A0A096N7S2_PAPAN Loading...

Ubiquitin conjugation factor E4

Ubiquitin-protein ligase that probably functions as an E3 ligase in conjunction with specific E1 and E2 ligases. Also functions as an E4 ligase mediating the assembly of polyubiquitin chains on substrates ubiquitinated by another E3 ubiquitin ligase. Mediates 'Lys-48'-linked polyubiquitination of substrates. Ubiquitin-protein ligase that probably functions as an E3 ligase in conjunction with specific E1 and E2 ligases. May also function as an E4 ligase mediating the assembly of polyubiquitin chains on substrates ubiquitinated by another E3 ubiquitin ligase. Mediates 'Lys-48'-linked polyubiquitination of substrates.

AlphaFold DB (A0A2K5XPJ9), UniProt , Accession A0A096N7S2, Species PAPAN (Papio anubis, Olive baboon), Gene UBE4A, Length 1,073 aa.

						>A0A096N7S2_PAPAN|A0A096N7S2|UBE4A
MTDQENNNNISSNPFAALFGSLADAKQFAAIQKEQLKQQSDELPASPDDSDNSVSESLDEFDYSVAEISRSFRSQQEICEQLNINHMIQRIFLITLDNSDPSLKSGNGIPSRCVYLEEMAVELEDQDWLDMSNVEQALFARLLLQDPGNHLINMTSSTTLNLSADRDAGERHIFCYLYSCFQRAKEEITKVPENLLPFAVQCRNLTVSNTRTVLLTPEIYVDQNIHEQLVDLMLEAIQGAREYMSKIYFEDVTEFLEEVIEALILDEEVRTFPEVMIPVFDVLLGRIKDLELCQILLYAYLDILLYFTRQKDMAKVFVEYIQPKDPTNGQMYQKTLLGVILNISCLLKTPGVVENHGYFLNPSRSSPQEIKVQEANIHQFMAQFHEKIYQMLKNLLQLSPETKHCILSWLGNCLHANAGRTKIWANQMPEIFFQMYASDAFFLNLGAALLKLCQPFCKPRSSRLLTFNPTYCALKELNDEERKIKNVHMRGLDKETCLIPAVQEPKFPQNYNLVTENLALTEYTLYLGFHRLHDQMVKINQNLHRLQVAWRDAQQSSSPAADNLREQFERLMTIYLSTKTAMTEPQMLQNCLNLQVSMAVLLVQLAIGNEGSQPIELTFPLPDGYSSLAYVPEFFADNLGDFLIFLRRFADDILETSADSLEHVLHFITIFTGSIERMKNPHLRAKLAEVLEAVMPHLDQTPNPLVSSVFHRKRVFCNFQYAPQLAEALIKVFVDIEFTGDPHQFEQKFNYRRPMYPILRYMWGTDTYRESIKDLADYASKNLEAMNPPLFLRFLNLLMNDAIFLLDEAIQYLSKIKIQQIEKDRGEWDSLTPEARREKEAGLQMFGQLARFHNIMSNETIGTLAFLTSEIKSLFVHPFLAERIISMLNYFLQHLVGPKMGALKVKDFSEFDFKPQQLVSDICTIYLNLGDEENFCATVPKDGRSYSPTLFAQTVRVLKKINKPGNMIVAFSNLAERIKSLADLQQQEEETYADACDEFLDPIMSTLMCDPVVLPSSRVTVDRSTIARHLLSDQTDPFNRSPLTMDQIRPNTELKEKIQRWLAERKQQKEQLE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.3	Very low	39.2	Very low	233 Å²	233	145.5 Å²	145.5	100%	1.148	77%	0.765	S	S	*	*				0	93.3	0	-70.9	-169.7	-132.7	0	0	106
2	T	30.4	Very low	40.7	Very low	120 Å²	120	141 Å²	141	74%	0.736	76%	0.755	S	S	*	*				73.1	99.9	113.2	52.5	0	0	0	0	111.4
3	D	27	Very low	42.1	Very low	158 Å²	158	136.4 Å²	136.4	85%	0.845	73%	0.73	S	S	*	*				176.3	103.2	109.5	-81.6	-16.6	0	0	0	110.2
4	Q	28	Very low	43.1	Very low	193 Å²	193	134.4 Å²	134.4	90%	0.902	73%	0.728	S	S	*	*			trans	-75.9	120.9	145.9	-81.2	179.1	-25	0	0	106.3
5	E	32.2	Very low	43.8	Very low	183 Å²	183	134.6 Å²	134.6	86%	0.855	72%	0.72	S	S	*	*			trans	162.7	96.8	136.5	-90.6	180	-177.5	0	0	110.2
6	N	33	Very low	44.7	Very low	150 Å²	150	127.9 Å²	127.9	80%	0.802	69%	0.689	S	S	*	*			trans	-161.3	97.4	134.6	-108.2	-35.3	0	0	0	112.4
7	N	36.2	Very low	45.6	Very low	134 Å²	134	125.9 Å²	125.9	72%	0.717	69%	0.694	S	S	*	*				65.2	89.2	129.6	-73.5	-36.9	0	0	0	121.3	N9	N7-N9 PolarHBondContact O-N 3.14Å
8	N	53.9	Low	46.4	Very low	169 Å²	169	126.5 Å²	126.5	90%	0.904	70%	0.695	S	S	*	*				-0.6	95.5	121.2	-74.3	-32.1	0	0	0	117
9	N	49.2	Very low	47.4	Very low	105 Å²	105	124.5 Å²	124.5	56%	0.561	68%	0.679	S	S	*	*			trans	-132.8	104.9	157.2	-146.7	-2.7	0	0	0	109.9	N7 S11 S12	N7-N9 PolarHBondContact O-N 3.14Å; N9-S11 PolarHBondContact O-N 2.97Å; N9-S11 PolarHBondContact OD1-OG 3.12Å; N9-S11 VanDerWaalsContact OD1-OG 3.14Å; N9-S12 PolarHBondContact O-N 3.25Å; N9-S12 VanDerWaalsContact O-N 3.12Å; N9-S12 PolarHBondContact O-OG 3.33Å
10	I	59.1	Low	48.3	Very low	76 Å²	76	122.6 Å²	122.6	39%	0.39	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-64	-19.4	-179.9	-81.9	170.1	0	0	0	111.7	S12 N13 L22	I10-S12 PolarHBondContact O-N 2.69Å; I10-N13 PolarHBondContact O-N 3.19Å; I10-L22 HydrophobicContact CG2-CD2 3.92Å
11	S	55.5	Low	49.5	Very low	79 Å²	79	119 Å²	119	55%	0.552	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-73.8	-7.3	175	59.8	0	0	0	0	114.4	N9	N9-S11 PolarHBondContact O-N 2.97Å; N9-S11 PolarHBondContact OD1-OG 3.12Å; N9-S11 VanDerWaalsContact OD1-OG 3.14Å
12	S	57	Low	51.3	Low	92 Å²	92	112 Å²	112	64%	0.643	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-114.8	11.2	176.5	55	0	0	0	0	113.7	N9 I10	N9-S12 PolarHBondContact O-N 3.25Å; N9-S12 VanDerWaalsContact O-N 3.12Å; N9-S12 PolarHBondContact O-OG 3.33Å; I10-S12 PolarHBondContact O-N 2.69Å
13	N	59.7	Low	53.1	Low	81 Å²	81	109.3 Å²	109.3	43%	0.433	63%	0.629	S	S	.	*			trans	-83.8	120.1	174.5	-173	-25.3	0	0	0	110.1	I10 F15 A16	I10-N13 PolarHBondContact O-N 3.19Å; N13-F15 PolarHBondContact O-N 3.29Å; N13-F15 VanDerWaalsContact O-N 3.13Å; N13-F15 WeakPolarHBondContact OD1-CB 3.46Å; N13-F15 WeakPolarHBondContact OD1-CD2 3.45Å; N13-F15 PolarHBondContact OD1-N 3.37Å; N13-A16 WeakPolarHBondContact O-CB 3.32Å; N13-A16 PolarHBondContact O-N 3.24Å
14	P	55.3	Low	55.1	Low	109 Å²	109	105.2 Å²	105.2	71%	0.708	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-61.9	-19.8	-179	23.7	-32.4	0	0	0	113.9	A16	P14-A16 VanDerWaalsContact C-N 3.33Å
15	F	53.6	Low	57	Low	137 Å²	137	96.8 Å²	96.8	60%	0.601	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-81.9	-6.3	176.7	-64.1	-77.1	0	0	0	114.1	N13 A17 L18	N13-F15 PolarHBondContact O-N 3.29Å; N13-F15 VanDerWaalsContact O-N 3.13Å; N13-F15 WeakPolarHBondContact OD1-CB 3.46Å; N13-F15 WeakPolarHBondContact OD1-CD2 3.45Å; N13-F15 PolarHBondContact OD1-N 3.37Å; F15-A17 PolarHBondContact O-N 3.38Å; F15-L18 HydrophobicContact CB-CD1 4.44Å; F15-L18 HydrophobicContact CD1-CD1 3.78Å; F15-L18 WeakPolarHBondContact O-CB 3.39Å; F15-L18 PolarHBondContact O-N 3.21Å; F15-L18 VanDerWaalsContact O-N 3.12Å
16	A	59.2	Low	58.7	Low	27 Å²	27	94.1 Å²	94.1	22%	0.223	56%	0.556	C	S	.	*	G	3₁₀ helix	trans	-63.3	-22.4	175.1	0	0	0	0	0	112.7	N13 P14 L18 F19	N13-A16 WeakPolarHBondContact O-CB 3.32Å; N13-A16 PolarHBondContact O-N 3.24Å; P14-A16 VanDerWaalsContact C-N 3.33Å; A16-L18 PolarHBondContact O-N 3.06Å; A16-F19 PolarHBondContact O-N 3.5Å
17	A	59.9	Low	60.3	Low	94 Å²	94	93 Å²	93	78%	0.777	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-70.9	-13.5	175.9	0	0	0	0	0	114	F15 F19	F15-A17 PolarHBondContact O-N 3.38Å; A17-F19 PolarHBondContact O-N 3.13Å
18	L	59.6	Low	61.8	Low	137 Å²	137	92.6 Å²	92.6	72%	0.717	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-79	-7.7	175	-67.1	172.5	0	0	0	113	F15 A16	F15-L18 HydrophobicContact CB-CD1 4.44Å; F15-L18 HydrophobicContact CD1-CD1 3.78Å; F15-L18 WeakPolarHBondContact O-CB 3.39Å; F15-L18 PolarHBondContact O-N 3.21Å; F15-L18 VanDerWaalsContact O-N 3.12Å; A16-L18 PolarHBondContact O-N 3.06Å
