 3.39Å; L169-G171 PolarHBondContact O-N 3.34Å; G171-L175 PolarHBondContact O-N 3.08Å
172	S	90.5	Very high	88.2	Confident	2 Å²	2	14.7 Å²	14.7	1%	0.014	7%	0.07	C	C	.	.	H	α-helix	trans	-69.8	-46.2	178.6	-55.6	0	0	0	0	111.7	E168 L169 G170 L175 I176	E168-S172 PolarHBondContact O-OG 2.88Å; L169-S172 PolarHBondContact O-N 3.22Å; G170-S172 PolarHBondContact O-N 3.18Å; S172-L175 PolarHBondContact O-N 3.37Å; S172-I176 WeakPolarHBondContact O-CG1 3.38Å; S172-I176 PolarHBondContact O-N 3.19Å
173	I	91.5	Very high	88.7	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-61.7	-45.9	176.9	-66.2	164.3	0	0	0	110.7	I161 L165 L169 L175 I176 F177 L498 I499	I161-I173 HydrophobicContact CD1-CG2 3.89Å; I161-I173 HydrophobicContact CG2-CB 4.21Å; I161-I173 HydrophobicContact CG2-CD1 3.74Å; I161-I173 HydrophobicContact CG2-CG2 4.11Å; L165-I173 HydrophobicContact CD1-CD1 4.39Å; L169-I173 WeakPolarHBondContact O-CD1 3.47Å; L169-I173 VanDerWaalsContact O-CG1 3.27Å; L169-I173 WeakPolarHBondContact O-CG1 3.47Å; L169-I173 PolarHBondContact O-N 3.28Å; I173-L175 PolarHBondContact O-N 3.18Å; I173-I176 PolarHBondContact O-N 3.4Å; I173-F177 WeakPolarHBondContact O-CB 3.26Å; I173-F177 PolarHBondContact O-N 2.98Å; I173-L498 HydrophobicContact CD1-CB 4.17Å; I173-L498 HydrophobicContact CG1-CB 3.63Å; I173-L498 HydrophobicContact CG1-CD1 4.14Å; I173-I499 HydrophobicContact CD1-CG1 4.24Å; I173-I499 HydrophobicContact CG2-CD1 4.25Å; I173-I499 HydrophobicContact CG2-CG1 3.86Å
174	G	90.5	Very high	89.1	Confident	3 Å²	3	10 Å²	10	3%	0.031	5%	0.053	C	C	.	.	H	α-helix	trans	-59.9	-42.6	-179.1	0	0	0	0	0	113.3	G170 A178 V435	G170-G174 PolarHBondContact O-N 3.28Å; G174-A178 WeakPolarHBondContact O-CB 3.48Å; G174-A178 PolarHBondContact O-N 3.45Å; G174-V435 WeakPolarHBondContact O-CG1 3.39Å
175	L	91.4	Very high	89.8	Confident	44 Å²	44	9 Å²	9	23%	0.23	5%	0.046	C	C	.	.	H	α-helix	trans	-67.4	-46.9	-179.4	-171.2	66.3	0	0	0	112.2	G171 S172 I173 F177 A178 F179 F436 L439 L555	G171-L175 PolarHBondContact O-N 3.08Å; S172-L175 PolarHBondContact O-N 3.37Å; I173-L175 PolarHBondContact O-N 3.18Å; L175-F177 VanDerWaalsContact C-N 3.35Å; L175-A178 PolarHBondContact O-N 2.85Å; L175-F179 PolarHBondContact O-N 3.2Å; L175-F179 VanDerWaalsContact O-N 3.07Å; L175-F436 HydrophobicContact CD1-CD2 4.07Å; L175-F436 HydrophobicContact CD1-CE2 3.55Å; L175-L439 HydrophobicContact CB-CD2 3.89Å; L175-L439 HydrophobicContact CD1-CD2 3.81Å; L175-L439 HydrophobicContact CG-CD2 4.44Å; L175-L555 HydrophobicContact CD2-CD1 3.74Å; L175-L555 HydrophobicContact CD2-CD2 3.7Å; L175-L555 HydrophobicContact CD2-CG 4.39Å
176	I	92	Very high	90.4	Very high	13 Å²	13	8.9 Å²	8.9	7%	0.067	5%	0.046	C	C	.	.	H	α-helix	trans	-66.8	-40.6	-179.7	-61.6	167.6	0	0	0	110.2	S172 I173 F179 A180 F491 C494 S495 L498 V552	S172-I176 WeakPolarHBondContact O-CG1 3.38Å; S172-I176 PolarHBondContact O-N 3.19Å; I173-I176 PolarHBondContact O-N 3.4Å; I176-F179 PolarHBondContact O-N 3.5Å; I176-A180 WeakPolarHBondContact O-CB 3.36Å; I176-A180 PolarHBondContact O-N 3.42Å; I176-F491 HydrophobicContact CG2-CD1 4.27Å; I176-C494 HydrophobicContact CG2-CB 4.49Å; I176-S495 WeakPolarHBondContact CG2-OG 3.24Å; I176-L498 HydrophobicContact CD1-CD1 3.65Å; I176-V552 HydrophobicContact CD1-CG2 3.52Å
177	F	91.2	Very high	91	Very high	7 Å²	7	9 Å²	9	3%	0.031	5%	0.046	C	C	.	.	H	α-helix	trans	-66	-41	177.6	-177.6	-112.3	0	0	0	112.5	T157 I173 L175 F179 A180 N181 L309 V435 Y492	T157-F177 HydrophobicContact CG2-CE1 4.4Å; I173-F177 WeakPolarHBondContact O-CB 3.26Å; I173-F177 PolarHBondContact O-N 2.98Å; L175-F177 VanDerWaalsContact C-N 3.35Å; F177-F179 VanDerWaalsContact C-N 3.32Å; F177-F179 PolarHBondContact O-N 3.31Å; F177-A180 PolarHBondContact O-N 3Å; F177-N181 WeakPolarHBondContact CE1-ND2 3.4Å; F177-N181 WeakPolarHBondContact CZ-ND2 3.43Å; F177-N181 PolarHBondContact O-N 3.41Å; F177-L309 HydrophobicContact CD2-CD1 4.09Å; F177-L309 HydrophobicContact CE2-CB 4.16Å; F177-L309 HydrophobicContact CE2-CD1 3.59Å; F177-L309 HydrophobicContact CE2-CG 4.43Å; F177-L309 HydrophobicContact CZ-CB 3.77Å; F177-L309 HydrophobicContact CZ-CD1 3.87Å; F177-L309 HydrophobicContact CZ-CG 4.44Å; F177-V435 HydrophobicContact CD1-CG1 4.19Å; F177-V435 HydrophobicContact CD1-CG2 4.05Å; F177-V435 HydrophobicContact CE1-CG2 4.05Å; F177-Y492 HydrophobicContact CD2-CE1 4.25Å; F177-Y492 AromaticContact CE2-CE1 3.96Å; F177-Y492 HydrophobicContact CE2-CE1 3.96Å
178	A	92.2	Very high	91.5	Very high	6 Å²	6	8.9 Å²	8.9	5%	0.05	5%	0.045	C	C	.	.	H	α-helix	trans	-61.2	-42.6	174	0	0	0	0	0	111.6	G174 L175 N181 A182 A432 V435 F436	G174-A178 WeakPolarHBondContact O-CB 3.48Å; G174-A178 PolarHBondContact O-N 3.45Å; L175-A178 PolarHBondContact O-N 2.85Å; A178-N181 PolarHBondContact O-N 2.76Å; A178-A182 PolarHBondContact O-N 2.97Å; A178-A432 WeakPolarHBondContact O-CB 3.38Å; A178-V435 HydrophobicContact CB-CB 4.31Å; A178-V435 HydrophobicContact CB-CG1 3.86Å; A178-F436 HydrophobicContact CB-CB 4.23Å; A178-F436 HydrophobicContact CB-CD2 4.44Å
179	F	92.8	Very high	92.1	Very high	67 Å²	67	8.1 Å²	8.1	29%	0.294	4%	0.041	S	C	.	.	H	α-helix	trans	-63.8	-45.5	175.8	-173.9	-96.8	0	0	0	111.9	L175 I176 F177 N181 A182 V183 I471 F475 F491	L175-F179 PolarHBondContact O-N 3.2Å; L175-F179 VanDerWaalsContact O-N 3.07Å; I176-F179 PolarHBondContact O-N 3.5Å; F177-F179 VanDerWaalsContact C-N 3.32Å; F177-F179 PolarHBondContact O-N 3.31Å; F179-N181 VanDerWaalsContact C-N 3.34Å; F179-N181 PolarHBondContact O-N 2.93Å; F179-A182 WeakPolarHBondContact O-CB 3.24Å; F179-A182 PolarHBondContact O-N 3.01Å; F179-A182 VanDerWaalsContact O-N 3.11Å; F179-V183 HydrophobicContact CD1-CG2 4.16Å; F179-V183 HydrophobicContact CE1-CG2 3.7Å; F179-V183 HydrophobicContact CE2-CG2 4.44Å; F179-V183 HydrophobicContact CZ-CG2 3.87Å; F179-V183 WeakPolarHBondContact O-CG2 3.49Å; F179-V183 PolarHBondContact O-N 3.16Å; F179-I471 HydrophobicContact CD2-CD1 4.45Å; F179-I471 HydrophobicContact CE2-CG2 4.22Å; F179-F475 HydrophobicContact CZ-CE2 4.36Å; F179-F491 AromaticContact CD1-CD1 4Å; F179-F491 HydrophobicContact CD1-CD1 4Å; F179-F491 HydrophobicContact CD1-CD2 4.08Å; F179-F491 AromaticContact CD1-CE1 3.91Å; F179-F491 HydrophobicContact CD1-CE1 3.91Å; F179-F491 HydrophobicContact CD1-CE2 4.03Å; F179-F491 HydrophobicContact CD1-CG 4.09Å; F179-F491 AromaticContact CD1-CZ 3.93Å; F179-F491 HydrophobicContact CD1-CZ 3.93Å; F179-F491 HydrophobicContact CE1-CD1 4.36Å; F179-F491 AromaticContact CE1-CD2 3.88Å; F179-F491 HydrophobicContact CE1-CD2 3.88Å; F179-F491 AromaticContact CE1-CE1 3.95Å; F179-F491 HydrophobicContact CE1-CE1 3.95Å; F179-F491 AromaticContact CE1-CE2 3.45Å; F179-F491 HydrophobicContact CE1-CE2 3.45Å; F179-F491 VanDerWaalsContact CE1-CE2 3.45Å; F179-F491 HydrophobicContact CE1-CG 4.34Å; F179-F491 AromaticContact CE1-CZ 3.47Å; F179-F491 HydrophobicContact CE1-CZ 3.47Å; F179-F491 VanDerWaalsContact CE1-CZ 3.47Å; F179-F491 HydrophobicContact CZ-CZ 4.47Å
180	A	92.9	Very high	92.5	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-57	-46.6	177.2	0	0	0	0	0	111.9	I176 F177 A182 V183 A184 F491 Y492	I176-A180 WeakPolarHBondContact O-CB 3.36Å; I176-A180 PolarHBondContact O-N 3.42Å; F177-A180 PolarHBondContact O-N 3Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.17Å; A180-V183 PolarHBondContact O-N 3.39Å; A180-A184 WeakPolarHBondContact O-CB 3.42Å; A180-A184 PolarHBondContact O-N 3.33Å; A180-F491 HydrophobicContact CB-CB 3.9Å; A180-Y492 HydrophobicContact CB-CD1 4.18Å; A180-Y492 HydrophobicContact CB-CD2 4.32Å; A180-Y492 HydrophobicContact CB-CE1 3.99Å; A180-Y492 HydrophobicContact CB-CE2 4.19Å; A180-Y492 HydrophobicContact CB-CG 4.33Å
181	N	92.5	Very high	92.8	Very high	3 Å²	3	7.5 Å²	7.5	2%	0.016	4%	0.038	C	C	.	.	H	α-helix	trans	-64.7	-36.2	176.7	-70.7	-18.9	0	0	0	112.2	F177 A178 F179 A184 V185 S431 A432 Y492	F177-N181 WeakPolarHBondContact CE1-ND2 3.4Å; F177-N181 WeakPolarHBondContact CZ-ND2 3.43Å; F177-N181 PolarHBondContact O-N 3.41Å; A178-N181 PolarHBondContact O-N 2.76Å; F179-N181 VanDerWaalsContact C-N 3.34Å; F179-N181 PolarHBondContact O-N 2.93Å; N181-A184 PolarHBondContact O-N 3.23Å; N181-V185 WeakPolarHBondContact O-CG2 3.47Å; N181-V185 PolarHBondContact O-N 3.32Å; N181-S431 PolarHBondContact ND2-OG 3.25Å; N181-S431 VanDerWaalsContact ND2-OG 3.09Å; N181-A432 HydrophobicContact CB-CB 3.74Å; N181-Y492 PolarHBondContact OD1-OH 3.47Å
182	A	94.5	Very high	93.1	Very high	2 Å²	2	8.8 Å²	8.8	2%	0.017	4%	0.044	C	C	.	.	H	α-helix	trans	-64.3	-41.2	176.8	0	0	0	0	0	112.3	A178 F179 A180 V185 A432 T468 I471	A178-A182 PolarHBondContact O-N 2.97Å; F179-A182 WeakPolarHBondContact O-CB 3.24Å; F179-A182 PolarHBondContact O-N 3.01Å; F179-A182 VanDerWaalsContact O-N 3.11Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.17Å; A182-V185 PolarHBondContact O-N 3.05Å; A182-A432 HydrophobicContact CB-CB 4.29Å; A182-T468 HydrophobicContact CB-CG2 3.84Å; A182-I471 HydrophobicContact CB-CB 4.33Å; A182-I471 HydrophobicContact CB-CD1 4.43Å; A182-I471 HydrophobicContact CB-CG2 3.97Å
183	V	94.1	Very high	93.3	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-71	-34.6	175.1	-174.4	0	0	0	0	111.2	F179 A180 V185 A186 M187 I471 F475 I484 I488	F179-V183 HydrophobicContact CD1-CG2 4.16Å; F179-V183 HydrophobicContact CE1-CG2 3.7Å; F179-V183 HydrophobicContact CE2-CG2 4.44Å; F179-V183 HydrophobicContact CZ-CG2 3.87Å; F179-V183 WeakPolarHBondContact O-CG2 3.49Å; F179-V183 PolarHBondContact O-N 3.16Å; A180-V183 PolarHBondContact O-N 3.39Å; V183-V185 VanDerWaalsContact C-N 3.27Å; V183-V185 PolarHBondContact O-N 2.94Å; V183-A186 VanDerWaalsContact O-CB 3.32Å; V183-A186 WeakPolarHBondContact O-CB 3.25Å; V183-A186 PolarHBondContact O-N 3.06Å; V183-M187 PolarHBondContact O-N 3.3Å; V183-I471 HydrophobicContact CG2-CG2 4.26Å; V183-F475 HydrophobicContact CG1-CD1 3.8Å; V183-F475 HydrophobicContact CG1-CD2 4.1Å; V183-F475 HydrophobicContact CG1-CE1 3.9Å; V183-F475 HydrophobicContact CG1-CE2 4.2Å; V183-F475 HydrophobicContact CG1-CG 3.9Å; V183-F475 HydrophobicContact CG1-CZ 4.11Å; V183-F475 HydrophobicContact CG2-CD2 3.98Å; V183-F475 HydrophobicContact CG2-CE2 3.63Å; V183-F475 HydrophobicContact CG2-CZ 3.97Å; V183-I484 HydrophobicContact CG1-CG2 4.44Å; V183-I488 HydrophobicContact CB-CG1 4.13Å; V183-I488 HydrophobicContact CG1-CD1 3.99Å; V183-I488 HydrophobicContact CG1-CG1 3.51Å
184	A	93.4	Very high	93.4	Very high	1 Å²	1	9.2 Å²	9.2	1%	0.008	5%	0.046	C	C	.	.	H	α-helix	trans	-60.2	-34.8	176	0	0	0	0	0	112.9	A180 N181 A186 M187 H188 C428 Y492	A180-A184 WeakPolarHBondContact O-CB 3.42Å; A180-A184 PolarHBondContact O-N 3.33Å; N181-A184 PolarHBondContact O-N 3.23Å; A184-A186 VanDerWaalsContact C-N 3.26Å; A184-A186 PolarHBondContact O-N 3.46Å; A184-M187 PolarHBondContact O-N 3.48Å; A184-H188 PolarHBondContact O-CD2 3.06Å; A184-H188 PolarHBondContact O-N 2.93Å; A184-H188 VanDerWaalsContact O-N 3.09Å; A184-C428 HydrophobicContact CB-CB 4.48Å; A184-Y492 HydrophobicContact CB-CE2 4.37Å
185	V	94.9	Very high	93.5	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-53.6	-46.8	172	177.7	0	0	0	0	110.6	N181 A182 V183 M187 H188 T189 V222 C428 L429 A472	N181-V185 WeakPolarHBondContact O-CG2 3.47Å; N181-V185 PolarHBondContact O-N 3.32Å; A182-V185 PolarHBondContact O-N 3.05Å; V183-V185 VanDerWaalsContact C-N 3.27Å; V183-V185 PolarHBondContact O-N 2.94Å; V185-M187 PolarHBondContact O-N 3.44Å; V185-H188 PolarHBondContact O-N 3.34Å; V185-T189 WeakPolarHBondContact O-CB 3.28Å; V185-T189 PolarHBondContact O-N 3.4Å; V185-T189 PolarHBondContact O-OG1 2.68Å; V185-V222 HydrophobicContact CG1-CG2 3.93Å; V185-C428 HydrophobicContact CG2-CB 3.65Å; V185-L429 HydrophobicContact CG1-CB 4.48Å; V185-L429 HydrophobicContact CG1-CD1 4.35Å; V185-L429 HydrophobicContact CG2-CB 3.91Å; V185-L429 HydrophobicContact CG2-CD1 4.34Å; V185-A472 HydrophobicContact CB-CB 4.07Å; V185-A472 HydrophobicContact CG1-CB 3.96Å
186	A	94.8	Very high	93.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-61.3	-45.2	179.8	0	0	0	0	0	112.2	V183 A184 H188 T189 V190 A472 F475 I476	V183-A186 VanDerWaalsContact O-CB 3.32Å; V183-A186 WeakPolarHBondContact O-CB 3.25Å; V183-A186 PolarHBondContact O-N 3.06Å; A184-A186 VanDerWaalsContact C-N 3.26Å; A184-A186 PolarHBondContact O-N 3.46Å; A186-H188 PolarHBondContact O-N 2.69Å; A186-T189 PolarHBondContact O-N 2.89Å; A186-V190 WeakPolarHBondContact O-CB 3.33Å; A186-V190 VanDerWaalsContact O-CG2 3.24Å; A186-V190 WeakPolarHBondContact O-CG2 3.5Å; A186-V190 PolarHBondContact O-N 3.44Å; A186-A472 HydrophobicContact CB-CB 4.46Å; A186-A472 WeakPolarHBondContact CB-O 3.22Å; A186-F475 HydrophobicContact CB-CB 3.45Å; A186-F475 VanDerWaalsContact CB-CB 3.45Å; A186-I476 HydrophobicContact CB-CG1 3.83Å
187	M	93.9	Very high	93.6	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-60.1	-47.1	179.2	178.5	-171.1	72.2	0	0	112.3	I108 V183 A184 V185 V190 G191 P303 L481 I484 I488	I108-M187 HydrophobicContact CD1-SD 4.29Å; V183-M187 PolarHBondContact O-N 3.3Å; A184-M187 PolarHBondContact O-N 3.48Å; V185-M187 PolarHBondContact O-N 3.44Å; M187-V190 PolarHBondContact O-N 3.39Å; M187-G191 PolarHBondContact O-N 3.13Å; M187-P303 HydrophobicContact CE-CB 3.81Å; M187-P303 HydrophobicContact SD-CB 3.67Å; M187-P303 HydrophobicContact SD-CG 4.16Å; M187-L481 HydrophobicContact CB-CD1 4.46Å; M187-L481 HydrophobicContact CG-CD1 3.54Å; M187-L481 WeakPolarHBondContact O-CD1 3.45Å; M187-I484 HydrophobicContact CB-CG2 4.04Å; M187-I488 HydrophobicContact CB-CD1 3.35Å; M187-I488 HydrophobicContact CE-CD1 4.34Å; M187-I488 HydrophobicContact CG-CD1 3.94Å; M187-I488 HydrophobicContact SD-CD1 3.59Å; M187-I488 VanDerWaalsContact SD-CD1 3.59Å
188	H	94.2	Very high	93.5	Very high	6 Å²	6	8.4 Å²	8.4	3%	0.028	4%	0.042	C	C	.	.	H	α-helix	trans	-66.4	-39	179.6	-65.7	-58	0	0	0	111.9	A184 V185 A186 G191 F192 A425	A184-H188 PolarHBondContact O-CD2 3.06Å; A184-H188 PolarHBondContact O-N 2.93Å; A184-H188 VanDerWaalsContact O-N 3.09Å; V185-H188 PolarHBondContact O-N 3.34Å; A186-H188 PolarHBondContact O-N 2.69Å; H188-G191 PolarHBondContact O-N 3.17Å; H188-F192 PolarHBondContact O-N 3.34Å; H188-A425 HydrophobicContact CB-CB 3.78Å
189	T	94.7	Very high	93.4	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.006	5%	0.054	C	C	.	.	H	α-helix	trans	-69.8	-39.3	176.8	-58.9	0	0	0	0	112.8	V185 A186 G191 F192 A193 G218 T221 V222 I476	V185-T189 WeakPolarHBondContact O-CB 3.28Å; V185-T189 PolarHBondContact O-N 3.4Å; V185-T189 PolarHBondContact O-OG1 2.68Å; A186-T189 PolarHBondContact O-N 2.89Å; T189-G191 VanDerWaalsContact C-N 3.31Å; T189-G191 PolarHBondContact O-N 3.15Å; T189-F192 WeakPolarHBondContact O-CB 3.33Å; T189-F192 PolarHBondContact O-N 3.01Å; T189-A193 WeakPolarHBondContact O-CB 3.43Å; T189-A193 PolarHBondContact O-N 2.66Å; T189-G218 WeakPolarHBondContact CG2-O 3.4Å; T189-T221 HydrophobicContact CG2-CG2 4.12Å; T189-V222 HydrophobicContact CG2-CB 4.25Å; T189-I476 HydrophobicContact CG2-CD1 4.04Å
190	V	95.3	Very high	93.3	Very high	1 Å²	1	10 Å²	10	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-62.3	-41.9	173.2	168.4	0	0	0	0	110.4	A186 M187 F192 A193 E194 I214 I476 L481 I484	A186-V190 WeakPolarHBondContact O-CB 3.33Å; A186-V190 VanDerWaalsContact O-CG2 3.24Å; A186-V190 WeakPolarHBondContact O-CG2 3.5Å; A186-V190 PolarHBondContact O-N 3.44Å; M187-V190 PolarHBondContact O-N 3.39Å; V190-F192 PolarHBondContact O-N 2.93Å; V190-A193 PolarHBondContact O-N 3.06Å; V190-E194 WeakPolarHBondContact O-CB 3.3Å; V190-E194 PolarHBondContact O-N 2.89Å; V190-I214 HydrophobicContact CG1-CG2 4.18Å; V190-I476 HydrophobicContact CG2-CB 4.37Å; V190-I476 HydrophobicContact CG2-CG1 4.16Å; V190-I476 HydrophobicContact CG2-CG2 4.4Å; V190-L481 HydrophobicContact CG1-CB 4.39Å; V190-L481 HydrophobicContact CG1-CD1 4.45Å; V190-I484 HydrophobicContact CB-CD1 4.49Å; V190-I484 HydrophobicContact CG2-CD1 3.99Å
191	G	93	Very high	93.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60	-41.2	174.7	0	0	0	0	0	114.4	V107 M187 H188 T189 T195	V107-G191 VanDerWaalsContact CG2-CA 3.44Å; M187-G191 PolarHBondContact O-N 3.13Å; H188-G191 PolarHBondContact O-N 3.17Å; T189-G191 VanDerWaalsContact C-N 3.31Å; T189-G191 PolarHBondContact O-N 3.15Å; G191-T195 PolarHBondContact O-N 3.41Å; G191-T195 PolarHBondContact O-OG1 2.96Å
192	F	95	Very high	92.8	Very high	27 Å²	27	19.9 Å²	19.9	12%	0.118	9%	0.094	C	C	.	.	H	α-helix	trans	-62.1	-49.4	171.8	174.2	-98.4	0	0	0	111.1	H188 T189 V190 E194 T195 V196 I217 T221 F418 T421 L422	H188-F192 PolarHBondContact O-N 3.34Å; T189-F192 WeakPolarHBondContact O-CB 3.33Å; T189-F192 PolarHBondContact O-N 3.01Å; V190-F192 PolarHBondContact O-N 2.93Å; F192-E194 VanDerWaalsContact C-N 3.35Å; F192-E194 PolarHBondContact O-N 3.47Å; F192-T195 PolarHBondContact O-N 3.48Å; F192-T195 VanDerWaalsContact O-N 3.17Å; F192-V196 HydrophobicContact CD1-CG2 4.15Å; F192-V196 HydrophobicContact CD2-CG2 4.41Å; F192-V196 HydrophobicContact CE1-CG2 3.7Å; F192-V196 HydrophobicContact CE2-CG2 3.99Å; F192-V196 HydrophobicContact CG-CG2 4.49Å; F192-V196 HydrophobicContact CZ-CG2 3.61Å; F192-V196 WeakPolarHBondContact O-CG2 3.48Å; F192-V196 PolarHBondContact O-N 3.24Å; F192-I217 HydrophobicContact CE1-CG2 4.38Å; F192-T221 HydrophobicContact CD1-CG2 3.69Å; F192-T221 HydrophobicContact CE1-CG2 3.82Å; F192-T221 WeakPolarHBondContact CE1-OG1 3.29Å; F192-T221 HydrophobicContact CG-CG2 4.49Å; F192-F418 HydrophobicContact CD2-CB 4.44Å; F192-F418 AromaticContact CD2-CD1 3.53Å; F192-F418 HydrophobicContact CD2-CD1 3.53Å; F192-F418 HydrophobicContact CD2-CE1 4.05Å; F192-F418 HydrophobicContact CD2-CG 4.17Å; F192-F418 HydrophobicContact CE2-CB 4.14Å; F192-F418 AromaticContact CE2-CD1 3.39Å; F192-F418 HydrophobicContact CE2-CD1 3.39Å; F192-F418 HydrophobicContact CE2-CD2 4.33Å; F192-F418 AromaticContact CE2-CE1 3.78Å; F192-F418 HydrophobicContact CE2-CE1 3.78Å; F192-F418 AromaticContact CE2-CG 3.7Å; F192-F418 HydrophobicContact CE2-CG 3.7Å; F192-F418 HydrophobicContact CE2-CZ 4.4Å; F192-T421 HydrophobicContact CB-CG2 4.38Å; F192-L422 HydrophobicContact CD1-CD2 4.5Å; F192-L422 HydrophobicContact CD2-CD1 4.35Å; F192-L422 HydrophobicContact CD2-CD2 4.04Å; F192-L422 HydrophobicContact CD2-CG 3.99Å; F192-L422 HydrophobicContact CE2-CD1 3.94Å; F192-L422 HydrophobicContact CE2-CD2 4.14Å; F192-L422 HydrophobicContact CE2-CG 4.08Å; F192-L422 HydrophobicContact CG-CD2 4.22Å; F192-L422 HydrophobicContact CZ-CD2 4.42Å
193	A	95.1	Very high	92.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.4	-37.1	-178	0	0	0	0	0	112.9	T189 V190 V196 T197 I214 I217	T189-A193 WeakPolarHBondContact O-CB 3.43Å; T189-A193 PolarHBondContact O-N 2.66Å; V190-A193 PolarHBondContact O-N 3.06Å; A193-V196 PolarHBondContact O-N 3.47Å; A193-T197 WeakPolarHBondContact O-CB 3.14Å; A193-T197 PolarHBondContact O-N 2.89Å; A193-T197 PolarHBondContact O-OG1 3.3Å; A193-I214 HydrophobicContact CB-CG2 4.02Å; A193-I214 WeakPolarHBondContact CB-O 3.45Å; A193-I217 HydrophobicContact CB-CB 4.02Å; A193-I217 HydrophobicContact CB-CG2 3.83Å
194	E	92.9	Very high	92.1	Very high	11 Å²	11	29.9 Å²	29.9	5%	0.051	16%	0.157	C	C	.	.	H	α-helix	trans	-57.6	-48.5	172.4	-174.6	178.1	155	0	0	110.7	R112 V190 F192 V196 T197 D198 I214	R112-E194 IonicContact CZ-OE1 3.51Å; R112-E194 IonicContact CZ-OE2 3.3Å; R112-E194 IonicContact NH1-OE1 3.38Å; R112-E194 PolarHBondContact NH1-OE1 3.19Å; R112-E194 IonicContact NH1-OE2 2.9Å; R112-E194 VanDerWaalsContact NH2-CD 3.34Å; R112-E194 IonicContact NH2-OE1 3.81Å; R112-E194 PolarHBondContact NH2-OE1 2.79Å; R112-E194 IonicContact NH2-OE2 2.84Å; R112-E194 PolarHBondContact NH2-OE2 3.05Å; V190-E194 WeakPolarHBondContact O-CB 3.3Å; V190-E194 PolarHBondContact O-N 2.89Å; F192-E194 VanDerWaalsContact C-N 3.35Å; F192-E194 PolarHBondContact O-N 3.47Å; E194-V196 PolarHBondContact O-N 2.93Å; E194-T197 PolarHBondContact O-N 3.42Å; E194-D198 WeakPolarHBondContact O-CB 3.24Å; E194-D198 VanDerWaalsContact O-CG 3.3Å; E194-D198 PolarHBondContact O-N 3.26Å; E194-I214 HydrophobicContact CB-CD1 4.44Å
195	T	92.5	Very high	91.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-65.3	-42.1	-179.4	-50.2	0	0	0	0	112.3	G191 F192 L199 I417 F418	G191-T195 PolarHBondContact O-N 3.41Å; G191-T195 PolarHBondContact O-OG1 2.96Å; F192-T195 PolarHBondContact O-N 3.48Å; F192-T195 VanDerWaalsContact O-N 3.17Å; T195-L199 WeakPolarHBondContact O-CB 3.4Å; T195-L199 PolarHBondContact O-N 3.43Å; T195-I417 HydrophobicContact CG2-CB 4.44Å; T195-I417 HydrophobicContact CG2-CD1 4.09Å; T195-I417 HydrophobicContact CG2-CG2 3.98Å; T195-I417 WeakPolarHBondContact OG1-CG2 3.08Å; T195-F418 HydrophobicContact CG2-CE1 3.92Å
196	V	93.5	Very high	91.6	Very high	27 Å²	27	36.2 Å²	36.2	16%	0.164	20%	0.201	C	C	.	.	H	α-helix	trans	-65.4	-42.9	177.1	176.1	0	0	0	0	110.9	F192 A193 E194 D198 L199 M200 I217 F418	F192-V196 HydrophobicContact CD1-CG2 4.15Å; F192-V196 HydrophobicContact CD2-CG2 4.41Å; F192-V196 HydrophobicContact CE1-CG2 3.7Å; F192-V196 HydrophobicContact CE2-CG2 3.99Å; F192-V196 HydrophobicContact CG-CG2 4.49Å; F192-V196 HydrophobicContact CZ-CG2 3.61Å; F192-V196 WeakPolarHBondContact O-CG2 3.48Å; F192-V196 PolarHBondContact O-N 3.24Å; A193-V196 PolarHBondContact O-N 3.47Å; E194-V196 PolarHBondContact O-N 2.93Å; V196-D198 VanDerWaalsContact C-N 3.35Å; V196-D198 PolarHBondContact O-N 2.93Å; V196-L199 PolarHBondContact O-N 3.1Å; V196-M200 HydrophobicContact CG1-CG 4.32Å; V196-M200 HydrophobicContact CG1-SD 4.05Å; V196-M200 WeakPolarHBondContact O-CB 3.37Å; V196-M200 VanDerWaalsContact O-CG 3.28Å; V196-M200 WeakPolarHBondContact O-CG 3.42Å; V196-M200 PolarHBondContact O-N 2.97Å; V196-I217 HydrophobicContact CB-CD1 4.41Å; V196-I217 HydrophobicContact CB-CG2 4.26Å; V196-I217 HydrophobicContact CG1-CD1 3.95Å; V196-I217 HydrophobicContact CG1-CG2 4.26Å; V196-F418 HydrophobicContact CG2-CE1 3.74Å; V196-F418 HydrophobicContact CG2-CZ 3.85Å
197	T	92.6	Very high	91.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-42.3	179	-54.5	0	0	0	0	111.3	A193 E194 M200 R201 R210 D213 I214 I217	A193-T197 WeakPolarHBondContact O-CB 3.14Å; A193-T197 PolarHBondContact O-N 2.89Å; A193-T197 PolarHBondContact O-OG1 3.3Å; E194-T197 PolarHBondContact O-N 3.42Å; T197-M200 PolarHBondContact O-N 2.89Å; T197-R201 WeakPolarHBondContact O-CG 3.47Å; T197-R201 PolarHBondContact O-N 3.32Å; T197-R210 HydrophobicContact CG2-CG 4.45Å; T197-D213 HydrophobicContact CG2-CB 3.73Å; T197-I214 HydrophobicContact CG2-CG1 4.43Å; T197-I217 WeakPolarHBondContact OG1-CD1 3.42Å
198	D	89.2	Confident	91.1	Very high	23 Å²	23	44.6 Å²	44.6	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-43.6	176.4	-71.3	-11.7	0	0	0	111	E194 V196 M200 R201 E202 R210 Q401	E194-D198 WeakPolarHBondContact O-CB 3.24Å; E194-D198 VanDerWaalsContact O-CG 3.3Å; E194-D198 PolarHBondContact O-N 3.26Å; V196-D198 VanDerWaalsContact C-N 3.35Å; V196-D198 PolarHBondContact O-N 2.93Å; D198-M200 PolarHBondContact O-N 2.98Å; D198-R201 WeakPolarHBondContact O-CB 3.45Å; D198-R201 PolarHBondContact O-N 2.97Å; D198-E202 WeakPolarHBondContact O-CG 3.44Å; D198-E202 PolarHBondContact O-N 3.38Å; D198-R210 IonicContact OD1-CZ 3.31Å; D198-R210 IonicContact OD1-NE 3.83Å; D198-R210 IonicContact OD1-NH2 2.91Å; D198-R210 PolarHBondContact OD1-NH2 3.35Å; D198-R210 IonicContact OD2-NH2 3.99Å; D198-Q401 PolarHBondContact OD2-NE2 3.35Å
199	L	90.3	Very high	90.9	Very high	56 Å²	56	48.8 Å²	48.8	29%	0.293	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-38.9	176.5	-175.8	66.9	0	0	0	112.7	T195 V196 R201 E202 H203	T195-L199 WeakPolarHBondContact O-CB 3.4Å; T195-L199 PolarHBondContact O-N 3.43Å; V196-L199 PolarHBondContact O-N 3.1Å; L199-R201 VanDerWaalsContact C-N 3.33Å; L199-E202 PolarHBondContact O-N 3.1Å; L199-H203 PolarHBondContact O-N 3.2Å; L199-H203 PolarHBondContact O-ND1 3.26Å
200	M	90.5	Very high	90.6	Very high	49 Å²	49	53.5 Å²	53.5	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-39.9	175.5	-77.6	-179	62	0	0	111.5	V196 T197 D198 H203 G204 A205 M207 I217	V196-M200 HydrophobicContact CG1-CG 4.32Å; V196-M200 HydrophobicContact CG1-SD 4.05Å; V196-M200 WeakPolarHBondContact O-CB 3.37Å; V196-M200 VanDerWaalsContact O-CG 3.28Å; V196-M200 WeakPolarHBondContact O-CG 3.42Å; V196-M200 PolarHBondContact O-N 2.97Å; T197-M200 PolarHBondContact O-N 2.89Å; D198-M200 PolarHBondContact O-N 2.98Å; M200-H203 CarbonylContact O-C 3.33Å; M200-H203 PolarHBondContact O-N 3.29Å; M200-G204 PolarHBondContact O-N 3.11Å; M200-A205 HydrophobicContact CB-CB 4.4Å; M200-A205 WeakPolarHBondContact CB-O 3.42Å; M200-A205 HydrophobicContact CE-CB 4.31Å; M200-A205 WeakPolarHBondContact CE-O 3.34Å; M200-A205 PolarHBondContact O-N 2.99Å; M200-M207 HydrophobicContact CE-CE 3.94Å; M200-M207 HydrophobicContact CE-CG 3.97Å; M200-M207 HydrophobicContact CE-SD 4.15Å; M200-M207 HydrophobicContact SD-CE 4.44Å; M200-I217 HydrophobicContact SD-CD1 3.96Å
201	R	88.5	Confident	90.5	Very high	99 Å²	99	56.6 Å²	56.6	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-66.1	-39.9	175.8	-77.2	171.4	175.3	-136.2	-19.6	113	T197 D198 L199 H203 G204 V206	T197-R201 WeakPolarHBondContact O-CG 3.47Å; T197-R201 PolarHBondContact O-N 3.32Å; D198-R201 WeakPolarHBondContact O-CB 3.45Å; D198-R201 PolarHBondContact O-N 2.97Å; L199-R201 VanDerWaalsContact C-N 3.33Å; R201-H203 PolarHBondContact O-N 2.76Å; R201-G204 PolarHBondContact O-N 3.15Å; R201-V206 HydrophobicContact CG-CG2 4.21Å
202	E	85.3	Confident	90.5	Very high	113 Å²	113	59.1 Å²	59.1	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-58.4	-29.7	175.1	-73.1	-179.3	169.5	0	0	112.3	D198 L199 Y399	D198-E202 WeakPolarHBondContact O-CG 3.44Å; D198-E202 PolarHBondContact O-N 3.38Å; L199-E202 PolarHBondContact O-N 3.1Å; E202-Y399 PolarHBondContact OE1-OH 3.06Å
203	H	89.1	Confident	90.4	Very high	145 Å²	145	58 Å²	58	67%	0.671	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	9.2	178	-64.9	79.9	0	0	0	113.9	L199 M200 R201 A205	L199-H203 PolarHBondContact O-N 3.2Å; L199-H203 PolarHBondContact O-ND1 3.26Å; M200-H203 CarbonylContact O-C 3.33Å; M200-H203 PolarHBondContact O-N 3.29Å; R201-H203 PolarHBondContact O-N 2.76Å; H203-A205 VanDerWaalsContact C-N 3.32Å; H203-A205 PolarHBondContact O-N 3.42Å
204	G	86.4	Confident	90.4	Very high	66 Å²	66	58.4 Å²	58.4	68%	0.68	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	14.5	177.9	0	0	0	0	0	115.5	M200 R201 V206	M200-G204 PolarHBondContact O-N 3.11Å; R201-G204 PolarHBondContact O-N 3.15Å; G204-V206 PolarHBondContact O-N 2.71Å
205	A	88.1	Confident	90.5	Very high	48 Å²	48	62.2 Å²	62.2	40%	0.397	33%	0.33	S	S	.	.			trans	-95.8	86.3	178.7	0	0	0	0	0	111.1	M200 H203	M200-A205 HydrophobicContact CB-CB 4.4Å; M200-A205 WeakPolarHBondContact CB-O 3.42Å; M200-A205 HydrophobicContact CE-CB 4.31Å; M200-A205 WeakPolarHBondContact CE-O 3.34Å; M200-A205 PolarHBondContact O-N 2.99Å; H203-A205 VanDerWaalsContact C-N 3.32Å; H203-A205 PolarHBondContact O-N 3.42Å
206	V	88.5	Confident	90.6	Very high	86 Å²	86	65.5 Å²	65.5	52%	0.521	35%	0.347	S	S	.	.			trans	-101.6	130.1	175.8	-176.9	0	0	0	0	109.8	R201 G204	R201-V206 HydrophobicContact CG-CG2 4.21Å; G204-V206 PolarHBondContact O-N 2.71Å
207	M	87.4	Confident	90.7	Very high	97 Å²	97	65 Å²	65	48%	0.478	34%	0.343	S	S	.	.			trans	-90.8	-57.5	178.8	-66.6	-178.4	-67.7	0	0	111.8	M200 D213 I217	M200-M207 HydrophobicContact CE-CE 3.94Å; M200-M207 HydrophobicContact CE-CG 3.97Å; M200-M207 HydrophobicContact CE-SD 4.15Å; M200-M207 HydrophobicContact SD-CE 4.44Å; M207-D213 HydrophobicContact CE-CB 4.18Å; M207-I217 HydrophobicContact CE-CD1 3.97Å; M207-I217 HydrophobicContact CE-CG1 3.99Å
208	V	90.3	Very high	90.9	Very high	80 Å²	80	65 Å²	65	49%	0.485	34%	0.343	S	S	.	.	S	Bend	trans	-134.7	-78.5	-178.9	-173.2	0	0	0	0	110.8	N212 D213 I216	V208-N212 HydrophobicContact CB-CB 4.4Å; V208-N212 HydrophobicContact CG1-CB 4.33Å; V208-D213 PolarHBondContact N-OD1 2.98Å; V208-I216 HydrophobicContact CG2-CD1 4.33Å
209	D	90.5	Very high	91.2	Very high	94 Å²	94	66.3 Å²	66.3	50%	0.503	35%	0.35	S	S	.	.			trans	-153.2	155.8	-174.2	-78	-46.1	0	0	0	109.1	T211 N212 D213	D209-T211 VanDerWaalsContact C-N 3.32Å; D209-T211 PolarHBondContact O-N 2.69Å; D209-T211 VanDerWaalsContact O-N 3.15Å; D209-N212 HydrophobicContact CB-CB 4.32Å; D209-N212 PolarHBondContact O-N 3.45Å; D209-N212 VanDerWaalsContact O-N 3.09Å; D209-D213 PolarHBondContact N-OD1 3.17Å; D209-D213 WeakPolarHBondContact O-CB 3.4Å; D209-D213 PolarHBondContact O-N 3.22Å
210	R	88.7	Confident	91.5	Very high	101 Å²	101	68.4 Å²	68.4	38%	0.381	36%	0.36	S	S	.	.	H	α-helix	trans	-49.2	-52.7	-174.8	-161.9	177.3	-178.2	166	3.2	112.4	T197 D198 I214	T197-R210 HydrophobicContact CG2-CG 4.45Å; D198-R210 IonicContact OD1-CZ 3.31Å; D198-R210 IonicContact OD1-NE 3.83Å; D198-R210 IonicContact OD1-NH2 2.91Å; D198-R210 PolarHBondContact OD1-NH2 3.35Å; D198-R210 IonicContact OD2-NH2 3.99Å; R210-I214 HydrophobicContact CG-CD1 4.34Å; R210-I214 WeakPolarHBondContact O-CD1 3.47Å; R210-I214 VanDerWaalsContact O-CG1 3.26Å; R210-I214 WeakPolarHBondContact O-CG1 3.47Å; R210-I214 PolarHBondContact O-N 3.36Å
211	T	92.3	Very high	91.7	Very high	66 Å²	66	66.8 Å²	66.8	41%	0.405	35%	0.353	S	S	.	.	H	α-helix	trans	-71.7	-38.3	-174.4	-47.8	0	0	0	0	111.4	D209 I214 R215 A479	D209-T211 VanDerWaalsContact C-N 3.32Å; D209-T211 PolarHBondContact O-N 2.69Å; D209-T211 VanDerWaalsContact O-N 3.15Å; T211-I214 PolarHBondContact O-N 2.73Å; T211-R215 WeakPolarHBondContact O-CG 3.32Å; T211-R215 PolarHBondContact O-N 3.11Å; T211-R215 VanDerWaalsContact O-N 3.14Å; T211-A479 HydrophobicContact CG2-CB 3.72Å
212	N	93.3	Very high	92	Very high	52 Å²	52	62.1 Å²	62.1	28%	0.278	34%	0.336	S	S	.	.	H	α-helix	trans	-73.6	-34.2	179.6	-69.1	-34.3	0	0	0	111.9	V208 D209 R215 I216	V208-N212 HydrophobicContact CB-CB 4.4Å; V208-N212 HydrophobicContact CG1-CB 4.33Å; D209-N212 HydrophobicContact CB-CB 4.32Å; D209-N212 PolarHBondContact O-N 3.45Å; D209-N212 VanDerWaalsContact O-N 3.09Å; N212-R215 WeakPolarHBondContact O-CB 3.34Å; N212-R215 PolarHBondContact O-N 2.89Å; N212-R215 PolarHBondContact OD1-NH1 3.45Å; N212-I216 VanDerWaalsContact O-CG1 3.28Å; N212-I216 WeakPolarHBondContact O-CG1 3.47Å; N212-I216 PolarHBondContact O-N 3.22Å
213	D	94.1	Very high	92.5	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-43.5	174.2	-65.8	-7.5	0	0	0	110.3	T197 M207 V208 D209 R215 I216 I217	T197-D213 HydrophobicContact CG2-CB 3.73Å; M207-D213 HydrophobicContact CE-CB 4.18Å; V208-D213 PolarHBondContact N-OD1 2.98Å; D209-D213 PolarHBondContact N-OD1 3.17Å; D209-D213 WeakPolarHBondContact O-CB 3.4Å; D209-D213 PolarHBondContact O-N 3.22Å; D213-R215 VanDerWaalsContact C-N 3.32Å; D213-R215 PolarHBondContact O-N 2.76Å; D213-I216 PolarHBondContact O-N 3.19Å; D213-I217 WeakPolarHBondContact O-CB 3.35Å; D213-I217 WeakPolarHBondContact O-CD1 3.5Å; D213-I217 VanDerWaalsContact O-CG1 3.28Å; D213-I217 WeakPolarHBondContact O-CG1 3.36Å; D213-I217 PolarHBondContact O-N 3.43Å
214	I	94.2	Very high	92.7	Very high	10 Å²	10	56.4 Å²	56.4	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-42.6	173.1	-68	167.2	0	0	0	111.1	V190 A193 E194 T197 R210 T211 G218 A479	V190-I214 HydrophobicContact CG1-CG2 4.18Å; A193-I214 HydrophobicContact CB-CG2 4.02Å; A193-I214 WeakPolarHBondContact CB-O 3.45Å; E194-I214 HydrophobicContact CB-CD1 4.44Å; T197-I214 HydrophobicContact CG2-CG1 4.43Å; R210-I214 HydrophobicContact CG-CD1 4.34Å; R210-I214 WeakPolarHBondContact O-CD1 3.47Å; R210-I214 VanDerWaalsContact O-CG1 3.26Å; R210-I214 WeakPolarHBondContact O-CG1 3.47Å; R210-I214 PolarHBondContact O-N 3.36Å; T211-I214 PolarHBondContact O-N 2.73Å; I214-G218 WeakPolarHBondContact O-CA 3.3Å; I214-G218 PolarHBondContact O-N 2.8Å; I214-A479 HydrophobicContact CB-CB 4.35Å; I214-A479 HydrophobicContact CG2-CB 3.95Å
215	R	95.6	Very high	92.9	Very high	91 Å²	91	53.7 Å²	53.7	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-49.5	177	-68.3	170.2	176.7	163.1	-4.6	111.7	T211 N212 D213 G218 I219 I477 A479	T211-R215 WeakPolarHBondContact O-CG 3.32Å; T211-R215 PolarHBondContact O-N 3.11Å; T211-R215 VanDerWaalsContact O-N 3.14Å; N212-R215 WeakPolarHBondContact O-CB 3.34Å; N212-R215 PolarHBondContact O-N 2.89Å; N212-R215 PolarHBondContact OD1-NH1 3.45Å; D213-R215 VanDerWaalsContact C-N 3.32Å; D213-R215 PolarHBondContact O-N 2.76Å; R215-G218 PolarHBondContact O-N 3.04Å; R215-I219 WeakPolarHBondContact O-CG1 3.47Å; R215-I219 PolarHBondContact O-N 3.17Å; R215-I477 PolarHBondContact NE-O 2.63Å; R215-I477 PolarHBondContact NH2-O 3.33Å; R215-I477 VanDerWaalsContact NH2-O 3.16Å; R215-A479 HydrophobicContact CG-CB 3.57Å
216	I	95.3	Very high	93.1	Very high	70 Å²	70	52.5 Å²	52.5	36%	0.359	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-52	-177	-67.7	164.3	0	0	0	109.9	V208 N212 D213 G218 I219 I220	V208-I216 HydrophobicContact CG2-CD1 4.33Å; N212-I216 VanDerWaalsContact O-CG1 3.28Å; N212-I216 WeakPolarHBondContact O-CG1 3.47Å; N212-I216 PolarHBondContact O-N 3.22Å; D213-I216 PolarHBondContact O-N 3.19Å; I216-G218 VanDerWaalsContact C-N 3.29Å; I216-G218 PolarHBondContact O-N 3.24Å; I216-I219 PolarHBondContact O-N 3.15Å; I216-I220 HydrophobicContact CG2-CD1 3.76Å; I216-I220 VanDerWaalsContact O-CG1 3.28Å; I216-I220 WeakPolarHBondContact O-CG1 3.28Å; I216-I220 PolarHBondContact O-N 3.33Å
217	I	95.6	Very high	93.1	Very high	16 Å²	16	50.3 Å²	50.3	8%	0.082	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-40.8	179.3	-65.1	164	0	0	0	110.2	F192 A193 V196 T197 M200 M207 D213 I220 T221	F192-I217 HydrophobicContact CE1-CG2 4.38Å; A193-I217 HydrophobicContact CB-CB 4.02Å; A193-I217 HydrophobicContact CB-CG2 3.83Å; V196-I217 HydrophobicContact CB-CD1 4.41Å; V196-I217 HydrophobicContact CB-CG2 4.26Å; V196-I217 HydrophobicContact CG1-CD1 3.95Å; V196-I217 HydrophobicContact CG1-CG2 4.26Å; T197-I217 WeakPolarHBondContact OG1-CD1 3.42Å; M200-I217 HydrophobicContact SD-CD1 3.96Å; M207-I217 HydrophobicContact CE-CD1 3.97Å; M207-I217 HydrophobicContact CE-CG1 3.99Å; D213-I217 WeakPolarHBondContact O-CB 3.35Å; D213-I217 WeakPolarHBondContact O-CD1 3.5Å; D213-I217 VanDerWaalsContact O-CG1 3.28Å; D213-I217 WeakPolarHBondContact O-CG1 3.36Å; D213-I217 PolarHBondContact O-N 3.43Å; I217-I220 PolarHBondContact O-N 3.21Å; I217-T221 VanDerWaalsContact O-CB 3.3Å; I217-T221 WeakPolarHBondContact O-CB 3.28Å; I217-T221 PolarHBondContact O-N 3.3Å; I217-T221 PolarHBondContact O-OG1 3.17Å
218	G	95.3	Very high	93	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-47.4	177.6	0	0	0	0	0	112.8	T189 I214 R215 I216 T221 V222	T189-G218 WeakPolarHBondContact CG2-O 3.4Å; I214-G218 WeakPolarHBondContact O-CA 3.3Å; I214-G218 PolarHBondContact O-N 2.8Å; R215-G218 PolarHBondContact O-N 3.04Å; I216-G218 VanDerWaalsContact C-N 3.29Å; I216-G218 PolarHBondContact O-N 3.24Å; G218-T221 PolarHBondContact O-N 3.26Å; G218-V222 PolarHBondContact O-N 3.33Å
219	I	96.4	Very high	92.7	Very high	51 Å²	51	46.3 Å²	46.3	26%	0.262	25%	0.25	S	S	.	.	H	α-helix	trans	-66.2	-42	178.5	-67.3	-63.4	0	0	0	111.6	R215 I216 T221 V222 T223 A473 I476	R215-I219 WeakPolarHBondContact O-CG1 3.47Å; R215-I219 PolarHBondContact O-N 3.17Å; I216-I219 PolarHBondContact O-N 3.15Å; I219-T221 VanDerWaalsContact C-N 3.32Å; I219-T221 PolarHBondContact O-N 3.39Å; I219-V222 WeakPolarHBondContact O-CG1 3.49Å; I219-T223 WeakPolarHBondContact O-CB 3.26Å; I219-T223 PolarHBondContact O-N 3.17Å; I219-T223 PolarHBondContact O-OG1 2.97Å; I219-A473 HydrophobicContact CD1-CB 3.8Å; I219-I476 HydrophobicContact CD1-CB 4.37Å; I219-I476 HydrophobicContact CD1-CG2 4.07Å; I219-I476 HydrophobicContact CG1-CG2 4.21Å
220	I	96.3	Very high	92.3	Very high	99 Å²	99	46.8 Å²	46.8	51%	0.508	25%	0.251	S	S	.	.	H	α-helix	trans	-59.2	-48.2	175	-68	167	0	0	0	109.8	I216 I217 T223 C224	I216-I220 HydrophobicContact CG2-CD1 3.76Å; I216-I220 VanDerWaalsContact O-CG1 3.28Å; I216-I220 WeakPolarHBondContact O-CG1 3.28Å; I216-I220 PolarHBondContact O-N 3.33Å; I217-I220 PolarHBondContact O-N 3.21Å; I220-T223 WeakPolarHBondContact O-CB 3.2Å; I220-T223 PolarHBondContact O-N 2.95Å; I220-C224 PolarHBondContact O-N 3.02Å; I220-C224 PolarHBondContact O-SG 3.06Å; I220-C224 VanDerWaalsContact O-SG 3.33Å
221	T	95.1	Very high	91.7	Very high	16 Å²	16	45.7 Å²	45.7	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-48.8	-177.3	-55.6	0	0	0	0	112	T189 F192 I217 G218 I219 T223 C224 L225 L422	T189-T221 HydrophobicContact CG2-CG2 4.12Å; F192-T221 HydrophobicContact CD1-CG2 3.69Å; F192-T221 HydrophobicContact CE1-CG2 3.82Å; F192-T221 WeakPolarHBondContact CE1-OG1 3.29Å; F192-T221 HydrophobicContact CG-CG2 4.49Å; I217-T221 VanDerWaalsContact O-CB 3.3Å; I217-T221 WeakPolarHBondContact O-CB 3.28Å; I217-T221 PolarHBondContact O-N 3.3Å; I217-T221 PolarHBondContact O-OG1 3.17Å; G218-T221 PolarHBondContact O-N 3.26Å; I219-T221 VanDerWaalsContact C-N 3.32Å; I219-T221 PolarHBondContact O-N 3.39Å; T221-T223 VanDerWaalsContact C-N 3.26Å; T221-T223 PolarHBondContact O-N 3.28Å; T221-C224 PolarHBondContact O-N 3.13Å; T221-L225 HydrophobicContact CG2-CD1 4.22Å; T221-L225 HydrophobicContact CG2-CG 4.44Å; T221-L225 WeakPolarHBondContact O-CG 3.38Å; T221-L225 PolarHBondContact O-N 3.18Å; T221-L422 HydrophobicContact CG2-CD2 3.77Å
222	V	95.3	Very high	90.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-31.4	179.5	73.3	0	0	0	0	111.8	V185 T189 G218 I219 L225 L226 Y469 A472 I476	V185-V222 HydrophobicContact CG1-CG2 3.93Å; T189-V222 HydrophobicContact CG2-CB 4.25Å; G218-V222 PolarHBondContact O-N 3.33Å; I219-V222 WeakPolarHBondContact O-CG1 3.49Å; V222-L225 PolarHBondContact O-N 3.45Å; V222-L226 WeakPolarHBondContact O-CB 3.48Å; V222-L226 PolarHBondContact O-N 3.1Å; V222-Y469 HydrophobicContact CG1-CD2 4.18Å; V222-Y469 HydrophobicContact CG1-CE2 3.79Å; V222-Y469 HydrophobicContact CG2-CD2 4.27Å; V222-A472 HydrophobicContact CG2-CB 4.39Å; V222-I476 HydrophobicContact CB-CD1 3.86Å; V222-I476 HydrophobicContact CG1-CD1 3.69Å; V222-I476 HydrophobicContact CG2-CD1 4.26Å
223	T	95	Very high	89.4	Confident	63 Å²	63	43.1 Å²	43.1	39%	0.387	25%	0.249	S	C	.	.	H	α-helix	trans	-66.8	-43.5	173.7	-54.7	0	0	0	0	111.3	I219 I220 T221 L226 G227 Y469	I219-T223 WeakPolarHBondContact O-CB 3.26Å; I219-T223 PolarHBondContact O-N 3.17Å; I219-T223 PolarHBondContact O-OG1 2.97Å; I220-T223 WeakPolarHBondContact O-CB 3.2Å; I220-T223 PolarHBondContact O-N 2.95Å; T221-T223 VanDerWaalsContact C-N 3.26Å; T221-T223 PolarHBondContact O-N 3.28Å; T223-L226 WeakPolarHBondContact O-CB 3.49Å; T223-L226 PolarHBondContact O-N 3.22Å; T223-G227 PolarHBondContact O-N 3.46Å; T223-G227 VanDerWaalsContact O-N 3.09Å; T223-Y469 PolarHBondContact OG1-OH 3.18Å
224	C	93	Very high	88.3	Confident	76 Å²	76	46.2 Å²	46.2	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-62.7	-44.5	173.5	-68.4	0	0	0	0	111.9	I220 T221 L226 G227 I228	I220-C224 PolarHBondContact O-N 3.02Å; I220-C224 PolarHBondContact O-SG 3.06Å; I220-C224 VanDerWaalsContact O-SG 3.33Å; T221-C224 PolarHBondContact O-N 3.13Å; C224-L226 VanDerWaalsContact C-N 3.31Å; C224-L226 PolarHBondContact O-N 3.31Å; C224-G227 PolarHBondContact O-N 3.34Å; C224-G227 VanDerWaalsContact O-N 3.17Å; C224-I228 WeakPolarHBondContact O-CG1 3.41Å; C224-I228 PolarHBondContact O-N 3.02Å
225	L	91.2	Very high	87.4	Confident	9 Å²	9	54.6 Å²	54.6	5%	0.047	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-37.9	176.8	-70.6	177.1	0	0	0	112	T221 V222 I228 S229 L422 A425 L426 L429	T221-L225 HydrophobicContact CG2-CD1 4.22Å; T221-L225 HydrophobicContact CG2-CG 4.44Å; T221-L225 WeakPolarHBondContact O-CG 3.38Å; T221-L225 PolarHBondContact O-N 3.18Å; V222-L225 PolarHBondContact O-N 3.45Å; L225-I228 HydrophobicContact CD2-CD1 4.45Å; L225-I228 PolarHBondContact O-N 3.1Å; L225-S229 WeakPolarHBondContact O-CB 3.47Å; L225-S229 PolarHBondContact O-N 3.42Å; L225-S229 PolarHBondContact O-OG 3.47Å; L225-L422 HydrophobicContact CD1-CD2 4.33Å; L225-L422 HydrophobicContact CD2-CD2 4.29Å; L225-A425 HydrophobicContact CD1-CB 3.71Å; L225-L426 HydrophobicContact CD2-CB 4.42Å; L225-L426 HydrophobicContact CD2-CD1 4.44Å; L225-L429 HydrophobicContact CB-CD2 3.88Å
226	L	91.1	Very high	86.5	Confident	22 Å²	22	50.7 Å²	50.7	12%	0.115	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-46.8	172.8	179.6	65.1	0	0	0	110.8	V222 T223 C224 I228 S229 M230 L429 Y465 Y469	V222-L226 WeakPolarHBondContact O-CB 3.48Å; V222-L226 PolarHBondContact O-N 3.1Å; T223-L226 WeakPolarHBondContact O-CB 3.49Å; T223-L226 PolarHBondContact O-N 3.22Å; C224-L226 VanDerWaalsContact C-N 3.31Å; C224-L226 PolarHBondContact O-N 3.31Å; L226-I228 VanDerWaalsContact C-N 3.33Å; L226-I228 PolarHBondContact O-N 2.82Å; L226-S229 WeakPolarHBondContact CA-OG 3.4Å; L226-S229 PolarHBondContact O-N 3.33Å; L226-S229 PolarHBondContact O-OG 3.43Å; L226-M230 HydrophobicContact CD1-SD 4.4Å; L226-M230 HydrophobicContact CG-SD 4.21Å; L226-M230 WeakPolarHBondContact O-CG 3.34Å; L226-M230 PolarHBondContact O-N 3.47Å; L226-L429 HydrophobicContact CB-CD2 4.49Å; L226-Y465 HydrophobicContact CD1-CD1 4.46Å; L226-Y469 HydrophobicContact CB-CD2 4.4Å; L226-Y469 HydrophobicContact CD2-CD2 3.79Å; L226-Y469 HydrophobicContact CD2-CE2 4.38Å; L226-Y469 HydrophobicContact CD2-CG 3.88Å
227	G	88.6	Confident	85.5	Confident	41 Å²	41	48.3 Å²	48.3	42%	0.423	28%	0.282	S	S	.	.	H	α-helix	trans	-56.6	-44.2	174.8	0	0	0	0	0	113	T223 C224 M230 A231	T223-G227 PolarHBondContact O-N 3.46Å; T223-G227 VanDerWaalsContact O-N 3.09Å; C224-G227 PolarHBondContact O-N 3.34Å; C224-G227 VanDerWaalsContact O-N 3.17Å; G227-M230 PolarHBondContact O-N 3.04Å; G227-A231 PolarHBondContact O-N 3.04Å
228	I	86.4	Confident	84.8	Confident	86 Å²	86	54.7 Å²	54.7	44%	0.441	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-44.3	176.5	-65.3	167.9	0	0	0	111	C224 L225 L226 M230 A231 L426	C224-I228 WeakPolarHBondContact O-CG1 3.41Å; C224-I228 PolarHBondContact O-N 3.02Å; L225-I228 HydrophobicContact CD2-CD1 4.45Å; L225-I228 PolarHBondContact O-N 3.1Å; L226-I228 VanDerWaalsContact C-N 3.33Å; L226-I228 PolarHBondContact O-N 2.82Å; I228-M230 VanDerWaalsContact C-N 3.28Å; I228-M230 PolarHBondContact O-N 3.47Å; I228-A231 PolarHBondContact O-N 3.05Å; I228-L426 HydrophobicContact CG2-CD1 4.14Å; I228-L426 HydrophobicContact CG2-CD2 4.44Å
229	S	83.8	Confident	84.2	Confident	6 Å²	6	56.1 Å²	56.1	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-33.2	179.9	72.4	0	0	0	0	112.8	L225 L226	L225-S229 WeakPolarHBondContact O-CB 3.47Å; L225-S229 PolarHBondContact O-N 3.42Å; L225-S229 PolarHBondContact O-OG 3.47Å; L226-S229 WeakPolarHBondContact CA-OG 3.4Å; L226-S229 PolarHBondContact O-N 3.33Å; L226-S229 PolarHBondContact O-OG 3.43Å
230	M	81.6	Confident	83.6	Confident	105 Å²	105	54.2 Å²	54.2	52%	0.517	31%	0.311	S	S	.	.	H	α-helix	trans	-73.7	-22.8	177.3	-71.4	176.4	59.5	0	0	113.6	L226 G227 I228 G232 L462	L226-M230 HydrophobicContact CD1-SD 4.4Å; L226-M230 HydrophobicContact CG-SD 4.21Å; L226-M230 WeakPolarHBondContact O-CG 3.34Å; L226-M230 PolarHBondContact O-N 3.47Å; G227-M230 PolarHBondContact O-N 3.04Å; I228-M230 VanDerWaalsContact C-N 3.28Å; I228-M230 PolarHBondContact O-N 3.47Å; M230-G232 VanDerWaalsContact C-N 3.27Å; M230-G232 PolarHBondContact O-N 3.09Å; M230-L462 HydrophobicContact CE-CD2 3.94Å; M230-L462 HydrophobicContact CG-CD2 4.29Å
231	A	76.2	Confident	83.1	Confident	77 Å²	77	52.6 Å²	52.6	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-11	178.8	0	0	0	0	0	114	G227 I228	G227-A231 PolarHBondContact O-N 3.04Å; I228-A231 PolarHBondContact O-N 3.05Å
232	G	67.8	Low	82.8	Confident	14 Å²	14	56.9 Å²	56.9	14%	0.144	32%	0.324	C	S	.	.			trans	115.7	154	167.6	0	0	0	0	0	116.1	M230 A234 W235	M230-G232 VanDerWaalsContact C-N 3.27Å; M230-G232 PolarHBondContact O-N 3.09Å; G232-A234 VanDerWaalsContact C-N 3.3Å; G232-A234 PolarHBondContact O-N 3.24Å; G232-W235 PolarHBondContact O-N 2.69Å
233	M	69.1	Low	82.6	Confident	51 Å²	51	59 Å²	59	25%	0.251	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-21.8	-172.6	-70.7	-130.8	-64	0	0	116.1	W235 E236 S237 V430 K434	M233-W235 VanDerWaalsContact C-N 3.3Å; M233-W235 PolarHBondContact O-N 2.99Å; M233-E236 PolarHBondContact O-N 3.49Å; M233-S237 PolarHBondContact O-N 2.91Å; M233-V430 HydrophobicContact SD-CG1 3.91Å; M233-K434 HydrophobicContact SD-CD 4.38Å; M233-K434 PolarHBondContact SD-NZ 3.13Å
234	A	72.1	Confident	82.4	Confident	68 Å²	68	57.6 Å²	57.6	56%	0.562	32%	0.322	S	S	*	.	H	α-helix	trans	-64.1	-36.6	-177.2	0	0	0	0	0	112.3	G232 S237	G232-A234 VanDerWaalsContact C-N 3.3Å; G232-A234 PolarHBondContact O-N 3.24Å; A234-S237 PolarHBondContact O-OG 3.43Å
235	W	73.9	Confident	82.4	Confident	185 Å²	185	58.8 Å²	58.8	70%	0.701	32%	0.323	S	S	*	.	H	α-helix	trans	-74.3	-36.8	178.1	-72.5	97.7	0	0	0	112.3	G232 M233 S237 K238 A239	G232-W235 PolarHBondContact O-N 2.69Å; M233-W235 VanDerWaalsContact C-N 3.3Å; M233-W235 PolarHBondContact O-N 2.99Å; W235-S237 PolarHBondContact O-N 3.43Å; W235-K238 PolarHBondContact O-N 3.39Å; W235-A239 WeakPolarHBondContact O-CB 3.43Å; W235-A239 PolarHBondContact O-N 3.37Å
236	E	78.3	Confident	82.5	Confident	9 Å²	9	60.3 Å²	60.3	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-48.7	176	173.2	-97.6	-171.3	0	0	111.8	R99 M233 K238 A239 Q240 L426	R99-E236 IonicContact CZ-OE1 3.12Å; R99-E236 IonicContact CZ-OE2 2.85Å; R99-E236 IonicContact NH1-OE1 2.67Å; R99-E236 PolarHBondContact NH1-OE1 2.82Å; R99-E236 IonicContact NH1-OE2 2.92Å; R99-E236 IonicContact NH2-OE1 2.78Å; R99-E236 PolarHBondContact NH2-OE1 3.46Å; R99-E236 IonicContact NH2-OE2 3.5Å; R99-E236 PolarHBondContact NH2-OE2 3.19Å; M233-E236 PolarHBondContact O-N 3.49Å; E236-K238 VanDerWaalsContact C-N 3.29Å; E236-K238 PolarHBondContact O-N 2.92Å; E236-A239 PolarHBondContact O-N 3.26Å; E236-Q240 WeakPolarHBondContact O-CG 3.33Å; E236-Q240 PolarHBondContact O-N 3.38Å; E236-Q240 PolarHBondContact OE1-NE2 3.05Å; E236-L426 HydrophobicContact CB-CD2 4.32Å; E236-L426 HydrophobicContact CG-CD2 3.99Å; E236-L426 HydrophobicContact CG-CG 4.23Å
237	S	74.7	Confident	82.5	Confident	21 Å²	21	59.3 Å²	59.3	15%	0.147	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-33.3	-178.5	68.4	0	0	0	0	113.7	M233 A234 W235	M233-S237 PolarHBondContact O-N 2.91Å; A234-S237 PolarHBondContact O-OG 3.43Å; W235-S237 PolarHBondContact O-N 3.43Å
238	K	80.9	Confident	82.7	Confident	149 Å²	149	60.3 Å²	60.3	65%	0.648	32%	0.322	S	S	*	.	H	α-helix	trans	-74.5	-41.2	175.4	-68.9	-178.6	-179.9	-179	0	111.5	W235 E236 Q240 I241 L242	W235-K238 PolarHBondContact O-N 3.39Å; E236-K238 VanDerWaalsContact C-N 3.29Å; E236-K238 PolarHBondContact O-N 2.92Å; K238-Q240 VanDerWaalsContact C-N 3.31Å; K238-Q240 PolarHBondContact O-N 3.49Å; K238-I241 PolarHBondContact O-N 3.41Å; K238-L242 PolarHBondContact O-N 3.41Å
239	A	82.4	Confident	83.1	Confident	30 Å²	30	60 Å²	60	25%	0.248	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-35.2	178.1	0	0	0	0	0	112.4	W235 E236 I241 L242 F243	W235-A239 WeakPolarHBondContact O-CB 3.43Å; W235-A239 PolarHBondContact O-N 3.37Å; E236-A239 PolarHBondContact O-N 3.26Å; A239-I241 VanDerWaalsContact C-N 3.33Å; A239-I241 PolarHBondContact O-N 3.04Å; A239-L242 WeakPolarHBondContact O-CB 3.39Å; A239-L242 PolarHBondContact O-N 3.01Å; A239-F243 HydrophobicContact CB-CD2 4.41Å; A239-F243 HydrophobicContact CB-CE2 4.02Å; A239-F243 WeakPolarHBondContact O-CD2 3.36Å; A239-F243 WeakPolarHBondContact O-CG 3.44Å; A239-F243 PolarHBondContact O-N 2.87Å
240	Q	82.6	Confident	83.5	Confident	11 Å²	11	59.7 Å²	59.7	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-58.9	-41.3	176.8	-80.4	175.2	-10.8	0	0	113.2	R99 L102 E236 K238 L242 F243 F244	R99-Q240 VanDerWaalsContact NE-OE1 3.12Å; L102-Q240 HydrophobicContact CD1-CB 3.69Å; L102-Q240 HydrophobicContact CD1-CG 4.01Å; L102-Q240 VanDerWaalsContact CD1-O 3.31Å; L102-Q240 WeakPolarHBondContact CD1-O 3.5Å; E236-Q240 WeakPolarHBondContact O-CG 3.33Å; E236-Q240 PolarHBondContact O-N 3.38Å; E236-Q240 PolarHBondContact OE1-NE2 3.05Å; K238-Q240 VanDerWaalsContact C-N 3.31Å; K238-Q240 PolarHBondContact O-N 3.49Å; Q240-L242 VanDerWaalsContact C-N 3.32Å; Q240-L242 PolarHBondContact O-N 2.82Å; Q240-F243 PolarHBondContact O-N 3.34Å; Q240-F244 WeakPolarHBondContact O-CB 3.42Å; Q240-F244 PolarHBondContact O-N 3.36Å
241	I	85.9	Confident	84	Confident	65 Å²	65	55.8 Å²	55.8	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-40.8	178	-61.5	170.1	0	0	0	110.4	Q94 K238 A239 F244 L245	Q94-I241 HydrophobicContact CG-CD1 4.39Å; K238-I241 PolarHBondContact O-N 3.41Å; A239-I241 VanDerWaalsContact C-N 3.33Å; A239-I241 PolarHBondContact O-N 3.04Å; I241-F244 PolarHBondContact O-N 3.28Å; I241-L245 WeakPolarHBondContact O-CG 3.4Å; I241-L245 PolarHBondContact O-N 3.46Å; I241-L245 VanDerWaalsContact O-N 3.07Å
242	L	89.3	Confident	84.8	Confident	107 Å²	107	54.7 Å²	54.7	56%	0.56	29%	0.292	S	S	*	.	H	α-helix	trans	-60.7	-50.2	175.1	178.8	66.4	0	0	0	111.1	K238 A239 Q240 F244 L245 V246	K238-L242 PolarHBondContact O-N 3.41Å; A239-L242 WeakPolarHBondContact O-CB 3.39Å; A239-L242 PolarHBondContact O-N 3.01Å; Q240-L242 VanDerWaalsContact C-N 3.32Å; Q240-L242 PolarHBondContact O-N 2.82Å; L242-F244 VanDerWaalsContact C-N 3.29Å; L242-F244 PolarHBondContact O-N 2.89Å; L242-L245 PolarHBondContact O-N 2.88Å; L242-V246 WeakPolarHBondContact O-CG2 3.44Å; L242-V246 PolarHBondContact O-N 3.33Å
243	F	90.9	Very high	86	Confident	44 Å²	44	54.7 Å²	54.7	19%	0.193	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-37.8	178.2	-66.5	-47.6	0	0	0	112.5	L102 A239 Q240 V246 I247 L422	L102-F243 HydrophobicContact CD2-CB 4.48Å; A239-F243 HydrophobicContact CB-CD2 4.41Å; A239-F243 HydrophobicContact CB-CE2 4.02Å; A239-F243 WeakPolarHBondContact O-CD2 3.36Å; A239-F243 WeakPolarHBondContact O-CG 3.44Å; A239-F243 PolarHBondContact O-N 2.87Å; Q240-F243 PolarHBondContact O-N 3.34Å; F243-V246 PolarHBondContact O-N 2.97Å; F243-I247 WeakPolarHBondContact O-CD1 3.38Å; F243-I247 VanDerWaalsContact O-CG1 3.29Å; F243-I247 WeakPolarHBondContact O-CG1 3.32Å; F243-I247 PolarHBondContact O-N 3.26Å; F243-L422 HydrophobicContact CZ-CB 4.37Å
244	F	91.2	Very high	87.2	Confident	34 Å²	34	52.3 Å²	52.3	15%	0.149	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-46	175.3	-178.2	-97	0	0	0	111.8	I98 M101 L102 W105 Q240 I241 L242 V246 I247 M248	I98-F244 HydrophobicContact CG1-CE2 4.39Å; I98-F244 HydrophobicContact CG1-CZ 4.42Å; I98-F244 HydrophobicContact CG2-CB 4.07Å; I98-F244 HydrophobicContact CG2-CD2 3.82Å; I98-F244 HydrophobicContact CG2-CE2 4.41Å; I98-F244 HydrophobicContact CG2-CG 3.9Å; M101-F244 HydrophobicContact CE-CE2 4.15Å; L102-F244 HydrophobicContact CD1-CB 4.27Å; L102-F244 HydrophobicContact CD2-CB 3.94Å; L102-F244 HydrophobicContact CD2-CD2 4.22Å; L102-F244 HydrophobicContact CG-CB 4.3Å; L102-F244 HydrophobicContact CG-CD2 4.26Å; W105-F244 HydrophobicContact CH2-CE2 4.35Å; W105-F244 HydrophobicContact CZ3-CD2 4.16Å; W105-F244 AromaticContact CZ3-CE2 3.71Å; W105-F244 HydrophobicContact CZ3-CE2 3.71Å; Q240-F244 WeakPolarHBondContact O-CB 3.42Å; Q240-F244 PolarHBondContact O-N 3.36Å; I241-F244 PolarHBondContact O-N 3.28Å; L242-F244 VanDerWaalsContact C-N 3.29Å; L242-F244 PolarHBondContact O-N 2.89Å; F244-V246 PolarHBondContact O-N 2.95Å; F244-I247 PolarHBondContact O-N 2.95Å; F244-M248 HydrophobicContact CD1-CG 4.15Å; F244-M248 HydrophobicContact CE1-CG 3.76Å; F244-M248 HydrophobicContact CE1-SD 4.42Å; F244-M248 HydrophobicContact CZ-CG 3.99Å; F244-M248 HydrophobicContact CZ-SD 4.08Å; F244-M248 WeakPolarHBondContact O-CG 3.32Å; F244-M248 PolarHBondContact O-N 3.15Å
245	L	92.3	Very high	88.2	Confident	101 Å²	101	53 Å²	53	53%	0.529	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-43	176.8	-69.9	172	0	0	0	111.7	I241 L242 I247 M248 V249	I241-L245 WeakPolarHBondContact O-CG 3.4Å; I241-L245 PolarHBondContact O-N 3.46Å; I241-L245 VanDerWaalsContact O-N 3.07Å; L242-L245 PolarHBondContact O-N 2.88Å; L245-I247 VanDerWaalsContact C-N 3.32Å; L245-I247 PolarHBondContact O-N 3.49Å; L245-M248 PolarHBondContact O-N 3.27Å; L245-V249 WeakPolarHBondContact O-CG2 3.32Å; L245-V249 PolarHBondContact O-N 3.21Å
246	V	92.7	Very high	89.1	Confident	41 Å²	41	48.3 Å²	48.3	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-42.4	176.5	177.7	0	0	0	0	111.5	L242 F243 F244 V249 S250 A415	L242-V246 WeakPolarHBondContact O-CG2 3.44Å; L242-V246 PolarHBondContact O-N 3.33Å; F243-V246 PolarHBondContact O-N 2.97Å; F244-V246 PolarHBondContact O-N 2.95Å; V246-V249 PolarHBondContact O-N 3.09Å; V246-S250 WeakPolarHBondContact O-CB 3.38Å; V246-S250 PolarHBondContact O-N 3.43Å; V246-A415 HydrophobicContact CG1-CB 4.05Å; V246-A415 WeakPolarHBondContact CG1-O 3.23Å
247	I	92.3	Very high	89.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-39.9	177.6	-66.7	163.1	0	0	0	111.4	L102 W105 F243 F244 L245 S250 F251 A420	L102-I247 HydrophobicContact CD2-CD1 3.62Å; W105-I247 HydrophobicContact CD2-CG2 4.47Å; W105-I247 HydrophobicContact CE3-CG2 3.87Å; W105-I247 HydrophobicContact CZ3-CG2 4.21Å; F243-I247 WeakPolarHBondContact O-CD1 3.38Å; F243-I247 VanDerWaalsContact O-CG1 3.29Å; F243-I247 WeakPolarHBondContact O-CG1 3.32Å; F243-I247 PolarHBondContact O-N 3.26Å; F244-I247 PolarHBondContact O-N 2.95Å; L245-I247 VanDerWaalsContact C-N 3.32Å; L245-I247 PolarHBondContact O-N 3.49Å; I247-S250 WeakPolarHBondContact O-CB 3.33Å; I247-S250 PolarHBondContact O-N 3.47Å; I247-F251 HydrophobicContact CG2-CD2 4.26Å; I247-F251 HydrophobicContact CG2-CE1 4.21Å; I247-F251 HydrophobicContact CG2-CE2 3.68Å; I247-F251 HydrophobicContact CG2-CZ 3.61Å; I247-F251 PolarHBondContact O-N 3.42Å; I247-A420 HydrophobicContact CD1-CB 4.06Å; I247-A420 HydrophobicContact CG1-CB 4.41Å
248	M	92.8	Very high	90.5	Very high	63 Å²	63	46.9 Å²	46.9	31%	0.31	26%	0.255	S	S	.	.	H	α-helix	trans	-63.3	-43.7	176	-68.8	-59	89.2	0	0	112.7	W105 F244 L245 S250 F251 A252	W105-M248 HydrophobicContact CE3-CE 4.18Å; W105-M248 HydrophobicContact CH2-CE 3.16Å; W105-M248 HydrophobicContact CH2-SD 4.22Å; W105-M248 HydrophobicContact CZ2-CE 4.17Å; W105-M248 HydrophobicContact CZ3-CE 3.19Å; W105-M248 HydrophobicContact CZ3-SD 4.46Å; F244-M248 HydrophobicContact CD1-CG 4.15Å; F244-M248 HydrophobicContact CE1-CG 3.76Å; F244-M248 HydrophobicContact CE1-SD 4.42Å; F244-M248 HydrophobicContact CZ-CG 3.99Å; F244-M248 HydrophobicContact CZ-SD 4.08Å; F244-M248 WeakPolarHBondContact O-CG 3.32Å; F244-M248 PolarHBondContact O-N 3.15Å; L245-M248 PolarHBondContact O-N 3.27Å; M248-S250 VanDerWaalsContact C-N 3.32Å; M248-F251 HydrophobicContact CE-CD2 3.39Å; M248-F251 HydrophobicContact CE-CE2 3.55Å; M248-F251 HydrophobicContact CE-CG 4.49Å; M248-F251 PolarHBondContact O-N 3.31Å; M248-A252 PolarHBondContact O-N 3.06Å
249	V	93.8	Very high	91	Very high	79 Å²	79	45.6 Å²	45.6	48%	0.479	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-38.1	177.1	178	0	0	0	0	110.7	L245 V246 A252 S253 L412	L245-V249 WeakPolarHBondContact O-CG2 3.32Å; L245-V249 PolarHBondContact O-N 3.21Å; V246-V249 PolarHBondContact O-N 3.09Å; V249-A252 PolarHBondContact O-N 2.99Å; V249-S253 PolarHBondContact O-N 3.26Å; V249-L412 HydrophobicContact CG1-CD1 3.9Å; V249-L412 HydrophobicContact CG1-CD2 3.67Å; V249-L412 HydrophobicContact CG1-CG 4.21Å
250	S	93.5	Very high	91.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-47.9	171.6	168.4	0	0	0	0	112.5	Y110 V246 I247 M248 A252 S253 Y254 I413	Y110-S250 WeakPolarHBondContact CE1-OG 3.45Å; Y110-S250 PolarHBondContact OH-OG 2.96Å; V246-S250 WeakPolarHBondContact O-CB 3.38Å; V246-S250 PolarHBondContact O-N 3.43Å; I247-S250 WeakPolarHBondContact O-CB 3.33Å; I247-S250 PolarHBondContact O-N 3.47Å; M248-S250 VanDerWaalsContact C-N 3.32Å; S250-A252 PolarHBondContact O-N 3.22Å; S250-S253 PolarHBondContact O-N 3.45Å; S250-Y254 PolarHBondContact O-N 2.89Å; S250-I413 WeakPolarHBondContact O-CD1 3.37Å; S250-I413 WeakPolarHBondContact OG-CD1 3.26Å
251	F	91.7	Very high	91.5	Very high	22 Å²	22	54.2 Å²	54.2	10%	0.096	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-40.3	176.9	-69.3	-20.3	0	0	0	113.4	W105 L109 Y110 I247 M248 S253 Y254 I255 I343	W105-F251 AromaticContact CD2-CE2 3.99Å; W105-F251 HydrophobicContact CD2-CE2 3.99Å; W105-F251 HydrophobicContact CD2-CZ 4.13Å; W105-F251 AromaticContact CE2-CE2 3.69Å; W105-F251 HydrophobicContact CE3-CE2 4.21Å; W105-F251 HydrophobicContact CG-CZ 4.37Å; W105-F251 AromaticContact CH2-CE2 3.87Å; W105-F251 HydrophobicContact CH2-CE2 3.87Å; W105-F251 AromaticContact CZ2-CE2 3.65Å; W105-F251 HydrophobicContact CZ2-CE2 3.65Å; W105-F251 HydrophobicContact CZ2-CZ 4.46Å; W105-F251 HydrophobicContact CZ3-CE2 4.16Å; L109-F251 HydrophobicContact CD2-CE1 3.49Å; L109-F251 VanDerWaalsContact CD2-CE1 3.49Å; L109-F251 HydrophobicContact CD2-CZ 3.31Å; L109-F251 HydrophobicContact CG-CE1 4.48Å; Y110-F251 HydrophobicContact CE1-CE1 4.16Å; Y110-F251 HydrophobicContact CE2-CE1 4.28Å; Y110-F251 AromaticContact CZ-CE1 3.65Å; Y110-F251 VanDerWaalsContact OH-CE1 3.24Å; Y110-F251 WeakPolarHBondContact OH-CE1 3.33Å; I247-F251 HydrophobicContact CG2-CD2 4.26Å; I247-F251 HydrophobicContact CG2-CE1 4.21Å; I247-F251 HydrophobicContact CG2-CE2 3.68Å; I247-F251 HydrophobicContact CG2-CZ 3.61Å; I247-F251 PolarHBondContact O-N 3.42Å; M248-F251 HydrophobicContact CE-CD2 3.39Å; M248-F251 HydrophobicContact CE-CE2 3.55Å; M248-F251 HydrophobicContact CE-CG 4.49Å; M248-F251 PolarHBondContact O-N 3.31Å; F251-S253 VanDerWaalsContact C-N 3.3Å; F251-S253 PolarHBondContact O-N 3.07Å; F251-Y254 WeakPolarHBondContact O-CB 3.31Å; F251-Y254 PolarHBondContact O-N 3.38Å; F251-I255 WeakPolarHBondContact O-CG1 3.36Å; F251-I255 PolarHBondContact O-N 3.28Å; F251-I343 HydrophobicContact CD1-CD1 4.46Å; F251-I343 HydrophobicContact CE1-CD1 4.26Å
252	A	92.7	Very high	91.5	Very high	54 Å²	54	51.9 Å²	51.9	45%	0.446	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-43.9	175.1	0	0	0	0	0	110.9	M248 V249 S250 Y254 I255 V256	M248-A252 PolarHBondContact O-N 3.06Å; V249-A252 PolarHBondContact O-N 2.99Å; S250-A252 PolarHBondContact O-N 3.22Å; A252-Y254 PolarHBondContact O-N 3.34Å; A252-I255 PolarHBondContact O-N 3.11Å; A252-V256 VanDerWaalsContact O-CG2 3.28Å; A252-V256 WeakPolarHBondContact O-CG2 3.27Å; A252-V256 PolarHBondContact O-N 3.18Å
253	S	93.8	Very high	91.5	Very high	14 Å²	14	49.5 Å²	49.5	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-36.8	176.7	-173.5	0	0	0	0	113.5	V249 S250 F251 G257 A408 F409 L412	V249-S253 PolarHBondContact O-N 3.26Å; S250-S253 PolarHBondContact O-N 3.45Å; F251-S253 VanDerWaalsContact C-N 3.3Å; F251-S253 PolarHBondContact O-N 3.07Å; S253-G257 PolarHBondContact O-N 3.25Å; S253-A408 PolarHBondContact O-N 2.97Å; S253-F409 PolarHBondContact OG-N 2.95Å; S253-L412 VanDerWaalsContact CB-CD2 3.44Å
254	Y	93.6	Very high	91.3	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-60.9	-52.7	172.8	169.8	-106.3	0	0	0	111.4	S250 F251 A252 V256 G257 T258 I343 T346 V347 L403 V406	S250-Y254 PolarHBondContact O-N 2.89Å; F251-Y254 WeakPolarHBondContact O-CB 3.31Å; F251-Y254 PolarHBondContact O-N 3.38Å; A252-Y254 PolarHBondContact O-N 3.34Å; Y254-V256 PolarHBondContact O-N 2.92Å; Y254-G257 WeakPolarHBondContact O-CA 3.39Å; Y254-G257 PolarHBondContact O-N 3.49Å; Y254-G257 VanDerWaalsContact O-N 3.1Å; Y254-T258 HydrophobicContact CD2-CG2 4.47Å; Y254-T258 HydrophobicContact CE1-CG2 4.19Å; Y254-T258 HydrophobicContact CE2-CG2 3.96Å; Y254-T258 WeakPolarHBondContact O-CG2 3.49Å; Y254-T258 PolarHBondContact O-N 3Å; Y254-I343 HydrophobicContact CD1-CG1 4.38Å; Y254-I343 HydrophobicContact CE1-CB 4.44Å; Y254-I343 HydrophobicContact CE1-CG1 3.95Å; Y254-I343 HydrophobicContact CE1-CG2 4.26Å; Y254-T346 WeakPolarHBondContact CE1-OG1 3.13Å; Y254-T346 PolarHBondContact OH-OG1 3.19Å; Y254-V347 PolarHBondContact OH-N 2.95Å; Y254-L403 HydrophobicContact CD2-CD2 4.38Å; Y254-L403 HydrophobicContact CD2-CG 4.03Å; Y254-L403 HydrophobicContact CE2-CG 3.9Å; Y254-V406 HydrophobicContact CD2-CG1 4.43Å; Y254-V406 HydrophobicContact CE2-CB 4.27Å; Y254-V406 HydrophobicContact CE2-CG1 3.95Å
255	I	92.4	Very high	91.1	Very high	81 Å²	81	56.1 Å²	56.1	42%	0.415	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-45.9	-178.3	-65.4	173.1	0	0	0	110.6	F251 A252 G257 T258 I259	F251-I255 WeakPolarHBondContact O-CG1 3.36Å; F251-I255 PolarHBondContact O-N 3.28Å; A252-I255 PolarHBondContact O-N 3.11Å; I255-G257 VanDerWaalsContact C-N 3.26Å; I255-G257 PolarHBondContact O-N 2.86Å; I255-T258 PolarHBondContact O-N 3.46Å; I255-T258 PolarHBondContact O-OG1 3.32Å; I255-I259 HydrophobicContact CG2-CD1 4.33Å; I255-I259 PolarHBondContact O-N 2.95Å
256	V	92.6	Very high	90.9	Very high	87 Å²	87	53.6 Å²	53.6	53%	0.527	30%	0.304	S	S	.	.	H	α-helix	trans	-59.1	-40	175.5	173	0	0	0	0	111.2	A252 Y254 T258 I259 M260 A408	A252-V256 VanDerWaalsContact O-CG2 3.28Å; A252-V256 WeakPolarHBondContact O-CG2 3.27Å; A252-V256 PolarHBondContact O-N 3.18Å; Y254-V256 PolarHBondContact O-N 2.92Å; V256-T258 PolarHBondContact O-N 3.04Å; V256-I259 PolarHBondContact O-N 3.35Å; V256-M260 PolarHBondContact O-N 2.8Å; V256-A408 HydrophobicContact CG1-CB 4.18Å
257	G	91.6	Very high	90.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-39.7	176.1	0	0	0	0	0	113.9	S253 Y254 I255 I259 M260 V406 A408	S253-G257 PolarHBondContact O-N 3.25Å; Y254-G257 WeakPolarHBondContact O-CA 3.39Å; Y254-G257 PolarHBondContact O-N 3.49Å; Y254-G257 VanDerWaalsContact O-N 3.1Å; I255-G257 VanDerWaalsContact C-N 3.26Å; I255-G257 PolarHBondContact O-N 2.86Å; G257-I259 VanDerWaalsContact C-N 3.26Å; G257-I259 PolarHBondContact O-N 3.49Å; G257-M260 PolarHBondContact O-N 3.03Å; G257-V406 CarbonylContact C-O 3.28Å; G257-V406 WeakPolarHBondContact CA-O 3.33Å; G257-A408 VanDerWaalsContact CA-N 3.33Å
258	T	91.3	Very high	90.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-28.6	178.1	65.3	0	0	0	0	113.4	Y254 I255 V256 Y274 V406	Y254-T258 HydrophobicContact CD2-CG2 4.47Å; Y254-T258 HydrophobicContact CE1-CG2 4.19Å; Y254-T258 HydrophobicContact CE2-CG2 3.96Å; Y254-T258 WeakPolarHBondContact O-CG2 3.49Å; Y254-T258 PolarHBondContact O-N 3Å; I255-T258 PolarHBondContact O-N 3.46Å; I255-T258 PolarHBondContact O-OG1 3.32Å; V256-T258 PolarHBondContact O-N 3.04Å; T258-Y274 VanDerWaalsContact CB-OH 3.26Å; T258-Y274 WeakPolarHBondContact CB-OH 3.49Å; T258-Y274 VanDerWaalsContact O-CE2 3.31Å; T258-Y274 WeakPolarHBondContact O-CE2 3.29Å; T258-Y274 PolarHBondContact OG1-OH 3.5Å; T258-V406 HydrophobicContact CG2-CG1 3.55Å