19	F	65.1	Low	62.3	Low	88 Å²	88	86.8 Å²	86.8	39%	0.386	51%	0.514	S	S	.	.	S	Bend	trans	-111.2	142.9	-179.9	-61.1	-86.9	0	0	0	110.5	A16 A17 S21 A25	A16-F19 PolarHBondContact O-N 3.5Å; A17-F19 PolarHBondContact O-N 3.13Å; F19-S21 PolarHBondContact O-N 2.97Å; F19-S21 VanDerWaalsContact O-N 3.15Å; F19-A25 HydrophobicContact CB-CB 4.37Å; F19-A25 HydrophobicContact CD2-CB 4.14Å; F19-A25 HydrophobicContact CG-CB 4.21Å
20	G	66.3	Low	62.7	Low	86 Å²	86	84.2 Å²	84.2	89%	0.887	51%	0.507	S	S	*	.	S	Bend	trans	-61.9	-22	-177.5	0	0	0	0	0	114.3
21	S	72.2	Confident	62.6	Low	47 Å²	47	85.6 Å²	85.6	33%	0.329	51%	0.514	S	S	.	.			trans	-155.6	161.5	171.1	76.7	0	0	0	0	112.8	F19 A23 D24 A25	F19-S21 PolarHBondContact O-N 2.97Å; F19-S21 VanDerWaalsContact O-N 3.15Å; S21-A23 PolarHBondContact O-N 3.26Å; S21-A23 PolarHBondContact OG-N 3.16Å; S21-D24 WeakPolarHBondContact CB-OD2 3.46Å; S21-D24 PolarHBondContact N-OD2 3.37Å; S21-D24 VanDerWaalsContact N-OD2 3.09Å; S21-D24 PolarHBondContact O-N 3.47Å; S21-D24 VanDerWaalsContact O-N 3.16Å; S21-D24 PolarHBondContact OG-N 3.02Å; S21-D24 PolarHBondContact OG-OD2 3.23Å; S21-A25 PolarHBondContact O-N 3.09Å
22	L	65.8	Low	62.5	Low	88 Å²	88	88.2 Å²	88.2	46%	0.461	52%	0.518	S	S	.	.	H	α-helix	trans	-66.9	-15.9	174.4	-124.1	142.5	0	0	0	112.9	I10 K26	I10-L22 HydrophobicContact CG2-CD2 3.92Å; L22-K26 WeakPolarHBondContact O-CG 3.4Å
23	A	67.7	Low	61.9	Low	62 Å²	62	91.9 Å²	91.9	51%	0.512	52%	0.522	S	S	.	.	H	α-helix	trans	-76.1	-39.7	172.9	0	0	0	0	0	111	S21 A25 K26 Q27	S21-A23 PolarHBondContact O-N 3.26Å; S21-A23 PolarHBondContact OG-N 3.16Å; A23-A25 PolarHBondContact O-N 3.25Å; A23-K26 PolarHBondContact O-N 2.98Å; A23-Q27 PolarHBondContact O-N 3.39Å
24	D	69.8	Low	61	Low	72 Å²	72	95.9 Å²	95.9	39%	0.385	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-40	179.5	-56.3	-42	0	0	0	111.5	S21 K26 Q27 F28	S21-D24 WeakPolarHBondContact CB-OD2 3.46Å; S21-D24 PolarHBondContact N-OD2 3.37Å; S21-D24 VanDerWaalsContact N-OD2 3.09Å; S21-D24 PolarHBondContact O-N 3.47Å; S21-D24 VanDerWaalsContact O-N 3.16Å; S21-D24 PolarHBondContact OG-N 3.02Å; S21-D24 PolarHBondContact OG-OD2 3.23Å; D24-K26 VanDerWaalsContact C-N 3.28Å; D24-K26 PolarHBondContact O-N 3.1Å; D24-Q27 PolarHBondContact O-N 3.11Å; D24-F28 PolarHBondContact O-N 3.15Å
25	A	67	Low	60.3	Low	17 Å²	17	99 Å²	99	14%	0.14	54%	0.543	C	S	.	.	H	α-helix	trans	-63	-33.2	174.4	0	0	0	0	0	112.8	F19 S21 A23 A29	F19-A25 HydrophobicContact CB-CB 4.37Å; F19-A25 HydrophobicContact CD2-CB 4.14Å; F19-A25 HydrophobicContact CG-CB 4.21Å; S21-A25 PolarHBondContact O-N 3.09Å; A23-A25 PolarHBondContact O-N 3.25Å; A25-A29 PolarHBondContact O-N 3.17Å
26	K	67.1	Low	59.6	Low	127 Å²	127	99.6 Å²	99.6	55%	0.552	55%	0.552	S	S	*	*	H	α-helix	trans	-76.6	-34.3	175.8	-76.2	-179.9	178.5	-179.3	0	112.4	L22 A23 D24 A29 A30	L22-K26 WeakPolarHBondContact O-CG 3.4Å; A23-K26 PolarHBondContact O-N 2.98Å; D24-K26 VanDerWaalsContact C-N 3.28Å; D24-K26 PolarHBondContact O-N 3.1Å; K26-A29 PolarHBondContact O-N 3.5Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 3.46Å; K26-A30 VanDerWaalsContact O-N 3.1Å
27	Q	67.5	Low	58.4	Low	125 Å²	125	107.1 Å²	107.1	58%	0.584	58%	0.58	S	S	*	*	H	α-helix	trans	-71.9	-37.1	179.5	-157.5	170.7	1.2	0	0	111.5	A23 D24 A30 I31	A23-Q27 PolarHBondContact O-N 3.39Å; D24-Q27 PolarHBondContact O-N 3.11Å; Q27-A30 PolarHBondContact O-N 3.47Å; Q27-I31 WeakPolarHBondContact O-CG1 3.44Å; Q27-I31 PolarHBondContact O-N 3.4Å
28	F	67.9	Low	57.1	Low	127 Å²	127	110.9 Å²	110.9	56%	0.557	58%	0.581	S	S	*	*	H	α-helix	trans	-62.8	-41	172.6	-170.1	-97.4	0	0	0	112.5	D24 A30	D24-F28 PolarHBondContact O-N 3.15Å; F28-A30 VanDerWaalsContact C-N 3.33Å; F28-A30 PolarHBondContact O-N 3.49Å
29	A	63.5	Low	55.7	Low	47 Å²	47	112.9 Å²	112.9	39%	0.388	59%	0.587	S	S	.	*	H	α-helix	trans	-71.2	-24.5	176.1	0	0	0	0	0	113.8	A25 K26	A25-A29 PolarHBondContact O-N 3.17Å; K26-A29 PolarHBondContact O-N 3.5Å
30	A	57.8	Low	53.9	Low	51 Å²	51	113.5 Å²	113.5	42%	0.421	60%	0.602	S	S	.	*	H	α-helix	trans	-77.3	-36.7	177.9	0	0	0	0	0	112.4	K26 Q27 F28 Q32 K33 E34	K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 3.46Å; K26-A30 VanDerWaalsContact O-N 3.1Å; Q27-A30 PolarHBondContact O-N 3.47Å; F28-A30 VanDerWaalsContact C-N 3.33Å; F28-A30 PolarHBondContact O-N 3.49Å; A30-Q32 PolarHBondContact O-N 3.33Å; A30-K33 PolarHBondContact O-N 3.44Å; A30-K33 VanDerWaalsContact O-N 3.11Å; A30-E34 PolarHBondContact O-N 3.35Å
31	I	57.8	Low	52	Low	105 Å²	105	116.4 Å²	116.4	54%	0.538	60%	0.597	S	S	.	*	H	α-helix	trans	-66.9	-34.9	179.7	-67.1	166	0	0	0	111.8	Q27 K33	Q27-I31 WeakPolarHBondContact O-CG1 3.44Å; Q27-I31 PolarHBondContact O-N 3.4Å; I31-K33 VanDerWaalsContact C-N 3.27Å; I31-K33 PolarHBondContact O-N 3.12Å
32	Q	52.7	Low	50	Low	134 Å²	134	123.5 Å²	123.5	63%	0.626	63%	0.625	S	S	*	*	H	α-helix	trans	-71.7	-18.8	174	-84.9	-168.5	-13.5	0	0	113.9	A30	A30-Q32 PolarHBondContact O-N 3.33Å
33	K	43.8	Very low	48.1	Very low	168 Å²	168	127.3 Å²	127.3	73%	0.73	65%	0.645	S	S	*	*	H	α-helix	trans	-88.7	-18.7	179.6	-115.7	177.8	179.9	176.4	0	113.6	A30 I31	A30-K33 PolarHBondContact O-N 3.44Å; A30-K33 VanDerWaalsContact O-N 3.11Å; I31-K33 VanDerWaalsContact C-N 3.27Å; I31-K33 PolarHBondContact O-N 3.12Å
34	E	41.6	Very low	46.8	Very low	166 Å²	166	130.1 Å²	130.1	78%	0.776	66%	0.658	S	S	*	*	H	α-helix	trans	-85.7	-20.4	178.6	-82.2	-178	157.5	0	0	114.1	A30 L36	A30-E34 PolarHBondContact O-N 3.35Å; E34-L36 VanDerWaalsContact C-N 3.29Å; E34-L36 PolarHBondContact O-N 3.4Å
35	Q	40.8	Very low	44.6	Very low	173 Å²	173	131.3 Å²	131.3	81%	0.808	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-7.8	175.9	-80.2	-175.8	-21.6	0	0	114.7
36	L	37.7	Very low	42.7	Very low	150 Å²	150	135.7 Å²	135.7	79%	0.785	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	11.2	-172	-90.5	158.5	0	0	0	114.9	E34	E34-L36 VanDerWaalsContact C-N 3.29Å; E34-L36 PolarHBondContact O-N 3.4Å
37	K	35.1	Very low	41.3	Very low	186 Å²	186	134.9 Å²	134.9	81%	0.809	72%	0.715	S	S	*	*			trans	-138.3	18.5	-169.9	-104.6	-176.1	-178.7	-174.3	0	119.7
38	Q	33.3	Very low	39.3	Very low	173 Å²	173	135.5 Å²	135.5	81%	0.808	72%	0.723	S	S	*	*	S	Bend	trans	-138	123.6	163.2	-69	177.7	-6.3	0	0	107.9
39	Q	29.9	Very low	37.4	Very low	179 Å²	179	136.3 Å²	136.3	84%	0.836	73%	0.733	S	S	*	*			cis	-168.3	137	7.2	-122.7	165	-12.1	0	0	106.8
40	S	26.4	Very low	35.9	Very low	100 Å²	100	138.2 Å²	138.2	70%	0.699	74%	0.743	S	S	*	*			trans	-83.1	153.1	161.7	50.5	0	0	0	0	110.6
41	D	27.8	Very low	34.4	Very low	148 Å²	148	142.2 Å²	142.2	79%	0.791	76%	0.758	S	S	*	*			trans	97.9	119.9	155.4	-60.7	-26.2	0	0	0	122
42	E	28.6	Very low	33	Very low	196 Å²	196	144.3 Å²	144.3	92%	0.916	77%	0.77	S	S	*	*			trans	92.4	121.6	145	-72.6	-176.3	167.3	0	0	123.3
43	L	26.4	Very low	31.8	Very low	167 Å²	167	142.7 Å²	142.7	87%	0.874	77%	0.773	S	S	*	*			trans	-59	174.6	169.7	-75.4	154.2	0	0	0	113.4