259	I	91.5	Very high	90.4	Very high	122 Å²	122	54.6 Å²	54.6	63%	0.626	31%	0.305	S	S	*	.	H	α-helix	trans	-85.1	-26.9	-178.5	-60.2	168.6	0	0	0	111	I255 V256 G257 Y274	I255-I259 HydrophobicContact CG2-CD1 4.33Å; I255-I259 PolarHBondContact O-N 2.95Å; V256-I259 PolarHBondContact O-N 3.35Å; G257-I259 VanDerWaalsContact C-N 3.26Å; G257-I259 PolarHBondContact O-N 3.49Å; I259-Y274 HydrophobicContact CG1-CE2 4.36Å
260	M	89.7	Confident	90.1	Very high	114 Å²	114	50.9 Å²	50.9	56%	0.562	28%	0.282	S	S	*	.	S	Bend	trans	-68.8	136.4	178.9	-164.1	174.8	-177.9	0	0	110.9	V256 G257 S273	V256-M260 PolarHBondContact O-N 2.8Å; G257-M260 PolarHBondContact O-N 3.03Å; M260-S273 PolarHBondContact O-OG 3.35Å
261	P	86.8	Confident	90.1	Very high	108 Å²	108	51 Å²	51	70%	0.701	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-62.4	139.6	179.2	24.2	-33.4	0	0	0	111.5	S263	P261-S263 PolarHBondContact O-N 3.2Å
262	A	85.1	Confident	90	Very high	15 Å²	15	50.4 Å²	50.4	12%	0.124	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-65.5	124	-178.2	0	0	0	0	0	112.4	Q267 F271 S273	A262-Q267 HydrophobicContact CB-CG 3.68Å; A262-Q267 PolarHBondContact O-NE2 3.47Å; A262-F271 HydrophobicContact CB-CD1 3.37Å; A262-F271 HydrophobicContact CB-CE1 3.59Å; A262-F271 HydrophobicContact CB-CG 4.33Å; A262-F271 WeakPolarHBondContact CB-O 3.49Å; A262-S273 PolarHBondContact N-OG 2.9Å; A262-S273 VanDerWaalsContact N-OG 3.14Å
263	S	88.6	Confident	89.9	Confident	57 Å²	57	49 Å²	49	40%	0.399	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-69.5	157.4	168	62.2	0	0	0	0	111	P261 E265 K266 Q267	P261-S263 PolarHBondContact O-N 3.2Å; S263-E265 PolarHBondContact O-N 3.01Å; S263-K266 WeakPolarHBondContact O-CA 3.35Å; S263-K266 PolarHBondContact O-N 2.82Å; S263-K266 WeakPolarHBondContact OG-CG 3.42Å; S263-Q267 WeakPolarHBondContact O-CG 3.49Å; S263-Q267 PolarHBondContact O-N 2.88Å
264	V	86.9	Confident	89.8	Confident	85 Å²	85	53.1 Å²	53.1	52%	0.515	28%	0.281	S	S	.	.	H	α-helix	trans	-56.4	-38.4	-177.5	-178	0	0	0	0	111.4	K266 Q267 A268 L359 W381	V264-K266 PolarHBondContact O-N 2.67Å; V264-Q267 PolarHBondContact O-N 3.34Å; V264-A268 PolarHBondContact O-N 2.92Å; V264-L359 HydrophobicContact CG1-CD2 4.09Å; V264-W381 HydrophobicContact CG1-CH2 4.04Å; V264-W381 HydrophobicContact CG1-CZ2 3.94Å
265	E	87.4	Confident	89.7	Confident	132 Å²	132	57.1 Å²	57.1	62%	0.617	30%	0.298	S	S	*	.	H	α-helix	trans	-65.6	-37	175.2	-63.5	178.3	-175.2	0	0	113.4	S263 K269	S263-E265 PolarHBondContact O-N 3.01Å; E265-K269 PolarHBondContact O-N 3.26Å
266	K	88.3	Confident	89.6	Confident	49 Å²	49	57 Å²	57	21%	0.213	31%	0.309	C	S	.	.	H	α-helix	trans	-73.9	-32.6	176.3	-72.7	-175	171.6	-167.1	0	111.4	S263 V264 K269 G270 F271 M405 S407	S263-K266 WeakPolarHBondContact O-CA 3.35Å; S263-K266 PolarHBondContact O-N 2.82Å; S263-K266 WeakPolarHBondContact OG-CG 3.42Å; V264-K266 PolarHBondContact O-N 2.67Å; K266-K269 CarbonylContact O-C 3.47Å; K266-K269 PolarHBondContact O-N 3.37Å; K266-G270 PolarHBondContact O-N 3.33Å; K266-F271 HydrophobicContact CB-CB 4.29Å; K266-F271 HydrophobicContact CB-CD1 3.94Å; K266-F271 HydrophobicContact CD-CD1 4.1Å; K266-F271 HydrophobicContact CD-CE1 4.46Å; K266-F271 PolarHBondContact O-N 3.31Å; K266-M405 VanDerWaalsContact CE-O 3.26Å; K266-M405 WeakPolarHBondContact CE-O 3.37Å; K266-M405 PolarHBondContact NZ-O 3.34Å; K266-S407 PolarHBondContact NZ-O 3.02Å
267	Q	89.2	Confident	89.6	Confident	53 Å²	53	56.6 Å²	56.6	25%	0.248	30%	0.304	C	S	.	.	H	α-helix	trans	-65.2	-42.6	173.7	-67.7	177.1	7.3	0	0	111.8	A262 S263 V264 K269 G270 F271 F272 W381	A262-Q267 HydrophobicContact CB-CG 3.68Å; A262-Q267 PolarHBondContact O-NE2 3.47Å; S263-Q267 WeakPolarHBondContact O-CG 3.49Å; S263-Q267 PolarHBondContact O-N 2.88Å; V264-Q267 PolarHBondContact O-N 3.34Å; Q267-K269 PolarHBondContact O-N 3.17Å; Q267-G270 WeakPolarHBondContact O-CA 3.42Å; Q267-G270 PolarHBondContact O-N 2.93Å; Q267-F271 WeakPolarHBondContact CA-O 3.33Å; Q267-F271 WeakPolarHBondContact CG-O 3.31Å; Q267-F272 HydrophobicContact CB-CD1 4.41Å; Q267-F272 HydrophobicContact CB-CE1 3.97Å; Q267-F272 HydrophobicContact CG-CD1 4.15Å; Q267-F272 HydrophobicContact CG-CE1 4.17Å; Q267-W381 HydrophobicContact CB-CZ2 3.69Å
268	A	88.9	Confident	89.5	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-57.5	-32.9	173.6	0	0	0	0	0	112.7	V264 G270 G357 L359 W381	V264-A268 PolarHBondContact O-N 2.92Å; A268-G270 VanDerWaalsContact C-N 3.32Å; A268-G357 WeakPolarHBondContact O-CA 3.34Å; A268-G357 PolarHBondContact O-N 3.36Å; A268-L359 HydrophobicContact CB-CD2 4.06Å; A268-W381 HydrophobicContact CB-CE3 4.4Å; A268-W381 HydrophobicContact CB-CH2 3.56Å; A268-W381 HydrophobicContact CB-CZ2 4.4Å; A268-W381 HydrophobicContact CB-CZ3 3.56Å
269	K	88.1	Confident	89.6	Confident	71 Å²	71	60.4 Å²	60.4	31%	0.309	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.3	176.4	-65.1	177.5	-179.2	177	0	113.8	E265 K266 Q267 A355 Y394 G395 M405	E265-K269 PolarHBondContact O-N 3.26Å; K266-K269 CarbonylContact O-C 3.47Å; K266-K269 PolarHBondContact O-N 3.37Å; Q267-K269 PolarHBondContact O-N 3.17Å; K269-A355 VanDerWaalsContact C-CB 3.47Å; K269-A355 WeakPolarHBondContact O-CB 3.38Å; K269-Y394 HydrophobicContact CB-CD1 4.24Å; K269-Y394 HydrophobicContact CB-CG 4.19Å; K269-Y394 HydrophobicContact CD-CD1 4.22Å; K269-Y394 HydrophobicContact CD-CE1 4.03Å; K269-Y394 HydrophobicContact CG-CD1 4.01Å; K269-Y394 HydrophobicContact CG-CD2 4.18Å; K269-Y394 HydrophobicContact CG-CE1 4.2Å; K269-Y394 HydrophobicContact CG-CE2 4.33Å; K269-Y394 HydrophobicContact CG-CG 3.99Å; K269-G395 PolarHBondContact O-N 2.82Å; K269-M405 HydrophobicContact CB-CE 4.36Å; K269-M405 HydrophobicContact CB-CG 4.24Å; K269-M405 HydrophobicContact CB-SD 4.35Å; K269-M405 HydrophobicContact CD-CG 4.32Å; K269-M405 WeakPolarHBondContact O-CE 3.31Å
270	G	88.9	Confident	89.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.3	6.1	171.8	0	0	0	0	0	116.7	K266 Q267 A268 F272 V351 V352	K266-G270 PolarHBondContact O-N 3.33Å; Q267-G270 WeakPolarHBondContact O-CA 3.42Å; Q267-G270 PolarHBondContact O-N 2.93Å; A268-G270 VanDerWaalsContact C-N 3.32Å; G270-F272 WeakPolarHBondContact O-CD2 3.49Å; G270-V351 VanDerWaalsContact O-CA 3.29Å; G270-V351 WeakPolarHBondContact O-CA 3.31Å; G270-V351 WeakPolarHBondContact O-CG1 3.47Å; G270-V352 PolarHBondContact O-N 3.42Å
271	F	92.6	Very high	89.7	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.009	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-91.5	121.3	176.5	172.3	-109.4	0	0	0	111.7	A262 K266 Q267 C350 V351 M405 V406	A262-F271 HydrophobicContact CB-CD1 3.37Å; A262-F271 HydrophobicContact CB-CE1 3.59Å; A262-F271 HydrophobicContact CB-CG 4.33Å; A262-F271 WeakPolarHBondContact CB-O 3.49Å; K266-F271 HydrophobicContact CB-CB 4.29Å; K266-F271 HydrophobicContact CB-CD1 3.94Å; K266-F271 HydrophobicContact CD-CD1 4.1Å; K266-F271 HydrophobicContact CD-CE1 4.46Å; K266-F271 PolarHBondContact O-N 3.31Å; Q267-F271 WeakPolarHBondContact CA-O 3.33Å; Q267-F271 WeakPolarHBondContact CG-O 3.31Å; F271-C350 HydrophobicContact CD2-CB 3.91Å; F271-C350 HydrophobicContact CE2-CB 3.75Å; F271-V351 HydrophobicContact CB-CG2 4.4Å; F271-V351 HydrophobicContact CD2-CG2 4.02Å; F271-M405 HydrophobicContact CB-SD 3.64Å; F271-V406 HydrophobicContact CD2-CB 4.45Å; F271-V406 HydrophobicContact CD2-CG1 4.13Å; F271-V406 HydrophobicContact CD2-CG2 3.88Å; F271-V406 HydrophobicContact CE2-CG1 3.74Å; F271-V406 HydrophobicContact CE2-CG2 4.36Å; F271-V406 HydrophobicContact CZ-CG1 4.41Å
272	F	89.5	Confident	90	Very high	11 Å²	11	48.7 Å²	48.7	5%	0.048	27%	0.269	C	S	.	.			trans	-122.9	17.6	-175	-69.2	-76.8	0	0	0	113.7	Q267 G270 K275 I278 C350 V352 Y379 W381 F383	Q267-F272 HydrophobicContact CB-CD1 4.41Å; Q267-F272 HydrophobicContact CB-CE1 3.97Å; Q267-F272 HydrophobicContact CG-CD1 4.15Å; Q267-F272 HydrophobicContact CG-CE1 4.17Å; G270-F272 WeakPolarHBondContact O-CD2 3.49Å; F272-K275 HydrophobicContact CB-CG 4.41Å; F272-K275 WeakPolarHBondContact O-CE 3.41Å; F272-I278 HydrophobicContact CB-CD1 3.68Å; F272-I278 HydrophobicContact CD2-CD1 4.1Å; F272-I278 HydrophobicContact CG-CD1 4.25Å; F272-C350 PolarHBondContact N-O 3.07Å; F272-V352 HydrophobicContact CD2-CG1 4Å; F272-V352 HydrophobicContact CD2-CG2 4.49Å; F272-V352 HydrophobicContact CE2-CG1 4.09Å; F272-V352 HydrophobicContact CE2-CG2 4.05Å; F272-Y379 HydrophobicContact CD1-CD2 4.17Å; F272-Y379 HydrophobicContact CD1-CG 4.2Å; F272-Y379 HydrophobicContact CD2-CD2 4.46Å; F272-Y379 HydrophobicContact CE1-CD2 4.49Å; F272-Y379 HydrophobicContact CE1-CG 4.48Å; F272-Y379 HydrophobicContact CG-CD2 4.16Å; F272-W381 AromaticContact CE1-CD1 3.43Å; F272-W381 VanDerWaalsContact CE1-CD1 3.43Å; F272-W381 HydrophobicContact CE1-CG 4.24Å; F272-W381 AromaticContact CE1-NE1 3.77Å; F272-W381 HydrophobicContact CZ-CB 4.36Å; F272-W381 AromaticContact CZ-CD1 3.68Å; F272-W381 HydrophobicContact CZ-CG 4.05Å; F272-F383 HydrophobicContact CZ-CE2 4.42Å
273	S	90.2	Very high	90.5	Very high	23 Å²	23	52.7 Å²	52.7	16%	0.161	28%	0.283	C	S	.	.	S	Bend	trans	56.9	-174	-169.3	-54.2	0	0	0	0	111.9	M260 A262 K275 C350	M260-S273 PolarHBondContact O-OG 3.35Å; A262-S273 PolarHBondContact N-OG 2.9Å; A262-S273 VanDerWaalsContact N-OG 3.14Å; S273-K275 PolarHBondContact O-N 3.02Å; S273-K275 VanDerWaalsContact O-N 3.15Å; S273-C350 WeakPolarHBondContact O-CA 3.49Å
274	Y	92.2	Very high	90.7	Very high	101 Å²	101	53.9 Å²	53.9	40%	0.396	29%	0.288	S	S	.	.	S	Bend	trans	-63.3	115.7	-177.7	-70.6	-75.6	0	0	0	112.5	T258 I259 T346 S349 C350	T258-Y274 VanDerWaalsContact CB-OH 3.26Å; T258-Y274 WeakPolarHBondContact CB-OH 3.49Å; T258-Y274 VanDerWaalsContact O-CE2 3.31Å; T258-Y274 WeakPolarHBondContact O-CE2 3.29Å; T258-Y274 PolarHBondContact OG1-OH 3.5Å; I259-Y274 HydrophobicContact CG1-CE2 4.36Å; Y274-T346 HydrophobicContact CE1-CG2 4.23Å; Y274-T346 VanDerWaalsContact OH-CG2 3.27Å; Y274-T346 WeakPolarHBondContact OH-CG2 3.42Å; Y274-S349 VanDerWaalsContact CD1-OG 3.32Å; Y274-S349 WeakPolarHBondContact CD1-OG 3.48Å; Y274-S349 WeakPolarHBondContact CE1-OG 3.13Å; Y274-C350 WeakPolarHBondContact CD1-SG 3.21Å; Y274-C350 WeakPolarHBondContact CE1-SG 3.37Å
275	K	91.6	Very high	91	Very high	87 Å²	87	52.7 Å²	52.7	38%	0.378	28%	0.282	S	S	.	.			trans	-131	135	175.7	-61.2	-65.6	179.9	-179	0	111.2	F272 S273 D277 I278 F279 S349 Y379	F272-K275 HydrophobicContact CB-CG 4.41Å; F272-K275 WeakPolarHBondContact O-CE 3.41Å; S273-K275 PolarHBondContact O-N 3.02Å; S273-K275 VanDerWaalsContact O-N 3.15Å; K275-D277 VanDerWaalsContact C-N 3.33Å; K275-D277 PolarHBondContact O-N 2.86Å; K275-I278 HydrophobicContact CB-CB 4.13Å; K275-I278 HydrophobicContact CB-CD1 3.82Å; K275-I278 HydrophobicContact CB-CG1 3.81Å; K275-I278 HydrophobicContact CG-CD1 3.94Å; K275-I278 HydrophobicContact CG-CG1 4.43Å; K275-F279 PolarHBondContact O-N 3.43Å; K275-F279 VanDerWaalsContact O-N 3.13Å; K275-S349 PolarHBondContact N-O 3.28Å; K275-Y379 HydrophobicContact CD-CE1 4.21Å; K275-Y379 HydrophobicContact CG-CE1 4.44Å
276	A	90.9	Very high	91.1	Very high	77 Å²	77	49 Å²	49	64%	0.636	27%	0.266	S	S	*	.	H	α-helix	trans	-65.9	-37.3	179.8	0	0	0	0	0	112	F279 A280	A276-F279 WeakPolarHBondContact O-CB 3.33Å; A276-F279 PolarHBondContact O-N 2.61Å; A276-A280 WeakPolarHBondContact O-CB 3.42Å; A276-A280 PolarHBondContact O-N 2.66Å
277	D	91.5	Very high	91.2	Very high	79 Å²	79	51.1 Å²	51.1	42%	0.422	27%	0.273	S	S	.	.	H	α-helix	trans	-70.8	-37.9	-177.5	-41.8	-55.1	0	0	0	111.7	K275 A280 A281 L375 Y379	K275-D277 VanDerWaalsContact C-N 3.33Å; K275-D277 PolarHBondContact O-N 2.86Å; D277-A280 PolarHBondContact O-N 3.11Å; D277-A281 WeakPolarHBondContact O-CB 3.27Å; D277-A281 PolarHBondContact O-N 3.37Å; D277-L375 HydrophobicContact CB-CD2 3.35Å; D277-Y379 PolarHBondContact OD2-OH 3.2Å
278	I	90.9	Very high	91.1	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.015	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-44.8	173.3	-60.2	-179.9	0	0	0	110.1	F272 K275 A280 A281 N282 V352 Y379	F272-I278 HydrophobicContact CB-CD1 3.68Å; F272-I278 HydrophobicContact CD2-CD1 4.1Å; F272-I278 HydrophobicContact CG-CD1 4.25Å; K275-I278 HydrophobicContact CB-CB 4.13Å; K275-I278 HydrophobicContact CB-CD1 3.82Å; K275-I278 HydrophobicContact CB-CG1 3.81Å; K275-I278 HydrophobicContact CG-CD1 3.94Å; K275-I278 HydrophobicContact CG-CG1 4.43Å; I278-A280 VanDerWaalsContact C-N 3.33Å; I278-A280 PolarHBondContact O-N 3.36Å; I278-A281 PolarHBondContact O-N 3.01Å; I278-N282 WeakPolarHBondContact O-CB 3.31Å; I278-N282 PolarHBondContact O-N 3.27Å; I278-V352 HydrophobicContact CD1-CG1 4.03Å; I278-V352 HydrophobicContact CG1-CG1 4.23Å; I278-Y379 HydrophobicContact CD1-CE2 3.92Å; I278-Y379 HydrophobicContact CG1-CE2 3.94Å
279	F	93.1	Very high	90.7	Very high	79 Å²	79	55.3 Å²	55.3	35%	0.346	31%	0.306	S	S	.	.	H	α-helix	trans	-58.2	-45.6	175.4	177	-94.3	0	0	0	111.8	I122 K275 A276 N282 F283	I122-F279 HydrophobicContact CD1-CD2 3.45Å; I122-F279 VanDerWaalsContact CD1-CD2 3.45Å; I122-F279 HydrophobicContact CD1-CE2 3.59Å; I122-F279 HydrophobicContact CD1-CG 4.32Å; I122-F279 HydrophobicContact CG2-CE2 4.35Å; K275-F279 PolarHBondContact O-N 3.43Å; K275-F279 VanDerWaalsContact O-N 3.13Å; A276-F279 WeakPolarHBondContact O-CB 3.33Å; A276-F279 PolarHBondContact O-N 2.61Å; F279-N282 PolarHBondContact O-N 2.94Å; F279-F283 HydrophobicContact CE1-CD2 4.21Å; F279-F283 HydrophobicContact CZ-CD2 4.1Å; F279-F283 PolarHBondContact O-N 2.93Å
280	A	92.6	Very high	89.9	Confident	61 Å²	61	58.8 Å²	58.8	50%	0.504	34%	0.335	S	S	.	.	H	α-helix	trans	-63.4	-43.4	178.9	0	0	0	0	0	112.1	A276 D277 I278 F283	A276-A280 WeakPolarHBondContact O-CB 3.42Å; A276-A280 PolarHBondContact O-N 2.66Å; D277-A280 PolarHBondContact O-N 3.11Å; I278-A280 VanDerWaalsContact C-N 3.33Å; I278-A280 PolarHBondContact O-N 3.36Å; A280-F283 WeakPolarHBondContact O-CB 3.42Å; A280-F283 PolarHBondContact O-N 3.2Å
281	A	90.3	Very high	88.9	Confident	32 Å²	32	62.2 Å²	62.2	26%	0.264	35%	0.351	S	S	.	.	H	α-helix	trans	-67.9	-35.2	179.2	0	0	0	0	0	113.5	D277 I278 F283 R353 L375	D277-A281 WeakPolarHBondContact O-CB 3.27Å; D277-A281 PolarHBondContact O-N 3.37Å; I278-A281 PolarHBondContact O-N 3.01Å; A281-F283 VanDerWaalsContact C-N 3.31Å; A281-R353 PolarHBondContact O-NH1 3.49Å; A281-L375 HydrophobicContact CB-CD1 3.33Å
282	N	93.9	Very high	88.3	Confident	5 Å²	5	63 Å²	63	3%	0.027	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.5	177.6	-72.6	-21.9	0	0	0	113.2	G121 I122 I278 F279 G348 V351 R353	G121-N282 CarbonylContact C-O 3.59Å; G121-N282 WeakPolarHBondContact CA-O 3.48Å; I122-N282 HydrophobicContact CD1-CB 4.25Å; I122-N282 HydrophobicContact CG1-CB 4.46Å; I122-N282 PolarHBondContact N-O 2.99Å; I278-N282 WeakPolarHBondContact O-CB 3.31Å; I278-N282 PolarHBondContact O-N 3.27Å; F279-N282 PolarHBondContact O-N 2.94Å; N282-G348 WeakPolarHBondContact CB-O 3.33Å; N282-G348 PolarHBondContact ND2-O 3.44Å; N282-V351 PolarHBondContact ND2-O 2.79Å; N282-R353 WeakPolarHBondContact OD1-CG 3.34Å
283	F	94.3	Very high	88.4	Confident	98 Å²	98	65.2 Å²	65.2	43%	0.43	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-39	-179.3	-168.8	-95.9	0	0	0	112.5	I122 G123 F279 A280 A281	I122-F283 HydrophobicContact CB-CD2 4.36Å; I122-F283 PolarHBondContact N-O 2.95Å; G123-F283 PolarHBondContact N-O 3.33Å; F279-F283 HydrophobicContact CE1-CD2 4.21Å; F279-F283 HydrophobicContact CZ-CD2 4.1Å; F279-F283 PolarHBondContact O-N 2.93Å; A280-F283 WeakPolarHBondContact O-CB 3.42Å; A280-F283 PolarHBondContact O-N 3.2Å; A281-F283 VanDerWaalsContact C-N 3.31Å
284	V	92.9	Very high	88.5	Confident	82 Å²	82	66 Å²	66	50%	0.497	38%	0.378	S	S	.	.	S	Bend	trans	-88.3	149.8	-178	-66.6	0	0	0	0	112.1	R353	V284-R353 PolarHBondContact O-NH2 3.26Å
285	P	93.1	Very high	88.4	Confident	60 Å²	60	64.5 Å²	64.5	39%	0.39	37%	0.373	S	S	.	.			trans	-67.7	145.9	178.7	24.9	-32.7	0	0	0	113.4	Q119 A120 M124 W287	Q119-P285 WeakPolarHBondContact O-CA 3.44Å; A120-P285 VanDerWaalsContact O-CA 3.27Å; A120-P285 WeakPolarHBondContact O-CA 3.32Å; A120-P285 VanDerWaalsContact O-CB 3.27Å; A120-P285 WeakPolarHBondContact O-CB 3.28Å; M124-P285 HydrophobicContact CG-CG 4.44Å; P285-W287 HydrophobicContact CB-CD2 4.44Å; P285-W287 HydrophobicContact CB-CZ2 3.9Å
286	D	90.6	Very high	88.4	Confident	55 Å²	55	61 Å²	61	29%	0.294	36%	0.362	S	S	.	.			trans	-135.7	88.7	169	179.7	25.5	0	0	0	109	Q119 R288	Q119-D286 WeakPolarHBondContact CA-O 3.48Å; Q119-D286 CarbonylContact O-C 3.57Å; Q119-D286 VanDerWaalsContact O-C 3.28Å; Q119-D286 PolarHBondContact O-N 3.01Å; Q119-D286 PolarHBondContact OE1-O 3.49Å; D286-R288 IonicContact OD2-CZ 2.92Å; D286-R288 VanDerWaalsContact OD2-CZ 3.3Å; D286-R288 IonicContact OD2-NE 2.74Å; D286-R288 PolarHBondContact OD2-NE 3.02Å; D286-R288 IonicContact OD2-NH2 3.53Å; D286-R288 PolarHBondContact OD2-NH2 3.34Å
287	W	90.9	Very high	88.4	Confident	94 Å²	94	57.3 Å²	57.3	36%	0.356	33%	0.332	S	S	.	.			trans	-78.1	122.2	-174.3	-54.8	111.1	0	0	0	111.9	Q119 A120 P285 G292 F294 M297	Q119-W287 HydrophobicContact CB-CE3 4.39Å; A120-W287 HydrophobicContact CB-CH2 3.54Å; A120-W287 HydrophobicContact CB-CZ2 4.45Å; A120-W287 HydrophobicContact CB-CZ3 3.8Å; P285-W287 HydrophobicContact CB-CD2 4.44Å; P285-W287 HydrophobicContact CB-CZ2 3.9Å; W287-G292 WeakPolarHBondContact CB-O 3.3Å; W287-F294 HydrophobicContact CH2-CB 4.23Å; W287-F294 HydrophobicContact CZ2-CB 4.34Å; W287-M297 HydrophobicContact CE3-CG 4.4Å; W287-M297 HydrophobicContact CZ3-CB 4.39Å; W287-M297 HydrophobicContact CZ3-CG 3.64Å
288	R	86.3	Confident	88.6	Confident	80 Å²	80	53.6 Å²	53.6	30%	0.302	31%	0.312	S	S	.	.			trans	-124.1	143.4	-179.9	-53.4	-179.1	-178.8	-173	-1.6	111.5	Q119 D286 D354	Q119-R288 PolarHBondContact OE1-O 3.39Å; D286-R288 IonicContact OD2-CZ 2.92Å; D286-R288 VanDerWaalsContact OD2-CZ 3.3Å; D286-R288 IonicContact OD2-NE 2.74Å; D286-R288 PolarHBondContact OD2-NE 3.02Å; D286-R288 IonicContact OD2-NH2 3.53Å; D286-R288 PolarHBondContact OD2-NH2 3.34Å; R288-D354 IonicContact CZ-OD1 3.86Å; R288-D354 IonicContact CZ-OD2 3.23Å; R288-D354 VanDerWaalsContact CZ-OD2 3.31Å; R288-D354 VanDerWaalsContact NH1-CG 3.29Å; R288-D354 IonicContact NH1-OD1 2.78Å; R288-D354 PolarHBondContact NH1-OD1 3.33Å; R288-D354 IonicContact NH1-OD2 2.99Å; R288-D354 PolarHBondContact NH1-OD2 2.94Å; R288-D354 IonicContact NH2-OD1 2.84Å; R288-D354 IonicContact NH2-OD2 3.65Å; R288-D354 PolarHBondContact NH2-OD2 3.04Å
289	G	80.4	Confident	88.6	Confident	62 Å²	62	53.9 Å²	53.9	64%	0.639	31%	0.314	S	S	*	.	S	Bend	trans	77.2	177.9	175.9	0	0	0	0	0	114.7	E291 G292	G289-E291 VanDerWaalsContact C-N 3.27Å; G289-E291 PolarHBondContact O-N 3.45Å; G289-G292 PolarHBondContact O-N 3.5Å
290	P	71.3	Confident	88.6	Confident	143 Å²	143	50.2 Å²	50.2	93%	0.929	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.3	-176	26.9	-33.8	0	0	0	113.5
291	E	68.2	Low	88.7	Confident	72 Å²	72	47.4 Å²	47.4	34%	0.336	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	0.7	177.1	-58.4	-162.5	160.6	0	0	113.4	G289 S293 I300	G289-E291 VanDerWaalsContact C-N 3.27Å; G289-E291 PolarHBondContact O-N 3.45Å; E291-S293 VanDerWaalsContact C-N 3.27Å; E291-S293 PolarHBondContact O-N 2.92Å; E291-I300 WeakPolarHBondContact OE2-CD1 3.18Å
292	G	79.7	Confident	88.9	Confident	19 Å²	19	45.9 Å²	45.9	20%	0.196	26%	0.262	C	S	.	.			trans	-69.7	72.7	-178.1	0	0	0	0	0	113.2	W287 G289	W287-G292 WeakPolarHBondContact CB-O 3.3Å; G289-G292 PolarHBondContact O-N 3.5Å
293	S	90.7	Very high	88.9	Confident	57 Å²	57	45.7 Å²	45.7	40%	0.399	26%	0.261	S	S	.	.	S	Bend	trans	-144.7	161.2	173.4	69	0	0	0	0	110.9	E291 F295 G296 M297	E291-S293 VanDerWaalsContact C-N 3.27Å; E291-S293 PolarHBondContact O-N 2.92Å; S293-F295 PolarHBondContact O-N 3.4Å; S293-G296 PolarHBondContact O-N 3.21Å; S293-G296 PolarHBondContact OG-N 3.11Å; S293-M297 PolarHBondContact O-N 3.02Å
294	F	92.6	Very high	88.8	Confident	41 Å²	41	41.1 Å²	41.1	18%	0.18	24%	0.241	C	C	.	.	H	α-helix	trans	-55.7	-49.6	177.5	178.4	-95.3	0	0	0	112.5	M124 V127 I128 W287 M297 F298	M124-F294 HydrophobicContact CE-CD2 3.39Å; M124-F294 HydrophobicContact CE-CE2 3.55Å; M124-F294 HydrophobicContact CE-CG 4.39Å; V127-F294 HydrophobicContact CG1-CE2 4.17Å; V127-F294 HydrophobicContact CG1-CZ 4.12Å; I128-F294 HydrophobicContact CD1-CD2 4.23Å; I128-F294 HydrophobicContact CD1-CE2 4.17Å; I128-F294 HydrophobicContact CG1-CD2 4.05Å; I128-F294 HydrophobicContact CG1-CE2 3.5Å; I128-F294 VanDerWaalsContact CG1-CE2 3.5Å; I128-F294 HydrophobicContact CG1-CZ 3.93Å; W287-F294 HydrophobicContact CH2-CB 4.23Å; W287-F294 HydrophobicContact CZ2-CB 4.34Å; F294-M297 PolarHBondContact O-N 3.32Å; F294-F298 WeakPolarHBondContact O-CB 3.2Å; F294-F298 PolarHBondContact O-N 2.97Å
295	F	91	Very high	88.8	Confident	68 Å²	68	37.7 Å²	37.7	30%	0.298	22%	0.221	S	C	.	.	H	α-helix	trans	-74	-27.8	179.8	-71.4	-70.1	0	0	0	112.9	S293 F298 S299 L539 L540	S293-F295 PolarHBondContact O-N 3.4Å; F295-F298 PolarHBondContact O-N 2.99Å; F295-S299 WeakPolarHBondContact O-CB 3.47Å; F295-S299 PolarHBondContact O-N 3.32Å; F295-L539 HydrophobicContact CD1-CB 4.06Å; F295-L539 HydrophobicContact CD1-CD1 4.47Å; F295-L539 HydrophobicContact CD2-CB 4.42Å; F295-L539 HydrophobicContact CE1-CB 4.16Å; F295-L539 HydrophobicContact CE1-CD1 3.73Å; F295-L539 HydrophobicContact CE2-CD1 4.02Å; F295-L539 HydrophobicContact CG-CB 4.22Å; F295-L539 HydrophobicContact CZ-CB 4.4Å; F295-L539 HydrophobicContact CZ-CD1 3.49Å; F295-L539 VanDerWaalsContact CZ-CD1 3.49Å; F295-L539 HydrophobicContact CZ-CG 4.46Å; F295-L540 HydrophobicContact CB-CD2 4Å; F295-L540 HydrophobicContact CD1-CD2 4.22Å; F295-L540 WeakPolarHBondContact O-CD2 3.4Å
296	G	90.4	Very high	88.6	Confident	14 Å²	14	35 Å²	35	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-54.6	169	0	0	0	0	0	111.4	S293 F298 S299 I300	S293-G296 PolarHBondContact O-N 3.21Å; S293-G296 PolarHBondContact OG-N 3.11Å; G296-F298 VanDerWaalsContact C-N 3.34Å; G296-F298 PolarHBondContact O-N 3.21Å; G296-S299 PolarHBondContact O-N 2.88Å; G296-S299 VanDerWaalsContact O-N 3.11Å; G296-S299 PolarHBondContact O-OG 3.29Å; G296-I300 PolarHBondContact O-N 2.9Å
297	M	92.7	Very high	88.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-37.2	177.2	-65.4	-53.9	147.6	0	0	112.8	W115 I116 Q119 I128 W287 S293 F294 S299 I300 F301	W115-M297 HydrophobicContact CE3-SD 4.05Å; W115-M297 HydrophobicContact CH2-CE 3.46Å; W115-M297 VanDerWaalsContact CH2-CE 3.46Å; W115-M297 HydrophobicContact CH2-SD 3.69Å; W115-M297 HydrophobicContact CZ2-CE 3.98Å; W115-M297 HydrophobicContact CZ3-CE 3.86Å; W115-M297 HydrophobicContact CZ3-SD 3.4Å; W115-M297 WeakPolarHBondContact CZ3-SD 3.28Å; I116-M297 HydrophobicContact CG1-SD 4.15Å; I116-M297 HydrophobicContact CG2-CB 4.17Å; Q119-M297 HydrophobicContact CB-CE 3.88Å; Q119-M297 HydrophobicContact CB-CG 4.38Å; Q119-M297 HydrophobicContact CB-SD 4.15Å; Q119-M297 HydrophobicContact CG-CE 3.8Å; Q119-M297 HydrophobicContact CG-SD 4.31Å; I128-M297 HydrophobicContact CD1-CB 3.88Å; W287-M297 HydrophobicContact CE3-CG 4.4Å; W287-M297 HydrophobicContact CZ3-CB 4.39Å; W287-M297 HydrophobicContact CZ3-CG 3.64Å; S293-M297 PolarHBondContact O-N 3.02Å; F294-M297 PolarHBondContact O-N 3.32Å; M297-S299 VanDerWaalsContact C-N 3.32Å; M297-S299 PolarHBondContact O-N 2.65Å; M297-I300 PolarHBondContact O-N 3.43Å; M297-F301 VanDerWaalsContact O-CB 3.3Å; M297-F301 WeakPolarHBondContact O-CB 3.47Å; M297-F301 PolarHBondContact O-N 3.28Å
298	F	94.1	Very high	88.6	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.2	-43.6	172.5	178	-83	0	0	0	111.4	I128 L131 S132 I135 F294 F295 G296 I300 F301 F302 I536 L540	I128-F298 HydrophobicContact CG2-CB 4.36Å; I128-F298 HydrophobicContact CG2-CD2 4.12Å; L131-F298 HydrophobicContact CB-CE2 4.34Å; L131-F298 HydrophobicContact CD2-CD2 3.94Å; L131-F298 HydrophobicContact CD2-CE2 3.68Å; L131-F298 HydrophobicContact CG-CD2 4.49Å; L131-F298 HydrophobicContact CG-CE2 3.84Å; S132-F298 VanDerWaalsContact OG-CE2 3.31Å; S132-F298 WeakPolarHBondContact OG-CE2 3.43Å; I135-F298 HydrophobicContact CD1-CZ 4.08Å; F294-F298 WeakPolarHBondContact O-CB 3.2Å; F294-F298 PolarHBondContact O-N 2.97Å; F295-F298 PolarHBondContact O-N 2.99Å; G296-F298 VanDerWaalsContact C-N 3.34Å; G296-F298 PolarHBondContact O-N 3.21Å; F298-I300 VanDerWaalsContact C-N 3.28Å; F298-I300 PolarHBondContact O-N 3.48Å; F298-F301 PolarHBondContact O-N 3.45Å; F298-F302 HydrophobicContact CD1-CB 4.33Å; F298-F302 HydrophobicContact CE1-CB 3.94Å; F298-F302 AromaticContact CE1-CD2 3.9Å; F298-F302 HydrophobicContact CE1-CD2 3.9Å; F298-F302 HydrophobicContact CE1-CG 4.05Å; F298-F302 HydrophobicContact CE2-CD2 4.26Å; F298-F302 HydrophobicContact CZ-CB 4.23Å; F298-F302 AromaticContact CZ-CD2 3.49Å; F298-F302 HydrophobicContact CZ-CD2 3.49Å; F298-F302 VanDerWaalsContact CZ-CD2 3.49Å; F298-F302 HydrophobicContact CZ-CE2 4.18Å; F298-F302 HydrophobicContact CZ-CG 4.11Å; F298-F302 VanDerWaalsContact O-CB 3.28Å; F298-F302 WeakPolarHBondContact O-CB 3.48Å; F298-F302 PolarHBondContact O-N 3.2Å; F298-I536 HydrophobicContact CD1-CG2 4.04Å; F298-I536 HydrophobicContact CE1-CG2 3.4Å; F298-I536 HydrophobicContact CZ-CD1 4.15Å; F298-I536 HydrophobicContact CZ-CG2 3.97Å; F298-L540 HydrophobicContact CD1-CD1 4.36Å; F298-L540 HydrophobicContact CD1-CD2 3.96Å; F298-L540 HydrophobicContact CE1-CD1 4.44Å
299	S	91.9	Very high	88.6	Confident	9 Å²	9	24.4 Å²	24.4	6%	0.063	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-31.3	-178.7	76.7	0	0	0	0	113.4	F295 G296 M297 P303 S489	F295-S299 WeakPolarHBondContact O-CB 3.47Å; F295-S299 PolarHBondContact O-N 3.32Å; G296-S299 PolarHBondContact O-N 2.88Å; G296-S299 VanDerWaalsContact O-N 3.11Å; G296-S299 PolarHBondContact O-OG 3.29Å; M297-S299 VanDerWaalsContact C-N 3.32Å; M297-S299 PolarHBondContact O-N 2.65Å; S299-P303 WeakPolarHBondContact O-CD 3.35Å; S299-S489 PolarHBondContact O-OG 3.15Å
300	I	92.7	Very high	88.9	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-79.8	-35.4	175.9	-61.7	168.2	0	0	0	110.5	I108 W115 I116 E291 G296 M297 F298 P303 N482	I108-I300 WeakPolarHBondContact CD1-O 3.49Å; W115-I300 HydrophobicContact CH2-CD1 3.97Å; W115-I300 HydrophobicContact CZ3-CD1 3.72Å; I116-I300 HydrophobicContact CD1-CG2 4.46Å; E291-I300 WeakPolarHBondContact OE2-CD1 3.18Å; G296-I300 PolarHBondContact O-N 2.9Å; M297-I300 PolarHBondContact O-N 3.43Å; F298-I300 VanDerWaalsContact C-N 3.28Å; F298-I300 PolarHBondContact O-N 3.48Å; I300-P303 WeakPolarHBondContact O-CD 3.18Å; I300-N482 HydrophobicContact CD1-CB 4.44Å
301	F	94.9	Very high	89.5	Confident	2 Å²	2	15.1 Å²	15.1	1%	0.009	9%	0.091	C	C	.	.	H	α-helix	trans	-75.3	-41.7	179.1	-178.2	-99.6	0	0	0	112.9	I108 L113 I116 I128 I129 M297 F298 P303 S304 Y340	I108-F301 HydrophobicContact CG2-CD2 4.34Å; L113-F301 HydrophobicContact CD1-CD2 4.36Å; L113-F301 HydrophobicContact CD1-CE2 4Å; I116-F301 HydrophobicContact CD1-CB 3.9Å; I116-F301 HydrophobicContact CD1-CD2 4.06Å; I116-F301 HydrophobicContact CD1-CG 4.47Å; I128-F301 HydrophobicContact CG2-CB 3.79Å; I128-F301 HydrophobicContact CG2-CD1 3.62Å; I128-F301 HydrophobicContact CG2-CE1 4.48Å; I128-F301 HydrophobicContact CG2-CG 3.8Å; I129-F301 HydrophobicContact CB-CE1 4.33Å; I129-F301 HydrophobicContact CB-CZ 4.22Å; I129-F301 HydrophobicContact CG1-CE1 3.95Å; I129-F301 HydrophobicContact CG1-CE2 3.93Å; I129-F301 HydrophobicContact CG1-CZ 3.51Å; I129-F301 HydrophobicContact CG2-CZ 4.42Å; M297-F301 VanDerWaalsContact O-CB 3.3Å; M297-F301 WeakPolarHBondContact O-CB 3.47Å; M297-F301 PolarHBondContact O-N 3.28Å; F298-F301 PolarHBondContact O-N 3.45Å; F301-P303 VanDerWaalsContact C-N 3.33Å; F301-P303 WeakPolarHBondContact O-CD 3.44Å; F301-P303 VanDerWaalsContact O-N 3.12Å; F301-S304 WeakPolarHBondContact CD2-OG 3.29Å; F301-S304 WeakPolarHBondContact CE2-OG 3.46Å; F301-S304 VanDerWaalsContact CZ-OG 3.3Å; F301-S304 WeakPolarHBondContact CZ-OG 3.22Å; F301-S304 WeakPolarHBondContact O-CB 3.5Å; F301-S304 PolarHBondContact O-N 3.39Å; F301-S304 PolarHBondContact O-OG 3.5Å; F301-Y340 HydrophobicContact CE2-CG 4.49Å; F301-Y340 HydrophobicContact CZ-CD2 4.13Å; F301-Y340 HydrophobicContact CZ-CE2 4.49Å; F301-Y340 HydrophobicContact CZ-CG 4.26Å
302	F	94.6	Very high	90.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-53.3	-36.4	-168.6	-175.4	-99.1	0	0	0	115	I135 F298 S304 A305 T306 L493 Y496	I135-F302 HydrophobicContact CB-CE2 4.48Å; I135-F302 HydrophobicContact CD1-CE2 4.28Å; I135-F302 HydrophobicContact CG2-CE2 4.14Å; I135-F302 HydrophobicContact CG2-CZ 4.31Å; F298-F302 HydrophobicContact CD1-CB 4.33Å; F298-F302 HydrophobicContact CE1-CB 3.94Å; F298-F302 AromaticContact CE1-CD2 3.9Å; F298-F302 HydrophobicContact CE1-CD2 3.9Å; F298-F302 HydrophobicContact CE1-CG 4.05Å; F298-F302 HydrophobicContact CE2-CD2 4.26Å; F298-F302 HydrophobicContact CZ-CB 4.23Å; F298-F302 AromaticContact CZ-CD2 3.49Å; F298-F302 HydrophobicContact CZ-CD2 3.49Å; F298-F302 VanDerWaalsContact CZ-CD2 3.49Å; F298-F302 HydrophobicContact CZ-CE2 4.18Å; F298-F302 HydrophobicContact CZ-CG 4.11Å; F298-F302 VanDerWaalsContact O-CB 3.28Å; F298-F302 WeakPolarHBondContact O-CB 3.48Å; F298-F302 PolarHBondContact O-N 3.2Å; F302-S304 PolarHBondContact O-N 3.47Å; F302-S304 VanDerWaalsContact O-N 3.11Å; F302-A305 PolarHBondContact O-N 2.95Å; F302-T306 HydrophobicContact CD1-CG2 4.1Å; F302-T306 HydrophobicContact CE1-CG2 3.9Å; F302-T306 WeakPolarHBondContact O-CG2 3.34Å; F302-T306 PolarHBondContact O-N 3.43Å; F302-L493 HydrophobicContact CD1-CD2 4.5Å; F302-L493 HydrophobicContact CD1-CG 4.16Å; F302-L493 HydrophobicContact CD2-CD2 4.5Å; F302-L493 HydrophobicContact CE1-CD1 4.48Å; F302-L493 HydrophobicContact CE1-CD2 3.77Å; F302-L493 HydrophobicContact CE1-CG 3.58Å; F302-L493 HydrophobicContact CE2-CD2 3.77Å; F302-L493 HydrophobicContact CE2-CG 4.44Å; F302-L493 HydrophobicContact CZ-CD2 3.34Å; F302-L493 HydrophobicContact CZ-CG 3.74Å; F302-Y496 HydrophobicContact CE1-CE2 4.48Å; F302-Y496 HydrophobicContact CZ-CD2 4.03Å; F302-Y496 HydrophobicContact CZ-CE2 4.05Å
303	P	92.9	Very high	90.5	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.013	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-59.8	-25.2	175.8	-21	34.2	0	0	0	113	I108 M187 S299 I300 F301 A305 T306 A485 I488 S489	I108-P303 HydrophobicContact CD1-CB 3.7Å; I108-P303 HydrophobicContact CD1-CG 4.09Å; M187-P303 HydrophobicContact CE-CB 3.81Å; M187-P303 HydrophobicContact SD-CB 3.67Å; M187-P303 HydrophobicContact SD-CG 4.16Å; S299-P303 WeakPolarHBondContact O-CD 3.35Å; I300-P303 WeakPolarHBondContact O-CD 3.18Å; F301-P303 VanDerWaalsContact C-N 3.33Å; F301-P303 WeakPolarHBondContact O-CD 3.44Å; F301-P303 VanDerWaalsContact O-N 3.12Å; P303-A305 VanDerWaalsContact C-N 3.28Å; P303-A305 PolarHBondContact O-N 2.91Å; P303-T306 WeakPolarHBondContact O-CB 3.5Å; P303-T306 PolarHBondContact O-N 2.97Å; P303-T306 PolarHBondContact O-OG1 3.04Å; P303-A485 HydrophobicContact CG-CB 4.12Å; P303-I488 HydrophobicContact CB-CG2 4.1Å; P303-I488 HydrophobicContact CG-CB 4.47Å; P303-I488 HydrophobicContact CG-CG2 4.24Å; P303-S489 WeakPolarHBondContact CD-OG 3.38Å; P303-S489 VanDerWaalsContact CG-OG 3.29Å; P303-S489 WeakPolarHBondContact CG-OG 3.48Å
304	S	92	Very high	90	Very high	2 Å²	2	10.4 Å²	10.4	1%	0.014	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-69.9	-21.8	174.1	75.3	0	0	0	0	113.8	I104 F301 F302 Y340	I104-S304 WeakPolarHBondContact CG2-O 3.28Å; F301-S304 WeakPolarHBondContact CD2-OG 3.29Å; F301-S304 WeakPolarHBondContact CE2-OG 3.46Å; F301-S304 VanDerWaalsContact CZ-OG 3.3Å; F301-S304 WeakPolarHBondContact CZ-OG 3.22Å; F301-S304 WeakPolarHBondContact O-CB 3.5Å; F301-S304 PolarHBondContact O-N 3.39Å; F301-S304 PolarHBondContact O-OG 3.5Å; F302-S304 PolarHBondContact O-N 3.47Å; F302-S304 VanDerWaalsContact O-N 3.11Å; S304-Y340 PolarHBondContact O-OH 3.34Å; S304-Y340 VanDerWaalsContact O-OH 3.04Å
305	A	93.2	Very high	89.4	Confident	9 Å²	9	8.5 Å²	8.5	7%	0.074	5%	0.051	C	C	.	.	G	3₁₀ helix	trans	-90	-8.3	174.1	0	0	0	0	0	112.3	T136 F302 P303	T136-A305 HydrophobicContact CG2-CB 4.02Å; T136-A305 VanDerWaalsContact CG2-O 3.29Å; T136-A305 WeakPolarHBondContact CG2-O 3.42Å; F302-A305 PolarHBondContact O-N 2.95Å; P303-A305 VanDerWaalsContact C-N 3.28Å; P303-A305 PolarHBondContact O-N 2.91Å
306	T	89.8	Confident	88.6	Confident	4 Å²	4	6.4 Å²	6.4	3%	0.025	5%	0.048	C	C	.	.			trans	-76.3	177.6	179.7	73	0	0	0	0	111.6	I104 F302 P303 Y492 Y496	I104-T306 WeakPolarHBondContact CG1-O 3.32Å; F302-T306 HydrophobicContact CD1-CG2 4.1Å; F302-T306 HydrophobicContact CE1-CG2 3.9Å; F302-T306 WeakPolarHBondContact O-CG2 3.34Å; F302-T306 PolarHBondContact O-N 3.43Å; P303-T306 WeakPolarHBondContact O-CB 3.5Å; P303-T306 PolarHBondContact O-N 2.97Å; P303-T306 PolarHBondContact O-OG1 3.04Å; T306-Y492 HydrophobicContact CG2-CD1 4.31Å; T306-Y492 HydrophobicContact CG2-CD2 3.63Å; T306-Y492 HydrophobicContact CG2-CE2 4.22Å; T306-Y492 HydrophobicContact CG2-CG 3.67Å; T306-Y496 HydrophobicContact CG2-CE2 4.48Å
307	G	87.5	Confident	88	Confident	5 Å²	5	8.9 Å²	8.9	5%	0.052	6%	0.058	C	C	.	.			trans	92.3	4.6	179.2	0	0	0	0	0	115.4	L309 A310	G307-L309 PolarHBondContact O-N 3.26Å; G307-L309 VanDerWaalsContact O-N 3.08Å; G307-A310 VanDerWaalsContact O-CB 3.23Å; G307-A310 WeakPolarHBondContact O-CB 3.24Å; G307-A310 PolarHBondContact O-N 3.43Å
308	I	92.9	Very high	87.6	Confident	0 Å²	0	8.9 Å²	8.9	0%	0	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.6	177.4	68.3	175.3	0	0	0	114	C100 I104 T136 T139 A310 T329 I333 Y496	C100-I308 PolarHBondContact SG-O 2.88Å; I104-I308 HydrophobicContact CD1-CG2 4.35Å; T136-I308 WeakPolarHBondContact O-CD1 3.41Å; T139-I308 HydrophobicContact CG2-CD1 3.96Å; I308-A310 VanDerWaalsContact C-N 3.34Å; I308-T329 HydrophobicContact CB-CG2 3.98Å; I308-T329 WeakPolarHBondContact O-CG2 3.45Å; I308-I333 HydrophobicContact CB-CD1 4.32Å; I308-I333 HydrophobicContact CG2-CD1 3.74Å; I308-I333 HydrophobicContact CG2-CG1 3.71Å; I308-Y496 HydrophobicContact CD1-CE1 4.43Å; I308-Y496 HydrophobicContact CG1-CE1 4.46Å
309	L	88	Confident	87	Confident	1 Å²	1	15.9 Å²	15.9	1%	0.005	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	1.5	179.7	-63.1	175.9	0	0	0	113.2	T143 T157 F177 G307 G311 A312 N313 Y496 I499	T143-L309 HydrophobicContact CG2-CD2 3.49Å; T143-L309 VanDerWaalsContact CG2-CD2 3.49Å; T157-L309 HydrophobicContact CG2-CB 4.22Å; T157-L309 HydrophobicContact CG2-CD1 4.13Å; T157-L309 HydrophobicContact CG2-CD2 4.23Å; T157-L309 HydrophobicContact CG2-CG 4.41Å; T157-L309 PolarHBondContact OG1-O 2.93Å; F177-L309 HydrophobicContact CD2-CD1 4.09Å; F177-L309 HydrophobicContact CE2-CB 4.16Å; F177-L309 HydrophobicContact CE2-CD1 3.59Å; F177-L309 HydrophobicContact CE2-CG 4.43Å; F177-L309 HydrophobicContact CZ-CB 3.77Å; F177-L309 HydrophobicContact CZ-CD1 3.87Å; F177-L309 HydrophobicContact CZ-CG 4.44Å; G307-L309 PolarHBondContact O-N 3.26Å; G307-L309 VanDerWaalsContact O-N 3.08Å; L309-G311 VanDerWaalsContact C-N 3.35Å; L309-G311 PolarHBondContact O-N 3.04Å; L309-A312 PolarHBondContact O-N 3.48Å; L309-N313 PolarHBondContact O-N 3.03Å; L309-N313 PolarHBondContact O-ND2 3.4Å; L309-Y496 HydrophobicContact CD1-CE1 4.27Å; L309-I499 HydrophobicContact CD1-CD1 3.9Å
310	A	86.3	Confident	86.6	Confident	10 Å²	10	20.1 Å²	20.1	8%	0.083	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-42.2	-178.8	0	0	0	0	0	112.4	N103 G307 I308 A312 N313	N103-A310 HydrophobicContact CB-CB 3.97Å; G307-A310 VanDerWaalsContact O-CB 3.23Å; G307-A310 WeakPolarHBondContact O-CB 3.24Å; G307-A310 PolarHBondContact O-N 3.43Å; I308-A310 VanDerWaalsContact C-N 3.34Å; A310-A312 VanDerWaalsContact C-N 3.34Å; A310-N313 WeakPolarHBondContact O-CB 3.45Å; A310-N313 PolarHBondContact O-N 3.19Å
311	G	82.8	Confident	86.3	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.9	177.9	0	0	0	0	0	113.9	C100 L309 N313	C100-G311 PolarHBondContact SG-N 3.26Å; L309-G311 VanDerWaalsContact C-N 3.35Å; L309-G311 PolarHBondContact O-N 3.04Å; G311-N313 VanDerWaalsContact C-N 3.33Å
312	A	86	Confident	85.9	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.008	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-75.6	-21.3	175.1	0	0	0	0	0	112.8	G156 T157 L160 L309 A310 I314 S315 I325	G156-A312 CarbonylContact C-O 3.59Å; G156-A312 WeakPolarHBondContact CA-O 3.38Å; T157-A312 PolarHBondContact N-O 3.37Å; T157-A312 WeakPolarHBondContact OG1-CB 3.43Å; L160-A312 HydrophobicContact CD1-CB 4.21Å; L309-A312 PolarHBondContact O-N 3.48Å; A310-A312 VanDerWaalsContact C-N 3.34Å; A312-I314 VanDerWaalsContact C-N 3.25Å; A312-I314 PolarHBondContact O-N 3.37Å; A312-S315 WeakPolarHBondContact O-CB 3.34Å; A312-S315 PolarHBondContact O-N 2.89Å; A312-S315 PolarHBondContact O-OG 3.29Å; A312-I325 HydrophobicContact CB-CD1 4.41Å; A312-I325 HydrophobicContact CB-CG2 4.37Å
313	N	83.9	Confident	85.6	Confident	37 Å²	37	26.6 Å²	26.6	20%	0.198	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-65.8	-26.6	178.5	-72.3	-33	0	0	0	113.4	G156 T157 L309 A310 G311 S431	G156-N313 VanDerWaalsContact CA-O 3.23Å; G156-N313 WeakPolarHBondContact CA-O 3.43Å; T157-N313 WeakPolarHBondContact CB-OD1 3.27Å; T157-N313 WeakPolarHBondContact OG1-CA 3.45Å; T157-N313 PolarHBondContact OG1-N 3.49Å; T157-N313 VanDerWaalsContact OG1-N 3.08Å; T157-N313 PolarHBondContact OG1-OD1 3.01Å; L309-N313 PolarHBondContact O-N 3.03Å; L309-N313 PolarHBondContact O-ND2 3.4Å; A310-N313 WeakPolarHBondContact O-CB 3.45Å; A310-N313 PolarHBondContact O-N 3.19Å; G311-N313 VanDerWaalsContact C-N 3.33Å; N313-S431 PolarHBondContact ND2-OG 3.48Å
314	I	79	Confident	85.5	Confident	11 Å²	11	26.8 Å²	26.8	6%	0.056	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-105.6	29.7	177.8	64.2	153.3	0	0	0	112.5	F90 G95 A312 G316 D317 L318	F90-I314 HydrophobicContact CD2-CD1 4.48Å; G95-I314 WeakPolarHBondContact O-CD1 3.46Å; A312-I314 VanDerWaalsContact C-N 3.25Å; A312-I314 PolarHBondContact O-N 3.37Å; I314-G316 PolarHBondContact O-N 3.34Å; I314-D317 HydrophobicContact CB-CB 4.44Å; I314-D317 PolarHBondContact O-N 3.37Å; I314-L318 HydrophobicContact CD1-CD2 4.33Å
315	S	80.5	Confident	85.5	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.014	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-26.1	-177.4	59.1	0	0	0	0	114.6	G156 A312	G156-S315 VanDerWaalsContact CA-OG 3.31Å; G156-S315 WeakPolarHBondContact CA-OG 3.39Å; G156-S315 PolarHBondContact N-OG 3.14Å; A312-S315 WeakPolarHBondContact O-CB 3.34Å; A312-S315 PolarHBondContact O-N 2.89Å; A312-S315 PolarHBondContact O-OG 3.29Å
316	G	74.5	Confident	85.5	Confident	23 Å²	23	26.6 Å²	26.6	24%	0.237	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-20.1	175.6	0	0	0	0	0	115.2	I314	I314-G316 PolarHBondContact O-N 3.34Å
317	D	78.8	Confident	85.6	Confident	66 Å²	66	33.7 Å²	33.7	35%	0.353	18%	0.176	S	C	.	.	S	Bend	trans	-99.1	-0.6	-176.7	-56.7	-34.8	0	0	0	112.1	R89 F90 I314	R89-D317 CarbonylContact C-O 3.44Å; R89-D317 WeakPolarHBondContact CA-O 3.49Å; R89-D317 WeakPolarHBondContact CB-O 3.39Å; F90-D317 HydrophobicContact CD2-CB 4.07Å; F90-D317 HydrophobicContact CE2-CB 4.4Å; F90-D317 PolarHBondContact N-O 3.17Å; I314-D317 HydrophobicContact CB-CB 4.44Å; I314-D317 PolarHBondContact O-N 3.37Å
318	L	83.2	Confident	85.9	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-88.3	140.5	179.8	-64.7	176.4	0	0	0	111.4	R89 F90 V96 I314 N320 P321 A324 I325	R89-L318 WeakPolarHBondContact CD-O 3.24Å; F90-L318 HydrophobicContact CB-CD2 4.34Å; V96-L318 HydrophobicContact CG2-CD1 3.54Å; V96-L318 HydrophobicContact CG2-CD2 3.75Å; V96-L318 HydrophobicContact CG2-CG 4.32Å; I314-L318 HydrophobicContact CD1-CD2 4.33Å; L318-N320 PolarHBondContact O-N 3.46Å; L318-P321 HydrophobicContact CB-CB 4.36Å; L318-P321 HydrophobicContact CD1-CB 4.31Å; L318-A324 HydrophobicContact CD1-CB 4.2Å; L318-I325 HydrophobicContact CD1-CD1 4.34Å; L318-I325 HydrophobicContact CD1-CG1 3.82Å
319	K	80.9	Confident	86	Confident	146 Å²	146	33.6 Å²	33.6	64%	0.635	18%	0.175	S	C	*	.	S	Bend	trans	-59.6	-47.4	177.8	-172.6	177.4	-178.1	177.9	0	111.6	R89 F90	R89-K319 HydrophobicContact CB-CB 4.1Å; F90-K319 PolarHBondContact O-N 2.87Å
320	N	84.1	Confident	86.4	Confident	98 Å²	98	36 Å²	36	52%	0.524	19%	0.187	S	C	.	.			trans	-138.9	86.8	179.8	-75.3	-30.7	0	0	0	110	L318 T322 V323 A324	L318-N320 PolarHBondContact O-N 3.46Å; N320-T322 VanDerWaalsContact C-N 3.35Å; N320-T322 PolarHBondContact O-N 2.92Å; N320-V323 PolarHBondContact O-N 3.35Å; N320-A324 WeakPolarHBondContact O-CB 3.38Å; N320-A324 PolarHBondContact O-N 3.22Å
321	P	85.9	Confident	86.8	Confident	18 Å²	18	39.9 Å²	39.9	12%	0.117	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-36.9	-174.5	22.2	-33.8	0	0	0	113.8	V152 L318 V323 A324 I325	V152-P321 HydrophobicContact CB-CB 4.05Å; V152-P321 HydrophobicContact CB-CG 3.67Å; V152-P321 HydrophobicContact CG1-CB 3.87Å; V152-P321 HydrophobicContact CG1-CG 3.84Å; V152-P321 HydrophobicContact CG2-CB 4.46Å; V152-P321 HydrophobicContact CG2-CG 4.41Å; L318-P321 HydrophobicContact CB-CB 4.36Å; L318-P321 HydrophobicContact CD1-CB 4.31Å; P321-V323 VanDerWaalsContact C-N 3.26Å; P321-V323 PolarHBondContact O-N 3.45Å; P321-A324 PolarHBondContact O-N 3.16Å; P321-I325 HydrophobicContact CB-CD1 4.03Å; P321-I325 WeakPolarHBondContact O-CB 3.47Å; P321-I325 VanDerWaalsContact O-CG1 3.31Å; P321-I325 WeakPolarHBondContact O-CG1 3.12Å; P321-I325 PolarHBondContact O-N 3.45Å
322	T	86.5	Confident	87.4	Confident	51 Å²	51	39.9 Å²	39.9	31%	0.313	21%	0.205	S	C	.	.	H	α-helix	trans	-60.9	-31.4	-178.7	54	0	0	0	0	113.3	T148 V152 N320 P326	T148-T322 WeakPolarHBondContact CG2-O 3.4Å; V152-T322 HydrophobicContact CG2-CG2 4.2Å; N320-T322 VanDerWaalsContact C-N 3.35Å; N320-T322 PolarHBondContact O-N 2.92Å; T322-P326 VanDerWaalsContact O-CD 3.22Å; T322-P326 WeakPolarHBondContact O-CD 3.21Å; T322-P326 VanDerWaalsContact O-CG 3.32Å; T322-P326 WeakPolarHBondContact O-CG 3.21Å
323	V	88.3	Confident	87.8	Confident	71 Å²	71	40.4 Å²	40.4	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-98.7	-36.8	178.1	-179.5	0	0	0	0	111.5	N320 P321 R327	N320-V323 PolarHBondContact O-N 3.35Å; P321-V323 VanDerWaalsContact C-N 3.26Å; P321-V323 PolarHBondContact O-N 3.45Å; V323-R327 PolarHBondContact O-N 3.43Å
324	A	90.8	Very high	88.4	Confident	6 Å²	6	44.4 Å²	44.4	5%	0.05	22%	0.223	C	C	.	.	H	α-helix	trans	-69.4	-42.7	-175.6	0	0	0	0	0	112.9	W92 V96 L318 N320 P321 G328	W92-A324 HydrophobicContact CB-CB 3.56Å; V96-A324 HydrophobicContact CG2-CB 4.07Å; L318-A324 HydrophobicContact CD1-CB 4.2Å; N320-A324 WeakPolarHBondContact O-CB 3.38Å; N320-A324 PolarHBondContact O-N 3.22Å; P321-A324 PolarHBondContact O-N 3.16Å; A324-G328 PolarHBondContact O-N 2.9Å
325	I	92.3	Very high	89.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-51.4	-177.3	-64.5	167.7	0	0	0	110.9	V96 A147 L160 A312 L318 P321 T329	V96-I325 HydrophobicContact CG2-CG1 4.49Å; A147-I325 HydrophobicContact CB-CB 4.13Å; A147-I325 HydrophobicContact CB-CD1 4.04Å; A147-I325 HydrophobicContact CB-CG2 3.98Å; L160-I325 HydrophobicContact CD1-CD1 3.99Å; A312-I325 HydrophobicContact CB-CD1 4.41Å; A312-I325 HydrophobicContact CB-CG2 4.37Å; L318-I325 HydrophobicContact CD1-CD1 4.34Å; L318-I325 HydrophobicContact CD1-CG1 3.82Å; P321-I325 HydrophobicContact CB-CD1 4.03Å; P321-I325 WeakPolarHBondContact O-CB 3.47Å; P321-I325 VanDerWaalsContact O-CG1 3.31Å; P321-I325 WeakPolarHBondContact O-CG1 3.12Å; P321-I325 PolarHBondContact O-N 3.45Å; I325-T329 WeakPolarHBondContact O-CB 3.37Å; I325-T329 PolarHBondContact O-N 3.1Å; I325-T329 PolarHBondContact O-OG1 3.29Å
326	P	93.2	Very high	89.9	Confident	7 Å²	7	49.7 Å²	49.7	5%	0.045	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-47.4	179.6	-24.7	35.5	0	0	0	113.4	S144 T148 T322 L330 F518	S144-P326 WeakPolarHBondContact OG-CA 3.34Å; S144-P326 WeakPolarHBondContact OG-CB 3.46Å; T148-P326 HydrophobicContact CG2-CG 4.24Å; T322-P326 VanDerWaalsContact O-CD 3.22Å; T322-P326 WeakPolarHBondContact O-CD 3.21Å; T322-P326 VanDerWaalsContact O-CG 3.32Å; T322-P326 WeakPolarHBondContact O-CG 3.21Å; P326-L330 WeakPolarHBondContact O-CB 3.43Å; P326-L330 VanDerWaalsContact O-CG 3.32Å; P326-L330 WeakPolarHBondContact O-CG 3.49Å; P326-L330 PolarHBondContact O-N 3.33Å; P326-F518 HydrophobicContact CB-CD2 4.15Å; P326-F518 HydrophobicContact CB-CE2 3.76Å; P326-F518 HydrophobicContact CB-CZ 4.45Å; P326-F518 HydrophobicContact CG-CD2 4.42Å
327	R	93	Very high	90.9	Very high	154 Å²	154	49.4 Å²	49.4	58%	0.581	24%	0.236	S	C	*	.	H	α-helix	trans	-65.4	-48.2	-178.6	-72.4	-173.5	177.8	-175.1	0.4	111.9	W92 V323 M331	W92-R327 HydrophobicContact CE3-CB 4.25Å; V323-R327 PolarHBondContact O-N 3.43Å; R327-M331 VanDerWaalsContact O-CB 3.28Å; R327-M331 WeakPolarHBondContact O-CB 3.49Å; R327-M331 VanDerWaalsContact O-CG 3.24Å; R327-M331 WeakPolarHBondContact O-CG 3.23Å; R327-M331 PolarHBondContact O-N 3.05Å; R327-M331 VanDerWaalsContact O-N 3.12Å
328	G	94.1	Very high	91.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.3	-41.7	-177.1	0	0	0	0	0	112.8	A324 A332	A324-G328 PolarHBondContact O-N 2.9Å; G328-A332 WeakPolarHBondContact O-CB 3.4Å; G328-A332 PolarHBondContact O-N 2.84Å
329	T	94.8	Very high	92.2	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-68.8	-47.3	-178.2	-52.1	0	0	0	0	111.6	I308 I325 A332 I333	I308-T329 HydrophobicContact CB-CG2 3.98Å; I308-T329 WeakPolarHBondContact O-CG2 3.45Å; I325-T329 WeakPolarHBondContact O-CB 3.37Å; I325-T329 PolarHBondContact O-N 3.1Å; I325-T329 PolarHBondContact O-OG1 3.29Å; T329-A332 PolarHBondContact O-N 2.82Å; T329-I333 HydrophobicContact CG2-CD1 4.12Å; T329-I333 WeakPolarHBondContact O-CG1 3.44Å; T329-I333 PolarHBondContact O-N 3.4Å
330	L	94.6	Very high	92.9	Very high	50 Å²	50	44.9 Å²	44.9	26%	0.262	22%	0.215	S	C	.	.	H	α-helix	trans	-68.2	-39.1	-178.9	-65.7	173.2	0	0	0	112.1	L141 P326 I333 F334 F518	L141-L330 HydrophobicContact CD2-CD1 4Å; L141-L330 HydrophobicContact CD2-CD2 4.03Å; P326-L330 WeakPolarHBondContact O-CB 3.43Å; P326-L330 VanDerWaalsContact O-CG 3.32Å; P326-L330 WeakPolarHBondContact O-CG 3.49Å; P326-L330 PolarHBondContact O-N 3.33Å; L330-I333 PolarHBondContact O-N 3.42Å; L330-F334 PolarHBondContact O-N 3.49Å; L330-F518 HydrophobicContact CD1-CZ 3.85Å
331	M	95.1	Very high	93.4	Very high	93 Å²	93	42 Å²	42	46%	0.458	20%	0.2	S	C	.	.	H	α-helix	trans	-67.1	-36.4	174.7	-71.4	-63.9	166.6	0	0	112.3	M97 R327 F334 W335	M97-M331 HydrophobicContact CG-CB 4.49Å; M97-M331 HydrophobicContact SD-CB 3.98Å; R327-M331 VanDerWaalsContact O-CB 3.28Å; R327-M331 WeakPolarHBondContact O-CB 3.49Å; R327-M331 VanDerWaalsContact O-CG 3.24Å; R327-M331 WeakPolarHBondContact O-CG 3.23Å; R327-M331 PolarHBondContact O-N 3.05Å; R327-M331 VanDerWaalsContact O-N 3.12Å; M331-F334 PolarHBondContact O-N 3.09Å; M331-W335 VanDerWaalsContact O-CD1 3.28Å; M331-W335 PolarHBondContact O-N 3.45Å
332	A	95.4	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-45.5	174.2	0	0	0	0	0	111.8	M97 C100 M101 I104 G328 T329 F334 T336	M97-A332 HydrophobicContact CG-CB 4.3Å; C100-A332 HydrophobicContact CB-CB 3.53Å; M101-A332 HydrophobicContact CG-CB 3.69Å; I104-A332 HydrophobicContact CD1-CB 4.41Å; G328-A332 WeakPolarHBondContact O-CB 3.4Å; G328-A332 PolarHBondContact O-N 2.84Å; T329-A332 PolarHBondContact O-N 2.82Å; A332-F334 VanDerWaalsContact C-N 3.32Å; A332-F334 PolarHBondContact O-N 3.39Å; A332-T336 WeakPolarHBondContact O-CB 3.35Å; A332-T336 WeakPolarHBondContact O-CG2 3.22Å; A332-T336 PolarHBondContact O-N 2.85Å; A332-T336 PolarHBondContact O-OG1 3.42Å
333	I	95.6	Very high	94.2	Very high	11 Å²	11	42 Å²	42	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-43.5	176.3	-66	164.7	0	0	0	110.6	I308 T329 L330 T336 T337	I308-I333 HydrophobicContact CB-CD1 4.32Å; I308-I333 HydrophobicContact CG2-CD1 3.74Å; I308-I333 HydrophobicContact CG2-CG1 3.71Å; T329-I333 HydrophobicContact CG2-CD1 4.12Å; T329-I333 WeakPolarHBondContact O-CG1 3.44Å; T329-I333 PolarHBondContact O-N 3.4Å; L330-I333 PolarHBondContact O-N 3.42Å; I333-T336 WeakPolarHBondContact CA-OG1 3.45Å; I333-T336 PolarHBondContact O-OG1 2.81Å; I333-T337 VanDerWaalsContact O-CB 3.26Å; I333-T337 WeakPolarHBondContact O-CB 3.26Å; I333-T337 PolarHBondContact O-N 3.14Å; I333-T337 PolarHBondContact O-OG1 2.63Å
334	F	95.8	Very high	94.5	Very high	122 Å²	122	38.7 Å²	38.7	54%	0.535	18%	0.176	S	C	.	.	H	α-helix	trans	-60.6	-54.5	178.9	177.3	-97.5	0	0	0	112.3	L330 M331 A332 T336 T337 F338	L330-F334 PolarHBondContact O-N 3.49Å; M331-F334 PolarHBondContact O-N 3.09Å; A332-F334 VanDerWaalsContact C-N 3.32Å; A332-F334 PolarHBondContact O-N 3.39Å; F334-T336 PolarHBondContact O-N 3.06Å; F334-T337 PolarHBondContact O-N 2.96Å; F334-F338 WeakPolarHBondContact O-CB 3.45Å; F334-F338 PolarHBondContact O-N 2.98Å
335	W	95.2	Very high	94.7	Very high	120 Å²	120	39.4 Å²	39.4	46%	0.455	18%	0.182	S	C	.	.	H	α-helix	trans	-67.1	-35.1	-176.6	-78.2	117.4	0	0	0	113.4	M101 M331 F338 S339	M101-W335 HydrophobicContact CE-CB 4.11Å; M331-W335 VanDerWaalsContact O-CD1 3.28Å; M331-W335 PolarHBondContact O-N 3.45Å; W335-F338 AromaticContact CE3-CD1 3.96Å; W335-F338 HydrophobicContact CE3-CD1 3.96Å; W335-F338 AromaticContact CZ3-CD1 3.85Å; W335-F338 HydrophobicContact CZ3-CD1 3.85Å; W335-F338 HydrophobicContact CZ3-CE1 4.09Å; W335-S339 WeakPolarHBondContact O-CB 3.28Å; W335-S339 PolarHBondContact O-N 3.39Å
336	T	95	Very high	94.7	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-44.4	175.8	52.7	0	0	0	0	111.2	M101 I104 W105 A332 I333 F334 F338 S339 Y340	M101-T336 HydrophobicContact CB-CG2 4.31Å; M101-T336 HydrophobicContact CG-CG2 4.06Å; I104-T336 HydrophobicContact CB-CG2 3.89Å; I104-T336 HydrophobicContact CD1-CG2 4.11Å; I104-T336 HydrophobicContact CG2-CG2 3.6Å; W105-T336 HydrophobicContact CD2-CG2 4.41Å; W105-T336 HydrophobicContact CG-CG2 4.49Å; W105-T336 HydrophobicContact CZ2-CG2 4.37Å; A332-T336 WeakPolarHBondContact O-CB 3.35Å; A332-T336 WeakPolarHBondContact O-CG2 3.22Å; A332-T336 PolarHBondContact O-N 2.85Å; A332-T336 PolarHBondContact O-OG1 3.42Å; I333-T336 WeakPolarHBondContact CA-OG1 3.45Å; I333-T336 PolarHBondContact O-OG1 2.81Å; F334-T336 PolarHBondContact O-N 3.06Å; T336-F338 VanDerWaalsContact C-N 3.32Å; T336-F338 PolarHBondContact O-N 3.22Å; T336-S339 WeakPolarHBondContact CA-OG 3.42Å; T336-S339 PolarHBondContact O-N 3.32Å; T336-S339 VanDerWaalsContact O-N 3.14Å; T336-S339 PolarHBondContact O-OG 2.98Å; T336-Y340 WeakPolarHBondContact O-CD2 3.21Å; T336-Y340 PolarHBondContact O-N 3.46Å
337	T	95.8	Very high	94.7	Very high	17 Å²	17	40 Å²	40	10%	0.104	19%	0.185	C	C	.	.	H	α-helix	trans	-57.8	-45.9	173.6	-55.8	0	0	0	0	111.2	I129 S133 I333 F334 S339 Y340 L341	I129-T337 HydrophobicContact CG2-CG2 3.93Å; S133-T337 WeakPolarHBondContact CB-OG1 3.48Å; S133-T337 WeakPolarHBondContact OG-CG2 3.3Å; S133-T337 PolarHBondContact OG-OG1 3.4Å; I333-T337 VanDerWaalsContact O-CB 3.26Å; I333-T337 WeakPolarHBondContact O-CB 3.26Å; I333-T337 PolarHBondContact O-N 3.14Å; I333-T337 PolarHBondContact O-OG1 2.63Å; F334-T337 PolarHBondContact O-N 2.96Å; T337-S339 VanDerWaalsContact C-N 3.33Å; T337-S339 PolarHBondContact O-N 3.18Å; T337-Y340 PolarHBondContact O-N 3.27Å; T337-L341 HydrophobicContact CG2-CD1 4.29Å; T337-L341 WeakPolarHBondContact O-CG 3.39Å; T337-L341 PolarHBondContact O-N 2.96Å
338	F	95.6	Very high	94.7	Very high	97 Å²	97	32.6 Å²	32.6	43%	0.425	16%	0.158	S	C	.	.	H	α-helix	trans	-58.9	-43.9	176.2	-174.9	-110.5	0	0	0	111.9	F334 W335 T336 Y340 L341 I342	F334-F338 WeakPolarHBondContact O-CB 3.45Å; F334-F338 PolarHBondContact O-N 2.98Å; W335-F338 AromaticContact CE3-CD1 3.96Å; W335-F338 HydrophobicContact CE3-CD1 3.96Å; W335-F338 AromaticContact CZ3-CD1 3.85Å; W335-F338 HydrophobicContact CZ3-CD1 3.85Å; W335-F338 HydrophobicContact CZ3-CE1 4.09Å; T336-F338 VanDerWaalsContact C-N 3.32Å; T336-F338 PolarHBondContact O-N 3.22Å; F338-Y340 PolarHBondContact O-N 3.41Å; F338-L341 PolarHBondContact O-N 2.89Å; F338-I342 HydrophobicContact CD1-CD1 3.72Å; F338-I342 HydrophobicContact CD2-CD1 4.4Å; F338-I342 HydrophobicContact CE1-CD1 3.24Å; F338-I342 HydrophobicContact CE1-CG1 4.43Å; F338-I342 HydrophobicContact CE2-CD1 3.98Å; F338-I342 HydrophobicContact CE2-CG1 4.5Å; F338-I342 HydrophobicContact CG-CD1 4.29Å; F338-I342 HydrophobicContact CZ-CD1 3.4Å; F338-I342 HydrophobicContact CZ-CG1 4.35Å; F338-I342 WeakPolarHBondContact O-CG1 3.4Å; F338-I342 PolarHBondContact O-N 2.85Å; F338-I342 VanDerWaalsContact O-N 3.09Å
339	S	94.3	Very high	94.6	Very high	16 Å²	16	33.1 Å²	33.1	11%	0.112	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-40.7	176.2	71.3	0	0	0	0	112.9	W105 W335 T336 T337 I342 I343	W105-S339 PolarHBondContact NE1-OG 3.01Å; W335-S339 WeakPolarHBondContact O-CB 3.28Å; W335-S339 PolarHBondContact O-N 3.39Å; T336-S339 WeakPolarHBondContact CA-OG 3.42Å; T336-S339 PolarHBondContact O-N 3.32Å; T336-S339 VanDerWaalsContact O-N 3.14Å; T336-S339 PolarHBondContact O-OG 2.98Å; T337-S339 VanDerWaalsContact C-N 3.33Å; T337-S339 PolarHBondContact O-N 3.18Å; S339-I342 PolarHBondContact O-N 3.16Å; S339-I343 WeakPolarHBondContact O-CB 3.22Å; S339-I343 VanDerWaalsContact O-CG1 3.28Å; S339-I343 WeakPolarHBondContact O-CG1 3.28Å; S339-I343 PolarHBondContact O-N 3.46Å
340	Y	95.5	Very high	94.5	Very high	5 Å²	5	33 Å²	33	2%	0.02	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-42.6	177.8	-67.1	-48.8	0	0	0	112.7	I104 L109 L113 F301 S304 T336 T337 F338 S344	I104-Y340 HydrophobicContact CG2-CE2 4.01Å; I104-Y340 PolarHBondContact O-OH 3.48Å; L109-Y340 HydrophobicContact CB-CE1 3.89Å; L109-Y340 HydrophobicContact CD1-CD1 3.38Å; L109-Y340 HydrophobicContact CD1-CE1 3.31Å; L109-Y340 HydrophobicContact CD2-CE1 4.44Å; L109-Y340 HydrophobicContact CG-CE1 4.04Å; L113-Y340 HydrophobicContact CD2-CD1 4Å; F301-Y340 HydrophobicContact CE2-CG 4.49Å; F301-Y340 HydrophobicContact CZ-CD2 4.13Å; F301-Y340 HydrophobicContact CZ-CE2 4.49Å; F301-Y340 HydrophobicContact CZ-CG 4.26Å; S304-Y340 PolarHBondContact O-OH 3.34Å; S304-Y340 VanDerWaalsContact O-OH 3.04Å; T336-Y340 WeakPolarHBondContact O-CD2 3.21Å; T336-Y340 PolarHBondContact O-N 3.46Å; T337-Y340 PolarHBondContact O-N 3.27Å; F338-Y340 PolarHBondContact O-N 3.41Å; Y340-S344 WeakPolarHBondContact O-CB 3.3Å; Y340-S344 PolarHBondContact O-N 2.91Å
341	L	95.6	Very high	94.4	Very high	38 Å²	38	30.6 Å²	30.6	20%	0.199	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-44.1	178.4	-67.9	174.3	0	0	0	111.6	W126 I129 L130 T337 F338 A345	W126-L341 HydrophobicContact CB-CD2 3.97Å; W126-L341 VanDerWaalsContact CD1-CD2 3.49Å; W126-L341 HydrophobicContact CD2-CD2 4.17Å; W126-L341 HydrophobicContact CG-CD2 3.62Å; W126-L341 PolarHBondContact NE1-O 3.37Å; I129-L341 HydrophobicContact CB-CD2 4.13Å; I129-L341 HydrophobicContact CD1-CD2 4.07Å; I129-L341 HydrophobicContact CG2-CD2 3.9Å; I129-L341 HydrophobicContact CG2-CG 4.13Å; L130-L341 HydrophobicContact CD2-CD1 4.36Å; T337-L341 HydrophobicContact CG2-CD1 4.29Å; T337-L341 WeakPolarHBondContact O-CG 3.39Å; T337-L341 PolarHBondContact O-N 2.96Å; F338-L341 PolarHBondContact O-N 2.89Å; L341-A345 WeakPolarHBondContact O-CB 3.31Å; L341-A345 PolarHBondContact O-N 3.47Å; L341-A345 VanDerWaalsContact O-N 3.11Å
342	I	94.6	Very high	94.3	Very high	61 Å²	61	26.9 Å²	26.9	31%	0.313	13%	0.131	S	C	.	.	H	α-helix	trans	-62.1	-54.1	177.2	-71.8	176.1	0	0	0	110.3	F338 S339 S344 A345 T346	F338-I342 HydrophobicContact CD1-CD1 3.72Å; F338-I342 HydrophobicContact CD2-CD1 4.4Å; F338-I342 HydrophobicContact CE1-CD1 3.24Å; F338-I342 HydrophobicContact CE1-CG1 4.43Å; F338-I342 HydrophobicContact CE2-CD1 3.98Å; F338-I342 HydrophobicContact CE2-CG1 4.5Å; F338-I342 HydrophobicContact CG-CD1 4.29Å; F338-I342 HydrophobicContact CZ-CD1 3.4Å; F338-I342 HydrophobicContact CZ-CG1 4.35Å; F338-I342 WeakPolarHBondContact O-CG1 3.4Å; F338-I342 PolarHBondContact O-N 2.85Å; F338-I342 VanDerWaalsContact O-N 3.09Å; S339-I342 PolarHBondContact O-N 3.16Å; I342-S344 VanDerWaalsContact C-N 3.29Å; I342-S344 PolarHBondContact O-N 3.01Å; I342-A345 PolarHBondContact O-N 2.92Å; I342-T346 HydrophobicContact CG2-CG2 4.02Å; I342-T346 WeakPolarHBondContact O-CG2 3.31Å; I342-T346 PolarHBondContact O-N 3.32Å; I342-T346 PolarHBondContact O-OG1 2.85Å; I342-T346 VanDerWaalsContact O-OG1 3.04Å
343	I	93.8	Very high	94	Very high	9 Å²	9	28.7 Å²	28.7	5%	0.046	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-39.6	-174.6	-67.5	166.8	0	0	0	111.1	L109 L113 F251 Y254 S339 A345 T346 V347 L403	L109-I343 HydrophobicContact CD1-CD1 3.71Å; L113-I343 HydrophobicContact CD2-CB 4Å; L113-I343 HydrophobicContact CD2-CG2 3.79Å; F251-I343 HydrophobicContact CD1-CD1 4.46Å; F251-I343 HydrophobicContact CE1-CD1 4.26Å; Y254-I343 HydrophobicContact CD1-CG1 4.38Å; Y254-I343 HydrophobicContact CE1-CB 4.44Å; Y254-I343 HydrophobicContact CE1-CG1 3.95Å; Y254-I343 HydrophobicContact CE1-CG2 4.26Å; S339-I343 WeakPolarHBondContact O-CB 3.22Å; S339-I343 VanDerWaalsContact O-CG1 3.28Å; S339-I343 WeakPolarHBondContact O-CG1 3.28Å; S339-I343 PolarHBondContact O-N 3.46Å; I343-A345 VanDerWaalsContact C-N 3.33Å; I343-A345 PolarHBondContact O-N 2.98Å; I343-T346 WeakPolarHBondContact CA-OG1 3.29Å; I343-T346 PolarHBondContact O-OG1 3.34Å; I343-V347 WeakPolarHBondContact O-CB 3.46Å; I343-V347 VanDerWaalsContact O-CG1 3.28Å; I343-V347 WeakPolarHBondContact O-CG1 3.5Å; I343-V347 PolarHBondContact O-N 3.37Å; I343-L403 HydrophobicContact CG2-CD1 4.36Å; I343-L403 HydrophobicContact CG2-CD2 4.23Å
344	S	94.4	Very high	93.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.9	-39.2	174.1	-178.9	0	0	0	0	112.3	T117 T125 Y340 I342 G348	T117-S344 WeakPolarHBondContact CG2-O 3.12Å; T117-S344 WeakPolarHBondContact CG2-OG 3.45Å; T117-S344 PolarHBondContact OG1-OG 3.23Å; T125-S344 WeakPolarHBondContact CG2-OG 3.41Å; Y340-S344 WeakPolarHBondContact O-CB 3.3Å; Y340-S344 PolarHBondContact O-N 2.91Å; I342-S344 VanDerWaalsContact C-N 3.29Å; I342-S344 PolarHBondContact O-N 3.01Å; S344-G348 PolarHBondContact O-N 3.04Å
345	A	94.1	Very high	93.5	Very high	21 Å²	21	23.4 Å²	23.4	17%	0.174	12%	0.115	C	C	.	.	H	α-helix	trans	-74.5	-41.2	-179.7	0	0	0	0	0	112.2	W126 L341 I342 I343 S349	W126-A345 HydrophobicContact CZ2-CB 3.87Å; L341-A345 WeakPolarHBondContact O-CB 3.31Å; L341-A345 PolarHBondContact O-N 3.47Å; L341-A345 VanDerWaalsContact O-N 3.11Å; I342-A345 PolarHBondContact O-N 2.92Å; I343-A345 VanDerWaalsContact C-N 3.33Å; I343-A345 PolarHBondContact O-N 2.98Å; A345-S349 WeakPolarHBondContact O-CB 3.45Å; A345-S349 PolarHBondContact O-N 3.19Å; A345-S349 VanDerWaalsContact O-N 3.1Å; A345-S349 PolarHBondContact O-OG 2.96Å
346	T	93.9	Very high	93.2	Very high	19 Å²	19	18.7 Å²	18.7	12%	0.117	10%	0.1	C	C	.	.	H	α-helix	trans	-70.8	-42.9	-178.8	53.3	0	0	0	0	111.3	Y254 Y274 I342 I343 S349 C350	Y254-T346 WeakPolarHBondContact CE1-OG1 3.13Å; Y254-T346 PolarHBondContact OH-OG1 3.19Å; Y274-T346 HydrophobicContact CE1-CG2 4.23Å; Y274-T346 VanDerWaalsContact OH-CG2 3.27Å; Y274-T346 WeakPolarHBondContact OH-CG2 3.42Å; I342-T346 HydrophobicContact CG2-CG2 4.02Å; I342-T346 WeakPolarHBondContact O-CG2 3.31Å; I342-T346 PolarHBondContact O-N 3.32Å; I342-T346 PolarHBondContact O-OG1 2.85Å; I342-T346 VanDerWaalsContact O-OG1 3.04Å; I343-T346 WeakPolarHBondContact CA-OG1 3.29Å; I343-T346 PolarHBondContact O-OG1 3.34Å; T346-S349 WeakPolarHBondContact CA-OG 3.44Å; T346-S349 PolarHBondContact O-N 3.24Å; T346-S349 PolarHBondContact O-OG 2.87Å; T346-C350 WeakPolarHBondContact O-CB 3.4Å; T346-C350 PolarHBondContact O-N 2.64Å; T346-C350 PolarHBondContact O-SG 2.86Å
347	V	92.9	Very high	92.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.6	-42.5	177.1	79	0	0	0	0	111.7	P114 T117 Y254 I343 S349 C350 V351 I396	P114-V347 HydrophobicContact CB-CG1 4.39Å; P114-V347 HydrophobicContact CB-CG2 4.21Å; P114-V347 HydrophobicContact CG-CG2 4.49Å; T117-V347 HydrophobicContact CG2-CG1 4.33Å; Y254-V347 PolarHBondContact OH-N 2.95Å; I343-V347 WeakPolarHBondContact O-CB 3.46Å; I343-V347 VanDerWaalsContact O-CG1 3.28Å; I343-V347 WeakPolarHBondContact O-CG1 3.5Å; I343-V347 PolarHBondContact O-N 3.37Å; V347-S349 VanDerWaalsContact C-N 3.28Å; V347-S349 PolarHBondContact O-N 2.99Å; V347-C350 PolarHBondContact O-N 3.24Å; V347-V351 HydrophobicContact CG2-CG2 4.41Å; V347-V351 PolarHBondContact O-N 3.48Å; V347-I396 HydrophobicContact CG2-CG2 4.32Å
348	G	92.3	Very high	92.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-70.2	-20.3	-179.5	0	0	0	0	0	114	N282 S344	N282-G348 WeakPolarHBondContact CB-O 3.33Å; N282-G348 PolarHBondContact ND2-O 3.44Å; S344-G348 PolarHBondContact O-N 3.04Å
349	S	93.1	Very high	91.8	Very high	11 Å²	11	20.4 Å²	20.4	8%	0.077	12%	0.121	C	C	.	.	H	α-helix	trans	-89.2	-15.5	174.7	48.6	0	0	0	0	114.1	Y274 K275 A345 T346 V347	Y274-S349 VanDerWaalsContact CD1-OG 3.32Å; Y274-S349 WeakPolarHBondContact CD1-OG 3.48Å; Y274-S349 WeakPolarHBondContact CE1-OG 3.13Å; K275-S349 PolarHBondContact N-O 3.28Å; A345-S349 WeakPolarHBondContact O-CB 3.45Å; A345-S349 PolarHBondContact O-N 3.19Å; A345-S349 VanDerWaalsContact O-N 3.1Å; A345-S349 PolarHBondContact O-OG 2.96Å; T346-S349 WeakPolarHBondContact CA-OG 3.44Å; T346-S349 PolarHBondContact O-N 3.24Å; T346-S349 PolarHBondContact O-OG 2.87Å; V347-S349 VanDerWaalsContact C-N 3.28Å; V347-S349 PolarHBondContact O-N 2.99Å
350	C	91.8	Very high	91.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-108.7	-22.2	-171.6	-64.9	0	0	0	0	114.9	F271 F272 S273 Y274 T346 V347	F271-C350 HydrophobicContact CD2-CB 3.91Å; F271-C350 HydrophobicContact CE2-CB 3.75Å; F272-C350 PolarHBondContact N-O 3.07Å; S273-C350 WeakPolarHBondContact O-CA 3.49Å; Y274-C350 WeakPolarHBondContact CD1-SG 3.21Å; Y274-C350 WeakPolarHBondContact CE1-SG 3.37Å; T346-C350 WeakPolarHBondContact O-CB 3.4Å; T346-C350 PolarHBondContact O-N 2.64Å; T346-C350 PolarHBondContact O-SG 2.86Å; V347-C350 PolarHBondContact O-N 3.24Å
351	V	92.8	Very high	90.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-130.2	135.5	-169	-168.6	0	0	0	0	110.9	G270 F271 N282 V347 I396 M405 V406	G270-V351 VanDerWaalsContact O-CA 3.29Å; G270-V351 WeakPolarHBondContact O-CA 3.31Å; G270-V351 WeakPolarHBondContact O-CG1 3.47Å; F271-V351 HydrophobicContact CB-CG2 4.4Å; F271-V351 HydrophobicContact CD2-CG2 4.02Å; N282-V351 PolarHBondContact ND2-O 2.79Å; V347-V351 HydrophobicContact CG2-CG2 4.41Å; V347-V351 PolarHBondContact O-N 3.48Å; V351-I396 HydrophobicContact CB-CG2 3.36Å; V351-I396 HydrophobicContact CG1-CG2 3.32Å; V351-I396 HydrophobicContact CG2-CG2 4.27Å; V351-M405 HydrophobicContact CG1-CE 3.94Å; V351-V406 HydrophobicContact CG2-CG2 3.46Å; V351-V406 VanDerWaalsContact CG2-CG2 3.46Å
352	V	92.5	Very high	89.9	Confident	15 Å²	15	30.3 Å²	30.3	9%	0.091	18%	0.176	C	C	.	.			trans	-77.2	158.3	175.5	-63.7	0	0	0	0	112	G270 F272 I278 D354 G395 I396	G270-V352 PolarHBondContact O-N 3.42Å; F272-V352 HydrophobicContact CD2-CG1 4Å; F272-V352 HydrophobicContact CD2-CG2 4.49Å; F272-V352 HydrophobicContact CE2-CG1 4.09Å; F272-V352 HydrophobicContact CE2-CG2 4.05Å; I278-V352 HydrophobicContact CD1-CG1 4.03Å; I278-V352 HydrophobicContact CG1-CG1 4.23Å; V352-D354 WeakPolarHBondContact CG2-O 3.44Å; V352-D354 PolarHBondContact O-N 3.34Å; V352-G395 WeakPolarHBondContact O-CA 3.36Å; V352-I396 PolarHBondContact O-N 2.97Å; V352-I396 VanDerWaalsContact O-N 3.08Å
353	R	90.4	Very high	89.1	Confident	38 Å²	38	29.4 Å²	29.4	14%	0.143	17%	0.172	C	C	.	.	S	Bend	trans	-61.4	-42.9	-178.4	-73.5	-170.7	167.8	114.8	5.5	113.7	A118 A281 N282 V284 G395 I396 S397	A118-R353 PolarHBondContact O-NE 3.01Å; A118-R353 PolarHBondContact O-NH2 3.35Å; A281-R353 PolarHBondContact O-NH1 3.49Å; N282-R353 WeakPolarHBondContact OD1-CG 3.34Å; V284-R353 PolarHBondContact O-NH2 3.26Å; R353-G395 CarbonylContact O-C 3.56Å; R353-G395 WeakPolarHBondContact O-CA 3.45Å; R353-I396 HydrophobicContact CG-CD1 4.44Å; R353-I396 HydrophobicContact CG-CG1 4.31Å; R353-I396 PolarHBondContact O-N 3.03Å; R353-S397 WeakPolarHBondContact O-CB 3.44Å; R353-S397 PolarHBondContact O-N 3.49Å
354	D	90.6	Very high	87.8	Confident	21 Å²	21	31.9 Å²	31.9	11%	0.112	19%	0.19	C	C	.	.			trans	-130.4	134.4	-172.1	-64.5	-61.6	0	0	0	110.2	R288 V352 I387 C392 N398	R288-D354 IonicContact CZ-OD1 3.86Å; R288-D354 IonicContact CZ-OD2 3.23Å; R288-D354 VanDerWaalsContact CZ-OD2 3.31Å; R288-D354 VanDerWaalsContact NH1-CG 3.29Å; R288-D354 IonicContact NH1-OD1 2.78Å; R288-D354 PolarHBondContact NH1-OD1 3.33Å; R288-D354 IonicContact NH1-OD2 2.99Å; R288-D354 PolarHBondContact NH1-OD2 2.94Å; R288-D354 IonicContact NH2-OD1 2.84Å; R288-D354 IonicContact NH2-OD2 3.65Å; R288-D354 PolarHBondContact NH2-OD2 3.04Å; V352-D354 WeakPolarHBondContact CG2-O 3.44Å; V352-D354 PolarHBondContact O-N 3.34Å; D354-I387 HydrophobicContact CB-CD1 4.48Å; D354-I387 HydrophobicContact CB-CG1 3.86Å; D354-C392 HydrophobicContact CB-CB 4.31Å; D354-N398 PolarHBondContact OD1-ND2 2.97Å
355	A	90.2	Very high	86.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-150.1	148.4	174.6	0	0	0	0	0	110.8	K269 F383 Y394	K269-A355 VanDerWaalsContact C-CB 3.47Å; K269-A355 WeakPolarHBondContact O-CB 3.38Å; A355-F383 HydrophobicContact CB-CD2 4.33Å; A355-F383 HydrophobicContact CB-CE2 3.98Å; A355-F383 HydrophobicContact CB-CZ 4.12Å; A355-Y394 PolarHBondContact N-O 3.36Å; A355-Y394 CarbonylContact O-C 3.57Å; A355-Y394 WeakPolarHBondContact O-CA 3.36Å; A355-Y394 PolarHBondContact O-N 3.31Å; A355-Y394 VanDerWaalsContact O-O 3.11Å
356	S	87.5	Confident	84.5	Confident	21 Å²	21	42.8 Å²	42.8	15%	0.147	26%	0.261	C	S	.	.			trans	-85.2	-29.6	-177.9	67.9	0	0	0	0	113.7	S358 D361 F383 T393	S356-S358 PolarHBondContact O-N 2.93Å; S356-S358 PolarHBondContact OG-N 3.37Å; S356-D361 WeakPolarHBondContact CB-OD2 3.49Å; S356-D361 PolarHBondContact OG-OD2 3.06Å; S356-F383 WeakPolarHBondContact OG-CD1 3.39Å; S356-F383 WeakPolarHBondContact OG-CE1 3.44Å; S356-T393 PolarHBondContact O-OG1 2.9Å
357	G	86.4	Confident	82.9	Confident	23 Å²	23	44.6 Å²	44.6	24%	0.237	27%	0.272	C	S	.	.			trans	76.2	1.7	-171.2	0	0	0	0	0	115	A268	A268-G357 WeakPolarHBondContact O-CA 3.34Å; A268-G357 PolarHBondContact O-N 3.36Å
358	S	86.2	Confident	81.5	Confident	38 Å²	38	49 Å²	49	27%	0.266	30%	0.301	S	S	.	.			trans	-85.6	130.6	178.8	165.5	0	0	0	0	110.7	S356 N360 D361 W381	S356-S358 PolarHBondContact O-N 2.93Å; S356-S358 PolarHBondContact OG-N 3.37Å; S358-N360 PolarHBondContact O-N 3Å; S358-N360 WeakPolarHBondContact OG-CB 3.46Å; S358-N360 PolarHBondContact OG-N 3.31Å; S358-D361 VanDerWaalsContact CB-OD1 3.27Å; S358-D361 WeakPolarHBondContact CB-OD1 3.45Å; S358-D361 PolarHBondContact OG-OD1 3.47Å; S358-W381 WeakPolarHBondContact O-CZ3 3.38Å
359	L	85.3	Confident	79.9	Confident	92 Å²	92	55.5 Å²	55.5	48%	0.482	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-72.8	-15.4	173.8	-67.9	174	0	0	0	112.7	V264 A268 D361 W381	V264-L359 HydrophobicContact CG1-CD2 4.09Å; A268-L359 HydrophobicContact CB-CD2 4.06Å; L359-D361 PolarHBondContact O-N 3.26Å; L359-W381 HydrophobicContact CD2-CH2 4.24Å
360	N	82.2	Confident	78.4	Confident	146 Å²	146	63 Å²	63	78%	0.781	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-76.4	-10.4	-179.2	-61.8	-21	0	0	0	112.5	S358 T362	S358-N360 PolarHBondContact O-N 3Å; S358-N360 WeakPolarHBondContact OG-CB 3.46Å; S358-N360 PolarHBondContact OG-N 3.31Å; N360-T362 PolarHBondContact O-N 3.42Å
361	D	81.4	Confident	77.3	Confident	42 Å²	42	65.8 Å²	65.8	23%	0.225	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-88.3	23.1	-173.3	-60.7	15.8	0	0	0	111.8	S356 S358 L359 W381 D382 F383	S356-D361 WeakPolarHBondContact CB-OD2 3.49Å; S356-D361 PolarHBondContact OG-OD2 3.06Å; S358-D361 VanDerWaalsContact CB-OD1 3.27Å; S358-D361 WeakPolarHBondContact CB-OD1 3.45Å; S358-D361 PolarHBondContact OG-OD1 3.47Å; L359-D361 PolarHBondContact O-N 3.26Å; D361-W381 HydrophobicContact CB-CE3 4.42Å; D361-W381 WeakPolarHBondContact O-CA 3.49Å; D361-D382 WeakPolarHBondContact CB-O 3.41Å; D361-D382 PolarHBondContact O-N 3.18Å; D361-F383 HydrophobicContact CB-CD1 4.41Å; D361-F383 HydrophobicContact CB-CE1 4.35Å
362	T	81.6	Confident	76.4	Confident	80 Å²	80	66.6 Å²	66.6	49%	0.491	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-82.8	126.5	179.3	47.6	0	0	0	0	110.5	N360 W381	N360-T362 PolarHBondContact O-N 3.42Å; T362-W381 HydrophobicContact CG2-CD2 4.34Å; T362-W381 HydrophobicContact CG2-CE3 4Å; T362-W381 HydrophobicContact CG2-CH2 3.55Å; T362-W381 HydrophobicContact CG2-CZ2 3.92Å; T362-W381 HydrophobicContact CG2-CZ3 3.59Å
363	L	77.3	Confident	75.8	Confident	42 Å²	42	69.4 Å²	69.4	22%	0.22	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-77.8	128.3	179.1	-76.6	164.3	0	0	0	110.6	T367 G380 D382	L363-T367 HydrophobicContact CD2-CG2 3.95Å; L363-G380 PolarHBondContact N-O 3.12Å; L363-D382 HydrophobicContact CD1-CB 4.13Å; L363-D382 HydrophobicContact CD2-CB 3.86Å; L363-D382 HydrophobicContact CG-CB 3.84Å
364	S	66.7	Low	75.1	Confident	61 Å²	61	69.8 Å²	69.8	43%	0.427	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-72	143.7	165.8	71.9	0	0	0	0	110.1	S366 T367	S364-S366 PolarHBondContact O-N 3Å; S364-S366 PolarHBondContact OG-OG 3.07Å; S364-T367 PolarHBondContact O-N 3.19Å; S364-T367 VanDerWaalsContact O-N 3.1Å; S364-T367 PolarHBondContact O-OG1 2.84Å; S364-T367 PolarHBondContact OG-OG1 2.98Å; S364-T367 VanDerWaalsContact OG-OG1 3.11Å
365	P	61.6	Low	74.7	Confident	145 Å²	145	71.1 Å²	71.1	94%	0.942	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-6.3	-177.2	21.7	-31.2	0	0	0	114.8
366	S	57.2	Low	74.3	Confident	104 Å²	104	71.3 Å²	71.3	73%	0.727	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	0.8	176.2	45.8	0	0	0	0	114.9	S364	S364-S366 PolarHBondContact O-N 3Å; S364-S366 PolarHBondContact OG-OG 3.07Å
367	T	61.7	Low	74	Confident	57 Å²	57	71.1 Å²	71.1	35%	0.35	44%	0.44	S	S	.	.	S	Bend	trans	-86.7	127.6	-175.7	-33.6	0	0	0	0	110.4	L363 S364	L363-T367 HydrophobicContact CD2-CG2 3.95Å; S364-T367 PolarHBondContact O-N 3.19Å; S364-T367 VanDerWaalsContact O-N 3.1Å; S364-T367 PolarHBondContact O-OG1 2.84Å; S364-T367 PolarHBondContact OG-OG1 2.98Å; S364-T367 VanDerWaalsContact OG-OG1 3.11Å
368	P	62.8	Low	73.9	Confident	92 Å²	92	75.3 Å²	75.3	60%	0.597	45%	0.454	S	S	*	.			trans	-65	135.9	179.3	22.5	-29.7	0	0	0	111.8	D370 A371	P368-D370 PolarHBondContact O-N 3.44Å; P368-D370 VanDerWaalsContact O-N 3.1Å; P368-A371 WeakPolarHBondContact O-CB 3.29Å; P368-A371 PolarHBondContact O-N 3.06Å
369	M	59.4	Low	73.7	Confident	137 Å²	137	76 Å²	76	68%	0.675	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-59.5	-20.9	-177.5	-87.5	173.6	98	0	0	114.4	A371 Q378	M369-A371 PolarHBondContact O-N 3.43Å; M369-Q378 HydrophobicContact CE-CG 4.08Å
370	D	61.7	Low	73.6	Confident	170 Å²	170	72.9 Å²	72.9	91%	0.909	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-74.5	-9.2	177.1	-69	-24.1	0	0	0	113.6	P368	P368-D370 PolarHBondContact O-N 3.44Å; P368-D370 VanDerWaalsContact O-N 3.1Å
371	A	67.3	Low	73.8	Confident	57 Å²	57	66.2 Å²	66.2	47%	0.471	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-85.2	-13.6	-177	0	0	0	0	0	114.2	P368 M369	P368-A371 WeakPolarHBondContact O-CB 3.29Å; P368-A371 PolarHBondContact O-N 3.06Å; M369-A371 PolarHBondContact O-N 3.43Å
372	C	75.4	Confident	74.1	Confident	18 Å²	18	66.6 Å²	66.6	12%	0.122	41%	0.407	C	S	.	.	S	Bend	trans	-129.1	146.4	-173.6	74	0	0	0	0	112.9	C377 D382 T384	C372-C377 HydrophobicContact CB-CB 4.34Å; C372-C377 WeakPolarHBondContact CB-SG 3.45Å; C372-C377 PolarHBondContact O-SG 3.34Å; C372-C377 VanDerWaalsContact O-SG 3.41Å; C372-C377 WeakPolarHBondContact SG-CB 3.26Å; C372-C377 CovalentContact SG-SG 2.01Å; C372-C377 PolarHBondContact SG-SG 3.26Å; C372-D382 HydrophobicContact CB-CB 4.3Å; C372-D382 WeakPolarHBondContact CB-OD1 2.99Å; C372-T384 VanDerWaalsContact CA-OG1 3.32Å; C372-T384 WeakPolarHBondContact CA-OG1 3.34Å
373	V	78.1	Confident	74.4	Confident	73 Å²	73	62.9 Å²	62.9	44%	0.442	38%	0.384	S	S	.	.			trans	-108	124.3	-172.1	178.8	0	0	0	0	110.2	T384	V373-T384 HydrophobicContact CB-CG2 4.01Å; V373-T384 HydrophobicContact CG2-CG2 3.69Å; V373-T384 PolarHBondContact N-OG1 2.92Å
374	G	77.2	Confident	74.7	Confident	46 Å²	46	61.8 Å²	61.8	47%	0.474	38%	0.379	S	S	.	.	S	Bend	trans	107.9	171.4	172.5	0	0	0	0	0	114.3	S376 C377	G374-S376 VanDerWaalsContact C-N 3.26Å; G374-S376 PolarHBondContact O-N 2.93Å; G374-C377 WeakPolarHBondContact O-CB 3.16Å; G374-C377 PolarHBondContact O-N 2.94Å; G374-C377 PolarHBondContact O-SG 2.72Å; G374-C377 VanDerWaalsContact O-SG 3.39Å
375	L	81.8	Confident	75.6	Confident	49 Å²	49	66.2 Å²	66.2	26%	0.257	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-69.8	-20.2	-176.5	-92.4	135.3	0	0	0	114.2	D277 A281 C377 Q378 Y379	D277-L375 HydrophobicContact CB-CD2 3.35Å; A281-L375 HydrophobicContact CB-CD1 3.33Å; L375-C377 PolarHBondContact O-N 2.98Å; L375-Q378 PolarHBondContact O-N 2.88Å; L375-Y379 WeakPolarHBondContact O-CD2 3.46Å
376	S	81.9	Confident	76.7	Confident	5 Å²	5	60 Å²	60	4%	0.035	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-61	-27.6	177	55.3	0	0	0	0	112.7	G374 Q378 Y379 G380 W381 F383	G374-S376 VanDerWaalsContact C-N 3.26Å; G374-S376 PolarHBondContact O-N 2.93Å; S376-Q378 VanDerWaalsContact C-N 3.31Å; S376-Q378 PolarHBondContact O-N 3.03Å; S376-Y379 CarbonylContact O-C 3.45Å; S376-Y379 WeakPolarHBondContact O-CA 3.34Å; S376-Y379 PolarHBondContact O-N 3.35Å; S376-G380 PolarHBondContact O-N 3.18Å; S376-W381 CarbonylContact C-O 3.1Å; S376-W381 WeakPolarHBondContact CB-O 3.4Å; S376-W381 PolarHBondContact O-N 3.38Å; S376-W381 VanDerWaalsContact O-N 3.08Å; S376-W381 PolarHBondContact OG-O 3.11Å; S376-F383 WeakPolarHBondContact OG-CD2 3.41Å
377	C	82	Confident	78	Confident	17 Å²	17	57.3 Å²	57.3	12%	0.115	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-55.3	-43.3	175.1	-71.9	0	0	0	0	113.5	C372 G374 L375 Y379 G380 W381	C372-C377 HydrophobicContact CB-CB 4.34Å; C372-C377 WeakPolarHBondContact CB-SG 3.45Å; C372-C377 PolarHBondContact O-SG 3.34Å; C372-C377 VanDerWaalsContact O-SG 3.41Å; C372-C377 WeakPolarHBondContact SG-CB 3.26Å; C372-C377 CovalentContact SG-SG 2.01Å; C372-C377 PolarHBondContact SG-SG 3.26Å; G374-C377 WeakPolarHBondContact O-CB 3.16Å; G374-C377 PolarHBondContact O-N 2.94Å; G374-C377 PolarHBondContact O-SG 2.72Å; G374-C377 VanDerWaalsContact O-SG 3.39Å; L375-C377 PolarHBondContact O-N 2.98Å; C377-Y379 PolarHBondContact O-N 3.44Å; C377-G380 PolarHBondContact O-N 3.02Å; C377-G380 VanDerWaalsContact O-N 3.1Å; C377-W381 WeakPolarHBondContact CA-O 3.18Å; C377-W381 PolarHBondContact N-O 3.35Å
378	Q	82.4	Confident	79.2	Confident	111 Å²	111	59.7 Å²	59.7	52%	0.519	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-66.7	-18.5	179.7	-62.8	-177.7	-0.7	0	0	112.1	M369 L375 S376	M369-Q378 HydrophobicContact CE-CG 4.08Å; L375-Q378 PolarHBondContact O-N 2.88Å; S376-Q378 VanDerWaalsContact C-N 3.31Å; S376-Q378 PolarHBondContact O-N 3.03Å
379	Y	82.9	Confident	80.2	Confident	51 Å²	51	60.4 Å²	60.4	20%	0.2	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-104.2	10.2	178.5	-51.8	-50.1	0	0	0	112.8	F272 K275 D277 I278 L375 S376 C377 W381	F272-Y379 HydrophobicContact CD1-CD2 4.17Å; F272-Y379 HydrophobicContact CD1-CG 4.2Å; F272-Y379 HydrophobicContact CD2-CD2 4.46Å; F272-Y379 HydrophobicContact CE1-CD2 4.49Å; F272-Y379 HydrophobicContact CE1-CG 4.48Å; F272-Y379 HydrophobicContact CG-CD2 4.16Å; K275-Y379 HydrophobicContact CD-CE1 4.21Å; K275-Y379 HydrophobicContact CG-CE1 4.44Å; D277-Y379 PolarHBondContact OD2-OH 3.2Å; I278-Y379 HydrophobicContact CD1-CE2 3.92Å; I278-Y379 HydrophobicContact CG1-CE2 3.94Å; L375-Y379 WeakPolarHBondContact O-CD2 3.46Å; S376-Y379 CarbonylContact O-C 3.45Å; S376-Y379 WeakPolarHBondContact O-CA 3.34Å; S376-Y379 PolarHBondContact O-N 3.35Å; C377-Y379 PolarHBondContact O-N 3.44Å; Y379-W381 VanDerWaalsContact O-CD1 3.32Å
380	G	84	Confident	81.3	Confident	28 Å²	28	63 Å²	63	29%	0.289	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	22.5	174.4	0	0	0	0	0	115.5	L363 S376 C377	L363-G380 PolarHBondContact N-O 3.12Å; S376-G380 PolarHBondContact O-N 3.18Å; C377-G380 PolarHBondContact O-N 3.02Å; C377-G380 VanDerWaalsContact O-N 3.1Å
381	W	86.5	Confident	82.5	Confident	6 Å²	6	59.2 Å²	59.2	2%	0.023	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-128.3	130.6	-179.5	-67.4	85.5	0	0	0	112.7	V264 Q267 A268 F272 S358 L359 D361 T362 S376 C377 Y379 F383	V264-W381 HydrophobicContact CG1-CH2 4.04Å; V264-W381 HydrophobicContact CG1-CZ2 3.94Å; Q267-W381 HydrophobicContact CB-CZ2 3.69Å; A268-W381 HydrophobicContact CB-CE3 4.4Å; A268-W381 HydrophobicContact CB-CH2 3.56Å; A268-W381 HydrophobicContact CB-CZ2 4.4Å; A268-W381 HydrophobicContact CB-CZ3 3.56Å; F272-W381 AromaticContact CE1-CD1 3.43Å; F272-W381 VanDerWaalsContact CE1-CD1 3.43Å; F272-W381 HydrophobicContact CE1-CG 4.24Å; F272-W381 AromaticContact CE1-NE1 3.77Å; F272-W381 HydrophobicContact CZ-CB 4.36Å; F272-W381 AromaticContact CZ-CD1 3.68Å; F272-W381 HydrophobicContact CZ-CG 4.05Å; S358-W381 WeakPolarHBondContact O-CZ3 3.38Å; L359-W381 HydrophobicContact CD2-CH2 4.24Å; D361-W381 HydrophobicContact CB-CE3 4.42Å; D361-W381 WeakPolarHBondContact O-CA 3.49Å; T362-W381 HydrophobicContact CG2-CD2 4.34Å; T362-W381 HydrophobicContact CG2-CE3 4Å; T362-W381 HydrophobicContact CG2-CH2 3.55Å; T362-W381 HydrophobicContact CG2-CZ2 3.92Å; T362-W381 HydrophobicContact CG2-CZ3 3.59Å; S376-W381 CarbonylContact C-O 3.1Å; S376-W381 WeakPolarHBondContact CB-O 3.4Å; S376-W381 PolarHBondContact O-N 3.38Å; S376-W381 VanDerWaalsContact O-N 3.08Å; S376-W381 PolarHBondContact OG-O 3.11Å; C377-W381 WeakPolarHBondContact CA-O 3.18Å; C377-W381 PolarHBondContact N-O 3.35Å; Y379-W381 VanDerWaalsContact O-CD1 3.32Å; W381-F383 HydrophobicContact CB-CE1 4.29Å; W381-F383 HydrophobicContact CB-CE2 4.03Å; W381-F383 HydrophobicContact CB-CZ 3.83Å; W381-F383 HydrophobicContact CD2-CZ 4.27Å; W381-F383 HydrophobicContact CE3-CE1 4.06Å; W381-F383 HydrophobicContact CE3-CZ 4.08Å; W381-F383 HydrophobicContact CG-CZ 4.21Å
382	D	87.7	Confident	83.5	Confident	49 Å²	49	57.2 Å²	57.2	26%	0.262	31%	0.312	S	S	.	.			trans	-106.4	102.3	178.9	-172.1	1.6	0	0	0	112.2	D361 L363 C372 T384	D361-D382 WeakPolarHBondContact CB-O 3.41Å; D361-D382 PolarHBondContact O-N 3.18Å; L363-D382 HydrophobicContact CD1-CB 4.13Å; L363-D382 HydrophobicContact CD2-CB 3.86Å; L363-D382 HydrophobicContact CG-CB 3.84Å; C372-D382 HydrophobicContact CB-CB 4.3Å; C372-D382 WeakPolarHBondContact CB-OD1 2.99Å; D382-T384 WeakPolarHBondContact OD1-CB 3.31Å; D382-T384 PolarHBondContact OD1-N 3.18Å; D382-T384 PolarHBondContact OD1-OG1 3.4Å
383	F	86.6	Confident	84.1	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.009	33%	0.33	C	S	.	.			trans	-102.8	19.3	176.5	-56.7	-44.6	0	0	0	113	F272 A355 S356 D361 S376 W381 E385 C386 I387	F272-F383 HydrophobicContact CZ-CE2 4.42Å; A355-F383 HydrophobicContact CB-CD2 4.33Å; A355-F383 HydrophobicContact CB-CE2 3.98Å; A355-F383 HydrophobicContact CB-CZ 4.12Å; S356-F383 WeakPolarHBondContact OG-CD1 3.39Å; S356-F383 WeakPolarHBondContact OG-CE1 3.44Å; D361-F383 HydrophobicContact CB-CD1 4.41Å; D361-F383 HydrophobicContact CB-CE1 4.35Å; S376-F383 WeakPolarHBondContact OG-CD2 3.41Å; W381-F383 HydrophobicContact CB-CE1 4.29Å; W381-F383 HydrophobicContact CB-CE2 4.03Å; W381-F383 HydrophobicContact CB-CZ 3.83Å; W381-F383 HydrophobicContact CD2-CZ 4.27Å; W381-F383 HydrophobicContact CE3-CE1 4.06Å; W381-F383 HydrophobicContact CE3-CZ 4.08Å; W381-F383 HydrophobicContact CG-CZ 4.21Å; F383-E385 PolarHBondContact O-N 3.33Å; F383-C386 WeakPolarHBondContact O-CB 3.24Å; F383-C386 PolarHBondContact O-N 3.49Å; F383-I387 HydrophobicContact CB-CD1 4.12Å; F383-I387 HydrophobicContact CB-CG1 4.5Å; F383-I387 VanDerWaalsContact O-CG1 3.29Å; F383-I387 WeakPolarHBondContact O-CG1 3.46Å; F383-I387 PolarHBondContact O-N 2.94Å; F383-I387 VanDerWaalsContact O-N 3.07Å
384	T	84.6	Confident	84.6	Confident	19 Å²	19	59.7 Å²	59.7	12%	0.117	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-44.1	-170.4	-57	0	0	0	0	113.4	C372 V373 D382 C386 I387 N388	C372-T384 VanDerWaalsContact CA-OG1 3.32Å; C372-T384 WeakPolarHBondContact CA-OG1 3.34Å; V373-T384 HydrophobicContact CB-CG2 4.01Å; V373-T384 HydrophobicContact CG2-CG2 3.69Å; V373-T384 PolarHBondContact N-OG1 2.92Å; D382-T384 WeakPolarHBondContact OD1-CB 3.31Å; D382-T384 PolarHBondContact OD1-N 3.18Å; D382-T384 PolarHBondContact OD1-OG1 3.4Å; T384-C386 VanDerWaalsContact C-N 3.32Å; T384-C386 PolarHBondContact O-N 3.4Å; T384-I387 PolarHBondContact O-N 3.04Å; T384-N388 WeakPolarHBondContact CG2-ND2 3.35Å; T384-N388 WeakPolarHBondContact O-CB 3.28Å; T384-N388 PolarHBondContact O-N 3.3Å; T384-N388 PolarHBondContact O-ND2 3.45Å
385	E	84.3	Confident	85.2	Confident	155 Å²	155	57.5 Å²	57.5	72%	0.724	30%	0.298	S	S	*	.	H	α-helix	trans	-60.5	-44.4	-179.6	-172.3	179.4	179.5	0	0	111.5	F383 N389	F383-E385 PolarHBondContact O-N 3.33Å; E385-N389 WeakPolarHBondContact O-CB 3.37Å; E385-N389 PolarHBondContact O-N 2.72Å; E385-N389 VanDerWaalsContact O-N 3.08Å
386	C	86.3	Confident	85.6	Confident	13 Å²	13	55.1 Å²	55.1	9%	0.088	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-45.4	179.1	-175.2	0	0	0	0	112.3	F383 T384 K390 T391 C392	F383-C386 WeakPolarHBondContact O-CB 3.24Å; F383-C386 PolarHBondContact O-N 3.49Å; T384-C386 VanDerWaalsContact C-N 3.32Å; T384-C386 PolarHBondContact O-N 3.4Å; C386-K390 WeakPolarHBondContact O-CA 3.29Å; C386-K390 PolarHBondContact O-N 2.85Å; C386-T391 PolarHBondContact O-N 3.44Å; C386-T391 VanDerWaalsContact O-N 3.12Å; C386-C392 HydrophobicContact CB-CB 4.49Å; C386-C392 WeakPolarHBondContact CB-SG 3.29Å; C386-C392 PolarHBondContact O-SG 2.87Å; C386-C392 WeakPolarHBondContact SG-CA 3.45Å; C386-C392 WeakPolarHBondContact SG-CB 3.41Å; C386-C392 CovalentContact SG-SG 2.03Å; C386-C392 PolarHBondContact SG-SG 3.28Å
387	I	84.6	Confident	85.9	Confident	48 Å²	48	55.3 Å²	55.3	25%	0.246	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-46.9	-179.2	-68.1	165.4	0	0	0	110.6	D354 F383 T384 K390	D354-I387 HydrophobicContact CB-CD1 4.48Å; D354-I387 HydrophobicContact CB-CG1 3.86Å; F383-I387 HydrophobicContact CB-CD1 4.12Å; F383-I387 HydrophobicContact CB-CG1 4.5Å; F383-I387 VanDerWaalsContact O-CG1 3.29Å; F383-I387 WeakPolarHBondContact O-CG1 3.46Å; F383-I387 PolarHBondContact O-N 2.94Å; F383-I387 VanDerWaalsContact O-N 3.07Å; T384-I387 PolarHBondContact O-N 3.04Å; I387-K390 PolarHBondContact O-N 3.26Å
388	N	85.5	Confident	86.2	Confident	108 Å²	108	57.4 Å²	57.4	58%	0.578	30%	0.297	S	S	*	.	H	α-helix	trans	-66	-41.4	-177.6	-73.6	-23.5	0	0	0	112.3	T384 K390	T384-N388 WeakPolarHBondContact CG2-ND2 3.35Å; T384-N388 WeakPolarHBondContact O-CB 3.28Å; T384-N388 PolarHBondContact O-N 3.3Å; T384-N388 PolarHBondContact O-ND2 3.45Å; N388-K390 VanDerWaalsContact C-N 3.29Å; N388-K390 PolarHBondContact O-N 2.93Å
389	N	84.8	Confident	86.6	Confident	106 Å²	106	54.2 Å²	54.2	57%	0.567	28%	0.28	S	S	*	.	H	α-helix	trans	-80.8	-7.6	177.4	-75.4	-17.7	0	0	0	113.5	E385 T391	E385-N389 WeakPolarHBondContact O-CB 3.37Å; E385-N389 PolarHBondContact O-N 2.72Å; E385-N389 VanDerWaalsContact O-N 3.08Å; N389-T391 HydrophobicContact CB-CG2 3.98Å; N389-T391 PolarHBondContact O-N 3.45Å
390	K	82.2	Confident	86.8	Confident	192 Å²	192	54.5 Å²	54.5	84%	0.835	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	32.8	-172.7	-56	-176.3	-179.3	179.8	0	113	C386 I387 N388	C386-K390 WeakPolarHBondContact O-CA 3.29Å; C386-K390 PolarHBondContact O-N 2.85Å; I387-K390 PolarHBondContact O-N 3.26Å; N388-K390 VanDerWaalsContact C-N 3.29Å; N388-K390 PolarHBondContact O-N 2.93Å
391	T	87.4	Confident	87	Confident	91 Å²	91	53.6 Å²	53.6	56%	0.558	27%	0.27	S	S	*	.			trans	-101	17.5	-178.2	49.9	0	0	0	0	112.7	C386 N389 T393	C386-T391 PolarHBondContact O-N 3.44Å; C386-T391 VanDerWaalsContact O-N 3.12Å; N389-T391 HydrophobicContact CB-CG2 3.98Å; N389-T391 PolarHBondContact O-N 3.45Å; T391-T393 PolarHBondContact O-N 3.38Å
392	C	87.3	Confident	87.1	Confident	14 Å²	14	53.3 Å²	53.3	10%	0.095	27%	0.269	C	S	.	.			trans	-67.5	128.6	-178	-66	0	0	0	0	113.7	D354 C386 N398	D354-C392 HydrophobicContact CB-CB 4.31Å; C386-C392 HydrophobicContact CB-CB 4.49Å; C386-C392 WeakPolarHBondContact CB-SG 3.29Å; C386-C392 PolarHBondContact O-SG 2.87Å; C386-C392 WeakPolarHBondContact SG-CA 3.45Å; C386-C392 WeakPolarHBondContact SG-CB 3.41Å; C386-C392 CovalentContact SG-SG 2.03Å; C386-C392 PolarHBondContact SG-SG 3.28Å; C392-N398 VanDerWaalsContact CB-ND2 3.33Å; C392-N398 WeakPolarHBondContact CB-ND2 3.4Å; C392-N398 VanDerWaalsContact O-CB 3.31Å; C392-N398 WeakPolarHBondContact O-CB 3.34Å
393	T	87.4	Confident	87.3	Confident	81 Å²	81	51 Å²	51	50%	0.497	26%	0.257	S	S	.	.			trans	-92.1	-31.8	-178.6	53.3	0	0	0	0	111.6	S356 T391	S356-T393 PolarHBondContact O-OG1 2.9Å; T391-T393 PolarHBondContact O-N 3.38Å
394	Y	90.2	Very high	87.5	Confident	62 Å²	62	52 Å²	52	24%	0.243	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-116	-179.1	-179.2	-64.3	-76.9	0	0	0	112.2	K269 A355 N398 Y399	K269-Y394 HydrophobicContact CB-CD1 4.24Å; K269-Y394 HydrophobicContact CB-CG 4.19Å; K269-Y394 HydrophobicContact CD-CD1 4.22Å; K269-Y394 HydrophobicContact CD-CE1 4.03Å; K269-Y394 HydrophobicContact CG-CD1 4.01Å; K269-Y394 HydrophobicContact CG-CD2 4.18Å; K269-Y394 HydrophobicContact CG-CE1 4.2Å; K269-Y394 HydrophobicContact CG-CE2 4.33Å; K269-Y394 HydrophobicContact CG-CG 3.99Å; A355-Y394 PolarHBondContact N-O 3.36Å; A355-Y394 CarbonylContact O-C 3.57Å; A355-Y394 WeakPolarHBondContact O-CA 3.36Å; A355-Y394 PolarHBondContact O-N 3.31Å; A355-Y394 VanDerWaalsContact O-O 3.11Å; Y394-N398 PolarHBondContact O-ND2 2.91Å; Y394-Y399 HydrophobicContact CD1-CD1 4.35Å; Y394-Y399 HydrophobicContact CD1-CD2 4.05Å; Y394-Y399 HydrophobicContact CD1-CE2 4.47Å; Y394-Y399 AromaticContact CD1-CG 3.99Å; Y394-Y399 HydrophobicContact CD1-CG 3.99Å; Y394-Y399 HydrophobicContact CE1-CD2 4.1Å; Y394-Y399 HydrophobicContact CE1-CE2 4.09Å; Y394-Y399 HydrophobicContact CE1-CG 4.42Å
395	G	88.9	Confident	87.7	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	94.2	163.1	-168.9	0	0	0	0	0	113	K269 V352 R353 S397 N398 Y399	K269-G395 PolarHBondContact O-N 2.82Å; V352-G395 WeakPolarHBondContact O-CA 3.36Å; R353-G395 CarbonylContact O-C 3.56Å; R353-G395 WeakPolarHBondContact O-CA 3.45Å; G395-S397 PolarHBondContact O-N 3.01Å; G395-N398 PolarHBondContact O-N 2.71Å; G395-Y399 PolarHBondContact O-N 3.01Å
396	I	90.3	Very high	88.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-22	-173.9	62.4	165.6	0	0	0	113.9	A118 V347 V351 V352 R353	A118-I396 HydrophobicContact CB-CB 4.09Å; A118-I396 HydrophobicContact CB-CD1 3.49Å; A118-I396 VanDerWaalsContact CB-CD1 3.49Å; A118-I396 HydrophobicContact CB-CG1 3.46Å; A118-I396 VanDerWaalsContact CB-CG1 3.46Å; V347-I396 HydrophobicContact CG2-CG2 4.32Å; V351-I396 HydrophobicContact CB-CG2 3.36Å; V351-I396 HydrophobicContact CG1-CG2 3.32Å; V351-I396 HydrophobicContact CG2-CG2 4.27Å; V352-I396 PolarHBondContact O-N 2.97Å; V352-I396 VanDerWaalsContact O-N 3.08Å; R353-I396 HydrophobicContact CG-CD1 4.44Å; R353-I396 HydrophobicContact CG-CG1 4.31Å; R353-I396 PolarHBondContact O-N 3.03Å
397	S	88.4	Confident	88.3	Confident	9 Å²	9	44 Å²	44	6%	0.063	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-26.9	179.7	-174.6	0	0	0	0	113.2	W115 Q119 R353 G395	W115-S397 PolarHBondContact NE1-O 3.43Å; Q119-S397 PolarHBondContact NE2-OG 3.46Å; R353-S397 WeakPolarHBondContact O-CB 3.44Å; R353-S397 PolarHBondContact O-N 3.49Å; G395-S397 PolarHBondContact O-N 3.01Å
398	N	88.7	Confident	88.6	Confident	60 Å²	60	43.9 Å²	43.9	32%	0.321	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-29.1	-168.9	-52.8	-50	0	0	0	112.3	D354 C392 Y394 G395	D354-N398 PolarHBondContact OD1-ND2 2.97Å; C392-N398 VanDerWaalsContact CB-ND2 3.33Å; C392-N398 WeakPolarHBondContact CB-ND2 3.4Å; C392-N398 VanDerWaalsContact O-CB 3.31Å; C392-N398 WeakPolarHBondContact O-CB 3.34Å; Y394-N398 PolarHBondContact O-ND2 2.91Å; G395-N398 PolarHBondContact O-N 2.71Å
399	Y	89.2	Confident	88.9	Confident	44 Å²	44	44.8 Å²	44.8	17%	0.173	23%	0.229	C	C	.	.			trans	-105.3	102.3	-177.2	-168.4	-114.2	0	0	0	112.3	E202 Y394 G395 Q401 S402 M405	E202-Y399 PolarHBondContact OE1-OH 3.06Å; Y394-Y399 HydrophobicContact CD1-CD1 4.35Å; Y394-Y399 HydrophobicContact CD1-CD2 4.05Å; Y394-Y399 HydrophobicContact CD1-CE2 4.47Å; Y394-Y399 AromaticContact CD1-CG 3.99Å; Y394-Y399 HydrophobicContact CD1-CG 3.99Å; Y394-Y399 HydrophobicContact CE1-CD2 4.1Å; Y394-Y399 HydrophobicContact CE1-CE2 4.09Å; Y394-Y399 HydrophobicContact CE1-CG 4.42Å; G395-Y399 PolarHBondContact O-N 3.01Å; Y399-Q401 VanDerWaalsContact CD1-C 3.49Å; Y399-Q401 HydrophobicContact CD1-CB 4.27Å; Y399-Q401 HydrophobicContact CE1-CB 3.57Å; Y399-Q401 VanDerWaalsContact CE1-O 3.31Å; Y399-Q401 WeakPolarHBondContact CE1-O 3.44Å; Y399-Q401 HydrophobicContact CE2-CB 4.44Å; Y399-Q401 PolarHBondContact O-N 3.01Å; Y399-S402 PolarHBondContact O-N 3.27Å; Y399-S402 PolarHBondContact O-OG 2.75Å; Y399-M405 HydrophobicContact CE1-CB 4.31Å
400	Y	87.3	Confident	89	Confident	58 Å²	58	40.7 Å²	40.7	23%	0.227	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.6	-179.3	-67.9	-47.6	0	0	0	113.8	L111 R112 W115 S402	L111-Y400 WeakPolarHBondContact O-CB 3.45Å; L111-Y400 WeakPolarHBondContact O-CD1 3.26Å; R112-Y400 VanDerWaalsContact NH1-CD2 3.34Å; W115-Y400 HydrophobicContact CB-CD1 3.99Å; W115-Y400 HydrophobicContact CB-CE1 4.05Å; W115-Y400 AromaticContact CD1-CE1 3.58Å; W115-Y400 AromaticContact CD2-CE1 3.92Å; W115-Y400 HydrophobicContact CD2-CE1 3.92Å; W115-Y400 HydrophobicContact CG-CD1 4.03Å; W115-Y400 AromaticContact CG-CE1 3.58Å; W115-Y400 HydrophobicContact CG-CE1 3.58Å; W115-Y400 AromaticContact NE1-CE1 3.89Å; Y400-S402 PolarHBondContact O-N 2.75Å
401	Q	89.2	Confident	89.5	Confident	8 Å²	8	35 Å²	35	4%	0.037	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	30.2	178.7	-54.3	-172.4	11.1	0	0	113.2	L111 D198 Y399 L403 S404 M405	L111-Q401 HydrophobicContact CD2-CG 4.11Å; D198-Q401 PolarHBondContact OD2-NE2 3.35Å; Y399-Q401 VanDerWaalsContact CD1-C 3.49Å; Y399-Q401 HydrophobicContact CD1-CB 4.27Å; Y399-Q401 HydrophobicContact CE1-CB 3.57Å; Y399-Q401 VanDerWaalsContact CE1-O 3.31Å; Y399-Q401 WeakPolarHBondContact CE1-O 3.44Å; Y399-Q401 HydrophobicContact CE2-CB 4.44Å; Y399-Q401 PolarHBondContact O-N 3.01Å; Q401-L403 PolarHBondContact O-N 2.97Å; Q401-L403 VanDerWaalsContact O-N 3.15Å; Q401-S404 WeakPolarHBondContact O-CB 3.4Å; Q401-S404 PolarHBondContact O-N 3.02Å; Q401-M405 PolarHBondContact O-N 2.9Å
402	S	89.3	Confident	89.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-54.1	-33.2	178.8	-73.3	0	0	0	0	113.5	Y399 Y400 S404 M405 V406	Y399-S402 PolarHBondContact O-N 3.27Å; Y399-S402 PolarHBondContact O-OG 2.75Å; Y400-S402 PolarHBondContact O-N 2.75Å; S402-S404 VanDerWaalsContact C-N 3.32Å; S402-S404 PolarHBondContact O-N 2.92Å; S402-M405 PolarHBondContact O-N 3.22Å; S402-V406 WeakPolarHBondContact O-CG2 3.2Å; S402-V406 PolarHBondContact O-N 2.67Å; S402-V406 VanDerWaalsContact O-N 3.11Å
403	L	90.1	Very high	90	Very high	2 Å²	2	32 Å²	32	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-36.8	174.5	-96.5	78.4	0	0	0	113.1	Y110 P114 Y254 I343 Q401 M405 S407 I413	Y110-L403 HydrophobicContact CD1-CD2 3.7Å; Y110-L403 HydrophobicContact CE1-CD2 4.22Å; P114-L403 HydrophobicContact CB-CD1 4.33Å; P114-L403 HydrophobicContact CG-CD1 3.01Å; Y254-L403 HydrophobicContact CD2-CD2 4.38Å; Y254-L403 HydrophobicContact CD2-CG 4.03Å; Y254-L403 HydrophobicContact CE2-CG 3.9Å; I343-L403 HydrophobicContact CG2-CD1 4.36Å; I343-L403 HydrophobicContact CG2-CD2 4.23Å; Q401-L403 PolarHBondContact O-N 2.97Å; Q401-L403 VanDerWaalsContact O-N 3.15Å; L403-M405 VanDerWaalsContact C-N 3.34Å; L403-S407 WeakPolarHBondContact O-CB 3.44Å; L403-S407 PolarHBondContact O-N 3.36Å; L403-I413 HydrophobicContact CB-CG2 4.22Å
404	S	91	Very high	90.2	Very high	22 Å²	22	28.9 Å²	28.9	15%	0.154	16%	0.155	C	C	.	.	H	α-helix	trans	-68.6	-36.5	178	-172.5	0	0	0	0	111.2	Q401 S402 S407 G410	Q401-S404 WeakPolarHBondContact O-CB 3.4Å; Q401-S404 PolarHBondContact O-N 3.02Å; S402-S404 VanDerWaalsContact C-N 3.32Å; S402-S404 PolarHBondContact O-N 2.92Å; S404-S407 PolarHBondContact O-OG 3.43Å; S404-S407 VanDerWaalsContact O-OG 3.08Å; S404-G410 PolarHBondContact OG-O 2.83Å
405	M	89.8	Confident	90.3	Very high	18 Å²	18	27.7 Å²	27.7	9%	0.089	16%	0.157	C	C	.	.	H	α-helix	trans	-68.6	-38.3	178	179	-97.7	-74.1	0	0	112.7	K266 K269 F271 V351 Y399 Q401 S402 L403	K266-M405 VanDerWaalsContact CE-O 3.26Å; K266-M405 WeakPolarHBondContact CE-O 3.37Å; K266-M405 PolarHBondContact NZ-O 3.34Å; K269-M405 HydrophobicContact CB-CE 4.36Å; K269-M405 HydrophobicContact CB-CG 4.24Å; K269-M405 HydrophobicContact CB-SD 4.35Å; K269-M405 HydrophobicContact CD-CG 4.32Å; K269-M405 WeakPolarHBondContact O-CE 3.31Å; F271-M405 HydrophobicContact CB-SD 3.64Å; V351-M405 HydrophobicContact CG1-CE 3.94Å; Y399-M405 HydrophobicContact CE1-CB 4.31Å; Q401-M405 PolarHBondContact O-N 2.9Å; S402-M405 PolarHBondContact O-N 3.22Å; L403-M405 VanDerWaalsContact C-N 3.34Å
406	V	91.4	Very high	90.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-77.4	-28.9	-179.3	174.3	0	0	0	0	112.9	Y254 G257 T258 F271 V351 S402	Y254-V406 HydrophobicContact CD2-CG1 4.43Å; Y254-V406 HydrophobicContact CE2-CB 4.27Å; Y254-V406 HydrophobicContact CE2-CG1 3.95Å; G257-V406 CarbonylContact C-O 3.28Å; G257-V406 WeakPolarHBondContact CA-O 3.33Å; T258-V406 HydrophobicContact CG2-CG1 3.55Å; F271-V406 HydrophobicContact CD2-CB 4.45Å; F271-V406 HydrophobicContact CD2-CG1 4.13Å; F271-V406 HydrophobicContact CD2-CG2 3.88Å; F271-V406 HydrophobicContact CE2-CG1 3.74Å; F271-V406 HydrophobicContact CE2-CG2 4.36Å; F271-V406 HydrophobicContact CZ-CG1 4.41Å; V351-V406 HydrophobicContact CG2-CG2 3.46Å; V351-V406 VanDerWaalsContact CG2-CG2 3.46Å; S402-V406 WeakPolarHBondContact O-CG2 3.2Å; S402-V406 PolarHBondContact O-N 2.67Å; S402-V406 VanDerWaalsContact O-N 3.11Å
407	S	92.3	Very high	90.6	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.014	16%	0.158	C	C	.	.	S	Bend	trans	-64.9	161.6	-173.4	74.6	0	0	0	0	113.9	K266 L403 S404 F409 G410 I413	K266-S407 PolarHBondContact NZ-O 3.02Å; L403-S407 WeakPolarHBondContact O-CB 3.44Å; L403-S407 PolarHBondContact O-N 3.36Å; S404-S407 PolarHBondContact O-OG 3.43Å; S404-S407 VanDerWaalsContact O-OG 3.08Å; S407-F409 VanDerWaalsContact C-N 3.33Å; S407-F409 PolarHBondContact OG-O 3.48Å; S407-G410 PolarHBondContact OG-N 3.03Å; S407-I413 WeakPolarHBondContact OG-CG1 3.35Å
408	A	90.8	Very high	90.8	Very high	45 Å²	45	30 Å²	30	37%	0.372	17%	0.166	S	C	.	.	S	Bend	trans	-67.3	-36.6	175.4	0	0	0	0	0	111.5	S253 V256 G257	S253-A408 PolarHBondContact O-N 2.97Å; V256-A408 HydrophobicContact CG1-CB 4.18Å; G257-A408 VanDerWaalsContact CA-N 3.33Å
409	F	91.5	Very high	91	Very high	127 Å²	127	27.2 Å²	27.2	56%	0.557	15%	0.152	S	C	*	.	S	Bend	trans	-137.6	101.2	178.3	-171.3	-123.2	0	0	0	110.9	S253 S407 P411 L412	S253-F409 PolarHBondContact OG-N 2.95Å; S407-F409 VanDerWaalsContact C-N 3.33Å; S407-F409 PolarHBondContact OG-O 3.48Å; F409-P411 HydrophobicContact CD1-CB 4.4Å; F409-P411 HydrophobicContact CD2-CG 4.5Å; F409-P411 HydrophobicContact CE1-CB 3.81Å; F409-P411 HydrophobicContact CE1-CG 4.05Å; F409-P411 HydrophobicContact CE2-CG 3.96Å; F409-P411 HydrophobicContact CZ-CB 3.92Å; F409-P411 HydrophobicContact CZ-CG 3.69Å; F409-L412 HydrophobicContact CD1-CB 3.87Å; F409-L412 WeakPolarHBondContact O-CB 3.15Å; F409-L412 PolarHBondContact O-N 2.68Å; F409-L412 VanDerWaalsContact O-N 3.1Å
410	G	86.9	Confident	91.1	Very high	19 Å²	19	25.1 Å²	25.1	20%	0.196	14%	0.144	C	C	.	.	H	α-helix	trans	-49.9	-48	-176.6	0	0	0	0	0	115.2	S404 S407 L412 I413 T414	S404-G410 PolarHBondContact OG-O 2.83Å; S407-G410 PolarHBondContact OG-N 3.03Å; G410-L412 PolarHBondContact O-N 3.03Å; G410-I413 WeakPolarHBondContact O-CB 3.46Å; G410-I413 PolarHBondContact O-N 2.87Å; G410-T414 PolarHBondContact O-N 3.41Å
411	P	91.3	Very high	91.4	Very high	73 Å²	73	22.4 Å²	22.4	47%	0.474	13%	0.133	S	C	.	.	H	α-helix	trans	-59.7	-22	-179.1	-27.4	36.3	0	0	0	114.8	F409 T414 A415	F409-P411 HydrophobicContact CD1-CB 4.4Å; F409-P411 HydrophobicContact CD2-CG 4.5Å; F409-P411 HydrophobicContact CE1-CB 3.81Å; F409-P411 HydrophobicContact CE1-CG 4.05Å; F409-P411 HydrophobicContact CE2-CG 3.96Å; F409-P411 HydrophobicContact CZ-CB 3.92Å; F409-P411 HydrophobicContact CZ-CG 3.69Å; P411-T414 VanDerWaalsContact C-OG1 3.24Å; P411-T414 VanDerWaalsContact CA-OG1 3.24Å; P411-T414 WeakPolarHBondContact CA-OG1 3.16Å; P411-T414 PolarHBondContact O-OG1 3.43Å; P411-A415 PolarHBondContact O-N 3.07Å
412	L	92.3	Very high	91.6	Very high	42 Å²	42	23.7 Å²	23.7	22%	0.22	14%	0.14	C	C	.	.	H	α-helix	trans	-76.8	-32.4	176.7	-170.9	58.5	0	0	0	112.2	V249 S253 F409 G410 A415 G416	V249-L412 HydrophobicContact CG1-CD1 3.9Å; V249-L412 HydrophobicContact CG1-CD2 3.67Å; V249-L412 HydrophobicContact CG1-CG 4.21Å; S253-L412 VanDerWaalsContact CB-CD2 3.44Å; F409-L412 HydrophobicContact CD1-CB 3.87Å; F409-L412 WeakPolarHBondContact O-CB 3.15Å; F409-L412 PolarHBondContact O-N 2.68Å; F409-L412 VanDerWaalsContact O-N 3.1Å; G410-L412 PolarHBondContact O-N 3.03Å; L412-A415 PolarHBondContact O-N 3.05Å; L412-G416 PolarHBondContact O-N 3.02Å
413	I	92.7	Very high	91.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.4	-42.4	171.5	-60.7	-60.4	0	0	0	109.9	Y110 S250 L403 S407 G410 A415 G416 I417	Y110-I413 HydrophobicContact CD1-CG2 3.88Å; Y110-I413 HydrophobicContact CE1-CG2 4.11Å; S250-I413 WeakPolarHBondContact O-CD1 3.37Å; S250-I413 WeakPolarHBondContact OG-CD1 3.26Å; L403-I413 HydrophobicContact CB-CG2 4.22Å; S407-I413 WeakPolarHBondContact OG-CG1 3.35Å; G410-I413 WeakPolarHBondContact O-CB 3.46Å; G410-I413 PolarHBondContact O-N 2.87Å; I413-A415 VanDerWaalsContact C-N 3.31Å; I413-A415 PolarHBondContact O-N 3.02Å; I413-G416 CarbonylContact O-C 3.36Å; I413-G416 WeakPolarHBondContact O-CA 3.18Å; I413-G416 PolarHBondContact O-N 3.48Å; I413-I417 HydrophobicContact CG2-CD1 4.17Å; I413-I417 HydrophobicContact CG2-CG1 4.46Å; I413-I417 WeakPolarHBondContact O-CG1 3.41Å; I413-I417 PolarHBondContact O-N 3.26Å
414	T	92.2	Very high	91.7	Very high	16 Å²	16	23.7 Å²	23.7	10%	0.098	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-39.3	175.4	53.6	0	0	0	0	111.7	G410 P411 G416 I417 F418	G410-T414 PolarHBondContact O-N 3.41Å; P411-T414 VanDerWaalsContact C-OG1 3.24Å; P411-T414 VanDerWaalsContact CA-OG1 3.24Å; P411-T414 WeakPolarHBondContact CA-OG1 3.16Å; P411-T414 PolarHBondContact O-OG1 3.43Å; T414-G416 VanDerWaalsContact C-N 3.32Å; T414-G416 PolarHBondContact O-N 3.45Å; T414-I417 PolarHBondContact O-N 2.93Å; T414-F418 WeakPolarHBondContact O-CG 3.46Å; T414-F418 PolarHBondContact O-N 3.08Å
415	A	92.5	Very high	91.8	Very high	36 Å²	36	22.7 Å²	22.7	30%	0.298	13%	0.133	S	C	.	.	H	α-helix	trans	-62.3	-38.6	171	0	0	0	0	0	112.3	V246 P411 L412 I413 F418 G419	V246-A415 HydrophobicContact CG1-CB 4.05Å; V246-A415 WeakPolarHBondContact CG1-O 3.23Å; P411-A415 PolarHBondContact O-N 3.07Å; L412-A415 PolarHBondContact O-N 3.05Å; I413-A415 VanDerWaalsContact C-N 3.31Å; I413-A415 PolarHBondContact O-N 3.02Å; A415-F418 PolarHBondContact O-N 3.03Å; A415-G419 PolarHBondContact O-N 3.48Å
416	G	92.9	Very high	91.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.7	-42.7	172.1	0	0	0	0	0	113.2	L412 I413 T414 G419 A420	L412-G416 PolarHBondContact O-N 3.02Å; I413-G416 CarbonylContact O-C 3.36Å; I413-G416 WeakPolarHBondContact O-CA 3.18Å; I413-G416 PolarHBondContact O-N 3.48Å; T414-G416 VanDerWaalsContact C-N 3.32Å; T414-G416 PolarHBondContact O-N 3.45Å; G416-G419 PolarHBondContact O-N 2.92Å; G416-A420 WeakPolarHBondContact O-CB 3.49Å; G416-A420 PolarHBondContact O-N 3.3Å
417	I	92.8	Very high	91.7	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-45.8	175.1	-65.5	165.4	0	0	0	110.1	Y110 L111 T195 I413 T414 G419 A420 T421	Y110-I417 HydrophobicContact CD1-CG1 3.92Å; Y110-I417 HydrophobicContact CD2-CG1 4.05Å; Y110-I417 HydrophobicContact CG-CD1 4.47Å; Y110-I417 HydrophobicContact CG-CG1 3.58Å; L111-I417 HydrophobicContact CD2-CD1 4.08Å; T195-I417 HydrophobicContact CG2-CB 4.44Å; T195-I417 HydrophobicContact CG2-CD1 4.09Å; T195-I417 HydrophobicContact CG2-CG2 3.98Å; T195-I417 WeakPolarHBondContact OG1-CG2 3.08Å; I413-I417 HydrophobicContact CG2-CD1 4.17Å; I413-I417 HydrophobicContact CG2-CG1 4.46Å; I413-I417 WeakPolarHBondContact O-CG1 3.41Å; I413-I417 PolarHBondContact O-N 3.26Å; T414-I417 PolarHBondContact O-N 2.93Å; I417-G419 PolarHBondContact O-N 3.47Å; I417-A420 PolarHBondContact O-N 2.89Å; I417-T421 HydrophobicContact CG2-CG2 4.2Å; I417-T421 WeakPolarHBondContact O-CB 3.35Å; I417-T421 WeakPolarHBondContact O-CG2 3.23Å; I417-T421 PolarHBondContact O-N 3.42Å; I417-T421 PolarHBondContact O-OG1 2.83Å
418	F	93.5	Very high	91.7	Very high	55 Å²	55	22.9 Å²	22.9	24%	0.241	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-43.5	176.1	-64	-12	0	0	0	111.6	F192 T195 V196 T414 A415 T421 L422	F192-F418 HydrophobicContact CD2-CB 4.44Å; F192-F418 AromaticContact CD2-CD1 3.53Å; F192-F418 HydrophobicContact CD2-CD1 3.53Å; F192-F418 HydrophobicContact CD2-CE1 4.05Å; F192-F418 HydrophobicContact CD2-CG 4.17Å; F192-F418 HydrophobicContact CE2-CB 4.14Å; F192-F418 AromaticContact CE2-CD1 3.39Å; F192-F418 HydrophobicContact CE2-CD1 3.39Å; F192-F418 HydrophobicContact CE2-CD2 4.33Å; F192-F418 AromaticContact CE2-CE1 3.78Å; F192-F418 HydrophobicContact CE2-CE1 3.78Å; F192-F418 AromaticContact CE2-CG 3.7Å; F192-F418 HydrophobicContact CE2-CG 3.7Å; F192-F418 HydrophobicContact CE2-CZ 4.4Å; T195-F418 HydrophobicContact CG2-CE1 3.92Å; V196-F418 HydrophobicContact CG2-CE1 3.74Å; V196-F418 HydrophobicContact CG2-CZ 3.85Å; T414-F418 WeakPolarHBondContact O-CG 3.46Å; T414-F418 PolarHBondContact O-N 3.08Å; A415-F418 PolarHBondContact O-N 3.03Å; F418-T421 PolarHBondContact O-OG1 3.44Å; F418-L422 HydrophobicContact CB-CD1 4.45Å; F418-L422 VanDerWaalsContact O-CB 3.23Å; F418-L422 WeakPolarHBondContact O-CB 3.17Å; F418-L422 VanDerWaalsContact O-CG 3.27Å; F418-L422 WeakPolarHBondContact O-CG 3.33Å; F418-L422 PolarHBondContact O-N 3.4Å
419	G	91.9	Very high	91.7	Very high	2 Å²	2	20.8 Å²	20.8	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-46.9	175.4	0	0	0	0	0	112.9	A415 G416 I417 S423	A415-G419 PolarHBondContact O-N 3.48Å; G416-G419 PolarHBondContact O-N 2.92Å; I417-G419 PolarHBondContact O-N 3.47Å; G419-S423 WeakPolarHBondContact O-CB 3.25Å; G419-S423 PolarHBondContact O-N 2.9Å; G419-S423 VanDerWaalsContact O-N 3.15Å; G419-S423 PolarHBondContact O-OG 3.33Å
420	A	92.3	Very high	91.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.8	-46.9	-180	0	0	0	0	0	112.6	W105 Y110 I247 G416 I417 S423 S424	W105-A420 WeakPolarHBondContact O-CB 3.47Å; Y110-A420 HydrophobicContact CD2-CB 4.34Å; Y110-A420 HydrophobicContact CE2-CB 4.02Å; I247-A420 HydrophobicContact CD1-CB 4.06Å; I247-A420 HydrophobicContact CG1-CB 4.41Å; G416-A420 WeakPolarHBondContact O-CB 3.49Å; G416-A420 PolarHBondContact O-N 3.3Å; I417-A420 PolarHBondContact O-N 2.89Å; A420-S423 PolarHBondContact O-OG 2.9Å; A420-S424 WeakPolarHBondContact O-CB 3.4Å; A420-S424 PolarHBondContact O-N 3.23Å; A420-S424 PolarHBondContact O-OG 3.09Å
421	T	93.6	Very high	91.6	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-70.4	-49.6	-177.3	50.7	0	0	0	0	112.6	V107 F192 I417 F418 A425	V107-T421 HydrophobicContact CB-CG2 3.79Å; V107-T421 HydrophobicContact CG2-CG2 4.07Å; F192-T421 HydrophobicContact CB-CG2 4.38Å; I417-T421 HydrophobicContact CG2-CG2 4.2Å; I417-T421 WeakPolarHBondContact O-CB 3.35Å; I417-T421 WeakPolarHBondContact O-CG2 3.23Å; I417-T421 PolarHBondContact O-N 3.42Å; I417-T421 PolarHBondContact O-OG1 2.83Å; F418-T421 PolarHBondContact O-OG1 3.44Å; T421-A425 VanDerWaalsContact O-CB 3.24Å; T421-A425 WeakPolarHBondContact O-CB 3.36Å; T421-A425 PolarHBondContact O-N 3.06Å
422	L	92.3	Very high	91.6	Very high	36 Å²	36	11.4 Å²	11.4	19%	0.188	7%	0.068	C	C	.	.	H	α-helix	trans	-68.2	-37.9	-178.3	-64.8	172.5	0	0	0	111.8	F192 T221 L225 F243 F418 L426	F192-L422 HydrophobicContact CD1-CD2 4.5Å; F192-L422 HydrophobicContact CD2-CD1 4.35Å; F192-L422 HydrophobicContact CD2-CD2 4.04Å; F192-L422 HydrophobicContact CD2-CG 3.99Å; F192-L422 HydrophobicContact CE2-CD1 3.94Å; F192-L422 HydrophobicContact CE2-CD2 4.14Å; F192-L422 HydrophobicContact CE2-CG 4.08Å; F192-L422 HydrophobicContact CG-CD2 4.22Å; F192-L422 HydrophobicContact CZ-CD2 4.42Å; T221-L422 HydrophobicContact CG2-CD2 3.77Å; L225-L422 HydrophobicContact CD1-CD2 4.33Å; L225-L422 HydrophobicContact CD2-CD2 4.29Å; F243-L422 HydrophobicContact CZ-CB 4.37Å; F418-L422 HydrophobicContact CB-CD1 4.45Å; F418-L422 VanDerWaalsContact O-CB 3.23Å; F418-L422 WeakPolarHBondContact O-CB 3.17Å; F418-L422 VanDerWaalsContact O-CG 3.27Å; F418-L422 WeakPolarHBondContact O-CG 3.33Å; F418-L422 PolarHBondContact O-N 3.4Å; L422-L426 WeakPolarHBondContact O-CB 3.31Å; L422-L426 PolarHBondContact O-N 2.98Å
423	S	90.7	Very high	91.5	Very high	2 Å²	2	9.4 Å²	9.4	1%	0.014	6%	0.058	C	C	.	.	H	α-helix	trans	-66.6	-45.5	177.9	64.3	0	0	0	0	112.5	G419 A420 L426 A427	G419-S423 WeakPolarHBondContact O-CB 3.25Å; G419-S423 PolarHBondContact O-N 2.9Å; G419-S423 VanDerWaalsContact O-N 3.15Å; G419-S423 PolarHBondContact O-OG 3.33Å; A420-S423 PolarHBondContact O-OG 2.9Å; S423-L426 PolarHBondContact O-N 3.11Å; S423-A427 WeakPolarHBondContact O-CB 3.17Å; S423-A427 PolarHBondContact O-N 3.42Å
424	S	91.5	Very high	91.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-65.9	-42.7	177.4	-62.3	0	0	0	0	111.9	L102 A420 A427 C428	L102-S424 PolarHBondContact O-OG 2.93Å; A420-S424 WeakPolarHBondContact O-CB 3.4Å; A420-S424 PolarHBondContact O-N 3.23Å; A420-S424 PolarHBondContact O-OG 3.09Å; S424-A427 PolarHBondContact O-N 3.44Å; S424-C428 WeakPolarHBondContact O-CB 3.38Å; S424-C428 PolarHBondContact O-N 3.37Å; S424-C428 PolarHBondContact O-SG 3.4Å; S424-C428 VanDerWaalsContact O-SG 3.34Å
425	A	93	Very high	91.1	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60.5	-47.1	175.9	0	0	0	0	0	111.4	H188 L225 T421 C428 L429	H188-A425 HydrophobicContact CB-CB 3.78Å; L225-A425 HydrophobicContact CD1-CB 3.71Å; T421-A425 VanDerWaalsContact O-CB 3.24Å; T421-A425 WeakPolarHBondContact O-CB 3.36Å; T421-A425 PolarHBondContact O-N 3.06Å; A425-C428 PolarHBondContact O-N 3.49Å; A425-L429 WeakPolarHBondContact O-CB 3.49Å; A425-L429 PolarHBondContact O-N 3.43Å
426	L	90.2	Very high	91	Very high	6 Å²	6	10.6 Å²	10.6	3%	0.031	6%	0.056	C	C	.	.	H	α-helix	trans	-63.2	-43	177.9	-175.4	65.1	0	0	0	111.7	L225 I228 E236 L422 S423 L429 V430	L225-L426 HydrophobicContact CD2-CB 4.42Å; L225-L426 HydrophobicContact CD2-CD1 4.44Å; I228-L426 HydrophobicContact CG2-CD1 4.14Å; I228-L426 HydrophobicContact CG2-CD2 4.44Å; E236-L426 HydrophobicContact CB-CD2 4.32Å; E236-L426 HydrophobicContact CG-CD2 3.99Å; E236-L426 HydrophobicContact CG-CG 4.23Å; L422-L426 WeakPolarHBondContact O-CB 3.31Å; L422-L426 PolarHBondContact O-N 2.98Å; S423-L426 PolarHBondContact O-N 3.11Å; L426-L429 PolarHBondContact O-N 3.27Å; L426-V430 WeakPolarHBondContact O-CG2 2.93Å; L426-V430 PolarHBondContact O-N 2.85Å
427	A	89.1	Confident	90.9	Very high	17 Å²	17	11.2 Å²	11.2	14%	0.14	6%	0.058	C	C	.	.	H	α-helix	trans	-62.1	-44.8	178.1	0	0	0	0	0	112	S423 S424 V430 S431	S423-A427 WeakPolarHBondContact O-CB 3.17Å; S423-A427 PolarHBondContact O-N 3.42Å; S424-A427 PolarHBondContact O-N 3.44Å; A427-V430 PolarHBondContact O-N 3.47Å; A427-S431 VanDerWaalsContact O-CB 3.26Å; A427-S431 WeakPolarHBondContact O-CB 3.44Å; A427-S431 PolarHBondContact O-N 3.48Å
428	C	91	Very high	90.6	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.014	7%	0.068	C	C	.	.	H	α-helix	trans	-67.6	-37.3	177.1	-68.6	0	0	0	0	112.2	A184 V185 S424 A425 V430 S431 A432	A184-C428 HydrophobicContact CB-CB 4.48Å; V185-C428 HydrophobicContact CG2-CB 3.65Å; S424-C428 WeakPolarHBondContact O-CB 3.38Å; S424-C428 PolarHBondContact O-N 3.37Å; S424-C428 PolarHBondContact O-SG 3.4Å; S424-C428 VanDerWaalsContact O-SG 3.34Å; A425-C428 PolarHBondContact O-N 3.49Å; C428-V430 VanDerWaalsContact C-N 3.3Å; C428-V430 PolarHBondContact O-N 2.71Å; C428-S431 PolarHBondContact O-N 3.04Å; C428-A432 PolarHBondContact O-N 3.49Å
429	L	91.1	Very high	90.3	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-66.9	-30	178.5	-172.8	62.8	0	0	0	112.5	V185 L225 L226 A425 L426 P433 Y465 T468	V185-L429 HydrophobicContact CG1-CB 4.48Å; V185-L429 HydrophobicContact CG1-CD1 4.35Å; V185-L429 HydrophobicContact CG2-CB 3.91Å; V185-L429 HydrophobicContact CG2-CD1 4.34Å; L225-L429 HydrophobicContact CB-CD2 3.88Å; L226-L429 HydrophobicContact CB-CD2 4.49Å; A425-L429 WeakPolarHBondContact O-CB 3.49Å; A425-L429 PolarHBondContact O-N 3.43Å; L426-L429 PolarHBondContact O-N 3.27Å; L429-P433 WeakPolarHBondContact O-CD 3.32Å; L429-P433 WeakPolarHBondContact O-CG 3.33Å; L429-Y465 WeakPolarHBondContact O-CE1 3.43Å; L429-T468 HydrophobicContact CD1-CG2 3.91Å
430	V	88.2	Confident	90.2	Very high	10 Å²	10	10 Å²	10	6%	0.061	6%	0.056	C	C	.	.	H	α-helix	trans	-83.3	-35.9	172.2	176	0	0	0	0	111.6	M233 L426 A427 C428 K434	M233-V430 HydrophobicContact SD-CG1 3.91Å; L426-V430 WeakPolarHBondContact O-CG2 2.93Å; L426-V430 PolarHBondContact O-N 2.85Å; A427-V430 PolarHBondContact O-N 3.47Å; C428-V430 VanDerWaalsContact C-N 3.3Å; C428-V430 PolarHBondContact O-N 2.71Å; V430-K434 HydrophobicContact CG1-CD 4.02Å; V430-K434 VanDerWaalsContact O-CG 3.32Å; V430-K434 WeakPolarHBondContact O-CG 3.45Å
431	S	87.7	Confident	89.8	Confident	11 Å²	11	14.7 Å²	14.7	8%	0.077	8%	0.077	C	C	.	.	H	α-helix	trans	-69	-49.5	-177.4	177.6	0	0	0	0	113.4	N181 N313 A427 C428 K434 V435	N181-S431 PolarHBondContact ND2-OG 3.25Å; N181-S431 VanDerWaalsContact ND2-OG 3.09Å; N313-S431 PolarHBondContact ND2-OG 3.48Å; A427-S431 VanDerWaalsContact O-CB 3.26Å; A427-S431 WeakPolarHBondContact O-CB 3.44Å; A427-S431 PolarHBondContact O-N 3.48Å; C428-S431 PolarHBondContact O-N 3.04Å; S431-K434 PolarHBondContact O-N 3.36Å; S431-V435 WeakPolarHBondContact O-CG2 3.43Å; S431-V435 PolarHBondContact O-N 2.97Å
432	A	91.4	Very high	89.3	Confident	1 Å²	1	16 Å²	16	1%	0.008	8%	0.083	C	C	.	.	H	α-helix	trans	-58.9	-48.8	-174	0	0	0	0	0	113	A178 N181 A182 C428 K434 F436 T468	A178-A432 WeakPolarHBondContact O-CB 3.38Å; N181-A432 HydrophobicContact CB-CB 3.74Å; A182-A432 HydrophobicContact CB-CB 4.29Å; C428-A432 PolarHBondContact O-N 3.49Å; A432-K434 VanDerWaalsContact C-N 3.35Å; A432-K434 PolarHBondContact O-N 3.43Å; A432-F436 WeakPolarHBondContact O-CB 3.24Å; A432-F436 PolarHBondContact O-N 2.9Å; A432-T468 HydrophobicContact CB-CG2 3.96Å
433	P	91.1	Very high	88.9	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.6	-35.9	178.2	-24.7	36.6	0	0	0	113.6	L429 F436 Q437 P461 A464 Y465 T468	L429-P433 WeakPolarHBondContact O-CD 3.32Å; L429-P433 WeakPolarHBondContact O-CG 3.33Å; P433-F436 PolarHBondContact O-N 3.47Å; P433-Q437 VanDerWaalsContact O-CB 3.24Å; P433-Q437 WeakPolarHBondContact O-CB 3.29Å; P433-Q437 PolarHBondContact O-N 3.2Å; P433-P461 HydrophobicContact CB-CG 3.99Å; P433-A464 HydrophobicContact CB-CB 3.79Å; P433-Y465 HydrophobicContact CB-CD1 4.06Å; P433-Y465 HydrophobicContact CB-CD2 4.31Å; P433-Y465 HydrophobicContact CB-CE1 4.19Å; P433-Y465 HydrophobicContact CB-CE2 4.46Å; P433-Y465 HydrophobicContact CB-CG 4.09Å; P433-Y465 HydrophobicContact CG-CD1 3.51Å; P433-Y465 HydrophobicContact CG-CE1 3.8Å; P433-Y465 HydrophobicContact CG-CG 3.93Å; P433-T468 HydrophobicContact CG-CG2 4.41Å; P433-T468 WeakPolarHBondContact CG-OG1 3.39Å
434	K	87.5	Confident	88.5	Confident	49 Å²	49	20.2 Å²	20.2	21%	0.213	10%	0.102	C	C	.	.	H	α-helix	trans	-72.2	-42.5	-178.6	-71.1	-171.8	179.6	-153.7	0	112	M233 V430 S431 A432 F436 Q437 C438 E460 Y465	M233-K434 HydrophobicContact SD-CD 4.38Å; M233-K434 PolarHBondContact SD-NZ 3.13Å; V430-K434 HydrophobicContact CG1-CD 4.02Å; V430-K434 VanDerWaalsContact O-CG 3.32Å; V430-K434 WeakPolarHBondContact O-CG 3.45Å; S431-K434 PolarHBondContact O-N 3.36Å; A432-K434 VanDerWaalsContact C-N 3.35Å; A432-K434 PolarHBondContact O-N 3.43Å; K434-F436 VanDerWaalsContact C-N 3.31Å; K434-F436 PolarHBondContact O-N 2.92Å; K434-Q437 PolarHBondContact O-N 3.01Å; K434-C438 PolarHBondContact O-N 3.49Å; K434-C438 VanDerWaalsContact O-N 3.09Å; K434-C438 PolarHBondContact O-SG 2.99Å; K434-E460 VanDerWaalsContact CE-OE2 3.29Å; K434-E460 WeakPolarHBondContact CE-OE2 3.49Å; K434-E460 IonicContact NZ-OE1 3.88Å; K434-E460 PolarHBondContact NZ-OE1 2.96Å; K434-E460 IonicContact NZ-OE2 2.87Å; K434-E460 PolarHBondContact NZ-OE2 3.22Å; K434-Y465 WeakPolarHBondContact CE-OH 3.42Å
435	V	89.2	Confident	88.1	Confident	8 Å²	8	21.1 Å²	21.1	5%	0.048	11%	0.105	C	C	.	.	H	α-helix	trans	-57.7	-48.4	170.3	170.2	0	0	0	0	109.8	G174 F177 A178 S431 Q437 C438 L439	G174-V435 WeakPolarHBondContact O-CG1 3.39Å; F177-V435 HydrophobicContact CD1-CG1 4.19Å; F177-V435 HydrophobicContact CD1-CG2 4.05Å; F177-V435 HydrophobicContact CE1-CG2 4.05Å; A178-V435 HydrophobicContact CB-CB 4.31Å; A178-V435 HydrophobicContact CB-CG1 3.86Å; S431-V435 WeakPolarHBondContact O-CG2 3.43Å; S431-V435 PolarHBondContact O-N 2.97Å; V435-Q437 PolarHBondContact O-N 3.14Å; V435-C438 PolarHBondContact O-N 3.49Å; V435-L439 PolarHBondContact O-N 2.77Å; V435-L439 VanDerWaalsContact O-N 3.11Å
436	F	90.4	Very high	87.3	Confident	21 Å²	21	24.5 Å²	24.5	9%	0.092	13%	0.127	C	C	.	.	H	α-helix	trans	-66	-38.1	-179	-164.3	-117.3	0	0	0	112.6	L175 A178 A432 P433 K434 L439 C440 I448 F451 A464 L467	L175-F436 HydrophobicContact CD1-CD2 4.07Å; L175-F436 HydrophobicContact CD1-CE2 3.55Å; A178-F436 HydrophobicContact CB-CB 4.23Å; A178-F436 HydrophobicContact CB-CD2 4.44Å; A432-F436 WeakPolarHBondContact O-CB 3.24Å; A432-F436 PolarHBondContact O-N 2.9Å; P433-F436 PolarHBondContact O-N 3.47Å; K434-F436 VanDerWaalsContact C-N 3.31Å; K434-F436 PolarHBondContact O-N 2.92Å; F436-L439 HydrophobicContact CD2-CD2 4.28Å; F436-L439 HydrophobicContact CE2-CD2 4.46Å; F436-L439 WeakPolarHBondContact O-CB 3.42Å; F436-L439 PolarHBondContact O-N 3.02Å; F436-C440 WeakPolarHBondContact O-CB 3.48Å; F436-C440 PolarHBondContact O-N 3.49Å; F436-C440 PolarHBondContact O-SG 3.23Å; F436-I448 HydrophobicContact CE2-CD1 4.48Å; F436-I448 HydrophobicContact CZ-CB 4.19Å; F436-I448 HydrophobicContact CZ-CG2 4.23Å; F436-F451 HydrophobicContact CD1-CB 3.97Å; F436-F451 HydrophobicContact CD1-CG 4.46Å; F436-F451 HydrophobicContact CE1-CB 3.54Å; F436-F451 HydrophobicContact CE1-CD1 4.37Å; F436-F451 AromaticContact CE1-CD2 3.83Å; F436-F451 HydrophobicContact CE1-CD2 3.83Å; F436-F451 AromaticContact CE1-CG 3.67Å; F436-F451 HydrophobicContact CE1-CG 3.67Å; F436-F451 HydrophobicContact CZ-CD2 4.32Å; F436-A464 HydrophobicContact CD1-CB 4.04Å; F436-L467 HydrophobicContact CD1-CD2 4.19Å; F436-L467 HydrophobicContact CE1-CD2 3.56Å; F436-L467 HydrophobicContact CZ-CD2 4.01Å
437	Q	90.3	Very high	86.9	Confident	13 Å²	13	32 Å²	32	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-47.9	176.5	-176.3	-170.5	26.3	0	0	111.6	P433 K434 V435 L439 C440 K441 H459 P461	P433-Q437 VanDerWaalsContact O-CB 3.24Å; P433-Q437 WeakPolarHBondContact O-CB 3.29Å; P433-Q437 PolarHBondContact O-N 3.2Å; K434-Q437 PolarHBondContact O-N 3.01Å; V435-Q437 PolarHBondContact O-N 3.14Å; Q437-L439 VanDerWaalsContact C-N 3.32Å; Q437-L439 PolarHBondContact O-N 3.35Å; Q437-C440 PolarHBondContact O-N 3.21Å; Q437-K441 HydrophobicContact CG-CD 4.43Å; Q437-K441 WeakPolarHBondContact O-CG 3.38Å; Q437-K441 PolarHBondContact O-N 2.99Å; Q437-H459 PolarHBondContact NE2-O 2.87Å; Q437-P461 HydrophobicContact CB-CB 3.73Å; Q437-P461 HydrophobicContact CB-CG 3.94Å; Q437-P461 HydrophobicContact CG-CB 3.75Å; Q437-P461 HydrophobicContact CG-CG 4.26Å
438	C	85.8	Confident	86.7	Confident	32 Å²	32	32.5 Å²	32.5	22%	0.216	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-42.7	178.2	-69.1	0	0	0	0	111.1	Y158 K434 V435 C440 K441 D442	Y158-C438 HydrophobicContact CD1-CB 3.5Å; Y158-C438 VanDerWaalsContact CD1-CB 3.5Å; Y158-C438 HydrophobicContact CE1-CB 3.92Å; K434-C438 PolarHBondContact O-N 3.49Å; K434-C438 VanDerWaalsContact O-N 3.09Å; K434-C438 PolarHBondContact O-SG 2.99Å; V435-C438 PolarHBondContact O-N 3.49Å; C438-C440 VanDerWaalsContact C-N 3.31Å; C438-C440 PolarHBondContact O-N 2.87Å; C438-K441 PolarHBondContact O-N 3.3Å; C438-D442 PolarHBondContact O-N 3.34Å
439	L	88.4	Confident	86.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.1	-42.5	174	-179.8	72.7	0	0	0	112.3	Y158 L175 V435 F436 Q437 D442 L444 Y445 I448	Y158-L439 HydrophobicContact CD2-CD1 4.44Å; Y158-L439 HydrophobicContact CE1-CB 4.29Å; Y158-L439 HydrophobicContact CE2-CB 4.25Å; Y158-L439 HydrophobicContact CE2-CD1 3.52Å; L175-L439 HydrophobicContact CB-CD2 3.89Å; L175-L439 HydrophobicContact CD1-CD2 3.81Å; L175-L439 HydrophobicContact CG-CD2 4.44Å; V435-L439 PolarHBondContact O-N 2.77Å; V435-L439 VanDerWaalsContact O-N 3.11Å; F436-L439 HydrophobicContact CD2-CD2 4.28Å; F436-L439 HydrophobicContact CE2-CD2 4.46Å; F436-L439 WeakPolarHBondContact O-CB 3.42Å; F436-L439 PolarHBondContact O-N 3.02Å; Q437-L439 VanDerWaalsContact C-N 3.32Å; Q437-L439 PolarHBondContact O-N 3.35Å; L439-D442 PolarHBondContact O-N 3.37Å; L439-L444 HydrophobicContact CD1-CD1 4.03Å; L439-Y445 HydrophobicContact CD1-CE2 4.3Å; L439-I448 HydrophobicContact CD2-CD1 3.95Å; L439-I448 HydrophobicContact CG-CD1 4.08Å
440	C	88.9	Confident	86.3	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-70.4	-32.5	-179.4	-66.9	0	0	0	0	113	F436 Q437 C438 D442 H443 I448 G452	F436-C440 WeakPolarHBondContact O-CB 3.48Å; F436-C440 PolarHBondContact O-N 3.49Å; F436-C440 PolarHBondContact O-SG 3.23Å; Q437-C440 PolarHBondContact O-N 3.21Å; C438-C440 VanDerWaalsContact C-N 3.31Å; C438-C440 PolarHBondContact O-N 2.87Å; C440-D442 VanDerWaalsContact C-N 3.26Å; C440-D442 PolarHBondContact O-N 3.32Å; C440-H443 PolarHBondContact O-N 3.5Å; C440-I448 PolarHBondContact SG-O 2.96Å; C440-G452 VanDerWaalsContact CB-CA 3.5Å
441	K	84.9	Confident	86.4	Confident	99 Å²	99	41.1 Å²	41.1	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-67.3	-27.6	175.8	-76.2	177.1	177.9	174.1	0	112.6	Q437 C438 H443	Q437-K441 HydrophobicContact CG-CD 4.43Å; Q437-K441 WeakPolarHBondContact O-CG 3.38Å; Q437-K441 PolarHBondContact O-N 2.99Å; C438-K441 PolarHBondContact O-N 3.3Å; K441-H443 PolarHBondContact O-CD2 3.41Å; K441-H443 VanDerWaalsContact O-CD2 3.3Å; K441-H443 PolarHBondContact O-N 3.21Å
442	D	82.3	Confident	86.2	Confident	27 Å²	27	41 Å²	41	14%	0.144	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-3.7	178.2	-67.9	-28.3	0	0	0	113.4	Y158 R163 C438 L439 C440 L444 W568	Y158-D442 WeakPolarHBondContact CE1-OD2 3.27Å; Y158-D442 VanDerWaalsContact CZ-OD2 3.27Å; Y158-D442 PolarHBondContact OH-OD2 3.35Å; R163-D442 IonicContact NH2-OD1 3.96Å; C438-D442 PolarHBondContact O-N 3.34Å; L439-D442 PolarHBondContact O-N 3.37Å; C440-D442 VanDerWaalsContact C-N 3.26Å; C440-D442 PolarHBondContact O-N 3.32Å; D442-L444 HydrophobicContact CB-CD1 4.42Å; D442-L444 HydrophobicContact CB-CG 3.99Å; D442-L444 PolarHBondContact O-N 3.35Å; D442-W568 HydrophobicContact CB-CH2 3.62Å; D442-W568 HydrophobicContact CB-CZ2 3.93Å; D442-W568 VanDerWaalsContact CG-CZ2 3.42Å; D442-W568 WeakPolarHBondContact OD1-CZ2 3.43Å; D442-W568 WeakPolarHBondContact OD2-CH2 3.45Å
443	H	83.6	Confident	86	Confident	125 Å²	125	46.8 Å²	46.8	58%	0.579	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	25.6	176.8	-63.8	-61.8	0	0	0	115.5	C440 K441 Y445	C440-H443 PolarHBondContact O-N 3.5Å; K441-H443 PolarHBondContact O-CD2 3.41Å; K441-H443 VanDerWaalsContact O-CD2 3.3Å; K441-H443 PolarHBondContact O-N 3.21Å; H443-Y445 VanDerWaalsContact C-N 3.32Å; H443-Y445 PolarHBondContact O-N 3.29Å
444	L	82.7	Confident	85.9	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.245	C	C	.	.	S	Bend	trans	-60.7	-42.9	178.4	-62.1	179.2	0	0	0	111.3	Y158 P167 L439 D442 P564 W568	Y158-L444 WeakPolarHBondContact OH-CD1 3.47Å; P167-L444 HydrophobicContact CB-CD1 4.49Å; P167-L444 HydrophobicContact CB-CD2 3.73Å; L439-L444 HydrophobicContact CD1-CD1 4.03Å; D442-L444 HydrophobicContact CB-CD1 4.42Å; D442-L444 HydrophobicContact CB-CG 3.99Å; D442-L444 PolarHBondContact O-N 3.35Å; L444-P564 HydrophobicContact CD2-CB 4.33Å; L444-P564 HydrophobicContact CD2-CG 3.99Å; L444-W568 HydrophobicContact CD1-CH2 4.38Å; L444-W568 HydrophobicContact CD1-CZ3 4.42Å; L444-W568 HydrophobicContact CD2-CH2 4.35Å
445	Y	84.5	Confident	85.7	Confident	19 Å²	19	49.3 Å²	49.3	8%	0.075	25%	0.25	C	S	.	.	S	Bend	trans	-111.8	125.8	174.2	-50.2	-78.6	0	0	0	109.6	L439 H443 L447 I448 L555 Y558 T559	L439-Y445 HydrophobicContact CD1-CE2 4.3Å; H443-Y445 VanDerWaalsContact C-N 3.32Å; H443-Y445 PolarHBondContact O-N 3.29Å; Y445-L447 PolarHBondContact O-N 3.19Å; Y445-I448 HydrophobicContact CD2-CD1 3.67Å; Y445-I448 HydrophobicContact CG-CD1 4.19Å; Y445-I448 WeakPolarHBondContact O-CG1 3.39Å; Y445-L555 HydrophobicContact CD1-CD2 4.41Å; Y445-L555 HydrophobicContact CE1-CB 4.49Å; Y445-L555 HydrophobicContact CE1-CD2 3.65Å; Y445-Y558 AromaticContact CD1-CD1 3.61Å; Y445-Y558 HydrophobicContact CD1-CD1 3.61Å; Y445-Y558 AromaticContact CD1-CE1 3.79Å; Y445-Y558 HydrophobicContact CD1-CE1 3.79Å; Y445-Y558 AromaticContact CE1-CD1 3.82Å; Y445-Y558 HydrophobicContact CE1-CD1 3.82Å; Y445-Y558 HydrophobicContact CE1-CE1 4.43Å; Y445-T559 HydrophobicContact CE1-CG2 3.87Å
446	P	74.9	Confident	85.4	Confident	72 Å²	72	52.1 Å²	52.1	47%	0.468	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-33.5	-169.7	26.1	-33.7	0	0	0	113.4	I448 Y558	P446-I448 PolarHBondContact O-N 3.39Å; P446-Y558 WeakPolarHBondContact CD-OH 3.4Å; P446-Y558 WeakPolarHBondContact CG-OH 3.04Å
447	L	81.1	Confident	84.6	Confident	162 Å²	162	60.9 Å²	60.9	85%	0.848	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-24.6	-174.7	-68.1	169	0	0	0	113.2	Y445	Y445-L447 PolarHBondContact O-N 3.19Å
448	I	86.8	Confident	83.8	Confident	29 Å²	29	66 Å²	66	15%	0.149	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-9.5	-174.2	68.3	177.2	0	0	0	113.4	F436 L439 C440 Y445 P446 F450 F451	F436-I448 HydrophobicContact CE2-CD1 4.48Å; F436-I448 HydrophobicContact CZ-CB 4.19Å; F436-I448 HydrophobicContact CZ-CG2 4.23Å; L439-I448 HydrophobicContact CD2-CD1 3.95Å; L439-I448 HydrophobicContact CG-CD1 4.08Å; C440-I448 PolarHBondContact SG-O 2.96Å; Y445-I448 HydrophobicContact CD2-CD1 3.67Å; Y445-I448 HydrophobicContact CG-CD1 4.19Å; Y445-I448 WeakPolarHBondContact O-CG1 3.39Å; P446-I448 PolarHBondContact O-N 3.39Å; I448-F450 PolarHBondContact O-N 3.33Å; I448-F451 PolarHBondContact O-N 3.01Å
449	G	83.6	Confident	83.5	Confident	21 Å²	21	70.2 Å²	70.2	22%	0.216	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-54.7	-27	-177.6	0	0	0	0	0	114.1	F451 G452	G449-F451 PolarHBondContact O-N 3.48Å; G449-G452 PolarHBondContact O-N 3.06Å; G449-G452 VanDerWaalsContact O-N 3.13Å
450	F	88.4	Confident	83.4	Confident	120 Å²	120	71.5 Å²	71.5	53%	0.526	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-55.1	-33.5	174.4	177.8	-96.6	0	0	0	114.1	I448 R463	I448-F450 PolarHBondContact O-N 3.33Å; F450-R463 HydrophobicContact CE1-CG 4.38Å; F450-R463 VanDerWaalsContact O-CD 3.31Å; F450-R463 WeakPolarHBondContact O-CD 3.25Å; F450-R463 PolarHBondContact O-NH1 2.95Å
451	F	90.5	Very high	83.4	Confident	52 Å²	52	71.4 Å²	71.4	23%	0.228	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-84	-10.4	-178	-64.1	-80.6	0	0	0	113.6	F436 I448 G449 K453 R463 L467	F436-F451 HydrophobicContact CD1-CB 3.97Å; F436-F451 HydrophobicContact CD1-CG 4.46Å; F436-F451 HydrophobicContact CE1-CB 3.54Å; F436-F451 HydrophobicContact CE1-CD1 4.37Å; F436-F451 AromaticContact CE1-CD2 3.83Å; F436-F451 HydrophobicContact CE1-CD2 3.83Å; F436-F451 AromaticContact CE1-CG 3.67Å; F436-F451 HydrophobicContact CE1-CG 3.67Å; F436-F451 HydrophobicContact CZ-CD2 4.32Å; I448-F451 PolarHBondContact O-N 3.01Å; G449-F451 PolarHBondContact O-N 3.48Å; F451-K453 VanDerWaalsContact C-N 3.35Å; F451-K453 PolarHBondContact O-N 3.41Å; F451-R463 HydrophobicContact CD1-CB 3.94Å; F451-L467 HydrophobicContact CD1-CB 4.41Å; F451-L467 HydrophobicContact CD1-CD2 4.25Å; F451-L467 HydrophobicContact CE1-CB 4.09Å; F451-L467 HydrophobicContact CE1-CD2 4.06Å; F451-L467 HydrophobicContact CE1-CG 4.48Å; F451-L467 HydrophobicContact CZ-CD2 4.2Å
452	G	84.6	Confident	83.6	Confident	7 Å²	7	69.9 Å²	69.9	7%	0.072	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-78.7	-12.2	-178.8	0	0	0	0	0	115.1	C440 G449 G454	C440-G452 VanDerWaalsContact CB-CA 3.5Å; G449-G452 PolarHBondContact O-N 3.06Å; G449-G452 VanDerWaalsContact O-N 3.13Å; G452-G454 PolarHBondContact O-N 3.46Å