44	P	39.4	Very low	31.1	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	77%	0.774	S	S	*	*			cis	-150.2	-179.3	30.2	41.3	-18.6	0	0	0	119.3
45	A	24.7	Very low	30.3	Very low	98 Å²	98	137 Å²	137	81%	0.81	77%	0.768	S	S	*	*			trans	96.7	112.9	148.2	0	0	0	0	0	119.2
46	S	26.8	Very low	29.8	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	77%	0.771	S	S	*	*			trans	-75	176	173.7	58.7	0	0	0	0	112.3
47	P	37.3	Very low	29.1	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	77%	0.768	S	S	*	*				-140.8	166.6	75.6	33.1	-13.3	0	0	0	115.8
48	D	26	Very low	29.4	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	77%	0.772	S	S	*	*			trans	83.1	85.3	164.6	-63.3	-10.1	0	0	0	115.8
49	D	29.1	Very low	29.1	Very low	143 Å²	143	133 Å²	133	77%	0.765	77%	0.768	S	S	*	*				63.1	124.6	69.1	-72.8	-15.9	0	0	0	111.8
50	S	30.4	Very low	29.8	Very low	88 Å²	88	132.6 Å²	132.6	62%	0.615	77%	0.766	S	S	*	*			cis	-174.2	145.8	12.1	43.8	0	0	0	0	110.4
51	D	27.4	Very low	29.9	Very low	135 Å²	135	137.5 Å²	137.5	72%	0.722	78%	0.775	S	S	*	*			trans	66.9	129.3	138.7	-60	-10.2	0	0	0	119.3
52	N	28.8	Very low	30.5	Very low	148 Å²	148	134.2 Å²	134.2	79%	0.791	76%	0.758	S	S	*	*			cis	-147.2	130.6	30.2	-96.6	-42.2	0	0	0	112.2
53	S	27.3	Very low	31.1	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	75%	0.747	S	S	*	*			trans	-70.4	165	148.2	51.2	0	0	0	0	112.3
54	V	27.6	Very low	32.2	Very low	124 Å²	124	126.8 Å²	126.8	75%	0.752	72%	0.715	S	S	*	*			trans	166.8	102	140.3	162.4	0	0	0	0	104.8
55	S	25.1	Very low	32.6	Very low	92 Å²	92	123.9 Å²	123.9	64%	0.643	70%	0.696	S	S	*	*				66.7	124	72.1	74.4	0	0	0	0	115
56	E	29.8	Very low	33.5	Very low	189 Å²	189	121.2 Å²	121.2	88%	0.883	67%	0.674	S	S	*	*			trans	57.9	117.6	147.6	-68.9	-176.3	157.2	0	0	120.6
57	S	24.8	Very low	34.5	Very low	103 Å²	103	119 Å²	119	72%	0.72	65%	0.651	S	S	*	*			trans	-175.9	109.7	132.2	53	0	0	0	0	105.6	D59	S57-D59 VanDerWaalsContact C-N 3.31Å
58	L	41.3	Very low	35.1	Very low	170 Å²	170	114 Å²	114	89%	0.89	62%	0.618	S	S	*	*				14	82.1	79.4	-78.7	173.1	0	0	0	110.8
59	D	27.1	Very low	36.1	Very low	134 Å²	134	111.1 Å²	111.1	72%	0.717	61%	0.609	S	S	*	*			trans	-167.5	130.4	137.3	-87.9	-26.4	0	0	0	110.4	S57	S57-D59 VanDerWaalsContact C-N 3.31Å
60	E	42.9	Very low	37.1	Very low	172 Å²	172	113.9 Å²	113.9	80%	0.804	61%	0.609	S	S	*	*			trans	25.1	108.3	147.4	-64.1	-179.6	157.5	0	0	118.6
61	F	30	Very low	38	Very low	202 Å²	202	113.8 Å²	113.8	89%	0.886	61%	0.608	S	S	*	*			trans	-139.4	77.6	144.5	-80.2	-74.9	0	0	0	109.9
62	D	39.9	Very low	39.2	Very low	80 Å²	80	110.1 Å²	110.1	43%	0.428	59%	0.586	S	S	.	*			trans	-55.6	133.2	143.7	-138	-1.8	0	0	0	106.5	A66	D62-A66 WeakPolarHBondContact OD1-CB 3.42Å
63	Y	40.4	Very low	40.3	Very low	176 Å²	176	114.6 Å²	114.6	69%	0.69	59%	0.592	S	S	*	*	S	Bend		-164.9	102.5	60.3	-79.7	-88.2	0	0	0	110
64	S	49.7	Very low	41.9	Very low	30 Å²	30	112.1 Å²	112.1	21%	0.21	57%	0.574	C	S	.	*	S	Bend	trans	-174.4	20.1	144.9	69.3	0	0	0	0	113.6
65	V	47.9	Very low	43.5	Very low	61 Å²	61	114.7 Å²	114.7	37%	0.37	58%	0.578	S	S	.	*	S	Bend	trans	-137.1	8.5	-179.7	179.9	0	0	0	0	110.9	E67 I68	V65-E67 VanDerWaalsContact C-N 3.26Å; V65-E67 PolarHBondContact O-N 3.45Å; V65-E67 VanDerWaalsContact O-N 3.14Å; V65-I68 HydrophobicContact CG1-CB 4.17Å; V65-I68 HydrophobicContact CG1-CD1 4.17Å; V65-I68 HydrophobicContact CG1-CG1 4.43Å; V65-I68 PolarHBondContact O-N 3.23Å
66	A	43.5	Very low	45.4	Very low	42 Å²	42	118 Å²	118	35%	0.347	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.2	-27	-167	0	0	0	0	0	113.9	D62	D62-A66 WeakPolarHBondContact OD1-CB 3.42Å
67	E	47.6	Very low	47.3	Very low	61 Å²	61	112.7 Å²	112.7	29%	0.285	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98	-19.3	-177.9	-90.5	166	172.8	0	0	115.4	V65 S69 R70 D125	V65-E67 VanDerWaalsContact C-N 3.26Å; V65-E67 PolarHBondContact O-N 3.45Å; V65-E67 VanDerWaalsContact O-N 3.14Å; E67-S69 PolarHBondContact O-N 2.83Å; E67-S69 VanDerWaalsContact O-N 3.1Å; E67-R70 PolarHBondContact O-N 3.08Å; E67-R70 IonicContact OE1-NH1 3.69Å; E67-D125 WeakPolarHBondContact OE2-CA 3.45Å; E67-D125 WeakPolarHBondContact OE2-CB 3.21Å
68	I	50.9	Low	49.6	Very low	6 Å²	6	109.7 Å²	109.7	3%	0.031	53%	0.534	C	S	.	.	H	α-helix	trans	-59.4	-23.5	165.2	-54.8	-176.2	0	0	0	110.1	V65 F72 I78 W128	V65-I68 HydrophobicContact CG1-CB 4.17Å; V65-I68 HydrophobicContact CG1-CD1 4.17Å; V65-I68 HydrophobicContact CG1-CG1 4.43Å; V65-I68 PolarHBondContact O-N 3.23Å; I68-F72 HydrophobicContact CG2-CD2 4.06Å; I68-F72 HydrophobicContact CG2-CE2 4.23Å; I68-F72 WeakPolarHBondContact O-CD2 3.21Å; I68-I78 HydrophobicContact CG2-CB 4.25Å; I68-I78 HydrophobicContact CG2-CG1 4.02Å; I68-I78 HydrophobicContact CG2-CG2 3.8Å; I68-W128 HydrophobicContact CD1-CB 4.49Å; I68-W128 HydrophobicContact CD1-CD2 3.99Å; I68-W128 HydrophobicContact CD1-CE3 3.82Å; I68-W128 HydrophobicContact CD1-CG 4.29Å; I68-W128 HydrophobicContact CD1-CZ3 4.45Å; I68-W128 HydrophobicContact CG1-CD2 3.86Å; I68-W128 HydrophobicContact CG1-CE3 3.38Å; I68-W128 HydrophobicContact CG1-CH2 4.09Å; I68-W128 HydrophobicContact CG1-CZ2 4.49Å; I68-W128 HydrophobicContact CG1-CZ3 3.52Å
69	S	47.2	Very low	51.2	Low	77 Å²	77	105 Å²	105	54%	0.538	51%	0.514	S	S	.	.	H	α-helix	trans	-79.1	-24.9	178.1	-49.2	0	0	0	0	114	E67	E67-S69 PolarHBondContact O-N 2.83Å; E67-S69 VanDerWaalsContact O-N 3.1Å
70	R	49	Very low	53.7	Low	202 Å²	202	102.1 Å²	102.1	76%	0.762	50%	0.497	S	S	*	.	H	α-helix	trans	-88.5	-19.1	-174.6	-74.3	-176.4	-174.2	157.6	4.4	113.6	E67	E67-R70 PolarHBondContact O-N 3.08Å; E67-R70 IonicContact OE1-NH1 3.69Å
71	S	50.3	Low	55.7	Low	86 Å²	86	95.9 Å²	95.9	60%	0.601	47%	0.467	S	S	*	.	H	α-helix	trans	-104.1	-16	-170.7	-52.7	0	0	0	0	114.6
72	F	52.1	Low	58.2	Low	57 Å²	57	88.5 Å²	88.5	25%	0.25	44%	0.437	C	S	.	.			trans	-116.8	146.4	-169.5	-66.5	-85.8	0	0	0	113.1	I68 E77 I78 Q81 W128	I68-F72 HydrophobicContact CG2-CD2 4.06Å; I68-F72 HydrophobicContact CG2-CE2 4.23Å; I68-F72 WeakPolarHBondContact O-CD2 3.21Å; F72-E77 HydrophobicContact CB-CB 4.36Å; F72-E77 HydrophobicContact CD1-CB 4.08Å; F72-I78 HydrophobicContact CB-CG1 4.13Å; F72-Q81 HydrophobicContact CE1-CG 3.89Å; F72-Q81 HydrophobicContact CZ-CG 3.88Å; F72-W128 AromaticContact CE2-CZ2 3.97Å; F72-W128 HydrophobicContact CE2-CZ2 3.97Å; F72-W128 HydrophobicContact CZ-CZ2 4.41Å
73	R	51.4	Low	60.5	Low	243 Å²	243	87.9 Å²	87.9	92%	0.917	43%	0.434	S	S	*	.	S	Bend	trans	-95.3	-8.4	-169.4	-70.4	-177.7	179	178	1.6	113.4	E77	R73-E77 PolarHBondContact N-OE2 3Å
74	S	61.4	Low	62.8	Low	48 Å²	48	79.9 Å²	79.9	34%	0.336	40%	0.403	S	S	.	.	S	Bend	trans	-150.3	154.3	175.9	75.5	0	0	0	0	115.1	Q76 E77 I78	S74-Q76 PolarHBondContact O-N 3.37Å; S74-E77 PolarHBondContact N-OE2 3.06Å; S74-E77 PolarHBondContact O-N 3.2Å; S74-E77 WeakPolarHBondContact OG-CG 3.36Å; S74-E77 PolarHBondContact OG-N 3.48Å; S74-I78 PolarHBondContact O-N 3.17Å