453	K	87.4	Confident	84	Confident	123 Å²	123	71.8 Å²	71.8	54%	0.535	37%	0.37	S	S	.	.			trans	-67.2	115.4	-177.6	-168.4	173.4	-176.1	174.8	0	110.7	F451 Y455	F451-K453 VanDerWaalsContact C-N 3.35Å; F451-K453 PolarHBondContact O-N 3.41Å; K453-Y455 HydrophobicContact CB-CE2 4.27Å; K453-Y455 HydrophobicContact CD-CE2 4.45Å; K453-Y455 HydrophobicContact CG-CE2 4.17Å; K453-Y455 WeakPolarHBondContact O-CD2 3.22Å; K453-Y455 WeakPolarHBondContact O-CE2 3.5Å
454	G	87.8	Confident	84.4	Confident	23 Å²	23	65.9 Å²	65.9	24%	0.237	34%	0.342	C	S	.	.			trans	-81.3	147.3	172.6	0	0	0	0	0	111.8	G452	G452-G454 PolarHBondContact O-N 3.46Å
455	Y	84.8	Confident	84.9	Confident	80 Å²	80	65.9 Å²	65.9	31%	0.314	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-123.6	150.1	178.6	-67.4	-98.2	0	0	0	110.8	K453 E460 L462 R463	K453-Y455 HydrophobicContact CB-CE2 4.27Å; K453-Y455 HydrophobicContact CD-CE2 4.45Å; K453-Y455 HydrophobicContact CG-CE2 4.17Å; K453-Y455 WeakPolarHBondContact O-CD2 3.22Å; K453-Y455 WeakPolarHBondContact O-CE2 3.5Å; Y455-E460 PolarHBondContact N-O 3.48Å; Y455-E460 PolarHBondContact O-N 3.09Å; Y455-L462 HydrophobicContact CD1-CD1 4.43Å; Y455-L462 HydrophobicContact CD2-CB 4.06Å; Y455-L462 HydrophobicContact CD2-CD1 4.21Å; Y455-L462 HydrophobicContact CD2-CG 4.17Å; Y455-L462 HydrophobicContact CG-CD1 3.89Å; Y455-L462 HydrophobicContact CG-CG 4.25Å; Y455-R463 HydrophobicContact CE2-CG 4.27Å; Y455-R463 VanDerWaalsContact OH-CZ 3.24Å; Y455-R463 PolarHBondContact OH-NE 3.44Å; Y455-R463 PolarHBondContact OH-NH2 3.1Å
456	G	81.4	Confident	85.3	Confident	67 Å²	67	69.6 Å²	69.6	69%	0.691	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	-177.2	179.2	0	0	0	0	0	114.4	N458 H459	G456-N458 VanDerWaalsContact C-N 3.29Å; G456-N458 PolarHBondContact O-N 3.33Å; G456-H459 PolarHBondContact O-N 2.89Å
457	K	74.3	Confident	86.3	Confident	205 Å²	205	68.4 Å²	68.4	89%	0.891	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-32.3	-176.3	-66.8	-178.9	174.5	179.3	0	113.1
458	N	72.4	Confident	86.9	Confident	120 Å²	120	61 Å²	61	64%	0.642	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	8.6	-177.4	-63.7	-7.6	0	0	0	113.8	G456 E460	G456-N458 VanDerWaalsContact C-N 3.29Å; G456-N458 PolarHBondContact O-N 3.33Å; N458-E460 VanDerWaalsContact C-N 3.31Å; N458-E460 HydrophobicContact CB-CG 4.18Å; N458-E460 PolarHBondContact O-N 3.45Å
459	H	81.2	Confident	87.3	Confident	120 Å²	120	62 Å²	62	56%	0.556	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	39.6	-179	-64.3	75.1	0	0	0	114.4	Q437 G456	Q437-H459 PolarHBondContact NE2-O 2.87Å; G456-H459 PolarHBondContact O-N 2.89Å
460	E	84.4	Confident	87.9	Confident	27 Å²	27	65.1 Å²	65.1	13%	0.126	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-73.1	135.8	-176.4	-72.5	-71.2	163.6	0	0	111.9	K434 Y455 N458 L462 Y465	K434-E460 VanDerWaalsContact CE-OE2 3.29Å; K434-E460 WeakPolarHBondContact CE-OE2 3.49Å; K434-E460 IonicContact NZ-OE1 3.88Å; K434-E460 PolarHBondContact NZ-OE1 2.96Å; K434-E460 IonicContact NZ-OE2 2.87Å; K434-E460 PolarHBondContact NZ-OE2 3.22Å; Y455-E460 PolarHBondContact N-O 3.48Å; Y455-E460 PolarHBondContact O-N 3.09Å; N458-E460 VanDerWaalsContact C-N 3.31Å; N458-E460 HydrophobicContact CB-CG 4.18Å; N458-E460 PolarHBondContact O-N 3.45Å; E460-L462 PolarHBondContact O-N 2.62Å; E460-L462 VanDerWaalsContact O-N 3.11Å; E460-Y465 HydrophobicContact CB-CE2 4.49Å; E460-Y465 WeakPolarHBondContact OE2-CE2 3.44Å; E460-Y465 PolarHBondContact OE2-OH 2.95Å
461	P	89.4	Confident	88.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.311	C	S	.	.			trans	-86.6	74.4	-173.8	33.9	-36.9	0	0	0	113.6	P433 Q437 R463 A464 Y465	P433-P461 HydrophobicContact CB-CG 3.99Å; Q437-P461 HydrophobicContact CB-CB 3.73Å; Q437-P461 HydrophobicContact CB-CG 3.94Å; Q437-P461 HydrophobicContact CG-CB 3.75Å; Q437-P461 HydrophobicContact CG-CG 4.26Å; P461-R463 PolarHBondContact O-N 3.44Å; P461-R463 VanDerWaalsContact O-N 3.12Å; P461-A464 HydrophobicContact CB-CB 3.96Å; P461-A464 HydrophobicContact CG-CB 4.43Å; P461-A464 PolarHBondContact O-N 3.37Å; P461-Y465 HydrophobicContact CG-CD2 4.26Å; P461-Y465 HydrophobicContact CG-CE2 4.02Å; P461-Y465 VanDerWaalsContact O-CD2 3.24Å; P461-Y465 WeakPolarHBondContact O-CD2 3.4Å; P461-Y465 PolarHBondContact O-N 3.39Å
462	L	89.3	Confident	88.5	Confident	66 Å²	66	58.7 Å²	58.7	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-51.9	-39	-177.6	-64.3	-178.3	0	0	0	114.1	M230 Y455 E460 Y465 L466	M230-L462 HydrophobicContact CE-CD2 3.94Å; M230-L462 HydrophobicContact CG-CD2 4.29Å; Y455-L462 HydrophobicContact CD1-CD1 4.43Å; Y455-L462 HydrophobicContact CD2-CB 4.06Å; Y455-L462 HydrophobicContact CD2-CD1 4.21Å; Y455-L462 HydrophobicContact CD2-CG 4.17Å; Y455-L462 HydrophobicContact CG-CD1 3.89Å; Y455-L462 HydrophobicContact CG-CG 4.25Å; E460-L462 PolarHBondContact O-N 2.62Å; E460-L462 VanDerWaalsContact O-N 3.11Å; L462-Y465 PolarHBondContact O-N 2.76Å; L462-L466 PolarHBondContact O-N 3.1Å
463	R	91.5	Very high	89.1	Confident	68 Å²	68	59 Å²	59	26%	0.257	30%	0.302	S	S	.	.	H	α-helix	trans	-67.5	-36.9	178.9	-65.9	173.9	175.8	-177.6	-6.7	112.8	F450 F451 Y455 P461 L466 L467	F450-R463 HydrophobicContact CE1-CG 4.38Å; F450-R463 VanDerWaalsContact O-CD 3.31Å; F450-R463 WeakPolarHBondContact O-CD 3.25Å; F450-R463 PolarHBondContact O-NH1 2.95Å; F451-R463 HydrophobicContact CD1-CB 3.94Å; Y455-R463 HydrophobicContact CE2-CG 4.27Å; Y455-R463 VanDerWaalsContact OH-CZ 3.24Å; Y455-R463 PolarHBondContact OH-NE 3.44Å; Y455-R463 PolarHBondContact OH-NH2 3.1Å; P461-R463 PolarHBondContact O-N 3.44Å; P461-R463 VanDerWaalsContact O-N 3.12Å; R463-L466 PolarHBondContact O-N 3.02Å; R463-L467 PolarHBondContact O-N 2.64Å
464	A	92.3	Very high	89.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-75.8	-33	178.1	0	0	0	0	0	111.6	P433 F436 P461 L467 T468	P433-A464 HydrophobicContact CB-CB 3.79Å; F436-A464 HydrophobicContact CD1-CB 4.04Å; P461-A464 HydrophobicContact CB-CB 3.96Å; P461-A464 HydrophobicContact CG-CB 4.43Å; P461-A464 PolarHBondContact O-N 3.37Å; A464-L467 PolarHBondContact O-N 3.37Å; A464-T468 WeakPolarHBondContact O-CB 3.17Å; A464-T468 PolarHBondContact O-N 3.02Å; A464-T468 PolarHBondContact O-OG1 2.98Å
465	Y	92.6	Very high	89.8	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-46.6	168.5	-79	-71.7	0	0	0	111	L226 L429 P433 K434 E460 P461 L462 L467 T468 Y469	L226-Y465 HydrophobicContact CD1-CD1 4.46Å; L429-Y465 WeakPolarHBondContact O-CE1 3.43Å; P433-Y465 HydrophobicContact CB-CD1 4.06Å; P433-Y465 HydrophobicContact CB-CD2 4.31Å; P433-Y465 HydrophobicContact CB-CE1 4.19Å; P433-Y465 HydrophobicContact CB-CE2 4.46Å; P433-Y465 HydrophobicContact CB-CG 4.09Å; P433-Y465 HydrophobicContact CG-CD1 3.51Å; P433-Y465 HydrophobicContact CG-CE1 3.8Å; P433-Y465 HydrophobicContact CG-CG 3.93Å; K434-Y465 WeakPolarHBondContact CE-OH 3.42Å; E460-Y465 HydrophobicContact CB-CE2 4.49Å; E460-Y465 WeakPolarHBondContact OE2-CE2 3.44Å; E460-Y465 PolarHBondContact OE2-OH 2.95Å; P461-Y465 HydrophobicContact CG-CD2 4.26Å; P461-Y465 HydrophobicContact CG-CE2 4.02Å; P461-Y465 VanDerWaalsContact O-CD2 3.24Å; P461-Y465 WeakPolarHBondContact O-CD2 3.4Å; P461-Y465 PolarHBondContact O-N 3.39Å; L462-Y465 PolarHBondContact O-N 2.76Å; Y465-L467 PolarHBondContact O-N 2.78Å; Y465-T468 PolarHBondContact O-N 3.33Å; Y465-Y469 WeakPolarHBondContact O-CB 3.33Å; Y465-Y469 PolarHBondContact O-N 3.12Å
466	L	93.4	Very high	90.4	Very high	96 Å²	96	53.6 Å²	53.6	50%	0.503	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-42.7	177	-174.2	65.9	0	0	0	112.2	L462 R463 T468 Y469 I470	L462-L466 PolarHBondContact O-N 3.1Å; R463-L466 PolarHBondContact O-N 3.02Å; L466-T468 PolarHBondContact O-N 3.45Å; L466-Y469 HydrophobicContact CD1-CD1 4.47Å; L466-Y469 PolarHBondContact O-N 3.39Å; L466-I470 HydrophobicContact CG-CD1 4.17Å; L466-I470 VanDerWaalsContact O-CG1 3.31Å; L466-I470 WeakPolarHBondContact O-CG1 3.21Å; L466-I470 PolarHBondContact O-N 2.97Å
467	L	94.1	Very high	91	Very high	48 Å²	48	54.9 Å²	54.9	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-60.6	-45.4	175.4	179.7	63.6	0	0	0	111.7	F436 F451 R463 A464 Y465 Y469 I470 I471	F436-L467 HydrophobicContact CD1-CD2 4.19Å; F436-L467 HydrophobicContact CE1-CD2 3.56Å; F436-L467 HydrophobicContact CZ-CD2 4.01Å; F451-L467 HydrophobicContact CD1-CB 4.41Å; F451-L467 HydrophobicContact CD1-CD2 4.25Å; F451-L467 HydrophobicContact CE1-CB 4.09Å; F451-L467 HydrophobicContact CE1-CD2 4.06Å; F451-L467 HydrophobicContact CE1-CG 4.48Å; F451-L467 HydrophobicContact CZ-CD2 4.2Å; R463-L467 PolarHBondContact O-N 2.64Å; A464-L467 PolarHBondContact O-N 3.37Å; Y465-L467 PolarHBondContact O-N 2.78Å; L467-Y469 VanDerWaalsContact C-N 3.34Å; L467-Y469 PolarHBondContact O-N 2.83Å; L467-I470 PolarHBondContact O-N 3.42Å; L467-I471 HydrophobicContact CD1-CD1 4.25Å; L467-I471 HydrophobicContact CG-CD1 4.06Å; L467-I471 WeakPolarHBondContact O-CG1 3.28Å; L467-I471 PolarHBondContact O-N 2.97Å
468	T	94.8	Very high	92	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-41.9	178.2	-57.7	0	0	0	0	111	A182 L429 A432 P433 A464 Y465 L466 I471 A472	A182-T468 HydrophobicContact CB-CG2 3.84Å; L429-T468 HydrophobicContact CD1-CG2 3.91Å; A432-T468 HydrophobicContact CB-CG2 3.96Å; P433-T468 HydrophobicContact CG-CG2 4.41Å; P433-T468 WeakPolarHBondContact CG-OG1 3.39Å; A464-T468 WeakPolarHBondContact O-CB 3.17Å; A464-T468 PolarHBondContact O-N 3.02Å; A464-T468 PolarHBondContact O-OG1 2.98Å; Y465-T468 PolarHBondContact O-N 3.33Å; L466-T468 PolarHBondContact O-N 3.45Å; T468-I471 PolarHBondContact O-N 3.36Å; T468-A472 WeakPolarHBondContact O-CB 3.37Å; T468-A472 PolarHBondContact O-N 3.35Å
469	Y	95.4	Very high	92.9	Very high	49 Å²	49	43.1 Å²	43.1	19%	0.192	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-45.6	174.3	169.4	-93.6	0	0	0	112.1	V222 T223 L226 Y465 L466 L467 I471 A472 A473	V222-Y469 HydrophobicContact CG1-CD2 4.18Å; V222-Y469 HydrophobicContact CG1-CE2 3.79Å; V222-Y469 HydrophobicContact CG2-CD2 4.27Å; T223-Y469 PolarHBondContact OG1-OH 3.18Å; L226-Y469 HydrophobicContact CB-CD2 4.4Å; L226-Y469 HydrophobicContact CD2-CD2 3.79Å; L226-Y469 HydrophobicContact CD2-CE2 4.38Å; L226-Y469 HydrophobicContact CD2-CG 3.88Å; Y465-Y469 WeakPolarHBondContact O-CB 3.33Å; Y465-Y469 PolarHBondContact O-N 3.12Å; L466-Y469 HydrophobicContact CD1-CD1 4.47Å; L466-Y469 PolarHBondContact O-N 3.39Å; L467-Y469 VanDerWaalsContact C-N 3.34Å; L467-Y469 PolarHBondContact O-N 2.83Å; Y469-I471 PolarHBondContact O-N 2.92Å; Y469-A472 PolarHBondContact O-N 3.48Å; Y469-A473 VanDerWaalsContact O-CB 3.28Å; Y469-A473 WeakPolarHBondContact O-CB 3.23Å; Y469-A473 PolarHBondContact O-N 2.98Å
470	I	96.1	Very high	93.4	Very high	87 Å²	87	42.7 Å²	42.7	45%	0.446	22%	0.218	S	C	.	.	H	α-helix	trans	-62.2	-45.1	178.4	-68.6	165.6	0	0	0	110.6	L466 L467 A473 C474	L466-I470 HydrophobicContact CG-CD1 4.17Å; L466-I470 VanDerWaalsContact O-CG1 3.31Å; L466-I470 WeakPolarHBondContact O-CG1 3.21Å; L466-I470 PolarHBondContact O-N 2.97Å; L467-I470 PolarHBondContact O-N 3.42Å; I470-A473 PolarHBondContact O-N 3.31Å; I470-C474 PolarHBondContact O-N 2.71Å; I470-C474 PolarHBondContact O-SG 3.34Å
471	I	95.9	Very high	93.5	Very high	37 Å²	37	41.6 Å²	41.6	19%	0.19	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-49.5	177	-66.1	167.2	0	0	0	109.9	F179 A182 V183 L467 T468 Y469 A473 C474 F475	F179-I471 HydrophobicContact CD2-CD1 4.45Å; F179-I471 HydrophobicContact CE2-CG2 4.22Å; A182-I471 HydrophobicContact CB-CB 4.33Å; A182-I471 HydrophobicContact CB-CD1 4.43Å; A182-I471 HydrophobicContact CB-CG2 3.97Å; V183-I471 HydrophobicContact CG2-CG2 4.26Å; L467-I471 HydrophobicContact CD1-CD1 4.25Å; L467-I471 HydrophobicContact CG-CD1 4.06Å; L467-I471 WeakPolarHBondContact O-CG1 3.28Å; L467-I471 PolarHBondContact O-N 2.97Å; T468-I471 PolarHBondContact O-N 3.36Å; Y469-I471 PolarHBondContact O-N 2.92Å; I471-A473 VanDerWaalsContact C-N 3.34Å; I471-A473 PolarHBondContact O-N 3.45Å; I471-C474 WeakPolarHBondContact O-CB 3.35Å; I471-C474 PolarHBondContact O-N 3.47Å; I471-F475 HydrophobicContact CG2-CD2 4.26Å; I471-F475 HydrophobicContact CG2-CE2 4.32Å; I471-F475 WeakPolarHBondContact O-CD2 3.48Å; I471-F475 PolarHBondContact O-N 2.99Å
472	A	95.9	Very high	93.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-44.2	179.1	0	0	0	0	0	111.7	V185 A186 V222 T468 Y469 C474 F475 I476	V185-A472 HydrophobicContact CB-CB 4.07Å; V185-A472 HydrophobicContact CG1-CB 3.96Å; A186-A472 HydrophobicContact CB-CB 4.46Å; A186-A472 WeakPolarHBondContact CB-O 3.22Å; V222-A472 HydrophobicContact CG2-CB 4.39Å; T468-A472 WeakPolarHBondContact O-CB 3.37Å; T468-A472 PolarHBondContact O-N 3.35Å; Y469-A472 PolarHBondContact O-N 3.48Å; A472-C474 VanDerWaalsContact C-N 3.33Å; A472-C474 PolarHBondContact O-N 3.31Å; A472-F475 PolarHBondContact O-N 3.4Å; A472-I476 VanDerWaalsContact O-CG1 3.25Å; A472-I476 WeakPolarHBondContact O-CG1 3.27Å; A472-I476 PolarHBondContact O-N 3.3Å
473	A	96.1	Very high	93.6	Very high	14 Å²	14	40.8 Å²	40.8	12%	0.116	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-40.8	177.5	0	0	0	0	0	112.4	I219 Y469 I470 I471 F475 I476 I477	I219-A473 HydrophobicContact CD1-CB 3.8Å; Y469-A473 VanDerWaalsContact O-CB 3.28Å; Y469-A473 WeakPolarHBondContact O-CB 3.23Å; Y469-A473 PolarHBondContact O-N 2.98Å; I470-A473 PolarHBondContact O-N 3.31Å; I471-A473 VanDerWaalsContact C-N 3.34Å; I471-A473 PolarHBondContact O-N 3.45Å; A473-F475 VanDerWaalsContact C-N 3.32Å; A473-F475 PolarHBondContact O-N 2.99Å; A473-I476 PolarHBondContact O-N 3.01Å; A473-I477 WeakPolarHBondContact O-CG1 3.23Å; A473-I477 PolarHBondContact O-N 3.11Å
474	C	95.9	Very high	93.5	Very high	75 Å²	75	37.5 Å²	37.5	51%	0.507	20%	0.202	S	C	.	.	H	α-helix	trans	-60.1	-41.1	176.3	-66.6	0	0	0	0	112.2	I470 I471 A472	I470-C474 PolarHBondContact O-N 2.71Å; I470-C474 PolarHBondContact O-SG 3.34Å; I471-C474 WeakPolarHBondContact O-CB 3.35Å; I471-C474 PolarHBondContact O-N 3.47Å; A472-C474 VanDerWaalsContact C-N 3.33Å; A472-C474 PolarHBondContact O-N 3.31Å
475	F	95.2	Very high	93.4	Very high	36 Å²	36	37.6 Å²	37.6	16%	0.158	20%	0.202	C	C	.	.	H	α-helix	trans	-77.1	-30.8	177.7	-80.7	-87.6	0	0	0	113	F179 V183 A186 I471 A472 A473 I477 I478 I484 I487	F179-F475 HydrophobicContact CZ-CE2 4.36Å; V183-F475 HydrophobicContact CG1-CD1 3.8Å; V183-F475 HydrophobicContact CG1-CD2 4.1Å; V183-F475 HydrophobicContact CG1-CE1 3.9Å; V183-F475 HydrophobicContact CG1-CE2 4.2Å; V183-F475 HydrophobicContact CG1-CG 3.9Å; V183-F475 HydrophobicContact CG1-CZ 4.11Å; V183-F475 HydrophobicContact CG2-CD2 3.98Å; V183-F475 HydrophobicContact CG2-CE2 3.63Å; V183-F475 HydrophobicContact CG2-CZ 3.97Å; A186-F475 HydrophobicContact CB-CB 3.45Å; A186-F475 VanDerWaalsContact CB-CB 3.45Å; I471-F475 HydrophobicContact CG2-CD2 4.26Å; I471-F475 HydrophobicContact CG2-CE2 4.32Å; I471-F475 WeakPolarHBondContact O-CD2 3.48Å; I471-F475 PolarHBondContact O-N 2.99Å; A472-F475 PolarHBondContact O-N 3.4Å; A473-F475 VanDerWaalsContact C-N 3.32Å; A473-F475 PolarHBondContact O-N 2.99Å; F475-I477 PolarHBondContact O-N 2.96Å; F475-I478 HydrophobicContact CD1-CD1 3.86Å; F475-I478 HydrophobicContact CE1-CD1 4.44Å; F475-I478 WeakPolarHBondContact O-CB 3.22Å; F475-I478 PolarHBondContact O-N 3.03Å; F475-I484 WeakPolarHBondContact O-CD1 3.43Å; F475-I487 HydrophobicContact CE1-CD1 4Å; F475-I487 HydrophobicContact CE1-CG2 4.12Å; F475-I487 HydrophobicContact CZ-CG2 4.47Å
476	I	95.8	Very high	93.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-34.6	174.3	-71.7	164.4	0	0	0	111.1	A186 T189 V190 I219 V222 A472 A473 I478 A479	A186-I476 HydrophobicContact CB-CG1 3.83Å; T189-I476 HydrophobicContact CG2-CD1 4.04Å; V190-I476 HydrophobicContact CG2-CB 4.37Å; V190-I476 HydrophobicContact CG2-CG1 4.16Å; V190-I476 HydrophobicContact CG2-CG2 4.4Å; I219-I476 HydrophobicContact CD1-CB 4.37Å; I219-I476 HydrophobicContact CD1-CG2 4.07Å; I219-I476 HydrophobicContact CG1-CG2 4.21Å; V222-I476 HydrophobicContact CB-CD1 3.86Å; V222-I476 HydrophobicContact CG1-CD1 3.69Å; V222-I476 HydrophobicContact CG2-CD1 4.26Å; A472-I476 VanDerWaalsContact O-CG1 3.25Å; A472-I476 WeakPolarHBondContact O-CG1 3.27Å; A472-I476 PolarHBondContact O-N 3.3Å; A473-I476 PolarHBondContact O-N 3.01Å; I476-I478 PolarHBondContact O-N 3.38Å; I476-A479 WeakPolarHBondContact O-CA 3.49Å; I476-A479 PolarHBondContact O-N 3.5Å
477	I	95.1	Very high	93	Very high	94 Å²	94	36.6 Å²	36.6	48%	0.482	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.2	179.1	-68.8	163.8	0	0	0	112.4	R215 A473 F475 A479	R215-I477 PolarHBondContact NE-O 2.63Å; R215-I477 PolarHBondContact NH2-O 3.33Å; R215-I477 VanDerWaalsContact NH2-O 3.16Å; A473-I477 WeakPolarHBondContact O-CG1 3.23Å; A473-I477 PolarHBondContact O-N 3.11Å; F475-I477 PolarHBondContact O-N 2.96Å; I477-A479 PolarHBondContact O-N 3.45Å
478	I	94.5	Very high	92.9	Very high	70 Å²	70	34.3 Å²	34.3	36%	0.359	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-37.7	174.3	-58.1	173	0	0	0	110.2	F475 I476 E480 A483 I484	F475-I478 HydrophobicContact CD1-CD1 3.86Å; F475-I478 HydrophobicContact CE1-CD1 4.44Å; F475-I478 WeakPolarHBondContact O-CB 3.22Å; F475-I478 PolarHBondContact O-N 3.03Å; I476-I478 PolarHBondContact O-N 3.38Å; I478-E480 HydrophobicContact CG2-CB 4.41Å; I478-E480 PolarHBondContact O-N 3.25Å; I478-A483 HydrophobicContact CG2-CB 4.25Å; I478-I484 HydrophobicContact CB-CD1 4.35Å; I478-I484 HydrophobicContact CB-CG1 4.31Å; I478-I484 HydrophobicContact CD1-CG1 4.31Å; I478-I484 HydrophobicContact CG2-CG1 4.33Å
479	A	92.4	Very high	92.8	Very high	9 Å²	9	34 Å²	34	7%	0.074	18%	0.184	C	C	.	.			trans	57.3	23.3	174.8	0	0	0	0	0	115.8	T211 I214 R215 I476 I477	T211-A479 HydrophobicContact CG2-CB 3.72Å; I214-A479 HydrophobicContact CB-CB 4.35Å; I214-A479 HydrophobicContact CG2-CB 3.95Å; R215-A479 HydrophobicContact CG-CB 3.57Å; I476-A479 WeakPolarHBondContact O-CA 3.49Å; I476-A479 PolarHBondContact O-N 3.5Å; I477-A479 PolarHBondContact O-N 3.45Å
480	E	90.9	Very high	92.6	Very high	111 Å²	111	31.8 Å²	31.8	52%	0.519	18%	0.176	S	C	.	.			trans	-132.5	112.3	177.2	-174.8	169.3	-165.2	0	0	110.2	I478 N482 A483 I484	I478-E480 HydrophobicContact CG2-CB 4.41Å; I478-E480 PolarHBondContact O-N 3.25Å; E480-N482 VanDerWaalsContact C-N 3.33Å; E480-N482 PolarHBondContact O-N 3.08Å; E480-A483 HydrophobicContact CB-CB 4.24Å; E480-A483 HydrophobicContact CG-CB 4.21Å; E480-A483 PolarHBondContact O-N 3.45Å; E480-I484 WeakPolarHBondContact O-CG1 3.19Å; E480-I484 PolarHBondContact O-N 3.33Å
481	L	87.8	Confident	92.4	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-38.8	-174	-171.2	69	0	0	0	112.5	V107 R112 M187 V190 A483 I484 A485	V107-L481 HydrophobicContact CG1-CD1 4.13Å; V107-L481 HydrophobicContact CG1-CD2 4.05Å; V107-L481 HydrophobicContact CG2-CD2 4.16Å; R112-L481 HydrophobicContact CG-CD2 4.13Å; M187-L481 HydrophobicContact CB-CD1 4.46Å; M187-L481 HydrophobicContact CG-CD1 3.54Å; M187-L481 WeakPolarHBondContact O-CD1 3.45Å; V190-L481 HydrophobicContact CG1-CB 4.39Å; V190-L481 HydrophobicContact CG1-CD1 4.45Å; L481-A483 VanDerWaalsContact C-N 3.29Å; L481-A483 PolarHBondContact O-N 3.26Å; L481-I484 PolarHBondContact O-N 2.62Å; L481-A485 PolarHBondContact O-N 3.23Å
482	N	89.7	Confident	92.3	Very high	12 Å²	12	28.5 Å²	28.5	6%	0.064	16%	0.157	C	C	.	.	H	α-helix	trans	-70.1	-26.6	-176.4	-64	-1.6	0	0	0	112.2	R112 I300 E480 P486	R112-N482 PolarHBondContact NE-OD1 3.33Å; I300-N482 HydrophobicContact CD1-CB 4.44Å; E480-N482 VanDerWaalsContact C-N 3.33Å; E480-N482 PolarHBondContact O-N 3.08Å; N482-P486 WeakPolarHBondContact O-CD 3.44Å; N482-P486 WeakPolarHBondContact O-CG 3.37Å
483	A	89.3	Confident	92.2	Very high	36 Å²	36	28.5 Å²	28.5	30%	0.298	16%	0.157	S	C	.	.	H	α-helix	trans	-78.6	-32.6	173.7	0	0	0	0	0	112.8	I478 E480 L481	I478-A483 HydrophobicContact CG2-CB 4.25Å; E480-A483 HydrophobicContact CB-CB 4.24Å; E480-A483 HydrophobicContact CG-CB 4.21Å; E480-A483 PolarHBondContact O-N 3.45Å; L481-A483 VanDerWaalsContact C-N 3.29Å; L481-A483 PolarHBondContact O-N 3.26Å
484	I	90.8	Very high	92.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-78	-37.9	-178	-62.4	166.7	0	0	0	111.3	V183 M187 V190 F475 I478 E480 L481 I487 I488	V183-I484 HydrophobicContact CG1-CG2 4.44Å; M187-I484 HydrophobicContact CB-CG2 4.04Å; V190-I484 HydrophobicContact CB-CD1 4.49Å; V190-I484 HydrophobicContact CG2-CD1 3.99Å; F475-I484 WeakPolarHBondContact O-CD1 3.43Å; I478-I484 HydrophobicContact CB-CD1 4.35Å; I478-I484 HydrophobicContact CB-CG1 4.31Å; I478-I484 HydrophobicContact CD1-CG1 4.31Å; I478-I484 HydrophobicContact CG2-CG1 4.33Å; E480-I484 WeakPolarHBondContact O-CG1 3.19Å; E480-I484 PolarHBondContact O-N 3.33Å; L481-I484 PolarHBondContact O-N 2.62Å; I484-I487 PolarHBondContact O-N 3.42Å; I484-I488 HydrophobicContact CG2-CD1 3.69Å; I484-I488 HydrophobicContact CG2-CG1 4.34Å; I484-I488 PolarHBondContact O-N 3.37Å
485	A	90	Very high	91.9	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-58.7	-45.2	-174.5	0	0	0	0	0	114.6	P303 L481 I487 I488 S489	P303-A485 HydrophobicContact CG-CB 4.12Å; L481-A485 PolarHBondContact O-N 3.23Å; A485-I487 VanDerWaalsContact C-N 3.3Å; A485-I487 PolarHBondContact O-N 2.94Å; A485-I488 PolarHBondContact O-N 3.32Å; A485-S489 PolarHBondContact O-N 3.22Å; A485-S489 PolarHBondContact O-OG 3.42Å
486	P	89	Confident	91.9	Very high	21 Å²	21	22.8 Å²	22.8	14%	0.136	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-35	178.1	-23.7	32.9	0	0	0	113.7	N482 S489 N490	N482-P486 WeakPolarHBondContact O-CD 3.44Å; N482-P486 WeakPolarHBondContact O-CG 3.37Å; P486-S489 PolarHBondContact O-N 3.1Å; P486-N490 PolarHBondContact O-N 2.95Å; P486-N490 VanDerWaalsContact O-N 3.15Å
487	I	89.4	Confident	91.8	Very high	57 Å²	57	23.2 Å²	23.2	29%	0.292	12%	0.124	S	C	.	.	H	α-helix	trans	-63.5	-46.7	177.4	-59.9	175.1	0	0	0	109.6	F475 I484 A485 S489 N490 F491	F475-I487 HydrophobicContact CE1-CD1 4Å; F475-I487 HydrophobicContact CE1-CG2 4.12Å; F475-I487 HydrophobicContact CZ-CG2 4.47Å; I484-I487 PolarHBondContact O-N 3.42Å; A485-I487 VanDerWaalsContact C-N 3.3Å; A485-I487 PolarHBondContact O-N 2.94Å; I487-S489 VanDerWaalsContact C-N 3.35Å; I487-S489 PolarHBondContact O-N 3.2Å; I487-N490 PolarHBondContact O-N 3.38Å; I487-F491 HydrophobicContact CG2-CD2 3.99Å; I487-F491 HydrophobicContact CG2-CE2 3.68Å; I487-F491 WeakPolarHBondContact O-CD2 3.44Å; I487-F491 PolarHBondContact O-N 3.28Å
488	I	91.3	Very high	91.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62	-44.8	177.8	-69.1	169.4	0	0	0	110.8	V183 M187 P303 I484 A485 N490 F491 Y492	V183-I488 HydrophobicContact CB-CG1 4.13Å; V183-I488 HydrophobicContact CG1-CD1 3.99Å; V183-I488 HydrophobicContact CG1-CG1 3.51Å; M187-I488 HydrophobicContact CB-CD1 3.35Å; M187-I488 HydrophobicContact CE-CD1 4.34Å; M187-I488 HydrophobicContact CG-CD1 3.94Å; M187-I488 HydrophobicContact SD-CD1 3.59Å; M187-I488 VanDerWaalsContact SD-CD1 3.59Å; P303-I488 HydrophobicContact CB-CG2 4.1Å; P303-I488 HydrophobicContact CG-CB 4.47Å; P303-I488 HydrophobicContact CG-CG2 4.24Å; I484-I488 HydrophobicContact CG2-CD1 3.69Å; I484-I488 HydrophobicContact CG2-CG1 4.34Å; I484-I488 PolarHBondContact O-N 3.37Å; A485-I488 PolarHBondContact O-N 3.32Å; I488-N490 VanDerWaalsContact C-N 3.28Å; I488-N490 PolarHBondContact O-N 3.48Å; I488-F491 PolarHBondContact O-N 3.47Å; I488-F491 VanDerWaalsContact O-N 3.17Å; I488-Y492 HydrophobicContact CG2-CD2 3.45Å; I488-Y492 VanDerWaalsContact CG2-CD2 3.45Å; I488-Y492 HydrophobicContact CG2-CE2 3.5Å; I488-Y492 VanDerWaalsContact CG2-CE2 3.5Å; I488-Y492 WeakPolarHBondContact O-CD2 3.36Å; I488-Y492 PolarHBondContact O-N 3.3Å
489	S	92.6	Very high	91.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-55.1	-43.6	178.5	-68.7	0	0	0	0	112.3	S299 P303 A485 P486 I487 L493	S299-S489 PolarHBondContact O-OG 3.15Å; P303-S489 WeakPolarHBondContact CD-OG 3.38Å; P303-S489 VanDerWaalsContact CG-OG 3.29Å; P303-S489 WeakPolarHBondContact CG-OG 3.48Å; A485-S489 PolarHBondContact O-N 3.22Å; A485-S489 PolarHBondContact O-OG 3.42Å; P486-S489 PolarHBondContact O-N 3.1Å; I487-S489 VanDerWaalsContact C-N 3.35Å; I487-S489 PolarHBondContact O-N 3.2Å; S489-L493 VanDerWaalsContact O-CB 3.3Å; S489-L493 WeakPolarHBondContact O-CB 3.47Å; S489-L493 WeakPolarHBondContact O-CG 3.23Å; S489-L493 PolarHBondContact O-N 3.39Å
490	N	91.7	Very high	91.9	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.016	9%	0.087	C	C	.	.	H	α-helix	trans	-63	-44.7	176.7	-82.8	-4.9	0	0	0	113.7	P486 I487 I488 L493 C494 T541 A544	P486-N490 PolarHBondContact O-N 2.95Å; P486-N490 VanDerWaalsContact O-N 3.15Å; I487-N490 PolarHBondContact O-N 3.38Å; I488-N490 VanDerWaalsContact C-N 3.28Å; I488-N490 PolarHBondContact O-N 3.48Å; N490-L493 PolarHBondContact O-N 3.32Å; N490-C494 VanDerWaalsContact O-CB 3.29Å; N490-C494 WeakPolarHBondContact O-CB 3.31Å; N490-C494 PolarHBondContact O-N 3.36Å; N490-T541 PolarHBondContact ND2-OG1 3.13Å; N490-A544 VanDerWaalsContact ND2-CB 3.32Å; N490-A544 WeakPolarHBondContact ND2-CB 3.41Å
491	F	92	Very high	92	Very high	53 Å²	53	15.2 Å²	15.2	23%	0.232	8%	0.081	C	C	.	.	H	α-helix	trans	-69	-36.5	-178.7	-74.1	-67.6	0	0	0	112.5	I176 F179 A180 I487 I488 S495	I176-F491 HydrophobicContact CG2-CD1 4.27Å; F179-F491 AromaticContact CD1-CD1 4Å; F179-F491 HydrophobicContact CD1-CD1 4Å; F179-F491 HydrophobicContact CD1-CD2 4.08Å; F179-F491 AromaticContact CD1-CE1 3.91Å; F179-F491 HydrophobicContact CD1-CE1 3.91Å; F179-F491 HydrophobicContact CD1-CE2 4.03Å; F179-F491 HydrophobicContact CD1-CG 4.09Å; F179-F491 AromaticContact CD1-CZ 3.93Å; F179-F491 HydrophobicContact CD1-CZ 3.93Å; F179-F491 HydrophobicContact CE1-CD1 4.36Å; F179-F491 AromaticContact CE1-CD2 3.88Å; F179-F491 HydrophobicContact CE1-CD2 3.88Å; F179-F491 AromaticContact CE1-CE1 3.95Å; F179-F491 HydrophobicContact CE1-CE1 3.95Å; F179-F491 AromaticContact CE1-CE2 3.45Å; F179-F491 HydrophobicContact CE1-CE2 3.45Å; F179-F491 VanDerWaalsContact CE1-CE2 3.45Å; F179-F491 HydrophobicContact CE1-CG 4.34Å; F179-F491 AromaticContact CE1-CZ 3.47Å; F179-F491 HydrophobicContact CE1-CZ 3.47Å; F179-F491 VanDerWaalsContact CE1-CZ 3.47Å; F179-F491 HydrophobicContact CZ-CZ 4.47Å; A180-F491 HydrophobicContact CB-CB 3.9Å; I487-F491 HydrophobicContact CG2-CD2 3.99Å; I487-F491 HydrophobicContact CG2-CE2 3.68Å; I487-F491 WeakPolarHBondContact O-CD2 3.44Å; I487-F491 PolarHBondContact O-N 3.28Å; I488-F491 PolarHBondContact O-N 3.47Å; I488-F491 VanDerWaalsContact O-N 3.17Å; F491-S495 WeakPolarHBondContact O-CB 3.36Å; F491-S495 PolarHBondContact O-N 3.09Å; F491-S495 PolarHBondContact O-OG 3.38Å
492	Y	92.5	Very high	92.2	Very high	2 Å²	2	15 Å²	15	1%	0.008	8%	0.08	C	C	.	.	H	α-helix	trans	-70.5	-43.1	173	-81.5	-65.5	0	0	0	112.4	F177 A180 N181 A184 T306 I488 C494 S495 Y496	F177-Y492 HydrophobicContact CD2-CE1 4.25Å; F177-Y492 AromaticContact CE2-CE1 3.96Å; F177-Y492 HydrophobicContact CE2-CE1 3.96Å; A180-Y492 HydrophobicContact CB-CD1 4.18Å; A180-Y492 HydrophobicContact CB-CD2 4.32Å; A180-Y492 HydrophobicContact CB-CE1 3.99Å; A180-Y492 HydrophobicContact CB-CE2 4.19Å; A180-Y492 HydrophobicContact CB-CG 4.33Å; N181-Y492 PolarHBondContact OD1-OH 3.47Å; A184-Y492 HydrophobicContact CB-CE2 4.37Å; T306-Y492 HydrophobicContact CG2-CD1 4.31Å; T306-Y492 HydrophobicContact CG2-CD2 3.63Å; T306-Y492 HydrophobicContact CG2-CE2 4.22Å; T306-Y492 HydrophobicContact CG2-CG 3.67Å; I488-Y492 HydrophobicContact CG2-CD2 3.45Å; I488-Y492 VanDerWaalsContact CG2-CD2 3.45Å; I488-Y492 HydrophobicContact CG2-CE2 3.5Å; I488-Y492 VanDerWaalsContact CG2-CE2 3.5Å; I488-Y492 WeakPolarHBondContact O-CD2 3.36Å; I488-Y492 PolarHBondContact O-N 3.3Å; Y492-C494 VanDerWaalsContact C-N 3.27Å; Y492-C494 PolarHBondContact O-N 2.86Å; Y492-S495 PolarHBondContact O-N 2.75Å; Y492-S495 VanDerWaalsContact O-N 3.16Å; Y492-Y496 HydrophobicContact CD1-CE1 4.33Å; Y492-Y496 WeakPolarHBondContact O-CB 3.4Å; Y492-Y496 VanDerWaalsContact O-CG 3.22Å; Y492-Y496 PolarHBondContact O-N 3.3Å
493	L	94.3	Very high	92.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-40.2	174.1	-75.4	169.4	0	0	0	111.4	I135 F302 S489 N490 Y496 A497 C533 I536 M537 L540	I135-L493 HydrophobicContact CD1-CD2 4.44Å; I135-L493 HydrophobicContact CG2-CD2 4.42Å; F302-L493 HydrophobicContact CD1-CD2 4.5Å; F302-L493 HydrophobicContact CD1-CG 4.16Å; F302-L493 HydrophobicContact CD2-CD2 4.5Å; F302-L493 HydrophobicContact CE1-CD1 4.48Å; F302-L493 HydrophobicContact CE1-CD2 3.77Å; F302-L493 HydrophobicContact CE1-CG 3.58Å; F302-L493 HydrophobicContact CE2-CD2 3.77Å; F302-L493 HydrophobicContact CE2-CG 4.44Å; F302-L493 HydrophobicContact CZ-CD2 3.34Å; F302-L493 HydrophobicContact CZ-CG 3.74Å; S489-L493 VanDerWaalsContact O-CB 3.3Å; S489-L493 WeakPolarHBondContact O-CB 3.47Å; S489-L493 WeakPolarHBondContact O-CG 3.23Å; S489-L493 PolarHBondContact O-N 3.39Å; N490-L493 PolarHBondContact O-N 3.32Å; L493-Y496 PolarHBondContact O-N 2.98Å; L493-A497 VanDerWaalsContact O-CB 3.28Å; L493-A497 WeakPolarHBondContact O-CB 3.09Å; L493-A497 PolarHBondContact O-N 3.01Å; L493-C533 HydrophobicContact CD2-CB 4.28Å; L493-I536 HydrophobicContact CD1-CB 4.38Å; L493-I536 HydrophobicContact CD1-CG2 3.68Å; L493-M537 HydrophobicContact CB-CG 3.44Å; L493-M537 VanDerWaalsContact CB-CG 3.44Å; L493-M537 HydrophobicContact CB-SD 3.88Å; L493-M537 HydrophobicContact CD1-CG 3.9Å; L493-M537 HydrophobicContact CG-CG 4.31Å; L493-L540 HydrophobicContact CD1-CD1 3.9Å
494	C	93.4	Very high	92.5	Very high	5 Å²	5	13.9 Å²	13.9	3%	0.034	7%	0.068	C	C	.	.	H	α-helix	trans	-62.1	-46.6	174.9	-171.1	0	0	0	0	111.4	I176 N490 Y492 Y496 A497 L498 M537	I176-C494 HydrophobicContact CG2-CB 4.49Å; N490-C494 VanDerWaalsContact O-CB 3.29Å; N490-C494 WeakPolarHBondContact O-CB 3.31Å; N490-C494 PolarHBondContact O-N 3.36Å; Y492-C494 VanDerWaalsContact C-N 3.27Å; Y492-C494 PolarHBondContact O-N 2.86Å; C494-Y496 PolarHBondContact O-N 3Å; C494-A497 PolarHBondContact O-N 3.16Å; C494-L498 WeakPolarHBondContact O-CG 3.37Å; C494-L498 PolarHBondContact O-N 3.29Å; C494-M537 VanDerWaalsContact CA-SD 3.59Å; C494-M537 HydrophobicContact CB-CE 3.64Å; C494-M537 HydrophobicContact CB-SD 3.91Å; C494-M537 PolarHBondContact N-SD 2.92Å; C494-M537 VanDerWaalsContact N-SD 3.4Å
495	S	92.5	Very high	92.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.8	-43.9	178.2	-58.7	0	0	0	0	111.6	I176 F491 Y492 L498 I499	I176-S495 WeakPolarHBondContact CG2-OG 3.24Å; F491-S495 WeakPolarHBondContact O-CB 3.36Å; F491-S495 PolarHBondContact O-N 3.09Å; F491-S495 PolarHBondContact O-OG 3.38Å; Y492-S495 PolarHBondContact O-N 2.75Å; Y492-S495 VanDerWaalsContact O-N 3.16Å; S495-L498 PolarHBondContact O-N 3.39Å; S495-I499 VanDerWaalsContact O-CG1 3.31Å; S495-I499 WeakPolarHBondContact O-CG1 3.42Å; S495-I499 PolarHBondContact O-N 3.32Å
496	Y	94.6	Very high	92.4	Very high	1 Å²	1	15.7 Å²	15.7	0%	0.004	8%	0.077	C	C	.	.	H	α-helix	trans	-69.3	-37.8	178.5	-63.1	-15.5	0	0	0	112	I135 T136 T139 F302 T306 I308 L309 Y492 L493 C494 L498 I499 N500	I135-Y496 HydrophobicContact CG2-CD2 4.48Å; T136-Y496 HydrophobicContact CG2-CE2 4.16Å; T139-Y496 HydrophobicContact CG2-CD1 3.73Å; T139-Y496 HydrophobicContact CG2-CE1 4.37Å; T139-Y496 HydrophobicContact CG2-CG 3.86Å; F302-Y496 HydrophobicContact CE1-CE2 4.48Å; F302-Y496 HydrophobicContact CZ-CD2 4.03Å; F302-Y496 HydrophobicContact CZ-CE2 4.05Å; T306-Y496 HydrophobicContact CG2-CE2 4.48Å; I308-Y496 HydrophobicContact CD1-CE1 4.43Å; I308-Y496 HydrophobicContact CG1-CE1 4.46Å; L309-Y496 HydrophobicContact CD1-CE1 4.27Å; Y492-Y496 HydrophobicContact CD1-CE1 4.33Å; Y492-Y496 WeakPolarHBondContact O-CB 3.4Å; Y492-Y496 VanDerWaalsContact O-CG 3.22Å; Y492-Y496 PolarHBondContact O-N 3.3Å; L493-Y496 PolarHBondContact O-N 2.98Å; C494-Y496 PolarHBondContact O-N 3Å; Y496-L498 VanDerWaalsContact C-N 3.32Å; Y496-L498 PolarHBondContact O-N 3.36Å; Y496-I499 HydrophobicContact CD1-CD1 4.43Å; Y496-I499 PolarHBondContact O-N 2.95Å; Y496-N500 WeakPolarHBondContact O-CB 3.32Å; Y496-N500 PolarHBondContact O-N 3.33Å; Y496-N500 PolarHBondContact O-ND2 3.43Å
497	A	95.1	Very high	92.4	Very high	8 Å²	8	15.4 Å²	15.4	7%	0.066	8%	0.075	C	C	.	.	H	α-helix	trans	-58.1	-46	172.1	0	0	0	0	0	111.1	L493 C494 N500 F501 C533 V534	L493-A497 VanDerWaalsContact O-CB 3.28Å; L493-A497 WeakPolarHBondContact O-CB 3.09Å; L493-A497 PolarHBondContact O-N 3.01Å; C494-A497 PolarHBondContact O-N 3.16Å; A497-N500 PolarHBondContact O-N 3.2Å; A497-F501 WeakPolarHBondContact O-CB 3.3Å; A497-F501 PolarHBondContact O-N 2.72Å; A497-C533 HydrophobicContact CB-CB 3.76Å; A497-V534 HydrophobicContact CB-CG2 4.07Å
498	L	93.3	Very high	92.4	Very high	25 Å²	25	16.7 Å²	16.7	13%	0.131	8%	0.082	C	C	.	.	H	α-helix	trans	-66.4	-42.9	178.8	-69.8	174.3	0	0	0	113.1	I173 I176 C494 S495 Y496 S502 V552	I173-L498 HydrophobicContact CD1-CB 4.17Å; I173-L498 HydrophobicContact CG1-CB 3.63Å; I173-L498 HydrophobicContact CG1-CD1 4.14Å; I176-L498 HydrophobicContact CD1-CD1 3.65Å; C494-L498 WeakPolarHBondContact O-CG 3.37Å; C494-L498 PolarHBondContact O-N 3.29Å; S495-L498 PolarHBondContact O-N 3.39Å; Y496-L498 VanDerWaalsContact C-N 3.32Å; Y496-L498 PolarHBondContact O-N 3.36Å; L498-S502 WeakPolarHBondContact O-CB 3.38Å; L498-S502 PolarHBondContact O-N 3.02Å; L498-S502 PolarHBondContact O-OG 2.86Å; L498-V552 HydrophobicContact CD1-CG1 4.06Å; L498-V552 HydrophobicContact CD1-CG2 4.14Å; L498-V552 HydrophobicContact CD2-CG1 3.67Å; L498-V552 HydrophobicContact CG-CG1 4.45Å
499	I	93.7	Very high	91.9	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-58.9	-50.6	176.7	-71.3	166.7	0	0	0	109.9	T139 I146 I161 I173 L309 S495 Y496 S502 C503	T139-I499 HydrophobicContact CG2-CG2 4.42Å; I146-I499 HydrophobicContact CD1-CG2 4.02Å; I161-I499 HydrophobicContact CD1-CD1 4.23Å; I161-I499 HydrophobicContact CD1-CG1 4.35Å; I173-I499 HydrophobicContact CD1-CG1 4.24Å; I173-I499 HydrophobicContact CG2-CD1 4.25Å; I173-I499 HydrophobicContact CG2-CG1 3.86Å; L309-I499 HydrophobicContact CD1-CD1 3.9Å; S495-I499 VanDerWaalsContact O-CG1 3.31Å; S495-I499 WeakPolarHBondContact O-CG1 3.42Å; S495-I499 PolarHBondContact O-N 3.32Å; Y496-I499 HydrophobicContact CD1-CD1 4.43Å; Y496-I499 PolarHBondContact O-N 2.95Å; I499-S502 PolarHBondContact O-N 3.05Å; I499-C503 PolarHBondContact O-N 3.36Å; I499-C503 PolarHBondContact O-SG 3.3Å; I499-C503 VanDerWaalsContact O-SG 3.37Å
500	N	95.9	Very high	91.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66	-43.5	-178.1	-74.8	-54.4	0	0	0	112.5	T139 S142 Y496 A497 S502 C503 F504 S526 C529 A530	T139-N500 PolarHBondContact OG1-ND2 2.88Å; S142-N500 VanDerWaalsContact CB-OD1 3.25Å; S142-N500 WeakPolarHBondContact CB-OD1 3.4Å; S142-N500 PolarHBondContact OG-OD1 3.31Å; Y496-N500 WeakPolarHBondContact O-CB 3.32Å; Y496-N500 PolarHBondContact O-N 3.33Å; Y496-N500 PolarHBondContact O-ND2 3.43Å; A497-N500 PolarHBondContact O-N 3.2Å; N500-S502 VanDerWaalsContact C-N 3.32Å; N500-S502 PolarHBondContact O-N 3.05Å; N500-C503 PolarHBondContact O-N 2.84Å; N500-F504 PolarHBondContact O-N 3.36Å; N500-F504 VanDerWaalsContact O-N 3.09Å; N500-S526 WeakPolarHBondContact CB-O 3.44Å; N500-S526 WeakPolarHBondContact O-CB 3.32Å; N500-C529 PolarHBondContact ND2-SG 3.46Å; N500-A530 HydrophobicContact CB-CB 4.02Å
501	F	94.1	Very high	90.1	Very high	90 Å²	90	24 Å²	24	40%	0.395	12%	0.123	S	C	.	.	H	α-helix	trans	-62	-40.9	175.4	176.6	-102.1	0	0	0	111.8	A497 F504 H505 A530	A497-F501 WeakPolarHBondContact O-CB 3.3Å; A497-F501 PolarHBondContact O-N 2.72Å; F501-F504 PolarHBondContact O-N 3.05Å; F501-H505 WeakPolarHBondContact O-CB 3.41Å; F501-H505 PolarHBondContact O-N 3.26Å; F501-A530 HydrophobicContact CB-CB 4.06Å
502	S	91.3	Very high	88.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-41.3	-179.7	-60	0	0	0	0	112.1	L498 I499 N500 H505 A506	L498-S502 WeakPolarHBondContact O-CB 3.38Å; L498-S502 PolarHBondContact O-N 3.02Å; L498-S502 PolarHBondContact O-OG 2.86Å; I499-S502 PolarHBondContact O-N 3.05Å; N500-S502 VanDerWaalsContact C-N 3.32Å; N500-S502 PolarHBondContact O-N 3.05Å; S502-H505 PolarHBondContact O-N 3.5Å; S502-A506 WeakPolarHBondContact O-CB 3.43Å; S502-A506 PolarHBondContact O-N 3.27Å
503	C	92.3	Very high	88	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-43.6	173.1	-68.6	0	0	0	0	111.9	I499 N500 S507 W514 Y521	I499-C503 PolarHBondContact O-N 3.36Å; I499-C503 PolarHBondContact O-SG 3.3Å; I499-C503 VanDerWaalsContact O-SG 3.37Å; N500-C503 PolarHBondContact O-N 2.84Å; C503-S507 WeakPolarHBondContact O-CB 3.37Å; C503-S507 PolarHBondContact O-N 2.92Å; C503-S507 PolarHBondContact O-OG 3.23Å; C503-W514 HydrophobicContact CB-CH2 4.15Å; C503-W514 HydrophobicContact CB-CZ2 4.07Å; C503-Y521 VanDerWaalsContact C-OH 3.32Å; C503-Y521 HydrophobicContact CB-CE2 4.12Å; C503-Y521 PolarHBondContact O-OH 3.5Å; C503-Y521 VanDerWaalsContact O-OH 3.05Å
504	F	93.8	Very high	87.5	Confident	24 Å²	24	29 Å²	29	11%	0.105	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-49.1	174.6	167.3	-102.1	0	0	0	111.5	N500 F501 A506 S507 I508 K523 W524 L527	N500-F504 PolarHBondContact O-N 3.36Å; N500-F504 VanDerWaalsContact O-N 3.09Å; F501-F504 PolarHBondContact O-N 3.05Å; F504-A506 PolarHBondContact O-N 3.46Å; F504-S507 PolarHBondContact O-N 2.71Å; F504-S507 VanDerWaalsContact O-N 3.13Å; F504-I508 HydrophobicContact CE2-CD1 4.38Å; F504-I508 HydrophobicContact CZ-CD1 3.9Å; F504-I508 PolarHBondContact O-N 2.65Å; F504-K523 HydrophobicContact CD2-CB 4.2Å; F504-K523 WeakPolarHBondContact CD2-O 3.48Å; F504-W524 HydrophobicContact CE2-CE3 4.08Å; F504-W524 AromaticContact CE2-CZ3 3.99Å; F504-W524 HydrophobicContact CE2-CZ3 3.99Å; F504-W524 HydrophobicContact CZ-CZ3 4.38Å; F504-L527 HydrophobicContact CB-CB 4.39Å; F504-L527 HydrophobicContact CD1-CB 4.38Å; F504-L527 HydrophobicContact CD1-CD1 3.85Å; F504-L527 HydrophobicContact CD2-CB 3.77Å; F504-L527 HydrophobicContact CD2-CD2 4.39Å; F504-L527 HydrophobicContact CD2-CG 4.49Å; F504-L527 HydrophobicContact CE1-CD1 3.91Å; F504-L527 HydrophobicContact CE1-CD2 4.16Å; F504-L527 HydrophobicContact CE1-CG 4.47Å; F504-L527 HydrophobicContact CE2-CB 4.1Å; F504-L527 HydrophobicContact CE2-CD2 3.88Å; F504-L527 HydrophobicContact CE2-CG 4.45Å; F504-L527 HydrophobicContact CG-CB 3.91Å; F504-L527 HydrophobicContact CG-CD1 4.23Å; F504-L527 HydrophobicContact CZ-CD1 4.35Å; F504-L527 HydrophobicContact CZ-CD2 3.76Å; F504-L527 HydrophobicContact CZ-CG 4.44Å
505	H	89.6	Confident	87.2	Confident	38 Å²	38	37.7 Å²	37.7	18%	0.176	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-44.6	179.3	-178.1	-100.6	0	0	0	112.1	F501 S502 S507 I508 T509 S571	F501-H505 WeakPolarHBondContact O-CB 3.41Å; F501-H505 PolarHBondContact O-N 3.26Å; S502-H505 PolarHBondContact O-N 3.5Å; H505-S507 VanDerWaalsContact C-N 3.27Å; H505-S507 PolarHBondContact O-N 2.88Å; H505-I508 WeakPolarHBondContact O-CG2 3.4Å; H505-I508 PolarHBondContact O-N 3.22Å; H505-T509 WeakPolarHBondContact O-CB 3.34Å; H505-T509 VanDerWaalsContact O-CG2 3.25Å; H505-T509 WeakPolarHBondContact O-CG2 3.4Å; H505-T509 PolarHBondContact O-N 3.01Å; H505-T509 VanDerWaalsContact O-N 3.1Å; H505-T509 PolarHBondContact O-OG1 3.01Å; H505-S571 PolarHBondContact ND1-OG 2.86Å
506	A	87.3	Confident	87	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-35.9	175.5	0	0	0	0	0	112.3	L165 S502 F504 T509 W514	L165-A506 HydrophobicContact CD2-CB 4.12Å; S502-A506 WeakPolarHBondContact O-CB 3.43Å; S502-A506 PolarHBondContact O-N 3.27Å; F504-A506 PolarHBondContact O-N 3.46Å; A506-T509 PolarHBondContact O-OG1 3.44Å; A506-W514 HydrophobicContact CB-CB 4.23Å; A506-W514 HydrophobicContact CB-CD2 3.67Å; A506-W514 HydrophobicContact CB-CE3 4Å; A506-W514 HydrophobicContact CB-CG 3.75Å
507	S	90.1	Very high	86.7	Confident	15 Å²	15	43.9 Å²	43.9	11%	0.105	24%	0.243	C	C	.	.	H	α-helix	trans	-76.1	-31.3	-179.9	-55.5	0	0	0	0	114	C503 F504 H505 N510 W514 Y521	C503-S507 WeakPolarHBondContact O-CB 3.37Å; C503-S507 PolarHBondContact O-N 2.92Å; C503-S507 PolarHBondContact O-OG 3.23Å; F504-S507 PolarHBondContact O-N 2.71Å; F504-S507 VanDerWaalsContact O-N 3.13Å; H505-S507 VanDerWaalsContact C-N 3.27Å; H505-S507 PolarHBondContact O-N 2.88Å; S507-N510 PolarHBondContact O-OD1 3.46Å; S507-W514 PolarHBondContact OG-NE1 2.9Å; S507-Y521 PolarHBondContact OG-OH 3.39Å
508	I	89.3	Confident	86.4	Confident	85 Å²	85	45.1 Å²	45.1	44%	0.436	25%	0.246	S	C	.	.	H	α-helix	trans	-82.7	-29.4	178.3	-162.4	164.6	0	0	0	112.2	F504 H505 N510	F504-I508 HydrophobicContact CE2-CD1 4.38Å; F504-I508 HydrophobicContact CZ-CD1 3.9Å; F504-I508 PolarHBondContact O-N 2.65Å; H505-I508 WeakPolarHBondContact O-CG2 3.4Å; H505-I508 PolarHBondContact O-N 3.22Å; I508-N510 PolarHBondContact O-N 3.44Å
509	T	80.4	Confident	86.1	Confident	17 Å²	17	54.7 Å²	54.7	10%	0.104	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-5.8	178.4	51.5	0	0	0	0	113.3	H505 A506 S511 N578	H505-T509 WeakPolarHBondContact O-CB 3.34Å; H505-T509 VanDerWaalsContact O-CG2 3.25Å; H505-T509 WeakPolarHBondContact O-CG2 3.4Å; H505-T509 PolarHBondContact O-N 3.01Å; H505-T509 VanDerWaalsContact O-N 3.1Å; H505-T509 PolarHBondContact O-OG1 3.01Å; A506-T509 PolarHBondContact O-OG1 3.44Å; T509-S511 PolarHBondContact O-N 3.14Å; T509-N578 PolarHBondContact O-ND2 2.86Å
510	N	77.4	Confident	86	Confident	121 Å²	121	61.6 Å²	61.6	65%	0.647	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	45.6	-175.4	-65.1	-34.8	0	0	0	111.5	S507 I508 P512	S507-N510 PolarHBondContact O-OD1 3.46Å; I508-N510 PolarHBondContact O-N 3.44Å; N510-P512 WeakPolarHBondContact O-CD 3.32Å
511	S	68.6	Low	85.9	Confident	19 Å²	19	63.3 Å²	63.3	13%	0.133	32%	0.318	C	S	.	.			trans	-60.9	125.7	177.9	179.7	0	0	0	0	109.6	T509 G513 W514	T509-S511 PolarHBondContact O-N 3.14Å; S511-G513 PolarHBondContact O-N 3.02Å; S511-G513 VanDerWaalsContact O-N 3.1Å; S511-W514 PolarHBondContact O-N 3.32Å
512	P	68.6	Low	85.9	Confident	84 Å²	84	61.5 Å²	61.5	55%	0.545	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.4	-178.4	-27.2	34.9	0	0	0	114	N510 W514 R515	N510-P512 WeakPolarHBondContact O-CD 3.32Å; P512-W514 VanDerWaalsContact C-N 3.29Å; P512-R515 PolarHBondContact O-NE 3.49Å; P512-R515 PolarHBondContact O-NH2 3.13Å
513	G	72.8	Confident	86.1	Confident	53 Å²	53	65.2 Å²	65.2	55%	0.546	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	0.3	176.4	0	0	0	0	0	114.7	N149 S511	N149-G513 PolarHBondContact ND2-O 3.13Å; N149-G513 PolarHBondContact OD1-O 3.39Å; S511-G513 PolarHBondContact O-N 3.02Å; S511-G513 VanDerWaalsContact O-N 3.1Å
514	W	83.8	Confident	86.2	Confident	21 Å²	21	72.6 Å²	72.6	8%	0.08	36%	0.36	C	S	.	.			trans	-111	98.2	177.1	-177.8	-98.7	0	0	0	110.5	A145 I146 N149 L165 C503 A506 S507 S511 P512 P516 Y521	A145-W514 HydrophobicContact CB-CH2 4.36Å; A145-W514 HydrophobicContact CB-CZ2 4.3Å; I146-W514 HydrophobicContact CG1-CH2 3.85Å; I146-W514 HydrophobicContact CG1-CZ3 4.05Å; N149-W514 HydrophobicContact CB-CE3 4.46Å; N149-W514 HydrophobicContact CB-CZ3 4.42Å; L165-W514 HydrophobicContact CD2-CE3 4.04Å; L165-W514 HydrophobicContact CD2-CH2 4.22Å; L165-W514 HydrophobicContact CD2-CZ3 3.61Å; C503-W514 HydrophobicContact CB-CH2 4.15Å; C503-W514 HydrophobicContact CB-CZ2 4.07Å; A506-W514 HydrophobicContact CB-CB 4.23Å; A506-W514 HydrophobicContact CB-CD2 3.67Å; A506-W514 HydrophobicContact CB-CE3 4Å; A506-W514 HydrophobicContact CB-CG 3.75Å; S507-W514 PolarHBondContact OG-NE1 2.9Å; S511-W514 PolarHBondContact O-N 3.32Å; P512-W514 VanDerWaalsContact C-N 3.29Å; W514-P516 HydrophobicContact CZ2-CB 4.49Å; W514-P516 HydrophobicContact CZ2-CG 4.11Å; W514-Y521 HydrophobicContact CZ2-CE1 4.41Å
515	R	87.4	Confident	86.2	Confident	189 Å²	189	74.2 Å²	74.2	71%	0.713	37%	0.37	S	S	*	.			trans	-137.5	66.4	-179.3	-57.8	-179.3	-165.9	-169.4	-1	110.5	N149 P512 S517	N149-R515 PolarHBondContact OD1-N 2.78Å; P512-R515 PolarHBondContact O-NE 3.49Å; P512-R515 PolarHBondContact O-NH2 3.13Å; R515-S517 PolarHBondContact O-N 3.13Å
516	P	88.4	Confident	86.5	Confident	37 Å²	37	72.5 Å²	72.5	24%	0.24	36%	0.362	C	S	.	.			trans	-63.6	126.6	179.9	27.3	-34.3	0	0	0	110.3	A145 W514 F518 Y521	A145-P516 HydrophobicContact CB-CB 3.81Å; W514-P516 HydrophobicContact CZ2-CB 4.49Å; W514-P516 HydrophobicContact CZ2-CG 4.11Å; P516-F518 VanDerWaalsContact C-N 3.32Å; P516-Y521 HydrophobicContact CG-CD1 4.02Å; P516-Y521 HydrophobicContact CG-CE1 4.13Å
517	S	87.3	Confident	87	Confident	94 Å²	94	74.7 Å²	74.7	66%	0.657	37%	0.374	S	S	*	.			trans	-86.8	-4.3	176.9	62.9	0	0	0	0	113.4	T148 R515 R519	T148-S517 WeakPolarHBondContact CB-OG 3.28Å; R515-S517 PolarHBondContact O-N 3.13Å; S517-R519 PolarHBondContact O-N 3.48Å
518	F	89.4	Confident	87.3	Confident	33 Å²	33	78.5 Å²	78.5	15%	0.145	39%	0.392	C	S	.	.			trans	-72.9	113.6	-178.2	-170.6	-111.4	0	0	0	112.9	L141 T148 P326 L330 P516 F520 Y521	L141-F518 HydrophobicContact CB-CE1 4.45Å; L141-F518 HydrophobicContact CD2-CE1 3.63Å; L141-F518 HydrophobicContact CD2-CZ 4.09Å; T148-F518 HydrophobicContact CG2-CB 4.16Å; T148-F518 WeakPolarHBondContact OG1-CB 3.41Å; T148-F518 PolarHBondContact OG1-N 3.07Å; P326-F518 HydrophobicContact CB-CD2 4.15Å; P326-F518 HydrophobicContact CB-CE2 3.76Å; P326-F518 HydrophobicContact CB-CZ 4.45Å; P326-F518 HydrophobicContact CG-CD2 4.42Å; L330-F518 HydrophobicContact CD1-CZ 3.85Å; P516-F518 VanDerWaalsContact C-N 3.32Å; F518-F520 HydrophobicContact CD1-CB 4.4Å; F518-F520 HydrophobicContact CE1-CB 3.7Å; F518-F520 HydrophobicContact CE1-CD2 4.44Å; F518-F520 HydrophobicContact CE2-CD2 4.34Å; F518-F520 HydrophobicContact CZ-CB 4.03Å; F518-F520 AromaticContact CZ-CD2 3.94Å; F518-F520 HydrophobicContact CZ-CD2 3.94Å; F518-F520 HydrophobicContact CZ-CG 4.49Å; F518-F520 PolarHBondContact O-N 2.83Å; F518-Y521 WeakPolarHBondContact O-CB 3.37Å; F518-Y521 PolarHBondContact O-N 3.46Å
519	R	87.8	Confident	87.6	Confident	227 Å²	227	74.5 Å²	74.5	86%	0.857	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-33.2	-172	-173.6	176.7	177.4	178.2	-0.3	115.6	S517 Y521	S517-R519 PolarHBondContact O-N 3.48Å; R519-Y521 VanDerWaalsContact C-N 3.29Å; R519-Y521 PolarHBondContact O-N 3.22Å
520	F	91.1	Very high	88.4	Confident	146 Å²	146	74 Å²	74	64%	0.64	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	3.1	-175.2	-60.1	-74.2	0	0	0	113.6	L141 F518	L141-F520 HydrophobicContact CD2-CB 4.11Å; F518-F520 HydrophobicContact CD1-CB 4.4Å; F518-F520 HydrophobicContact CE1-CB 3.7Å; F518-F520 HydrophobicContact CE1-CD2 4.44Å; F518-F520 HydrophobicContact CE2-CD2 4.34Å; F518-F520 HydrophobicContact CZ-CB 4.03Å; F518-F520 AromaticContact CZ-CD2 3.94Å; F518-F520 HydrophobicContact CZ-CD2 3.94Å; F518-F520 HydrophobicContact CZ-CG 4.49Å; F518-F520 PolarHBondContact O-N 2.83Å
521	Y	93.6	Very high	89.3	Confident	35 Å²	35	72.1 Å²	72.1	14%	0.137	36%	0.362	C	S	.	.			trans	-76.8	134.9	176.2	170.5	-107.3	0	0	0	111.4	A145 C503 S507 W514 P516 F518 R519 S526	A145-Y521 HydrophobicContact CB-CD1 4.13Å; A145-Y521 HydrophobicContact CB-CD2 3.51Å; A145-Y521 HydrophobicContact CB-CE2 3.99Å; A145-Y521 HydrophobicContact CB-CG 3.59Å; C503-Y521 VanDerWaalsContact C-OH 3.32Å; C503-Y521 HydrophobicContact CB-CE2 4.12Å; C503-Y521 PolarHBondContact O-OH 3.5Å; C503-Y521 VanDerWaalsContact O-OH 3.05Å; S507-Y521 PolarHBondContact OG-OH 3.39Å; W514-Y521 HydrophobicContact CZ2-CE1 4.41Å; P516-Y521 HydrophobicContact CG-CD1 4.02Å; P516-Y521 HydrophobicContact CG-CE1 4.13Å; F518-Y521 WeakPolarHBondContact O-CB 3.37Å; F518-Y521 PolarHBondContact O-N 3.46Å; R519-Y521 VanDerWaalsContact C-N 3.29Å; R519-Y521 PolarHBondContact O-N 3.22Å; Y521-S526 WeakPolarHBondContact CE2-OG 3.24Å
522	S	94.4	Very high	90.6	Very high	52 Å²	52	73.9 Å²	73.9	36%	0.364	37%	0.369	S	S	.	.			trans	-135.6	126.5	172.1	174.3	0	0	0	0	110.6	W524 L525 S526	S522-W524 VanDerWaalsContact C-N 3.28Å; S522-W524 PolarHBondContact O-N 3.35Å; S522-L525 PolarHBondContact O-N 3.04Å; S522-S526 PolarHBondContact O-N 3.44Å; S522-S526 VanDerWaalsContact O-N 3.16Å; S522-S526 PolarHBondContact O-OG 3.1Å
523	K	93.8	Very high	91.9	Very high	78 Å²	78	69.9 Å²	69.9	34%	0.339	34%	0.344	S	S	.	.	H	α-helix	trans	-58.8	-37.2	-179.4	64.9	-174.4	178.4	-176	0	113	F504 S526 L527	F504-K523 HydrophobicContact CD2-CB 4.2Å; F504-K523 WeakPolarHBondContact CD2-O 3.48Å; K523-S526 PolarHBondContact O-N 3.02Å; K523-L527 PolarHBondContact O-N 2.89Å
524	W	95.4	Very high	92.9	Very high	155 Å²	155	69.9 Å²	69.9	59%	0.587	33%	0.333	S	S	*	.	H	α-helix	trans	-72.1	-34.8	-179.3	-63.2	117.9	0	0	0	112.4	F504 S522 S526 L527 L528	F504-W524 HydrophobicContact CE2-CE3 4.08Å; F504-W524 AromaticContact CE2-CZ3 3.99Å; F504-W524 HydrophobicContact CE2-CZ3 3.99Å; F504-W524 HydrophobicContact CZ-CZ3 4.38Å; S522-W524 VanDerWaalsContact C-N 3.28Å; S522-W524 PolarHBondContact O-N 3.35Å; W524-S526 VanDerWaalsContact C-N 3.35Å; W524-L527 HydrophobicContact CE3-CD2 4.14Å; W524-L527 HydrophobicContact CZ3-CD2 4.16Å; W524-L527 PolarHBondContact O-N 2.85Å; W524-L528 WeakPolarHBondContact O-CB 3.37Å; W524-L528 PolarHBondContact O-N 3.41Å
525	L	94.8	Very high	93.4	Very high	59 Å²	59	72.5 Å²	72.5	31%	0.309	35%	0.351	S	S	.	.	H	α-helix	trans	-67	-39.5	175.4	-170.8	62.5	0	0	0	110.9	I138 L141 S522 L528 C529	I138-L525 HydrophobicContact CD1-CD1 3.68Å; I138-L525 HydrophobicContact CD1-CG 3.95Å; I138-L525 HydrophobicContact CG1-CD1 4.1Å; I138-L525 HydrophobicContact CG1-CD2 4.07Å; I138-L525 HydrophobicContact CG1-CG 3.89Å; I138-L525 HydrophobicContact CG2-CD2 4.43Å; I138-L525 HydrophobicContact CG2-CG 3.89Å; L141-L525 HydrophobicContact CD1-CD2 4.01Å; S522-L525 PolarHBondContact O-N 3.04Å; L525-L528 HydrophobicContact CD1-CD2 4.44Å; L525-L528 PolarHBondContact O-N 2.79Å; L525-C529 PolarHBondContact O-N 3.13Å
526	S	95.4	Very high	93.7	Very high	2 Å²	2	64 Å²	64	1%	0.014	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-43.6	172.2	-56.8	0	0	0	0	111.9	S142 N500 Y521 S522 K523 W524 L528 C529 A530	S142-S526 PolarHBondContact OG-OG 2.84Å; N500-S526 WeakPolarHBondContact CB-O 3.44Å; N500-S526 WeakPolarHBondContact O-CB 3.32Å; Y521-S526 WeakPolarHBondContact CE2-OG 3.24Å; S522-S526 PolarHBondContact O-N 3.44Å; S522-S526 VanDerWaalsContact O-N 3.16Å; S522-S526 PolarHBondContact O-OG 3.1Å; K523-S526 PolarHBondContact O-N 3.02Å; W524-S526 VanDerWaalsContact C-N 3.35Å; S526-L528 PolarHBondContact O-N 2.91Å; S526-C529 PolarHBondContact O-N 3.34Å; S526-A530 PolarHBondContact O-N 3.44Å
527	L	96.6	Very high	93.9	Very high	47 Å²	47	62.2 Å²	62.2	25%	0.246	31%	0.308	C	S	.	.	H	α-helix	trans	-60.6	-46.5	175.5	-179.7	64.4	0	0	0	111.9	F504 K523 W524 C529 A530 V531	F504-L527 HydrophobicContact CB-CB 4.39Å; F504-L527 HydrophobicContact CD1-CB 4.38Å; F504-L527 HydrophobicContact CD1-CD1 3.85Å; F504-L527 HydrophobicContact CD2-CB 3.77Å; F504-L527 HydrophobicContact CD2-CD2 4.39Å; F504-L527 HydrophobicContact CD2-CG 4.49Å; F504-L527 HydrophobicContact CE1-CD1 3.91Å; F504-L527 HydrophobicContact CE1-CD2 4.16Å; F504-L527 HydrophobicContact CE1-CG 4.47Å; F504-L527 HydrophobicContact CE2-CB 4.1Å; F504-L527 HydrophobicContact CE2-CD2 3.88Å; F504-L527 HydrophobicContact CE2-CG 4.45Å; F504-L527 HydrophobicContact CG-CB 3.91Å; F504-L527 HydrophobicContact CG-CD1 4.23Å; F504-L527 HydrophobicContact CZ-CD1 4.35Å; F504-L527 HydrophobicContact CZ-CD2 3.76Å; F504-L527 HydrophobicContact CZ-CG 4.44Å; K523-L527 PolarHBondContact O-N 2.89Å; W524-L527 HydrophobicContact CE3-CD2 4.14Å; W524-L527 HydrophobicContact CZ3-CD2 4.16Å; W524-L527 PolarHBondContact O-N 2.85Å; L527-C529 VanDerWaalsContact C-N 3.31Å; L527-C529 PolarHBondContact O-N 3.21Å; L527-A530 PolarHBondContact O-N 3.45Å; L527-V531 WeakPolarHBondContact O-CG2 3.35Å; L527-V531 PolarHBondContact O-N 3.2Å
528	L	96.4	Very high	94.2	Very high	95 Å²	95	61.7 Å²	61.7	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-56.7	-46.4	177.9	179.4	66.6	0	0	0	111	W524 L525 S526 V531 I532	W524-L528 WeakPolarHBondContact O-CB 3.37Å; W524-L528 PolarHBondContact O-N 3.41Å; L525-L528 HydrophobicContact CD1-CD2 4.44Å; L525-L528 PolarHBondContact O-N 2.79Å; S526-L528 PolarHBondContact O-N 2.91Å; L528-V531 PolarHBondContact O-N 3.18Å; L528-I532 HydrophobicContact CD1-CD1 4.1Å; L528-I532 HydrophobicContact CD1-CG1 4.48Å; L528-I532 HydrophobicContact CD2-CD1 4.47Å; L528-I532 HydrophobicContact CG-CD1 3.84Å; L528-I532 VanDerWaalsContact O-CG1 3.29Å; L528-I532 WeakPolarHBondContact O-CG1 3.47Å; L528-I532 PolarHBondContact O-N 3.42Å
529	C	96.6	Very high	94.3	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.007	31%	0.309	C	S	.	.	H	α-helix	trans	-64.2	-40.9	177.7	-177.3	0	0	0	0	112.4	I138 N500 L525 S526 L527 V531 I532 C533	I138-C529 HydrophobicContact CB-CB 3.97Å; I138-C529 HydrophobicContact CD1-CB 4.04Å; I138-C529 HydrophobicContact CG2-CB 3.46Å; I138-C529 VanDerWaalsContact CG2-CB 3.46Å; N500-C529 PolarHBondContact ND2-SG 3.46Å; L525-C529 PolarHBondContact O-N 3.13Å; S526-C529 PolarHBondContact O-N 3.34Å; L527-C529 VanDerWaalsContact C-N 3.31Å; L527-C529 PolarHBondContact O-N 3.21Å; C529-V531 VanDerWaalsContact C-N 3.32Å; C529-V531 PolarHBondContact O-N 2.73Å; C529-I532 PolarHBondContact O-N 2.95Å; C529-C533 WeakPolarHBondContact O-CB 3.36Å; C529-C533 PolarHBondContact O-N 2.89Å; C529-C533 PolarHBondContact O-SG 3.49Å
530	A	96.3	Very high	94.3	Very high	7 Å²	7	54.9 Å²	54.9	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-59.2	-43.3	176.1	0	0	0	0	0	112	N500 F501 S526 L527 C533 V534	N500-A530 HydrophobicContact CB-CB 4.02Å; F501-A530 HydrophobicContact CB-CB 4.06Å; S526-A530 PolarHBondContact O-N 3.44Å; L527-A530 PolarHBondContact O-N 3.45Å; A530-C533 PolarHBondContact O-N 3.14Å; A530-V534 WeakPolarHBondContact O-CG2 3.3Å; A530-V534 PolarHBondContact O-N 3.37Å; A530-V534 VanDerWaalsContact O-N 3.16Å
531	V	96.4	Very high	94	Very high	80 Å²	80	49.7 Å²	49.7	49%	0.485	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-46.5	176.4	175.2	0	0	0	0	111.1	L527 L528 C529 C533 V534 V535	L527-V531 WeakPolarHBondContact O-CG2 3.35Å; L527-V531 PolarHBondContact O-N 3.2Å; L528-V531 PolarHBondContact O-N 3.18Å; C529-V531 VanDerWaalsContact C-N 3.32Å; C529-V531 PolarHBondContact O-N 2.73Å; V531-C533 VanDerWaalsContact C-N 3.32Å; V531-C533 PolarHBondContact O-N 3.1Å; V531-V534 PolarHBondContact O-N 2.86Å; V531-V535 HydrophobicContact CG1-CG2 4.29Å; V531-V535 WeakPolarHBondContact O-CG2 3.39Å; V531-V535 PolarHBondContact O-N 3.33Å
532	I	95.6	Very high	93.8	Very high	57 Å²	57	55.9 Å²	55.9	29%	0.292	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-44.2	177.7	-70.6	169.2	0	0	0	110.9	I135 L528 C529 V534 V535 I536	I135-I532 HydrophobicContact CD1-CG2 4.34Å; I135-I532 HydrophobicContact CG1-CG2 4.3Å; L528-I532 HydrophobicContact CD1-CD1 4.1Å; L528-I532 HydrophobicContact CD1-CG1 4.48Å; L528-I532 HydrophobicContact CD2-CD1 4.47Å; L528-I532 HydrophobicContact CG-CD1 3.84Å; L528-I532 VanDerWaalsContact O-CG1 3.29Å; L528-I532 WeakPolarHBondContact O-CG1 3.47Å; L528-I532 PolarHBondContact O-N 3.42Å; C529-I532 PolarHBondContact O-N 2.95Å; I532-V534 PolarHBondContact O-N 2.7Å; I532-V535 PolarHBondContact O-N 3.32Å; I532-I536 HydrophobicContact CG2-CD1 3.62Å; I532-I536 HydrophobicContact CG2-CG1 4.3Å; I532-I536 WeakPolarHBondContact O-CB 3.16Å; I532-I536 VanDerWaalsContact O-CG1 3.3Å; I532-I536 WeakPolarHBondContact O-CG1 3.49Å; I532-I536 PolarHBondContact O-N 3.19Å
533	C	95.5	Very high	93.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-46.3	177.3	-72.2	0	0	0	0	111.8	I135 L493 A497 C529 A530 V531 I536 M537	I135-C533 VanDerWaalsContact CG2-SG 3.58Å; L493-C533 HydrophobicContact CD2-CB 4.28Å; A497-C533 HydrophobicContact CB-CB 3.76Å; C529-C533 WeakPolarHBondContact O-CB 3.36Å; C529-C533 PolarHBondContact O-N 2.89Å; C529-C533 PolarHBondContact O-SG 3.49Å; A530-C533 PolarHBondContact O-N 3.14Å; V531-C533 VanDerWaalsContact C-N 3.32Å; V531-C533 PolarHBondContact O-N 3.1Å; C533-I536 PolarHBondContact O-N 3.48Å; C533-M537 VanDerWaalsContact O-CG 3.26Å; C533-M537 WeakPolarHBondContact O-CG 3.45Å; C533-M537 PolarHBondContact O-N 2.95Å
534	V	94.7	Very high	93.2	Very high	53 Å²	53	57.5 Å²	57.5	32%	0.321	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-45.3	178.5	173.4	0	0	0	0	111	A497 A530 V531 I532 I536 M537 F538 I549	A497-V534 HydrophobicContact CB-CG2 4.07Å; A530-V534 WeakPolarHBondContact O-CG2 3.3Å; A530-V534 PolarHBondContact O-N 3.37Å; A530-V534 VanDerWaalsContact O-N 3.16Å; V531-V534 PolarHBondContact O-N 2.86Å; I532-V534 PolarHBondContact O-N 2.7Å; V534-I536 VanDerWaalsContact C-N 3.35Å; V534-I536 PolarHBondContact O-N 3.13Å; V534-M537 WeakPolarHBondContact O-CB 3.38Å; V534-M537 PolarHBondContact O-N 3.09Å; V534-F538 HydrophobicContact CG1-CD2 4Å; V534-F538 HydrophobicContact CG1-CE2 3.9Å; V534-F538 VanDerWaalsContact O-CD2 3.31Å; V534-F538 WeakPolarHBondContact O-CD2 3.39Å; V534-F538 PolarHBondContact O-N 2.95Å; V534-I549 HydrophobicContact CG1-CD1 4.38Å
535	V	94.8	Very high	93	Very high	76 Å²	76	50.1 Å²	50.1	46%	0.461	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-47.2	177.7	171	0	0	0	0	110.7	V531 I532 M537 F538 L539	V531-V535 HydrophobicContact CG1-CG2 4.29Å; V531-V535 WeakPolarHBondContact O-CG2 3.39Å; V531-V535 PolarHBondContact O-N 3.33Å; I532-V535 PolarHBondContact O-N 3.32Å; V535-M537 PolarHBondContact O-N 2.85Å; V535-F538 PolarHBondContact O-N 2.94Å; V535-L539 HydrophobicContact CG1-CD1 3.88Å; V535-L539 HydrophobicContact CG1-CG 4.43Å; V535-L539 WeakPolarHBondContact O-CG 3.27Å; V535-L539 PolarHBondContact O-N 2.88Å
536	I	93.6	Very high	92.7	Very high	9 Å²	9	51.7 Å²	51.7	5%	0.046	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-43.4	178.1	-69.3	172.7	0	0	0	110.8	L131 I135 F298 L493 I532 C533 V534 F538 L539 L540	L131-I536 HydrophobicContact CD1-CD1 4.44Å; L131-I536 HydrophobicContact CD2-CD1 4.23Å; L131-I536 HydrophobicContact CG-CD1 4.46Å; I135-I536 HydrophobicContact CD1-CD1 3.53Å; F298-I536 HydrophobicContact CD1-CG2 4.04Å; F298-I536 HydrophobicContact CE1-CG2 3.4Å; F298-I536 HydrophobicContact CZ-CD1 4.15Å; F298-I536 HydrophobicContact CZ-CG2 3.97Å; L493-I536 HydrophobicContact CD1-CB 4.38Å; L493-I536 HydrophobicContact CD1-CG2 3.68Å; I532-I536 HydrophobicContact CG2-CD1 3.62Å; I532-I536 HydrophobicContact CG2-CG1 4.3Å; I532-I536 WeakPolarHBondContact O-CB 3.16Å; I532-I536 VanDerWaalsContact O-CG1 3.3Å; I532-I536 WeakPolarHBondContact O-CG1 3.49Å; I532-I536 PolarHBondContact O-N 3.19Å; C533-I536 PolarHBondContact O-N 3.48Å; V534-I536 VanDerWaalsContact C-N 3.35Å; V534-I536 PolarHBondContact O-N 3.13Å; I536-F538 VanDerWaalsContact C-N 3.27Å; I536-F538 PolarHBondContact O-N 2.91Å; I536-L539 CarbonylContact O-C 3.54Å; I536-L539 WeakPolarHBondContact O-CA 3.43Å; I536-L539 WeakPolarHBondContact O-CB 3.11Å; I536-L539 PolarHBondContact O-N 3.49Å; I536-L540 HydrophobicContact CG2-CD1 4.33Å; I536-L540 HydrophobicContact CG2-CD2 4.32Å; I536-L540 HydrophobicContact CG2-CG 4.09Å; I536-L540 WeakPolarHBondContact O-CG 3.31Å; I536-L540 PolarHBondContact O-N 3.18Å
537	M	93	Very high	92.5	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-53.9	-43.2	176.2	-73.8	172	65.4	0	0	112.6	L493 C494 C533 V534 V535 L540 T541 A545 A548	L493-M537 HydrophobicContact CB-CG 3.44Å; L493-M537 VanDerWaalsContact CB-CG 3.44Å; L493-M537 HydrophobicContact CB-SD 3.88Å; L493-M537 HydrophobicContact CD1-CG 3.9Å; L493-M537 HydrophobicContact CG-CG 4.31Å; C494-M537 VanDerWaalsContact CA-SD 3.59Å; C494-M537 HydrophobicContact CB-CE 3.64Å; C494-M537 HydrophobicContact CB-SD 3.91Å; C494-M537 PolarHBondContact N-SD 2.92Å; C494-M537 VanDerWaalsContact N-SD 3.4Å; C533-M537 VanDerWaalsContact O-CG 3.26Å; C533-M537 WeakPolarHBondContact O-CG 3.45Å; C533-M537 PolarHBondContact O-N 2.95Å; V534-M537 WeakPolarHBondContact O-CB 3.38Å; V534-M537 PolarHBondContact O-N 3.09Å; V535-M537 PolarHBondContact O-N 2.85Å; M537-L540 PolarHBondContact O-N 3Å; M537-T541 PolarHBondContact O-N 2.95Å; M537-A545 HydrophobicContact CB-CB 3.98Å; M537-A545 HydrophobicContact CE-CB 4.36Å; M537-A548 HydrophobicContact CE-CB 4.1Å
538	F	92.8	Very high	92	Very high	82 Å²	82	54.6 Å²	54.6	36%	0.36	28%	0.275	S	S	.	.	H	α-helix	trans	-67.9	-34.9	176.4	-83.4	-80.6	0	0	0	112.9	V534 V535 I536 L540 W542 A545 L546 I549	V534-F538 HydrophobicContact CG1-CD2 4Å; V534-F538 HydrophobicContact CG1-CE2 3.9Å; V534-F538 VanDerWaalsContact O-CD2 3.31Å; V534-F538 WeakPolarHBondContact O-CD2 3.39Å; V534-F538 PolarHBondContact O-N 2.95Å; V535-F538 PolarHBondContact O-N 2.94Å; I536-F538 VanDerWaalsContact C-N 3.27Å; I536-F538 PolarHBondContact O-N 2.91Å; F538-L540 VanDerWaalsContact C-N 3.33Å; F538-W542 HydrophobicContact CD1-CB 4.14Å; F538-W542 PolarHBondContact O-N 2.67Å; F538-A545 HydrophobicContact CD1-CB 4.23Å; F538-A545 HydrophobicContact CD2-CB 4.4Å; F538-A545 HydrophobicContact CE1-CB 4.33Å; F538-A545 HydrophobicContact CE2-CB 4.49Å; F538-A545 HydrophobicContact CG-CB 4.26Å; F538-A545 HydrophobicContact CZ-CB 4.45Å; F538-L546 HydrophobicContact CE1-CD2 4.09Å; F538-L546 HydrophobicContact CE1-CG 4.03Å; F538-L546 HydrophobicContact CZ-CD2 4.19Å; F538-L546 HydrophobicContact CZ-CG 4.48Å; F538-I549 HydrophobicContact CE2-CD1 3.6Å; F538-I549 HydrophobicContact CZ-CD1 3.88Å
539	L	91.4	Very high	91.6	Very high	89 Å²	89	52 Å²	52	47%	0.466	26%	0.261	S	S	.	.	H	α-helix	trans	-71.6	-26.1	176	-66.3	172.2	0	0	0	113	F295 V535 I536	F295-L539 HydrophobicContact CD1-CB 4.06Å; F295-L539 HydrophobicContact CD1-CD1 4.47Å; F295-L539 HydrophobicContact CD2-CB 4.42Å; F295-L539 HydrophobicContact CE1-CB 4.16Å; F295-L539 HydrophobicContact CE1-CD1 3.73Å; F295-L539 HydrophobicContact CE2-CD1 4.02Å; F295-L539 HydrophobicContact CG-CB 4.22Å; F295-L539 HydrophobicContact CZ-CB 4.4Å; F295-L539 HydrophobicContact CZ-CD1 3.49Å; F295-L539 VanDerWaalsContact CZ-CD1 3.49Å; F295-L539 HydrophobicContact CZ-CG 4.46Å; V535-L539 HydrophobicContact CG1-CD1 3.88Å; V535-L539 HydrophobicContact CG1-CG 4.43Å; V535-L539 WeakPolarHBondContact O-CG 3.27Å; V535-L539 PolarHBondContact O-N 2.88Å; I536-L539 CarbonylContact O-C 3.54Å; I536-L539 WeakPolarHBondContact O-CA 3.43Å; I536-L539 WeakPolarHBondContact O-CB 3.11Å; I536-L539 PolarHBondContact O-N 3.49Å