75	Q	61.3	Low	64.7	Low	178 Å²	178	79 Å²	79	83%	0.832	40%	0.396	S	S	*	.	H	α-helix	trans	-62.9	-21.4	177.8	-163.6	174.4	7.8	0	0	113.5	C79	Q75-C79 PolarHBondContact O-N 3.06Å
76	Q	65.8	Low	66.7	Low	161 Å²	161	77 Å²	77	75%	0.752	38%	0.382	S	S	*	.	H	α-helix	trans	-76.3	-38.6	177.3	-168.1	170.7	-5.2	0	0	111.8	S74 I78 C79 E80	S74-Q76 PolarHBondContact O-N 3.37Å; Q76-I78 VanDerWaalsContact C-N 3.31Å; Q76-I78 PolarHBondContact O-N 3.47Å; Q76-C79 PolarHBondContact O-N 3.46Å; Q76-E80 PolarHBondContact O-N 3.21Å
77	E	69.7	Low	69	Low	78 Å²	78	75 Å²	75	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-38	174.3	-72	167.4	178.3	0	0	111.5	F72 R73 S74 E80 Q81	F72-E77 HydrophobicContact CB-CB 4.36Å; F72-E77 HydrophobicContact CD1-CB 4.08Å; R73-E77 PolarHBondContact N-OE2 3Å; S74-E77 PolarHBondContact N-OE2 3.06Å; S74-E77 PolarHBondContact O-N 3.2Å; S74-E77 WeakPolarHBondContact OG-CG 3.36Å; S74-E77 PolarHBondContact OG-N 3.48Å; E77-E80 PolarHBondContact O-N 3.25Å; E77-Q81 PolarHBondContact O-N 3.37Å
78	I	71.3	Confident	71.2	Confident	39 Å²	39	72.1 Å²	72.1	20%	0.2	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-45.7	177.3	-63.1	179.5	0	0	0	111.1	I68 F72 S74 Q76 Q81 L82	I68-I78 HydrophobicContact CG2-CB 4.25Å; I68-I78 HydrophobicContact CG2-CG1 4.02Å; I68-I78 HydrophobicContact CG2-CG2 3.8Å; F72-I78 HydrophobicContact CB-CG1 4.13Å; S74-I78 PolarHBondContact O-N 3.17Å; Q76-I78 VanDerWaalsContact C-N 3.31Å; Q76-I78 PolarHBondContact O-N 3.47Å; I78-Q81 PolarHBondContact O-N 2.91Å; I78-L82 HydrophobicContact CG2-CD1 4Å; I78-L82 PolarHBondContact O-N 2.92Å
79	C	75.9	Confident	73.2	Confident	71 Å²	71	71.9 Å²	71.9	48%	0.48	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-39.1	179.2	-172.6	0	0	0	0	112	Q75 Q76 N83	Q75-C79 PolarHBondContact O-N 3.06Å; Q76-C79 PolarHBondContact O-N 3.46Å; C79-N83 VanDerWaalsContact O-CG 3.26Å; C79-N83 PolarHBondContact O-N 3.02Å; C79-N83 PolarHBondContact O-ND2 3.07Å
80	E	80.6	Confident	75.3	Confident	75 Å²	75	71.1 Å²	71.1	35%	0.35	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-45.1	175.8	-172.8	164.5	-142.8	0	0	111.9	Q76 E77 N83 I84	Q76-E80 PolarHBondContact O-N 3.21Å; E77-E80 PolarHBondContact O-N 3.25Å; E80-N83 PolarHBondContact O-N 3.27Å; E80-I84 HydrophobicContact CG-CD1 4.24Å; E80-I84 WeakPolarHBondContact O-CG1 3.37Å; E80-I84 PolarHBondContact O-N 3.03Å
81	Q	82.9	Confident	77.5	Confident	40 Å²	40	61.5 Å²	61.5	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.6	-80.5	-67.5	4.8	0	0	113.5	F72 E77 I78 N83 I84 N85	F72-Q81 HydrophobicContact CE1-CG 3.89Å; F72-Q81 HydrophobicContact CZ-CG 3.88Å; E77-Q81 PolarHBondContact O-N 3.37Å; I78-Q81 PolarHBondContact O-N 2.91Å; Q81-N83 VanDerWaalsContact C-N 3.29Å; Q81-N83 PolarHBondContact O-N 2.98Å; Q81-I84 PolarHBondContact O-N 3.02Å; Q81-N85 WeakPolarHBondContact O-CB 3.45Å; Q81-N85 PolarHBondContact O-N 3.1Å
82	L	83.9	Confident	79.7	Confident	48 Å²	48	57.4 Å²	57.4	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-42.6	173.1	-90.6	153.8	0	0	0	111.7	I78 N85 H86	I78-L82 HydrophobicContact CG2-CD1 4Å; I78-L82 PolarHBondContact O-N 2.92Å; L82-N85 PolarHBondContact O-N 3.13Å; L82-H86 WeakPolarHBondContact O-CB 3.41Å; L82-H86 PolarHBondContact O-CD2 2.58Å; L82-H86 PolarHBondContact O-N 3.23Å
83	N	86.9	Confident	81.7	Confident	67 Å²	67	55.4 Å²	55.4	36%	0.358	26%	0.263	S	S	.	.	H	α-helix	trans	-66.4	-38	177.6	-71.7	-42.8	0	0	0	112.6	C79 E80 Q81 M87 L195	C79-N83 VanDerWaalsContact O-CG 3.26Å; C79-N83 PolarHBondContact O-N 3.02Å; C79-N83 PolarHBondContact O-ND2 3.07Å; E80-N83 PolarHBondContact O-N 3.27Å; Q81-N83 VanDerWaalsContact C-N 3.29Å; Q81-N83 PolarHBondContact O-N 2.98Å; N83-M87 VanDerWaalsContact O-CB 3.3Å; N83-M87 WeakPolarHBondContact O-CB 3.25Å; N83-M87 PolarHBondContact O-N 3.45Å; N83-L195 HydrophobicContact CB-CD1 3.74Å; N83-L195 HydrophobicContact CB-CD2 4.38Å
84	I	88.7	Confident	83.8	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.036	22%	0.22	C	C	.	.	H	α-helix	trans	-63.9	-48.6	174	-68.1	167.3	0	0	0	110.1	E80 Q81 H86 M87 I88 M131 L195 F198	E80-I84 HydrophobicContact CG-CD1 4.24Å; E80-I84 WeakPolarHBondContact O-CG1 3.37Å; E80-I84 PolarHBondContact O-N 3.03Å; Q81-I84 PolarHBondContact O-N 3.02Å; I84-H86 PolarHBondContact O-N 3.46Å; I84-M87 WeakPolarHBondContact O-CB 3.4Å; I84-M87 PolarHBondContact O-N 2.8Å; I84-I88 HydrophobicContact CG2-CD1 3.74Å; I84-I88 HydrophobicContact CG2-CG1 4.4Å; I84-I88 WeakPolarHBondContact O-CG1 3.38Å; I84-I88 PolarHBondContact O-N 2.95Å; I84-M131 HydrophobicContact CG2-CG 4.42Å; I84-L195 HydrophobicContact CG1-CD2 3.83Å; I84-F198 HydrophobicContact CD1-CD2 3.95Å; I84-F198 HydrophobicContact CD1-CE1 4.47Å; I84-F198 HydrophobicContact CD1-CE2 3.76Å; I84-F198 HydrophobicContact CD1-CG 4.42Å; I84-F198 HydrophobicContact CD1-CZ 4.02Å; I84-F198 HydrophobicContact CG1-CD2 4.06Å; I84-F198 HydrophobicContact CG1-CE2 4.35Å; I84-F198 HydrophobicContact CG1-CG 4.46Å
85	N	90.6	Very high	85.3	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.059	20%	0.204	C	C	.	.	H	α-helix	trans	-56.6	-50.4	177	179.7	39.9	0	0	0	111.4	Q81 L82 M87 I88 Q89 W128 L129	Q81-N85 WeakPolarHBondContact O-CB 3.45Å; Q81-N85 PolarHBondContact O-N 3.1Å; L82-N85 PolarHBondContact O-N 3.13Å; N85-M87 VanDerWaalsContact C-N 3.31Å; N85-M87 PolarHBondContact O-N 2.86Å; N85-I88 PolarHBondContact O-N 3.14Å; N85-Q89 WeakPolarHBondContact O-CB 3.3Å; N85-Q89 VanDerWaalsContact O-CG 3.29Å; N85-Q89 WeakPolarHBondContact O-CG 3.45Å; N85-Q89 PolarHBondContact O-N 2.89Å; N85-W128 HydrophobicContact CB-CB 4.33Å; N85-L129 WeakPolarHBondContact CA-O 3.36Å; N85-L129 WeakPolarHBondContact CB-O 3.33Å; N85-L129 PolarHBondContact OD1-N 3.36Å
86	H	89.6	Confident	86.7	Confident	20 Å²	20	33.3 Å²	33.3	9%	0.093	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-36.3	178.7	-64.8	-34.2	0	0	0	112.7	L82 I84 Q89 R90 I109	L82-H86 WeakPolarHBondContact O-CB 3.41Å; L82-H86 PolarHBondContact O-CD2 2.58Å; L82-H86 PolarHBondContact O-N 3.23Å; I84-H86 PolarHBondContact O-N 3.46Å; H86-Q89 PolarHBondContact ND1-OE1 3.27Å; H86-Q89 VanDerWaalsContact ND1-OE1 3.07Å; H86-Q89 PolarHBondContact O-N 3.14Å; H86-R90 WeakPolarHBondContact O-CG 3.46Å; H86-R90 PolarHBondContact O-N 2.9Å; H86-R90 PolarHBondContact O-NH1 3.4Å; H86-I109 WeakPolarHBondContact CE1-CD1 3.4Å; H86-I109 WeakPolarHBondContact ND1-CG1 3.32Å