540	L	87.2	Confident	91.4	Very high	28 Å²	28	53.8 Å²	53.8	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-76.5	-67	174.8	-60.8	-166.2	0	0	0	111.1	F295 F298 L493 I536 M537 F538	F295-L540 HydrophobicContact CB-CD2 4Å; F295-L540 HydrophobicContact CD1-CD2 4.22Å; F295-L540 WeakPolarHBondContact O-CD2 3.4Å; F298-L540 HydrophobicContact CD1-CD1 4.36Å; F298-L540 HydrophobicContact CD1-CD2 3.96Å; F298-L540 HydrophobicContact CE1-CD1 4.44Å; L493-L540 HydrophobicContact CD1-CD1 3.9Å; I536-L540 HydrophobicContact CG2-CD1 4.33Å; I536-L540 HydrophobicContact CG2-CD2 4.32Å; I536-L540 HydrophobicContact CG2-CG 4.09Å; I536-L540 WeakPolarHBondContact O-CG 3.31Å; I536-L540 PolarHBondContact O-N 3.18Å; M537-L540 PolarHBondContact O-N 3Å; F538-L540 VanDerWaalsContact C-N 3.33Å
541	T	86.3	Confident	91.1	Very high	38 Å²	38	56.7 Å²	56.7	23%	0.233	30%	0.298	C	S	.	.	H	α-helix	trans	-149.7	93.9	-178.6	38.3	0	0	0	0	109.9	N490 M537 W543 A544 A545	N490-T541 PolarHBondContact ND2-OG1 3.13Å; M537-T541 PolarHBondContact O-N 2.95Å; T541-W543 VanDerWaalsContact C-N 3.3Å; T541-W543 PolarHBondContact O-N 2.92Å; T541-A544 PolarHBondContact O-N 3.11Å; T541-A544 VanDerWaalsContact O-N 3.15Å; T541-A545 PolarHBondContact O-N 3.48Å
542	W	89.6	Confident	90.8	Very high	165 Å²	165	53.8 Å²	53.8	63%	0.625	28%	0.28	S	S	*	.	H	α-helix	trans	-54.1	-39.1	-174.3	69.3	-91.6	0	0	0	114.4	F538 A545 L546	F538-W542 HydrophobicContact CD1-CB 4.14Å; F538-W542 PolarHBondContact O-N 2.67Å; W542-A545 PolarHBondContact O-N 3.24Å; W542-L546 HydrophobicContact CE3-CD1 3.67Å; W542-L546 HydrophobicContact CZ3-CD1 3.74Å; W542-L546 WeakPolarHBondContact O-CG 3.43Å; W542-L546 PolarHBondContact O-N 3.09Å
543	W	89	Confident	90.5	Very high	143 Å²	143	58 Å²	58	54%	0.542	30%	0.296	S	S	.	.	H	α-helix	trans	-70.1	-40.4	-178.4	63.4	-94.2	0	0	0	111.5	T541 A545 L546 I547	T541-W543 VanDerWaalsContact C-N 3.3Å; T541-W543 PolarHBondContact O-N 2.92Å; W543-A545 VanDerWaalsContact C-N 3.35Å; W543-L546 PolarHBondContact O-N 3.21Å; W543-I547 HydrophobicContact CE3-CD1 3.79Å; W543-I547 HydrophobicContact CZ3-CD1 4.07Å; W543-I547 WeakPolarHBondContact O-CG1 3.36Å; W543-I547 PolarHBondContact O-N 3.39Å; W543-I547 VanDerWaalsContact O-N 3.1Å
544	A	86.8	Confident	90.4	Very high	21 Å²	21	65 Å²	65	17%	0.174	33%	0.327	C	S	.	.	H	α-helix	trans	-69.3	-35.9	176.2	0	0	0	0	0	111.1	N490 T541 I547 A548	N490-A544 VanDerWaalsContact ND2-CB 3.32Å; N490-A544 WeakPolarHBondContact ND2-CB 3.41Å; T541-A544 PolarHBondContact O-N 3.11Å; T541-A544 VanDerWaalsContact O-N 3.15Å; A544-I547 PolarHBondContact O-N 3.5Å; A544-A548 WeakPolarHBondContact O-CB 3.34Å; A544-A548 PolarHBondContact O-N 3.05Å
545	A	89.4	Confident	90.1	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-44.5	172.6	0	0	0	0	0	112.2	M537 F538 T541 W542 W543 I547 A548 I549	M537-A545 HydrophobicContact CB-CB 3.98Å; M537-A545 HydrophobicContact CE-CB 4.36Å; F538-A545 HydrophobicContact CD1-CB 4.23Å; F538-A545 HydrophobicContact CD2-CB 4.4Å; F538-A545 HydrophobicContact CE1-CB 4.33Å; F538-A545 HydrophobicContact CE2-CB 4.49Å; F538-A545 HydrophobicContact CG-CB 4.26Å; F538-A545 HydrophobicContact CZ-CB 4.45Å; T541-A545 PolarHBondContact O-N 3.48Å; W542-A545 PolarHBondContact O-N 3.24Å; W543-A545 VanDerWaalsContact C-N 3.35Å; A545-I547 PolarHBondContact O-N 2.8Å; A545-A548 PolarHBondContact O-N 3.47Å; A545-I549 WeakPolarHBondContact O-CB 3.39Å; A545-I549 WeakPolarHBondContact O-CG1 3.41Å; A545-I549 PolarHBondContact O-N 3.05Å
546	L	90.3	Very high	89.7	Confident	91 Å²	91	61.4 Å²	61.4	48%	0.476	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-43.7	174.9	-78.7	172.2	0	0	0	112.3	F538 W542 W543 G550	F538-L546 HydrophobicContact CE1-CD2 4.09Å; F538-L546 HydrophobicContact CE1-CG 4.03Å; F538-L546 HydrophobicContact CZ-CD2 4.19Å; F538-L546 HydrophobicContact CZ-CG 4.48Å; W542-L546 HydrophobicContact CE3-CD1 3.67Å; W542-L546 HydrophobicContact CZ3-CD1 3.74Å; W542-L546 WeakPolarHBondContact O-CG 3.43Å; W542-L546 PolarHBondContact O-N 3.09Å; W543-L546 PolarHBondContact O-N 3.21Å; L546-G550 PolarHBondContact O-N 3.41Å
547	I	89.3	Confident	89.4	Confident	102 Å²	102	62.7 Å²	62.7	52%	0.523	32%	0.319	S	S	.	.	H	α-helix	trans	-62.5	-48.2	177	-66.9	168.8	0	0	0	110.3	W543 A544 A545 I549 G550 V551	W543-I547 HydrophobicContact CE3-CD1 3.79Å; W543-I547 HydrophobicContact CZ3-CD1 4.07Å; W543-I547 WeakPolarHBondContact O-CG1 3.36Å; W543-I547 PolarHBondContact O-N 3.39Å; W543-I547 VanDerWaalsContact O-N 3.1Å; A544-I547 PolarHBondContact O-N 3.5Å; A545-I547 PolarHBondContact O-N 2.8Å; I547-I549 PolarHBondContact O-N 3.16Å; I547-G550 PolarHBondContact O-N 3.44Å; I547-V551 WeakPolarHBondContact O-CG2 3.11Å; I547-V551 PolarHBondContact O-N 2.92Å
548	A	87.1	Confident	89.1	Confident	8 Å²	8	66 Å²	66	7%	0.066	33%	0.332	C	S	.	.	H	α-helix	trans	-59	-48.8	179.9	0	0	0	0	0	111.6	M537 A544 A545 G550 V551 V552	M537-A548 HydrophobicContact CE-CB 4.1Å; A544-A548 WeakPolarHBondContact O-CB 3.34Å; A544-A548 PolarHBondContact O-N 3.05Å; A545-A548 PolarHBondContact O-N 3.47Å; A548-G550 PolarHBondContact O-N 3.42Å; A548-V551 PolarHBondContact O-N 3.26Å; A548-V552 WeakPolarHBondContact O-CG2 3.15Å; A548-V552 PolarHBondContact O-N 3.19Å
549	I	88.3	Confident	88.7	Confident	40 Å²	40	62.2 Å²	62.2	21%	0.205	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-41.6	177.6	-69.4	170.1	0	0	0	111.2	V534 F538 A545 I547 V551 V552 F553	V534-I549 HydrophobicContact CG1-CD1 4.38Å; F538-I549 HydrophobicContact CE2-CD1 3.6Å; F538-I549 HydrophobicContact CZ-CD1 3.88Å; A545-I549 WeakPolarHBondContact O-CB 3.39Å; A545-I549 WeakPolarHBondContact O-CG1 3.41Å; A545-I549 PolarHBondContact O-N 3.05Å; I547-I549 PolarHBondContact O-N 3.16Å; I549-V551 VanDerWaalsContact C-N 3.34Å; I549-V551 PolarHBondContact O-N 3.36Å; I549-V552 WeakPolarHBondContact O-CB 3.25Å; I549-V552 PolarHBondContact O-N 3.23Å; I549-F553 HydrophobicContact CG2-CD2 3.57Å; I549-F553 HydrophobicContact CG2-CE2 3.41Å; I549-F553 VanDerWaalsContact CG2-CE2 3.41Å; I549-F553 VanDerWaalsContact O-CD2 3.31Å; I549-F553 WeakPolarHBondContact O-CD2 3.4Å; I549-F553 PolarHBondContact O-N 3.18Å
550	G	91.4	Very high	88.3	Confident	40 Å²	40	61.5 Å²	61.5	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-59.9	-42.6	175.5	0	0	0	0	0	112.6	L546 I547 A548 F553 F554	L546-G550 PolarHBondContact O-N 3.41Å; I547-G550 PolarHBondContact O-N 3.44Å; A548-G550 PolarHBondContact O-N 3.42Å; G550-F553 PolarHBondContact O-N 2.92Å; G550-F554 WeakPolarHBondContact O-CB 3.41Å; G550-F554 PolarHBondContact O-N 3.15Å
551	V	90.5	Very high	88	Confident	68 Å²	68	69.9 Å²	69.9	41%	0.412	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-43.5	173.6	171.1	0	0	0	0	110.8	I547 A548 I549 F554 L555	I547-V551 WeakPolarHBondContact O-CG2 3.11Å; I547-V551 PolarHBondContact O-N 2.92Å; A548-V551 PolarHBondContact O-N 3.26Å; I549-V551 VanDerWaalsContact C-N 3.34Å; I549-V551 PolarHBondContact O-N 3.36Å; V551-F554 PolarHBondContact O-N 3.3Å; V551-L555 HydrophobicContact CG1-CD1 3.79Å; V551-L555 HydrophobicContact CG1-CG 4.28Å; V551-L555 WeakPolarHBondContact O-CG 3.46Å; V551-L555 PolarHBondContact O-N 3.07Å
552	V	89.9	Confident	87.6	Confident	18 Å²	18	72.5 Å²	72.5	11%	0.109	35%	0.351	C	S	.	.	H	α-helix	trans	-59.1	-50.5	176.6	-177.2	0	0	0	0	111.4	I176 L498 A548 I549 F554 L555 L556	I176-V552 HydrophobicContact CD1-CG2 3.52Å; L498-V552 HydrophobicContact CD1-CG1 4.06Å; L498-V552 HydrophobicContact CD1-CG2 4.14Å; L498-V552 HydrophobicContact CD2-CG1 3.67Å; L498-V552 HydrophobicContact CG-CG1 4.45Å; A548-V552 WeakPolarHBondContact O-CG2 3.15Å; A548-V552 PolarHBondContact O-N 3.19Å; I549-V552 WeakPolarHBondContact O-CB 3.25Å; I549-V552 PolarHBondContact O-N 3.23Å; V552-F554 VanDerWaalsContact C-N 3.28Å; V552-F554 PolarHBondContact O-N 3.39Å; V552-L555 PolarHBondContact O-N 3.15Å; V552-L556 WeakPolarHBondContact O-CB 3.45Å; V552-L556 PolarHBondContact O-N 3.47Å
553	F	90.3	Very high	86.7	Confident	145 Å²	145	72.6 Å²	72.6	64%	0.636	36%	0.356	S	S	*	.	H	α-helix	trans	-62.5	-37.6	-179.8	-82.4	-63.6	0	0	0	112.1	I549 G550 G557	I549-F553 HydrophobicContact CG2-CD2 3.57Å; I549-F553 HydrophobicContact CG2-CE2 3.41Å; I549-F553 VanDerWaalsContact CG2-CE2 3.41Å; I549-F553 VanDerWaalsContact O-CD2 3.31Å; I549-F553 WeakPolarHBondContact O-CD2 3.4Å; I549-F553 PolarHBondContact O-N 3.18Å; G550-F553 PolarHBondContact O-N 2.92Å; F553-G557 PolarHBondContact O-N 3.02Å
554	F	91.9	Very high	85.6	Confident	148 Å²	148	67.2 Å²	67.2	65%	0.649	34%	0.339	S	S	*	.	H	α-helix	trans	-62.4	-47	174.3	175.9	-99.1	0	0	0	111.9	G550 V551 V552 G557 Y558	G550-F554 WeakPolarHBondContact O-CB 3.41Å; G550-F554 PolarHBondContact O-N 3.15Å; V551-F554 PolarHBondContact O-N 3.3Å; V552-F554 VanDerWaalsContact C-N 3.28Å; V552-F554 PolarHBondContact O-N 3.39Å; F554-G557 PolarHBondContact O-N 3.44Å; F554-Y558 VanDerWaalsContact O-CB 3.26Å; F554-Y558 WeakPolarHBondContact O-CB 3.3Å; F554-Y558 PolarHBondContact O-N 3.08Å
555	L	89.5	Confident	84.3	Confident	12 Å²	12	74.4 Å²	74.4	6%	0.063	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-44.4	179	-68.3	170.3	0	0	0	112.2	L175 Y445 V551 V552 Y558 T559	L175-L555 HydrophobicContact CD2-CD1 3.74Å; L175-L555 HydrophobicContact CD2-CD2 3.7Å; L175-L555 HydrophobicContact CD2-CG 4.39Å; Y445-L555 HydrophobicContact CD1-CD2 4.41Å; Y445-L555 HydrophobicContact CE1-CB 4.49Å; Y445-L555 HydrophobicContact CE1-CD2 3.65Å; V551-L555 HydrophobicContact CG1-CD1 3.79Å; V551-L555 HydrophobicContact CG1-CG 4.28Å; V551-L555 WeakPolarHBondContact O-CG 3.46Å; V551-L555 PolarHBondContact O-N 3.07Å; V552-L555 PolarHBondContact O-N 3.15Å; L555-Y558 PolarHBondContact O-N 3.41Å; L555-T559 WeakPolarHBondContact O-CG2 3.38Å; L555-T559 PolarHBondContact O-N 3.43Å; L555-T559 PolarHBondContact O-OG1 3.36Å; L555-T559 VanDerWaalsContact O-OG1 3.07Å
556	L	86.2	Confident	83	Confident	41 Å²	41	76.4 Å²	76.4	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-45.7	176	-164.3	97.3	0	0	0	111.1	E168 L169 V552 Y558 T559 L560	E168-L556 HydrophobicContact CB-CD1 4.37Å; L169-L556 HydrophobicContact CD2-CD1 3.79Å; V552-L556 WeakPolarHBondContact O-CB 3.45Å; V552-L556 PolarHBondContact O-N 3.47Å; L556-Y558 VanDerWaalsContact C-N 3.31Å; L556-Y558 PolarHBondContact O-N 2.97Å; L556-T559 PolarHBondContact O-N 2.92Å; L556-T559 PolarHBondContact O-OG1 3.37Å; L556-L560 HydrophobicContact CD2-CD1 3.99Å; L556-L560 HydrophobicContact CG-CD1 4.15Å; L556-L560 WeakPolarHBondContact O-CB 3.45Å; L556-L560 VanDerWaalsContact O-CG 3.23Å; L556-L560 WeakPolarHBondContact O-CG 3.32Å; L556-L560 PolarHBondContact O-N 3.21Å
557	G	86.9	Confident	81.5	Confident	37 Å²	37	78 Å²	78	38%	0.381	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-39.4	177.5	0	0	0	0	0	112.4	F553 F554 Y561	F553-G557 PolarHBondContact O-N 3.02Å; F554-G557 PolarHBondContact O-N 3.44Å; G557-Y561 WeakPolarHBondContact O-CB 3.49Å; G557-Y561 PolarHBondContact O-N 2.9Å
558	Y	87.9	Confident	80.1	Confident	70 Å²	70	75.3 Å²	75.3	28%	0.275	38%	0.379	S	S	.	.	H	α-helix	trans	-64.6	-47.2	176.3	179.9	-91.9	0	0	0	112.4	Y445 P446 F554 L555 L556 Y561 K562	Y445-Y558 AromaticContact CD1-CD1 3.61Å; Y445-Y558 HydrophobicContact CD1-CD1 3.61Å; Y445-Y558 AromaticContact CD1-CE1 3.79Å; Y445-Y558 HydrophobicContact CD1-CE1 3.79Å; Y445-Y558 AromaticContact CE1-CD1 3.82Å; Y445-Y558 HydrophobicContact CE1-CD1 3.82Å; Y445-Y558 HydrophobicContact CE1-CE1 4.43Å; P446-Y558 WeakPolarHBondContact CD-OH 3.4Å; P446-Y558 WeakPolarHBondContact CG-OH 3.04Å; F554-Y558 VanDerWaalsContact O-CB 3.26Å; F554-Y558 WeakPolarHBondContact O-CB 3.3Å; F554-Y558 PolarHBondContact O-N 3.08Å; L555-Y558 PolarHBondContact O-N 3.41Å; L556-Y558 VanDerWaalsContact C-N 3.31Å; L556-Y558 PolarHBondContact O-N 2.97Å; Y558-Y561 PolarHBondContact O-N 2.69Å; Y558-K562 HydrophobicContact CE1-CD 4.09Å; Y558-K562 PolarHBondContact O-N 2.83Å; Y558-K562 WeakPolarHBondContact OH-CD 3.33Å
559	T	84.1	Confident	78.6	Confident	2 Å²	2	76.8 Å²	76.8	1%	0.012	40%	0.396	C	S	.	.	H	α-helix	trans	-65.2	-39.6	178.9	49.8	0	0	0	0	111.8	Y445 L555 L556 K563	Y445-T559 HydrophobicContact CE1-CG2 3.87Å; L555-T559 WeakPolarHBondContact O-CG2 3.38Å; L555-T559 PolarHBondContact O-N 3.43Å; L555-T559 PolarHBondContact O-OG1 3.36Å; L555-T559 VanDerWaalsContact O-OG1 3.07Å; L556-T559 PolarHBondContact O-N 2.92Å; L556-T559 PolarHBondContact O-OG1 3.37Å; T559-K563 PolarHBondContact O-N 3.17Å; T559-K563 VanDerWaalsContact O-N 3.11Å
560	L	81.7	Confident	77.5	Confident	75 Å²	75	75.1 Å²	75.1	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-63.2	-39.1	173.7	-75.3	172.6	0	0	0	113.4	E168 L556 K563 L572	E168-L560 HydrophobicContact CG-CD2 4.28Å; L556-L560 HydrophobicContact CD2-CD1 3.99Å; L556-L560 HydrophobicContact CG-CD1 4.15Å; L556-L560 WeakPolarHBondContact O-CB 3.45Å; L556-L560 VanDerWaalsContact O-CG 3.23Å; L556-L560 WeakPolarHBondContact O-CG 3.32Å; L556-L560 PolarHBondContact O-N 3.21Å; L560-K563 WeakPolarHBondContact O-CG 3.44Å; L560-L572 HydrophobicContact CD2-CD1 3.81Å
561	Y	82.4	Confident	76.3	Confident	204 Å²	204	73.3 Å²	73.3	80%	0.8	37%	0.368	S	S	*	.	H	α-helix	trans	-71.3	-45.8	179.3	178.8	-102.2	0	0	0	112	G557 Y558	G557-Y561 WeakPolarHBondContact O-CB 3.49Å; G557-Y561 PolarHBondContact O-N 2.9Å; Y558-Y561 PolarHBondContact O-N 2.69Å
562	K	77.8	Confident	75.3	Confident	93 Å²	93	72.5 Å²	72.5	40%	0.404	36%	0.362	S	S	.	.	H	α-helix	trans	-73.7	-27.3	-175.6	-169.5	173.3	176.4	-168.8	0	113	Y558	Y558-K562 HydrophobicContact CE1-CD 4.09Å; Y558-K562 PolarHBondContact O-N 2.83Å; Y558-K562 WeakPolarHBondContact OH-CD 3.33Å
563	K	70.5	Confident	74.4	Confident	167 Å²	167	76.4 Å²	76.4	73%	0.726	38%	0.378	S	S	*	.			trans	44.1	69	-175.3	-65	-172.4	178.2	-176.6	0	111.7	T559 L560	T559-K563 PolarHBondContact O-N 3.17Å; T559-K563 VanDerWaalsContact O-N 3.11Å; L560-K563 WeakPolarHBondContact O-CG 3.44Å
564	P	65	Low	73.3	Confident	30 Å²	30	70.2 Å²	70.2	20%	0.195	35%	0.354	C	S	.	.			trans	-55.4	146.3	-177.5	24.3	-33.1	0	0	0	111.2	L444 V566	L444-P564 HydrophobicContact CD2-CB 4.33Å; L444-P564 HydrophobicContact CD2-CG 3.99Å; P564-V566 HydrophobicContact CB-CG2 4.43Å; P564-V566 PolarHBondContact O-N 3.22Å
565	D	60.2	Low	72.2	Confident	172 Å²	172	64.9 Å²	64.9	92%	0.92	34%	0.335	S	S	*	.	S	Bend	trans	-66	12.1	-177.7	-64.2	-42.8	0	0	0	114.4
566	V	60.8	Low	71.6	Confident	42 Å²	42	67.9 Å²	67.9	26%	0.255	36%	0.357	S	S	.	.			trans	-98.6	97.8	-170.7	-178	0	0	0	0	108.5	P564 W568	P564-V566 HydrophobicContact CB-CG2 4.43Å; P564-V566 PolarHBondContact O-N 3.22Å; V566-W568 HydrophobicContact CB-CZ2 4.49Å; V566-W568 HydrophobicContact CG1-CD2 3.63Å; V566-W568 HydrophobicContact CG1-CE3 4.3Å; V566-W568 HydrophobicContact CG1-CG 4.1Å; V566-W568 HydrophobicContact CG1-CH2 3.85Å; V566-W568 HydrophobicContact CG1-CZ2 3.14Å; V566-W568 HydrophobicContact CG1-CZ3 4.38Å; V566-W568 PolarHBondContact O-N 3.36Å
567	N	60.3	Low	71.3	Confident	123 Å²	123	73.3 Å²	73.3	66%	0.658	38%	0.376	S	S	*	.			trans	-97.2	83.8	-176.3	-167.6	5.1	0	0	0	111.8	G569 Q573	N567-G569 VanDerWaalsContact C-N 3.26Å; N567-G569 PolarHBondContact OD1-N 3.5Å; N567-Q573 PolarHBondContact OD1-OE1 2.75Å
568	W	59.1	Low	70.8	Confident	46 Å²	46	73.5 Å²	73.5	17%	0.174	37%	0.368	C	S	.	.	S	Bend	trans	-88	7.8	173.6	-56.2	-27.4	0	0	0	113.5	R163 P167 D442 L444 V566	R163-W568 VanDerWaalsContact NH2-CE2 3.27Å; R163-W568 VanDerWaalsContact NH2-CZ2 3.31Å; P167-W568 HydrophobicContact CB-CE3 3.73Å; P167-W568 HydrophobicContact CB-CH2 4.48Å; P167-W568 HydrophobicContact CB-CZ3 3.62Å; P167-W568 HydrophobicContact CG-CE3 4.31Å; D442-W568 HydrophobicContact CB-CH2 3.62Å; D442-W568 HydrophobicContact CB-CZ2 3.93Å; D442-W568 VanDerWaalsContact CG-CZ2 3.42Å; D442-W568 WeakPolarHBondContact OD1-CZ2 3.43Å; D442-W568 WeakPolarHBondContact OD2-CH2 3.45Å; L444-W568 HydrophobicContact CD1-CH2 4.38Å; L444-W568 HydrophobicContact CD1-CZ3 4.42Å; L444-W568 HydrophobicContact CD2-CH2 4.35Å; V566-W568 HydrophobicContact CB-CZ2 4.49Å; V566-W568 HydrophobicContact CG1-CD2 3.63Å; V566-W568 HydrophobicContact CG1-CE3 4.3Å; V566-W568 HydrophobicContact CG1-CG 4.1Å; V566-W568 HydrophobicContact CG1-CH2 3.85Å; V566-W568 HydrophobicContact CG1-CZ2 3.14Å; V566-W568 HydrophobicContact CG1-CZ3 4.38Å; V566-W568 PolarHBondContact O-N 3.36Å
569	G	56.5	Low	70.4	Confident	40 Å²	40	75.2 Å²	75.2	41%	0.412	38%	0.38	S	S	.	.			trans	72.1	117.1	-161.5	0	0	0	0	0	110	N567	N567-G569 VanDerWaalsContact C-N 3.26Å; N567-G569 PolarHBondContact OD1-N 3.5Å
570	S	64.5	Low	70.4	Confident	4 Å²	4	77.6 Å²	77.6	3%	0.028	40%	0.4	C	S	.	.			trans	-106.1	138.7	175.3	173.1	0	0	0	0	110.6	E168 L572 Q573 A574	E168-S570 VanDerWaalsContact CD-OG 3.28Å; E168-S570 PolarHBondContact OE1-OG 2.81Å; E168-S570 WeakPolarHBondContact OE2-CB 3.41Å; E168-S570 PolarHBondContact OE2-OG 3.39Å; S570-L572 PolarHBondContact O-N 3.3Å; S570-L572 WeakPolarHBondContact OG-CB 3.32Å; S570-L572 PolarHBondContact OG-N 3.47Å; S570-L572 VanDerWaalsContact OG-N 3.09Å; S570-Q573 PolarHBondContact O-N 3.29Å; S570-Q573 VanDerWaalsContact O-N 3.13Å; S570-A574 PolarHBondContact O-N 2.97Å
571	S	66.3	Low	70.6	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.021	40%	0.398	C	S	.	.	H	α-helix	trans	-57.4	-30	169.6	58.5	0	0	0	0	112	H505 S575	H505-S571 PolarHBondContact ND1-OG 2.86Å; S571-S575 WeakPolarHBondContact O-CB 3.36Å; S571-S575 PolarHBondContact O-N 2.86Å
572	L	69.6	Low	70.7	Confident	51 Å²	51	72.7 Å²	72.7	27%	0.267	39%	0.388	S	S	.	.	H	α-helix	trans	-72.6	-38.7	176.4	-65.6	161.2	0	0	0	112.3	E168 L560 S570 S576	E168-L572 HydrophobicContact CB-CD1 4.05Å; E168-L572 HydrophobicContact CG-CD1 3.97Å; L560-L572 HydrophobicContact CD2-CD1 3.81Å; S570-L572 PolarHBondContact O-N 3.3Å; S570-L572 WeakPolarHBondContact OG-CB 3.32Å; S570-L572 PolarHBondContact OG-N 3.47Å; S570-L572 VanDerWaalsContact OG-N 3.09Å; L572-S576 PolarHBondContact O-N 3.35Å; L572-S576 PolarHBondContact O-OG 3.23Å
573	Q	70.6	Confident	71.2	Confident	99 Å²	99	74.2 Å²	74.2	46%	0.463	40%	0.396	S	S	.	.	H	α-helix	trans	-68.7	-42.6	174.3	-70.6	173.7	-9.9	0	0	111.4	N567 S570 S575 S576 Y577	N567-Q573 PolarHBondContact OD1-OE1 2.75Å; S570-Q573 PolarHBondContact O-N 3.29Å; S570-Q573 VanDerWaalsContact O-N 3.13Å; Q573-S575 VanDerWaalsContact C-N 3.33Å; Q573-S575 PolarHBondContact O-N 2.97Å; Q573-S576 WeakPolarHBondContact O-CB 3.36Å; Q573-S576 PolarHBondContact O-N 3.42Å; Q573-Y577 PolarHBondContact O-N 3.09Å
574	A	67	Low	72	Confident	15 Å²	15	67.6 Å²	67.6	12%	0.124	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-42	174.9	0	0	0	0	0	111.6	S570 S576 Y577 N578	S570-A574 PolarHBondContact O-N 2.97Å; A574-S576 PolarHBondContact O-N 2.96Å; A574-Y577 PolarHBondContact O-N 2.94Å; A574-N578 WeakPolarHBondContact O-CB 3.41Å; A574-N578 PolarHBondContact O-N 2.96Å
575	S	70.4	Confident	73.1	Confident	36 Å²	36	70 Å²	70	25%	0.252	38%	0.384	S	S	.	.	H	α-helix	trans	-59.1	-45.5	172.4	-177.1	0	0	0	0	111.9	S571 Q573 Y577 N578 M579	S571-S575 WeakPolarHBondContact O-CB 3.36Å; S571-S575 PolarHBondContact O-N 2.86Å; Q573-S575 VanDerWaalsContact C-N 3.33Å; Q573-S575 PolarHBondContact O-N 2.97Å; S575-Y577 VanDerWaalsContact C-N 3.34Å; S575-Y577 PolarHBondContact O-N 3.29Å; S575-N578 PolarHBondContact O-N 3.16Å; S575-M579 VanDerWaalsContact O-CB 3.3Å; S575-M579 WeakPolarHBondContact O-CB 3.24Å; S575-M579 PolarHBondContact O-N 3.39Å
576	S	75.6	Confident	74.4	Confident	76 Å²	76	63.7 Å²	63.7	53%	0.531	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-40.4	177.7	-58.2	0	0	0	0	112.2	L572 Q573 A574 A580	L572-S576 PolarHBondContact O-N 3.35Å; L572-S576 PolarHBondContact O-OG 3.23Å; Q573-S576 WeakPolarHBondContact O-CB 3.36Å; Q573-S576 PolarHBondContact O-N 3.42Å; A574-S576 PolarHBondContact O-N 2.96Å; S576-A580 WeakPolarHBondContact O-CB 3.22Å; S576-A580 PolarHBondContact O-N 2.89Å
577	Y	79.5	Confident	75.7	Confident	155 Å²	155	65.3 Å²	65.3	61%	0.608	37%	0.367	S	S	*	.	H	α-helix	trans	-65	-48.8	175.1	179.7	-89.8	0	0	0	111.8	Q573 A574 S575 M579 A580 L581	Q573-Y577 PolarHBondContact O-N 3.09Å; A574-Y577 PolarHBondContact O-N 2.94Å; S575-Y577 VanDerWaalsContact C-N 3.34Å; S575-Y577 PolarHBondContact O-N 3.29Å; Y577-M579 VanDerWaalsContact C-N 3.29Å; Y577-M579 PolarHBondContact O-N 3.49Å; Y577-A580 PolarHBondContact O-N 3.44Å; Y577-A580 VanDerWaalsContact O-N 3.16Å; Y577-L581 HydrophobicContact CE1-CB 4.5Å; Y577-L581 HydrophobicContact CE1-CD2 4.21Å; Y577-L581 WeakPolarHBondContact O-CB 3.31Å; Y577-L581 PolarHBondContact O-N 2.84Å
578	N	76.9	Confident	76.9	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.214	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-38.9	178	-78.6	-18.2	0	0	0	111.6	T509 A574 S575 L581 N582	T509-N578 PolarHBondContact O-ND2 2.86Å; A574-N578 WeakPolarHBondContact O-CB 3.41Å; A574-N578 PolarHBondContact O-N 2.96Å; S575-N578 PolarHBondContact O-N 3.16Å; N578-L581 PolarHBondContact O-N 3.49Å; N578-N582 VanDerWaalsContact O-CB 3.24Å; N578-N582 WeakPolarHBondContact O-CB 3.12Å; N578-N582 PolarHBondContact O-N 3.27Å; N578-N582 PolarHBondContact O-ND2 3.02Å
579	M	79.9	Confident	78.1	Confident	107 Å²	107	67.3 Å²	67.3	53%	0.527	39%	0.385	S	S	.	.	H	α-helix	trans	-62.4	-48	173.5	-175.2	179.7	-66.4	0	0	111.1	S575 Y577 L581 N582 H583	S575-M579 VanDerWaalsContact O-CB 3.3Å; S575-M579 WeakPolarHBondContact O-CB 3.24Å; S575-M579 PolarHBondContact O-N 3.39Å; Y577-M579 VanDerWaalsContact C-N 3.29Å; Y577-M579 PolarHBondContact O-N 3.49Å; M579-L581 PolarHBondContact O-N 3.35Å; M579-N582 PolarHBondContact O-N 3.3Å; M579-H583 VanDerWaalsContact CG-CD2 3.49Å; M579-H583 WeakPolarHBondContact CG-CD2 3.45Å; M579-H583 VanDerWaalsContact CG-NE2 3.32Å; M579-H583 WeakPolarHBondContact CG-NE2 3.48Å; M579-H583 WeakPolarHBondContact O-CB 3.32Å; M579-H583 PolarHBondContact O-CD2 2.8Å; M579-H583 VanDerWaalsContact O-CG 3.25Å; M579-H583 PolarHBondContact O-N 2.83Å
580	A	84.3	Confident	79.5	Confident	52 Å²	52	69 Å²	69	43%	0.43	39%	0.388	S	S	.	.	H	α-helix	trans	-60.5	-46	176.6	0	0	0	0	0	112	S576 Y577 H583 C584	S576-A580 WeakPolarHBondContact O-CB 3.22Å; S576-A580 PolarHBondContact O-N 2.89Å; Y577-A580 PolarHBondContact O-N 3.44Å; Y577-A580 VanDerWaalsContact O-N 3.16Å; A580-H583 PolarHBondContact O-N 3.02Å; A580-C584 WeakPolarHBondContact O-CB 3.31Å; A580-C584 PolarHBondContact O-N 3.07Å; A580-C584 PolarHBondContact O-SG 3.19Å
581	L	85.4	Confident	80.3	Confident	65 Å²	65	76.9 Å²	76.9	34%	0.34	42%	0.424	S	S	.	.	H	α-helix	trans	-62	-49.2	178.2	-178.6	64.9	0	0	0	111.6	Y577 N578 M579 H583 C584 V585	Y577-L581 HydrophobicContact CE1-CB 4.5Å; Y577-L581 HydrophobicContact CE1-CD2 4.21Å; Y577-L581 WeakPolarHBondContact O-CB 3.31Å; Y577-L581 PolarHBondContact O-N 2.84Å; N578-L581 PolarHBondContact O-N 3.49Å; M579-L581 PolarHBondContact O-N 3.35Å; L581-H583 VanDerWaalsContact C-N 3.3Å; L581-H583 PolarHBondContact O-N 3.27Å; L581-C584 WeakPolarHBondContact O-CB 3.41Å; L581-C584 PolarHBondContact O-N 3.46Å; L581-C584 VanDerWaalsContact O-N 3.15Å; L581-V585 HydrophobicContact CD1-CG2 4.25Å; L581-V585 HydrophobicContact CG-CG2 4.45Å; L581-V585 WeakPolarHBondContact O-CG2 3.32Å; L581-V585 PolarHBondContact O-N 3.19Å
582	N	84.8	Confident	80.7	Confident	111 Å²	111	83.1 Å²	83.1	59%	0.594	46%	0.457	S	S	*	.	H	α-helix	trans	-61.3	-39.5	178.7	-74.1	-18.3	0	0	0	111.7	N578 M579 G586	N578-N582 VanDerWaalsContact O-CB 3.24Å; N578-N582 WeakPolarHBondContact O-CB 3.12Å; N578-N582 PolarHBondContact O-N 3.27Å; N578-N582 PolarHBondContact O-ND2 3.02Å; M579-N582 PolarHBondContact O-N 3.3Å; N582-G586 PolarHBondContact O-N 3.31Å
583	H	88.1	Confident	81.2	Confident	124 Å²	124	84.3 Å²	84.3	57%	0.574	46%	0.461	S	S	*	.	H	α-helix	trans	-66.1	-43	173.8	-70.8	-45.8	0	0	0	112.1	M579 A580 L581 G586 L587	M579-H583 VanDerWaalsContact CG-CD2 3.49Å; M579-H583 WeakPolarHBondContact CG-CD2 3.45Å; M579-H583 VanDerWaalsContact CG-NE2 3.32Å; M579-H583 WeakPolarHBondContact CG-NE2 3.48Å; M579-H583 WeakPolarHBondContact O-CB 3.32Å; M579-H583 PolarHBondContact O-CD2 2.8Å; M579-H583 VanDerWaalsContact O-CG 3.25Å; M579-H583 PolarHBondContact O-N 2.83Å; A580-H583 PolarHBondContact O-N 3.02Å; L581-H583 VanDerWaalsContact C-N 3.3Å; L581-H583 PolarHBondContact O-N 3.27Å; H583-G586 PolarHBondContact O-N 2.9Å; H583-L587 WeakPolarHBondContact O-CG 3.4Å; H583-L587 PolarHBondContact O-N 2.65Å; H583-L587 VanDerWaalsContact O-N 3.14Å
584	C	87.8	Confident	81.4	Confident	28 Å²	28	81.7 Å²	81.7	19%	0.189	45%	0.452	C	S	.	.	H	α-helix	trans	-61.3	-44.4	175.8	-70.6	0	0	0	0	112.2	A580 L581 L587	A580-C584 WeakPolarHBondContact O-CB 3.31Å; A580-C584 PolarHBondContact O-N 3.07Å; A580-C584 PolarHBondContact O-SG 3.19Å; L581-C584 WeakPolarHBondContact O-CB 3.41Å; L581-C584 PolarHBondContact O-N 3.46Å; L581-C584 VanDerWaalsContact O-N 3.15Å; C584-L587 PolarHBondContact O-N 2.9Å
585	V	88.1	Confident	82	Confident	81 Å²	81	85.8 Å²	85.8	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-67.1	-41.2	177.4	172.5	0	0	0	0	110.8	L581 L587 N588	L581-V585 HydrophobicContact CD1-CG2 4.25Å; L581-V585 HydrophobicContact CG-CG2 4.45Å; L581-V585 WeakPolarHBondContact O-CG2 3.32Å; L581-V585 PolarHBondContact O-N 3.19Å; V585-L587 PolarHBondContact O-N 2.8Å; V585-N588 VanDerWaalsContact O-CB 3.31Å; V585-N588 WeakPolarHBondContact O-CB 2.68Å; V585-N588 PolarHBondContact O-N 3.16Å
586	G	87.3	Confident	82.5	Confident	40 Å²	40	89 Å²	89	41%	0.412	48%	0.481	S	S	.	.	H	α-helix	trans	-59.3	-31.6	176.4	0	0	0	0	0	113.4	N582 H583 N588 V589	N582-G586 PolarHBondContact O-N 3.31Å; H583-G586 PolarHBondContact O-N 2.9Å; G586-N588 PolarHBondContact O-N 3.1Å; G586-V589 PolarHBondContact O-N 2.82Å
587	L	87.4	Confident	83	Confident	75 Å²	75	87.2 Å²	87.2	39%	0.393	46%	0.463	S	S	.	.	H	α-helix	trans	-65.9	-23.4	174.8	-71.3	171	0	0	0	113.3	H583 C584 V585 V589 V590 R687 I688	H583-L587 WeakPolarHBondContact O-CG 3.4Å; H583-L587 PolarHBondContact O-N 2.65Å; H583-L587 VanDerWaalsContact O-N 3.14Å; C584-L587 PolarHBondContact O-N 2.9Å; V585-L587 PolarHBondContact O-N 2.8Å; L587-V589 PolarHBondContact O-N 3.3Å; L587-V590 PolarHBondContact O-N 3.15Å; L587-R687 HydrophobicContact CB-CB 4.21Å; L587-R687 HydrophobicContact CB-CG 4.41Å; L587-R687 WeakPolarHBondContact O-CG 3.49Å; L587-I688 HydrophobicContact CD1-CD1 3.92Å; L587-I688 HydrophobicContact CD1-CG1 3.95Å
588	N	85.5	Confident	83.4	Confident	80 Å²	80	85 Å²	85	43%	0.428	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.7	179.8	-68.1	-20.6	0	0	0	113	V585 G586	V585-N588 VanDerWaalsContact O-CB 3.31Å; V585-N588 WeakPolarHBondContact O-CB 2.68Å; V585-N588 PolarHBondContact O-N 3.16Å; G586-N588 PolarHBondContact O-N 3.1Å
589	V	85.7	Confident	84.1	Confident	131 Å²	131	83.2 Å²	83.2	79%	0.794	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-19.9	179.2	-176.8	0	0	0	0	112	G586 L587	G586-V589 PolarHBondContact O-N 2.82Å; L587-V589 PolarHBondContact O-N 3.3Å
590	V	84.9	Confident	84.7	Confident	76 Å²	76	79.9 Å²	79.9	46%	0.461	43%	0.427	S	S	.	.	S	Bend	trans	-82.8	132.5	-175.7	-175.1	0	0	0	0	110.4	L587	L587-V590 PolarHBondContact O-N 3.15Å
591	E	80.5	Confident	85.2	Confident	170 Å²	170	77.4 Å²	77.4	79%	0.794	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-73.7	147.5	175.1	-65.8	-175.4	173.6	0	0	112.2	H593	E591-H593 PolarHBondContact O-N 3.02Å
592	D	74.9	Confident	85.7	Confident	133 Å²	133	74.3 Å²	74.3	71%	0.711	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-71.7	128.2	178.8	-63.6	-44	0	0	0	110.3	R687	D592-R687 IonicContact OD1-CZ 2.85Å; D592-R687 IonicContact OD1-NH1 2.74Å; D592-R687 PolarHBondContact OD1-NH1 3.2Å; D592-R687 VanDerWaalsContact OD1-NH1 3.09Å; D592-R687 IonicContact OD2-CZ 3.78Å; D592-R687 IonicContact OD2-NH1 3.69Å; D592-R687 PolarHBondContact OD2-NH1 3.12Å
593	H	80.1	Confident	86.3	Confident	76 Å²	76	69 Å²	69	35%	0.352	36%	0.362	S	S	.	.			trans	-135.3	136.3	175.8	-171	-34.4	0	0	0	110.3	E591 K595 N596 Y597	E591-H593 PolarHBondContact O-N 3.02Å; H593-K595 PolarHBondContact ND1-N 3.24Å; H593-K595 PolarHBondContact O-N 2.83Å; H593-N596 WeakPolarHBondContact O-CA 3.29Å; H593-N596 PolarHBondContact O-N 3.13Å; H593-Y597 PolarHBondContact O-N 3.23Å
594	V	76.4	Confident	86.6	Confident	44 Å²	44	63.9 Å²	63.9	27%	0.267	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-44.8	-37.5	176.6	-177	0	0	0	0	114.5	N596 Y597 S977 T980	V594-N596 VanDerWaalsContact C-N 3.28Å; V594-N596 PolarHBondContact O-N 3.26Å; V594-Y597 WeakPolarHBondContact O-CB 3.2Å; V594-Y597 PolarHBondContact O-N 3.38Å; V594-Y597 VanDerWaalsContact O-N 3.12Å; V594-S977 VanDerWaalsContact CG1-O 3.24Å; V594-S977 WeakPolarHBondContact CG1-O 3.36Å; V594-S977 WeakPolarHBondContact CG2-O 3.44Å; V594-T980 HydrophobicContact CB-CG2 3.93Å; V594-T980 HydrophobicContact CG1-CG2 3.71Å
595	K	78.8	Confident	86.7	Confident	101 Å²	101	62.6 Å²	62.6	44%	0.439	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-67.4	-29.3	178.9	-70	176.6	-176.8	162.4	0	113.6	H593 Y597 R598 T980 C983	H593-K595 PolarHBondContact ND1-N 3.24Å; H593-K595 PolarHBondContact O-N 2.83Å; K595-Y597 VanDerWaalsContact C-N 3.3Å; K595-R598 PolarHBondContact O-NH1 3.24Å; K595-T980 HydrophobicContact CG-CG2 4.22Å; K595-C983 PolarHBondContact NZ-SG 3.05Å
596	N	80.6	Confident	86.7	Confident	105 Å²	105	59.3 Å²	59.3	56%	0.561	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-89.5	-2	177.7	-66.6	-20.4	0	0	0	111.7	H593 V594 R598	H593-N596 WeakPolarHBondContact O-CA 3.29Å; H593-N596 PolarHBondContact O-N 3.13Å; V594-N596 VanDerWaalsContact C-N 3.28Å; V594-N596 PolarHBondContact O-N 3.26Å; N596-R598 PolarHBondContact O-N 2.98Å
597	Y	86.3	Confident	86.7	Confident	37 Å²	37	59.7 Å²	59.7	15%	0.145	31%	0.308	C	S	.	.			trans	-55.4	134.3	175.6	-174.1	-84	0	0	0	110.4	H593 V594 K595 N691 L807 V978	H593-Y597 PolarHBondContact O-N 3.23Å; V594-Y597 WeakPolarHBondContact O-CB 3.2Å; V594-Y597 PolarHBondContact O-N 3.38Å; V594-Y597 VanDerWaalsContact O-N 3.12Å; K595-Y597 VanDerWaalsContact C-N 3.3Å; Y597-N691 WeakPolarHBondContact CE2-ND2 3.44Å; Y597-L807 HydrophobicContact CD1-CD2 4.11Å; Y597-L807 HydrophobicContact CE1-CD2 4.23Å; Y597-V978 HydrophobicContact CD1-CB 4.22Å; Y597-V978 HydrophobicContact CD1-CG1 3.41Å; Y597-V978 VanDerWaalsContact CD1-CG1 3.41Å; Y597-V978 HydrophobicContact CD1-CG2 4.17Å; Y597-V978 HydrophobicContact CD2-CG2 4.28Å; Y597-V978 HydrophobicContact CE1-CB 4.21Å; Y597-V978 HydrophobicContact CE1-CG1 3.47Å; Y597-V978 VanDerWaalsContact CE1-CG1 3.47Å; Y597-V978 HydrophobicContact CE1-CG2 3.78Å; Y597-V978 HydrophobicContact CE2-CG2 3.91Å; Y597-V978 HydrophobicContact CG-CG1 4.12Å; Y597-V978 HydrophobicContact CG-CG2 4.39Å
598	R	88.1	Confident	86.7	Confident	110 Å²	110	56.1 Å²	56.1	42%	0.415	29%	0.289	S	S	.	.			trans	-133.8	136	173	-65.1	-63.9	-179.4	-87.4	-3.7	107.4	K595 N596 Q600 N691	K595-R598 PolarHBondContact O-NH1 3.24Å; N596-R598 PolarHBondContact O-N 2.98Å; R598-Q600 HydrophobicContact CB-CG 4.47Å; R598-Q600 PolarHBondContact O-N 3.25Å; R598-N691 PolarHBondContact O-ND2 3.05Å
599	P	91.4	Very high	86.7	Confident	1 Å²	1	54 Å²	54	1%	0.006	28%	0.281	C	S	.	.			trans	-70.4	102.4	170.9	27.8	-31.8	0	0	0	108.3	F621 S626 L808 L811	P599-F621 HydrophobicContact CG-CD2 4.44Å; P599-S626 WeakPolarHBondContact O-CB 3.4Å; P599-S626 PolarHBondContact O-OG 3.46Å; P599-L808 HydrophobicContact CB-CD2 4.2Å; P599-L808 HydrophobicContact CG-CD2 4.33Å; P599-L811 HydrophobicContact CG-CD1 3.62Å
600	Q	92.8	Very high	86.8	Confident	38 Å²	38	49.3 Å²	49.3	18%	0.178	25%	0.254	C	S	.	.			trans	-94.1	106.6	177.2	-59.1	-167.5	40.1	0	0	108	R598 L627 K689 P690 N691 V692	R598-Q600 HydrophobicContact CB-CG 4.47Å; R598-Q600 PolarHBondContact O-N 3.25Å; Q600-L627 WeakPolarHBondContact CA-O 3.35Å; Q600-L627 HydrophobicContact CB-CB 3.99Å; Q600-L627 HydrophobicContact CB-CD2 4.38Å; Q600-L627 HydrophobicContact CG-CB 4.01Å; Q600-K689 WeakPolarHBondContact CB-O 3.23Å; Q600-K689 VanDerWaalsContact CD-O 3.22Å; Q600-K689 VanDerWaalsContact OE1-N 3.11Å; Q600-K689 PolarHBondContact OE1-O 3.25Å; Q600-P690 CarbonylContact O-C 3.33Å; Q600-P690 WeakPolarHBondContact O-CA 3.42Å; Q600-N691 WeakPolarHBondContact CA-OD1 3.39Å; Q600-N691 WeakPolarHBondContact CB-OD1 3.4Å; Q600-N691 PolarHBondContact N-OD1 2.91Å; Q600-N691 PolarHBondContact O-N 2.84Å; Q600-N691 PolarHBondContact O-OD1 2.73Å; Q600-N691 VanDerWaalsContact O-OD1 3.07Å; Q600-V692 PolarHBondContact O-N 3.02Å
601	C	94.8	Very high	87.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.2	-166.1	-65	0	0	0	0	113.2	V603 V618 F621 T622 L627 M629 V692 M694	C601-V603 HydrophobicContact CB-CG2 4.18Å; C601-V618 HydrophobicContact CB-CG1 3.72Å; C601-F621 VanDerWaalsContact SG-CE2 3.59Å; C601-T622 HydrophobicContact CB-CG2 4.41Å; C601-L627 PolarHBondContact N-O 2.94Å; C601-M629 PolarHBondContact O-N 3.33Å; C601-V692 CarbonylContact C-O 3.39Å; C601-V692 VanDerWaalsContact CA-O 3.26Å; C601-V692 WeakPolarHBondContact CA-O 3.3Å; C601-M694 HydrophobicContact CB-CG 4.04Å
602	L	96.3	Very high	87.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.2	161.2	178.5	63.5	0	0	0	108.3	L604 M629 L679 L680 P690 V692 L693 M694	L602-L604 HydrophobicContact CG-CD2 4.45Å; L602-M629 CarbonylContact C-O 3.52Å; L602-M629 WeakPolarHBondContact CA-O 3.43Å; L602-M629 HydrophobicContact CD1-CB 4.36Å; L602-M629 HydrophobicContact CD1-CG 4.29Å; L602-M629 HydrophobicContact CD1-SD 4.45Å; L602-L679 HydrophobicContact CD2-CB 4.01Å; L602-L680 HydrophobicContact CD2-CD2 4.03Å; L602-P690 HydrophobicContact CB-CB 3.67Å; L602-P690 HydrophobicContact CB-CG 4.02Å; L602-V692 PolarHBondContact N-O 3.2Å; L602-L693 HydrophobicContact CB-CD1 4.46Å; L602-L693 HydrophobicContact CD2-CD1 4.1Å; L602-L693 HydrophobicContact CG-CD1 4.27Å; L602-M694 PolarHBondContact O-N 3.18Å
603	V	95.8	Very high	88.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.9	-174.8	-166	0	0	0	0	110	C601 T605 L614 V618 M628 M629 C630 G631 M694	C601-V603 HydrophobicContact CB-CG2 4.18Å; V603-T605 HydrophobicContact CB-CG2 4.11Å; V603-T605 HydrophobicContact CG1-CG2 3.52Å; V603-T605 PolarHBondContact O-N 3.1Å; V603-L614 HydrophobicContact CG1-CD2 3.65Å; V603-L614 HydrophobicContact CG1-CG 3.65Å; V603-V618 HydrophobicContact CG1-CG2 4.31Å; V603-V618 HydrophobicContact CG2-CB 4.11Å; V603-V618 HydrophobicContact CG2-CG1 3.76Å; V603-V618 HydrophobicContact CG2-CG2 3.93Å; V603-M628 HydrophobicContact CG2-CE 4.13Å; V603-M628 HydrophobicContact CG2-CG 4.27Å; V603-M629 PolarHBondContact N-O 2.97Å; V603-C630 WeakPolarHBondContact O-CA 3.45Å; V603-G631 PolarHBondContact O-N 3.28Å; V603-M694 HydrophobicContact CB-CB 4.29Å; V603-M694 HydrophobicContact CG1-CB 4.05Å; V603-M694 HydrophobicContact CG2-CB 4.13Å; V603-M694 HydrophobicContact CG2-CG 4.24Å
604	L	94.7	Very high	88.8	Confident	16 Å²	16	32 Å²	32	8%	0.084	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	72.7	176.9	-60.1	-170.5	0	0	0	110.7	L602 G606 R611 V676 L679 L693 M694 M695	L602-L604 HydrophobicContact CG-CD2 4.45Å; L604-G606 VanDerWaalsContact C-N 3.31Å; L604-R611 PolarHBondContact O-NH1 3.38Å; L604-V676 HydrophobicContact CD1-CB 4.44Å; L604-V676 HydrophobicContact CD1-CG1 3.86Å; L604-V676 HydrophobicContact CD1-CG2 3.61Å; L604-V676 HydrophobicContact CD2-CG1 4.49Å; L604-V676 HydrophobicContact CD2-CG2 4.19Å; L604-L679 HydrophobicContact CD2-CD1 4.22Å; L604-L693 HydrophobicContact CD1-CD1 4.01Å; L604-L693 HydrophobicContact CD2-CD1 4.31Å; L604-L693 HydrophobicContact CG-CD1 3.84Å; L604-M694 PolarHBondContact N-O 2.94Å; L604-M695 HydrophobicContact CD1-CE 4.04Å; L604-M695 HydrophobicContact CD1-CG 3.88Å; L604-M695 HydrophobicContact CD1-SD 4.14Å; L604-M695 HydrophobicContact CG-CG 4.34Å
605	T	89.6	Confident	89.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.			trans	-76.8	-20	179.9	54.7	0	0	0	0	112.9	V603 L615 G631	V603-T605 HydrophobicContact CB-CG2 4.11Å; V603-T605 HydrophobicContact CG1-CG2 3.52Å; V603-T605 PolarHBondContact O-N 3.1Å; T605-L615 HydrophobicContact CG2-CB 4.34Å; T605-L615 HydrophobicContact CG2-CD1 3.99Å; T605-G631 PolarHBondContact N-O 2.61Å
606	G	88.3	Confident	90.2	Very high	12 Å²	12	25.2 Å²	25.2	12%	0.124	13%	0.13	C	C	.	.	S	Bend	trans	63	-144.4	-155.7	0	0	0	0	0	108.9	L604 G631 N632	L604-G606 VanDerWaalsContact C-N 3.31Å; G606-G631 PolarHBondContact N-O 3.22Å; G606-N632 VanDerWaalsContact C-CG 3.5Å; G606-N632 VanDerWaalsContact CA-OD1 3.26Å; G606-N632 WeakPolarHBondContact CA-OD1 3.44Å
607	P	87.8	Confident	90.7	Very high	49 Å²	49	20.3 Å²	20.3	32%	0.318	10%	0.104	S	C	.	.	S	Bend	trans	-54.1	127.3	165.1	-23.2	34.5	0	0	0	110	S609 S610 N632	P607-S609 PolarHBondContact O-N 2.73Å; P607-S610 WeakPolarHBondContact O-CB 3.31Å; P607-S610 PolarHBondContact O-N 3.08Å; P607-N632 WeakPolarHBondContact CD-OD1 3.39Å
608	P	87.7	Confident	91	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.7	-175.1	-30.2	37.2	0	0	0	114.9	S610 H651 W654 L655 Y664	P608-S610 VanDerWaalsContact C-N 3.32Å; P608-H651 HydrophobicContact CG-CB 4.08Å; P608-W654 HydrophobicContact CB-CE3 3.81Å; P608-W654 HydrophobicContact CB-CZ3 3.86Å; P608-W654 VanDerWaalsContact O-CH2 3.3Å; P608-W654 WeakPolarHBondContact O-CH2 3.42Å; P608-W654 WeakPolarHBondContact O-CZ3 3.08Å; P608-L655 HydrophobicContact CB-CD2 4.03Å; P608-L655 HydrophobicContact CB-CG 4.25Å; P608-L655 HydrophobicContact CG-CD1 4.41Å; P608-L655 HydrophobicContact CG-CG 4.43Å; P608-Y664 HydrophobicContact CG-CD2 3.9Å; P608-Y664 HydrophobicContact CG-CE2 4.05Å
609	S	86.2	Confident	91.3	Very high	36 Å²	36	13.9 Å²	13.9	25%	0.252	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-24.7	175.2	50.9	0	0	0	0	113.9	P607	P607-S609 PolarHBondContact O-N 2.73Å
610	S	88	Confident	91.2	Very high	32 Å²	32	14.2 Å²	14.2	22%	0.224	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-36.9	-174	-171.6	0	0	0	0	112.3	P607 P608 P612 V736	P607-S610 WeakPolarHBondContact O-CB 3.31Å; P607-S610 PolarHBondContact O-N 3.08Å; P608-S610 VanDerWaalsContact C-N 3.32Å; S610-P612 VanDerWaalsContact C-CD 3.41Å; S610-P612 WeakPolarHBondContact O-CD 3.17Å; S610-V736 PolarHBondContact O-N 3.2Å
611	R	89.8	Confident	91.1	Very high	71 Å²	71	12.4 Å²	12.4	27%	0.268	7%	0.074	S	C	.	.			trans	-124.6	62.4	-178.2	-62.3	-177.8	-179.9	125.7	14.6	113.3	L604 A613 L614 L615 L734 D735	L604-R611 PolarHBondContact O-NH1 3.38Å; R611-A613 VanDerWaalsContact C-N 3.27Å; R611-A613 PolarHBondContact O-N 3.14Å; R611-L614 HydrophobicContact CB-CB 4.39Å; R611-L614 PolarHBondContact O-N 3.22Å; R611-L615 PolarHBondContact O-N 3.4Å; R611-L734 HydrophobicContact CG-CB 4.33Å; R611-D735 IonicContact CZ-OD1 3.83Å; R611-D735 VanDerWaalsContact CZ-OD1 3.23Å; R611-D735 IonicContact NE-OD1 3.44Å; R611-D735 PolarHBondContact NE-OD1 2.94Å; R611-D735 IonicContact NH2-OD1 3.65Å; R611-D735 PolarHBondContact NH2-OD1 3.41Å; R611-D735 IonicContact NH2-OD2 3.92Å
612	P	90.3	Very high	90.8	Very high	5 Å²	5	12.5 Å²	12.5	3%	0.032	8%	0.075	C	C	.	.	H	α-helix	trans	-64.4	-29.5	-176	25.2	-33.7	0	0	0	113.3	S610 L615 D616 W654 V736 T782	S610-P612 VanDerWaalsContact C-CD 3.41Å; S610-P612 WeakPolarHBondContact O-CD 3.17Å; P612-L615 PolarHBondContact O-N 3Å; P612-D616 WeakPolarHBondContact O-CB 3.34Å; P612-D616 VanDerWaalsContact O-CG 3.27Å; P612-D616 PolarHBondContact O-N 3.45Å; P612-W654 HydrophobicContact CB-CH2 4.11Å; P612-V736 HydrophobicContact CG-CG2 4.2Å; P612-T782 HydrophobicContact CB-CG2 4.02Å; P612-T782 HydrophobicContact CG-CG2 4.2Å
613	A	89.8	Confident	90.3	Very high	13 Å²	13	16.6 Å²	16.6	11%	0.107	9%	0.093	C	C	.	.	H	α-helix	trans	-68.1	-40.5	-178.3	0	0	0	0	0	112.8	R611 L615 D616 L617 L734 T782 F784	R611-A613 VanDerWaalsContact C-N 3.27Å; R611-A613 PolarHBondContact O-N 3.14Å; A613-L615 VanDerWaalsContact C-N 3.35Å; A613-D616 PolarHBondContact O-N 3.18Å; A613-L617 PolarHBondContact O-N 2.63Å; A613-L617 VanDerWaalsContact O-N 3.1Å; A613-L734 HydrophobicContact CB-CD2 3.89Å; A613-T782 HydrophobicContact CB-CG2 3.96Å; A613-F784 HydrophobicContact CB-CD2 4.33Å; A613-F784 HydrophobicContact CB-CE2 4.19Å; A613-F784 VanDerWaalsContact O-CD2 3.26Å; A613-F784 WeakPolarHBondContact O-CD2 3.49Å; A613-F784 WeakPolarHBondContact O-CE2 2.99Å
614	L	91.5	Very high	89.5	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-62.5	-46.4	175.2	-179.3	65.5	0	0	0	110.3	V603 R611 L617 V618 L728 L734	V603-L614 HydrophobicContact CG1-CD2 3.65Å; V603-L614 HydrophobicContact CG1-CG 3.65Å; R611-L614 HydrophobicContact CB-CB 4.39Å; R611-L614 PolarHBondContact O-N 3.22Å; L614-L617 PolarHBondContact O-N 3.49Å; L614-V618 WeakPolarHBondContact O-CG2 3.07Å; L614-V618 PolarHBondContact O-N 3.19Å; L614-L728 HydrophobicContact CB-CD2 4.36Å; L614-L728 HydrophobicContact CD1-CB 3.85Å; L614-L728 HydrophobicContact CD1-CD2 3.84Å; L614-L734 HydrophobicContact CB-CD2 4.45Å
615	L	92.1	Very high	89.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-46.8	178.2	-171.7	82.1	0	0	0	112.5	T605 R611 P612 A613 L617 V618 N619 M628 C630 W654 L655 I660	T605-L615 HydrophobicContact CG2-CB 4.34Å; T605-L615 HydrophobicContact CG2-CD1 3.99Å; R611-L615 PolarHBondContact O-N 3.4Å; P612-L615 PolarHBondContact O-N 3Å; A613-L615 VanDerWaalsContact C-N 3.35Å; L615-L617 PolarHBondContact O-N 2.81Å; L615-V618 PolarHBondContact O-N 2.94Å; L615-N619 VanDerWaalsContact O-CB 3.31Å; L615-N619 WeakPolarHBondContact O-CB 3.27Å; L615-N619 PolarHBondContact O-N 3.21Å; L615-M628 HydrophobicContact CD1-CE 3.17Å; L615-M628 HydrophobicContact CG-CE 3.79Å; L615-C630 WeakPolarHBondContact CD1-SG 3.35Å; L615-W654 HydrophobicContact CD2-CH2 4.15Å; L615-W654 HydrophobicContact CD2-CZ3 3.57Å; L615-L655 HydrophobicContact CD1-CD2 4.04Å; L615-L655 HydrophobicContact CD2-CD2 3.52Å; L615-L655 HydrophobicContact CG-CD2 4.38Å; L615-I660 HydrophobicContact CD2-CD1 3.3Å; L615-I660 HydrophobicContact CD2-CG2 4.44Å; L615-I660 HydrophobicContact CG-CD1 3.77Å; L615-I660 HydrophobicContact CG-CG2 4.34Å
616	D	91.5	Very high	89.1	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.011	14%	0.143	C	C	.	.	H	α-helix	trans	-65.8	-35.9	-179.3	-75.5	-40.1	0	0	0	112.4	P612 A613 C620 R658 T782 F784 Q785	P612-D616 WeakPolarHBondContact O-CB 3.34Å; P612-D616 VanDerWaalsContact O-CG 3.27Å; P612-D616 PolarHBondContact O-N 3.45Å; A613-D616 PolarHBondContact O-N 3.18Å; D616-C620 PolarHBondContact O-N 2.79Å; D616-C620 PolarHBondContact O-SG 3.45Å; D616-R658 IonicContact OD1-NE 3.77Å; D616-R658 PolarHBondContact OD1-NE 3.03Å; D616-R658 IonicContact OD1-NH2 3.99Å; D616-R658 IonicContact OD2-CZ 3.74Å; D616-R658 IonicContact OD2-NE 2.77Å; D616-R658 IonicContact OD2-NH2 2.67Å; D616-R658 PolarHBondContact OD2-NH2 3.47Å; D616-T782 WeakPolarHBondContact OD2-CB 3.5Å; D616-T782 WeakPolarHBondContact OD2-CG2 3.48Å; D616-T782 PolarHBondContact OD2-OG1 2.86Å; D616-F784 HydrophobicContact CB-CB 3.91Å; D616-Q785 HydrophobicContact CB-CG 4.42Å; D616-Q785 PolarHBondContact OD1-NE2 3.41Å; D616-Q785 WeakPolarHBondContact OD2-CG 3.43Å; D616-Q785 PolarHBondContact OD2-NE2 3.42Å; D616-Q785 VanDerWaalsContact OD2-NE2 3.08Å
617	L	92.4	Very high	89.3	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-50.7	174.6	173.7	62.8	0	0	0	111	A613 L614 L615 N619 C620 F621 L728 F784 L812 L969	A613-L617 PolarHBondContact O-N 2.63Å; A613-L617 VanDerWaalsContact O-N 3.1Å; L614-L617 PolarHBondContact O-N 3.49Å; L615-L617 PolarHBondContact O-N 2.81Å; L617-N619 VanDerWaalsContact C-N 3.34Å; L617-N619 PolarHBondContact O-N 2.87Å; L617-C620 VanDerWaalsContact O-CB 3.27Å; L617-C620 WeakPolarHBondContact O-CB 3.31Å; L617-C620 PolarHBondContact O-N 3.04Å; L617-F621 HydrophobicContact CG-CE1 4.49Å; L617-F621 WeakPolarHBondContact O-CD1 3.47Å; L617-L728 HydrophobicContact CD2-CD1 3.65Å; L617-L728 HydrophobicContact CD2-CD2 3.77Å; L617-L728 HydrophobicContact CD2-CG 4.22Å; L617-F784 HydrophobicContact CB-CD1 3.96Å; L617-F784 HydrophobicContact CB-CD2 4.05Å; L617-F784 HydrophobicContact CB-CE1 4.07Å; L617-F784 HydrophobicContact CB-CE2 4.1Å; L617-F784 HydrophobicContact CB-CG 4Å; L617-F784 HydrophobicContact CB-CZ 4.13Å; L617-F784 HydrophobicContact CD1-CD1 3.71Å; L617-F784 HydrophobicContact CD1-CE1 3.62Å; L617-F784 HydrophobicContact CD1-CZ 4.34Å; L617-F784 HydrophobicContact CD2-CE1 4.33Å; L617-F784 HydrophobicContact CD2-CZ 4.28Å; L617-F784 HydrophobicContact CG-CD1 4.37Å; L617-F784 HydrophobicContact CG-CE1 4.2Å; L617-F784 HydrophobicContact CG-CZ 4.47Å; L617-L812 HydrophobicContact CD1-CD1 4.48Å; L617-L812 HydrophobicContact CD1-CD2 4.43Å; L617-L969 HydrophobicContact CD2-CD1 4.29Å
618	V	93.3	Very high	89.6	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.5	-44.5	-178.5	178.6	0	0	0	0	110.7	C601 V603 L614 L615 C620 F621 T622 M628 M694	C601-V618 HydrophobicContact CB-CG1 3.72Å; V603-V618 HydrophobicContact CG1-CG2 4.31Å; V603-V618 HydrophobicContact CG2-CB 4.11Å; V603-V618 HydrophobicContact CG2-CG1 3.76Å; V603-V618 HydrophobicContact CG2-CG2 3.93Å; L614-V618 WeakPolarHBondContact O-CG2 3.07Å; L614-V618 PolarHBondContact O-N 3.19Å; L615-V618 PolarHBondContact O-N 2.94Å; V618-C620 PolarHBondContact O-N 2.97Å; V618-C620 VanDerWaalsContact O-N 3.12Å; V618-F621 HydrophobicContact CB-CE1 4.43Å; V618-F621 HydrophobicContact CB-CZ 4.16Å; V618-F621 HydrophobicContact CG1-CE2 4.16Å; V618-F621 HydrophobicContact CG1-CZ 3.95Å; V618-F621 HydrophobicContact CG2-CE1 4.44Å; V618-F621 HydrophobicContact CG2-CZ 4.13Å; V618-F621 PolarHBondContact O-N 3.02Å; V618-F621 VanDerWaalsContact O-N 3.07Å; V618-T622 HydrophobicContact CG1-CG2 3.73Å; V618-T622 PolarHBondContact O-N 3.21Å; V618-T622 PolarHBondContact O-OG1 2.87Å; V618-M628 HydrophobicContact CB-CE 4Å; V618-M628 HydrophobicContact CB-SD 4.36Å; V618-M628 HydrophobicContact CG1-CE 4.05Å; V618-M628 HydrophobicContact CG1-CG 4.02Å; V618-M628 HydrophobicContact CG1-SD 3.95Å; V618-M694 HydrophobicContact CG2-CB 4.17Å; V618-M694 HydrophobicContact CG2-CG 3.63Å; V618-M694 HydrophobicContact CG2-SD 4.13Å
619	N	92.4	Very high	89.9	Confident	12 Å²	12	24.8 Å²	24.8	6%	0.064	13%	0.132	C	C	.	.	H	α-helix	trans	-57.7	-27.3	175	-176.2	47.2	0	0	0	112.6	L615 L617 F621 T622 K623 M628 I660	L615-N619 VanDerWaalsContact O-CB 3.31Å; L615-N619 WeakPolarHBondContact O-CB 3.27Å; L615-N619 PolarHBondContact O-N 3.21Å; L617-N619 VanDerWaalsContact C-N 3.34Å; L617-N619 PolarHBondContact O-N 2.87Å; N619-F621 PolarHBondContact O-N 3.42Å; N619-T622 WeakPolarHBondContact CA-OG1 3.4Å; N619-K623 WeakPolarHBondContact O-CB 3.5Å; N619-K623 PolarHBondContact O-N 3.34Å; N619-M628 HydrophobicContact CB-SD 4.14Å; N619-I660 HydrophobicContact CB-CG2 4.25Å
620	C	90.8	Very high	90.3	Very high	8 Å²	8	23 Å²	23	5%	0.054	12%	0.12	C	C	.	.	H	α-helix	trans	-62.8	-40.5	176.2	-70.8	0	0	0	0	111.9	D616 L617 V618 L812 R815	D616-C620 PolarHBondContact O-N 2.79Å; D616-C620 PolarHBondContact O-SG 3.45Å; L617-C620 VanDerWaalsContact O-CB 3.27Å; L617-C620 WeakPolarHBondContact O-CB 3.31Å; L617-C620 PolarHBondContact O-N 3.04Å; V618-C620 PolarHBondContact O-N 2.97Å; V618-C620 VanDerWaalsContact O-N 3.12Å; C620-L812 HydrophobicContact CB-CD2 3.4Å; C620-R815 WeakPolarHBondContact O-CD 3.28Å; C620-R815 WeakPolarHBondContact O-CG 3.49Å; C620-R815 PolarHBondContact O-NE 3.02Å
621	F	89.2	Confident	90.6	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-96	-25.3	-179.6	58.2	-99.4	0	0	0	113.7	P599 C601 L617 V618 N619 M694 L808 L811 L812 R815	P599-F621 HydrophobicContact CG-CD2 4.44Å; C601-F621 VanDerWaalsContact SG-CE2 3.59Å; L617-F621 HydrophobicContact CG-CE1 4.49Å; L617-F621 WeakPolarHBondContact O-CD1 3.47Å; V618-F621 HydrophobicContact CB-CE1 4.43Å; V618-F621 HydrophobicContact CB-CZ 4.16Å; V618-F621 HydrophobicContact CG1-CE2 4.16Å; V618-F621 HydrophobicContact CG1-CZ 3.95Å; V618-F621 HydrophobicContact CG2-CE1 4.44Å; V618-F621 HydrophobicContact CG2-CZ 4.13Å; V618-F621 PolarHBondContact O-N 3.02Å; V618-F621 VanDerWaalsContact O-N 3.07Å; N619-F621 PolarHBondContact O-N 3.42Å; F621-M694 HydrophobicContact CZ-SD 4.33Å; F621-L808 HydrophobicContact CD2-CD2 3.85Å; F621-L808 HydrophobicContact CE1-CD2 4.46Å; F621-L808 HydrophobicContact CE2-CD2 3.71Å; F621-L808 HydrophobicContact CG-CD2 4.29Å; F621-L808 HydrophobicContact CZ-CD2 4.03Å; F621-L811 HydrophobicContact CB-CB 3.76Å; F621-L811 HydrophobicContact CB-CD1 4.48Å; F621-L812 HydrophobicContact CB-CD2 4.16Å; F621-L812 HydrophobicContact CB-CG 4.29Å; F621-L812 HydrophobicContact CD1-CD2 4.02Å; F621-L812 HydrophobicContact CD1-CG 4.31Å; F621-R815 PolarHBondContact O-NH2 2.87Å
622	T	89.4	Confident	90.7	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.012	10%	0.099	C	C	.	.	H	α-helix	trans	-85.3	-24.4	-179.8	60	0	0	0	0	115	C601 V618 N619 D624 L625 S626 M628	C601-T622 HydrophobicContact CB-CG2 4.41Å; V618-T622 HydrophobicContact CG1-CG2 3.73Å; V618-T622 PolarHBondContact O-N 3.21Å; V618-T622 PolarHBondContact O-OG1 2.87Å; N619-T622 WeakPolarHBondContact CA-OG1 3.4Å; T622-D624 PolarHBondContact O-N 3.46Å; T622-L625 PolarHBondContact O-N 3.15Å; T622-S626 PolarHBondContact O-N 3Å; T622-M628 HydrophobicContact CG2-CB 4.47Å
623	K	84.9	Confident	90.8	Very high	85 Å²	85	19.4 Å²	19.4	37%	0.37	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	119.2	-170.5	175.4	169.5	-174.3	172.3	0	114.9	N619 L625 R815	N619-K623 WeakPolarHBondContact O-CB 3.5Å; N619-K623 PolarHBondContact O-N 3.34Å; K623-L625 PolarHBondContact O-N 3.09Å; K623-L625 VanDerWaalsContact O-N 3.09Å; K623-R815 PolarHBondContact O-NH1 3.1Å; K623-R815 PolarHBondContact O-NH2 3.2Å
624	D	80.9	Confident	90.8	Very high	101 Å²	101	19.8 Å²	19.8	54%	0.54	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	11.6	-180	-51.6	-51.7	0	0	0	114.6	T622 K661	T622-D624 PolarHBondContact O-N 3.46Å; D624-K661 WeakPolarHBondContact OD1-CD 3.45Å; D624-K661 WeakPolarHBondContact OD1-CE 3.19Å; D624-K661 IonicContact OD1-NZ 3.47Å; D624-K661 PolarHBondContact OD1-NZ 3.44Å
625	L	86.1	Confident	90.7	Very high	84 Å²	84	24 Å²	24	44%	0.44	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-40.2	-177.6	-67.9	179.9	0	0	0	113.4	T622 K623 L811 R815	T622-L625 PolarHBondContact O-N 3.15Å; K623-L625 PolarHBondContact O-N 3.09Å; K623-L625 VanDerWaalsContact O-N 3.09Å; L625-L811 HydrophobicContact CD1-CD2 4.28Å; L625-R815 VanDerWaalsContact CD1-NH2 3.29Å
626	S	89.9	Confident	90.4	Very high	23 Å²	23	25.8 Å²	25.8	16%	0.161	15%	0.145	C	C	.	.	S	Bend	trans	-138.5	160.5	-172.5	-52.3	0	0	0	0	111.8	P599 T622	P599-S626 WeakPolarHBondContact O-CB 3.4Å; P599-S626 PolarHBondContact O-OG 3.46Å; T622-S626 PolarHBondContact O-N 3Å
627	L	92.1	Very high	89.9	Confident	20 Å²	20	32.1 Å²	32.1	11%	0.105	18%	0.179	C	C	.	.			trans	-64.1	135.6	171.6	178.7	68.8	0	0	0	110.8	Q600 C601 F663 I688 P690	Q600-L627 WeakPolarHBondContact CA-O 3.35Å; Q600-L627 HydrophobicContact CB-CB 3.99Å; Q600-L627 HydrophobicContact CB-CD2 4.38Å; Q600-L627 HydrophobicContact CG-CB 4.01Å; C601-L627 PolarHBondContact N-O 2.94Å; L627-F663 HydrophobicContact CD1-CD2 3.42Å; L627-F663 VanDerWaalsContact CD1-CD2 3.42Å; L627-F663 HydrophobicContact CD1-CE2 3.54Å; L627-I688 HydrophobicContact CD1-CG2 4.03Å; L627-I688 HydrophobicContact CD2-CG2 3.83Å; L627-I688 HydrophobicContact CG-CG2 4.37Å; L627-P690 HydrophobicContact CD2-CG 4.33Å
628	M	93.9	Very high	89.2	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.1	168.5	-175.1	179	170.3	0	0	108.1	V603 L615 V618 N619 T622 I660 S662 F663	V603-M628 HydrophobicContact CG2-CE 4.13Å; V603-M628 HydrophobicContact CG2-CG 4.27Å; L615-M628 HydrophobicContact CD1-CE 3.17Å; L615-M628 HydrophobicContact CG-CE 3.79Å; V618-M628 HydrophobicContact CB-CE 4Å; V618-M628 HydrophobicContact CB-SD 4.36Å; V618-M628 HydrophobicContact CG1-CE 4.05Å; V618-M628 HydrophobicContact CG1-CG 4.02Å; V618-M628 HydrophobicContact CG1-SD 3.95Å; N619-M628 HydrophobicContact CB-SD 4.14Å; T622-M628 HydrophobicContact CG2-CB 4.47Å; M628-I660 HydrophobicContact CE-CG2 4.32Å; M628-I660 HydrophobicContact SD-CG2 4.27Å; M628-S662 WeakPolarHBondContact O-CA 3.44Å; M628-S662 PolarHBondContact O-OG 3.26Å; M628-F663 PolarHBondContact O-N 3.15Å
629	M	94.3	Very high	88.6	Confident	18 Å²	18	39.6 Å²	39.6	9%	0.089	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.3	178.2	-172	175.4	-62.8	0	0	110	C601 L602 V603 F663 R665 A683 P690	C601-M629 PolarHBondContact O-N 3.33Å; L602-M629 CarbonylContact C-O 3.52Å; L602-M629 WeakPolarHBondContact CA-O 3.43Å; L602-M629 HydrophobicContact CD1-CB 4.36Å; L602-M629 HydrophobicContact CD1-CG 4.29Å; L602-M629 HydrophobicContact CD1-SD 4.45Å; V603-M629 PolarHBondContact N-O 2.97Å; M629-F663 CarbonylContact C-O 3.55Å; M629-F663 WeakPolarHBondContact CA-O 3.49Å; M629-F663 HydrophobicContact CE-CB 4.38Å; M629-F663 HydrophobicContact CG-CB 4.21Å; M629-R665 HydrophobicContact SD-CB 4.21Å; M629-A683 HydrophobicContact CE-CB 4.44Å; M629-A683 HydrophobicContact SD-CB 3.63Å; M629-P690 HydrophobicContact CB-CG 4.49Å
630	C	94.3	Very high	88	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.8	175.2	-60.1	0	0	0	0	109.6	V603 L615 S662 F663 Y664 R665	V603-C630 WeakPolarHBondContact O-CA 3.45Å; L615-C630 WeakPolarHBondContact CD1-SG 3.35Å; C630-S662 PolarHBondContact SG-OG 3.03Å; C630-F663 PolarHBondContact N-O 3.25Å; C630-Y664 HydrophobicContact CB-CD2 4.11Å; C630-Y664 WeakPolarHBondContact O-CA 3.47Å; C630-R665 PolarHBondContact O-N 3.13Å
631	G	93.2	Very high	87.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.2	174.2	0	0	0	0	0	111.5	V603 T605 G606 R665	V603-G631 PolarHBondContact O-N 3.28Å; T605-G631 PolarHBondContact N-O 2.61Å; G606-G631 PolarHBondContact N-O 3.22Å; G631-R665 WeakPolarHBondContact CA-O 3.24Å
632	N	93.3	Very high	87	Confident	9 Å²	9	48.4 Å²	48.4	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.8	170.5	-176.6	28.2	0	0	0	109.7	G606 P607 Y664 R665 G666 V667	G606-N632 VanDerWaalsContact C-CG 3.5Å; G606-N632 VanDerWaalsContact CA-OD1 3.26Å; G606-N632 WeakPolarHBondContact CA-OD1 3.44Å; P607-N632 WeakPolarHBondContact CD-OD1 3.39Å; N632-Y664 HydrophobicContact CB-CE2 3.74Å; N632-Y664 WeakPolarHBondContact CB-OH 3.26Å; N632-Y664 PolarHBondContact ND2-OH 3.34Å; N632-R665 PolarHBondContact N-O 3Å; N632-G666 CarbonylContact O-C 3.52Å; N632-G666 VanDerWaalsContact O-CA 3.29Å; N632-G666 WeakPolarHBondContact O-CA 3.27Å; N632-V667 PolarHBondContact O-N 2.86Å
633	V	92.5	Very high	86.6	Confident	21 Å²	21	52 Å²	52	13%	0.127	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	115.8	176.1	-176.9	0	0	0	0	107.7	V667 A669 L672 V676 L679	V633-V667 WeakPolarHBondContact CA-O 3.47Å; V633-V667 HydrophobicContact CB-CG2 4.23Å; V633-V667 HydrophobicContact CG1-CG2 4.27Å; V633-V667 HydrophobicContact CG2-CG2 3.72Å; V633-A669 HydrophobicContact CG1-CB 4.3Å; V633-L672 HydrophobicContact CB-CD1 3.84Å; V633-L672 HydrophobicContact CG1-CD1 4.21Å; V633-L672 HydrophobicContact CG2-CD1 4.1Å; V633-V676 HydrophobicContact CG2-CG2 3.96Å; V633-L679 HydrophobicContact CG2-CD1 3.91Å
634	V	90.1	Very high	86.4	Confident	22 Å²	22	54.7 Å²	54.7	13%	0.133	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.4	173.6	-178.9	0	0	0	0	107.4	A636 A646 V667 V668 A669	V634-A636 HydrophobicContact CG1-CB 4.3Å; V634-A636 PolarHBondContact O-N 3.28Å; V634-A636 VanDerWaalsContact O-N 3.16Å; V634-A646 HydrophobicContact CB-CB 4.5Å; V634-A646 HydrophobicContact CG2-CB 3.85Å; V634-V667 PolarHBondContact N-O 3.37Å; V634-V668 HydrophobicContact CB-CG2 4.49Å; V634-V668 WeakPolarHBondContact O-CA 3.5Å; V634-A669 PolarHBondContact O-N 2.8Å
635	T	87.9	Confident	86.3	Confident	91 Å²	91	56.9 Å²	56.9	56%	0.558	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	95.3	176.4	51.5	0	0	0	0	109.6	A669	T635-A669 VanDerWaalsContact CA-O 3.29Å; T635-A669 WeakPolarHBondContact CA-O 3.4Å
636	A	85.8	Confident	86	Confident	36 Å²	36	53.1 Å²	53.1	30%	0.298	31%	0.313	S	S	.	.	S	Bend	trans	-161.5	158.2	179	0	0	0	0	0	109.6	V634 A642 V668 A669	V634-A636 HydrophobicContact CG1-CB 4.3Å; V634-A636 PolarHBondContact O-N 3.28Å; V634-A636 VanDerWaalsContact O-N 3.16Å; A636-A642 HydrophobicContact CB-CB 4.02Å; A636-V668 WeakPolarHBondContact O-CG1 3.43Å; A636-A669 PolarHBondContact N-O 3.45Å
637	D	81.6	Confident	85.5	Confident	135 Å²	135	55.4 Å²	55.4	72%	0.722	33%	0.329	S	S	*	.			trans	-64.3	148.4	169.4	-63.2	-40.6	0	0	0	111	S639	D637-S639 PolarHBondContact O-N 3.33Å; D637-S639 PolarHBondContact O-OG 3.36Å
638	S	77.1	Confident	84.9	Confident	119 Å²	119	56.5 Å²	56.5	83%	0.832	34%	0.339	S	S	*	.	S	Bend	trans	-59	95.5	-179	-65.2	0	0	0	0	111.1
639	S	81.8	Confident	84.3	Confident	40 Å²	40	62.4 Å²	62.4	28%	0.28	37%	0.371	S	S	.	.			trans	-130.9	148.8	178.6	54.6	0	0	0	0	110.1	D637 S641 A642 V643	D637-S639 PolarHBondContact O-N 3.33Å; D637-S639 PolarHBondContact O-OG 3.36Å; S639-S641 PolarHBondContact O-N 2.88Å; S639-S641 PolarHBondContact OG-OG 2.87Å; S639-A642 PolarHBondContact O-N 3.15Å; S639-A642 VanDerWaalsContact OG-CB 3.26Å; S639-A642 WeakPolarHBondContact OG-CB 3.26Å; S639-A642 PolarHBondContact OG-N 3.14Å; S639-V643 PolarHBondContact O-N 3.38Å; S639-V643 VanDerWaalsContact O-N 3.12Å
640	P	78	Confident	83.6	Confident	117 Å²	117	64.2 Å²	64.2	76%	0.76	39%	0.385	S	S	*	.	H	α-helix	trans	-54.5	-37.9	179.3	-26.3	34	0	0	0	113	V643 E644	P640-V643 PolarHBondContact O-N 3.39Å; P640-E644 PolarHBondContact O-N 3.46Å
641	S	80	Confident	83.3	Confident	83 Å²	83	65.5 Å²	65.5	58%	0.58	39%	0.391	S	S	*	.	H	α-helix	trans	-68.2	-36.3	177.8	57.4	0	0	0	0	113.3	S639 K645	S639-S641 PolarHBondContact O-N 2.88Å; S639-S641 PolarHBondContact OG-OG 2.87Å; S641-K645 WeakPolarHBondContact O-CB 3.31Å; S641-K645 PolarHBondContact O-N 2.88Å
642	A	79.3	Confident	83	Confident	7 Å²	7	68 Å²	68	6%	0.058	41%	0.406	C	S	.	.	H	α-helix	trans	-67.8	-39.1	174.7	0	0	0	0	0	111.8	A636 S639 K645 A646 V668	A636-A642 HydrophobicContact CB-CB 4.02Å; S639-A642 PolarHBondContact O-N 3.15Å; S639-A642 VanDerWaalsContact OG-CB 3.26Å; S639-A642 WeakPolarHBondContact OG-CB 3.26Å; S639-A642 PolarHBondContact OG-N 3.14Å; A642-K645 PolarHBondContact O-N 2.82Å; A642-A646 WeakPolarHBondContact O-CB 3.42Å; A642-A646 PolarHBondContact O-N 2.93Å; A642-V668 HydrophobicContact CB-CG1 3.97Å; A642-V668 HydrophobicContact CB-CG2 4.15Å; A642-V668 WeakPolarHBondContact O-CG2 3.48Å
643	V	81.4	Confident	82.6	Confident	78 Å²	78	70.4 Å²	70.4	47%	0.473	42%	0.423	S	S	.	.	H	α-helix	trans	-66.6	-42	176.4	177.1	0	0	0	0	111.2	S639 P640 A646 S647 V668	S639-V643 PolarHBondContact O-N 3.38Å; S639-V643 VanDerWaalsContact O-N 3.12Å; P640-V643 PolarHBondContact O-N 3.39Å; V643-A646 PolarHBondContact O-N 2.94Å; V643-S647 WeakPolarHBondContact O-CB 3.2Å; V643-S647 PolarHBondContact O-N 3.27Å; V643-S647 PolarHBondContact O-OG 3.4Å; V643-V668 HydrophobicContact CG2-CG2 4.09Å
644	E	80.1	Confident	82.4	Confident	141 Å²	141	71.1 Å²	71.1	66%	0.659	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-43.6	175.2	-169.6	-179.8	-179.2	0	0	111.5	P640 A646 S647 S648	P640-E644 PolarHBondContact O-N 3.46Å; E644-A646 VanDerWaalsContact C-N 3.33Å; E644-A646 PolarHBondContact O-N 2.88Å; E644-S647 PolarHBondContact O-N 3.35Å; E644-S647 PolarHBondContact O-OG 3.16Å; E644-S648 PolarHBondContact O-N 3.31Å
645	K	79.8	Confident	82.3	Confident	147 Å²	147	70.1 Å²	70.1	64%	0.639	42%	0.418	S	S	*	.	H	α-helix	trans	-61.7	-40.5	175.1	-169.1	176.6	-177.4	179.4	0	112	S641 A642	S641-K645 WeakPolarHBondContact O-CB 3.31Å; S641-K645 PolarHBondContact O-N 2.88Å; A642-K645 PolarHBondContact O-N 2.82Å
646	A	79.3	Confident	82.2	Confident	4 Å²	4	70.9 Å²	70.9	3%	0.033	42%	0.418	C	S	.	.	H	α-helix	trans	-68.1	-36	177.5	0	0	0	0	0	112.6	V634 A642 V643 E644 Y664 G666 V668	V634-A646 HydrophobicContact CB-CB 4.5Å; V634-A646 HydrophobicContact CG2-CB 3.85Å; A642-A646 WeakPolarHBondContact O-CB 3.42Å; A642-A646 PolarHBondContact O-N 2.93Å; V643-A646 PolarHBondContact O-N 2.94Å; E644-A646 VanDerWaalsContact C-N 3.33Å; E644-A646 PolarHBondContact O-N 2.88Å; A646-Y664 WeakPolarHBondContact O-CE1 3.43Å; A646-Y664 PolarHBondContact O-OH 3.12Å; A646-G666 WeakPolarHBondContact O-CA 3.24Å; A646-V668 HydrophobicContact CB-CG2 3.84Å
647	S	79.8	Confident	82.2	Confident	71 Å²	71	74.6 Å²	74.6	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-95.3	6.9	-176	59.7	0	0	0	0	114.9	V643 E644 N649	V643-S647 WeakPolarHBondContact O-CB 3.2Å; V643-S647 PolarHBondContact O-N 3.27Å; V643-S647 PolarHBondContact O-OG 3.4Å; E644-S647 PolarHBondContact O-N 3.35Å; E644-S647 PolarHBondContact O-OG 3.16Å; S647-N649 PolarHBondContact O-N 3.16Å
648	S	80	Confident	82.4	Confident	44 Å²	44	69.2 Å²	69.2	31%	0.308	40%	0.399	S	S	.	.			trans	-55	125.1	-175	-172.4	0	0	0	0	113.7	E644 S650 H651	E644-S648 PolarHBondContact O-N 3.31Å; S648-S650 PolarHBondContact O-N 2.92Å; S648-S650 VanDerWaalsContact O-N 3.12Å; S648-S650 PolarHBondContact OG-N 2.82Å; S648-S650 PolarHBondContact OG-OG 2.72Å; S648-H651 PolarHBondContact O-N 3.21Å
649	N	80.1	Confident	82.8	Confident	127 Å²	127	71.6 Å²	71.6	68%	0.679	40%	0.395	S	S	*	.	H	α-helix	trans	-61.9	-18	174.9	-74.6	-27.6	0	0	0	113.4	S647 H651 V652 S653	S647-N649 PolarHBondContact O-N 3.16Å; N649-H651 PolarHBondContact O-N 2.91Å; N649-V652 PolarHBondContact O-N 2.84Å; N649-V652 VanDerWaalsContact O-N 3.15Å; N649-S653 PolarHBondContact O-N 2.62Å; N649-S653 PolarHBondContact O-OG 2.99Å
650	S	81.3	Confident	83.1	Confident	55 Å²	55	69.8 Å²	69.8	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-55.7	-37.2	177.3	64.2	0	0	0	0	112.6	S648 S653 W654	S648-S650 PolarHBondContact O-N 2.92Å; S648-S650 VanDerWaalsContact O-N 3.12Å; S648-S650 PolarHBondContact OG-N 2.82Å; S648-S650 PolarHBondContact OG-OG 2.72Å; S650-S653 PolarHBondContact O-N 3.03Å; S650-W654 PolarHBondContact O-N 2.95Å
651	H	86.8	Confident	83.5	Confident	27 Å²	27	71 Å²	71	13%	0.125	38%	0.375	C	S	.	.	H	α-helix	trans	-67.6	-39.5	179.3	-64.2	-42.6	0	0	0	112.3	P608 S648 N649 W654 L655 Y664	P608-H651 HydrophobicContact CG-CB 4.08Å; S648-H651 PolarHBondContact O-N 3.21Å; N649-H651 PolarHBondContact O-N 2.91Å; H651-W654 PolarHBondContact O-N 2.99Å; H651-L655 WeakPolarHBondContact O-CG 3.39Å; H651-L655 PolarHBondContact O-N 2.86Å; H651-L655 VanDerWaalsContact O-N 3.14Å; H651-Y664 HydrophobicContact CB-CD1 4.3Å; H651-Y664 HydrophobicContact CB-CD2 4.19Å; H651-Y664 HydrophobicContact CB-CE1 4.14Å; H651-Y664 HydrophobicContact CB-CE2 4.03Å; H651-Y664 HydrophobicContact CB-CG 4.33Å; H651-Y664 AromaticContact CD2-CE1 3.93Å; H651-Y664 AromaticContact CD2-CZ 3.48Å; H651-Y664 VanDerWaalsContact CD2-CZ 3.48Å; H651-Y664 PolarHBondContact CD2-OH 3.27Å; H651-Y664 VanDerWaalsContact CD2-OH 3.22Å; H651-Y664 AromaticContact CG-CZ 3.98Å