87	M	91.6	Very high	87.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-47.8	173.6	-178.9	-166.1	65.7	0	0	111.4	N83 I84 N85 Q89 R90 I91 M131 V191 F198 A199	N83-M87 VanDerWaalsContact O-CB 3.3Å; N83-M87 WeakPolarHBondContact O-CB 3.25Å; N83-M87 PolarHBondContact O-N 3.45Å; I84-M87 WeakPolarHBondContact O-CB 3.4Å; I84-M87 PolarHBondContact O-N 2.8Å; N85-M87 VanDerWaalsContact C-N 3.31Å; N85-M87 PolarHBondContact O-N 2.86Å; M87-Q89 VanDerWaalsContact C-N 3.32Å; M87-Q89 PolarHBondContact O-N 2.94Å; M87-R90 PolarHBondContact O-N 2.97Å; M87-I91 HydrophobicContact CG-CD1 3.95Å; M87-I91 WeakPolarHBondContact O-CG1 3.33Å; M87-I91 PolarHBondContact O-N 3.4Å; M87-M131 HydrophobicContact CE-CE 4.03Å; M87-V191 HydrophobicContact CG-CG1 4.44Å; M87-V191 HydrophobicContact SD-CG1 4.23Å; M87-F198 HydrophobicContact CE-CB 3.59Å; M87-F198 HydrophobicContact SD-CB 4.42Å; M87-A199 HydrophobicContact SD-CB 3.72Å
88	I	93.6	Very high	88.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.6	-46	175.9	-68.3	168.1	0	0	0	110.1	I84 N85 R90 I91 F92 L129 V134	I84-I88 HydrophobicContact CG2-CD1 3.74Å; I84-I88 HydrophobicContact CG2-CG1 4.4Å; I84-I88 WeakPolarHBondContact O-CG1 3.38Å; I84-I88 PolarHBondContact O-N 2.95Å; N85-I88 PolarHBondContact O-N 3.14Å; I88-R90 PolarHBondContact O-N 3.08Å; I88-I91 PolarHBondContact O-N 3.16Å; I88-F92 HydrophobicContact CG2-CD2 3.89Å; I88-F92 PolarHBondContact O-N 3.07Å; I88-L129 HydrophobicContact CB-CB 4.43Å; I88-L129 HydrophobicContact CD1-CB 4.28Å; I88-L129 HydrophobicContact CG2-CB 3.89Å; I88-L129 HydrophobicContact CG2-CD1 3.74Å; I88-L129 HydrophobicContact CG2-CG 4.42Å; I88-V134 HydrophobicContact CD1-CB 4.17Å; I88-V134 HydrophobicContact CD1-CG2 4.24Å; I88-V134 HydrophobicContact CG1-CG2 4.32Å; I88-V134 HydrophobicContact CG2-CB 4.46Å; I88-V134 HydrophobicContact CG2-CG2 3.67Å
89	Q	92.9	Very high	88.8	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-43.8	176	-72.3	172.3	-23.6	0	0	111.6	N85 H86 M87 I91 L93 I94 T95 P110	N85-Q89 WeakPolarHBondContact O-CB 3.3Å; N85-Q89 VanDerWaalsContact O-CG 3.29Å; N85-Q89 WeakPolarHBondContact O-CG 3.45Å; N85-Q89 PolarHBondContact O-N 2.89Å; H86-Q89 PolarHBondContact ND1-OE1 3.27Å; H86-Q89 VanDerWaalsContact ND1-OE1 3.07Å; H86-Q89 PolarHBondContact O-N 3.14Å; M87-Q89 VanDerWaalsContact C-N 3.32Å; M87-Q89 PolarHBondContact O-N 2.94Å; Q89-I91 PolarHBondContact O-N 3.36Å; Q89-L93 WeakPolarHBondContact O-CA 3.37Å; Q89-L93 PolarHBondContact O-N 3.21Å; Q89-I94 WeakPolarHBondContact CG-O 3.49Å; Q89-T95 PolarHBondContact NE2-OG1 3.22Å; Q89-P110 HydrophobicContact CB-CG 4.18Å
90	R	92.1	Very high	88.7	Confident	61 Å²	61	28 Å²	28	23%	0.23	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-37.2	176.9	-74.2	-168.9	-55.7	-79.7	-0.6	112.9	H86 M87 I88 G108 R183 E187	H86-R90 WeakPolarHBondContact O-CG 3.46Å; H86-R90 PolarHBondContact O-N 2.9Å; H86-R90 PolarHBondContact O-NH1 3.4Å; M87-R90 PolarHBondContact O-N 2.97Å; I88-R90 PolarHBondContact O-N 3.08Å; R90-G108 WeakPolarHBondContact CD-O 3.43Å; R90-G108 WeakPolarHBondContact CG-O 3.12Å; R90-G108 PolarHBondContact NH1-O 2.93Å; R90-R183 WeakPolarHBondContact O-CD 3.27Å; R90-E187 WeakPolarHBondContact CD-OE1 3.4Å; R90-E187 IonicContact CZ-OE1 2.91Å; R90-E187 IonicContact CZ-OE2 3.39Å; R90-E187 VanDerWaalsContact NE-CD 3.27Å; R90-E187 IonicContact NE-OE1 2.97Å; R90-E187 PolarHBondContact NE-OE1 2.94Å; R90-E187 IonicContact NE-OE2 3.8Å; R90-E187 PolarHBondContact NE-OE2 3.19Å; R90-E187 IonicContact NH2-OE1 3.84Å; R90-E187 IonicContact NH2-OE2 2.82Å; R90-E187 PolarHBondContact NH2-OE2 2.89Å
91	I	94.5	Very high	88.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-76.1	-50.6	-178.1	-67.2	172.9	0	0	0	111.1	M87 I88 Q89 R183 A184 E187 C202	M87-I91 HydrophobicContact CG-CD1 3.95Å; M87-I91 WeakPolarHBondContact O-CG1 3.33Å; M87-I91 PolarHBondContact O-N 3.4Å; I88-I91 PolarHBondContact O-N 3.16Å; Q89-I91 PolarHBondContact O-N 3.36Å; I91-R183 PolarHBondContact O-NE 3.04Å; I91-R183 PolarHBondContact O-NH2 3.4Å; I91-R183 VanDerWaalsContact O-NH2 3.11Å; I91-A184 HydrophobicContact CD1-CB 4.11Å; I91-A184 HydrophobicContact CG1-CB 4.36Å; I91-A184 HydrophobicContact CG2-CB 3.85Å; I91-E187 HydrophobicContact CD1-CB 4.2Å; I91-E187 HydrophobicContact CD1-CG 4.31Å; I91-E187 HydrophobicContact CG1-CB 4.25Å; I91-E187 HydrophobicContact CG1-CG 3.87Å; I91-C202 HydrophobicContact CD1-CB 3.62Å; I91-C202 HydrophobicContact CG2-CB 4.34Å
92	F	96.1	Very high	87.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-100.2	-14	-170.8	-63	-69.2	0	0	0	113.7	I88 I94 V134 L138 Y176 C180 C202 L205 T206	I88-F92 HydrophobicContact CG2-CD2 3.89Å; I88-F92 PolarHBondContact O-N 3.07Å; F92-I94 HydrophobicContact CB-CD1 3.98Å; F92-I94 HydrophobicContact CB-CG1 3.72Å; F92-I94 PolarHBondContact O-N 3.44Å; F92-V134 HydrophobicContact CD2-CG2 4.06Å; F92-V134 HydrophobicContact CE2-CG2 3.77Å; F92-L138 HydrophobicContact CD1-CD1 3.6Å; F92-L138 HydrophobicContact CD1-CD2 4.03Å; F92-L138 HydrophobicContact CD1-CG 4.4Å; F92-L138 HydrophobicContact CE1-CD1 3.99Å; F92-L138 HydrophobicContact CE1-CD2 3.52Å; F92-L138 HydrophobicContact CE1-CG 4.36Å; F92-L138 HydrophobicContact CG-CD1 4.36Å; F92-L138 HydrophobicContact CZ-CD2 4.09Å; F92-Y176 WeakPolarHBondContact O-CE2 3.47Å; F92-Y176 PolarHBondContact O-OH 2.95Å; F92-C180 HydrophobicContact CD1-CB 3.99Å; F92-C180 HydrophobicContact CE1-CB 4.19Å; F92-C202 HydrophobicContact CE2-CB 3.86Å; F92-C202 HydrophobicContact CZ-CB 4.04Å; F92-L205 HydrophobicContact CZ-CB 4.29Å; F92-T206 HydrophobicContact CD1-CG2 4.47Å; F92-T206 HydrophobicContact CE1-CG2 3.52Å; F92-T206 HydrophobicContact CZ-CG2 4.1Å
93	L	95.3	Very high	86.6	Confident	14 Å²	14	29.7 Å²	29.7	7%	0.073	16%	0.163	C	C	.	.			trans	56	39.8	-178.8	-51.4	177.3	0	0	0	112.7	Q89 P110 C113 V114 D167 A168	Q89-L93 WeakPolarHBondContact O-CA 3.37Å; Q89-L93 PolarHBondContact O-N 3.21Å; L93-P110 HydrophobicContact CD2-CB 3.62Å; L93-P110 HydrophobicContact CD2-CG 4.02Å; L93-C113 VanDerWaalsContact C-SG 3.59Å; L93-C113 CarbonylContact O-C 3.56Å; L93-C113 VanDerWaalsContact O-CA 3.25Å; L93-C113 WeakPolarHBondContact O-CA 3.49Å; L93-V114 PolarHBondContact O-N 3.04Å; L93-D167 HydrophobicContact CD1-CB 4.22Å; L93-A168 HydrophobicContact CB-CB 4.02Å; L93-A168 HydrophobicContact CD1-CB 4.1Å
94	I	95.5	Very high	85.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	153.9	177.1	56.1	174.5	0	0	0	110.2	Q89 F92 V114 L116 L129 A137 R141	Q89-I94 WeakPolarHBondContact CG-O 3.49Å; F92-I94 HydrophobicContact CB-CD1 3.98Å; F92-I94 HydrophobicContact CB-CG1 3.72Å; F92-I94 PolarHBondContact O-N 3.44Å; I94-V114 CarbonylContact C-O 3.6Å; I94-V114 WeakPolarHBondContact CA-O 3.34Å; I94-V114 HydrophobicContact CG2-CB 4.37Å; I94-L116 HydrophobicContact CB-CD1 4.28Å; I94-L116 HydrophobicContact CD1-CD1 4.28Å; I94-L129 HydrophobicContact CD1-CD1 4.11Å; I94-L129 HydrophobicContact CG1-CD1 3.75Å; I94-L129 WeakPolarHBondContact O-CD1 3.3Å; I94-A137 HydrophobicContact CD1-CB 3.77Å; I94-R141 HydrophobicContact CG2-CB 3.8Å; I94-R141 HydrophobicContact CG2-CG 3.55Å
95	T	92.3	Very high	84.3	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	150.7	-179.5	-172	0	0	0	0	111.8	Q89 D97 C113 V114 Y115 L116 I152 M154	Q89-T95 PolarHBondContact NE2-OG1 3.22Å; T95-D97 PolarHBondContact OG1-N 2.93Å; T95-D97 VanDerWaalsContact OG1-N 3.12Å; T95-C113 HydrophobicContact CG2-CB 3.61Å; T95-V114 PolarHBondContact N-O 3.37Å; T95-Y115 WeakPolarHBondContact O-CA 3.48Å; T95-L116 PolarHBondContact O-N 3.15Å; T95-L116 VanDerWaalsContact O-N 3.16Å; T95-I152 HydrophobicContact CG2-CD1 3.52Å; T95-I152 HydrophobicContact CG2-CG1 3.94Å; T95-M154 HydrophobicContact CG2-CE 4.23Å; T95-M154 HydrophobicContact CG2-SD 3.85Å
96	L	90	Very high	82.7	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.026	20%	0.201	C	C	.	.	S	Bend	trans	-101.8	-3.6	169.2	-58.6	175	0	0	0	111.9	Y115 L116 M119 A120 L123 D127 L129	L96-Y115 WeakPolarHBondContact O-CE2 3.39Å; L96-L116 HydrophobicContact CD2-CB 4.02Å; L96-M119 HydrophobicContact CD2-CB 4.07Å; L96-M119 HydrophobicContact CD2-CG 3.99Å; L96-M119 HydrophobicContact CD2-SD 4.23Å; L96-A120 HydrophobicContact CB-CB 4.37Å; L96-A120 HydrophobicContact CD2-CB 4.17Å; L96-L123 HydrophobicContact CD1-CD1 3.63Å; L96-D127 CarbonylContact C-O 3.51Å; L96-D127 WeakPolarHBondContact CB-O 3.34Å; L96-L129 HydrophobicContact CD1-CD2 3.74Å; L96-L129 HydrophobicContact CD1-CG 4.35Å; L96-L129 HydrophobicContact CG-CD2 3.84Å; L96-L129 HydrophobicContact CG-CG 4.27Å
97	D	86.1	Confident	81.5	Confident	21 Å²	21	39.5 Å²	39.5	11%	0.112	24%	0.235	C	C	.	.			trans	-100.3	109.3	-176.9	173.7	12.4	0	0	0	111.6	T95 S99 K104 D127 I152	T95-D97 PolarHBondContact OG1-N 2.93Å; T95-D97 VanDerWaalsContact OG1-N 3.12Å; D97-S99 VanDerWaalsContact CG-OG 3.26Å; D97-S99 WeakPolarHBondContact OD1-CA 3.39Å; D97-S99 WeakPolarHBondContact OD1-CB 3.33Å; D97-S99 PolarHBondContact OD1-N 3.49Å; D97-S99 PolarHBondContact OD1-OG 3.49Å; D97-S99 PolarHBondContact OD2-OG 3.43Å; D97-K104 PolarHBondContact O-NZ 2.87Å; D97-K104 IonicContact OD1-NZ 3.24Å; D97-K104 WeakPolarHBondContact OD2-CE 3.44Å; D97-K104 IonicContact OD2-NZ 3.83Å; D97-K104 PolarHBondContact OD2-NZ 3.31Å; D97-D127 PolarHBondContact N-O 3.41Å; D97-I152 WeakPolarHBondContact O-CD1 3.44Å
98	N	84.3	Confident	80.3	Confident	97 Å²	97	41.3 Å²	41.3	52%	0.519	25%	0.254	S	S	.	.			trans	-100.8	19.1	174.4	-166.8	26.9	0	0	0	113.5	Y115	N98-Y115 HydrophobicContact CB-CD1 4.47Å; N98-Y115 HydrophobicContact CB-CD2 4.01Å; N98-Y115 HydrophobicContact CB-CE1 4.18Å; N98-Y115 HydrophobicContact CB-CE2 3.69Å; N98-Y115 HydrophobicContact CB-CG 4.39Å
99	S	80.9	Confident	79.8	Confident	25 Å²	25	42.3 Å²	42.3	18%	0.175	26%	0.259	C	S	.	.	S	Bend	trans	-65.1	159.8	175	65.1	0	0	0	0	112.4	D97 K104	D97-S99 VanDerWaalsContact CG-OG 3.26Å; D97-S99 WeakPolarHBondContact OD1-CA 3.39Å; D97-S99 WeakPolarHBondContact OD1-CB 3.33Å; D97-S99 PolarHBondContact OD1-N 3.49Å; D97-S99 PolarHBondContact OD1-OG 3.49Å; D97-S99 PolarHBondContact OD2-OG 3.43Å; S99-K104 WeakPolarHBondContact O-CE 3.32Å; S99-K104 PolarHBondContact O-NZ 2.85Å; S99-K104 WeakPolarHBondContact OG-CE 3.47Å
100	D	74.7	Confident	79.5	Confident	94 Å²	94	43.2 Å²	43.2	50%	0.503	27%	0.265	S	S	.	.			trans	-56.2	130	-178.5	-170.2	-45.7	0	0	0	110.6	S102 L103	D100-S102 PolarHBondContact O-N 3.44Å; D100-S102 WeakPolarHBondContact OD1-CB 3.48Å; D100-S102 PolarHBondContact OD1-N 2.89Å; D100-S102 PolarHBondContact OD1-OG 2.9Å; D100-L103 HydrophobicContact CB-CD1 3.91Å; D100-L103 HydrophobicContact CB-CG 4.17Å; D100-L103 WeakPolarHBondContact O-CB 3.4Å; D100-L103 PolarHBondContact O-N 3.45Å
101	P	75	Confident	79.2	Confident	33 Å²	33	42 Å²	42	21%	0.214	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.1	178.5	-20.5	28.8	0	0	0	114.9	L103 N153 S156	P101-L103 VanDerWaalsContact C-N 3.35Å; P101-N153 HydrophobicContact CG-CB 4.04Å; P101-N153 WeakPolarHBondContact CG-O 3.31Å; P101-S156 PolarHBondContact O-OG 3.31Å
102	S	66.8	Low	79	Confident	79 Å²	79	44.1 Å²	44.1	55%	0.552	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-19.9	173.7	60.6	0	0	0	0	113.8	D100	D100-S102 PolarHBondContact O-N 3.44Å; D100-S102 WeakPolarHBondContact OD1-CB 3.48Å; D100-S102 PolarHBondContact OD1-N 2.89Å; D100-S102 PolarHBondContact OD1-OG 2.9Å
103	L	62	Low	78.8	Confident	87 Å²	87	44.1 Å²	44.1	46%	0.455	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-11.5	178.6	-62.3	169.2	0	0	0	112.6	D100 P101	D100-L103 HydrophobicContact CB-CD1 3.91Å; D100-L103 HydrophobicContact CB-CG 4.17Å; D100-L103 WeakPolarHBondContact O-CB 3.4Å; D100-L103 PolarHBondContact O-N 3.45Å; P101-L103 VanDerWaalsContact C-N 3.35Å
104	K	69.4	Low	78.8	Confident	20 Å²	20	43.5 Å²	43.5	9%	0.087	27%	0.27	C	S	.	.	S	Bend	trans	-90.6	128.8	-175.6	-60.7	179	-177.4	-176.2	0	111	D97 S99 G106 I109 M154	D97-K104 PolarHBondContact O-NZ 2.87Å; D97-K104 IonicContact OD1-NZ 3.24Å; D97-K104 WeakPolarHBondContact OD2-CE 3.44Å; D97-K104 IonicContact OD2-NZ 3.83Å; D97-K104 PolarHBondContact OD2-NZ 3.31Å; S99-K104 WeakPolarHBondContact O-CE 3.32Å; S99-K104 PolarHBondContact O-NZ 2.85Å; S99-K104 WeakPolarHBondContact OG-CE 3.47Å; K104-G106 PolarHBondContact O-N 3.31Å; K104-I109 HydrophobicContact CB-CD1 4.48Å; K104-M154 HydrophobicContact CD-CE 4.36Å; K104-M154 HydrophobicContact CD-SD 4.45Å; K104-M154 PolarHBondContact NZ-SD 2.98Å; K104-M154 VanDerWaalsContact NZ-SD 3.41Å
105	S	58.1	Low	78.7	Confident	82 Å²	82	45.4 Å²	45.4	57%	0.573	28%	0.278	S	S	*	.			trans	-69.6	118.1	175.5	69.1	0	0	0	0	110.3	N107 I109	S105-N107 PolarHBondContact O-N 3.29Å; S105-I109 WeakPolarHBondContact O-CD1 3.47Å
106	G	56.6	Low	78.7	Confident	58 Å²	58	45.8 Å²	45.8	60%	0.598	28%	0.28	S	S	*	.			trans	-68.7	1.3	-169.8	0	0	0	0	0	117.3	K104 G108	K104-G106 PolarHBondContact O-N 3.31Å; G106-G108 PolarHBondContact O-N 3.22Å
107	N	63.1	Low	78.6	Confident	151 Å²	151	51.2 Å²	51.2	81%	0.807	31%	0.305	S	S	*	.	S	Bend	trans	-85.7	105	-177.3	-77.6	-12.9	0	0	0	111	S105	S105-N107 PolarHBondContact O-N 3.29Å
108	G	67.5	Low	78.6	Confident	39 Å²	39	58.1 Å²	58.1	40%	0.402	34%	0.337	S	S	.	.	S	Bend	trans	92.4	10	167.2	0	0	0	0	0	116.4	R90 G106	R90-G108 WeakPolarHBondContact CD-O 3.43Å; R90-G108 WeakPolarHBondContact CG-O 3.12Å; R90-G108 PolarHBondContact NH1-O 2.93Å; G106-G108 PolarHBondContact O-N 3.22Å
109	I	82	Confident	78.8	Confident	21 Å²	21	53.8 Å²	53.8	11%	0.108	31%	0.313	C	S	.	.			trans	-99.5	137.6	176.6	-47.2	-175.5	0	0	0	109.2	H86 K104 S105 M154	H86-I109 WeakPolarHBondContact CE1-CD1 3.4Å; H86-I109 WeakPolarHBondContact ND1-CG1 3.32Å; K104-I109 HydrophobicContact CB-CD1 4.48Å; S105-I109 WeakPolarHBondContact O-CD1 3.47Å; I109-M154 HydrophobicContact CG2-CB 3.91Å; I109-M154 HydrophobicContact CG2-CE 3.81Å; I109-M154 HydrophobicContact CG2-CG 4.41Å