652	V	86.7	Confident	84	Confident	55 Å²	55	68.2 Å²	68.2	33%	0.333	36%	0.355	S	S	.	.	H	α-helix	trans	-68.8	-41.9	176.2	-179.2	0	0	0	0	110.6	N649 W654 L655 N656 Y664	N649-V652 PolarHBondContact O-N 2.84Å; N649-V652 VanDerWaalsContact O-N 3.15Å; V652-W654 VanDerWaalsContact C-N 3.31Å; V652-W654 PolarHBondContact O-N 3.45Å; V652-L655 WeakPolarHBondContact O-CB 3.43Å; V652-L655 PolarHBondContact O-N 3.3Å; V652-N656 PolarHBondContact O-N 2.97Å; V652-N656 PolarHBondContact O-ND2 3.4Å; V652-Y664 HydrophobicContact CG2-CD1 4.39Å
653	S	84.8	Confident	84.5	Confident	59 Å²	59	74.4 Å²	74.4	41%	0.413	38%	0.381	S	S	.	.	H	α-helix	trans	-58.4	-43.1	174.8	-60.3	0	0	0	0	111.9	N649 S650 N656 Q657	N649-S653 PolarHBondContact O-N 2.62Å; N649-S653 PolarHBondContact O-OG 2.99Å; S650-S653 PolarHBondContact O-N 3.03Å; S653-N656 PolarHBondContact O-N 3.45Å; S653-Q657 VanDerWaalsContact O-CG 3.32Å; S653-Q657 WeakPolarHBondContact O-CG 3.02Å; S653-Q657 PolarHBondContact O-N 3.18Å
654	W	88.5	Confident	85.1	Confident	35 Å²	35	72.4 Å²	72.4	13%	0.133	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-41.8	176.4	-174.7	95.2	0	0	0	112.6	P608 P612 L615 S650 H651 V652 Q657 R658	P608-W654 HydrophobicContact CB-CE3 3.81Å; P608-W654 HydrophobicContact CB-CZ3 3.86Å; P608-W654 VanDerWaalsContact O-CH2 3.3Å; P608-W654 WeakPolarHBondContact O-CH2 3.42Å; P608-W654 WeakPolarHBondContact O-CZ3 3.08Å; P612-W654 HydrophobicContact CB-CH2 4.11Å; L615-W654 HydrophobicContact CD2-CH2 4.15Å; L615-W654 HydrophobicContact CD2-CZ3 3.57Å; S650-W654 PolarHBondContact O-N 2.95Å; H651-W654 PolarHBondContact O-N 2.99Å; V652-W654 VanDerWaalsContact C-N 3.31Å; V652-W654 PolarHBondContact O-N 3.45Å; W654-Q657 PolarHBondContact O-N 2.8Å; W654-R658 VanDerWaalsContact CZ2-NH1 3.35Å; W654-R658 PolarHBondContact O-N 2.98Å; W654-R658 VanDerWaalsContact O-N 3.08Å
655	L	88.3	Confident	85.6	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-61.7	-43.2	175.2	-71.7	170.8	0	0	0	111.9	P608 L615 H651 V652 R658 K659 I660	P608-L655 HydrophobicContact CB-CD2 4.03Å; P608-L655 HydrophobicContact CB-CG 4.25Å; P608-L655 HydrophobicContact CG-CD1 4.41Å; P608-L655 HydrophobicContact CG-CG 4.43Å; L615-L655 HydrophobicContact CD1-CD2 4.04Å; L615-L655 HydrophobicContact CD2-CD2 3.52Å; L615-L655 HydrophobicContact CG-CD2 4.38Å; H651-L655 WeakPolarHBondContact O-CG 3.39Å; H651-L655 PolarHBondContact O-N 2.86Å; H651-L655 VanDerWaalsContact O-N 3.14Å; V652-L655 WeakPolarHBondContact O-CB 3.43Å; V652-L655 PolarHBondContact O-N 3.3Å; L655-R658 CarbonylContact O-C 3.6Å; L655-R658 PolarHBondContact O-N 3.25Å; L655-K659 PolarHBondContact O-N 3.1Å; L655-K659 VanDerWaalsContact O-N 3.15Å; L655-I660 HydrophobicContact CD2-CB 4.35Å; L655-I660 HydrophobicContact CD2-CG2 4.29Å; L655-I660 PolarHBondContact O-N 3.44Å
656	N	85.9	Confident	86.1	Confident	107 Å²	107	66.5 Å²	66.5	57%	0.572	34%	0.339	S	S	*	.	H	α-helix	trans	-64.4	-43.7	178.1	-74.2	-27.4	0	0	0	111.8	V652 S653 R658 K659	V652-N656 PolarHBondContact O-N 2.97Å; V652-N656 PolarHBondContact O-ND2 3.4Å; S653-N656 PolarHBondContact O-N 3.45Å; N656-R658 VanDerWaalsContact C-N 3.29Å; N656-R658 PolarHBondContact O-N 2.98Å; N656-K659 PolarHBondContact O-N 3.49Å
657	Q	85.6	Confident	86.7	Confident	114 Å²	114	67.2 Å²	67.2	53%	0.533	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-40.5	174.5	-73	172.7	4.8	0	0	111.8	S653 W654 K659	S653-Q657 VanDerWaalsContact O-CG 3.32Å; S653-Q657 WeakPolarHBondContact O-CG 3.02Å; S653-Q657 PolarHBondContact O-N 3.18Å; W654-Q657 PolarHBondContact O-N 2.8Å; Q657-K659 PolarHBondContact O-N 2.89Å
658	R	85.5	Confident	87.3	Confident	23 Å²	23	65 Å²	65	9%	0.087	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.2	177.1	-158	170.5	-179.2	115.7	6	113.7	D616 W654 L655 N656 I660 H780 Q785	D616-R658 IonicContact OD1-NE 3.77Å; D616-R658 PolarHBondContact OD1-NE 3.03Å; D616-R658 IonicContact OD1-NH2 3.99Å; D616-R658 IonicContact OD2-CZ 3.74Å; D616-R658 IonicContact OD2-NE 2.77Å; D616-R658 IonicContact OD2-NH2 2.67Å; D616-R658 PolarHBondContact OD2-NH2 3.47Å; W654-R658 VanDerWaalsContact CZ2-NH1 3.35Å; W654-R658 PolarHBondContact O-N 2.98Å; W654-R658 VanDerWaalsContact O-N 3.08Å; L655-R658 CarbonylContact O-C 3.6Å; L655-R658 PolarHBondContact O-N 3.25Å; N656-R658 VanDerWaalsContact C-N 3.29Å; N656-R658 PolarHBondContact O-N 2.98Å; R658-I660 VanDerWaalsContact C-N 3.33Å; R658-I660 HydrophobicContact CB-CD1 4.17Å; R658-I660 HydrophobicContact CB-CG1 4.23Å; R658-I660 HydrophobicContact CG-CD1 3.82Å; R658-I660 HydrophobicContact CG-CG1 4.19Å; R658-I660 PolarHBondContact O-N 3.02Å; R658-H780 PolarHBondContact NH1-O 3.24Å; R658-H780 PolarHBondContact NH2-O 3.43Å; R658-Q785 VanDerWaalsContact NE-NE2 3.16Å; R658-Q785 VanDerWaalsContact NH2-NE2 3.12Å
659	K	86.6	Confident	87.9	Confident	169 Å²	169	63 Å²	63	74%	0.735	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	38.8	-178.2	-56	-179.6	180	178.5	0	113.3	L655 N656 Q657	L655-K659 PolarHBondContact O-N 3.1Å; L655-K659 VanDerWaalsContact O-N 3.15Å; N656-K659 PolarHBondContact O-N 3.49Å; Q657-K659 PolarHBondContact O-N 2.89Å
660	I	87.6	Confident	88.3	Confident	2 Å²	2	61 Å²	61	1%	0.01	31%	0.306	C	S	.	.			trans	-103.5	116.8	177.2	-60.9	179.3	0	0	0	108.4	L615 N619 M628 L655 R658 S662	L615-I660 HydrophobicContact CD2-CD1 3.3Å; L615-I660 HydrophobicContact CD2-CG2 4.44Å; L615-I660 HydrophobicContact CG-CD1 3.77Å; L615-I660 HydrophobicContact CG-CG2 4.34Å; N619-I660 HydrophobicContact CB-CG2 4.25Å; M628-I660 HydrophobicContact CE-CG2 4.32Å; M628-I660 HydrophobicContact SD-CG2 4.27Å; L655-I660 HydrophobicContact CD2-CB 4.35Å; L655-I660 HydrophobicContact CD2-CG2 4.29Å; L655-I660 PolarHBondContact O-N 3.44Å; R658-I660 VanDerWaalsContact C-N 3.33Å; R658-I660 HydrophobicContact CB-CD1 4.17Å; R658-I660 HydrophobicContact CB-CG1 4.23Å; R658-I660 HydrophobicContact CG-CD1 3.82Å; R658-I660 HydrophobicContact CG-CG1 4.19Å; R658-I660 PolarHBondContact O-N 3.02Å; I660-S662 PolarHBondContact O-N 3.4Å
661	K	86	Confident	88.6	Confident	143 Å²	143	62.3 Å²	62.3	62%	0.622	31%	0.309	S	S	*	.			trans	-84.6	91.7	177.3	-65.4	-177.3	-179.8	-179.6	0	108.8	D624	D624-K661 WeakPolarHBondContact OD1-CD 3.45Å; D624-K661 WeakPolarHBondContact OD1-CE 3.19Å; D624-K661 IonicContact OD1-NZ 3.47Å; D624-K661 PolarHBondContact OD1-NZ 3.44Å
662	S	90.1	Very high	88.8	Confident	24 Å²	24	64.3 Å²	64.3	17%	0.168	32%	0.32	C	S	.	.			trans	-142	148.3	179.9	-175.9	0	0	0	0	110.5	M628 C630 I660	M628-S662 WeakPolarHBondContact O-CA 3.44Å; M628-S662 PolarHBondContact O-OG 3.26Å; C630-S662 PolarHBondContact SG-OG 3.03Å; I660-S662 PolarHBondContact O-N 3.4Å
663	F	91.3	Very high	89	Confident	136 Å²	136	64.4 Å²	64.4	60%	0.596	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	156.9	164.2	-63.3	-80.8	0	0	0	109.8	L627 M628 M629 C630	L627-F663 HydrophobicContact CD1-CD2 3.42Å; L627-F663 VanDerWaalsContact CD1-CD2 3.42Å; L627-F663 HydrophobicContact CD1-CE2 3.54Å; M628-F663 PolarHBondContact O-N 3.15Å; M629-F663 CarbonylContact C-O 3.55Å; M629-F663 WeakPolarHBondContact CA-O 3.49Å; M629-F663 HydrophobicContact CE-CB 4.38Å; M629-F663 HydrophobicContact CG-CB 4.21Å; C630-F663 PolarHBondContact N-O 3.25Å
664	Y	92.5	Very high	89.4	Confident	36 Å²	36	64.5 Å²	64.5	14%	0.141	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.1	175.5	170.7	-97.5	0	0	0	109.2	P608 C630 N632 A646 H651 V652	P608-Y664 HydrophobicContact CG-CD2 3.9Å; P608-Y664 HydrophobicContact CG-CE2 4.05Å; C630-Y664 HydrophobicContact CB-CD2 4.11Å; C630-Y664 WeakPolarHBondContact O-CA 3.47Å; N632-Y664 HydrophobicContact CB-CE2 3.74Å; N632-Y664 WeakPolarHBondContact CB-OH 3.26Å; N632-Y664 PolarHBondContact ND2-OH 3.34Å; A646-Y664 WeakPolarHBondContact O-CE1 3.43Å; A646-Y664 PolarHBondContact O-OH 3.12Å; H651-Y664 HydrophobicContact CB-CD1 4.3Å; H651-Y664 HydrophobicContact CB-CD2 4.19Å; H651-Y664 HydrophobicContact CB-CE1 4.14Å; H651-Y664 HydrophobicContact CB-CE2 4.03Å; H651-Y664 HydrophobicContact CB-CG 4.33Å; H651-Y664 AromaticContact CD2-CE1 3.93Å; H651-Y664 AromaticContact CD2-CZ 3.48Å; H651-Y664 VanDerWaalsContact CD2-CZ 3.48Å; H651-Y664 PolarHBondContact CD2-OH 3.27Å; H651-Y664 VanDerWaalsContact CD2-OH 3.22Å; H651-Y664 AromaticContact CG-CZ 3.98Å; V652-Y664 HydrophobicContact CG2-CD1 4.39Å
665	R	91.4	Very high	89.6	Confident	146 Å²	146	62.8 Å²	62.8	55%	0.551	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	113.5	177.2	-174	66.3	173.7	-177.5	-0.2	109.5	M629 C630 G631 N632 L679	M629-R665 HydrophobicContact SD-CB 4.21Å; C630-R665 PolarHBondContact O-N 3.13Å; G631-R665 WeakPolarHBondContact CA-O 3.24Å; N632-R665 PolarHBondContact N-O 3Å; R665-L679 HydrophobicContact CB-CD2 4.15Å; R665-L679 HydrophobicContact CG-CD2 3.66Å
666	G	91.1	Very high	89.8	Confident	18 Å²	18	62.8 Å²	62.8	19%	0.186	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139.1	168.3	0	0	0	0	0	111.1	N632 A646	N632-G666 CarbonylContact O-C 3.52Å; N632-G666 VanDerWaalsContact O-CA 3.29Å; N632-G666 WeakPolarHBondContact O-CA 3.27Å; A646-G666 WeakPolarHBondContact O-CA 3.24Å
667	V	91.9	Very high	90.2	Very high	19 Å²	19	60.2 Å²	60.2	12%	0.115	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.7	171.2	-64.6	0	0	0	0	109.7	N632 V633 V634 L679	N632-V667 PolarHBondContact O-N 2.86Å; V633-V667 WeakPolarHBondContact CA-O 3.47Å; V633-V667 HydrophobicContact CB-CG2 4.23Å; V633-V667 HydrophobicContact CG1-CG2 4.27Å; V633-V667 HydrophobicContact CG2-CG2 3.72Å; V634-V667 PolarHBondContact N-O 3.37Å; V667-L679 HydrophobicContact CG1-CD2 3.63Å; V667-L679 HydrophobicContact CG1-CG 3.98Å; V667-L679 HydrophobicContact CG2-CD1 3.93Å; V667-L679 HydrophobicContact CG2-CD2 4.27Å; V667-L679 HydrophobicContact CG2-CG 3.83Å
668	V	92.1	Very high	90.6	Very high	24 Å²	24	60.1 Å²	60.1	15%	0.145	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.6	173.5	-177.2	0	0	0	0	107.1	V634 A636 A642 V643 A646	V634-V668 HydrophobicContact CB-CG2 4.49Å; V634-V668 WeakPolarHBondContact O-CA 3.5Å; A636-V668 WeakPolarHBondContact O-CG1 3.43Å; A642-V668 HydrophobicContact CB-CG1 3.97Å; A642-V668 HydrophobicContact CB-CG2 4.15Å; A642-V668 WeakPolarHBondContact O-CG2 3.48Å; V643-V668 HydrophobicContact CG2-CG2 4.09Å; A646-V668 HydrophobicContact CB-CG2 3.84Å
669	A	91.1	Very high	91	Very high	3 Å²	3	59.1 Å²	59.1	3%	0.025	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	154.7	179.9	0	0	0	0	0	109.8	V633 V634 T635 A636 D671 C674 G675	V633-A669 HydrophobicContact CG1-CB 4.3Å; V634-A669 PolarHBondContact O-N 2.8Å; T635-A669 VanDerWaalsContact CA-O 3.29Å; T635-A669 WeakPolarHBondContact CA-O 3.4Å; A636-A669 PolarHBondContact N-O 3.45Å; A669-D671 VanDerWaalsContact C-N 3.3Å; A669-D671 PolarHBondContact O-N 3.12Å; A669-C674 HydrophobicContact CB-CB 4.42Å; A669-G675 VanDerWaalsContact CB-CA 3.44Å
670	P	88.6	Confident	91.3	Very high	85 Å²	85	51.4 Å²	51.4	55%	0.552	26%	0.258	S	S	*	.	S	Bend	trans	-63.7	-39.4	176.3	25.2	-33.5	0	0	0	111.4
671	D	89	Confident	91.4	Very high	83 Å²	83	57.7 Å²	57.7	44%	0.444	29%	0.287	S	S	.	.	S	Bend	trans	-126	151.5	-178	-65.2	-66.8	0	0	0	112.3	A669 R673 C674 G675	A669-D671 VanDerWaalsContact C-N 3.3Å; A669-D671 PolarHBondContact O-N 3.12Å; D671-R673 VanDerWaalsContact C-N 3.28Å; D671-R673 PolarHBondContact O-N 3.42Å; D671-C674 PolarHBondContact O-N 3.45Å; D671-G675 PolarHBondContact O-N 3Å
672	L	90.3	Very high	91.6	Very high	68 Å²	68	53.6 Å²	53.6	36%	0.356	29%	0.286	S	S	.	.	H	α-helix	trans	-57	-41.9	176.9	-178.6	64.2	0	0	0	111.9	V633 G675 V676 I714	V633-L672 HydrophobicContact CB-CD1 3.84Å; V633-L672 HydrophobicContact CG1-CD1 4.21Å; V633-L672 HydrophobicContact CG2-CD1 4.1Å; L672-G675 PolarHBondContact O-N 3.4Å; L672-V676 HydrophobicContact CD1-CG2 4.1Å; L672-V676 HydrophobicContact CG-CG2 4.35Å; L672-V676 WeakPolarHBondContact O-CB 3.43Å; L672-V676 VanDerWaalsContact O-CG2 3.27Å; L672-V676 WeakPolarHBondContact O-CG2 3.48Å; L672-V676 PolarHBondContact O-N 3Å; L672-I714 HydrophobicContact CD2-CD1 4.14Å; L672-I714 HydrophobicContact CG-CD1 3.94Å
673	R	92	Very high	91.6	Very high	58 Å²	58	53 Å²	53	22%	0.219	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-51.4	179.7	-177.8	-171.7	177.9	166.9	10.5	111.5	D671 G675 V676 N677 E713 I714 D717	D671-R673 VanDerWaalsContact C-N 3.28Å; D671-R673 PolarHBondContact O-N 3.42Å; R673-G675 VanDerWaalsContact C-N 3.34Å; R673-G675 PolarHBondContact O-N 3.21Å; R673-V676 PolarHBondContact O-N 2.7Å; R673-N677 WeakPolarHBondContact O-CB 3.43Å; R673-N677 PolarHBondContact O-N 3.3Å; R673-E713 VanDerWaalsContact CZ-CB 3.48Å; R673-E713 IonicContact CZ-OE2 3.25Å; R673-E713 VanDerWaalsContact CZ-OE2 3.25Å; R673-E713 IonicContact NH1-OE2 3.09Å; R673-E713 PolarHBondContact NH1-OE2 2.91Å; R673-E713 VanDerWaalsContact NH1-OE2 3.09Å; R673-E713 IonicContact NH2-OE2 2.76Å; R673-E713 PolarHBondContact NH2-OE2 3.38Å; R673-I714 HydrophobicContact CB-CD1 4.48Å; R673-I714 HydrophobicContact CB-CG1 4.13Å; R673-I714 HydrophobicContact CG-CG1 4.12Å; R673-D717 WeakPolarHBondContact CG-OD2 3.41Å; R673-D717 IonicContact CZ-OD1 3.69Å; R673-D717 IonicContact CZ-OD2 3.43Å; R673-D717 IonicContact NE-OD1 3.71Å; R673-D717 IonicContact NE-OD2 3.88Å; R673-D717 PolarHBondContact NE-OD2 3.27Å; R673-D717 IonicContact NH2-OD1 2.82Å; R673-D717 PolarHBondContact NH2-OD1 2.93Å; R673-D717 IonicContact NH2-OD2 2.74Å; R673-D717 PolarHBondContact NH2-OD2 3.45Å
674	C	91.7	Very high	91.5	Very high	60 Å²	60	48.3 Å²	48.3	41%	0.405	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-47.5	178.9	-65.6	0	0	0	0	111.1	A669 D671 V676 N677 M678	A669-C674 HydrophobicContact CB-CB 4.42Å; D671-C674 PolarHBondContact O-N 3.45Å; C674-V676 PolarHBondContact O-N 3.36Å; C674-N677 PolarHBondContact O-N 3.16Å; C674-M678 WeakPolarHBondContact O-CG 3.47Å; C674-M678 PolarHBondContact O-N 3.06Å
675	G	92.2	Very high	91.2	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-39.9	177.9	0	0	0	0	0	113.5	A669 D671 L672 R673 M678 L679	A669-G675 VanDerWaalsContact CB-CA 3.44Å; D671-G675 PolarHBondContact O-N 3Å; L672-G675 PolarHBondContact O-N 3.4Å; R673-G675 VanDerWaalsContact C-N 3.34Å; R673-G675 PolarHBondContact O-N 3.21Å; G675-M678 PolarHBondContact O-N 2.98Å; G675-L679 PolarHBondContact O-N 3Å; G675-L679 VanDerWaalsContact O-N 3.11Å
676	V	94.4	Very high	90.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-39.2	175.2	174.6	0	0	0	0	111.3	L604 V633 L672 R673 C674 M678 L679 L680 I714	L604-V676 HydrophobicContact CD1-CB 4.44Å; L604-V676 HydrophobicContact CD1-CG1 3.86Å; L604-V676 HydrophobicContact CD1-CG2 3.61Å; L604-V676 HydrophobicContact CD2-CG1 4.49Å; L604-V676 HydrophobicContact CD2-CG2 4.19Å; V633-V676 HydrophobicContact CG2-CG2 3.96Å; L672-V676 HydrophobicContact CD1-CG2 4.1Å; L672-V676 HydrophobicContact CG-CG2 4.35Å; L672-V676 WeakPolarHBondContact O-CB 3.43Å; L672-V676 VanDerWaalsContact O-CG2 3.27Å; L672-V676 WeakPolarHBondContact O-CG2 3.48Å; L672-V676 PolarHBondContact O-N 3Å; R673-V676 PolarHBondContact O-N 2.7Å; C674-V676 PolarHBondContact O-N 3.36Å; V676-M678 VanDerWaalsContact C-N 3.32Å; V676-M678 PolarHBondContact O-N 3.2Å; V676-L679 CarbonylContact O-C 3.58Å; V676-L679 WeakPolarHBondContact O-CA 3.44Å; V676-L679 WeakPolarHBondContact O-CB 3.46Å; V676-L679 PolarHBondContact O-N 3.12Å; V676-L680 HydrophobicContact CG1-CD1 3.98Å; V676-L680 HydrophobicContact CG1-CG 4.15Å; V676-L680 WeakPolarHBondContact O-CG 3.46Å; V676-L680 PolarHBondContact O-N 3.33Å; V676-I714 HydrophobicContact CB-CD1 4.3Å; V676-I714 HydrophobicContact CB-CG1 4.26Å; V676-I714 HydrophobicContact CB-CG2 4.31Å; V676-I714 HydrophobicContact CG1-CG1 4.42Å; V676-I714 HydrophobicContact CG1-CG2 3.6Å; V676-I714 HydrophobicContact CG2-CD1 4.09Å
677	N	93.9	Very high	90.6	Very high	52 Å²	52	50.9 Å²	50.9	28%	0.278	30%	0.298	S	S	.	.	H	α-helix	trans	-61.5	-41.4	175.9	-166.9	17.5	0	0	0	111.5	R673 C674 L679 L680 Q681	R673-N677 WeakPolarHBondContact O-CB 3.43Å; R673-N677 PolarHBondContact O-N 3.3Å; C674-N677 PolarHBondContact O-N 3.16Å; N677-L679 VanDerWaalsContact C-N 3.28Å; N677-L679 PolarHBondContact O-N 3.03Å; N677-L680 PolarHBondContact O-N 3.46Å; N677-Q681 PolarHBondContact O-N 3.2Å; N677-Q681 VanDerWaalsContact O-N 3.1Å; N677-Q681 PolarHBondContact OD1-NE2 3.39Å
678	M	93.3	Very high	90.5	Very high	112 Å²	112	52.7 Å²	52.7	55%	0.552	31%	0.307	S	S	*	.	H	α-helix	trans	-58.9	-39	172	-65.2	172.2	87.8	0	0	112.2	C674 G675 V676 G682	C674-M678 WeakPolarHBondContact O-CG 3.47Å; C674-M678 PolarHBondContact O-N 3.06Å; G675-M678 PolarHBondContact O-N 2.98Å; V676-M678 VanDerWaalsContact C-N 3.32Å; V676-M678 PolarHBondContact O-N 3.2Å; M678-G682 WeakPolarHBondContact O-CA 3.22Å; M678-G682 PolarHBondContact O-N 3.33Å
679	L	93.9	Very high	90.4	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-69.7	-41.3	175.7	-72.1	170.7	0	0	0	112.3	L602 L604 V633 R665 V667 G675 V676 N677 Q681 A683	L602-L679 HydrophobicContact CD2-CB 4.01Å; L604-L679 HydrophobicContact CD2-CD1 4.22Å; V633-L679 HydrophobicContact CG2-CD1 3.91Å; R665-L679 HydrophobicContact CB-CD2 4.15Å; R665-L679 HydrophobicContact CG-CD2 3.66Å; V667-L679 HydrophobicContact CG1-CD2 3.63Å; V667-L679 HydrophobicContact CG1-CG 3.98Å; V667-L679 HydrophobicContact CG2-CD1 3.93Å; V667-L679 HydrophobicContact CG2-CD2 4.27Å; V667-L679 HydrophobicContact CG2-CG 3.83Å; G675-L679 PolarHBondContact O-N 3Å; G675-L679 VanDerWaalsContact O-N 3.11Å; V676-L679 CarbonylContact O-C 3.58Å; V676-L679 WeakPolarHBondContact O-CA 3.44Å; V676-L679 WeakPolarHBondContact O-CB 3.46Å; V676-L679 PolarHBondContact O-N 3.12Å; N677-L679 VanDerWaalsContact C-N 3.28Å; N677-L679 PolarHBondContact O-N 3.03Å; L679-Q681 VanDerWaalsContact C-N 3.28Å; L679-Q681 PolarHBondContact O-N 3.26Å; L679-A683 WeakPolarHBondContact O-CB 3.49Å; L679-A683 PolarHBondContact O-N 2.78Å
680	L	93.3	Very high	90.6	Very high	6 Å²	6	57.3 Å²	57.3	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-35.1	-179.7	-72.5	169.4	0	0	0	112.3	L602 V676 N677 L693 A718 L721 Y723	L602-L680 HydrophobicContact CD2-CD2 4.03Å; V676-L680 HydrophobicContact CG1-CD1 3.98Å; V676-L680 HydrophobicContact CG1-CG 4.15Å; V676-L680 WeakPolarHBondContact O-CG 3.46Å; V676-L680 PolarHBondContact O-N 3.33Å; N677-L680 PolarHBondContact O-N 3.46Å; L680-L693 HydrophobicContact CD2-CB 4.42Å; L680-L693 HydrophobicContact CD2-CD1 4.13Å; L680-L693 HydrophobicContact CD2-CD2 4.24Å; L680-L693 HydrophobicContact CD2-CG 4.49Å; L680-A718 HydrophobicContact CD1-CB 4.16Å; L680-L721 HydrophobicContact CB-CD1 3.53Å; L680-L721 HydrophobicContact CD1-CD1 4.15Å; L680-L721 HydrophobicContact CG-CD1 4.42Å; L680-Y723 HydrophobicContact CD2-CD1 4.03Å; L680-Y723 HydrophobicContact CD2-CD2 4.25Å; L680-Y723 HydrophobicContact CD2-CE1 3.98Å; L680-Y723 HydrophobicContact CD2-CE2 4.2Å; L680-Y723 HydrophobicContact CD2-CG 4.17Å; L680-Y723 PolarHBondContact O-OH 3.4Å
681	Q	90.4	Very high	90.8	Very high	134 Å²	134	54.9 Å²	54.9	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-91.3	-33.9	-179.5	-60.2	-176.7	16	0	0	112.9	N677 L679 L721	N677-Q681 PolarHBondContact O-N 3.2Å; N677-Q681 VanDerWaalsContact O-N 3.1Å; N677-Q681 PolarHBondContact OD1-NE2 3.39Å; L679-Q681 VanDerWaalsContact C-N 3.28Å; L679-Q681 PolarHBondContact O-N 3.26Å; Q681-L721 HydrophobicContact CG-CD1 3.79Å; Q681-L721 HydrophobicContact CG-CD2 4.19Å
682	G	88.6	Confident	91	Very high	57 Å²	57	50.9 Å²	50.9	59%	0.588	29%	0.285	S	S	*	.	H	α-helix	trans	-103.3	-2.8	-171.3	0	0	0	0	0	116.2	M678	M678-G682 WeakPolarHBondContact O-CA 3.22Å; M678-G682 PolarHBondContact O-N 3.33Å
683	A	91.3	Very high	91.3	Very high	11 Å²	11	47.7 Å²	47.7	9%	0.091	27%	0.268	C	S	.	.			trans	-82	130.3	179.5	0	0	0	0	0	112.9	M629 L679 P690	M629-A683 HydrophobicContact CE-CB 4.44Å; M629-A683 HydrophobicContact SD-CB 3.63Å; L679-A683 WeakPolarHBondContact O-CB 3.49Å; L679-A683 PolarHBondContact O-N 2.78Å; A683-P690 HydrophobicContact CB-CG 4Å; A683-P690 VanDerWaalsContact O-CD 3.27Å; A683-P690 WeakPolarHBondContact O-CD 3.38Å
684	G	88.1	Confident	91.5	Very high	38 Å²	38	45.1 Å²	45.1	39%	0.392	26%	0.259	S	S	.	.	S	Bend	trans	110.7	-178.2	174.2	0	0	0	0	0	113.9	I688	G684-I688 CarbonylContact C-O 3.59Å; G684-I688 VanDerWaalsContact CA-O 3.22Å; G684-I688 WeakPolarHBondContact CA-O 3.26Å
685	L	87.5	Confident	91.6	Very high	112 Å²	112	42.6 Å²	42.6	59%	0.586	24%	0.241	S	C	*	.	B	Isolated β-bridge	trans	-141.9	119.4	175.9	-176.5	69.8	0	0	0	110.1	R687 I688	L685-R687 PolarHBondContact O-N 3Å; L685-I688 PolarHBondContact N-O 3.36Å; L685-I688 PolarHBondContact O-N 3.46Å
686	G	84.5	Confident	91.6	Very high	45 Å²	45	43.1 Å²	43.1	46%	0.464	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	-127.4	-178.4	0	0	0	0	0	112.1	I688	G686-I688 VanDerWaalsContact C-N 3.3Å; G686-I688 PolarHBondContact O-N 3.17Å
687	R	84.9	Confident	91.6	Very high	98 Å²	98	43.8 Å²	43.8	37%	0.37	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.8	175.8	-64.4	-67.7	-171.5	174.7	-2.1	114.5	L587 D592 L685 K689	L587-R687 HydrophobicContact CB-CB 4.21Å; L587-R687 HydrophobicContact CB-CG 4.41Å; L587-R687 WeakPolarHBondContact O-CG 3.49Å; D592-R687 IonicContact OD1-CZ 2.85Å; D592-R687 IonicContact OD1-NH1 2.74Å; D592-R687 PolarHBondContact OD1-NH1 3.2Å; D592-R687 VanDerWaalsContact OD1-NH1 3.09Å; D592-R687 IonicContact OD2-CZ 3.78Å; D592-R687 IonicContact OD2-NH1 3.69Å; D592-R687 PolarHBondContact OD2-NH1 3.12Å; L685-R687 PolarHBondContact O-N 3Å; R687-K689 PolarHBondContact O-N 2.99Å
688	I	89.4	Confident	91.4	Very high	57 Å²	57	43.1 Å²	43.1	29%	0.292	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-89.4	78.7	176.9	-59.6	173.2	0	0	0	107.7	L587 L627 G684 L685 G686	L587-I688 HydrophobicContact CD1-CD1 3.92Å; L587-I688 HydrophobicContact CD1-CG1 3.95Å; L627-I688 HydrophobicContact CD1-CG2 4.03Å; L627-I688 HydrophobicContact CD2-CG2 3.83Å; L627-I688 HydrophobicContact CG-CG2 4.37Å; G684-I688 CarbonylContact C-O 3.59Å; G684-I688 VanDerWaalsContact CA-O 3.22Å; G684-I688 WeakPolarHBondContact CA-O 3.26Å; L685-I688 PolarHBondContact N-O 3.36Å; L685-I688 PolarHBondContact O-N 3.46Å; G686-I688 VanDerWaalsContact C-N 3.3Å; G686-I688 PolarHBondContact O-N 3.17Å
689	K	90.8	Very high	91	Very high	121 Å²	121	41.5 Å²	41.5	53%	0.526	23%	0.234	S	C	.	.			trans	-135.4	144.2	-179.4	66.5	179.6	-176.9	176.4	0	111.5	Q600 R687	Q600-K689 WeakPolarHBondContact CB-O 3.23Å; Q600-K689 VanDerWaalsContact CD-O 3.22Å; Q600-K689 VanDerWaalsContact OE1-N 3.11Å; Q600-K689 PolarHBondContact OE1-O 3.25Å; R687-K689 PolarHBondContact O-N 2.99Å
690	P	94	Very high	90.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.013	25%	0.252	C	S	.	.			trans	-56	142.9	175.3	-23.3	35.6	0	0	0	111.9	Q600 L602 L627 M629 A683 Y723	Q600-P690 CarbonylContact O-C 3.33Å; Q600-P690 WeakPolarHBondContact O-CA 3.42Å; L602-P690 HydrophobicContact CB-CB 3.67Å; L602-P690 HydrophobicContact CB-CG 4.02Å; L627-P690 HydrophobicContact CD2-CG 4.33Å; M629-P690 HydrophobicContact CB-CG 4.49Å; A683-P690 HydrophobicContact CB-CG 4Å; A683-P690 VanDerWaalsContact O-CD 3.27Å; A683-P690 WeakPolarHBondContact O-CD 3.38Å; P690-Y723 HydrophobicContact CB-CE1 3.99Å; P690-Y723 VanDerWaalsContact O-CE1 3.24Å; P690-Y723 WeakPolarHBondContact O-CE1 3.43Å; P690-Y723 VanDerWaalsContact O-CZ 3.28Å; P690-Y723 PolarHBondContact O-OH 3.37Å; P690-Y723 VanDerWaalsContact O-OH 3.11Å
691	N	92.6	Very high	90.4	Very high	34 Å²	34	44.7 Å²	44.7	18%	0.182	25%	0.251	C	S	.	.			trans	-127.4	-4.4	174.2	62.8	0.9	0	0	0	112.3	Y597 R598 Q600 Y723 G724	Y597-N691 WeakPolarHBondContact CE2-ND2 3.44Å; R598-N691 PolarHBondContact O-ND2 3.05Å; Q600-N691 WeakPolarHBondContact CA-OD1 3.39Å; Q600-N691 WeakPolarHBondContact CB-OD1 3.4Å; Q600-N691 PolarHBondContact N-OD1 2.91Å; Q600-N691 PolarHBondContact O-N 2.84Å; Q600-N691 PolarHBondContact O-OD1 2.73Å; Q600-N691 VanDerWaalsContact O-OD1 3.07Å; N691-Y723 VanDerWaalsContact C-CD1 3.45Å; N691-G724 PolarHBondContact O-N 2.69Å
692	V	94.4	Very high	90	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	120.1	-178.4	169.4	0	0	0	0	109.7	Q600 C601 L602 M694 G724 L804	Q600-V692 PolarHBondContact O-N 3.02Å; C601-V692 CarbonylContact C-O 3.39Å; C601-V692 VanDerWaalsContact CA-O 3.26Å; C601-V692 WeakPolarHBondContact CA-O 3.3Å; L602-V692 PolarHBondContact N-O 3.2Å; V692-M694 HydrophobicContact CG1-CE 3.16Å; V692-M694 HydrophobicContact CG1-SD 4.44Å; V692-G724 CarbonylContact C-O 3.54Å; V692-G724 WeakPolarHBondContact CA-O 3.47Å; V692-L804 HydrophobicContact CG2-CD1 4.43Å; V692-L804 HydrophobicContact CG2-CD2 4.06Å
693	L	96.3	Very high	89.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	119.5	177.2	178	65	0	0	0	110.8	L602 L604 L680 M695 I714 A718 Y723 G724 C726	L602-L693 HydrophobicContact CB-CD1 4.46Å; L602-L693 HydrophobicContact CD2-CD1 4.1Å; L602-L693 HydrophobicContact CG-CD1 4.27Å; L604-L693 HydrophobicContact CD1-CD1 4.01Å; L604-L693 HydrophobicContact CD2-CD1 4.31Å; L604-L693 HydrophobicContact CG-CD1 3.84Å; L680-L693 HydrophobicContact CD2-CB 4.42Å; L680-L693 HydrophobicContact CD2-CD1 4.13Å; L680-L693 HydrophobicContact CD2-CD2 4.24Å; L680-L693 HydrophobicContact CD2-CG 4.49Å; L693-M695 HydrophobicContact CD1-CG 4.34Å; L693-M695 HydrophobicContact CD2-CG 4.16Å; L693-M695 HydrophobicContact CD2-SD 3.72Å; L693-M695 HydrophobicContact CG-CG 3.96Å; L693-M695 HydrophobicContact CG-SD 4.2Å; L693-I714 HydrophobicContact CD2-CG2 4.26Å; L693-A718 HydrophobicContact CD2-CB 3.53Å; L693-Y723 HydrophobicContact CB-CD1 4.38Å; L693-G724 PolarHBondContact N-O 3.21Å; L693-C726 PolarHBondContact O-N 2.65Å
694	M	95.6	Very high	89.3	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.02	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122	175.7	-63.9	-66.3	90.4	0	0	110.9	C601 L602 V603 L604 V618 F621 V692 C726	C601-M694 HydrophobicContact CB-CG 4.04Å; L602-M694 PolarHBondContact O-N 3.18Å; V603-M694 HydrophobicContact CB-CB 4.29Å; V603-M694 HydrophobicContact CG1-CB 4.05Å; V603-M694 HydrophobicContact CG2-CB 4.13Å; V603-M694 HydrophobicContact CG2-CG 4.24Å; L604-M694 PolarHBondContact N-O 2.94Å; V618-M694 HydrophobicContact CG2-CB 4.17Å; V618-M694 HydrophobicContact CG2-CG 3.63Å; V618-M694 HydrophobicContact CG2-SD 4.13Å; F621-M694 HydrophobicContact CZ-SD 4.33Å; V692-M694 HydrophobicContact CG1-CE 3.16Å; V692-M694 HydrophobicContact CG1-SD 4.44Å; M694-C726 WeakPolarHBondContact CA-O 3.22Å; M694-C726 HydrophobicContact CE-CB 3.16Å; M694-C726 WeakPolarHBondContact CE-SG 3.38Å; M694-C726 HydrophobicContact SD-CB 3.82Å
695	M	94.4	Very high	88.9	Confident	7 Å²	7	48.9 Å²	48.9	3%	0.034	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.1	178.9	-61.6	-176.7	67.4	0	0	112	L604 L693 Y711 I714 L715 C726 V727 L728	L604-M695 HydrophobicContact CD1-CE 4.04Å; L604-M695 HydrophobicContact CD1-CG 3.88Å; L604-M695 HydrophobicContact CD1-SD 4.14Å; L604-M695 HydrophobicContact CG-CG 4.34Å; L693-M695 HydrophobicContact CD1-CG 4.34Å; L693-M695 HydrophobicContact CD2-CG 4.16Å; L693-M695 HydrophobicContact CD2-SD 3.72Å; L693-M695 HydrophobicContact CG-CG 3.96Å; L693-M695 HydrophobicContact CG-SD 4.2Å; M695-Y711 HydrophobicContact CE-CD2 3.73Å; M695-Y711 HydrophobicContact CE-CE2 3.47Å; M695-Y711 VanDerWaalsContact CE-CE2 3.47Å; M695-Y711 HydrophobicContact CE-CG 4.49Å; M695-I714 HydrophobicContact CE-CB 4.36Å; M695-I714 HydrophobicContact CE-CG2 3.73Å; M695-I714 HydrophobicContact SD-CG2 3.75Å; M695-L715 HydrophobicContact SD-CD2 3.56Å; M695-L715 VanDerWaalsContact SD-CD2 3.56Å; M695-C726 PolarHBondContact N-O 3.09Å; M695-V727 CarbonylContact O-C 3.6Å; M695-V727 WeakPolarHBondContact O-CA 3.35Å; M695-L728 PolarHBondContact O-N 3.5Å
696	G	93.1	Very high	88.6	Confident	11 Å²	11	46.5 Å²	46.5	11%	0.113	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	145.8	165.2	0	0	0	0	0	111.2	Y711	G696-Y711 WeakPolarHBondContact O-CE2 3.3Å; G696-Y711 PolarHBondContact O-OH 2.76Å
697	F	92.8	Very high	88.6	Confident	15 Å²	15	47.4 Å²	47.4	7%	0.066	24%	0.239	C	C	.	.			trans	-71.2	126.4	173.3	-174.3	-98	0	0	0	111.1	K699 V727 L728 R729 L957 D958 M970	F697-K699 HydrophobicContact CD1-CG 4.11Å; F697-K699 PolarHBondContact O-N 3.07Å; F697-V727 HydrophobicContact CB-CG1 3.87Å; F697-V727 HydrophobicContact CD2-CG1 4.05Å; F697-V727 HydrophobicContact CG-CG1 4.49Å; F697-L728 WeakPolarHBondContact CB-O 3.43Å; F697-L728 PolarHBondContact N-O 3.46Å; F697-R729 HydrophobicContact CB-CB 3.8Å; F697-R729 HydrophobicContact CB-CG 4.03Å; F697-R729 HydrophobicContact CD1-CG 3.99Å; F697-R729 HydrophobicContact CG-CB 4.23Å; F697-R729 HydrophobicContact CG-CG 4.13Å; F697-L957 HydrophobicContact CE2-CB 3.81Å; F697-D958 HydrophobicContact CZ-CB 3.87Å; F697-M970 HydrophobicContact CD2-CE 3.94Å
698	K	89.6	Confident	88.6	Confident	39 Å²	39	42.9 Å²	42.9	17%	0.17	22%	0.223	C	C	.	.			trans	-79.9	107	176.6	-173.3	175.1	172.9	59.5	0	110.3	D700 W701 I707 Y711	K698-D700 WeakPolarHBondContact CG-OD1 3.47Å; K698-D700 IonicContact NZ-OD1 3.12Å; K698-D700 PolarHBondContact NZ-OD1 3.02Å; K698-D700 IonicContact NZ-OD2 3.79Å; K698-D700 PolarHBondContact NZ-OD2 2.77Å; K698-W701 HydrophobicContact CG-CB 4.38Å; K698-I707 HydrophobicContact CD-CG2 4.17Å; K698-Y711 HydrophobicContact CB-CD2 4.23Å; K698-Y711 HydrophobicContact CB-CE2 4.25Å
699	K	85.9	Confident	88.6	Confident	78 Å²	78	41.6 Å²	41.6	34%	0.339	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-34.6	-177.5	-71.7	-174.8	175.4	-177.7	0	114.1	F697 W701 M730 K731 E732 G733	F697-K699 HydrophobicContact CD1-CG 4.11Å; F697-K699 PolarHBondContact O-N 3.07Å; K699-W701 PolarHBondContact O-N 3.04Å; K699-M730 WeakPolarHBondContact CE-O 3.33Å; K699-M730 PolarHBondContact NZ-O 3.24Å; K699-K731 PolarHBondContact NZ-O 2.87Å; K699-E732 PolarHBondContact NZ-O 3.24Å; K699-G733 VanDerWaalsContact NZ-CA 3.3Å
700	D	86.2	Confident	88.5	Confident	73 Å²	73	37.8 Å²	37.8	39%	0.39	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	19.7	-177.1	63.2	-38.2	0	0	0	112.6	K698 R702 S703	K698-D700 WeakPolarHBondContact CG-OD1 3.47Å; K698-D700 IonicContact NZ-OD1 3.12Å; K698-D700 PolarHBondContact NZ-OD1 3.02Å; K698-D700 IonicContact NZ-OD2 3.79Å; K698-D700 PolarHBondContact NZ-OD2 2.77Å; D700-R702 PolarHBondContact O-N 3.19Å; D700-S703 PolarHBondContact O-N 3.03Å
701	W	86.9	Confident	88.4	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.008	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.3	-177.4	72.8	-92.6	0	0	0	113.8	K698 K699 A708 M876 F880 L954 A955 D958	K698-W701 HydrophobicContact CG-CB 4.38Å; K699-W701 PolarHBondContact O-N 3.04Å; W701-A708 HydrophobicContact CB-CB 4.05Å; W701-M876 HydrophobicContact CZ2-CG 4.37Å; W701-M876 HydrophobicContact CZ2-SD 4.19Å; W701-F880 HydrophobicContact CE3-CE2 4.39Å; W701-F880 HydrophobicContact CE3-CZ 4.34Å; W701-F880 HydrophobicContact CH2-CD2 4.35Å; W701-F880 AromaticContact CH2-CE2 3.74Å; W701-F880 HydrophobicContact CH2-CE2 3.74Å; W701-F880 HydrophobicContact CH2-CZ 4.47Å; W701-F880 HydrophobicContact CZ3-CD2 4.13Å; W701-F880 AromaticContact CZ3-CE2 3.42Å; W701-F880 HydrophobicContact CZ3-CE2 3.42Å; W701-F880 VanDerWaalsContact CZ3-CE2 3.42Å; W701-F880 AromaticContact CZ3-CZ 3.75Å; W701-F880 HydrophobicContact CZ3-CZ 3.75Å; W701-L954 HydrophobicContact CB-CD1 4.17Å; W701-L954 HydrophobicContact CD2-CB 4.19Å; W701-L954 HydrophobicContact CD2-CD1 4.34Å; W701-L954 HydrophobicContact CE3-CB 4.19Å; W701-L954 HydrophobicContact CE3-CD1 4.15Å; W701-L954 HydrophobicContact CG-CD1 4.39Å; W701-L954 HydrophobicContact CZ3-CB 4.42Å; W701-A955 HydrophobicContact CH2-CB 4.27Å; W701-A955 HydrophobicContact CZ2-CB 4.45Å; W701-D958 PolarHBondContact NE1-OD2 3.29Å; W701-D958 VanDerWaalsContact NE1-OD2 3.11Å
702	R	83.4	Confident	88.4	Confident	103 Å²	103	36.8 Å²	36.8	39%	0.389	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-20.1	178.7	-58.1	-175.8	-166.2	165.6	8.5	113.9	D700 M876 D958	D700-R702 PolarHBondContact O-N 3.19Å; R702-M876 PolarHBondContact NH2-SD 2.88Å; R702-M876 VanDerWaalsContact NH2-SD 3.43Å; R702-D958 IonicContact CZ-OD2 3.6Å; R702-D958 IonicContact NE-OD2 2.85Å; R702-D958 IonicContact NH2-OD2 3.48Å; R702-D958 PolarHBondContact NH2-OD2 2.86Å
703	S	83.9	Confident	88.2	Confident	93 Å²	93	37.6 Å²	37.6	65%	0.65	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-36.2	-179.9	-55.8	0	0	0	0	111.5	D700	D700-S703 PolarHBondContact O-N 3.03Å
704	E	80.8	Confident	88.1	Confident	90 Å²	90	37.6 Å²	37.6	42%	0.421	20%	0.198	S	C	.	.			trans	-133.3	91.2	-173.9	-70.5	177.8	-157.7	0	0	111.2	S706 I707 A708	E704-S706 VanDerWaalsContact C-N 3.33Å; E704-S706 PolarHBondContact O-N 3.49Å; E704-I707 HydrophobicContact CB-CB 4.38Å; E704-I707 HydrophobicContact CB-CG1 4.34Å; E704-I707 PolarHBondContact O-N 2.69Å; E704-I707 WeakPolarHBondContact OE2-CD1 3.48Å; E704-A708 PolarHBondContact O-N 3.01Å; E704-A708 VanDerWaalsContact O-N 3.14Å
705	P	80.1	Confident	87.9	Confident	43 Å²	43	37.4 Å²	37.4	28%	0.279	20%	0.197	S	C	.	.	H	α-helix	trans	-68.7	-26.9	-174.5	24	-32.2	0	0	0	114.1	A708 H709 F880 W902	P705-A708 WeakPolarHBondContact O-CB 3.37Å; P705-A708 PolarHBondContact O-N 3.02Å; P705-H709 PolarHBondContact O-N 2.76Å; P705-F880 HydrophobicContact CB-CE1 4.07Å; P705-W902 HydrophobicContact CB-CG 4.32Å
706	S	81.7	Confident	87.7	Confident	62 Å²	62	37.3 Å²	37.3	43%	0.434	20%	0.197	S	C	.	.	H	α-helix	trans	-65.9	-45.8	176.1	52.5	0	0	0	0	111.9	E704 A708 H709 N710	E704-S706 VanDerWaalsContact C-N 3.33Å; E704-S706 PolarHBondContact O-N 3.49Å; S706-A708 VanDerWaalsContact C-N 3.31Å; S706-A708 PolarHBondContact O-N 3.23Å; S706-H709 WeakPolarHBondContact O-CB 3.47Å; S706-H709 PolarHBondContact O-N 3.07Å; S706-N710 PolarHBondContact O-N 3.39Å; S706-N710 VanDerWaalsContact O-N 3.09Å
707	I	83.3	Confident	87.7	Confident	63 Å²	63	37.6 Å²	37.6	32%	0.323	20%	0.196	S	C	.	.	H	α-helix	trans	-67.6	-35.8	175.3	-57	-160.6	0	0	0	110.8	K698 E704 H709 N710 Y711	K698-I707 HydrophobicContact CD-CG2 4.17Å; E704-I707 HydrophobicContact CB-CB 4.38Å; E704-I707 HydrophobicContact CB-CG1 4.34Å; E704-I707 PolarHBondContact O-N 2.69Å; E704-I707 WeakPolarHBondContact OE2-CD1 3.48Å; I707-H709 VanDerWaalsContact C-N 3.33Å; I707-H709 PolarHBondContact O-N 2.83Å; I707-N710 PolarHBondContact O-N 2.97Å; I707-Y711 PolarHBondContact O-N 3.05Å
708	A	85.8	Confident	87.6	Confident	4 Å²	4	36.9 Å²	36.9	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-41.5	174.6	0	0	0	0	0	112	W701 E704 P705 S706 Y711 I712 L954	W701-A708 HydrophobicContact CB-CB 4.05Å; E704-A708 PolarHBondContact O-N 3.01Å; E704-A708 VanDerWaalsContact O-N 3.14Å; P705-A708 WeakPolarHBondContact O-CB 3.37Å; P705-A708 PolarHBondContact O-N 3.02Å; S706-A708 VanDerWaalsContact C-N 3.31Å; S706-A708 PolarHBondContact O-N 3.23Å; A708-Y711 PolarHBondContact O-N 2.98Å; A708-I712 PolarHBondContact O-N 2.81Å; A708-L954 HydrophobicContact CB-CD1 3.57Å; A708-L954 WeakPolarHBondContact O-CD1 3.42Å
709	H	88.3	Confident	87.7	Confident	29 Å²	29	35 Å²	35	13%	0.134	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-49.1	172.4	179.8	63.9	0	0	0	111.5	P705 S706 I707 Y711 I712 E713 W902 S950	P705-H709 PolarHBondContact O-N 2.76Å; S706-H709 WeakPolarHBondContact O-CB 3.47Å; S706-H709 PolarHBondContact O-N 3.07Å; I707-H709 VanDerWaalsContact C-N 3.33Å; I707-H709 PolarHBondContact O-N 2.83Å; H709-Y711 VanDerWaalsContact C-N 3.27Å; H709-Y711 PolarHBondContact O-N 3.23Å; H709-I712 PolarHBondContact O-N 2.77Å; H709-I712 VanDerWaalsContact O-N 3.14Å; H709-E713 IonicContact CE1-OE1 3.7Å; H709-E713 WeakPolarHBondContact O-CG 3.47Å; H709-E713 PolarHBondContact O-N 3.47Å; H709-W902 HydrophobicContact CB-CB 4.41Å; H709-W902 HydrophobicContact CB-CE3 3.87Å; H709-S950 PolarHBondContact ND1-OG 3.4Å
710	N	89.7	Confident	87.8	Confident	42 Å²	42	33.7 Å²	33.7	23%	0.225	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-37.8	176.6	-74.3	-15.3	0	0	0	112.9	S706 I707 E713 I714	S706-N710 PolarHBondContact O-N 3.39Å; S706-N710 VanDerWaalsContact O-N 3.09Å; I707-N710 PolarHBondContact O-N 2.97Å; N710-E713 PolarHBondContact O-N 2.85Å; N710-I714 WeakPolarHBondContact O-CD1 3.46Å; N710-I714 VanDerWaalsContact O-CG1 3.25Å; N710-I714 WeakPolarHBondContact O-CG1 3.15Å; N710-I714 PolarHBondContact O-N 2.86Å
711	Y	91.6	Very high	87.9	Confident	15 Å²	15	33.1 Å²	33.1	6%	0.059	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-43	176.9	-179.2	-87.5	0	0	0	112.5	M695 G696 K698 I707 A708 H709 I714 L715 V727 L954	M695-Y711 HydrophobicContact CE-CD2 3.73Å; M695-Y711 HydrophobicContact CE-CE2 3.47Å; M695-Y711 VanDerWaalsContact CE-CE2 3.47Å; M695-Y711 HydrophobicContact CE-CG 4.49Å; G696-Y711 WeakPolarHBondContact O-CE2 3.3Å; G696-Y711 PolarHBondContact O-OH 2.76Å; K698-Y711 HydrophobicContact CB-CD2 4.23Å; K698-Y711 HydrophobicContact CB-CE2 4.25Å; I707-Y711 PolarHBondContact O-N 3.05Å; A708-Y711 PolarHBondContact O-N 2.98Å; H709-Y711 VanDerWaalsContact C-N 3.27Å; H709-Y711 PolarHBondContact O-N 3.23Å; Y711-I714 WeakPolarHBondContact O-CB 3.34Å; Y711-I714 PolarHBondContact O-N 3.42Å; Y711-L715 HydrophobicContact CD1-CD1 4.47Å; Y711-L715 HydrophobicContact CE1-CD1 4.1Å; Y711-L715 PolarHBondContact O-N 3.41Å; Y711-V727 VanDerWaalsContact OH-CG1 3.31Å; Y711-V727 WeakPolarHBondContact OH-CG1 3.3Å; Y711-L954 HydrophobicContact CD1-CD2 3.89Å; Y711-L954 HydrophobicContact CE1-CD2 4.11Å
712	I	91.8	Very high	88	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.3	-40.9	177.6	-72.4	-54.8	0	0	0	111.6	A708 H709 I714 L715 H716 Y953 L954 L957	A708-I712 PolarHBondContact O-N 2.81Å; H709-I712 PolarHBondContact O-N 2.77Å; H709-I712 VanDerWaalsContact O-N 3.14Å; I712-I714 PolarHBondContact O-N 2.89Å; I712-L715 HydrophobicContact CD1-CD1 3.73Å; I712-L715 WeakPolarHBondContact O-CA 3.34Å; I712-L715 WeakPolarHBondContact O-CB 3.24Å; I712-L715 PolarHBondContact O-N 2.79Å; I712-H716 VanDerWaalsContact CG2-CD2 3.46Å; I712-H716 WeakPolarHBondContact CG2-CD2 3.16Å; I712-H716 VanDerWaalsContact CG2-NE2 3.32Å; I712-H716 WeakPolarHBondContact CG2-NE2 3.42Å; I712-H716 PolarHBondContact O-CD2 2.96Å; I712-H716 VanDerWaalsContact O-CD2 3.23Å; I712-H716 PolarHBondContact O-N 2.81Å; I712-Y953 HydrophobicContact CD1-CD1 3.49Å; I712-Y953 VanDerWaalsContact CD1-CD1 3.49Å; I712-Y953 HydrophobicContact CD1-CE1 3.91Å; I712-Y953 HydrophobicContact CD1-CG 4.27Å; I712-Y953 HydrophobicContact CG1-CD1 4.24Å; I712-Y953 HydrophobicContact CG2-CD1 3.78Å; I712-Y953 HydrophobicContact CG2-CE1 4.45Å; I712-L954 HydrophobicContact CD1-CD1 4.41Å; I712-L954 HydrophobicContact CD1-CD2 3.65Å; I712-L954 HydrophobicContact CD1-CG 3.57Å; I712-L954 HydrophobicContact CG1-CD1 3.86Å; I712-L954 HydrophobicContact CG1-CD2 4.03Å; I712-L954 HydrophobicContact CG1-CG 3.49Å; I712-L954 VanDerWaalsContact CG1-CG 3.49Å; I712-L957 HydrophobicContact CD1-CD1 4.43Å
713	E	91.1	Very high	88.4	Confident	16 Å²	16	32.1 Å²	32.1	8%	0.075	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-34.9	174.7	-73.3	-64.9	122.9	0	0	111.7	R673 H709 N710 L715 H716 D717 R945	R673-E713 VanDerWaalsContact CZ-CB 3.48Å; R673-E713 IonicContact CZ-OE2 3.25Å; R673-E713 VanDerWaalsContact CZ-OE2 3.25Å; R673-E713 IonicContact NH1-OE2 3.09Å; R673-E713 PolarHBondContact NH1-OE2 2.91Å; R673-E713 VanDerWaalsContact NH1-OE2 3.09Å; R673-E713 IonicContact NH2-OE2 2.76Å; R673-E713 PolarHBondContact NH2-OE2 3.38Å; H709-E713 IonicContact CE1-OE1 3.7Å; H709-E713 WeakPolarHBondContact O-CG 3.47Å; H709-E713 PolarHBondContact O-N 3.47Å; N710-E713 PolarHBondContact O-N 2.85Å; E713-L715 VanDerWaalsContact C-N 3.32Å; E713-L715 PolarHBondContact O-N 2.87Å; E713-H716 WeakPolarHBondContact O-CB 3.29Å; E713-H716 PolarHBondContact O-N 3.02Å; E713-H716 IonicContact OE1-CD2 3.28Å; E713-D717 WeakPolarHBondContact O-CB 3.42Å; E713-D717 PolarHBondContact O-N 2.99Å; E713-R945 IonicContact OE2-CZ 3.7Å; E713-R945 IonicContact OE2-NE 3.75Å; E713-R945 IonicContact OE2-NH2 2.95Å; E713-R945 PolarHBondContact OE2-NH2 2.82Å
714	I	93.6	Very high	88.8	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-39.8	171.4	-71.4	161.4	0	0	0	112	L672 R673 V676 L693 M695 N710 Y711 I712 H716 D717 A718	L672-I714 HydrophobicContact CD2-CD1 4.14Å; L672-I714 HydrophobicContact CG-CD1 3.94Å; R673-I714 HydrophobicContact CB-CD1 4.48Å; R673-I714 HydrophobicContact CB-CG1 4.13Å; R673-I714 HydrophobicContact CG-CG1 4.12Å; V676-I714 HydrophobicContact CB-CD1 4.3Å; V676-I714 HydrophobicContact CB-CG1 4.26Å; V676-I714 HydrophobicContact CB-CG2 4.31Å; V676-I714 HydrophobicContact CG1-CG1 4.42Å; V676-I714 HydrophobicContact CG1-CG2 3.6Å; V676-I714 HydrophobicContact CG2-CD1 4.09Å; L693-I714 HydrophobicContact CD2-CG2 4.26Å; M695-I714 HydrophobicContact CE-CB 4.36Å; M695-I714 HydrophobicContact CE-CG2 3.73Å; M695-I714 HydrophobicContact SD-CG2 3.75Å; N710-I714 WeakPolarHBondContact O-CD1 3.46Å; N710-I714 VanDerWaalsContact O-CG1 3.25Å; N710-I714 WeakPolarHBondContact O-CG1 3.15Å; N710-I714 PolarHBondContact O-N 2.86Å; Y711-I714 WeakPolarHBondContact O-CB 3.34Å; Y711-I714 PolarHBondContact O-N 3.42Å; I712-I714 PolarHBondContact O-N 2.89Å; I714-H716 VanDerWaalsContact C-N 3.32Å; I714-D717 PolarHBondContact O-N 3.42Å; I714-A718 WeakPolarHBondContact O-CB 3.36Å; I714-A718 PolarHBondContact O-N 2.65Å
715	L	92.3	Very high	89.5	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-40	175.9	-56.7	176.6	0	0	0	110.7	M695 Y711 I712 E713 A718 F719 V725 V727 Y953 L957	M695-L715 HydrophobicContact SD-CD2 3.56Å; M695-L715 VanDerWaalsContact SD-CD2 3.56Å; Y711-L715 HydrophobicContact CD1-CD1 4.47Å; Y711-L715 HydrophobicContact CE1-CD1 4.1Å; Y711-L715 PolarHBondContact O-N 3.41Å; I712-L715 HydrophobicContact CD1-CD1 3.73Å; I712-L715 WeakPolarHBondContact O-CA 3.34Å; I712-L715 WeakPolarHBondContact O-CB 3.24Å; I712-L715 PolarHBondContact O-N 2.79Å; E713-L715 VanDerWaalsContact C-N 3.32Å; E713-L715 PolarHBondContact O-N 2.87Å; L715-A718 PolarHBondContact O-N 3.22Å; L715-F719 WeakPolarHBondContact O-CD2 3.26Å; L715-F719 VanDerWaalsContact O-CG 3.28Å; L715-F719 WeakPolarHBondContact O-CG 3.33Å; L715-F719 PolarHBondContact O-N 3.42Å; L715-V725 HydrophobicContact CD2-CG1 3.65Å; L715-V727 HydrophobicContact CD2-CG2 4.1Å; L715-Y953 HydrophobicContact CD1-CE1 4.18Å; L715-L957 HydrophobicContact CD1-CD1 4.25Å
716	H	90.7	Very high	90.2	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.019	11%	0.113	C	C	.	.	H	α-helix	trans	-64.7	-46.5	175.3	-69.4	-57	0	0	0	112	H53 I712 E713 I714 A718 F719 D720 G943	H53-H716 AromaticContact CD2-ND1 3.84Å; H53-H716 AromaticContact CE1-ND1 3.7Å; H53-H716 AromaticContact NE2-CE1 3.67Å; H53-H716 AromaticContact NE2-CG 3.61Å; H53-H716 AromaticContact NE2-ND1 2.83Å; H53-H716 PolarHBondContact NE2-ND1 2.5Å; I712-H716 VanDerWaalsContact CG2-CD2 3.46Å; I712-H716 WeakPolarHBondContact CG2-CD2 3.16Å; I712-H716 VanDerWaalsContact CG2-NE2 3.32Å; I712-H716 WeakPolarHBondContact CG2-NE2 3.42Å; I712-H716 PolarHBondContact O-CD2 2.96Å; I712-H716 VanDerWaalsContact O-CD2 3.23Å; I712-H716 PolarHBondContact O-N 2.81Å; E713-H716 WeakPolarHBondContact O-CB 3.29Å; E713-H716 PolarHBondContact O-N 3.02Å; E713-H716 IonicContact OE1-CD2 3.28Å; I714-H716 VanDerWaalsContact C-N 3.32Å; H716-A718 VanDerWaalsContact C-N 3.26Å; H716-A718 PolarHBondContact O-N 3.03Å; H716-F719 WeakPolarHBondContact O-CB 3.31Å; H716-F719 PolarHBondContact O-N 3.49Å; H716-F719 VanDerWaalsContact O-N 3.08Å; H716-D720 PolarHBondContact O-N 2.76Å; H716-G943 PolarHBondContact CE1-O 3.28Å
717	D	92.2	Very high	90.9	Very high	17 Å²	17	18.5 Å²	18.5	9%	0.091	9%	0.093	C	C	.	.	H	α-helix	trans	-59.1	-39.3	176.9	-64.3	-18.6	0	0	0	110.5	R673 E713 I714 D720 L721	R673-D717 WeakPolarHBondContact CG-OD2 3.41Å; R673-D717 IonicContact CZ-OD1 3.69Å; R673-D717 IonicContact CZ-OD2 3.43Å; R673-D717 IonicContact NE-OD1 3.71Å; R673-D717 IonicContact NE-OD2 3.88Å; R673-D717 PolarHBondContact NE-OD2 3.27Å; R673-D717 IonicContact NH2-OD1 2.82Å; R673-D717 PolarHBondContact NH2-OD1 2.93Å; R673-D717 IonicContact NH2-OD2 2.74Å; R673-D717 PolarHBondContact NH2-OD2 3.45Å; E713-D717 WeakPolarHBondContact O-CB 3.42Å; E713-D717 PolarHBondContact O-N 2.99Å; I714-D717 PolarHBondContact O-N 3.42Å; D717-D720 PolarHBondContact O-N 3.32Å; D717-L721 WeakPolarHBondContact O-CG 3.37Å; D717-L721 PolarHBondContact O-N 3.15Å; D717-L721 VanDerWaalsContact O-N 3.12Å
718	A	91.8	Very high	91.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.8	-40.6	175	0	0	0	0	0	112.7	L680 L693 I714 L715 H716 L721 Q722 Y723 V725	L680-A718 HydrophobicContact CD1-CB 4.16Å; L693-A718 HydrophobicContact CD2-CB 3.53Å; I714-A718 WeakPolarHBondContact O-CB 3.36Å; I714-A718 PolarHBondContact O-N 2.65Å; L715-A718 PolarHBondContact O-N 3.22Å; H716-A718 VanDerWaalsContact C-N 3.26Å; H716-A718 PolarHBondContact O-N 3.03Å; A718-L721 PolarHBondContact O-N 2.85Å; A718-Q722 PolarHBondContact O-N 3.45Å; A718-Y723 WeakPolarHBondContact O-CB 3.23Å; A718-Y723 PolarHBondContact O-N 3.1Å; A718-V725 HydrophobicContact CB-CG2 3.8Å
719	F	89.8	Confident	91.8	Very high	1 Å²	1	17 Å²	17	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-66.5	-38.8	175.3	-68.7	-36.9	0	0	0	112.6	L49 L715 H716 L721 Q722 V725 M940 V942 R972	L49-F719 HydrophobicContact CD1-CB 4.49Å; L49-F719 HydrophobicContact CD1-CD1 4.15Å; L49-F719 HydrophobicContact CD1-CG 4.36Å; L49-F719 HydrophobicContact CD2-CB 3.81Å; L49-F719 HydrophobicContact CD2-CD1 3.76Å; L49-F719 HydrophobicContact CD2-CG 4.14Å; L49-F719 VanDerWaalsContact CD2-O 3.27Å; L49-F719 WeakPolarHBondContact CD2-O 3.35Å; L49-F719 HydrophobicContact CG-CB 4.14Å; L49-F719 HydrophobicContact CG-CD1 4.42Å; L715-F719 WeakPolarHBondContact O-CD2 3.26Å; L715-F719 VanDerWaalsContact O-CG 3.28Å; L715-F719 WeakPolarHBondContact O-CG 3.33Å; L715-F719 PolarHBondContact O-N 3.42Å; H716-F719 WeakPolarHBondContact O-CB 3.31Å; H716-F719 PolarHBondContact O-N 3.49Å; H716-F719 VanDerWaalsContact O-N 3.08Å; F719-L721 VanDerWaalsContact C-N 3.27Å; F719-L721 PolarHBondContact O-N 3.34Å; F719-Q722 PolarHBondContact O-N 3.42Å; F719-Q722 PolarHBondContact O-NE2 3.3Å; F719-V725 HydrophobicContact CD1-CB 4.49Å; F719-V725 HydrophobicContact CD1-CG2 3.7Å; F719-V725 HydrophobicContact CE1-CB 3.81Å; F719-V725 HydrophobicContact CE1-CG2 3.51Å; F719-V725 HydrophobicContact CZ-CB 4.34Å; F719-V725 HydrophobicContact CZ-CG2 4.27Å; F719-M940 HydrophobicContact CE1-CE 4.21Å; F719-M940 HydrophobicContact CE2-CE 4.19Å; F719-M940 HydrophobicContact CZ-CE 3.39Å; F719-V942 HydrophobicContact CE2-CG1 4.41Å; F719-V942 HydrophobicContact CZ-CG2 4.43Å; F719-R972 HydrophobicContact CE1-CB 4.06Å; F719-R972 HydrophobicContact CE1-CG 3.81Å; F719-R972 HydrophobicContact CZ-CB 4.26Å; F719-R972 HydrophobicContact CZ-CG 4.06Å
720	D	88.1	Confident	91.8	Very high	49 Å²	49	17 Å²	17	26%	0.262	8%	0.082	S	C	.	.	H	α-helix	trans	-61.1	-40.3	176.1	-72.4	-24.6	0	0	0	110.8	H53 H716 D717 Q722 R945	H53-D720 IonicContact CE1-OD1 3.77Å; H53-D720 PolarHBondContact CE1-OD1 3.32Å; H53-D720 IonicContact CE1-OD2 3.09Å; H53-D720 IonicContact ND1-OD1 2.75Å; H53-D720 PolarHBondContact ND1-OD1 3.31Å; H716-D720 PolarHBondContact O-N 2.76Å; D717-D720 PolarHBondContact O-N 3.32Å; D720-Q722 PolarHBondContact O-N 3.12Å; D720-Q722 PolarHBondContact O-NE2 3.47Å; D720-R945 IonicContact OD2-NH1 2.93Å; D720-R945 PolarHBondContact OD2-NH1 2.94Å
721	L	88.8	Confident	91.5	Very high	62 Å²	62	21.9 Å²	21.9	33%	0.325	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	9.3	175.5	-64.4	173.5	0	0	0	114.6	L680 Q681 D717 A718 F719 Y723	L680-L721 HydrophobicContact CB-CD1 3.53Å; L680-L721 HydrophobicContact CD1-CD1 4.15Å; L680-L721 HydrophobicContact CG-CD1 4.42Å; Q681-L721 HydrophobicContact CG-CD1 3.79Å; Q681-L721 HydrophobicContact CG-CD2 4.19Å; D717-L721 WeakPolarHBondContact O-CG 3.37Å; D717-L721 PolarHBondContact O-N 3.15Å; D717-L721 VanDerWaalsContact O-N 3.12Å; A718-L721 PolarHBondContact O-N 2.85Å; F719-L721 VanDerWaalsContact C-N 3.27Å; F719-L721 PolarHBondContact O-N 3.34Å; L721-Y723 VanDerWaalsContact C-N 3.29Å; L721-Y723 HydrophobicContact CB-CD2 3.82Å; L721-Y723 HydrophobicContact CB-CE2 4.13Å; L721-Y723 WeakPolarHBondContact O-CD2 3.46Å; L721-Y723 PolarHBondContact O-N 3.43Å
722	Q	89.3	Confident	90.9	Very high	65 Å²	65	30.4 Å²	30.4	30%	0.304	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	33.4	179.5	-50.8	-56.8	-62.6	0	0	114.1	A718 F719 D720 N974	A718-Q722 PolarHBondContact O-N 3.45Å; F719-Q722 PolarHBondContact O-N 3.42Å; F719-Q722 PolarHBondContact O-NE2 3.3Å; D720-Q722 PolarHBondContact O-N 3.12Å; D720-Q722 PolarHBondContact O-NE2 3.47Å; Q722-N974 WeakPolarHBondContact O-CB 3.24Å; Q722-N974 PolarHBondContact O-ND2 3.47Å
723	Y	91.7	Very high	90.4	Very high	19 Å²	19	31.7 Å²	31.7	8%	0.075	16%	0.155	C	C	.	.			trans	-81.9	144.6	171.6	-84.6	-110.8	0	0	0	111.4	L680 P690 N691 L693 A718 L721	L680-Y723 HydrophobicContact CD2-CD1 4.03Å; L680-Y723 HydrophobicContact CD2-CD2 4.25Å; L680-Y723 HydrophobicContact CD2-CE1 3.98Å; L680-Y723 HydrophobicContact CD2-CE2 4.2Å; L680-Y723 HydrophobicContact CD2-CG 4.17Å; L680-Y723 PolarHBondContact O-OH 3.4Å; P690-Y723 HydrophobicContact CB-CE1 3.99Å; P690-Y723 VanDerWaalsContact O-CE1 3.24Å; P690-Y723 WeakPolarHBondContact O-CE1 3.43Å; P690-Y723 VanDerWaalsContact O-CZ 3.28Å; P690-Y723 PolarHBondContact O-OH 3.37Å; P690-Y723 VanDerWaalsContact O-OH 3.11Å; N691-Y723 VanDerWaalsContact C-CD1 3.45Å; L693-Y723 HydrophobicContact CB-CD1 4.38Å; A718-Y723 WeakPolarHBondContact O-CB 3.23Å; A718-Y723 PolarHBondContact O-N 3.1Å; L721-Y723 VanDerWaalsContact C-N 3.29Å; L721-Y723 HydrophobicContact CB-CD2 3.82Å; L721-Y723 HydrophobicContact CB-CE2 4.13Å; L721-Y723 WeakPolarHBondContact O-CD2 3.46Å; L721-Y723 PolarHBondContact O-N 3.43Å
724	G	93	Very high	89.9	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	137.1	158.8	0	0	0	0	0	109.4	N691 V692 L693 R972	N691-G724 PolarHBondContact O-N 2.69Å; V692-G724 CarbonylContact C-O 3.54Å; V692-G724 WeakPolarHBondContact CA-O 3.47Å; L693-G724 PolarHBondContact N-O 3.21Å; G724-R972 CarbonylContact C-O 3.34Å; G724-R972 VanDerWaalsContact CA-O 3.28Å; G724-R972 WeakPolarHBondContact CA-O 3.48Å
725	V	94.5	Very high	89.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.7	-178.5	177.9	0	0	0	0	108.9	L715 A718 F719 V727 M940 R972	L715-V725 HydrophobicContact CD2-CG1 3.65Å; A718-V725 HydrophobicContact CB-CG2 3.8Å; F719-V725 HydrophobicContact CD1-CB 4.49Å; F719-V725 HydrophobicContact CD1-CG2 3.7Å; F719-V725 HydrophobicContact CE1-CB 3.81Å; F719-V725 HydrophobicContact CE1-CG2 3.51Å; F719-V725 HydrophobicContact CZ-CB 4.34Å; F719-V725 HydrophobicContact CZ-CG2 4.27Å; V725-V727 HydrophobicContact CG1-CG2 4.34Å; V725-M940 HydrophobicContact CB-CE 4.18Å; V725-M940 HydrophobicContact CG1-CE 3.88Å; V725-R972 PolarHBondContact N-O 3.17Å; V725-R972 PolarHBondContact O-N 2.63Å
726	C	95.5	Very high	88.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137.6	164	-35.6	0	0	0	0	112.9	L693 M694 M695 L969 M970 V971	L693-C726 PolarHBondContact O-N 2.65Å; M694-C726 WeakPolarHBondContact CA-O 3.22Å; M694-C726 HydrophobicContact CE-CB 3.16Å; M694-C726 WeakPolarHBondContact CE-SG 3.38Å; M694-C726 HydrophobicContact SD-CB 3.82Å; M695-C726 PolarHBondContact N-O 3.09Å; C726-L969 HydrophobicContact CB-CD1 3.78Å; C726-L969 HydrophobicContact CB-CG 4.31Å; C726-M970 CarbonylContact C-O 3.3Å; C726-M970 WeakPolarHBondContact CA-O 3.28Å; C726-M970 VanDerWaalsContact CB-O 3.28Å; C726-M970 WeakPolarHBondContact CB-O 3.5Å; C726-V971 HydrophobicContact CB-CG2 4.13Å
727	V	95.7	Very high	86.9	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118	-178.5	-178.5	0	0	0	0	108.9	M695 F697 Y711 L715 V725 M940 M970	M695-V727 CarbonylContact O-C 3.6Å; M695-V727 WeakPolarHBondContact O-CA 3.35Å; F697-V727 HydrophobicContact CB-CG1 3.87Å; F697-V727 HydrophobicContact CD2-CG1 4.05Å; F697-V727 HydrophobicContact CG-CG1 4.49Å; Y711-V727 VanDerWaalsContact OH-CG1 3.31Å; Y711-V727 WeakPolarHBondContact OH-CG1 3.3Å; L715-V727 HydrophobicContact CD2-CG2 4.1Å; V725-V727 HydrophobicContact CG1-CG2 4.34Å; V727-M940 HydrophobicContact CG2-SD 3.99Å; V727-M970 HydrophobicContact CB-CB 4.38Å; V727-M970 HydrophobicContact CB-CE 4.11Å; V727-M970 HydrophobicContact CG1-CE 3.86Å; V727-M970 PolarHBondContact N-O 2.98Å; V727-M970 PolarHBondContact O-N 2.88Å
728	L	95.2	Very high	84.6	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.8	177.3	178.9	64.1	0	0	0	110.5	L614 L617 M695 F697 L734 F784 P967 L969	L614-L728 HydrophobicContact CB-CD2 4.36Å; L614-L728 HydrophobicContact CD1-CB 3.85Å; L614-L728 HydrophobicContact CD1-CD2 3.84Å; L617-L728 HydrophobicContact CD2-CD1 3.65Å; L617-L728 HydrophobicContact CD2-CD2 3.77Å; L617-L728 HydrophobicContact CD2-CG 4.22Å; M695-L728 PolarHBondContact O-N 3.5Å; F697-L728 WeakPolarHBondContact CB-O 3.43Å; F697-L728 PolarHBondContact N-O 3.46Å; L728-L734 HydrophobicContact CD2-CD2 3.86Å; L728-L734 HydrophobicContact CG-CD1 4.5Å; L728-L734 HydrophobicContact CG-CD2 4.4Å; L728-L734 WeakPolarHBondContact O-CD1 3.36Å; L728-F784 HydrophobicContact CD1-CZ 4.5Å; L728-F784 HydrophobicContact CD2-CE2 4.43Å; L728-P967 HydrophobicContact CD1-CB 4.4Å; L728-L969 HydrophobicContact CB-CD1 4.32Å
729	R	93	Very high	82.1	Confident	35 Å²	35	51.1 Å²	51.1	13%	0.132	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.6	168.7	-171.2	179.1	-179.2	161.4	3.1	111.2	F697 D958 S961 V968	F697-R729 HydrophobicContact CB-CB 3.8Å; F697-R729 HydrophobicContact CB-CG 4.03Å; F697-R729 HydrophobicContact CD1-CG 3.99Å; F697-R729 HydrophobicContact CG-CB 4.23Å; F697-R729 HydrophobicContact CG-CG 4.13Å; R729-D958 IonicContact CZ-OD1 2.63Å; R729-D958 VanDerWaalsContact CZ-OD1 3.28Å; R729-D958 VanDerWaalsContact NH1-CA 3.34Å; R729-D958 PolarHBondContact NH1-O 3Å; R729-D958 IonicContact NH1-OD1 3.51Å; R729-D958 PolarHBondContact NH1-OD1 3.44Å; R729-D958 IonicContact NH2-OD1 2.73Å; R729-D958 PolarHBondContact NH2-OD1 2.54Å; R729-S961 WeakPolarHBondContact CD-OG 3.47Å; R729-S961 PolarHBondContact NH1-OG 2.78Å; R729-V968 PolarHBondContact N-O 3.18Å; R729-V968 PolarHBondContact O-N 3.43Å
730	M	89.4	Confident	79.6	Confident	29 Å²	29	54.6 Å²	54.6	14%	0.143	30%	0.304	C	S	.	.			trans	-118.4	148.6	173.9	-64.5	-69.7	-67.3	0	0	110	K699 E732 G733 L734 V783 F784 P967	K699-M730 WeakPolarHBondContact CE-O 3.33Å; K699-M730 PolarHBondContact NZ-O 3.24Å; M730-E732 PolarHBondContact O-N 3.41Å; M730-G733 WeakPolarHBondContact CB-O 3.26Å; M730-G733 PolarHBondContact O-N 3.07Å; M730-L734 HydrophobicContact CB-CD2 4.42Å; M730-L734 HydrophobicContact CG-CD2 3.55Å; M730-L734 HydrophobicContact CG-CG 4.17Å; M730-V783 HydrophobicContact CE-CG2 4.28Å; M730-F784 HydrophobicContact CE-CE2 4.31Å; M730-F784 HydrophobicContact SD-CE2 3.96Å; M730-F784 HydrophobicContact SD-CZ 3.9Å; M730-P967 HydrophobicContact CE-CG 4.07Å; M730-P967 HydrophobicContact SD-CB 3.56Å; M730-P967 VanDerWaalsContact SD-CB 3.56Å; M730-P967 HydrophobicContact SD-CG 3.62Å
731	K	83.3	Confident	76.9	Confident	145 Å²	145	60.1 Å²	60.1	63%	0.63	33%	0.328	S	S	*	.	S	Bend	trans	-60.3	-41.1	178.5	-173.3	-176.5	177.1	-171	0	113.4	K699	K699-K731 PolarHBondContact NZ-O 2.87Å
732	E	77.9	Confident	74.3	Confident	194 Å²	194	61.4 Å²	61.4	91%	0.907	34%	0.343	S	S	*	.	S	Bend	trans	-85.7	-24.7	-178.5	-70.2	168.3	-171.1	0	0	112.8	K699 M730	K699-E732 PolarHBondContact NZ-O 3.24Å; M730-E732 PolarHBondContact O-N 3.41Å
733	G	80.8	Confident	71.3	Confident	27 Å²	27	66.2 Å²	66.2	28%	0.278	37%	0.365	S	S	.	.			trans	119.6	178.5	-176.8	0	0	0	0	0	109.8	K699 M730	K699-G733 VanDerWaalsContact NZ-CA 3.3Å; M730-G733 WeakPolarHBondContact CB-O 3.26Å; M730-G733 PolarHBondContact O-N 3.07Å
734	L	81.6	Confident	68.4	Low	13 Å²	13	70.5 Å²	70.5	7%	0.068	39%	0.393	C	S	.	.	S	Bend	trans	-113.3	-24.5	177.7	-72.1	167.7	0	0	0	112.7	R611 A613 L614 L728 M730	R611-L734 HydrophobicContact CG-CB 4.33Å; A613-L734 HydrophobicContact CB-CD2 3.89Å; L614-L734 HydrophobicContact CB-CD2 4.45Å; L728-L734 HydrophobicContact CD2-CD2 3.86Å; L728-L734 HydrophobicContact CG-CD1 4.5Å; L728-L734 HydrophobicContact CG-CD2 4.4Å; L728-L734 WeakPolarHBondContact O-CD1 3.36Å; M730-L734 HydrophobicContact CB-CD2 4.42Å; M730-L734 HydrophobicContact CG-CD2 3.55Å; M730-L734 HydrophobicContact CG-CG 4.17Å
735	D	79.9	Confident	65.3	Low	98 Å²	98	77.8 Å²	77.8	52%	0.524	43%	0.431	S	S	.	.			trans	-81.4	125.4	-175.5	-58.7	-38.6	0	0	0	110.8	R611	R611-D735 IonicContact CZ-OD1 3.83Å; R611-D735 VanDerWaalsContact CZ-OD1 3.23Å; R611-D735 IonicContact NE-OD1 3.44Å; R611-D735 PolarHBondContact NE-OD1 2.94Å; R611-D735 IonicContact NH2-OD1 3.65Å; R611-D735 PolarHBondContact NH2-OD1 3.41Å; R611-D735 IonicContact NH2-OD2 3.92Å
736	V	78.6	Confident	62.2	Low	43 Å²	43	89.4 Å²	89.4	26%	0.261	48%	0.475	S	S	.	.			trans	-106.6	119.1	171.8	-176	0	0	0	0	107.7	S610 P612 S738	S610-V736 PolarHBondContact O-N 3.2Å; P612-V736 HydrophobicContact CG-CG2 4.2Å; V736-S738 WeakPolarHBondContact CG1-OG 3.36Å
737	S	55.9	Low	59.2	Low	125 Å²	125	91.8 Å²	91.8	87%	0.874	50%	0.5	S	S	*	.			trans	-91	9.2	-173.5	50.5	0	0	0	0	115	P739	S737-P739 WeakPolarHBondContact O-CD 3.44Å
738	S	43.6	Very low	56.2	Low	61 Å²	61	101.4 Å²	101.4	43%	0.427	54%	0.542	S	S	.	.			trans	-88	114.8	175.1	57.9	0	0	0	0	111.2	V736 P740 H780	V736-S738 WeakPolarHBondContact CG1-OG 3.36Å; S738-P740 WeakPolarHBondContact O-CD 3.47Å; S738-H780 PolarHBondContact OG-NE2 2.71Å
739	P	38.1	Very low	53	Low	106 Å²	106	109.5 Å²	109.5	69%	0.688	59%	0.586	S	S	*	*			trans	-69.7	128.4	167.6	28.4	-30.4	0	0	0	108.8	S737 Q741	S737-P739 WeakPolarHBondContact O-CD 3.44Å; P739-Q741 PolarHBondContact O-N 2.93Å; P739-Q741 VanDerWaalsContact O-N 3.12Å
740	P	37.5	Very low	49.9	Very low	73 Å²	73	116.6 Å²	116.6	47%	0.474	62%	0.62	S	S	.	*			trans	-66.8	111.1	156	27.4	-27	0	0	0	105.8	S738 S742	S738-P740 WeakPolarHBondContact O-CD 3.47Å; P740-S742 PolarHBondContact O-N 3.32Å
741	Q	31	Very low	46.9	Very low	165 Å²	165	118.7 Å²	118.7	77%	0.771	65%	0.649	S	S	*	*			trans	-63.8	89.5	163.4	-79.4	179.6	-19.6	0	0	106.9	P739 H743	P739-Q741 PolarHBondContact O-N 2.93Å; P739-Q741 VanDerWaalsContact O-N 3.12Å; Q741-H743 PolarHBondContact O-N 2.88Å
742	S	34.1	Very low	44.3	Very low	90 Å²	90	121.3 Å²	121.3	63%	0.629	66%	0.664	S	S	*	*			trans	-64.2	98.7	157.3	55.7	0	0	0	0	105.6	P740 V744	P740-S742 PolarHBondContact O-N 3.32Å; S742-V744 PolarHBondContact O-N 3.1Å
743	H	27.6	Very low	41.9	Very low	165 Å²	165	119.8 Å²	119.8	76%	0.764	66%	0.662	S	S	*	*			trans	-56	95.8	161.2	-89.7	-82.3	0	0	0	107.2	Q741 N745	Q741-H743 PolarHBondContact O-N 2.88Å; H743-N745 PolarHBondContact O-N 3.3Å
744	V	29.7	Very low	39.4	Very low	110 Å²	110	124.4 Å²	124.4	67%	0.667	69%	0.69	S	S	*	*			trans	-69.2	108	158.5	177.5	0	0	0	0	104	S742 R746	S742-V744 PolarHBondContact O-N 3.1Å; V744-R746 VanDerWaalsContact C-N 3.28Å; V744-R746 PolarHBondContact O-N 3.23Å
745	N	28.5	Very low	36.9	Very low	153 Å²	153	130.8 Å²	130.8	82%	0.818	72%	0.722	S	S	*	*			trans	-59.2	98.7	164.4	-109.4	-8.9	0	0	0	107	H743 G747	H743-N745 PolarHBondContact O-N 3.3Å; N745-G747 PolarHBondContact O-N 2.54Å
746	R	30.5	Very low	34.4	Very low	244 Å²	244	132.9 Å²	132.9	92%	0.921	73%	0.733	S	S	*	*			trans	-76.9	69.5	157.9	-75	-170.3	176.4	-177	-2.1	107.6	V744	V744-R746 VanDerWaalsContact C-N 3.28Å; V744-R746 PolarHBondContact O-N 3.23Å
747	G	30.8	Very low	32	Very low	50 Å²	50	138 Å²	138	52%	0.515	77%	0.765	S	S	.	*			trans	-105	119	161.6	0	0	0	0	0	106.4	N745	N745-G747 PolarHBondContact O-N 2.54Å
748	F	33.3	Very low	30.6	Very low	203 Å²	203	139.3 Å²	139.3	89%	0.89	76%	0.761	S	S	*	*			trans	90.3	77.2	-172	-59.6	-80.3	0	0	0	115.5
749	D	27.5	Very low	29.8	Very low	171 Å²	171	141.9 Å²	141.9	91%	0.914	78%	0.779	S	S	*	*			trans	-129.7	131.1	130.2	-107.7	-26.7	0	0	0	107.2
750	E	28.8	Very low	29.6	Very low	184 Å²	184	142.8 Å²	142.8	86%	0.86	79%	0.785	S	S	*	*			trans	-78.7	136.7	-172.4	-70	-179.9	149.1	0	0	112.6
751	G	26.9	Very low	29	Very low	73 Å²	73	142.9 Å²	142.9	75%	0.753	80%	0.798	S	S	*	*			trans	61.3	106	138	0	0	0	0	0	120.7
752	Q	27.3	Very low	28.7	Very low	200 Å²	200	140 Å²	140	94%	0.935	80%	0.796	S	S	*	*				-159.6	135.1	129.3	-117.4	161.6	2.2	0	0	112.8
753	D	28.6	Very low	28.4	Very low	161 Å²	161	143.4 Å²	143.4	86%	0.861	81%	0.807	S	S	*	*			trans	-57.6	141	-177.5	-68.7	-54.2	0	0	0	114.3
754	S	27.4	Very low	28.5	Very low	124 Å²	124	142.6 Å²	142.6	87%	0.867	81%	0.807	S	S	*	*			trans	-169.8	147	136.4	30.7	0	0	0	0	112.4
755	I	30	Very low	28.3	Very low	148 Å²	148	149 Å²	149	76%	0.759	82%	0.819	S	S	*	*			trans	-91.3	145.9	-157.8	-75	163	0	0	0	112.7
756	N	27.3	Very low	28.1	Very low	141 Å²	141	148 Å²	148	75%	0.754	82%	0.819	S	S	*	*			trans	45	122	155.2	-61	-16.2	0	0	0	121.1
757	T	27.1	Very low	27.9	Very low	150 Å²	150	141.3 Å²	141.3	92%	0.92	81%	0.809	S	S	*	*				-162.2	145.1	114.6	1.8	0	0	0	0	113.1
758	I	27.6	Very low	27.6	Very low	153 Å²	153	145 Å²	145	79%	0.785	82%	0.822	S	S	*	*			trans	-88.5	141.9	-169.9	-67.4	156.9	0	0	0	110.8
759	S	26.6	Very low	27.5	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	82%	0.823	S	S	*	*				178.4	153.8	123.9	-79.8	0	0	0	0	114.3
760	P	33.6	Very low	27.3	Very low	126 Å²	126	138.8 Å²	138.8	82%	0.818	81%	0.811	S	S	*	*			trans	-111.6	160.2	-151.4	37.6	-24.9	0	0	0	114.1
761	G	25.6	Very low	27.3	Very low	74 Å²	74	135.9 Å²	135.9	76%	0.763	81%	0.811	S	S	*	*			trans	-173.7	75.6	177.4	0	0	0	0	0	117.1
762	S	24.5	Very low	27.3	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	81%	0.81	S	S	*	*			trans	76.2	126.6	137	137.2	0	0	0	0	122.1
763	L	27.6	Very low	27.2	Very low	163 Å²	163	132.5 Å²	132.5	85%	0.853	79%	0.792	S	S	*	*			trans	92.5	91.2	144.9	-73	162	0	0	0	119.6
764	I	28.7	Very low	27.3	Very low	148 Å²	148	131.1 Å²	131.1	76%	0.759	79%	0.789	S	S	*	*			trans	-56.4	126.5	153.1	-64.6	166.1	0	0	0	109.8
765	R	25.2	Very low	27.4	Very low	244 Å²	244	131.9 Å²	131.9	92%	0.921	78%	0.784	S	S	*	*			trans	-135.4	107.5	152.8	-128.1	177.4	170.3	-175	-3.8	108.8
766	T	26.3	Very low	28	Very low	132 Å²	132	131 Å²	131	81%	0.81	78%	0.78	S	S	*	*			trans	-74.9	126.9	174.3	24.8	0	0	0	0	110.3
767	S	25.2	Very low	28.5	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	78%	0.782	S	S	*	*			trans	-158.1	107.8	154.9	60.3	0	0	0	0	111.4
768	T	25.2	Very low	29.7	Very low	128 Å²	128	131.1 Å²	131.1	79%	0.785	78%	0.777	S	S	*	*			trans	47	118.7	137.1	35.9	0	0	0	0	120.3	S770	T768-S770 PolarHBondContact O-N 2.95Å
769	T	30.6	Very low	31.3	Very low	148 Å²	148	126.9 Å²	126.9	91%	0.908	75%	0.754	S	S	*	*			trans	-37.6	112.7	157.1	44.1	0	0	0	0	114.3
770	S	24.3	Very low	33.1	Very low	94 Å²	94	126.9 Å²	126.9	66%	0.657	74%	0.74	S	S	*	*			trans	-134.6	125.6	155.1	56	0	0	0	0	107.9	T768 V772	T768-S770 PolarHBondContact O-N 2.95Å; S770-V772 PolarHBondContact O-N 2.85Å
771	S	28.4	Very low	34.8	Very low	123 Å²	123	125.6 Å²	125.6	86%	0.86	73%	0.731	S	S	*	*			trans	-56.6	102.4	171.8	49.6	0	0	0	0	110.2	S773	S771-S773 PolarHBondContact O-N 2.85Å
772	V	26.4	Very low	37.5	Very low	120 Å²	120	122.7 Å²	122.7	73%	0.727	70%	0.698	S	S	*	*			trans	-81.6	105.7	172.7	178.7	0	0	0	0	107.5	S770 V774	S770-V772 PolarHBondContact O-N 2.85Å; V772-V774 PolarHBondContact O-N 2.82Å
773	S	25.6	Very low	40.3	Very low	82 Å²	82	121 Å²	121	57%	0.573	68%	0.683	S	S	*	*			trans	-53.5	125.2	153.2	39.2	0	0	0	0	107.7	S771 D775	S771-S773 PolarHBondContact O-N 2.85Å; S773-D775 PolarHBondContact O-N 3.26Å
774	V	31	Very low	43	Very low	132 Å²	132	113.2 Å²	113.2	80%	0.8	64%	0.642	S	S	*	*			trans	-66.9	85.6	172.7	-178	0	0	0	0	107.4	V772 L776	V772-V774 PolarHBondContact O-N 2.82Å; V774-L776 PolarHBondContact O-N 2.77Å
775	D	28.1	Very low	45.7	Very low	140 Å²	140	108.7 Å²	108.7	75%	0.749	62%	0.618	S	S	*	*			trans	-70.3	109.7	169.1	-83.1	-29.3	0	0	0	107.5	S773 E777	S773-D775 PolarHBondContact O-N 3.26Å; D775-E777 PolarHBondContact O-N 2.83Å
776	L	42.3	Very low	48.4	Very low	129 Å²	129	103.2 Å²	103.2	68%	0.675	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-56	132.9	171.3	-81.4	98.7	0	0	0	109.4	V774	V774-L776 PolarHBondContact O-N 2.77Å
777	E	37.8	Very low	51.1	Low	169 Å²	169	105.7 Å²	105.7	79%	0.79	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-53	133.2	172.1	-74	-161	152.4	0	0	111.1	D775 Q779	D775-E777 PolarHBondContact O-N 2.83Å; E777-Q779 PolarHBondContact O-N 2.83Å
778	P	52.2	Low	53.9	Low	126 Å²	126	101.5 Å²	101.5	82%	0.818	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-69.7	117.4	-176.8	25.2	-31.5	0	0	0	111
779	Q	61.1	Low	56.7	Low	64 Å²	64	97 Å²	97	30%	0.299	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-55.8	143.1	174.3	-63.1	-176.4	-4.7	0	0	111.8	E777 T781	E777-Q779 PolarHBondContact O-N 2.83Å; Q779-T781 PolarHBondContact O-N 2.87Å
780	H	65.7	Low	59.3	Low	114 Å²	114	99.1 Å²	99.1	53%	0.528	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-54	120.7	177.4	-75.2	-85.6	0	0	0	112.7	R658 S738	R658-H780 PolarHBondContact NH1-O 3.24Å; R658-H780 PolarHBondContact NH2-O 3.43Å; S738-H780 PolarHBondContact OG-NE2 2.71Å
781	T	69.6	Low	62.3	Low	100 Å²	100	99.7 Å²	99.7	61%	0.613	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-79.2	131.7	176.9	63.6	0	0	0	0	111.1	Q779	Q779-T781 PolarHBondContact O-N 2.87Å
782	T	82.2	Confident	65.4	Low	13 Å²	13	95.3 Å²	95.3	8%	0.08	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-102.3	163.7	179.5	69.9	0	0	0	0	111.5	P612 A613 D616 F784 Q785	P612-T782 HydrophobicContact CB-CG2 4.02Å; P612-T782 HydrophobicContact CG-CG2 4.2Å; A613-T782 HydrophobicContact CB-CG2 3.96Å; D616-T782 WeakPolarHBondContact OD2-CB 3.5Å; D616-T782 WeakPolarHBondContact OD2-CG2 3.48Å; D616-T782 PolarHBondContact OD2-OG1 2.86Å; T782-F784 PolarHBondContact O-N 3.11Å; T782-Q785 PolarHBondContact O-N 3.01Å; T782-Q785 VanDerWaalsContact O-N 3.13Å
783	V	82.4	Confident	68.6	Low	67 Å²	67	89.6 Å²	89.6	41%	0.406	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-57.2	-36.2	175.8	-179.9	0	0	0	0	111.1	M730 Q785 K786 Q788	M730-V783 HydrophobicContact CE-CG2 4.28Å; V783-Q785 PolarHBondContact O-N 3.11Å; V783-K786 PolarHBondContact O-N 3.44Å; V783-Q788 PolarHBondContact O-NE2 3.32Å
784	F	85.6	Confident	72	Confident	0 Å²	0	85.7 Å²	85.7	0%	0	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-72.1	-10.8	-178.3	-53.2	-73.3	0	0	0	114.1	A613 D616 L617 L728 M730 T782 R817 W818 P967	A613-F784 HydrophobicContact CB-CD2 4.33Å; A613-F784 HydrophobicContact CB-CE2 4.19Å; A613-F784 VanDerWaalsContact O-CD2 3.26Å; A613-F784 WeakPolarHBondContact O-CD2 3.49Å; A613-F784 WeakPolarHBondContact O-CE2 2.99Å; D616-F784 HydrophobicContact CB-CB 3.91Å; L617-F784 HydrophobicContact CB-CD1 3.96Å; L617-F784 HydrophobicContact CB-CD2 4.05Å; L617-F784 HydrophobicContact CB-CE1 4.07Å; L617-F784 HydrophobicContact CB-CE2 4.1Å; L617-F784 HydrophobicContact CB-CG 4Å; L617-F784 HydrophobicContact CB-CZ 4.13Å; L617-F784 HydrophobicContact CD1-CD1 3.71Å; L617-F784 HydrophobicContact CD1-CE1 3.62Å; L617-F784 HydrophobicContact CD1-CZ 4.34Å; L617-F784 HydrophobicContact CD2-CE1 4.33Å; L617-F784 HydrophobicContact CD2-CZ 4.28Å; L617-F784 HydrophobicContact CG-CD1 4.37Å; L617-F784 HydrophobicContact CG-CE1 4.2Å; L617-F784 HydrophobicContact CG-CZ 4.47Å; L728-F784 HydrophobicContact CD1-CZ 4.5Å; L728-F784 HydrophobicContact CD2-CE2 4.43Å; M730-F784 HydrophobicContact CE-CE2 4.31Å; M730-F784 HydrophobicContact SD-CE2 3.96Å; M730-F784 HydrophobicContact SD-CZ 3.9Å; T782-F784 PolarHBondContact O-N 3.11Å; F784-R817 WeakPolarHBondContact O-CD 3.07Å; F784-R817 PolarHBondContact O-NH1 3.38Å; F784-R817 VanDerWaalsContact O-NH1 3.15Å; F784-W818 HydrophobicContact CD1-CH2 4.27Å; F784-W818 AromaticContact CD1-CZ2 3.73Å; F784-W818 HydrophobicContact CD1-CZ2 3.73Å; F784-W818 HydrophobicContact CE1-CH2 4.44Å; F784-W818 HydrophobicContact CE1-CZ2 4.33Å; F784-P967 HydrophobicContact CE1-CB 4.48Å; F784-P967 HydrophobicContact CE1-CG 4.41Å; F784-P967 HydrophobicContact CZ-CB 4.02Å; F784-P967 HydrophobicContact CZ-CG 4.05Å
785	Q	83.7	Confident	75	Confident	53 Å²	53	79.4 Å²	79.4	25%	0.248	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-89	-19.8	173.7	-67.5	-177.5	-18	0	0	113.4	D616 R658 T782 V783 R817	D616-Q785 HydrophobicContact CB-CG 4.42Å; D616-Q785 PolarHBondContact OD1-NE2 3.41Å; D616-Q785 WeakPolarHBondContact OD2-CG 3.43Å; D616-Q785 PolarHBondContact OD2-NE2 3.42Å; D616-Q785 VanDerWaalsContact OD2-NE2 3.08Å; R658-Q785 VanDerWaalsContact NE-NE2 3.16Å; R658-Q785 VanDerWaalsContact NH2-NE2 3.12Å; T782-Q785 PolarHBondContact O-N 3.01Å; T782-Q785 VanDerWaalsContact O-N 3.13Å; V783-Q785 PolarHBondContact O-N 3.11Å; Q785-R817 PolarHBondContact O-NE 3.38Å
786	K	83.4	Confident	78.1	Confident	130 Å²	130	72.7 Å²	72.7	57%	0.565	37%	0.368	S	S	*	.	S	Bend	trans	-86.5	152.1	179.3	-61	-177.5	-177.6	179.2	0	111.1	V783 Q788	V783-K786 PolarHBondContact O-N 3.44Å; K786-Q788 PolarHBondContact O-NE2 3.2Å
787	K	82.8	Confident	80.4	Confident	184 Å²	184	66.6 Å²	66.6	80%	0.8	34%	0.336	S	S	*	.			trans	-70.3	129.1	173.1	-69.9	-177.6	-178.6	175.1	0	108.9
788	Q	84.1	Confident	82.8	Confident	15 Å²	15	59.3 Å²	59.3	7%	0.07	30%	0.302	C	S	.	.			trans	-83.2	-17.2	-175.5	-60.9	-55.6	-45.1	0	0	113.7	V783 K786 K791 R817 W818 C821 A934	V783-Q788 PolarHBondContact O-NE2 3.32Å; K786-Q788 PolarHBondContact O-NE2 3.2Å; Q788-K791 WeakPolarHBondContact O-CG 3.4Å; Q788-R817 PolarHBondContact N-O 3.25Å; Q788-R817 VanDerWaalsContact N-O 3.16Å; Q788-W818 HydrophobicContact CB-CE3 4.33Å; Q788-W818 HydrophobicContact CB-CZ3 4.45Å; Q788-W818 HydrophobicContact CG-CD2 3.85Å; Q788-W818 HydrophobicContact CG-CE3 3.76Å; Q788-W818 HydrophobicContact CG-CH2 3.64Å; Q788-W818 HydrophobicContact CG-CZ2 3.68Å; Q788-W818 HydrophobicContact CG-CZ3 3.69Å; Q788-C821 VanDerWaalsContact CB-SG 3.59Å; Q788-A934 HydrophobicContact CB-CB 4.4Å
789	G	82.8	Confident	84.3	Confident	34 Å²	34	53.9 Å²	53.9	35%	0.351	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-142.9	178	0	0	0	0	0	112.7	K791 R820	G789-K791 VanDerWaalsContact C-N 3.3Å; G789-K791 PolarHBondContact O-N 3.11Å; G789-R820 CarbonylContact O-C 3.55Å; G789-R820 VanDerWaalsContact O-C 3.3Å; G789-R820 VanDerWaalsContact O-CB 3.3Å; G789-R820 WeakPolarHBondContact O-CB 3.18Å
790	K	84.9	Confident	85.1	Confident	192 Å²	192	51.1 Å²	51.1	84%	0.835	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	20.3	-179.1	-65.3	-174.3	177.5	-177.8	0	113.6
791	K	89.2	Confident	85.7	Confident	107 Å²	107	45.7 Å²	45.7	47%	0.465	23%	0.229	S	C	.	.			trans	-68.5	163.9	178.2	-68.1	-176.9	177.9	-170.5	0	111.3	Q788 G789 C821 K822 A934	Q788-K791 WeakPolarHBondContact O-CG 3.4Å; G789-K791 VanDerWaalsContact C-N 3.3Å; G789-K791 PolarHBondContact O-N 3.11Å; K791-C821 WeakPolarHBondContact O-CA 3Å; K791-C821 WeakPolarHBondContact O-CB 3.33Å; K791-K822 PolarHBondContact O-N 2.96Å; K791-A934 HydrophobicContact CB-CB 3.64Å; K791-A934 HydrophobicContact CD-CB 3.95Å; K791-A934 HydrophobicContact CG-CB 4.47Å
792	T	92.4	Very high	85.9	Confident	30 Å²	30	40.9 Å²	40.9	18%	0.184	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	148.9	178.7	60.3	0	0	0	0	112.4	D794 K822 R824 A934	T792-D794 VanDerWaalsContact CB-OD1 3.31Å; T792-D794 WeakPolarHBondContact CB-OD1 3.19Å; T792-D794 PolarHBondContact OG1-OD1 2.94Å; T792-K822 CarbonylContact C-O 3.49Å; T792-K822 WeakPolarHBondContact CA-O 3.48Å; T792-K822 HydrophobicContact CG2-CB 4.38Å; T792-R824 HydrophobicContact CG2-CG 4.47Å; T792-A934 PolarHBondContact O-N 2.86Å
793	I	94.4	Very high	86	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.1	161.5	-59.4	166.8	0	0	0	106	P809 T813 W818 C821 K822 V823 R824 L935	I793-P809 HydrophobicContact CG2-CB 4.2Å; I793-T813 HydrophobicContact CD1-CG2 3.94Å; I793-W818 HydrophobicContact CD1-CE3 3.86Å; I793-W818 HydrophobicContact CD1-CZ3 4.41Å; I793-W818 HydrophobicContact CG1-CE3 4.14Å; I793-W818 HydrophobicContact CG1-CZ3 4.26Å; I793-C821 HydrophobicContact CD1-CB 3.91Å; I793-C821 HydrophobicContact CG1-CB 3.94Å; I793-K822 PolarHBondContact N-O 2.92Å; I793-V823 HydrophobicContact CB-CG2 4.37Å; I793-V823 HydrophobicContact CD1-CG2 4.44Å; I793-V823 WeakPolarHBondContact O-CA 3.38Å; I793-R824 PolarHBondContact O-N 3.3Å; I793-L935 WeakPolarHBondContact CA-O 3.44Å; I793-L935 HydrophobicContact CG2-CB 4.4Å; I793-L935 HydrophobicContact CG2-CD2 4.49Å
794	D	95.3	Very high	86.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	-174.3	-66.6	-9.5	0	0	0	109.2	T792 Y796 R824 F826 S930 A933 L935 I936 V937	T792-D794 VanDerWaalsContact CB-OD1 3.31Å; T792-D794 WeakPolarHBondContact CB-OD1 3.19Å; T792-D794 PolarHBondContact OG1-OD1 2.94Å; D794-Y796 HydrophobicContact CB-CE2 4.07Å; D794-R824 VanDerWaalsContact CG-NH2 3.3Å; D794-R824 IonicContact OD1-CZ 2.69Å; D794-R824 IonicContact OD1-NE 3.88Å; D794-R824 PolarHBondContact OD1-NE 2.71Å; D794-R824 IonicContact OD1-NH2 3.29Å; D794-R824 PolarHBondContact OD1-NH2 3.1Å; D794-R824 IonicContact OD2-CZ 2.9Å; D794-R824 IonicContact OD2-NE 2.75Å; D794-R824 IonicContact OD2-NH2 3.8Å; D794-R824 PolarHBondContact OD2-NH2 3.39Å; D794-F826 HydrophobicContact CB-CD2 4.32Å; D794-F826 HydrophobicContact CB-CE2 3.79Å; D794-S930 WeakPolarHBondContact CB-OG 3.4Å; D794-S930 VanDerWaalsContact OD2-CB 3.26Å; D794-S930 WeakPolarHBondContact OD2-CB 3.42Å; D794-S930 PolarHBondContact OD2-OG 2.9Å; D794-A933 HydrophobicContact CB-CB 4.43Å; D794-A933 WeakPolarHBondContact OD2-CB 3.48Å; D794-L935 PolarHBondContact N-O 2.91Å; D794-I936 CarbonylContact O-C 3.5Å; D794-I936 WeakPolarHBondContact O-CA 3.35Å; D794-V937 PolarHBondContact O-N 2.87Å
795	I	95.1	Very high	86.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.1	-176	-52	173.5	0	0	0	108.9	T805 L806 P809 V823 R824 I825 F826 F852 V937	I795-T805 HydrophobicContact CG2-CG2 3.62Å; I795-L806 HydrophobicContact CD1-CD2 4.4Å; I795-L806 HydrophobicContact CG2-CD2 4.28Å; I795-P809 HydrophobicContact CD1-CB 3.57Å; I795-P809 HydrophobicContact CD1-CG 3.51Å; I795-P809 HydrophobicContact CG1-CB 4.16Å; I795-P809 HydrophobicContact CG1-CG 3.79Å; I795-V823 HydrophobicContact CD1-CG1 3.37Å; I795-V823 HydrophobicContact CG1-CG1 4.01Å; I795-R824 PolarHBondContact N-O 3.4Å; I795-I825 HydrophobicContact CB-CG1 4.29Å; I795-I825 HydrophobicContact CD1-CG1 4.13Å; I795-I825 CarbonylContact O-C 3.52Å; I795-I825 WeakPolarHBondContact O-CA 3.31Å; I795-F826 PolarHBondContact O-N 2.77Å; I795-F852 HydrophobicContact CD1-CE2 4.39Å; I795-V937 CarbonylContact C-O 3.43Å; I795-V937 VanDerWaalsContact CA-O 3.3Å; I795-V937 WeakPolarHBondContact CA-O 3.45Å
796	Y	93.6	Very high	86.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	93.3	174.8	-70.5	-100.3	0	0	0	109	D794 L798 F826 I858 V925 L926 S930 I936 V937 I938 T939	D794-Y796 HydrophobicContact CB-CE2 4.07Å; Y796-L798 PolarHBondContact O-N 2.67Å; Y796-F826 HydrophobicContact CD1-CB 3.68Å; Y796-F826 HydrophobicContact CD1-CD2 4.47Å; Y796-F826 HydrophobicContact CD1-CG 4.23Å; Y796-F826 HydrophobicContact CD2-CD2 4.23Å; Y796-F826 HydrophobicContact CE1-CB 3.83Å; Y796-F826 HydrophobicContact CE1-CD1 4.49Å; Y796-F826 HydrophobicContact CE1-CD2 4.12Å; Y796-F826 AromaticContact CE1-CG 3.9Å; Y796-F826 HydrophobicContact CE1-CG 3.9Å; Y796-F826 AromaticContact CE2-CD2 3.83Å; Y796-F826 HydrophobicContact CE2-CD2 3.83Å; Y796-F826 HydrophobicContact CE2-CE2 4.28Å; Y796-F826 HydrophobicContact CE2-CG 4.44Å; Y796-F826 HydrophobicContact CG-CB 4.12Å; Y796-F826 AromaticContact CZ-CD2 3.78Å; Y796-I858 HydrophobicContact CD1-CD1 4.35Å; Y796-I858 HydrophobicContact CE1-CD1 3.79Å; Y796-V925 HydrophobicContact CE1-CG1 4.43Å; Y796-L926 HydrophobicContact CD1-CD2 4.01Å; Y796-L926 HydrophobicContact CD2-CD2 3.62Å; Y796-L926 HydrophobicContact CE1-CD2 3.71Å; Y796-L926 HydrophobicContact CE2-CD2 3.31Å; Y796-L926 HydrophobicContact CG-CD2 3.96Å; Y796-S930 WeakPolarHBondContact CE2-OG 3.37Å; Y796-S930 PolarHBondContact OH-OG 2.99Å; Y796-I936 HydrophobicContact CD2-CG2 3.97Å; Y796-I936 HydrophobicContact CE2-CG2 4.03Å; Y796-V937 PolarHBondContact N-O 3.09Å; Y796-I938 HydrophobicContact CG-CD1 4.39Å; Y796-T939 PolarHBondContact O-N 2.96Å; Y796-T939 VanDerWaalsContact O-N 3.1Å; Y796-T939 PolarHBondContact O-OG1 2.79Å
797	W	91.1	Very high	87.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.			trans	-93.2	81.4	-178.5	-168.1	33.6	0	0	0	109.7	P28 Y33 L806 F826 V827 V841 L844	P28-W797 HydrophobicContact CB-CD2 3.82Å; P28-W797 HydrophobicContact CB-CE3 3.79Å; P28-W797 HydrophobicContact CB-CH2 3.25Å; P28-W797 HydrophobicContact CB-CZ2 3.25Å; P28-W797 HydrophobicContact CB-CZ3 3.51Å; P28-W797 HydrophobicContact CG-CD2 3.69Å; P28-W797 HydrophobicContact CG-CE3 3.61Å; P28-W797 HydrophobicContact CG-CG 4.37Å; P28-W797 HydrophobicContact CG-CH2 4.04Å; P28-W797 HydrophobicContact CG-CZ2 4.11Å; P28-W797 HydrophobicContact CG-CZ3 3.78Å; Y33-W797 HydrophobicContact CE2-CZ2 4.37Å; W797-L806 HydrophobicContact CD2-CD1 4.11Å; W797-L806 HydrophobicContact CD2-CG 4.36Å; W797-L806 HydrophobicContact CE3-CD1 4.05Å; W797-L806 HydrophobicContact CH2-CD1 3.83Å; W797-L806 HydrophobicContact CZ2-CD1 3.89Å; W797-L806 HydrophobicContact CZ3-CD1 3.93Å; W797-F826 PolarHBondContact N-O 3.4Å; W797-V827 HydrophobicContact CE3-CG2 4.49Å; W797-V841 HydrophobicContact CZ3-CG1 4.37Å; W797-L844 HydrophobicContact CH2-CD2 3.78Å; W797-L844 HydrophobicContact CZ3-CD2 4.2Å
798	L	87.3	Confident	87.7	Confident	16 Å²	16	20.5 Å²	20.5	8%	0.084	11%	0.105	C	C	.	.			trans	-95.6	-23.2	-168	-58.9	179.6	0	0	0	113.8	Y796 I861 L922 I938 T939	Y796-L798 PolarHBondContact O-N 2.67Å; L798-I861 HydrophobicContact CD2-CD1 3.67Å; L798-L922 HydrophobicContact CD1-CD1 3.84Å; L798-L922 HydrophobicContact CD1-CD2 3.61Å; L798-L922 HydrophobicContact CD1-CG 4.4Å; L798-I938 HydrophobicContact CD1-CD1 4.1Å; L798-I938 HydrophobicContact CD1-CG1 4.24Å; L798-T939 PolarHBondContact N-OG1 3.44Å
799	S	83.2	Confident	88	Confident	13 Å²	13	19.8 Å²	19.8	9%	0.091	10%	0.101	C	C	.	.	S	Bend	trans	-139.3	151.3	174.8	-45.8	0	0	0	0	109.1	D801	S799-D801 PolarHBondContact O-N 3.45Å
800	D	78.3	Confident	88.4	Confident	5 Å²	5	20.4 Å²	20.4	3%	0.027	9%	0.094	C	C	.	.			trans	-66.7	130.2	172.8	-168.1	23.9	0	0	0	110.8	A26 F32 Y33 R46 Q975	A26-D800 PolarHBondContact O-N 2.78Å; F32-D800 WeakPolarHBondContact CB-OD2 3.22Å; F32-D800 HydrophobicContact CD2-CB 4.18Å; F32-D800 WeakPolarHBondContact CD2-OD2 3.5Å; F32-D800 HydrophobicContact CE2-CB 4.35Å; F32-D800 WeakPolarHBondContact CG-OD2 3.32Å; Y33-D800 PolarHBondContact OH-OD1 3.15Å; R46-D800 IonicContact CZ-OD1 2.72Å; R46-D800 IonicContact CZ-OD2 2.81Å; R46-D800 IonicContact NE-OD2 2.87Å; R46-D800 PolarHBondContact NE-OD2 3.4Å; R46-D800 VanDerWaalsContact NH2-CG 3.29Å; R46-D800 IonicContact NH2-OD1 3.5Å; R46-D800 PolarHBondContact NH2-OD1 3.36Å; R46-D800 IonicContact NH2-OD2 3.25Å; R46-D800 PolarHBondContact NH2-OD2 3.42Å; D800-Q975 PolarHBondContact O-NE2 3.27Å; D800-Q975 PolarHBondContact O-OE1 3.15Å; D800-Q975 VanDerWaalsContact O-OE1 3.1Å
801	D	78.8	Confident	88.7	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.059	C	C	.	.			trans	-134.9	17	-174	78.9	-34	0	0	0	112.3	S799 G803 T805 G973 Q975	S799-D801 PolarHBondContact O-N 3.45Å; D801-G803 VanDerWaalsContact C-N 3.25Å; D801-G803 PolarHBondContact O-N 2.8Å; D801-G803 PolarHBondContact OD1-N 2.85Å; D801-G803 VanDerWaalsContact OD1-N 3.07Å; D801-T805 VanDerWaalsContact OD2-CB 3.23Å; D801-T805 WeakPolarHBondContact OD2-CB 3.31Å; D801-T805 PolarHBondContact OD2-N 2.97Å; D801-T805 PolarHBondContact OD2-OG1 3.34Å; D801-G973 WeakPolarHBondContact O-CA 3.28Å; D801-Q975 VanDerWaalsContact CA-OE1 3.24Å
802	G	73.8	Confident	88.8	Confident	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-2.1	-174.7	0	0	0	0	0	115.1	E976 V978	G802-E976 WeakPolarHBondContact CA-O 3.46Å; G802-V978 WeakPolarHBondContact O-CB 3.37Å; G802-V978 PolarHBondContact O-N 2.73Å
803	G	84.1	Confident	88.7	Confident	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	6.9	176.3	0	0	0	0	0	114.1	Y33 D801 T805 L806 L807	Y33-G803 PolarHBondContact OH-N 2.85Å; D801-G803 VanDerWaalsContact C-N 3.25Å; D801-G803 PolarHBondContact O-N 2.8Å; D801-G803 PolarHBondContact OD1-N 2.85Å; D801-G803 VanDerWaalsContact OD1-N 3.07Å; G803-T805 VanDerWaalsContact C-N 3.32Å; G803-T805 PolarHBondContact O-N 2.88Å; G803-L806 PolarHBondContact O-N 2.76Å; G803-L807 PolarHBondContact O-N 3.36Å
804	L	88.6	Confident	88.5	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.9	-40.5	176.9	-176	63	0	0	0	111.4	V692 L806 L807 L808 V971	V692-L804 HydrophobicContact CG2-CD1 4.43Å; V692-L804 HydrophobicContact CG2-CD2 4.06Å; L804-L806 PolarHBondContact O-N 2.75Å; L804-L807 PolarHBondContact O-N 2.93Å; L804-L808 HydrophobicContact CD1-CD1 4.41Å; L804-L808 HydrophobicContact CD1-CD2 4.23Å; L804-L808 HydrophobicContact CD1-CG 4.08Å; L804-L808 HydrophobicContact CG-CD1 4.28Å; L804-L808 HydrophobicContact CG-CG 4.37Å; L804-L808 PolarHBondContact O-N 3.36Å; L804-L808 VanDerWaalsContact O-N 3.16Å; L804-V971 HydrophobicContact CB-CG1 4.43Å; L804-V971 HydrophobicContact CD2-CG1 4.1Å; L804-V971 HydrophobicContact CG-CG1 4.05Å
805	T	91	Very high	88.2	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-56.3	-30.8	175.4	-67.2	0	0	0	0	112.7	I795 D801 G803 P809 V937	I795-T805 HydrophobicContact CG2-CG2 3.62Å; D801-T805 VanDerWaalsContact OD2-CB 3.23Å; D801-T805 WeakPolarHBondContact OD2-CB 3.31Å; D801-T805 PolarHBondContact OD2-N 2.97Å; D801-T805 PolarHBondContact OD2-OG1 3.34Å; G803-T805 VanDerWaalsContact C-N 3.32Å; G803-T805 PolarHBondContact O-N 2.88Å; T805-P809 WeakPolarHBondContact O-CD 3.24Å; T805-P809 WeakPolarHBondContact O-CG 3.33Å; T805-V937 HydrophobicContact CG2-CG1 4.14Å
806	L	90.8	Very high	87.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-88.2	-36	176.8	-65.6	174.6	0	0	0	112.9	I795 W797 G803 L804 Y810 I825 L850 L979	I795-L806 HydrophobicContact CD1-CD2 4.4Å; I795-L806 HydrophobicContact CG2-CD2 4.28Å; W797-L806 HydrophobicContact CD2-CD1 4.11Å; W797-L806 HydrophobicContact CD2-CG 4.36Å; W797-L806 HydrophobicContact CE3-CD1 4.05Å; W797-L806 HydrophobicContact CH2-CD1 3.83Å; W797-L806 HydrophobicContact CZ2-CD1 3.89Å; W797-L806 HydrophobicContact CZ3-CD1 3.93Å; G803-L806 PolarHBondContact O-N 2.76Å; L804-L806 PolarHBondContact O-N 2.75Å; L806-Y810 PolarHBondContact O-N 2.85Å; L806-I825 HydrophobicContact CD2-CD1 4.09Å; L806-I825 HydrophobicContact CD2-CG1 4.46Å; L806-L850 HydrophobicContact CB-CD1 3.98Å; L806-L850 HydrophobicContact CD1-CD1 4.4Å; L806-L979 HydrophobicContact CB-CD1 4.13Å
807	L	90.5	Very high	87.7	Confident	18 Å²	18	32 Å²	32	9%	0.094	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-40.7	-177.9	-179.1	65	0	0	0	112.2	Y597 G803 L804 Y810 L811 V978 L979	Y597-L807 HydrophobicContact CD1-CD2 4.11Å; Y597-L807 HydrophobicContact CE1-CD2 4.23Å; G803-L807 PolarHBondContact O-N 3.36Å; L804-L807 PolarHBondContact O-N 2.93Å; L807-Y810 HydrophobicContact CD1-CD1 4.12Å; L807-Y810 WeakPolarHBondContact O-CB 3.27Å; L807-Y810 PolarHBondContact O-N 3.28Å; L807-L811 HydrophobicContact CD1-CD1 4.29Å; L807-L811 HydrophobicContact CD1-CG 4.11Å; L807-L811 HydrophobicContact CD2-CD1 4.41Å; L807-L811 HydrophobicContact CG-CD1 4Å; L807-L811 HydrophobicContact CG-CG 4.26Å; L807-L811 WeakPolarHBondContact O-CG 3.21Å; L807-L811 PolarHBondContact O-N 3.01Å; L807-V978 HydrophobicContact CB-CG1 4.16Å; L807-V978 HydrophobicContact CD2-CG1 3.29Å; L807-V978 HydrophobicContact CG-CG1 4.29Å; L807-L979 HydrophobicContact CD1-CD2 4.2Å
808	L	91.4	Very high	87.7	Confident	0 Å²	0	32 Å²	32	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-51	-176.2	-64.1	175.4	0	0	0	112.5	P599 F621 L804 Y810 L811 L812 L969 V971	P599-L808 HydrophobicContact CB-CD2 4.2Å; P599-L808 HydrophobicContact CG-CD2 4.33Å; F621-L808 HydrophobicContact CD2-CD2 3.85Å; F621-L808 HydrophobicContact CE1-CD2 4.46Å; F621-L808 HydrophobicContact CE2-CD2 3.71Å; F621-L808 HydrophobicContact CG-CD2 4.29Å; F621-L808 HydrophobicContact CZ-CD2 4.03Å; L804-L808 HydrophobicContact CD1-CD1 4.41Å; L804-L808 HydrophobicContact CD1-CD2 4.23Å; L804-L808 HydrophobicContact CD1-CG 4.08Å; L804-L808 HydrophobicContact CG-CD1 4.28Å; L804-L808 HydrophobicContact CG-CG 4.37Å; L804-L808 PolarHBondContact O-N 3.36Å; L804-L808 VanDerWaalsContact O-N 3.16Å; L808-Y810 VanDerWaalsContact C-N 3.31Å; L808-Y810 PolarHBondContact O-N 3.19Å; L808-L811 PolarHBondContact O-N 2.99Å; L808-L812 WeakPolarHBondContact O-CG 3.48Å; L808-L812 PolarHBondContact O-N 3.12Å; L808-L969 HydrophobicContact CD1-CD2 4.32Å; L808-V971 HydrophobicContact CD1-CG1 4.24Å; L808-V971 HydrophobicContact CD1-CG2 4.09Å
809	P	92.4	Very high	87.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-38	172.9	-28.1	38.8	0	0	0	113.8	I793 I795 T805 L812 T813 V937	I793-P809 HydrophobicContact CG2-CB 4.2Å; I795-P809 HydrophobicContact CD1-CB 3.57Å; I795-P809 HydrophobicContact CD1-CG 3.51Å; I795-P809 HydrophobicContact CG1-CB 4.16Å; I795-P809 HydrophobicContact CG1-CG 3.79Å; T805-P809 WeakPolarHBondContact O-CD 3.24Å; T805-P809 WeakPolarHBondContact O-CG 3.33Å; P809-L812 WeakPolarHBondContact O-CB 3.21Å; P809-L812 PolarHBondContact O-N 2.92Å; P809-T813 VanDerWaalsContact O-CG2 3.29Å; P809-T813 WeakPolarHBondContact O-CG2 3.46Å; P809-T813 PolarHBondContact O-N 2.67Å; P809-V937 HydrophobicContact CG-CB 4.33Å; P809-V937 HydrophobicContact CG-CG1 4.44Å; P809-V937 HydrophobicContact CG-CG2 3.94Å
810	Y	91.3	Very high	88	Confident	48 Å²	48	43.2 Å²	43.2	19%	0.188	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-48	176.2	172	-105.6	0	0	0	111.4	L806 L807 L808 L812 T813 R814 L850 F852	L806-Y810 PolarHBondContact O-N 2.85Å; L807-Y810 HydrophobicContact CD1-CD1 4.12Å; L807-Y810 WeakPolarHBondContact O-CB 3.27Å; L807-Y810 PolarHBondContact O-N 3.28Å; L808-Y810 VanDerWaalsContact C-N 3.31Å; L808-Y810 PolarHBondContact O-N 3.19Å; Y810-L812 VanDerWaalsContact C-N 3.31Å; Y810-L812 PolarHBondContact O-N 2.96Å; Y810-T813 PolarHBondContact O-N 3.42Å; Y810-T813 PolarHBondContact O-OG1 3.2Å; Y810-R814 PolarHBondContact O-N 3.17Å; Y810-R814 VanDerWaalsContact OH-CZ 3.24Å; Y810-R814 PolarHBondContact OH-NE 3.45Å; Y810-R814 VanDerWaalsContact OH-NE 3.13Å; Y810-R814 PolarHBondContact OH-NH2 3.05Å; Y810-L850 HydrophobicContact CD1-CD2 4.22Å; Y810-L850 HydrophobicContact CD2-CB 4.23Å; Y810-L850 HydrophobicContact CD2-CD2 4.01Å; Y810-L850 WeakPolarHBondContact CD2-O 3.35Å; Y810-L850 HydrophobicContact CE2-CD2 4.4Å; Y810-L850 HydrophobicContact CG-CD2 3.9Å; Y810-F852 HydrophobicContact CD2-CZ 4.47Å
811	L	91.3	Very high	88.6	Confident	20 Å²	20	43.6 Å²	43.6	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-36.2	176.2	-67.5	175.5	0	0	0	112.5	P599 F621 L625 L807 L808 R814	P599-L811 HydrophobicContact CG-CD1 3.62Å; F621-L811 HydrophobicContact CB-CB 3.76Å; F621-L811 HydrophobicContact CB-CD1 4.48Å; L625-L811 HydrophobicContact CD1-CD2 4.28Å; L807-L811 HydrophobicContact CD1-CD1 4.29Å; L807-L811 HydrophobicContact CD1-CG 4.11Å; L807-L811 HydrophobicContact CD2-CD1 4.41Å; L807-L811 HydrophobicContact CG-CD1 4Å; L807-L811 HydrophobicContact CG-CG 4.26Å; L807-L811 WeakPolarHBondContact O-CG 3.21Å; L807-L811 PolarHBondContact O-N 3.01Å; L808-L811 PolarHBondContact O-N 2.99Å; L811-R814 PolarHBondContact O-N 3.43Å
812	L	90.6	Very high	89.2	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-49.8	175.1	-75.2	172.7	0	0	0	111.5	L617 C620 F621 L808 P809 Y810 R814 R815 W818 L935	L617-L812 HydrophobicContact CD1-CD1 4.48Å; L617-L812 HydrophobicContact CD1-CD2 4.43Å; C620-L812 HydrophobicContact CB-CD2 3.4Å; F621-L812 HydrophobicContact CB-CD2 4.16Å; F621-L812 HydrophobicContact CB-CG 4.29Å; F621-L812 HydrophobicContact CD1-CD2 4.02Å; F621-L812 HydrophobicContact CD1-CG 4.31Å; L808-L812 WeakPolarHBondContact O-CG 3.48Å; L808-L812 PolarHBondContact O-N 3.12Å; P809-L812 WeakPolarHBondContact O-CB 3.21Å; P809-L812 PolarHBondContact O-N 2.92Å; Y810-L812 VanDerWaalsContact C-N 3.31Å; Y810-L812 PolarHBondContact O-N 2.96Å; L812-R814 PolarHBondContact O-N 3.39Å; L812-R814 VanDerWaalsContact O-N 3.14Å; L812-R815 WeakPolarHBondContact O-CB 3.49Å; L812-R815 PolarHBondContact O-N 2.78Å; L812-W818 WeakPolarHBondContact O-CB 3.36Å; L812-L935 HydrophobicContact CD1-CD2 3.6Å
813	T	91.1	Very high	90.1	Very high	29 Å²	29	49.2 Å²	49.2	18%	0.178	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-23.2	-177.8	63.8	0	0	0	0	113.6	I793 P809 Y810 R815 A819 V823	I793-T813 HydrophobicContact CD1-CG2 3.94Å; P809-T813 VanDerWaalsContact O-CG2 3.29Å; P809-T813 WeakPolarHBondContact O-CG2 3.46Å; P809-T813 PolarHBondContact O-N 2.67Å; Y810-T813 PolarHBondContact O-N 3.42Å; Y810-T813 PolarHBondContact O-OG1 3.2Å; T813-R815 PolarHBondContact O-N 3.38Å; T813-A819 WeakPolarHBondContact O-CA 3.32Å; T813-A819 WeakPolarHBondContact O-CB 3.19Å; T813-V823 HydrophobicContact CG2-CG2 3.53Å
814	R	89.3	Confident	90.5	Very high	174 Å²	174	51.5 Å²	51.5	66%	0.657	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.7	173.3	-72.5	-173.8	158	-136.5	-5.5	114.1	Y810 L811 L812	Y810-R814 PolarHBondContact O-N 3.17Å; Y810-R814 VanDerWaalsContact OH-CZ 3.24Å; Y810-R814 PolarHBondContact OH-NE 3.45Å; Y810-R814 VanDerWaalsContact OH-NE 3.13Å; Y810-R814 PolarHBondContact OH-NH2 3.05Å; L811-R814 PolarHBondContact O-N 3.43Å; L812-R814 PolarHBondContact O-N 3.39Å; L812-R814 VanDerWaalsContact O-N 3.14Å
815	R	89.3	Confident	90.7	Very high	51 Å²	51	51.5 Å²	51.5	19%	0.192	23%	0.225	C	C	.	.	S	Bend	trans	-92.3	143.1	178.2	-57.5	-53.1	-177	170.9	-1.1	112.3	C620 F621 K623 L625 L812 T813 R817 W818 A819	C620-R815 WeakPolarHBondContact O-CD 3.28Å; C620-R815 WeakPolarHBondContact O-CG 3.49Å; C620-R815 PolarHBondContact O-NE 3.02Å; F621-R815 PolarHBondContact O-NH2 2.87Å; K623-R815 PolarHBondContact O-NH1 3.1Å; K623-R815 PolarHBondContact O-NH2 3.2Å; L625-R815 VanDerWaalsContact CD1-NH2 3.29Å; L812-R815 WeakPolarHBondContact O-CB 3.49Å; L812-R815 PolarHBondContact O-N 2.78Å; T813-R815 PolarHBondContact O-N 3.38Å; R815-R817 PolarHBondContact O-N 2.75Å; R815-W818 CarbonylContact O-C 3.58Å; R815-W818 PolarHBondContact O-N 3.09Å; R815-A819 WeakPolarHBondContact O-CB 2.95Å; R815-A819 PolarHBondContact O-N 3.32Å
816	K	87.8	Confident	90.8	Very high	204 Å²	204	51.5 Å²	51.5	89%	0.887	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-31.6	178.8	-64.9	-174.1	178.7	-176.9	0	114.8
817	R	89.8	Confident	90.6	Very high	93 Å²	93	51.8 Å²	51.8	35%	0.351	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-25.9	-179.2	-65.6	-178.3	-175.6	155.8	0.1	113.7	F784 Q785 Q788 R815	F784-R817 WeakPolarHBondContact O-CD 3.07Å; F784-R817 PolarHBondContact O-NH1 3.38Å; F784-R817 VanDerWaalsContact O-NH1 3.15Å; Q785-R817 PolarHBondContact O-NE 3.38Å; Q788-R817 PolarHBondContact N-O 3.25Å; Q788-R817 VanDerWaalsContact N-O 3.16Å; R815-R817 PolarHBondContact O-N 2.75Å
818	W	91.1	Very high	90.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-5.1	-172.3	-63	90.9	0	0	0	113.2	F784 Q788 I793 L812 R815 R820 C821 A934 L935	F784-W818 HydrophobicContact CD1-CH2 4.27Å; F784-W818 AromaticContact CD1-CZ2 3.73Å; F784-W818 HydrophobicContact CD1-CZ2 3.73Å; F784-W818 HydrophobicContact CE1-CH2 4.44Å; F784-W818 HydrophobicContact CE1-CZ2 4.33Å; Q788-W818 HydrophobicContact CB-CE3 4.33Å; Q788-W818 HydrophobicContact CB-CZ3 4.45Å; Q788-W818 HydrophobicContact CG-CD2 3.85Å; Q788-W818 HydrophobicContact CG-CE3 3.76Å; Q788-W818 HydrophobicContact CG-CH2 3.64Å; Q788-W818 HydrophobicContact CG-CZ2 3.68Å; Q788-W818 HydrophobicContact CG-CZ3 3.69Å; I793-W818 HydrophobicContact CD1-CE3 3.86Å; I793-W818 HydrophobicContact CD1-CZ3 4.41Å; I793-W818 HydrophobicContact CG1-CE3 4.14Å; I793-W818 HydrophobicContact CG1-CZ3 4.26Å; L812-W818 WeakPolarHBondContact O-CB 3.36Å; R815-W818 CarbonylContact O-C 3.58Å; R815-W818 PolarHBondContact O-N 3.09Å; W818-R820 PolarHBondContact O-N 3.08Å; W818-R820 VanDerWaalsContact O-N 3.09Å; W818-C821 VanDerWaalsContact O-CB 3.3Å; W818-C821 WeakPolarHBondContact O-CB 3.48Å; W818-C821 PolarHBondContact O-N 3.33Å; W818-A934 HydrophobicContact CZ3-CB 3.93Å; W818-L935 HydrophobicContact CH2-CB 4.25Å; W818-L935 HydrophobicContact CZ3-CB 4.01Å
819	A	88	Confident	89.6	Confident	61 Å²	61	51.3 Å²	51.3	50%	0.504	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.2	-175.9	0	0	0	0	0	115.8	T813 R815	T813-A819 WeakPolarHBondContact O-CA 3.32Å; T813-A819 WeakPolarHBondContact O-CB 3.19Å; R815-A819 WeakPolarHBondContact O-CB 2.95Å; R815-A819 PolarHBondContact O-N 3.32Å
820	R	88.9	Confident	88.7	Confident	204 Å²	204	56.1 Å²	56.1	77%	0.77	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-2	175.4	-67.6	-174	179.2	-177.1	-1.6	113.1	G789 W818	G789-R820 CarbonylContact O-C 3.55Å; G789-R820 VanDerWaalsContact O-C 3.3Å; G789-R820 VanDerWaalsContact O-CB 3.3Å; G789-R820 WeakPolarHBondContact O-CB 3.18Å; W818-R820 PolarHBondContact O-N 3.08Å; W818-R820 VanDerWaalsContact O-N 3.09Å
821	C	90.3	Very high	87.8	Confident	12 Å²	12	58.6 Å²	58.6	8%	0.081	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-75.6	135	178	-62.5	0	0	0	0	110.2	Q788 K791 I793 W818	Q788-C821 VanDerWaalsContact CB-SG 3.59Å; K791-C821 WeakPolarHBondContact O-CA 3Å; K791-C821 WeakPolarHBondContact O-CB 3.33Å; I793-C821 HydrophobicContact CD1-CB 3.91Å; I793-C821 HydrophobicContact CG1-CB 3.94Å; W818-C821 VanDerWaalsContact O-CB 3.3Å; W818-C821 WeakPolarHBondContact O-CB 3.48Å; W818-C821 PolarHBondContact O-N 3.33Å
822	K	91.3	Very high	86.9	Confident	106 Å²	106	65.1 Å²	65.1	46%	0.461	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	134.8	173.7	-173.5	176.9	178.1	-173.7	0	108.9	K791 T792 I793 D854	K791-K822 PolarHBondContact O-N 2.96Å; T792-K822 CarbonylContact C-O 3.49Å; T792-K822 WeakPolarHBondContact CA-O 3.48Å; T792-K822 HydrophobicContact CG2-CB 4.38Å; I793-K822 PolarHBondContact N-O 2.92Å; K822-D854 WeakPolarHBondContact CE-OD1 3.45Å; K822-D854 WeakPolarHBondContact CE-OD2 3.43Å; K822-D854 VanDerWaalsContact NZ-CG 3.27Å; K822-D854 IonicContact NZ-OD1 3.68Å; K822-D854 PolarHBondContact NZ-OD1 3.31Å; K822-D854 IonicContact NZ-OD2 3.72Å; K822-D854 PolarHBondContact NZ-OD2 2.81Å
823	V	93	Very high	86.1	Confident	12 Å²	12	69.4 Å²	69.4	7%	0.073	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.3	-179.4	-177.9	0	0	0	0	109.5	I793 I795 T813 F852	I793-V823 HydrophobicContact CB-CG2 4.37Å; I793-V823 HydrophobicContact CD1-CG2 4.44Å; I793-V823 WeakPolarHBondContact O-CA 3.38Å; I795-V823 HydrophobicContact CD1-CG1 3.37Å; I795-V823 HydrophobicContact CG1-CG1 4.01Å; T813-V823 HydrophobicContact CG2-CG2 3.53Å; V823-F852 HydrophobicContact CB-CD1 3.61Å; V823-F852 HydrophobicContact CB-CE1 3.77Å; V823-F852 HydrophobicContact CB-CG 4.37Å; V823-F852 HydrophobicContact CG1-CD1 3.71Å; V823-F852 HydrophobicContact CG1-CE1 3.72Å; V823-F852 HydrophobicContact CG1-CE2 4.46Å; V823-F852 HydrophobicContact CG1-CG 4.11Å; V823-F852 HydrophobicContact CG1-CZ 4.07Å; V823-F852 HydrophobicContact CG2-CD1 3.97Å; V823-F852 HydrophobicContact CG2-CE1 3.65Å; V823-F852 HydrophobicContact CG2-CZ 4.49Å
824	R	93.6	Very high	85.5	Confident	49 Å²	49	72.2 Å²	72.2	19%	0.185	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.8	174.9	-59.6	-169.4	-65	169.4	-0.7	109.7	T792 I793 D794 I795 F826 D854 E856 Y929	T792-R824 HydrophobicContact CG2-CG 4.47Å; I793-R824 PolarHBondContact O-N 3.3Å; D794-R824 VanDerWaalsContact CG-NH2 3.3Å; D794-R824 IonicContact OD1-CZ 2.69Å; D794-R824 IonicContact OD1-NE 3.88Å; D794-R824 PolarHBondContact OD1-NE 2.71Å; D794-R824 IonicContact OD1-NH2 3.29Å; D794-R824 PolarHBondContact OD1-NH2 3.1Å; D794-R824 IonicContact OD2-CZ 2.9Å; D794-R824 IonicContact OD2-NE 2.75Å; D794-R824 IonicContact OD2-NH2 3.8Å; D794-R824 PolarHBondContact OD2-NH2 3.39Å; I795-R824 PolarHBondContact N-O 3.4Å; R824-F826 HydrophobicContact CB-CE2 3.83Å; R824-F826 HydrophobicContact CB-CZ 4.22Å; R824-D854 HydrophobicContact CG-CB 4.37Å; R824-E856 IonicContact NH1-OE1 2.79Å; R824-Y929 PolarHBondContact NH2-O 2.88Å
825	I	92.4	Very high	85.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.8	-179.1	-62.6	165.3	0	0	0	109	I795 L806 V827 I845 F852 D854 V855 E856	I795-I825 HydrophobicContact CB-CG1 4.29Å; I795-I825 HydrophobicContact CD1-CG1 4.13Å; I795-I825 CarbonylContact O-C 3.52Å; I795-I825 WeakPolarHBondContact O-CA 3.31Å; L806-I825 HydrophobicContact CD2-CD1 4.09Å; L806-I825 HydrophobicContact CD2-CG1 4.46Å; I825-V827 HydrophobicContact CG2-CG2 4.12Å; I825-I845 HydrophobicContact CD1-CD1 3.49Å; I825-I845 VanDerWaalsContact CD1-CD1 3.49Å; I825-I845 HydrophobicContact CD1-CG1 4.28Å; I825-I845 HydrophobicContact CG2-CD1 4.39Å; I825-F852 HydrophobicContact CD1-CB 3.66Å; I825-F852 HydrophobicContact CD1-CD2 3.57Å; I825-F852 HydrophobicContact CD1-CE2 4.47Å; I825-F852 HydrophobicContact CD1-CG 3.92Å; I825-D854 PolarHBondContact N-O 2.82Å; I825-V855 HydrophobicContact CB-CG2 4.24Å; I825-V855 CarbonylContact O-C 3.53Å; I825-V855 VanDerWaalsContact O-CA 3.31Å; I825-V855 WeakPolarHBondContact O-CA 3.44Å; I825-E856 PolarHBondContact O-N 2.83Å
826	F	91.9	Very high	84.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.9	179.1	-62.5	-84.3	0	0	0	109.7	D794 I795 Y796 W797 R824 E856 I858 Y929	D794-F826 HydrophobicContact CB-CD2 4.32Å; D794-F826 HydrophobicContact CB-CE2 3.79Å; I795-F826 PolarHBondContact O-N 2.77Å; Y796-F826 HydrophobicContact CD1-CB 3.68Å; Y796-F826 HydrophobicContact CD1-CD2 4.47Å; Y796-F826 HydrophobicContact CD1-CG 4.23Å; Y796-F826 HydrophobicContact CD2-CD2 4.23Å; Y796-F826 HydrophobicContact CE1-CB 3.83Å; Y796-F826 HydrophobicContact CE1-CD1 4.49Å; Y796-F826 HydrophobicContact CE1-CD2 4.12Å; Y796-F826 AromaticContact CE1-CG 3.9Å; Y796-F826 HydrophobicContact CE1-CG 3.9Å; Y796-F826 AromaticContact CE2-CD2 3.83Å; Y796-F826 HydrophobicContact CE2-CD2 3.83Å; Y796-F826 HydrophobicContact CE2-CE2 4.28Å; Y796-F826 HydrophobicContact CE2-CG 4.44Å; Y796-F826 HydrophobicContact CG-CB 4.12Å; Y796-F826 AromaticContact CZ-CD2 3.78Å; W797-F826 PolarHBondContact N-O 3.4Å; R824-F826 HydrophobicContact CB-CE2 3.83Å; R824-F826 HydrophobicContact CB-CZ 4.22Å; F826-E856 VanDerWaalsContact CA-O 3.26Å; F826-E856 WeakPolarHBondContact CA-O 3.39Å; F826-E856 HydrophobicContact CD1-CB 3.66Å; F826-E856 HydrophobicContact CE1-CB 3.74Å; F826-E856 HydrophobicContact CE1-CG 4.24Å; F826-E856 WeakPolarHBondContact CE1-OE2 3.42Å; F826-I858 HydrophobicContact CB-CD1 3.86Å; F826-I858 HydrophobicContact CB-CG1 4.38Å; F826-I858 HydrophobicContact CD1-CD1 3.6Å; F826-I858 HydrophobicContact CD1-CG1 3.93Å; F826-I858 HydrophobicContact CE1-CD1 4.47Å; F826-I858 HydrophobicContact CG-CD1 4.04Å; F826-Y929 HydrophobicContact CE1-CD1 4.15Å
827	V	88.3	Confident	84.3	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	142.9	177.2	-175.5	0	0	0	0	109.8	P28 W797 I825 V841 E856 V857 I858	P28-V827 HydrophobicContact CG-CG1 4.42Å; W797-V827 HydrophobicContact CE3-CG2 4.49Å; I825-V827 HydrophobicContact CG2-CG2 4.12Å; V827-V841 HydrophobicContact CG1-CG2 4.32Å; V827-V841 HydrophobicContact CG2-CG1 3.96Å; V827-V841 HydrophobicContact CG2-CG2 4.29Å; V827-E856 PolarHBondContact N-O 3.09Å; V827-V857 CarbonylContact O-C 3.47Å; V827-V857 WeakPolarHBondContact O-CA 3.49Å; V827-I858 PolarHBondContact O-N 3.01Å
828	G	82.8	Confident	84	Confident	8 Å²	8	65.8 Å²	65.8	8%	0.082	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.4	175.7	0	0	0	0	0	112.1	Q837	G828-Q837 PolarHBondContact O-OE1 3.36Å
829	A	77.2	Confident	83.7	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.008	35%	0.354	C	S	.	.			trans	-139.3	159.9	176.3	0	0	0	0	0	111.9	V857 I858 P859 Y862	A829-V857 HydrophobicContact CB-CG1 3.15Å; A829-I858 PolarHBondContact N-O 2.96Å; A829-P859 WeakPolarHBondContact O-CA 3.34Å; A829-Y862 WeakPolarHBondContact O-CE2 3.44Å
830	E	73.3	Confident	83.5	Confident	101 Å²	101	73.6 Å²	73.6	47%	0.472	35%	0.348	S	S	.	.			trans	-72.1	146.5	161.7	-67.2	170.3	166.9	0	0	109.4	D832 K833	E830-D832 PolarHBondContact O-N 3.36Å; E830-D832 VanDerWaalsContact O-N 3.09Å; E830-K833 PolarHBondContact O-N 3.16Å; E830-K833 IonicContact OE2-NZ 2.65Å; E830-K833 PolarHBondContact OE2-NZ 3.4Å
831	T	72	Confident	83.3	Confident	100 Å²	100	64.2 Å²	64.2	61%	0.613	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-53.7	-34.8	-177.1	-38.3	0	0	0	0	112.6	K833 P859	T831-K833 VanDerWaalsContact C-N 3.34Å; T831-K833 PolarHBondContact O-N 3.18Å; T831-P859 HydrophobicContact CG2-CB 4.41Å
832	D	72.5	Confident	83.1	Confident	156 Å²	156	65.5 Å²	65.5	83%	0.834	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-77.1	-16.1	-175.6	-57	-20.8	0	0	0	113.7	E830	E830-D832 PolarHBondContact O-N 3.36Å; E830-D832 VanDerWaalsContact O-N 3.09Å
833	K	75.1	Confident	82.8	Confident	91 Å²	91	62.9 Å²	62.9	40%	0.396	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-118.9	17.4	-174.4	-64.5	176.4	-171.1	141.1	0	113.7	E830 T831 D835 Q837	E830-K833 PolarHBondContact O-N 3.16Å; E830-K833 IonicContact OE2-NZ 2.65Å; E830-K833 PolarHBondContact OE2-NZ 3.4Å; T831-K833 VanDerWaalsContact C-N 3.34Å; T831-K833 PolarHBondContact O-N 3.18Å; K833-D835 PolarHBondContact O-N 3.48Å; K833-Q837 HydrophobicContact CB-CG 4.32Å; K833-Q837 WeakPolarHBondContact O-CB 3.26Å; K833-Q837 WeakPolarHBondContact O-CG 3.44Å; K833-Q837 PolarHBondContact O-N 3.07Å; K833-Q837 VanDerWaalsContact O-N 3.1Å
834	K	77.4	Confident	82.3	Confident	88 Å²	88	62.4 Å²	62.4	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-57.9	-48.9	-171.1	-176.1	-179.5	177.6	178.8	0	113.5	K838 V857	K834-K838 WeakPolarHBondContact O-CB 3.29Å; K834-K838 PolarHBondContact O-N 3.11Å; K834-K838 VanDerWaalsContact O-N 3.16Å; K834-V857 HydrophobicContact CG-CB 4Å; K834-V857 HydrophobicContact CG-CG1 3.89Å
835	D	80.2	Confident	81.9	Confident	119 Å²	119	60.1 Å²	60.1	64%	0.636	30%	0.303	S	S	*	.	H	α-helix	trans	-75.4	-39.5	-174.5	-66.1	-37.5	0	0	0	112.1	K833 K838 E839	K833-D835 PolarHBondContact O-N 3.48Å; D835-K838 WeakPolarHBondContact O-CB 3.43Å; D835-K838 PolarHBondContact O-N 3.44Å; D835-E839 PolarHBondContact O-N 2.89Å
836	E	81.4	Confident	81.6	Confident	139 Å²	139	67.5 Å²	67.5	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-61.1	-48.6	176.6	-172.8	-179.4	-173.2	0	0	111.6	K838 E839 E840	E836-K838 VanDerWaalsContact C-N 3.32Å; E836-K838 PolarHBondContact O-N 2.84Å; E836-E839 PolarHBondContact O-N 3.22Å; E836-E840 PolarHBondContact O-N 2.86Å
837	Q	79.1	Confident	81.1	Confident	48 Å²	48	71.9 Å²	71.9	22%	0.224	35%	0.354	C	S	.	.	H	α-helix	trans	-66.9	-33.9	178.4	-70.3	-172.5	1.9	0	0	112.4	G828 K833 E840 V841	G828-Q837 PolarHBondContact O-OE1 3.36Å; K833-Q837 HydrophobicContact CB-CG 4.32Å; K833-Q837 WeakPolarHBondContact O-CB 3.26Å; K833-Q837 WeakPolarHBondContact O-CG 3.44Å; K833-Q837 PolarHBondContact O-N 3.07Å; K833-Q837 VanDerWaalsContact O-N 3.1Å; Q837-E840 PolarHBondContact O-N 3.48Å; Q837-V841 WeakPolarHBondContact O-CB 2.97Å; Q837-V841 VanDerWaalsContact O-CG2 3.29Å; Q837-V841 WeakPolarHBondContact O-CG2 3.37Å; Q837-V841 PolarHBondContact O-N 2.94Å
838	K	84.3	Confident	80.8	Confident	82 Å²	82	72.6 Å²	72.6	36%	0.357	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-46.5	174.9	-172.8	177.8	176.1	179.6	0	111	K834 D835 E836 L842 V855 V857	K834-K838 WeakPolarHBondContact O-CB 3.29Å; K834-K838 PolarHBondContact O-N 3.11Å; K834-K838 VanDerWaalsContact O-N 3.16Å; D835-K838 WeakPolarHBondContact O-CB 3.43Å; D835-K838 PolarHBondContact O-N 3.44Å; E836-K838 VanDerWaalsContact C-N 3.32Å; E836-K838 PolarHBondContact O-N 2.84Å; K838-L842 HydrophobicContact CG-CD1 3.98Å; K838-L842 VanDerWaalsContact O-CB 3.27Å; K838-L842 WeakPolarHBondContact O-CB 3.44Å; K838-L842 WeakPolarHBondContact O-CD1 3.05Å; K838-L842 VanDerWaalsContact O-CG 3.24Å; K838-L842 WeakPolarHBondContact O-CG 3.32Å; K838-L842 PolarHBondContact O-N 3.47Å; K838-V855 VanDerWaalsContact CE-O 3.26Å; K838-V855 WeakPolarHBondContact CE-O 3.21Å; K838-V857 HydrophobicContact CB-CG2 3.62Å; K838-V857 HydrophobicContact CG-CG2 4.06Å
839	E	84.9	Confident	80.9	Confident	145 Å²	145	82.7 Å²	82.7	68%	0.678	39%	0.392	S	S	*	.	H	α-helix	trans	-66.4	-41.6	177.9	-71.6	-168	166.6	0	0	112.4	D835 E836 L842 S843	D835-E839 PolarHBondContact O-N 2.89Å; E836-E839 PolarHBondContact O-N 3.22Å; E839-L842 PolarHBondContact O-N 2.77Å; E839-S843 WeakPolarHBondContact O-CB 3.4Å; E839-S843 PolarHBondContact O-N 2.87Å
840	E	83.6	Confident	81.1	Confident	79 Å²	79	83.2 Å²	83.2	37%	0.369	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-51.3	177.5	-170.9	-177.2	175.6	0	0	111.2	E836 Q837 S843 L844	E836-E840 PolarHBondContact O-N 2.86Å; Q837-E840 PolarHBondContact O-N 3.48Å; E840-S843 WeakPolarHBondContact O-CB 3.48Å; E840-S843 PolarHBondContact O-N 2.76Å; E840-S843 PolarHBondContact O-OG 3.25Å; E840-L844 PolarHBondContact O-N 2.91Å
841	V	84.3	Confident	81.4	Confident	8 Å²	8	81.4 Å²	81.4	5%	0.048	40%	0.403	C	S	.	.	H	α-helix	trans	-64.5	-42.3	179.5	171.1	0	0	0	0	111.4	W797 V827 Q837 S843 L844 I845 V855	W797-V841 HydrophobicContact CZ3-CG1 4.37Å; V827-V841 HydrophobicContact CG1-CG2 4.32Å; V827-V841 HydrophobicContact CG2-CG1 3.96Å; V827-V841 HydrophobicContact CG2-CG2 4.29Å; Q837-V841 WeakPolarHBondContact O-CB 2.97Å; Q837-V841 VanDerWaalsContact O-CG2 3.29Å; Q837-V841 WeakPolarHBondContact O-CG2 3.37Å; Q837-V841 PolarHBondContact O-N 2.94Å; V841-S843 VanDerWaalsContact C-N 3.3Å; V841-S843 PolarHBondContact O-N 3.44Å; V841-L844 PolarHBondContact O-N 3.14Å; V841-I845 HydrophobicContact CG1-CD1 3.61Å; V841-I845 HydrophobicContact CG1-CG1 4.38Å; V841-I845 WeakPolarHBondContact O-CD1 3.47Å; V841-I845 WeakPolarHBondContact O-CG1 3.4Å; V841-I845 PolarHBondContact O-N 2.79Å; V841-V855 HydrophobicContact CG1-CG1 3.97Å
842	L	85.8	Confident	82.1	Confident	39 Å²	39	77.4 Å²	77.4	20%	0.204	38%	0.377	C	S	.	.	H	α-helix	trans	-60.1	-41.2	174.7	-82.3	168.7	0	0	0	111.6	K838 E839 L844 K846 V855	K838-L842 HydrophobicContact CG-CD1 3.98Å; K838-L842 VanDerWaalsContact O-CB 3.27Å; K838-L842 WeakPolarHBondContact O-CB 3.44Å; K838-L842 WeakPolarHBondContact O-CD1 3.05Å; K838-L842 VanDerWaalsContact O-CG 3.24Å; K838-L842 WeakPolarHBondContact O-CG 3.32Å; K838-L842 PolarHBondContact O-N 3.47Å; E839-L842 PolarHBondContact O-N 2.77Å; L842-L844 VanDerWaalsContact C-N 3.33Å; L842-K846 WeakPolarHBondContact O-CB 3.4Å; L842-K846 VanDerWaalsContact O-CG 3.31Å; L842-K846 WeakPolarHBondContact O-CG 3.39Å; L842-K846 PolarHBondContact O-N 3.11Å; L842-V855 HydrophobicContact CD2-CB 3.76Å; L842-V855 HydrophobicContact CD2-CG2 3.35Å; L842-V855 HydrophobicContact CG-CB 3.9Å; L842-V855 HydrophobicContact CG-CG2 3.83Å
843	S	84.8	Confident	82.4	Confident	50 Å²	50	77.7 Å²	77.7	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-40.6	176.8	86.5	0	0	0	0	111.5	E839 E840 V841 K846 K847	E839-S843 WeakPolarHBondContact O-CB 3.4Å; E839-S843 PolarHBondContact O-N 2.87Å; E840-S843 WeakPolarHBondContact O-CB 3.48Å; E840-S843 PolarHBondContact O-N 2.76Å; E840-S843 PolarHBondContact O-OG 3.25Å; V841-S843 VanDerWaalsContact C-N 3.3Å; V841-S843 PolarHBondContact O-N 3.44Å; S843-K846 PolarHBondContact O-N 2.79Å; S843-K847 WeakPolarHBondContact O-CG 3.41Å; S843-K847 PolarHBondContact O-N 3.46Å
844	L	83.7	Confident	82.9	Confident	3 Å²	3	75.8 Å²	75.8	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-66.2	-46.2	179	-177.3	60.7	0	0	0	111.5	Y30 Y33 W797 E840 V841 L842 K846 K847 F848	Y30-L844 HydrophobicContact CD2-CD1 4.27Å; Y33-L844 HydrophobicContact CD2-CD2 4.41Å; W797-L844 HydrophobicContact CH2-CD2 3.78Å; W797-L844 HydrophobicContact CZ3-CD2 4.2Å; E840-L844 PolarHBondContact O-N 2.91Å; V841-L844 PolarHBondContact O-N 3.14Å; L842-L844 VanDerWaalsContact C-N 3.33Å; L844-K846 PolarHBondContact O-N 3.43Å; L844-K847 WeakPolarHBondContact O-CB 3.38Å; L844-K847 PolarHBondContact O-N 3.2Å; L844-K847 VanDerWaalsContact O-N 3.15Å; L844-F848 HydrophobicContact CD1-CE1 4.37Å; L844-F848 HydrophobicContact CD1-CE2 3.79Å; L844-F848 HydrophobicContact CD1-CZ 3.7Å; L844-F848 HydrophobicContact CD2-CE2 4.14Å; L844-F848 HydrophobicContact CG-CD2 4.2Å; L844-F848 HydrophobicContact CG-CE2 3.57Å; L844-F848 HydrophobicContact CG-CZ 4.01Å; L844-F848 WeakPolarHBondContact O-CD2 3.29Å; L844-F848 PolarHBondContact O-N 2.85Å
845	I	85.4	Confident	83.3	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-40.4	177	-68	160	0	0	0	111.4	I825 V841 K847 F848 R849 F852 V855	I825-I845 HydrophobicContact CD1-CD1 3.49Å; I825-I845 VanDerWaalsContact CD1-CD1 3.49Å; I825-I845 HydrophobicContact CD1-CG1 4.28Å; I825-I845 HydrophobicContact CG2-CD1 4.39Å; V841-I845 HydrophobicContact CG1-CD1 3.61Å; V841-I845 HydrophobicContact CG1-CG1 4.38Å; V841-I845 WeakPolarHBondContact O-CD1 3.47Å; V841-I845 WeakPolarHBondContact O-CG1 3.4Å; V841-I845 PolarHBondContact O-N 2.79Å; I845-K847 VanDerWaalsContact C-N 3.31Å; I845-K847 PolarHBondContact O-N 3.29Å; I845-F848 PolarHBondContact O-N 3.16Å; I845-R849 PolarHBondContact O-N 3.47Å; I845-R849 VanDerWaalsContact O-N 3.13Å; I845-F852 HydrophobicContact CG2-CB 3.93Å; I845-F852 HydrophobicContact CG2-CD2 4.34Å; I845-V855 HydrophobicContact CD1-CG2 3.54Å
846	K	85.3	Confident	83.7	Confident	155 Å²	155	69.5 Å²	69.5	67%	0.674	34%	0.336	S	S	*	.	H	α-helix	trans	-60.2	-41.3	173.7	-78.9	178	-179.4	177.5	0	111.3	L842 S843 L844 R849	L842-K846 WeakPolarHBondContact O-CB 3.4Å; L842-K846 VanDerWaalsContact O-CG 3.31Å; L842-K846 WeakPolarHBondContact O-CG 3.39Å; L842-K846 PolarHBondContact O-N 3.11Å; S843-K846 PolarHBondContact O-N 2.79Å; L844-K846 PolarHBondContact O-N 3.43Å; K846-R849 PolarHBondContact O-N 2.86Å; K846-R849 VanDerWaalsContact O-N 3.09Å
847	K	82.1	Confident	83.9	Confident	92 Å²	92	63.4 Å²	63.4	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-64.3	-36.9	175.2	-73.2	175.6	-177.2	179.8	0	112.5	Y30 S843 L844 I845 R849 F981	Y30-K847 HydrophobicContact CE2-CD 3.96Å; S843-K847 WeakPolarHBondContact O-CG 3.41Å; S843-K847 PolarHBondContact O-N 3.46Å; L844-K847 WeakPolarHBondContact O-CB 3.38Å; L844-K847 PolarHBondContact O-N 3.2Å; L844-K847 VanDerWaalsContact O-N 3.15Å; I845-K847 VanDerWaalsContact C-N 3.31Å; I845-K847 PolarHBondContact O-N 3.29Å; K847-R849 PolarHBondContact O-N 2.74Å; K847-F981 HydrophobicContact CB-CB 4.37Å; K847-F981 HydrophobicContact CB-CG 4.5Å
848	F	82.3	Confident	84.1	Confident	20 Å²	20	61.2 Å²	61.2	9%	0.088	30%	0.298	C	S	.	.	H	α-helix	trans	-70.9	-13.1	172.9	-64.8	-42.8	0	0	0	114.2	Y33 L844 I845 L850 L979 F981	Y33-F848 HydrophobicContact CD1-CE1 4.07Å; Y33-F848 AromaticContact CD1-CZ 3.63Å; Y33-F848 HydrophobicContact CD1-CZ 3.63Å; Y33-F848 HydrophobicContact CD2-CZ 4.03Å; Y33-F848 AromaticContact CE1-CZ 3.98Å; Y33-F848 HydrophobicContact CE1-CZ 3.98Å; Y33-F848 HydrophobicContact CE2-CZ 4.39Å; Y33-F848 HydrophobicContact CG-CE1 4.21Å; Y33-F848 AromaticContact CG-CZ 3.64Å; Y33-F848 HydrophobicContact CG-CZ 3.64Å; L844-F848 HydrophobicContact CD1-CE1 4.37Å; L844-F848 HydrophobicContact CD1-CE2 3.79Å; L844-F848 HydrophobicContact CD1-CZ 3.7Å; L844-F848 HydrophobicContact CD2-CE2 4.14Å; L844-F848 HydrophobicContact CG-CD2 4.2Å; L844-F848 HydrophobicContact CG-CE2 3.57Å; L844-F848 HydrophobicContact CG-CZ 4.01Å; L844-F848 WeakPolarHBondContact O-CD2 3.29Å; L844-F848 PolarHBondContact O-N 2.85Å; I845-F848 PolarHBondContact O-N 3.16Å; F848-L850 HydrophobicContact CB-CD1 4.03Å; F848-L850 HydrophobicContact CB-CD2 4.47Å; F848-L850 HydrophobicContact CB-CG 3.78Å; F848-L850 PolarHBondContact O-N 3.18Å; F848-L979 HydrophobicContact CD1-CB 3.98Å; F848-L979 HydrophobicContact CD2-CD1 4.34Å; F848-L979 HydrophobicContact CE1-CB 3.86Å; F848-L979 HydrophobicContact CG-CD1 4.42Å; F848-L979 HydrophobicContact CZ-CB 4.29Å; F848-F981 HydrophobicContact CD1-CD1 4.44Å; F848-F981 AromaticContact CE1-CD1 3.99Å; F848-F981 HydrophobicContact CE1-CD1 3.99Å
849	R	83.6	Confident	83.7	Confident	220 Å²	220	58.1 Å²	58.1	83%	0.83	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	33.2	178.7	-58.2	-178.7	177.5	-175	-1.1	114	I845 K846 K847 G851	I845-R849 PolarHBondContact O-N 3.47Å; I845-R849 VanDerWaalsContact O-N 3.13Å; K846-R849 PolarHBondContact O-N 2.86Å; K846-R849 VanDerWaalsContact O-N 3.09Å; K847-R849 PolarHBondContact O-N 2.74Å; R849-G851 PolarHBondContact O-N 3.07Å
850	L	82.4	Confident	83.2	Confident	12 Å²	12	53.2 Å²	53.2	6%	0.063	27%	0.265	C	S	.	.			trans	-74.3	-14.1	-179.9	-59.6	175.3	0	0	0	113.2	L806 Y810 F848 F852 L979	L806-L850 HydrophobicContact CB-CD1 3.98Å; L806-L850 HydrophobicContact CD1-CD1 4.4Å; Y810-L850 HydrophobicContact CD1-CD2 4.22Å; Y810-L850 HydrophobicContact CD2-CB 4.23Å; Y810-L850 HydrophobicContact CD2-CD2 4.01Å; Y810-L850 WeakPolarHBondContact CD2-O 3.35Å; Y810-L850 HydrophobicContact CE2-CD2 4.4Å; Y810-L850 HydrophobicContact CG-CD2 3.9Å; F848-L850 HydrophobicContact CB-CD1 4.03Å; F848-L850 HydrophobicContact CB-CD2 4.47Å; F848-L850 HydrophobicContact CB-CG 3.78Å; F848-L850 PolarHBondContact O-N 3.18Å; L850-F852 VanDerWaalsContact C-N 3.3Å; L850-F852 HydrophobicContact CB-CD2 3.6Å; L850-F852 HydrophobicContact CB-CE2 3.66Å; L850-F852 HydrophobicContact CB-CG 4.19Å; L850-F852 HydrophobicContact CB-CZ 4.22Å; L850-F852 HydrophobicContact CD1-CD2 4Å; L850-F852 HydrophobicContact CD1-CE2 3.77Å; L850-F852 HydrophobicContact CG-CD2 4.46Å; L850-F852 HydrophobicContact CG-CE2 4.3Å; L850-F852 PolarHBondContact O-N 3.48Å; L850-L979 HydrophobicContact CD1-CD1 4.09Å; L850-L979 HydrophobicContact CD2-CD2 4.38Å
851	G	79.7	Confident	82.9	Confident	63 Å²	63	49.6 Å²	49.6	65%	0.649	25%	0.248	S	C	*	.			trans	80.3	6.3	179.4	0	0	0	0	0	114.7	R849	R849-G851 PolarHBondContact O-N 3.07Å
852	F	87.3	Confident	82.6	Confident	15 Å²	15	54.9 Å²	54.9	7%	0.066	27%	0.268	C	S	.	.			trans	-78.5	132.9	174.3	-48.8	-38.5	0	0	0	110.3	I795 Y810 V823 I825 I845 L850	I795-F852 HydrophobicContact CD1-CE2 4.39Å; Y810-F852 HydrophobicContact CD2-CZ 4.47Å; V823-F852 HydrophobicContact CB-CD1 3.61Å; V823-F852 HydrophobicContact CB-CE1 3.77Å; V823-F852 HydrophobicContact CB-CG 4.37Å; V823-F852 HydrophobicContact CG1-CD1 3.71Å; V823-F852 HydrophobicContact CG1-CE1 3.72Å; V823-F852 HydrophobicContact CG1-CE2 4.46Å; V823-F852 HydrophobicContact CG1-CG 4.11Å; V823-F852 HydrophobicContact CG1-CZ 4.07Å; V823-F852 HydrophobicContact CG2-CD1 3.97Å; V823-F852 HydrophobicContact CG2-CE1 3.65Å; V823-F852 HydrophobicContact CG2-CZ 4.49Å; I825-F852 HydrophobicContact CD1-CB 3.66Å; I825-F852 HydrophobicContact CD1-CD2 3.57Å; I825-F852 HydrophobicContact CD1-CE2 4.47Å; I825-F852 HydrophobicContact CD1-CG 3.92Å; I845-F852 HydrophobicContact CG2-CB 3.93Å; I845-F852 HydrophobicContact CG2-CD2 4.34Å; L850-F852 VanDerWaalsContact C-N 3.3Å; L850-F852 HydrophobicContact CB-CD2 3.6Å; L850-F852 HydrophobicContact CB-CE2 3.66Å; L850-F852 HydrophobicContact CB-CG 4.19Å; L850-F852 HydrophobicContact CB-CZ 4.22Å; L850-F852 HydrophobicContact CD1-CD2 4Å; L850-F852 HydrophobicContact CD1-CE2 3.77Å; L850-F852 HydrophobicContact CG-CD2 4.46Å; L850-F852 HydrophobicContact CG-CE2 4.3Å; L850-F852 PolarHBondContact O-N 3.48Å
853	Q	78.4	Confident	82.4	Confident	162 Å²	162	57.3 Å²	57.3	76%	0.757	28%	0.278	S	S	*	.			trans	-121	-22.6	-175.9	-62.8	-176.6	3.4	0	0	112.9
854	D	85.1	Confident	82.4	Confident	52 Å²	52	60.9 Å²	60.9	28%	0.278	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	100	-175.9	-53.5	-92.4	0	0	0	110.6	K822 R824 I825	K822-D854 WeakPolarHBondContact CE-OD1 3.45Å; K822-D854 WeakPolarHBondContact CE-OD2 3.43Å; K822-D854 VanDerWaalsContact NZ-CG 3.27Å; K822-D854 IonicContact NZ-OD1 3.68Å; K822-D854 PolarHBondContact NZ-OD1 3.31Å; K822-D854 IonicContact NZ-OD2 3.72Å; K822-D854 PolarHBondContact NZ-OD2 2.81Å; R824-D854 HydrophobicContact CG-CB 4.37Å; I825-D854 PolarHBondContact N-O 2.82Å
855	V	86.9	Confident	82.7	Confident	6 Å²	6	61.5 Å²	61.5	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.3	173.2	-179.8	0	0	0	0	109.1	I825 K838 V841 L842 I845	I825-V855 HydrophobicContact CB-CG2 4.24Å; I825-V855 CarbonylContact O-C 3.53Å; I825-V855 VanDerWaalsContact O-CA 3.31Å; I825-V855 WeakPolarHBondContact O-CA 3.44Å; K838-V855 VanDerWaalsContact CE-O 3.26Å; K838-V855 WeakPolarHBondContact CE-O 3.21Å; V841-V855 HydrophobicContact CG1-CG1 3.97Å; L842-V855 HydrophobicContact CD2-CB 3.76Å; L842-V855 HydrophobicContact CD2-CG2 3.35Å; L842-V855 HydrophobicContact CG-CB 3.9Å; L842-V855 HydrophobicContact CG-CG2 3.83Å; I845-V855 HydrophobicContact CD1-CG2 3.54Å
856	E	87.6	Confident	82.9	Confident	68 Å²	68	66.6 Å²	66.6	32%	0.318	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.6	176.7	-68.5	-177.2	-148.4	0	0	109.2	R824 I825 F826 V827	R824-E856 IonicContact NH1-OE1 2.79Å; I825-E856 PolarHBondContact O-N 2.83Å; F826-E856 VanDerWaalsContact CA-O 3.26Å; F826-E856 WeakPolarHBondContact CA-O 3.39Å; F826-E856 HydrophobicContact CD1-CB 3.66Å; F826-E856 HydrophobicContact CE1-CB 3.74Å; F826-E856 HydrophobicContact CE1-CG 4.24Å; F826-E856 WeakPolarHBondContact CE1-OE2 3.42Å; V827-E856 PolarHBondContact N-O 3.09Å
857	V	84.7	Confident	83	Confident	11 Å²	11	63.8 Å²	63.8	7%	0.067	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.4	179.8	176.6	0	0	0	0	108.7	V827 A829 K834 K838 P859	V827-V857 CarbonylContact O-C 3.47Å; V827-V857 WeakPolarHBondContact O-CA 3.49Å; A829-V857 HydrophobicContact CB-CG1 3.15Å; K834-V857 HydrophobicContact CG-CB 4Å; K834-V857 HydrophobicContact CG-CG1 3.89Å; K838-V857 HydrophobicContact CB-CG2 3.62Å; K838-V857 HydrophobicContact CG-CG2 4.06Å; V857-P859 WeakPolarHBondContact O-CD 3.32Å
858	I	83.9	Confident	83.4	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.015	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	104.6	-174.4	-48.6	179	0	0	0	109.6	Y796 F826 V827 A829 D860 I861 V925	Y796-I858 HydrophobicContact CD1-CD1 4.35Å; Y796-I858 HydrophobicContact CE1-CD1 3.79Å; F826-I858 HydrophobicContact CB-CD1 3.86Å; F826-I858 HydrophobicContact CB-CG1 4.38Å; F826-I858 HydrophobicContact CD1-CD1 3.6Å; F826-I858 HydrophobicContact CD1-CG1 3.93Å; F826-I858 HydrophobicContact CE1-CD1 4.47Å; F826-I858 HydrophobicContact CG-CD1 4.04Å; V827-I858 PolarHBondContact O-N 3.01Å; A829-I858 PolarHBondContact N-O 2.96Å; I858-D860 VanDerWaalsContact C-N 3.32Å; I858-D860 HydrophobicContact CG2-CB 4.1Å; I858-I861 HydrophobicContact CB-CD1 4Å; I858-I861 HydrophobicContact CB-CG1 4.08Å; I858-I861 HydrophobicContact CG2-CD1 4.3Å; I858-I861 HydrophobicContact CG2-CG1 3.84Å; I858-V925 HydrophobicContact CD1-CG1 3.65Å; I858-V925 HydrophobicContact CG2-CG1 3.94Å
859	P	75.3	Confident	83.8	Confident	17 Å²	17	65.4 Å²	65.4	11%	0.11	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-76.9	-20.7	174.9	31.3	-34.2	0	0	0	113.2	A829 T831 V857 I861	A829-P859 WeakPolarHBondContact O-CA 3.34Å; T831-P859 HydrophobicContact CG2-CB 4.41Å; V857-P859 WeakPolarHBondContact O-CD 3.32Å; P859-I861 PolarHBondContact O-N 3.19Å; P859-I861 VanDerWaalsContact O-N 3.08Å
860	D	75.9	Confident	84.1	Confident	42 Å²	42	56.4 Å²	56.4	23%	0.225	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-69.8	-7.9	-172.3	-57.2	-40.5	0	0	0	114.6	I858 Y862 Q863 R921	I858-D860 VanDerWaalsContact C-N 3.32Å; I858-D860 HydrophobicContact CG2-CB 4.1Å; D860-Y862 PolarHBondContact O-N 3.17Å; D860-Q863 PolarHBondContact O-N 2.87Å; D860-Q863 PolarHBondContact OD1-NE2 3.41Å; D860-R921 PolarHBondContact O-NE 3.25Å
861	I	77.4	Confident	84.4	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.015	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-65.6	-26.9	-178.9	-61.2	178.4	0	0	0	111.9	L798 I858 P859 R918 L922	L798-I861 HydrophobicContact CD2-CD1 3.67Å; I858-I861 HydrophobicContact CB-CD1 4Å; I858-I861 HydrophobicContact CB-CG1 4.08Å; I858-I861 HydrophobicContact CG2-CD1 4.3Å; I858-I861 HydrophobicContact CG2-CG1 3.84Å; P859-I861 PolarHBondContact O-N 3.19Å; P859-I861 VanDerWaalsContact O-N 3.08Å; I861-R918 HydrophobicContact CG2-CG 4.49Å; I861-L922 HydrophobicContact CB-CD2 4.38Å; I861-L922 HydrophobicContact CD1-CD2 3.98Å; I861-L922 HydrophobicContact CG1-CD2 3.97Å; I861-L922 HydrophobicContact CG2-CD2 3.63Å; I861-L922 HydrophobicContact CG2-CG 4.18Å
862	Y	76.5	Confident	84.8	Confident	118 Å²	118	62.2 Å²	62.2	46%	0.463	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-94.5	1.4	-177.7	-59.8	-78.9	0	0	0	113.7	A829 D860	A829-Y862 WeakPolarHBondContact O-CE2 3.44Å; D860-Y862 PolarHBondContact O-N 3.17Å
863	Q	82.9	Confident	84.8	Confident	90 Å²	90	61.9 Å²	61.9	42%	0.421	31%	0.314	S	S	.	.	S	Bend	trans	-80.1	158.1	175.7	-67	167.5	6.5	0	0	111.5	D860 R921	D860-Q863 PolarHBondContact O-N 2.87Å; D860-Q863 PolarHBondContact OD1-NE2 3.41Å; Q863-R921 WeakPolarHBondContact O-CG 3.36Å
864	N	83.9	Confident	85.3	Confident	125 Å²	125	58.5 Å²	58.5	67%	0.668	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-67.6	137.9	175.7	-72.3	-21.8	0	0	0	111
865	P	90.4	Very high	85.5	Confident	16 Å²	16	60.5 Å²	60.5	10%	0.104	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-68.7	162.9	176.7	28.6	-35.1	0	0	0	112.4	V870 L917 I920 R921	P865-V870 HydrophobicContact CB-CG2 4.17Å; P865-V870 HydrophobicContact CG-CG2 3.6Å; P865-L917 HydrophobicContact CG-CB 4.17Å; P865-L917 HydrophobicContact CG-CD2 3.76Å; P865-I920 HydrophobicContact CB-CB 4.01Å; P865-I920 HydrophobicContact CB-CG2 3.59Å; P865-I920 HydrophobicContact CG-CB 4.32Å; P865-I920 HydrophobicContact CG-CG2 4.27Å; P865-R921 HydrophobicContact CB-CB 4.27Å
866	Q	88.6	Confident	85.5	Confident	109 Å²	109	60.7 Å²	60.7	51%	0.509	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-63.9	136.6	176.5	-67.2	-66.7	-31.1	0	0	111	V868 N869 V870 E924	Q866-V868 PolarHBondContact O-N 3.05Å; Q866-V868 VanDerWaalsContact O-N 3.13Å; Q866-N869 PolarHBondContact O-N 3.38Å; Q866-V870 PolarHBondContact O-N 3.21Å; Q866-V870 VanDerWaalsContact O-N 3.15Å; Q866-E924 VanDerWaalsContact CB-OE1 3.32Å; Q866-E924 WeakPolarHBondContact CB-OE1 3.43Å; Q866-E924 PolarHBondContact N-OE1 3.37Å
867	P	89.1	Confident	85.5	Confident	95 Å²	95	57.5 Å²	57.5	62%	0.617	29%	0.294	S	S	*	.	H	α-helix	trans	-60.9	-29.9	-175.6	23.8	-33.6	0	0	0	112.7	V870 H871	P867-V870 PolarHBondContact O-N 2.89Å; P867-H871 PolarHBondContact O-N 3.21Å
868	V	90.6	Very high	85.4	Confident	92 Å²	92	58.8 Å²	58.8	56%	0.558	31%	0.309	S	S	*	.	H	α-helix	trans	-61.9	-43.8	175.3	-178.6	0	0	0	0	111.4	Q866 H871 H872	Q866-V868 PolarHBondContact O-N 3.05Å; Q866-V868 VanDerWaalsContact O-N 3.13Å; V868-H871 PolarHBondContact O-N 3.02Å; V868-H872 PolarHBondContact O-CD2 2.92Å; V868-H872 PolarHBondContact O-N 3.12Å
869	N	89.1	Confident	85.3	Confident	55 Å²	55	68.9 Å²	68.9	29%	0.294	35%	0.347	S	S	.	.	H	α-helix	trans	-73.3	-32.5	-179.5	-69.1	-28.1	0	0	0	112	Q866 H872 F873 I920 E924	Q866-N869 PolarHBondContact O-N 3.38Å; N869-H872 PolarHBondContact O-N 3.36Å; N869-F873 PolarHBondContact O-N 3.43Å; N869-I920 HydrophobicContact CB-CG2 3.62Å; N869-E924 WeakPolarHBondContact ND2-CG 3.46Å; N869-E924 PolarHBondContact ND2-OE1 3.32Å
870	V	89.6	Confident	85.7	Confident	30 Å²	30	68.8 Å²	68.8	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-62.3	-48.7	170.8	179.9	0	0	0	0	110.6	P865 Q866 P867 H872 F873 E874 L917 I920	P865-V870 HydrophobicContact CB-CG2 4.17Å; P865-V870 HydrophobicContact CG-CG2 3.6Å; Q866-V870 PolarHBondContact O-N 3.21Å; Q866-V870 VanDerWaalsContact O-N 3.15Å; P867-V870 PolarHBondContact O-N 2.89Å; V870-H872 VanDerWaalsContact C-N 3.3Å; V870-H872 PolarHBondContact O-N 3.43Å; V870-F873 WeakPolarHBondContact O-CB 3.42Å; V870-F873 PolarHBondContact O-N 3.3Å; V870-E874 WeakPolarHBondContact O-CG 3.42Å; V870-E874 PolarHBondContact O-N 3.08Å; V870-L917 HydrophobicContact CG1-CD2 4.39Å; V870-L917 HydrophobicContact CG2-CD2 3.97Å; V870-I920 HydrophobicContact CG2-CD1 4.36Å
871	H	88.9	Confident	86	Confident	106 Å²	106	71.3 Å²	71.3	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-38.3	177.4	-172.2	60.2	0	0	0	112.3	P867 V868 F873 E874 N875	P867-H871 PolarHBondContact O-N 3.21Å; V868-H871 PolarHBondContact O-N 3.02Å; H871-F873 VanDerWaalsContact C-N 3.33Å; H871-F873 PolarHBondContact O-N 3.16Å; H871-E874 IonicContact ND1-OE2 3.9Å; H871-E874 PolarHBondContact O-N 2.87Å; H871-N875 PolarHBondContact CD2-ND2 3.27Å; H871-N875 VanDerWaalsContact CD2-ND2 3.32Å; H871-N875 PolarHBondContact NE2-ND2 3.18Å; H871-N875 WeakPolarHBondContact O-CB 3.43Å; H871-N875 VanDerWaalsContact O-CG 3.28Å; H871-N875 PolarHBondContact O-N 3.33Å; H871-N875 PolarHBondContact O-ND2 3.43Å; H871-N875 VanDerWaalsContact O-ND2 3.13Å
872	H	87.8	Confident	86	Confident	92 Å²	92	74.3 Å²	74.3	43%	0.426	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-36.3	172.7	-81.6	-56.2	0	0	0	113.6	V868 N869 V870 M876	V868-H872 PolarHBondContact O-CD2 2.92Å; V868-H872 PolarHBondContact O-N 3.12Å; N869-H872 PolarHBondContact O-N 3.36Å; V870-H872 VanDerWaalsContact C-N 3.3Å; V870-H872 PolarHBondContact O-N 3.43Å; H872-M876 PolarHBondContact O-N 2.98Å; H872-M876 VanDerWaalsContact O-N 3.09Å