110	P	86.9	Confident	79	Confident	21 Å²	21	53.5 Å²	53.5	14%	0.136	31%	0.313	C	S	.	.			trans	-63.1	155.1	173.3	30.3	-39.4	0	0	0	111.2	Q89 L93 R112 C113 M154	Q89-P110 HydrophobicContact CB-CG 4.18Å; L93-P110 HydrophobicContact CD2-CB 3.62Å; L93-P110 HydrophobicContact CD2-CG 4.02Å; P110-R112 PolarHBondContact O-N 2.98Å; P110-C113 WeakPolarHBondContact CG-SG 3.3Å; P110-M154 WeakPolarHBondContact O-CB 3.42Å
111	S	86.8	Confident	79.4	Confident	34 Å²	34	53.8 Å²	53.8	24%	0.238	32%	0.318	C	S	.	.	S	Bend	trans	-71.8	-29	-177.3	55.7	0	0	0	0	114.2	M154 A164	S111-M154 PolarHBondContact O-N 3.33Å; S111-A164 WeakPolarHBondContact OG-CB 3.46Å
112	R	89.4	Confident	79.8	Confident	46 Å²	46	58.7 Å²	58.7	17%	0.174	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.7	-179.1	-69	-65.7	-157.5	151.3	9.9	110	P110 I152 N153 A164 D165 A168	P110-R112 PolarHBondContact O-N 2.98Å; R112-I152 WeakPolarHBondContact CD-O 3.27Å; R112-N153 VanDerWaalsContact CD-OD1 3.32Å; R112-N153 WeakPolarHBondContact CD-OD1 3.47Å; R112-N153 PolarHBondContact NE-OD1 3.22Å; R112-N153 PolarHBondContact NH1-OD1 3.06Å; R112-A164 HydrophobicContact CB-CB 4.12Å; R112-A164 HydrophobicContact CG-CB 3.85Å; R112-D165 VanDerWaalsContact CG-OD1 3.31Å; R112-D165 WeakPolarHBondContact CG-OD1 3.47Å; R112-D165 IonicContact CZ-OD1 3.32Å; R112-D165 IonicContact CZ-OD2 3.48Å; R112-D165 IonicContact NE-OD1 2.92Å; R112-D165 PolarHBondContact NE-OD1 3.45Å; R112-D165 IonicContact NE-OD2 2.92Å; R112-D165 IonicContact NH2-OD1 2.72Å; R112-D165 PolarHBondContact NH2-OD1 3.33Å; R112-D165 IonicContact NH2-OD2 3.74Å; R112-D165 PolarHBondContact NH2-OD2 2.91Å; R112-A168 HydrophobicContact CB-CB 4.04Å
113	C	92	Very high	80.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	156.6	171	-78.3	0	0	0	0	109.8	L93 T95 P110 L151 I152 M154	L93-C113 VanDerWaalsContact C-SG 3.59Å; L93-C113 CarbonylContact O-C 3.56Å; L93-C113 VanDerWaalsContact O-CA 3.25Å; L93-C113 WeakPolarHBondContact O-CA 3.49Å; T95-C113 HydrophobicContact CG2-CB 3.61Å; P110-C113 WeakPolarHBondContact CG-SG 3.3Å; C113-L151 WeakPolarHBondContact O-CA 3.4Å; C113-I152 PolarHBondContact N-O 2.79Å; C113-I152 PolarHBondContact O-N 3.09Å; C113-M154 HydrophobicContact CB-CG 3.88Å; C113-M154 HydrophobicContact CB-SD 4.23Å
114	V	94.9	Very high	80.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.2	167.2	170.1	0	0	0	0	109	L93 I94 T95 L116 L144 P147 H150 L151 A168	L93-V114 PolarHBondContact O-N 3.04Å; I94-V114 CarbonylContact C-O 3.6Å; I94-V114 WeakPolarHBondContact CA-O 3.34Å; I94-V114 HydrophobicContact CG2-CB 4.37Å; T95-V114 PolarHBondContact N-O 3.37Å; V114-L116 HydrophobicContact CG1-CD2 4.13Å; V114-L144 HydrophobicContact CG1-CD1 3.64Å; V114-P147 HydrophobicContact CG2-CB 4.1Å; V114-H150 WeakPolarHBondContact CA-O 3.5Å; V114-H150 HydrophobicContact CG1-CB 3.87Å; V114-L151 HydrophobicContact CG2-CD2 3.79Å; V114-A168 VanDerWaalsContact CG2-O 3.31Å; V114-A168 WeakPolarHBondContact CG2-O 3.31Å
115	Y	94	Very high	81	Confident	41 Å²	41	65.2 Å²	65.2	16%	0.161	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	124.8	174.9	176.9	-119.5	0	0	0	110.5	T95 L96 N98 E117 A120 H150	T95-Y115 WeakPolarHBondContact O-CA 3.48Å; L96-Y115 WeakPolarHBondContact O-CE2 3.39Å; N98-Y115 HydrophobicContact CB-CD1 4.47Å; N98-Y115 HydrophobicContact CB-CD2 4.01Å; N98-Y115 HydrophobicContact CB-CE1 4.18Å; N98-Y115 HydrophobicContact CB-CE2 3.69Å; N98-Y115 HydrophobicContact CB-CG 4.39Å; Y115-E117 HydrophobicContact CD1-CB 3.96Å; Y115-E117 HydrophobicContact CE1-CB 3.56Å; Y115-E117 HydrophobicContact CE1-CG 3.85Å; Y115-E117 PolarHBondContact O-N 3.06Å; Y115-A120 HydrophobicContact CE2-CB 3.94Å; Y115-H150 PolarHBondContact N-O 3.2Å
116	L	93.1	Very high	82.1	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.037	34%	0.343	C	S	.	.			trans	-96.1	78.5	-179.8	-57.9	175.6	0	0	0	110	I94 T95 L96 V114 E118 M119 A120 A137 A140 R141 L144	I94-L116 HydrophobicContact CB-CD1 4.28Å; I94-L116 HydrophobicContact CD1-CD1 4.28Å; T95-L116 PolarHBondContact O-N 3.15Å; T95-L116 VanDerWaalsContact O-N 3.16Å; L96-L116 HydrophobicContact CD2-CB 4.02Å; V114-L116 HydrophobicContact CG1-CD2 4.13Å; L116-E118 PolarHBondContact O-N 2.96Å; L116-M119 HydrophobicContact CB-CB 4.19Å; L116-M119 HydrophobicContact CD1-SD 4.42Å; L116-M119 PolarHBondContact O-N 3.3Å; L116-A120 WeakPolarHBondContact O-CB 3.43Å; L116-A120 PolarHBondContact O-N 3.48Å; L116-A137 HydrophobicContact CD1-CB 3.78Å; L116-A137 WeakPolarHBondContact CD1-O 3.09Å; L116-A140 HydrophobicContact CD1-CB 4.47Å; L116-R141 HydrophobicContact CD2-CB 4.1Å; L116-L144 HydrophobicContact CD2-CD1 3.95Å
117	E	86.9	Confident	83.3	Confident	120 Å²	120	62.8 Å²	62.8	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-56.4	-47.8	-172.7	-174	172.1	-169.3	0	0	113.3	Y115 M119 A120 V121	Y115-E117 HydrophobicContact CD1-CB 3.96Å; Y115-E117 HydrophobicContact CE1-CB 3.56Å; Y115-E117 HydrophobicContact CE1-CG 3.85Å; Y115-E117 PolarHBondContact O-N 3.06Å; E117-M119 VanDerWaalsContact C-N 3.34Å; E117-M119 PolarHBondContact O-N 3.41Å; E117-A120 PolarHBondContact O-N 3.13Å; E117-V121 VanDerWaalsContact O-CG2 3.32Å; E117-V121 WeakPolarHBondContact O-CG2 3.39Å; E117-V121 PolarHBondContact O-N 3.36Å
118	E	85.8	Confident	84.4	Confident	165 Å²	165	56.3 Å²	56.3	77%	0.771	29%	0.292	S	S	*	.	H	α-helix	trans	-61.5	-42.8	-178.6	-64	-176.1	167.7	0	0	112	L116 V121 E122	L116-E118 PolarHBondContact O-N 2.96Å; E118-V121 PolarHBondContact O-N 2.85Å; E118-E122 WeakPolarHBondContact O-CG 3.38Å; E118-E122 PolarHBondContact O-N 2.96Å
119	M	88.3	Confident	85.5	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.03	27%	0.273	C	S	.	.	H	α-helix	trans	-72.2	-36.9	179.7	-174.6	174.9	175.3	0	0	112.4	L96 L116 E117 V121 E122 L123 N133 Q136 A137	L96-M119 HydrophobicContact CD2-CB 4.07Å; L96-M119 HydrophobicContact CD2-CG 3.99Å; L96-M119 HydrophobicContact CD2-SD 4.23Å; L116-M119 HydrophobicContact CB-CB 4.19Å; L116-M119 HydrophobicContact CD1-SD 4.42Å; L116-M119 PolarHBondContact O-N 3.3Å; E117-M119 VanDerWaalsContact C-N 3.34Å; E117-M119 PolarHBondContact O-N 3.41Å; M119-V121 PolarHBondContact O-N 3.16Å; M119-E122 PolarHBondContact O-N 3.16Å; M119-L123 HydrophobicContact CE-CD1 3.83Å; M119-L123 HydrophobicContact CG-CD1 4.05Å; M119-L123 PolarHBondContact O-N 2.67Å; M119-L123 VanDerWaalsContact O-N 3.16Å; M119-N133 HydrophobicContact CE-CB 3.82Å; M119-N133 WeakPolarHBondContact CE-O 3.35Å; M119-Q136 HydrophobicContact CE-CB 3.97Å; M119-Q136 HydrophobicContact CE-CG 4.02Å; M119-Q136 HydrophobicContact SD-CG 4.18Å; M119-A137 HydrophobicContact CE-CB 3.82Å; M119-A137 WeakPolarHBondContact SD-CA 3.09Å; M119-A137 HydrophobicContact SD-CB 3.57Å; M119-A137 VanDerWaalsContact SD-CB 3.57Å