873	F	89.3	Confident	85.3	Confident	8 Å²	8	75.8 Å²	75.8	4%	0.035	39%	0.386	C	S	.	.	H	α-helix	trans	-68.4	-44.3	175.2	178.5	-98.8	0	0	0	111.5	N869 V870 H871 N875 M876 I877 I920 L952 A955 W956 I959	N869-F873 PolarHBondContact O-N 3.43Å; V870-F873 WeakPolarHBondContact O-CB 3.42Å; V870-F873 PolarHBondContact O-N 3.3Å; H871-F873 VanDerWaalsContact C-N 3.33Å; H871-F873 PolarHBondContact O-N 3.16Å; F873-N875 VanDerWaalsContact C-N 3.32Å; F873-N875 PolarHBondContact O-N 3.4Å; F873-M876 WeakPolarHBondContact O-CA 3.4Å; F873-M876 VanDerWaalsContact O-CB 3.26Å; F873-M876 WeakPolarHBondContact O-CB 3.27Å; F873-M876 PolarHBondContact O-N 3Å; F873-I877 HydrophobicContact CD1-CD1 4.39Å; F873-I877 HydrophobicContact CE1-CD1 3.96Å; F873-I877 HydrophobicContact CE1-CG2 4.28Å; F873-I877 HydrophobicContact CE2-CG2 4.27Å; F873-I877 HydrophobicContact CZ-CG2 4.01Å; F873-I877 PolarHBondContact O-N 3.47Å; F873-I877 VanDerWaalsContact O-N 3.07Å; F873-I920 HydrophobicContact CB-CD1 3.66Å; F873-I920 HydrophobicContact CB-CG1 4.22Å; F873-I920 HydrophobicContact CD1-CD1 4Å; F873-I920 HydrophobicContact CD2-CD1 4.33Å; F873-I920 HydrophobicContact CD2-CG1 4.36Å; F873-I920 HydrophobicContact CG-CD1 3.74Å; F873-I920 HydrophobicContact CG-CG1 4.24Å; F873-L952 HydrophobicContact CZ-CD1 3.94Å; F873-A955 HydrophobicContact CE2-CB 3.88Å; F873-A955 HydrophobicContact CZ-CB 4.4Å; F873-W956 AromaticContact CZ-CD1 3.96Å; F873-I959 HydrophobicContact CD2-CB 4.4Å; F873-I959 HydrophobicContact CD2-CG2 4.42Å; F873-I959 HydrophobicContact CE2-CG2 4.49Å
874	E	88.3	Confident	83.7	Confident	90 Å²	90	75.3 Å²	75.3	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-58.3	-43.7	175	-70.7	176.9	165.6	0	0	111.9	V870 H871 M876 I877 G878	V870-E874 WeakPolarHBondContact O-CG 3.42Å; V870-E874 PolarHBondContact O-N 3.08Å; H871-E874 IonicContact ND1-OE2 3.9Å; H871-E874 PolarHBondContact O-N 2.87Å; E874-M876 VanDerWaalsContact C-N 3.27Å; E874-M876 PolarHBondContact O-N 3.43Å; E874-I877 WeakPolarHBondContact O-CG1 3.38Å; E874-I877 PolarHBondContact O-N 3.2Å; E874-G878 PolarHBondContact O-N 3.02Å
875	N	88.5	Confident	81.8	Confident	94 Å²	94	76.4 Å²	76.4	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-32.8	174.3	-73.2	-32.4	0	0	0	112.6	H871 F873	H871-N875 PolarHBondContact CD2-ND2 3.27Å; H871-N875 VanDerWaalsContact CD2-ND2 3.32Å; H871-N875 PolarHBondContact NE2-ND2 3.18Å; H871-N875 WeakPolarHBondContact O-CB 3.43Å; H871-N875 VanDerWaalsContact O-CG 3.28Å; H871-N875 PolarHBondContact O-N 3.33Å; H871-N875 PolarHBondContact O-ND2 3.43Å; H871-N875 VanDerWaalsContact O-ND2 3.13Å; F873-N875 VanDerWaalsContact C-N 3.32Å; F873-N875 PolarHBondContact O-N 3.4Å
876	M	86.5	Confident	79.7	Confident	11 Å²	11	81.3 Å²	81.3	5%	0.054	43%	0.43	C	S	.	.	H	α-helix	trans	-67.4	-44.1	177.3	-174.5	-173.9	-52.3	0	0	111.9	W701 R702 H872 F873 E874 A955 D958 I959	W701-M876 HydrophobicContact CZ2-CG 4.37Å; W701-M876 HydrophobicContact CZ2-SD 4.19Å; R702-M876 PolarHBondContact NH2-SD 2.88Å; R702-M876 VanDerWaalsContact NH2-SD 3.43Å; H872-M876 PolarHBondContact O-N 2.98Å; H872-M876 VanDerWaalsContact O-N 3.09Å; F873-M876 WeakPolarHBondContact O-CA 3.4Å; F873-M876 VanDerWaalsContact O-CB 3.26Å; F873-M876 WeakPolarHBondContact O-CB 3.27Å; F873-M876 PolarHBondContact O-N 3Å; E874-M876 VanDerWaalsContact C-N 3.27Å; E874-M876 PolarHBondContact O-N 3.43Å; M876-A955 HydrophobicContact SD-CB 4.16Å; M876-D958 HydrophobicContact SD-CB 4.39Å; M876-I959 HydrophobicContact CE-CD1 4.02Å
877	I	87.6	Confident	77.4	Confident	1 Å²	1	85.5 Å²	85.5	1%	0.005	45%	0.446	C	S	.	.	H	α-helix	trans	-83.9	-14.4	-178.9	64.2	172.4	0	0	0	113	F873 E874 R879 F880 R881 I904 L909 A955	F873-I877 HydrophobicContact CD1-CD1 4.39Å; F873-I877 HydrophobicContact CE1-CD1 3.96Å; F873-I877 HydrophobicContact CE1-CG2 4.28Å; F873-I877 HydrophobicContact CE2-CG2 4.27Å; F873-I877 HydrophobicContact CZ-CG2 4.01Å; F873-I877 PolarHBondContact O-N 3.47Å; F873-I877 VanDerWaalsContact O-N 3.07Å; E874-I877 WeakPolarHBondContact O-CG1 3.38Å; E874-I877 PolarHBondContact O-N 3.2Å; I877-R879 VanDerWaalsContact C-N 3.26Å; I877-R879 PolarHBondContact O-N 2.97Å; I877-R879 VanDerWaalsContact O-N 3.11Å; I877-F880 PolarHBondContact O-N 3.4Å; I877-R881 PolarHBondContact O-N 2.79Å; I877-I904 HydrophobicContact CB-CD1 3.93Å; I877-I904 HydrophobicContact CG2-CD1 4.18Å; I877-L909 HydrophobicContact CD1-CD1 3.79Å; I877-L909 HydrophobicContact CD1-CD2 4.35Å; I877-A955 HydrophobicContact CG2-CB 3.79Å
878	G	83.4	Confident	75.4	Confident	37 Å²	37	89.9 Å²	89.9	38%	0.381	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-52.1	-37.6	-173.3	0	0	0	0	0	114.8	E874 F880 R881	E874-G878 PolarHBondContact O-N 3.02Å; G878-F880 PolarHBondContact O-N 3.23Å; G878-R881 PolarHBondContact O-N 3.31Å
879	R	81.7	Confident	72.9	Confident	216 Å²	216	92.8 Å²	92.8	82%	0.815	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-69.2	-15.7	177.9	-66.9	-174.5	179	-176	-1.7	114.6	I877	I877-R879 VanDerWaalsContact C-N 3.26Å; I877-R879 PolarHBondContact O-N 2.97Å; I877-R879 VanDerWaalsContact O-N 3.11Å
880	F	82.9	Confident	70.7	Confident	14 Å²	14	95.3 Å²	95.3	6%	0.061	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-107.9	4.1	-177.4	-55.1	-69	0	0	0	112.2	W701 P705 I877 G878 M903 I904	W701-F880 HydrophobicContact CE3-CE2 4.39Å; W701-F880 HydrophobicContact CE3-CZ 4.34Å; W701-F880 HydrophobicContact CH2-CD2 4.35Å; W701-F880 AromaticContact CH2-CE2 3.74Å; W701-F880 HydrophobicContact CH2-CE2 3.74Å; W701-F880 HydrophobicContact CH2-CZ 4.47Å; W701-F880 HydrophobicContact CZ3-CD2 4.13Å; W701-F880 AromaticContact CZ3-CE2 3.42Å; W701-F880 HydrophobicContact CZ3-CE2 3.42Å; W701-F880 VanDerWaalsContact CZ3-CE2 3.42Å; W701-F880 AromaticContact CZ3-CZ 3.75Å; W701-F880 HydrophobicContact CZ3-CZ 3.75Å; P705-F880 HydrophobicContact CB-CE1 4.07Å; I877-F880 PolarHBondContact O-N 3.4Å; G878-F880 PolarHBondContact O-N 3.23Å; F880-M903 CarbonylContact O-C 3.59Å; F880-M903 WeakPolarHBondContact O-CA 3.35Å; F880-M903 WeakPolarHBondContact O-CE 3.49Å; F880-I904 HydrophobicContact CB-CD1 4.13Å; F880-I904 HydrophobicContact CB-CG1 4.35Å; F880-I904 PolarHBondContact O-N 3.39Å
881	R	83.1	Confident	68.6	Low	96 Å²	96	101.6 Å²	101.6	36%	0.362	53%	0.526	S	S	.	.	B	Isolated β-bridge	trans	-80.2	142	177.5	-66	-175.6	72.2	170.9	1.9	110.8	I877 G878 M903 N906	I877-R881 PolarHBondContact O-N 2.79Å; G878-R881 PolarHBondContact O-N 3.31Å; R881-M903 WeakPolarHBondContact O-CE 3.07Å; R881-N906 PolarHBondContact NH2-OD1 3.04Å
882	V	77.7	Confident	66.2	Low	65 Å²	65	102.1 Å²	102.1	39%	0.394	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-85	122.2	171.3	-175.4	0	0	0	0	109.1	S884 M903 I904	V882-S884 PolarHBondContact O-N 3.48Å; V882-M903 HydrophobicContact CG2-CB 3.63Å; V882-M903 HydrophobicContact CG2-CE 4Å; V882-M903 HydrophobicContact CG2-CG 4.42Å; V882-I904 PolarHBondContact N-O 3.42Å; V882-I904 VanDerWaalsContact N-O 3.11Å
883	D	61.2	Low	63.7	Low	150 Å²	150	104.9 Å²	104.9	80%	0.802	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-67.1	128.9	174.5	-77.5	-29.1	0	0	0	110.6	N885	D883-N885 VanDerWaalsContact C-N 3.32Å; D883-N885 PolarHBondContact O-N 2.85Å
884	S	50.1	Low	61.3	Low	80 Å²	80	109.9 Å²	109.9	56%	0.559	59%	0.592	S	S	*	*			trans	-89.2	12.9	-173.4	-41.5	0	0	0	0	114.3	V882 P886 N906	V882-S884 PolarHBondContact O-N 3.48Å; S884-P886 WeakPolarHBondContact O-CD 3.44Å; S884-N906 PolarHBondContact OG-ND2 2.99Å
885	N	43.2	Very low	59.1	Low	147 Å²	147	111.2 Å²	111.2	79%	0.786	61%	0.609	S	S	*	*			trans	-109.8	96.5	178.4	-89.5	-9.3	0	0	0	110.8	D883 K887	D883-N885 VanDerWaalsContact C-N 3.32Å; D883-N885 PolarHBondContact O-N 2.85Å; N885-K887 PolarHBondContact O-N 3.01Å; N885-K887 VanDerWaalsContact O-N 3.1Å
886	P	46.1	Very low	56.8	Low	119 Å²	119	117.4 Å²	117.4	77%	0.773	63%	0.625	S	S	*	*			trans	-69.8	104.7	160	28.7	-27.3	0	0	0	106.8	S884 Q888	S884-P886 WeakPolarHBondContact O-CD 3.44Å; P886-Q888 PolarHBondContact O-N 3.48Å; P886-Q888 VanDerWaalsContact O-N 3.15Å
887	K	41.7	Very low	54.8	Low	197 Å²	197	126.6 Å²	126.6	86%	0.857	67%	0.668	S	S	*	*			trans	-64.6	117.4	158.1	-80.7	-173.4	177.6	-178.5	0	106.3	N885 D889	N885-K887 PolarHBondContact O-N 3.01Å; N885-K887 VanDerWaalsContact O-N 3.1Å; K887-D889 PolarHBondContact O-N 3.4Å
888	Q	46.8	Very low	52.8	Low	187 Å²	187	134.9 Å²	134.9	87%	0.874	71%	0.707	S	S	*	*			trans	-59.7	97.8	176	-168.1	168.2	21.3	0	0	109	P886	P886-Q888 PolarHBondContact O-N 3.48Å; P886-Q888 VanDerWaalsContact O-N 3.15Å
889	D	37.4	Very low	51.4	Low	154 Å²	154	141.3 Å²	141.3	82%	0.824	73%	0.727	S	S	*	*			trans	-121.5	121	153.9	-83.6	-34.2	0	0	0	106.7	K887	K887-D889 PolarHBondContact O-N 3.4Å
890	S	43.8	Very low	50.9	Low	107 Å²	107	137.3 Å²	137.3	75%	0.748	72%	0.716	S	S	*	*			trans	-66	153.1	-174.9	42.7	0	0	0	0	113.4
891	D	45.1	Very low	50.3	Low	163 Å²	163	140.3 Å²	140.3	87%	0.872	74%	0.736	S	S	*	*			trans	80	70.9	173.9	-66.7	-13.9	0	0	0	117.8
892	S	39.2	Very low	50.1	Low	117 Å²	117	138 Å²	138	82%	0.818	73%	0.728	S	S	*	*			trans	-155.7	143.7	140.7	43.6	0	0	0	0	110.3
893	D	34.4	Very low	50.4	Low	150 Å²	150	137.3 Å²	137.3	80%	0.802	72%	0.721	S	S	*	*			trans	-42.4	156.9	175.7	-79.7	-43.8	0	0	0	113.9
894	P	38.1	Very low	51.5	Low	112 Å²	112	130.2 Å²	130.2	73%	0.727	68%	0.683	S	S	*	*			trans	-54	135.8	-175.9	23.2	-34.2	0	0	0	111.1	R896	P894-R896 PolarHBondContact O-N 3.25Å; P894-R896 VanDerWaalsContact O-N 3.13Å
895	P	43	Very low	53.1	Low	119 Å²	119	129.1 Å²	129.1	77%	0.773	67%	0.673	S	S	*	*			trans	-66.8	119.9	-174.5	25.2	-31.4	0	0	0	109.6	Q897	P895-Q897 PolarHBondContact O-N 2.88Å
896	R	39.4	Very low	54.8	Low	223 Å²	223	124.7 Å²	124.7	84%	0.842	65%	0.649	S	S	*	*			trans	-54.9	109	165.7	-74.1	177.7	172.6	170.3	-2.2	108.1	P894 Q898	P894-R896 PolarHBondContact O-N 3.25Å; P894-R896 VanDerWaalsContact O-N 3.13Å; R896-Q898 PolarHBondContact O-N 3.13Å
897	Q	44.9	Very low	56.5	Low	205 Å²	205	124.4 Å²	124.4	96%	0.958	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	22.4	-179.3	-98.9	173.3	-6.4	0	0	115.5	P895	P895-Q897 PolarHBondContact O-N 2.88Å
898	Q	45.6	Very low	58.4	Low	175 Å²	175	116 Å²	116	82%	0.818	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	5.2	-161.2	-134.2	167.3	21.8	0	0	115.6	R896	R896-Q898 PolarHBondContact O-N 3.13Å
899	E	54.5	Low	60.1	Low	172 Å²	172	108.8 Å²	108.8	80%	0.804	57%	0.569	S	S	*	*	S	Bend	trans	-87	-21.5	-170	-75.4	-169.2	164	0	0	116.2
900	K	70.4	Confident	62.3	Low	132 Å²	132	108.4 Å²	108.4	57%	0.574	56%	0.563	S	S	*	*			trans	-150.1	91.2	-179.6	-62.3	-175.6	-175.9	168	0	114.2	W902 M903	K900-W902 HydrophobicContact CB-CD2 4.38Å; K900-W902 HydrophobicContact CB-CH2 4.36Å; K900-W902 HydrophobicContact CB-CZ2 3.85Å; K900-W902 HydrophobicContact CD-CZ2 3.9Å; K900-W902 HydrophobicContact CG-CH2 4.13Å; K900-W902 HydrophobicContact CG-CZ2 3.58Å; K900-W902 PolarHBondContact O-N 3Å; K900-W902 VanDerWaalsContact O-N 3.13Å; K900-M903 HydrophobicContact CB-CG 3.82Å; K900-M903 PolarHBondContact O-N 3.15Å
901	P	71.6	Confident	64.2	Low	77 Å²	77	110.3 Å²	110.3	50%	0.5	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.5	-10.1	-176.3	27.4	-35.9	0	0	0	115.3
902	W	78.3	Confident	66.1	Low	46 Å²	46	103.1 Å²	103.1	17%	0.174	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.4	179.2	57.3	77.9	0	0	0	114	P705 H709 K900 S951	P705-W902 HydrophobicContact CB-CG 4.32Å; H709-W902 HydrophobicContact CB-CB 4.41Å; H709-W902 HydrophobicContact CB-CE3 3.87Å; K900-W902 HydrophobicContact CB-CD2 4.38Å; K900-W902 HydrophobicContact CB-CH2 4.36Å; K900-W902 HydrophobicContact CB-CZ2 3.85Å; K900-W902 HydrophobicContact CD-CZ2 3.9Å; K900-W902 HydrophobicContact CG-CH2 4.13Å; K900-W902 HydrophobicContact CG-CZ2 3.58Å; K900-W902 PolarHBondContact O-N 3Å; K900-W902 VanDerWaalsContact O-N 3.13Å; W902-S951 VanDerWaalsContact O-CB 3.24Å; W902-S951 WeakPolarHBondContact O-CB 3.32Å; W902-S951 PolarHBondContact O-OG 2.92Å
903	M	82.9	Confident	68.3	Low	52 Å²	52	102.6 Å²	102.6	26%	0.256	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-79.1	145.7	176	-65.6	-65.4	-68.1	0	0	111	F880 R881 V882 K900	F880-M903 CarbonylContact O-C 3.59Å; F880-M903 WeakPolarHBondContact O-CA 3.35Å; F880-M903 WeakPolarHBondContact O-CE 3.49Å; R881-M903 WeakPolarHBondContact O-CE 3.07Å; V882-M903 HydrophobicContact CG2-CB 3.63Å; V882-M903 HydrophobicContact CG2-CE 4Å; V882-M903 HydrophobicContact CG2-CG 4.42Å; K900-M903 HydrophobicContact CB-CG 3.82Å; K900-M903 PolarHBondContact O-N 3.15Å
904	I	84.2	Confident	70.7	Confident	1 Å²	1	98.6 Å²	98.6	1%	0.005	49%	0.489	C	S	.	.	B	Isolated β-bridge	trans	-100.6	116.5	-176.6	-55.1	170.4	0	0	0	108.6	I877 F880 V882 D908 L909 P949 S951 L952	I877-I904 HydrophobicContact CB-CD1 3.93Å; I877-I904 HydrophobicContact CG2-CD1 4.18Å; F880-I904 HydrophobicContact CB-CD1 4.13Å; F880-I904 HydrophobicContact CB-CG1 4.35Å; F880-I904 PolarHBondContact O-N 3.39Å; V882-I904 PolarHBondContact N-O 3.42Å; V882-I904 VanDerWaalsContact N-O 3.11Å; I904-D908 HydrophobicContact CG2-CB 4.46Å; I904-L909 HydrophobicContact CG2-CB 4.32Å; I904-P949 HydrophobicContact CG1-CB 4.23Å; I904-P949 HydrophobicContact CG1-CG 4.44Å; I904-S951 VanDerWaalsContact CG1-OG 3.28Å; I904-S951 WeakPolarHBondContact CG1-OG 3.48Å; I904-L952 HydrophobicContact CD1-CB 4Å; I904-L952 HydrophobicContact CD1-CD1 4.39Å; I904-L952 HydrophobicContact CG1-CB 4.26Å
905	T	84.5	Confident	72.9	Confident	56 Å²	56	95 Å²	95	34%	0.344	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-82.9	158.8	170.2	71.1	0	0	0	0	110.8	Q907 D908 L909	T905-Q907 PolarHBondContact O-N 3.37Å; T905-D908 WeakPolarHBondContact CB-OD2 3.47Å; T905-D908 PolarHBondContact N-OD2 3.13Å; T905-D908 PolarHBondContact O-N 3.21Å; T905-D908 PolarHBondContact OG1-N 3.24Å; T905-D908 VanDerWaalsContact OG1-N 3.16Å; T905-D908 PolarHBondContact OG1-OD2 3.47Å; T905-L909 PolarHBondContact O-N 3.24Å
906	N	80	Confident	75	Confident	55 Å²	55	89.5 Å²	89.5	29%	0.294	43%	0.426	S	S	.	.	H	α-helix	trans	-61	-33.4	175.1	-68.8	-31.7	0	0	0	111.6	R881 S884 L909 E910	R881-N906 PolarHBondContact NH2-OD1 3.04Å; S884-N906 PolarHBondContact OG-ND2 2.99Å; N906-L909 PolarHBondContact O-N 2.92Å; N906-E910 WeakPolarHBondContact O-CG 3.26Å; N906-E910 PolarHBondContact O-N 2.99Å
907	Q	80.5	Confident	77.4	Confident	112 Å²	112	81 Å²	81	52%	0.523	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-39.9	175.8	-168.9	177.8	37.5	0	0	112.4	T905 L909 R911	T905-Q907 PolarHBondContact O-N 3.37Å; Q907-L909 VanDerWaalsContact C-N 3.31Å; Q907-L909 PolarHBondContact O-N 2.95Å; Q907-R911 WeakPolarHBondContact O-CB 3.5Å; Q907-R911 VanDerWaalsContact O-CG 3.24Å; Q907-R911 WeakPolarHBondContact O-CG 3.27Å; Q907-R911 PolarHBondContact O-N 2.94Å; Q907-R911 VanDerWaalsContact O-N 3.1Å
908	D	81.8	Confident	79.5	Confident	22 Å²	22	73.6 Å²	73.6	12%	0.118	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-37.3	176.3	-61.3	-42.4	0	0	0	112	I904 T905 N912 P949	I904-D908 HydrophobicContact CG2-CB 4.46Å; T905-D908 WeakPolarHBondContact CB-OD2 3.47Å; T905-D908 PolarHBondContact N-OD2 3.13Å; T905-D908 PolarHBondContact O-N 3.21Å; T905-D908 PolarHBondContact OG1-N 3.24Å; T905-D908 VanDerWaalsContact OG1-N 3.16Å; T905-D908 PolarHBondContact OG1-OD2 3.47Å; D908-N912 PolarHBondContact O-N 3.14Å; D908-N912 PolarHBondContact O-ND2 3.26Å; D908-P949 HydrophobicContact CB-CG 3.78Å
909	L	83	Confident	81.6	Confident	34 Å²	34	66 Å²	66	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-69.4	-45.2	179.2	-172.4	65.1	0	0	0	111.4	I877 I904 T905 N906 Q907 N912 M913 L952	I877-L909 HydrophobicContact CD1-CD1 3.79Å; I877-L909 HydrophobicContact CD1-CD2 4.35Å; I904-L909 HydrophobicContact CG2-CB 4.32Å; T905-L909 PolarHBondContact O-N 3.24Å; N906-L909 PolarHBondContact O-N 2.92Å; Q907-L909 VanDerWaalsContact C-N 3.31Å; Q907-L909 PolarHBondContact O-N 2.95Å; L909-N912 CarbonylContact O-C 3.48Å; L909-N912 PolarHBondContact O-N 3.44Å; L909-M913 WeakPolarHBondContact O-CA 3.32Å; L909-M913 WeakPolarHBondContact O-CB 3.46Å; L909-M913 PolarHBondContact O-N 2.91Å; L909-L952 HydrophobicContact CD1-CD1 4.41Å
910	E	83.2	Confident	83.4	Confident	147 Å²	147	57.9 Å²	57.9	69%	0.687	29%	0.287	S	S	*	.	H	α-helix	trans	-59.3	-47.8	175.8	-75.8	174.8	-172.4	0	0	111.5	N906 N912 M913	N906-E910 WeakPolarHBondContact O-CG 3.26Å; N906-E910 PolarHBondContact O-N 2.99Å; E910-N912 PolarHBondContact O-N 3.45Å; E910-M913 PolarHBondContact O-N 3.38Å
911	R	83.1	Confident	84.4	Confident	146 Å²	146	52.8 Å²	52.8	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-59.1	-35	178.8	-74.6	173.7	-178.3	176	2.2	113.1	Q907	Q907-R911 WeakPolarHBondContact O-CB 3.5Å; Q907-R911 VanDerWaalsContact O-CG 3.24Å; Q907-R911 WeakPolarHBondContact O-CG 3.27Å; Q907-R911 PolarHBondContact O-N 2.94Å; Q907-R911 VanDerWaalsContact O-N 3.1Å
912	N	85.7	Confident	85.3	Confident	12 Å²	12	49.3 Å²	49.3	6%	0.064	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	13.7	-176	-59.6	-75.5	0	0	0	114	D908 L909 E910 A914 K915 S916 S947 L952 W956	D908-N912 PolarHBondContact O-N 3.14Å; D908-N912 PolarHBondContact O-ND2 3.26Å; L909-N912 CarbonylContact O-C 3.48Å; L909-N912 PolarHBondContact O-N 3.44Å; E910-N912 PolarHBondContact O-N 3.45Å; N912-A914 PolarHBondContact O-N 3.32Å; N912-K915 PolarHBondContact O-N 3.44Å; N912-S916 PolarHBondContact O-N 3.32Å; N912-S916 PolarHBondContact O-OG 3.01Å; N912-S947 PolarHBondContact ND2-O 3.27Å; N912-L952 HydrophobicContact CB-CD2 4.01Å; N912-W956 HydrophobicContact CB-CH2 3.74Å; N912-W956 HydrophobicContact CB-CZ2 3.52Å
913	M	84.8	Confident	86	Confident	106 Å²	106	47.8 Å²	47.8	52%	0.522	24%	0.237	S	C	.	.	H	α-helix	trans	-62.4	-46.2	-174.7	-170.5	176.4	-173.6	0	0	111.8	L909 E910 K915 S916 L917	L909-M913 WeakPolarHBondContact O-CA 3.32Å; L909-M913 WeakPolarHBondContact O-CB 3.46Å; L909-M913 PolarHBondContact O-N 2.91Å; E910-M913 PolarHBondContact O-N 3.38Å; M913-K915 VanDerWaalsContact C-N 3.33Å; M913-K915 PolarHBondContact O-N 3.07Å; M913-S916 WeakPolarHBondContact O-CB 3.19Å; M913-S916 PolarHBondContact O-N 2.96Å; M913-S916 VanDerWaalsContact O-N 3.11Å; M913-L917 HydrophobicContact CG-CD1 4.31Å; M913-L917 WeakPolarHBondContact O-CG 3.28Å; M913-L917 PolarHBondContact O-N 3.35Å
914	A	84.4	Confident	86.4	Confident	67 Å²	67	45.9 Å²	45.9	55%	0.554	23%	0.227	S	C	*	.	H	α-helix	trans	-59.7	-41.9	178.9	0	0	0	0	0	112.4	N912 R918	N912-A914 PolarHBondContact O-N 3.32Å; A914-R918 WeakPolarHBondContact O-CB 3.49Å; A914-R918 PolarHBondContact O-N 3.43Å; A914-R918 VanDerWaalsContact O-N 3.09Å
915	K	84.6	Confident	86.7	Confident	36 Å²	36	46 Å²	46	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-42.7	174.5	-76.8	-172.4	173	-171.5	0	111.4	T23 N912 M913 R918 Q919 V942 W956	T23-K915 HydrophobicContact CG2-CG 4.15Å; N912-K915 PolarHBondContact O-N 3.44Å; M913-K915 VanDerWaalsContact C-N 3.33Å; M913-K915 PolarHBondContact O-N 3.07Å; K915-R918 WeakPolarHBondContact O-CB 3.36Å; K915-R918 PolarHBondContact O-N 3.41Å; K915-Q919 WeakPolarHBondContact O-CG 3.48Å; K915-Q919 PolarHBondContact O-N 3.05Å; K915-V942 PolarHBondContact NZ-O 3.13Å; K915-W956 HydrophobicContact CB-CH2 4.19Å; K915-W956 HydrophobicContact CB-CZ2 4.25Å; K915-W956 HydrophobicContact CD-CH2 4.21Å; K915-W956 HydrophobicContact CD-CZ3 4.31Å
916	S	88.1	Confident	87	Confident	4 Å²	4	43.3 Å²	43.3	3%	0.028	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-48.4	179.3	-56.4	0	0	0	0	111.5	N912 M913 R918 Q919 I920 W956	N912-S916 PolarHBondContact O-N 3.32Å; N912-S916 PolarHBondContact O-OG 3.01Å; M913-S916 WeakPolarHBondContact O-CB 3.19Å; M913-S916 PolarHBondContact O-N 2.96Å; M913-S916 VanDerWaalsContact O-N 3.11Å; S916-R918 VanDerWaalsContact C-N 3.32Å; S916-R918 PolarHBondContact O-N 3.46Å; S916-Q919 PolarHBondContact O-N 3.09Å; S916-I920 WeakPolarHBondContact O-CG1 3.2Å; S916-I920 PolarHBondContact O-N 3.41Å; S916-I920 VanDerWaalsContact O-N 3.16Å; S916-W956 PolarHBondContact OG-NE1 2.97Å
917	L	89.9	Confident	87.5	Confident	45 Å²	45	43.5 Å²	43.5	24%	0.236	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-40.3	176.4	-66.6	175.3	0	0	0	111.9	P865 V870 M913 Q919 I920 R921	P865-L917 HydrophobicContact CG-CB 4.17Å; P865-L917 HydrophobicContact CG-CD2 3.76Å; V870-L917 HydrophobicContact CG1-CD2 4.39Å; V870-L917 HydrophobicContact CG2-CD2 3.97Å; M913-L917 HydrophobicContact CG-CD1 4.31Å; M913-L917 WeakPolarHBondContact O-CG 3.28Å; M913-L917 PolarHBondContact O-N 3.35Å; L917-Q919 PolarHBondContact O-N 3.49Å; L917-I920 PolarHBondContact O-N 3.14Å; L917-R921 PolarHBondContact O-N 3.28Å
918	R	88.3	Confident	87.9	Confident	49 Å²	49	44 Å²	44	19%	0.185	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-41.6	175.3	-175.8	178.1	177.3	-173.5	-1.4	112.5	I861 A914 K915 S916 I920 R921 L922	I861-R918 HydrophobicContact CG2-CG 4.49Å; A914-R918 WeakPolarHBondContact O-CB 3.49Å; A914-R918 PolarHBondContact O-N 3.43Å; A914-R918 VanDerWaalsContact O-N 3.09Å; K915-R918 WeakPolarHBondContact O-CB 3.36Å; K915-R918 PolarHBondContact O-N 3.41Å; S916-R918 VanDerWaalsContact C-N 3.32Å; S916-R918 PolarHBondContact O-N 3.46Å; R918-I920 VanDerWaalsContact C-N 3.34Å; R918-R921 PolarHBondContact O-N 3.49Å; R918-L922 HydrophobicContact CG-CD1 4.21Å; R918-L922 HydrophobicContact CG-CG 4.48Å; R918-L922 WeakPolarHBondContact O-CB 3.38Å; R918-L922 VanDerWaalsContact O-CG 3.29Å; R918-L922 WeakPolarHBondContact O-CG 3.36Å; R918-L922 PolarHBondContact O-N 3.42Å
919	Q	90.4	Very high	88.2	Confident	14 Å²	14	47.2 Å²	47.2	7%	0.065	23%	0.229	C	C	.	.	H	α-helix	trans	-67.3	-35.9	178.4	-60.2	-45	-50.4	0	0	112.4	K915 S916 L917 L922 N923 W956 I959	K915-Q919 WeakPolarHBondContact O-CG 3.48Å; K915-Q919 PolarHBondContact O-N 3.05Å; S916-Q919 PolarHBondContact O-N 3.09Å; L917-Q919 PolarHBondContact O-N 3.49Å; Q919-L922 PolarHBondContact O-N 3.38Å; Q919-N923 PolarHBondContact O-N 2.9Å; Q919-W956 HydrophobicContact CG-CB 4.01Å; Q919-W956 HydrophobicContact CG-CG 4.04Å; Q919-I959 HydrophobicContact CB-CG2 4Å
920	I	92.1	Very high	88.6	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-47.8	173.9	-60.6	164.5	0	0	0	109.8	P865 N869 V870 F873 S916 L917 R918 L922 N923 E924 I959	P865-I920 HydrophobicContact CB-CB 4.01Å; P865-I920 HydrophobicContact CB-CG2 3.59Å; P865-I920 HydrophobicContact CG-CB 4.32Å; P865-I920 HydrophobicContact CG-CG2 4.27Å; N869-I920 HydrophobicContact CB-CG2 3.62Å; V870-I920 HydrophobicContact CG2-CD1 4.36Å; F873-I920 HydrophobicContact CB-CD1 3.66Å; F873-I920 HydrophobicContact CB-CG1 4.22Å; F873-I920 HydrophobicContact CD1-CD1 4Å; F873-I920 HydrophobicContact CD2-CD1 4.33Å; F873-I920 HydrophobicContact CD2-CG1 4.36Å; F873-I920 HydrophobicContact CG-CD1 3.74Å; F873-I920 HydrophobicContact CG-CG1 4.24Å; S916-I920 WeakPolarHBondContact O-CG1 3.2Å; S916-I920 PolarHBondContact O-N 3.41Å; S916-I920 VanDerWaalsContact O-N 3.16Å; L917-I920 PolarHBondContact O-N 3.14Å; R918-I920 VanDerWaalsContact C-N 3.34Å; I920-L922 VanDerWaalsContact C-N 3.32Å; I920-L922 PolarHBondContact O-N 3.06Å; I920-N923 WeakPolarHBondContact O-CB 3.37Å; I920-N923 PolarHBondContact O-N 3.42Å; I920-N923 VanDerWaalsContact O-N 3.16Å; I920-E924 PolarHBondContact O-N 3.35Å; I920-I959 HydrophobicContact CG1-CG1 4.19Å
921	R	91.6	Very high	88.7	Confident	25 Å²	25	45.8 Å²	45.8	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-40.6	178.2	-176.6	60.1	179.1	158.9	-2.2	112.2	D860 Q863 P865 L917 R918 N923 E924 V925	D860-R921 PolarHBondContact O-NE 3.25Å; Q863-R921 WeakPolarHBondContact O-CG 3.36Å; P865-R921 HydrophobicContact CB-CB 4.27Å; L917-R921 PolarHBondContact O-N 3.28Å; R918-R921 PolarHBondContact O-N 3.49Å; R921-N923 VanDerWaalsContact C-N 3.3Å; R921-N923 PolarHBondContact O-N 3.47Å; R921-E924 WeakPolarHBondContact CD-OE2 3.41Å; R921-E924 IonicContact CZ-OE2 2.69Å; R921-E924 IonicContact NE-OE2 2.84Å; R921-E924 IonicContact NH1-OE2 3.21Å; R921-E924 PolarHBondContact NH1-OE2 3.06Å; R921-E924 WeakPolarHBondContact O-CB 3.45Å; R921-E924 PolarHBondContact O-N 3.09Å; R921-V925 WeakPolarHBondContact O-CG2 3.41Å; R921-V925 PolarHBondContact O-N 3.09Å; R921-V925 VanDerWaalsContact O-N 3.11Å
922	L	90.4	Very high	88.9	Confident	4 Å²	4	45 Å²	45	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-37	176.4	-78.1	171.7	0	0	0	112.5	L798 I861 R918 Q919 I920 V925 L926 L960	L798-L922 HydrophobicContact CD1-CD1 3.84Å; L798-L922 HydrophobicContact CD1-CD2 3.61Å; L798-L922 HydrophobicContact CD1-CG 4.4Å; I861-L922 HydrophobicContact CB-CD2 4.38Å; I861-L922 HydrophobicContact CD1-CD2 3.98Å; I861-L922 HydrophobicContact CG1-CD2 3.97Å; I861-L922 HydrophobicContact CG2-CD2 3.63Å; I861-L922 HydrophobicContact CG2-CG 4.18Å; R918-L922 HydrophobicContact CG-CD1 4.21Å; R918-L922 HydrophobicContact CG-CG 4.48Å; R918-L922 WeakPolarHBondContact O-CB 3.38Å; R918-L922 VanDerWaalsContact O-CG 3.29Å; R918-L922 WeakPolarHBondContact O-CG 3.36Å; R918-L922 PolarHBondContact O-N 3.42Å; Q919-L922 PolarHBondContact O-N 3.38Å; I920-L922 VanDerWaalsContact C-N 3.32Å; I920-L922 PolarHBondContact O-N 3.06Å; L922-V925 PolarHBondContact O-N 3.46Å; L922-L926 WeakPolarHBondContact O-CB 3.45Å; L922-L926 WeakPolarHBondContact O-CG 3.3Å; L922-L926 PolarHBondContact O-N 2.96Å; L922-L960 HydrophobicContact CB-CD1 3.63Å; L922-L960 HydrophobicContact CD1-CD1 4.21Å
923	N	92.4	Very high	89.1	Confident	13 Å²	13	44.9 Å²	44.9	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-46.4	174	179.9	-74.9	0	0	0	111.8	Q919 I920 R921 V925 L926 L927 I959 R962	Q919-N923 PolarHBondContact O-N 2.9Å; I920-N923 WeakPolarHBondContact O-CB 3.37Å; I920-N923 PolarHBondContact O-N 3.42Å; I920-N923 VanDerWaalsContact O-N 3.16Å; R921-N923 VanDerWaalsContact C-N 3.3Å; R921-N923 PolarHBondContact O-N 3.47Å; N923-V925 VanDerWaalsContact C-N 3.3Å; N923-V925 PolarHBondContact O-N 3.32Å; N923-L926 WeakPolarHBondContact O-CB 3.36Å; N923-L926 PolarHBondContact O-N 3.33Å; N923-L926 VanDerWaalsContact O-N 3.11Å; N923-L927 WeakPolarHBondContact O-CG 3.48Å; N923-L927 PolarHBondContact O-N 2.83Å; N923-L927 WeakPolarHBondContact OD1-CD1 3.47Å; N923-I959 WeakPolarHBondContact CB-O 3.47Å; N923-I959 PolarHBondContact ND2-O 3.4Å; N923-R962 PolarHBondContact ND2-N 3.18Å; N923-R962 PolarHBondContact ND2-O 3.5Å
924	E	91.3	Very high	89.4	Confident	13 Å²	13	40 Å²	40	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-56.7	-47	178.5	-63.2	171.3	175.1	0	0	110.7	Q866 N869 I920 R921 L926 L927 D928	Q866-E924 VanDerWaalsContact CB-OE1 3.32Å; Q866-E924 WeakPolarHBondContact CB-OE1 3.43Å; Q866-E924 PolarHBondContact N-OE1 3.37Å; N869-E924 WeakPolarHBondContact ND2-CG 3.46Å; N869-E924 PolarHBondContact ND2-OE1 3.32Å; I920-E924 PolarHBondContact O-N 3.35Å; R921-E924 WeakPolarHBondContact CD-OE2 3.41Å; R921-E924 IonicContact CZ-OE2 2.69Å; R921-E924 IonicContact NE-OE2 2.84Å; R921-E924 IonicContact NH1-OE2 3.21Å; R921-E924 PolarHBondContact NH1-OE2 3.06Å; R921-E924 WeakPolarHBondContact O-CB 3.45Å; R921-E924 PolarHBondContact O-N 3.09Å; E924-L926 PolarHBondContact O-N 3.2Å; E924-L927 WeakPolarHBondContact O-CB 3.43Å; E924-L927 PolarHBondContact O-N 3.12Å; E924-D928 PolarHBondContact O-N 2.74Å; E924-D928 VanDerWaalsContact O-N 3.07Å
925	V	90.4	Very high	89.8	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-43.4	176.1	172.6	0	0	0	0	111.7	Y796 I858 R921 L922 N923 L927 D928 Y929	Y796-V925 HydrophobicContact CE1-CG1 4.43Å; I858-V925 HydrophobicContact CD1-CG1 3.65Å; I858-V925 HydrophobicContact CG2-CG1 3.94Å; R921-V925 WeakPolarHBondContact O-CG2 3.41Å; R921-V925 PolarHBondContact O-N 3.09Å; R921-V925 VanDerWaalsContact O-N 3.11Å; L922-V925 PolarHBondContact O-N 3.46Å; N923-V925 VanDerWaalsContact C-N 3.3Å; N923-V925 PolarHBondContact O-N 3.32Å; V925-L927 VanDerWaalsContact C-N 3.29Å; V925-L927 PolarHBondContact O-N 3.5Å; V925-D928 PolarHBondContact O-N 3.43Å; V925-Y929 HydrophobicContact CG1-CD2 3.9Å; V925-Y929 HydrophobicContact CG1-CE2 4.28Å; V925-Y929 WeakPolarHBondContact O-CD2 3.25Å; V925-Y929 PolarHBondContact O-N 2.93Å
926	L	90.8	Very high	90.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-38	178.3	-72.7	165.9	0	0	0	112.2	Y796 L922 N923 E924 S930 I936 I938 L960 L964	Y796-L926 HydrophobicContact CD1-CD2 4.01Å; Y796-L926 HydrophobicContact CD2-CD2 3.62Å; Y796-L926 HydrophobicContact CE1-CD2 3.71Å; Y796-L926 HydrophobicContact CE2-CD2 3.31Å; Y796-L926 HydrophobicContact CG-CD2 3.96Å; L922-L926 WeakPolarHBondContact O-CB 3.45Å; L922-L926 WeakPolarHBondContact O-CG 3.3Å; L922-L926 PolarHBondContact O-N 2.96Å; N923-L926 WeakPolarHBondContact O-CB 3.36Å; N923-L926 PolarHBondContact O-N 3.33Å; N923-L926 VanDerWaalsContact O-N 3.11Å; E924-L926 PolarHBondContact O-N 3.2Å; L926-S930 WeakPolarHBondContact O-CB 3.34Å; L926-S930 PolarHBondContact O-N 3.11Å; L926-I936 HydrophobicContact CD2-CG2 3.93Å; L926-I938 HydrophobicContact CD1-CD1 3.85Å; L926-I938 HydrophobicContact CD2-CD1 4.23Å; L926-I938 HydrophobicContact CG-CD1 4.47Å; L926-L960 HydrophobicContact CD1-CD1 3.93Å; L926-L960 HydrophobicContact CD1-CG 4.41Å; L926-L960 WeakPolarHBondContact CD1-O 3.48Å; L926-L964 HydrophobicContact CB-CD1 4.14Å; L926-L964 HydrophobicContact CB-CD2 4.11Å; L926-L964 HydrophobicContact CD1-CD1 4.24Å
927	L	90.2	Very high	90.7	Very high	59 Å²	59	35 Å²	35	31%	0.309	16%	0.164	S	C	.	.	H	α-helix	trans	-67.2	-37.3	176.9	-74.8	173.3	0	0	0	112	N923 E924 V925 L964	N923-L927 WeakPolarHBondContact O-CG 3.48Å; N923-L927 PolarHBondContact O-N 2.83Å; N923-L927 WeakPolarHBondContact OD1-CD1 3.47Å; E924-L927 WeakPolarHBondContact O-CB 3.43Å; E924-L927 PolarHBondContact O-N 3.12Å; V925-L927 VanDerWaalsContact C-N 3.29Å; V925-L927 PolarHBondContact O-N 3.5Å; L927-L964 HydrophobicContact CD2-CD2 3.85Å; L927-L964 HydrophobicContact CD2-CG 4.33Å; L927-L964 HydrophobicContact CG-CD2 4.39Å
928	D	89.4	Confident	90.9	Very high	123 Å²	123	32.8 Å²	32.8	66%	0.658	15%	0.153	S	C	*	.	H	α-helix	trans	-72.7	-45.3	-179.4	-69.8	-19.6	0	0	0	112.2	E924 V925	E924-D928 PolarHBondContact O-N 2.74Å; E924-D928 VanDerWaalsContact O-N 3.07Å; V925-D928 PolarHBondContact O-N 3.43Å
929	Y	89	Confident	91.1	Very high	90 Å²	90	30.8 Å²	30.8	35%	0.353	15%	0.146	S	C	.	.	H	α-helix	trans	-96.5	-24.8	-170	-73.6	-92.8	0	0	0	115.1	R824 F826 V925	R824-Y929 PolarHBondContact NH2-O 2.88Å; F826-Y929 HydrophobicContact CE1-CD1 4.15Å; V925-Y929 HydrophobicContact CG1-CD2 3.9Å; V925-Y929 HydrophobicContact CG1-CE2 4.28Å; V925-Y929 WeakPolarHBondContact O-CD2 3.25Å; V925-Y929 PolarHBondContact O-N 2.93Å
930	S	91.3	Very high	91.1	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.007	14%	0.144	C	C	.	.			trans	-125.4	21.1	-167.1	-69.9	0	0	0	0	115.4	D794 Y796 L926 D932 A933	D794-S930 WeakPolarHBondContact CB-OG 3.4Å; D794-S930 VanDerWaalsContact OD2-CB 3.26Å; D794-S930 WeakPolarHBondContact OD2-CB 3.42Å; D794-S930 PolarHBondContact OD2-OG 2.9Å; Y796-S930 WeakPolarHBondContact CE2-OG 3.37Å; Y796-S930 PolarHBondContact OH-OG 2.99Å; L926-S930 WeakPolarHBondContact O-CB 3.34Å; L926-S930 PolarHBondContact O-N 3.11Å; S930-D932 VanDerWaalsContact C-N 3.31Å; S930-D932 PolarHBondContact O-N 2.96Å; S930-A933 WeakPolarHBondContact O-CB 3.26Å; S930-A933 PolarHBondContact O-N 2.88Å
931	R	85	Confident	91	Very high	149 Å²	149	30.9 Å²	30.9	56%	0.562	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-37.4	-177.3	-162.9	176.5	-171.8	-172.7	4.3	114.8
932	D	86.1	Confident	90.6	Very high	131 Å²	131	30.1 Å²	30.1	70%	0.701	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.7	12.5	-175.2	-66.4	-38.8	0	0	0	113.9	S930	S930-D932 VanDerWaalsContact C-N 3.31Å; S930-D932 PolarHBondContact O-N 2.96Å
933	A	90.6	Very high	90.2	Very high	8 Å²	8	30 Å²	30	7%	0.066	15%	0.146	C	C	.	.			trans	-63.4	151.1	177.8	0	0	0	0	0	112.2	D794 S930 I936 A966	D794-A933 HydrophobicContact CB-CB 4.43Å; D794-A933 WeakPolarHBondContact OD2-CB 3.48Å; S930-A933 WeakPolarHBondContact O-CB 3.26Å; S930-A933 PolarHBondContact O-N 2.88Å; A933-I936 HydrophobicContact CB-CG1 3.95Å; A933-A966 HydrophobicContact CB-CB 4.27Å; A933-A966 VanDerWaalsContact O-CB 3.22Å; A933-A966 WeakPolarHBondContact O-CB 3.38Å
934	A	90.3	Very high	89.5	Confident	4 Å²	4	33.5 Å²	33.5	3%	0.033	16%	0.158	C	C	.	.	S	Bend	trans	-78.8	-30.9	170.2	0	0	0	0	0	112.6	Q788 K791 T792 W818 P967	Q788-A934 HydrophobicContact CB-CB 4.4Å; K791-A934 HydrophobicContact CB-CB 3.64Å; K791-A934 HydrophobicContact CD-CB 3.95Å; K791-A934 HydrophobicContact CG-CB 4.47Å; T792-A934 PolarHBondContact O-N 2.86Å; W818-A934 HydrophobicContact CZ3-CB 3.93Å; A934-P967 WeakPolarHBondContact O-CD 3.47Å
935	L	93.8	Very high	88.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	134.8	178.8	177.8	67	0	0	0	108.2	I793 D794 L812 W818 V937 P967 L969	I793-L935 WeakPolarHBondContact CA-O 3.44Å; I793-L935 HydrophobicContact CG2-CB 4.4Å; I793-L935 HydrophobicContact CG2-CD2 4.49Å; D794-L935 PolarHBondContact N-O 2.91Å; L812-L935 HydrophobicContact CD1-CD2 3.6Å; W818-L935 HydrophobicContact CH2-CB 4.25Å; W818-L935 HydrophobicContact CZ3-CB 4.01Å; L935-V937 HydrophobicContact CD2-CG2 3.94Å; L935-V937 HydrophobicContact CG-CG2 4Å; L935-P967 HydrophobicContact CD1-CB 3.96Å; L935-L969 HydrophobicContact CD1-CB 4.34Å
936	I	95.5	Very high	87.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.9	172	-59.9	171.8	0	0	0	107.3	D794 Y796 L926 A933 L964 A966 P967 V968 L969	D794-I936 CarbonylContact O-C 3.5Å; D794-I936 WeakPolarHBondContact O-CA 3.35Å; Y796-I936 HydrophobicContact CD2-CG2 3.97Å; Y796-I936 HydrophobicContact CE2-CG2 4.03Å; L926-I936 HydrophobicContact CD2-CG2 3.93Å; A933-I936 HydrophobicContact CB-CG1 3.95Å; I936-L964 HydrophobicContact CD1-CD1 4.12Å; I936-L964 HydrophobicContact CD1-CD2 3.94Å; I936-L964 HydrophobicContact CD1-CG 4.47Å; I936-A966 HydrophobicContact CD1-CB 3.98Å; I936-A966 HydrophobicContact CG1-CB 4.05Å; I936-P967 PolarHBondContact N-O 2.95Å; I936-V968 HydrophobicContact CB-CG2 4.42Å; I936-V968 HydrophobicContact CD1-CG2 4.45Å; I936-V968 WeakPolarHBondContact O-CA 3.37Å; I936-L969 PolarHBondContact O-N 3.16Å
937	V	95.4	Very high	87.2	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.6	174.1	-173.9	0	0	0	0	107.8	D794 I795 Y796 T805 P809 L935 L969 V971	D794-V937 PolarHBondContact O-N 2.87Å; I795-V937 CarbonylContact C-O 3.43Å; I795-V937 VanDerWaalsContact CA-O 3.3Å; I795-V937 WeakPolarHBondContact CA-O 3.45Å; Y796-V937 PolarHBondContact N-O 3.09Å; T805-V937 HydrophobicContact CG2-CG1 4.14Å; P809-V937 HydrophobicContact CG-CB 4.33Å; P809-V937 HydrophobicContact CG-CG1 4.44Å; P809-V937 HydrophobicContact CG-CG2 3.94Å; L935-V937 HydrophobicContact CD2-CG2 3.94Å; L935-V937 HydrophobicContact CG-CG2 4Å; V937-L969 WeakPolarHBondContact CA-O 3.47Å; V937-L969 HydrophobicContact CG2-CB 4.38Å; V937-L969 HydrophobicContact CG2-CD2 4.41Å; V937-V971 HydrophobicContact CG1-CB 4.46Å; V937-V971 HydrophobicContact CG1-CG2 3.62Å
938	I	94.3	Very high	86.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.1	-175.4	-176.7	159.9	0	0	0	110.9	Y796 L798 L926 M940 L960 V968 L969 M970 V971	Y796-I938 HydrophobicContact CG-CD1 4.39Å; L798-I938 HydrophobicContact CD1-CD1 4.1Å; L798-I938 HydrophobicContact CD1-CG1 4.24Å; L926-I938 HydrophobicContact CD1-CD1 3.85Å; L926-I938 HydrophobicContact CD2-CD1 4.23Å; L926-I938 HydrophobicContact CG-CD1 4.47Å; I938-M940 PolarHBondContact O-N 2.82Å; I938-L960 HydrophobicContact CD1-CD1 3.83Å; I938-L960 HydrophobicContact CD1-CD2 4.13Å; I938-L960 HydrophobicContact CD1-CG 4.22Å; I938-L960 HydrophobicContact CG2-CD2 4.4Å; I938-V968 HydrophobicContact CG2-CG1 3.96Å; I938-L969 PolarHBondContact N-O 2.76Å; I938-M970 HydrophobicContact CG2-CG 3.84Å; I938-M970 CarbonylContact O-C 3.38Å; I938-M970 WeakPolarHBondContact O-CA 3.29Å; I938-V971 PolarHBondContact O-N 3.06Å
939	T	92.2	Very high	86.7	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.043	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	122.4	172.2	-51.3	0	0	0	0	110.4	Y796 L798 V971	Y796-T939 PolarHBondContact O-N 2.96Å; Y796-T939 VanDerWaalsContact O-N 3.1Å; Y796-T939 PolarHBondContact O-OG1 2.79Å; L798-T939 PolarHBondContact N-OG1 3.44Å; T939-V971 CarbonylContact C-O 3.6Å; T939-V971 VanDerWaalsContact CA-O 3.31Å; T939-V971 WeakPolarHBondContact CA-O 3.5Å
940	M	91.2	Very high	86.7	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-71.4	129.6	-179.4	-168	171.9	70.9	0	0	110	F719 V725 V727 I938 L957 M970 V971 R972	F719-M940 HydrophobicContact CE1-CE 4.21Å; F719-M940 HydrophobicContact CE2-CE 4.19Å; F719-M940 HydrophobicContact CZ-CE 3.39Å; V725-M940 HydrophobicContact CB-CE 4.18Å; V725-M940 HydrophobicContact CG1-CE 3.88Å; V727-M940 HydrophobicContact CG2-SD 3.99Å; I938-M940 PolarHBondContact O-N 2.82Å; M940-L957 HydrophobicContact CG-CD2 3.63Å; M940-L957 HydrophobicContact SD-CD2 4.18Å; M940-M970 HydrophobicContact CB-CB 4.05Å; M940-M970 HydrophobicContact CG-CB 4.08Å; M940-M970 HydrophobicContact SD-CB 4.29Å; M940-V971 PolarHBondContact N-O 3.31Å; M940-R972 HydrophobicContact CB-CB 4.18Å; M940-R972 HydrophobicContact CE-CB 4.11Å
941	P	89.8	Confident	86.5	Confident	18 Å²	18	31.9 Å²	31.9	12%	0.117	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-64.7	147.1	172.8	28.5	-34.6	0	0	0	109.8	Y953 L957 L960	P941-Y953 WeakPolarHBondContact O-CE2 2.94Å; P941-Y953 PolarHBondContact O-OH 3.42Å; P941-L957 HydrophobicContact CG-CD2 3.95Å; P941-L960 HydrophobicContact CG-CD2 4.4Å
942	V	83.9	Confident	86.7	Confident	8 Å²	8	24.8 Å²	24.8	5%	0.048	15%	0.145	C	C	.	.			trans	-105.4	120.2	177.1	-178.7	0	0	0	0	110	F719 K915 R972	F719-V942 HydrophobicContact CE2-CG1 4.41Å; F719-V942 HydrophobicContact CZ-CG2 4.43Å; K915-V942 PolarHBondContact NZ-O 3.13Å; V942-R972 HydrophobicContact CG2-CG 4.16Å
943	G	81.8	Confident	86.9	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.01	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-79.2	134.5	164.7	0	0	0	0	0	110	H716	H716-G943 PolarHBondContact CE1-O 3.28Å
944	R	78.3	Confident	86.9	Confident	87 Å²	87	18.3 Å²	18.3	33%	0.328	11%	0.109	S	C	.	.	P	Polyproline II helix	trans	-82	135.5	175.8	-71.2	-171.8	-178.9	156.7	9.4	110.3	L52 G946 S947 C948	L52-R944 WeakPolarHBondContact O-CG 3.27Å; L52-R944 PolarHBondContact O-NE 3.4Å; R944-G946 PolarHBondContact O-N 2.82Å; R944-S947 PolarHBondContact O-N 3.13Å; R944-C948 PolarHBondContact O-N 3Å
945	R	76.7	Confident	86.9	Confident	110 Å²	110	18.1 Å²	18.1	42%	0.415	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	136.3	176.5	-164.2	172.8	-168.1	-176.7	2	110	E713 D720 S947	E713-R945 IonicContact OE2-CZ 3.7Å; E713-R945 IonicContact OE2-NE 3.75Å; E713-R945 IonicContact OE2-NH2 2.95Å; E713-R945 PolarHBondContact OE2-NH2 2.82Å; D720-R945 IonicContact OD2-NH1 2.93Å; D720-R945 PolarHBondContact OD2-NH1 2.94Å; R945-S947 PolarHBondContact O-N 3.38Å
946	G	71.3	Confident	86.8	Confident	79 Å²	79	18.1 Å²	18.1	81%	0.814	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	-26.9	-177.9	0	0	0	0	0	115.8	R944	R944-G946 PolarHBondContact O-N 2.82Å
947	S	75.6	Confident	86.6	Confident	36 Å²	36	18.1 Å²	18.1	25%	0.252	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-19.3	177.8	178.2	0	0	0	0	114.1	N912 R944 R945	N912-S947 PolarHBondContact ND2-O 3.27Å; R944-S947 PolarHBondContact O-N 3.13Å; R945-S947 PolarHBondContact O-N 3.38Å
948	C	82.5	Confident	86.5	Confident	7 Å²	7	18.4 Å²	18.4	5%	0.047	11%	0.109	C	C	.	.	S	Bend	trans	-123.4	116.1	174.8	-176.6	0	0	0	0	108.7	R944 W956	R944-C948 PolarHBondContact O-N 3Å; C948-W956 HydrophobicContact CB-CH2 4.41Å; C948-W956 WeakPolarHBondContact SG-CH2 3.47Å
949	P	86.6	Confident	86.4	Confident	11 Å²	11	18.9 Å²	18.9	7%	0.071	11%	0.111	C	C	.	.			trans	-57.9	146.1	172.7	-24.8	33.8	0	0	0	111.6	I904 D908 S951 L952 Y953	I904-P949 HydrophobicContact CG1-CB 4.23Å; I904-P949 HydrophobicContact CG1-CG 4.44Å; D908-P949 HydrophobicContact CB-CG 3.78Å; P949-S951 VanDerWaalsContact C-N 3.28Å; P949-S951 PolarHBondContact O-N 3.01Å; P949-L952 HydrophobicContact CB-CB 4.38Å; P949-L952 WeakPolarHBondContact O-CB 3.44Å; P949-L952 PolarHBondContact O-N 3.35Å; P949-L952 VanDerWaalsContact O-N 3.13Å; P949-Y953 PolarHBondContact O-N 3.07Å
950	S	87.8	Confident	86.3	Confident	6 Å²	6	18.6 Å²	18.6	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-35.6	-176.5	-49.9	0	0	0	0	113.2	H709 Y953 L954	H709-S950 PolarHBondContact ND1-OG 3.4Å; S950-Y953 PolarHBondContact O-N 3.47Å; S950-L954 PolarHBondContact O-N 2.88Å
951	S	87.8	Confident	86.2	Confident	6 Å²	6	18.8 Å²	18.8	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-66.1	-39.1	176.6	56.7	0	0	0	0	112.3	W902 I904 P949 A955	W902-S951 VanDerWaalsContact O-CB 3.24Å; W902-S951 WeakPolarHBondContact O-CB 3.32Å; W902-S951 PolarHBondContact O-OG 2.92Å; I904-S951 VanDerWaalsContact CG1-OG 3.28Å; I904-S951 WeakPolarHBondContact CG1-OG 3.48Å; P949-S951 VanDerWaalsContact C-N 3.28Å; P949-S951 PolarHBondContact O-N 3.01Å; S951-A955 WeakPolarHBondContact O-CB 3.48Å; S951-A955 PolarHBondContact O-N 3.11Å
952	L	88.8	Confident	86.1	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.7	-42.1	175.9	-176.6	61.5	0	0	0	110.9	F873 I904 L909 N912 P949 A955 W956	F873-L952 HydrophobicContact CZ-CD1 3.94Å; I904-L952 HydrophobicContact CD1-CB 4Å; I904-L952 HydrophobicContact CD1-CD1 4.39Å; I904-L952 HydrophobicContact CG1-CB 4.26Å; L909-L952 HydrophobicContact CD1-CD1 4.41Å; N912-L952 HydrophobicContact CB-CD2 4.01Å; P949-L952 HydrophobicContact CB-CB 4.38Å; P949-L952 WeakPolarHBondContact O-CB 3.44Å; P949-L952 PolarHBondContact O-N 3.35Å; P949-L952 VanDerWaalsContact O-N 3.13Å; L952-A955 WeakPolarHBondContact O-CB 3.32Å; L952-A955 PolarHBondContact O-N 2.57Å; L952-W956 HydrophobicContact CD1-CZ2 4.42Å; L952-W956 HydrophobicContact CD2-CZ2 3.84Å; L952-W956 HydrophobicContact CG-CZ2 3.79Å; L952-W956 PolarHBondContact O-N 3.09Å
953	Y	90.3	Very high	86.2	Confident	1 Å²	1	26.8 Å²	26.8	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-66.3	-41.5	177.4	-174.5	-145.6	0	0	0	112.2	I712 L715 P941 P949 S950 A955 W956 L957	I712-Y953 HydrophobicContact CD1-CD1 3.49Å; I712-Y953 VanDerWaalsContact CD1-CD1 3.49Å; I712-Y953 HydrophobicContact CD1-CE1 3.91Å; I712-Y953 HydrophobicContact CD1-CG 4.27Å; I712-Y953 HydrophobicContact CG1-CD1 4.24Å; I712-Y953 HydrophobicContact CG2-CD1 3.78Å; I712-Y953 HydrophobicContact CG2-CE1 4.45Å; L715-Y953 HydrophobicContact CD1-CE1 4.18Å; P941-Y953 WeakPolarHBondContact O-CE2 2.94Å; P941-Y953 PolarHBondContact O-OH 3.42Å; P949-Y953 PolarHBondContact O-N 3.07Å; S950-Y953 PolarHBondContact O-N 3.47Å; Y953-A955 VanDerWaalsContact C-N 3.32Å; Y953-A955 PolarHBondContact O-N 2.95Å; Y953-W956 AromaticContact CD2-CE3 3.82Å; Y953-W956 HydrophobicContact CD2-CE3 3.82Å; Y953-W956 HydrophobicContact CD2-CZ3 4.36Å; Y953-W956 WeakPolarHBondContact O-CB 3.46Å; Y953-W956 PolarHBondContact O-N 3.3Å; Y953-L957 HydrophobicContact CD2-CG 4.5Å; Y953-L957 HydrophobicContact CE2-CD1 4.36Å; Y953-L957 HydrophobicContact CE2-CD2 4.19Å; Y953-L957 HydrophobicContact CE2-CG 4.21Å; Y953-L957 PolarHBondContact O-N 3.33Å; Y953-L957 VanDerWaalsContact O-N 3.13Å
954	L	90.4	Very high	86.5	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-62.6	-38.8	171.4	-82.7	170.8	0	0	0	112.6	W701 A708 Y711 I712 S950 W956 L957 D958	W701-L954 HydrophobicContact CB-CD1 4.17Å; W701-L954 HydrophobicContact CD2-CB 4.19Å; W701-L954 HydrophobicContact CD2-CD1 4.34Å; W701-L954 HydrophobicContact CE3-CB 4.19Å; W701-L954 HydrophobicContact CE3-CD1 4.15Å; W701-L954 HydrophobicContact CG-CD1 4.39Å; W701-L954 HydrophobicContact CZ3-CB 4.42Å; A708-L954 HydrophobicContact CB-CD1 3.57Å; A708-L954 WeakPolarHBondContact O-CD1 3.42Å; Y711-L954 HydrophobicContact CD1-CD2 3.89Å; Y711-L954 HydrophobicContact CE1-CD2 4.11Å; I712-L954 HydrophobicContact CD1-CD1 4.41Å; I712-L954 HydrophobicContact CD1-CD2 3.65Å; I712-L954 HydrophobicContact CD1-CG 3.57Å; I712-L954 HydrophobicContact CG1-CD1 3.86Å; I712-L954 HydrophobicContact CG1-CD2 4.03Å; I712-L954 HydrophobicContact CG1-CG 3.49Å; I712-L954 VanDerWaalsContact CG1-CG 3.49Å; S950-L954 PolarHBondContact O-N 2.88Å; L954-W956 PolarHBondContact O-N 3.09Å; L954-L957 PolarHBondContact O-N 2.88Å; L954-D958 VanDerWaalsContact O-CB 3.3Å; L954-D958 WeakPolarHBondContact O-CB 3.44Å; L954-D958 PolarHBondContact O-N 3.25Å
955	A	90.8	Very high	86.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-35	175.9	0	0	0	0	0	111.6	W701 F873 M876 I877 S951 L952 Y953 I959	W701-A955 HydrophobicContact CH2-CB 4.27Å; W701-A955 HydrophobicContact CZ2-CB 4.45Å; F873-A955 HydrophobicContact CE2-CB 3.88Å; F873-A955 HydrophobicContact CZ-CB 4.4Å; M876-A955 HydrophobicContact SD-CB 4.16Å; I877-A955 HydrophobicContact CG2-CB 3.79Å; S951-A955 WeakPolarHBondContact O-CB 3.48Å; S951-A955 PolarHBondContact O-N 3.11Å; L952-A955 WeakPolarHBondContact O-CB 3.32Å; L952-A955 PolarHBondContact O-N 2.57Å; Y953-A955 VanDerWaalsContact C-N 3.32Å; Y953-A955 PolarHBondContact O-N 2.95Å; A955-I959 WeakPolarHBondContact O-CB 3.5Å; A955-I959 WeakPolarHBondContact O-CG2 3.24Å; A955-I959 PolarHBondContact O-N 2.98Å
956	W	92.1	Very high	87.3	Confident	1 Å²	1	25.6 Å²	25.6	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-47.9	172.3	-66.4	-10.7	0	0	0	112.9	F873 N912 K915 S916 Q919 C948 L952 Y953 L954 D958 I959 L960	F873-W956 AromaticContact CZ-CD1 3.96Å; N912-W956 HydrophobicContact CB-CH2 3.74Å; N912-W956 HydrophobicContact CB-CZ2 3.52Å; K915-W956 HydrophobicContact CB-CH2 4.19Å; K915-W956 HydrophobicContact CB-CZ2 4.25Å; K915-W956 HydrophobicContact CD-CH2 4.21Å; K915-W956 HydrophobicContact CD-CZ3 4.31Å; S916-W956 PolarHBondContact OG-NE1 2.97Å; Q919-W956 HydrophobicContact CG-CB 4.01Å; Q919-W956 HydrophobicContact CG-CG 4.04Å; C948-W956 HydrophobicContact CB-CH2 4.41Å; C948-W956 WeakPolarHBondContact SG-CH2 3.47Å; L952-W956 HydrophobicContact CD1-CZ2 4.42Å; L952-W956 HydrophobicContact CD2-CZ2 3.84Å; L952-W956 HydrophobicContact CG-CZ2 3.79Å; L952-W956 PolarHBondContact O-N 3.09Å; Y953-W956 AromaticContact CD2-CE3 3.82Å; Y953-W956 HydrophobicContact CD2-CE3 3.82Å; Y953-W956 HydrophobicContact CD2-CZ3 4.36Å; Y953-W956 WeakPolarHBondContact O-CB 3.46Å; Y953-W956 PolarHBondContact O-N 3.3Å; L954-W956 PolarHBondContact O-N 3.09Å; W956-D958 VanDerWaalsContact C-N 3.28Å; W956-D958 PolarHBondContact O-N 3.32Å; W956-I959 WeakPolarHBondContact O-CG2 3.49Å; W956-I959 PolarHBondContact O-N 3.22Å; W956-L960 WeakPolarHBondContact O-CB 3.47Å; W956-L960 PolarHBondContact O-N 3.1Å
957	L	92.1	Very high	88.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.2	-35.9	177.8	-60.8	178.9	0	0	0	111.3	F697 I712 L715 M940 P941 Y953 L954 S961 M970	F697-L957 HydrophobicContact CE2-CB 3.81Å; I712-L957 HydrophobicContact CD1-CD1 4.43Å; L715-L957 HydrophobicContact CD1-CD1 4.25Å; M940-L957 HydrophobicContact CG-CD2 3.63Å; M940-L957 HydrophobicContact SD-CD2 4.18Å; P941-L957 HydrophobicContact CG-CD2 3.95Å; Y953-L957 HydrophobicContact CD2-CG 4.5Å; Y953-L957 HydrophobicContact CE2-CD1 4.36Å; Y953-L957 HydrophobicContact CE2-CD2 4.19Å; Y953-L957 HydrophobicContact CE2-CG 4.21Å; Y953-L957 PolarHBondContact O-N 3.33Å; Y953-L957 VanDerWaalsContact O-N 3.13Å; L954-L957 PolarHBondContact O-N 2.88Å; L957-S961 PolarHBondContact O-N 3.31Å; L957-S961 PolarHBondContact O-OG 3.33Å; L957-M970 HydrophobicContact CB-SD 4.25Å; L957-M970 HydrophobicContact CD2-SD 3.84Å
958	D	91.8	Very high	89.2	Confident	7 Å²	7	20.7 Å²	20.7	4%	0.037	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-52.2	176.3	-167.9	7.6	0	0	0	110.8	F697 W701 R702 R729 M876 L954 W956 L960 S961 R962	F697-D958 HydrophobicContact CZ-CB 3.87Å; W701-D958 PolarHBondContact NE1-OD2 3.29Å; W701-D958 VanDerWaalsContact NE1-OD2 3.11Å; R702-D958 IonicContact CZ-OD2 3.6Å; R702-D958 IonicContact NE-OD2 2.85Å; R702-D958 IonicContact NH2-OD2 3.48Å; R702-D958 PolarHBondContact NH2-OD2 2.86Å; R729-D958 IonicContact CZ-OD1 2.63Å; R729-D958 VanDerWaalsContact CZ-OD1 3.28Å; R729-D958 VanDerWaalsContact NH1-CA 3.34Å; R729-D958 PolarHBondContact NH1-O 3Å; R729-D958 IonicContact NH1-OD1 3.51Å; R729-D958 PolarHBondContact NH1-OD1 3.44Å; R729-D958 IonicContact NH2-OD1 2.73Å; R729-D958 PolarHBondContact NH2-OD1 2.54Å; M876-D958 HydrophobicContact SD-CB 4.39Å; L954-D958 VanDerWaalsContact O-CB 3.3Å; L954-D958 WeakPolarHBondContact O-CB 3.44Å; L954-D958 PolarHBondContact O-N 3.25Å; W956-D958 VanDerWaalsContact C-N 3.28Å; W956-D958 PolarHBondContact O-N 3.32Å; D958-L960 PolarHBondContact O-N 3.49Å; D958-S961 PolarHBondContact O-N 3.18Å; D958-R962 WeakPolarHBondContact O-CB 3.45Å; D958-R962 PolarHBondContact O-N 3.13Å; D958-R962 VanDerWaalsContact O-N 3.15Å
959	I	91.7	Very high	89.9	Confident	10 Å²	10	20.4 Å²	20.4	5%	0.051	10%	0.096	C	C	.	.	H	α-helix	trans	-65.1	-41.9	-178.8	-160.3	67.1	0	0	0	111.1	F873 M876 Q919 I920 N923 A955 W956 S961 R962	F873-I959 HydrophobicContact CD2-CB 4.4Å; F873-I959 HydrophobicContact CD2-CG2 4.42Å; F873-I959 HydrophobicContact CE2-CG2 4.49Å; M876-I959 HydrophobicContact CE-CD1 4.02Å; Q919-I959 HydrophobicContact CB-CG2 4Å; I920-I959 HydrophobicContact CG1-CG1 4.19Å; N923-I959 WeakPolarHBondContact CB-O 3.47Å; N923-I959 PolarHBondContact ND2-O 3.4Å; A955-I959 WeakPolarHBondContact O-CB 3.5Å; A955-I959 WeakPolarHBondContact O-CG2 3.24Å; A955-I959 PolarHBondContact O-N 2.98Å; W956-I959 WeakPolarHBondContact O-CG2 3.49Å; W956-I959 PolarHBondContact O-N 3.22Å; I959-S961 PolarHBondContact O-N 3.37Å; I959-S961 VanDerWaalsContact O-N 3.15Å; I959-R962 WeakPolarHBondContact O-CB 3.34Å; I959-R962 PolarHBondContact O-N 3.27Å
960	L	91.1	Very high	90.3	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-57.2	-36.3	-178.5	-177.6	64.7	0	0	0	112.6	L922 L926 I938 P941 W956 D958 M970	L922-L960 HydrophobicContact CB-CD1 3.63Å; L922-L960 HydrophobicContact CD1-CD1 4.21Å; L926-L960 HydrophobicContact CD1-CD1 3.93Å; L926-L960 HydrophobicContact CD1-CG 4.41Å; L926-L960 WeakPolarHBondContact CD1-O 3.48Å; I938-L960 HydrophobicContact CD1-CD1 3.83Å; I938-L960 HydrophobicContact CD1-CD2 4.13Å; I938-L960 HydrophobicContact CD1-CG 4.22Å; I938-L960 HydrophobicContact CG2-CD2 4.4Å; P941-L960 HydrophobicContact CG-CD2 4.4Å; W956-L960 WeakPolarHBondContact O-CB 3.47Å; W956-L960 PolarHBondContact O-N 3.1Å; D958-L960 PolarHBondContact O-N 3.49Å; L960-M970 HydrophobicContact CD2-SD 4.42Å
961	S	90	Very high	90.6	Very high	5 Å²	5	19.6 Å²	19.6	4%	0.035	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	14.9	-173.4	59.4	0	0	0	0	113.9	R729 L957 D958 I959	R729-S961 WeakPolarHBondContact CD-OG 3.47Å; R729-S961 PolarHBondContact NH1-OG 2.78Å; L957-S961 PolarHBondContact O-N 3.31Å; L957-S961 PolarHBondContact O-OG 3.33Å; D958-S961 PolarHBondContact O-N 3.18Å; I959-S961 PolarHBondContact O-N 3.37Å; I959-S961 VanDerWaalsContact O-N 3.15Å
962	R	87.4	Confident	90.8	Very high	71 Å²	71	19.4 Å²	19.4	27%	0.268	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	144	-178	-163.5	-179.5	168.5	163.5	0.4	112.3	N923 D958 I959 L964	N923-R962 PolarHBondContact ND2-N 3.18Å; N923-R962 PolarHBondContact ND2-O 3.5Å; D958-R962 WeakPolarHBondContact O-CB 3.45Å; D958-R962 PolarHBondContact O-N 3.13Å; D958-R962 VanDerWaalsContact O-N 3.15Å; I959-R962 WeakPolarHBondContact O-CB 3.34Å; I959-R962 PolarHBondContact O-N 3.27Å; R962-L964 PolarHBondContact O-N 3.47Å
963	D	85.8	Confident	90.7	Very high	122 Å²	122	19.4 Å²	19.4	65%	0.652	9%	0.088	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	9.3	171.4	-60.2	-37.8	0	0	0	117
964	L	88.1	Confident	90.3	Very high	10 Å²	10	19.8 Å²	19.8	5%	0.052	9%	0.091	C	C	.	.			trans	-76.3	134.3	171.8	-68.8	164.3	0	0	0	111.4	L926 L927 I936 R962 V968	L926-L964 HydrophobicContact CB-CD1 4.14Å; L926-L964 HydrophobicContact CB-CD2 4.11Å; L926-L964 HydrophobicContact CD1-CD1 4.24Å; L927-L964 HydrophobicContact CD2-CD2 3.85Å; L927-L964 HydrophobicContact CD2-CG 4.33Å; L927-L964 HydrophobicContact CG-CD2 4.39Å; I936-L964 HydrophobicContact CD1-CD1 4.12Å; I936-L964 HydrophobicContact CD1-CD2 3.94Å; I936-L964 HydrophobicContact CD1-CG 4.47Å; R962-L964 PolarHBondContact O-N 3.47Å; L964-V968 HydrophobicContact CB-CG2 4.06Å; L964-V968 HydrophobicContact CD1-CG2 3.58Å; L964-V968 HydrophobicContact CG-CG2 4.47Å
965	R	84.3	Confident	89.7	Confident	155 Å²	155	20.7 Å²	20.7	59%	0.585	10%	0.095	S	C	*	.	S	Bend	trans	-78	-36.7	176.2	-68.6	-179.3	178.1	-178	-2.7	112.1
966	A	87.5	Confident	89.1	Confident	8 Å²	8	26.3 Å²	26.3	7%	0.066	12%	0.121	C	C	.	.	S	Bend	trans	-72.1	148.5	178.4	0	0	0	0	0	111	A933 I936 V968	A933-A966 HydrophobicContact CB-CB 4.27Å; A933-A966 VanDerWaalsContact O-CB 3.22Å; A933-A966 WeakPolarHBondContact O-CB 3.38Å; I936-A966 HydrophobicContact CD1-CB 3.98Å; I936-A966 HydrophobicContact CG1-CB 4.05Å; A966-V968 PolarHBondContact O-N 3.39Å
967	P	92.7	Very high	88.4	Confident	11 Å²	11	28.1 Å²	28.1	7%	0.071	13%	0.134	C	C	.	.			trans	-55.9	135.4	164.9	-23	34.2	0	0	0	110.9	L728 M730 F784 A934 L935 I936	L728-P967 HydrophobicContact CD1-CB 4.4Å; M730-P967 HydrophobicContact CE-CG 4.07Å; M730-P967 HydrophobicContact SD-CB 3.56Å; M730-P967 VanDerWaalsContact SD-CB 3.56Å; M730-P967 HydrophobicContact SD-CG 3.62Å; F784-P967 HydrophobicContact CE1-CB 4.48Å; F784-P967 HydrophobicContact CE1-CG 4.41Å; F784-P967 HydrophobicContact CZ-CB 4.02Å; F784-P967 HydrophobicContact CZ-CG 4.05Å; A934-P967 WeakPolarHBondContact O-CD 3.47Å; L935-P967 HydrophobicContact CD1-CB 3.96Å; I936-P967 PolarHBondContact N-O 2.95Å
968	V	94.3	Very high	87.8	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122	177.8	-174.9	0	0	0	0	108.9	R729 I936 I938 L964 A966 M970	R729-V968 PolarHBondContact N-O 3.18Å; R729-V968 PolarHBondContact O-N 3.43Å; I936-V968 HydrophobicContact CB-CG2 4.42Å; I936-V968 HydrophobicContact CD1-CG2 4.45Å; I936-V968 WeakPolarHBondContact O-CA 3.37Å; I938-V968 HydrophobicContact CG2-CG1 3.96Å; L964-V968 HydrophobicContact CB-CG2 4.06Å; L964-V968 HydrophobicContact CD1-CG2 3.58Å; L964-V968 HydrophobicContact CG-CG2 4.47Å; A966-V968 PolarHBondContact O-N 3.39Å; V968-M970 HydrophobicContact CG1-CG 4.29Å
969	L	95.6	Very high	87.2	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	105.5	173.5	-176.3	67.9	0	0	0	108.6	L617 C726 L728 L808 L935 I936 V937 I938 V971	L617-L969 HydrophobicContact CD2-CD1 4.29Å; C726-L969 HydrophobicContact CB-CD1 3.78Å; C726-L969 HydrophobicContact CB-CG 4.31Å; L728-L969 HydrophobicContact CB-CD1 4.32Å; L808-L969 HydrophobicContact CD1-CD2 4.32Å; L935-L969 HydrophobicContact CD1-CB 4.34Å; I936-L969 PolarHBondContact O-N 3.16Å; V937-L969 WeakPolarHBondContact CA-O 3.47Å; V937-L969 HydrophobicContact CG2-CB 4.38Å; V937-L969 HydrophobicContact CG2-CD2 4.41Å; I938-L969 PolarHBondContact N-O 2.76Å; L969-V971 HydrophobicContact CD2-CG2 3.93Å; L969-V971 HydrophobicContact CG-CG2 3.76Å
970	M	95.4	Very high	86.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.6	173.1	-66.1	173.2	-84.7	0	0	108.3	F697 C726 V727 I938 M940 L957 L960 V968	F697-M970 HydrophobicContact CD2-CE 3.94Å; C726-M970 CarbonylContact C-O 3.3Å; C726-M970 WeakPolarHBondContact CA-O 3.28Å; C726-M970 VanDerWaalsContact CB-O 3.28Å; C726-M970 WeakPolarHBondContact CB-O 3.5Å; V727-M970 HydrophobicContact CB-CB 4.38Å; V727-M970 HydrophobicContact CB-CE 4.11Å; V727-M970 HydrophobicContact CG1-CE 3.86Å; V727-M970 PolarHBondContact N-O 2.98Å; V727-M970 PolarHBondContact O-N 2.88Å; I938-M970 HydrophobicContact CG2-CG 3.84Å; I938-M970 CarbonylContact O-C 3.38Å; I938-M970 WeakPolarHBondContact O-CA 3.29Å; M940-M970 HydrophobicContact CB-CB 4.05Å; M940-M970 HydrophobicContact CG-CB 4.08Å; M940-M970 HydrophobicContact SD-CB 4.29Å; L957-M970 HydrophobicContact CB-SD 4.25Å; L957-M970 HydrophobicContact CD2-SD 3.84Å; L960-M970 HydrophobicContact CD2-SD 4.42Å; V968-M970 HydrophobicContact CG1-CG 4.29Å
971	V	94.3	Very high	85	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.8	-172.6	179.5	0	0	0	0	110.6	C726 L804 L808 V937 I938 T939 M940 L969	C726-V971 HydrophobicContact CB-CG2 4.13Å; L804-V971 HydrophobicContact CB-CG1 4.43Å; L804-V971 HydrophobicContact CD2-CG1 4.1Å; L804-V971 HydrophobicContact CG-CG1 4.05Å; L808-V971 HydrophobicContact CD1-CG1 4.24Å; L808-V971 HydrophobicContact CD1-CG2 4.09Å; V937-V971 HydrophobicContact CG1-CB 4.46Å; V937-V971 HydrophobicContact CG1-CG2 3.62Å; I938-V971 PolarHBondContact O-N 3.06Å; T939-V971 CarbonylContact C-O 3.6Å; T939-V971 VanDerWaalsContact CA-O 3.31Å; T939-V971 WeakPolarHBondContact CA-O 3.5Å; M940-V971 PolarHBondContact N-O 3.31Å; L969-V971 HydrophobicContact CD2-CG2 3.93Å; L969-V971 HydrophobicContact CG-CG2 3.76Å
972	R	91.9	Very high	83.2	Confident	1 Å²	1	36.3 Å²	36.3	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	119.3	166.4	-173.9	63.5	170.4	-165.7	-9.5	108.8	D25 F719 G724 V725 M940 V942	D25-R972 IonicContact OD1-CZ 3.21Å; D25-R972 IonicContact OD1-NH1 3.83Å; D25-R972 IonicContact OD1-NH2 3.69Å; D25-R972 PolarHBondContact OD1-NH2 3.11Å; F719-R972 HydrophobicContact CE1-CB 4.06Å; F719-R972 HydrophobicContact CE1-CG 3.81Å; F719-R972 HydrophobicContact CZ-CB 4.26Å; F719-R972 HydrophobicContact CZ-CG 4.06Å; G724-R972 CarbonylContact C-O 3.34Å; G724-R972 VanDerWaalsContact CA-O 3.28Å; G724-R972 WeakPolarHBondContact CA-O 3.48Å; V725-R972 PolarHBondContact N-O 3.17Å; V725-R972 PolarHBondContact O-N 2.63Å; M940-R972 HydrophobicContact CB-CB 4.18Å; M940-R972 HydrophobicContact CE-CB 4.11Å; V942-R972 HydrophobicContact CG2-CG 4.16Å
973	G	87.1	Confident	81	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.			trans	-74.6	170.1	171.3	0	0	0	0	0	112.8	D801 Q975	D801-G973 WeakPolarHBondContact O-CA 3.28Å; G973-Q975 PolarHBondContact O-N 3Å
974	N	82.9	Confident	78.3	Confident	9 Å²	9	42.5 Å²	42.5	5%	0.048	21%	0.209	C	C	.	.			trans	-80.1	10.9	179.3	67.9	-19.3	0	0	0	113.7	Q722 E976	Q722-N974 WeakPolarHBondContact O-CB 3.24Å; Q722-N974 PolarHBondContact O-ND2 3.47Å; N974-E976 PolarHBondContact ND2-OE2 3.44Å; N974-E976 PolarHBondContact O-N 3.42Å; N974-E976 WeakPolarHBondContact OD1-CB 3.44Å; N974-E976 PolarHBondContact OD1-N 2.77Å
975	Q	76.3	Confident	77.8	Confident	21 Å²	21	44.2 Å²	44.2	10%	0.098	22%	0.217	C	C	.	.	S	Bend	trans	63.2	13.7	-175.9	-56.9	-61.9	16.4	0	0	115.8	R46 L49 D800 D801 G973	R46-Q975 WeakPolarHBondContact CD-O 3.36Å; R46-Q975 VanDerWaalsContact NH1-C 3.32Å; R46-Q975 PolarHBondContact NH1-O 3.22Å; L49-Q975 HydrophobicContact CB-CG 4.35Å; D800-Q975 PolarHBondContact O-NE2 3.27Å; D800-Q975 PolarHBondContact O-OE1 3.15Å; D800-Q975 VanDerWaalsContact O-OE1 3.1Å; D801-Q975 VanDerWaalsContact CA-OE1 3.24Å; G973-Q975 PolarHBondContact O-N 3Å
976	E	79.6	Confident	77.5	Confident	117 Å²	117	38.3 Å²	38.3	55%	0.547	20%	0.198	S	C	.	.	S	Bend	trans	-89.9	153.2	163.2	-63.5	-178.6	152.5	0	0	110.7	G802 N974 V978	G802-E976 WeakPolarHBondContact CA-O 3.46Å; N974-E976 PolarHBondContact ND2-OE2 3.44Å; N974-E976 PolarHBondContact O-N 3.42Å; N974-E976 WeakPolarHBondContact OD1-CB 3.44Å; N974-E976 PolarHBondContact OD1-N 2.77Å; E976-V978 PolarHBondContact O-N 3.13Å
977	S	77.4	Confident	76.9	Confident	40 Å²	40	40 Å²	40	28%	0.28	21%	0.205	S	C	.	.			trans	-71.8	118.1	179.5	-68.9	0	0	0	0	110.8	V594	V594-S977 VanDerWaalsContact CG1-O 3.24Å; V594-S977 WeakPolarHBondContact CG1-O 3.36Å; V594-S977 WeakPolarHBondContact CG2-O 3.44Å
978	V	79.7	Confident	76	Confident	6 Å²	6	41.7 Å²	41.7	4%	0.036	21%	0.213	C	C	.	.	S	Bend	trans	-95.7	-22.5	174.6	172.7	0	0	0	0	111.2	Y597 G802 L807 E976	Y597-V978 HydrophobicContact CD1-CB 4.22Å; Y597-V978 HydrophobicContact CD1-CG1 3.41Å; Y597-V978 VanDerWaalsContact CD1-CG1 3.41Å; Y597-V978 HydrophobicContact CD1-CG2 4.17Å; Y597-V978 HydrophobicContact CD2-CG2 4.28Å; Y597-V978 HydrophobicContact CE1-CB 4.21Å; Y597-V978 HydrophobicContact CE1-CG1 3.47Å; Y597-V978 VanDerWaalsContact CE1-CG1 3.47Å; Y597-V978 HydrophobicContact CE1-CG2 3.78Å; Y597-V978 HydrophobicContact CE2-CG2 3.91Å; Y597-V978 HydrophobicContact CG-CG1 4.12Å; Y597-V978 HydrophobicContact CG-CG2 4.39Å; G802-V978 WeakPolarHBondContact O-CB 3.37Å; G802-V978 PolarHBondContact O-N 2.73Å; L807-V978 HydrophobicContact CB-CG1 4.16Å; L807-V978 HydrophobicContact CD2-CG1 3.29Å; L807-V978 HydrophobicContact CG-CG1 4.29Å; E976-V978 PolarHBondContact O-N 3.13Å
979	L	78.3	Confident	74.9	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.11	23%	0.226	C	C	.	.			trans	-121.6	141.4	176.2	-63.7	173.3	0	0	0	109.6	L806 L807 F848 L850	L806-L979 HydrophobicContact CB-CD1 4.13Å; L807-L979 HydrophobicContact CD1-CD2 4.2Å; F848-L979 HydrophobicContact CD1-CB 3.98Å; F848-L979 HydrophobicContact CD2-CD1 4.34Å; F848-L979 HydrophobicContact CE1-CB 3.86Å; F848-L979 HydrophobicContact CG-CD1 4.42Å; F848-L979 HydrophobicContact CZ-CB 4.29Å; L850-L979 HydrophobicContact CD1-CD1 4.09Å; L850-L979 HydrophobicContact CD2-CD2 4.38Å
980	T	73	Confident	73.5	Confident	38 Å²	38	47.1 Å²	47.1	23%	0.233	24%	0.24	C	C	.	.			trans	-143	154.5	173.3	-175.9	0	0	0	0	110.1	V594 K595 Y982	V594-T980 HydrophobicContact CB-CG2 3.93Å; V594-T980 HydrophobicContact CG1-CG2 3.71Å; K595-T980 HydrophobicContact CG-CG2 4.22Å; T980-Y982 PolarHBondContact OG1-N 3.1Å
981	F	64.1	Low	71.9	Confident	46 Å²	46	50.4 Å²	50.4	20%	0.202	26%	0.257	C	S	.	.			trans	-115.9	-2.1	175.1	57.2	-90.1	0	0	0	113.6	Y30 Y33 A34 K847 F848	Y30-F981 HydrophobicContact CD2-CZ 4.11Å; Y30-F981 HydrophobicContact CE2-CE1 4.12Å; Y30-F981 AromaticContact CE2-CE2 3.79Å; Y30-F981 HydrophobicContact CE2-CE2 3.79Å; Y30-F981 AromaticContact CE2-CZ 3.33Å; Y30-F981 HydrophobicContact CE2-CZ 3.33Å; Y30-F981 AromaticContact CZ-CE2 3.94Å; Y30-F981 AromaticContact CZ-CZ 3.66Å; Y33-F981 VanDerWaalsContact C-CE1 3.45Å; Y33-F981 WeakPolarHBondContact O-CE1 3.32Å; A34-F981 HydrophobicContact CB-CE2 4.47Å; A34-F981 HydrophobicContact CB-CZ 3.72Å; K847-F981 HydrophobicContact CB-CB 4.37Å; K847-F981 HydrophobicContact CB-CG 4.5Å; F848-F981 HydrophobicContact CD1-CD1 4.44Å; F848-F981 AromaticContact CE1-CD1 3.99Å; F848-F981 HydrophobicContact CE1-CD1 3.99Å
982	Y	51.3	Low	70.2	Confident	83 Å²	83	54.3 Å²	54.3	33%	0.325	28%	0.277	S	S	.	.			trans	-107.8	140.4	177.5	-74.9	-66.5	0	0	0	112.7	Y30 A34 T980	Y30-Y982 PolarHBondContact OH-OH 3.15Å; A34-Y982 HydrophobicContact CB-CE2 4.08Å; T980-Y982 PolarHBondContact OG1-N 3.1Å
983	C	41.8	Very low	68.4	Low	99 Å²	99	58.8 Å²	58.8	67%	0.669	30%	0.3	S	S	*	.			trans	-102.3	88.6	165.4	-60.8	0	0	0	0	107.8	K595	K595-C983 PolarHBondContact NZ-SG 3.05Å
984	Q	29.7	Very low	66.7	Low	225 Å²	225	64.1 Å²	64.1	100%	1.051	33%	0.327	S	S	*	.			trans	-133	0	155.3	-84.9	-174	-28.5	0	0	107.5

Retrieved 984 of 984 residues in 2842.7 ms (Link to these results)

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