120	A	84.8	Confident	85.9	Confident	19 Å²	19	54.2 Å²	54.2	16%	0.157	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-34.7	174.6	0	0	0	0	0	111.3	L96 Y115 L116 E117	L96-A120 HydrophobicContact CB-CB 4.37Å; L96-A120 HydrophobicContact CD2-CB 4.17Å; Y115-A120 HydrophobicContact CE2-CB 3.94Å; L116-A120 WeakPolarHBondContact O-CB 3.43Å; L116-A120 PolarHBondContact O-N 3.48Å; E117-A120 PolarHBondContact O-N 3.13Å
121	V	84.1	Confident	86.1	Confident	101 Å²	101	55 Å²	55	61%	0.612	27%	0.274	S	S	*	.	H	α-helix	trans	-71.4	-39.8	174.1	174	0	0	0	0	111.9	E117 E118 M119 L123 E124	E117-V121 VanDerWaalsContact O-CG2 3.32Å; E117-V121 WeakPolarHBondContact O-CG2 3.39Å; E117-V121 PolarHBondContact O-N 3.36Å; E118-V121 PolarHBondContact O-N 2.85Å; M119-V121 PolarHBondContact O-N 3.16Å; V121-L123 VanDerWaalsContact C-N 3.31Å; V121-L123 PolarHBondContact O-N 3.45Å; V121-E124 PolarHBondContact O-N 3.28Å
122	E	84.3	Confident	86.2	Confident	135 Å²	135	58.4 Å²	58.4	63%	0.631	30%	0.298	S	S	*	.	H	α-helix	trans	-65.4	-30.7	179.7	-77.1	-178.2	172.4	0	0	114	E118 M119 Q136	E118-E122 WeakPolarHBondContact O-CG 3.38Å; E118-E122 PolarHBondContact O-N 2.96Å; M119-E122 PolarHBondContact O-N 3.16Å; E122-Q136 PolarHBondContact OE2-NE2 2.91Å
123	L	82.9	Confident	86.2	Confident	51 Å²	51	56.4 Å²	56.4	27%	0.267	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-10.4	-176.5	-71.8	169.8	0	0	0	113.9	L96 M119 V121 D125 Q126	L96-L123 HydrophobicContact CD1-CD1 3.63Å; M119-L123 HydrophobicContact CE-CD1 3.83Å; M119-L123 HydrophobicContact CG-CD1 4.05Å; M119-L123 PolarHBondContact O-N 2.67Å; M119-L123 VanDerWaalsContact O-N 3.16Å; V121-L123 VanDerWaalsContact C-N 3.31Å; V121-L123 PolarHBondContact O-N 3.45Å; L123-D125 PolarHBondContact O-N 3.1Å; L123-Q126 HydrophobicContact CB-CB 4.28Å
124	E	67.5	Low	86.3	Confident	169 Å²	169	56.5 Å²	56.5	79%	0.79	29%	0.291	S	S	*	.	S	Bend	trans	50.2	-46.8	177.7	-67.2	-173.5	169.5	0	0	117.1	V121	V121-E124 PolarHBondContact O-N 3.28Å
125	D	71.8	Confident	86.2	Confident	103 Å²	103	61.6 Å²	61.6	55%	0.551	32%	0.315	S	S	*	.	S	Bend	trans	-126.4	14.9	-172	-59.6	-28.7	0	0	0	113.4	E67 L123	E67-D125 WeakPolarHBondContact OE2-CA 3.45Å; E67-D125 WeakPolarHBondContact OE2-CB 3.21Å; L123-D125 PolarHBondContact O-N 3.1Å
126	Q	82.1	Confident	86.1	Confident	38 Å²	38	64.3 Å²	64.3	18%	0.178	33%	0.329	C	S	.	.			trans	-132.2	108.2	179	179.1	171.4	8	0	0	112.1	L123 W128 D130 N133	L123-Q126 HydrophobicContact CB-CB 4.28Å; Q126-W128 HydrophobicContact CB-CH2 4.3Å; Q126-W128 HydrophobicContact CB-CZ3 4.26Å; Q126-W128 HydrophobicContact CG-CD2 3.8Å; Q126-W128 HydrophobicContact CG-CE3 3.91Å; Q126-W128 HydrophobicContact CG-CG 4.38Å; Q126-W128 HydrophobicContact CG-CH2 4.02Å; Q126-W128 HydrophobicContact CG-CZ2 3.91Å; Q126-W128 HydrophobicContact CG-CZ3 4.01Å; Q126-W128 WeakPolarHBondContact CG-O 3.35Å; Q126-W128 VanDerWaalsContact NE2-NE1 3.15Å; Q126-W128 PolarHBondContact NE2-O 3.45Å; Q126-W128 VanDerWaalsContact NE2-O 3.09Å; Q126-D130 PolarHBondContact NE2-OD2 3.26Å; Q126-N133 PolarHBondContact NE2-ND2 3.16Å
127	D	81.8	Confident	86.1	Confident	52 Å²	52	64 Å²	64	28%	0.278	33%	0.327	S	S	.	.			trans	-101.8	4	178.5	63	-7.8	0	0	0	114	L96 D97	L96-D127 CarbonylContact C-O 3.51Å; L96-D127 WeakPolarHBondContact CB-O 3.34Å; D97-D127 PolarHBondContact N-O 3.41Å
128	W	86.3	Confident	86.5	Confident	14 Å²	14	58.2 Å²	58.2	5%	0.053	30%	0.301	C	S	.	.	S	Bend	trans	-112.8	151.4	176	73	89.6	0	0	0	112.7	I68 F72 N85 Q126 N133	I68-W128 HydrophobicContact CD1-CB 4.49Å; I68-W128 HydrophobicContact CD1-CD2 3.99Å; I68-W128 HydrophobicContact CD1-CE3 3.82Å; I68-W128 HydrophobicContact CD1-CG 4.29Å; I68-W128 HydrophobicContact CD1-CZ3 4.45Å; I68-W128 HydrophobicContact CG1-CD2 3.86Å; I68-W128 HydrophobicContact CG1-CE3 3.38Å; I68-W128 HydrophobicContact CG1-CH2 4.09Å; I68-W128 HydrophobicContact CG1-CZ2 4.49Å; I68-W128 HydrophobicContact CG1-CZ3 3.52Å; F72-W128 AromaticContact CE2-CZ2 3.97Å; F72-W128 HydrophobicContact CE2-CZ2 3.97Å; F72-W128 HydrophobicContact CZ-CZ2 4.41Å; N85-W128 HydrophobicContact CB-CB 4.33Å; Q126-W128 HydrophobicContact CB-CH2 4.3Å; Q126-W128 HydrophobicContact CB-CZ3 4.26Å; Q126-W128 HydrophobicContact CG-CD2 3.8Å; Q126-W128 HydrophobicContact CG-CE3 3.91Å; Q126-W128 HydrophobicContact CG-CG 4.38Å; Q126-W128 HydrophobicContact CG-CH2 4.02Å; Q126-W128 HydrophobicContact CG-CZ2 3.91Å; Q126-W128 HydrophobicContact CG-CZ3 4.01Å; Q126-W128 WeakPolarHBondContact CG-O 3.35Å; Q126-W128 VanDerWaalsContact NE2-NE1 3.15Å; Q126-W128 PolarHBondContact NE2-O 3.45Å; Q126-W128 VanDerWaalsContact NE2-O 3.09Å; W128-N133 PolarHBondContact O-ND2 3.24Å
129	L	89.8	Confident	86.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.			trans	-89	137.4	172.1	-65.5	166.4	0	0	0	110.7	N85 I88 I94 L96 N133 A137	N85-L129 WeakPolarHBondContact CA-O 3.36Å; N85-L129 WeakPolarHBondContact CB-O 3.33Å; N85-L129 PolarHBondContact OD1-N 3.36Å; I88-L129 HydrophobicContact CB-CB 4.43Å; I88-L129 HydrophobicContact CD1-CB 4.28Å; I88-L129 HydrophobicContact CG2-CB 3.89Å; I88-L129 HydrophobicContact CG2-CD1 3.74Å; I88-L129 HydrophobicContact CG2-CG 4.42Å; I94-L129 HydrophobicContact CD1-CD1 4.11Å; I94-L129 HydrophobicContact CG1-CD1 3.75Å; I94-L129 WeakPolarHBondContact O-CD1 3.3Å; L96-L129 HydrophobicContact CD1-CD2 3.74Å; L96-L129 HydrophobicContact CD1-CG 4.35Å; L96-L129 HydrophobicContact CG-CD2 3.84Å; L96-L129 HydrophobicContact CG-CG 4.27Å; L129-N133 WeakPolarHBondContact CA-OD1 3.46Å; L129-A137 HydrophobicContact CD2-CB 3.53Å
130	D	90.9	Very high	87.1	Confident	17 Å²	17	55 Å²	55	9%	0.091	29%	0.29	C	S	.	.			trans	-136.1	-179.4	172.1	67.1	36.4	0	0	0	110.7	Q126 S132 N133 V134	Q126-D130 PolarHBondContact NE2-OD2 3.26Å; D130-S132 PolarHBondContact O-N 2.89Å; D130-S132 WeakPolarHBondContact OD1-CA 3.49Å; D130-S132 WeakPolarHBondContact OD1-CB 3.34Å; D130-S132 PolarHBondContact OD1-N 3.44Å; D130-S132 PolarHBondContact OD1-OG 3.34Å; D130-N133 PolarHBondContact N-OD1 3.21Å; D130-N133 PolarHBondContact O-N 2.67Å; D130-N133 PolarHBondContact O-OD1 3.44Å; D130-N133 VanDerWaalsContact O-OD1 3.06Å; D130-N133 PolarHBondContact OD1-N 2.99Å; D130-V134 WeakPolarHBondContact O-CB 3.29Å; D130-V134 PolarHBondContact O-N 2.68Å
131	M	91.1	Very high	87.5	Confident	38 Å²	38	54.3 Å²	54.3	19%	0.187	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-12.8	-177	-74	-59.5	-171.9	0	0	115.2	I84 M87 V134 F198 Q201 C202	I84-M131 HydrophobicContact CG2-CG 4.42Å; M87-M131 HydrophobicContact CE-CE 4.03Å; M131-V134 HydrophobicContact SD-CG1 3.97Å; M131-F198 VanDerWaalsContact CE-CA 3.46Å; M131-F198 HydrophobicContact CE-CB 3.37Å; M131-F198 HydrophobicContact CE-CD1 3.82Å; M131-F198 HydrophobicContact CE-CG 4.02Å; M131-F198 WeakPolarHBondContact CE-O 3.26Å; M131-F198 HydrophobicContact CG-CD1 3.71Å; M131-F198 HydrophobicContact CG-CE1 4.18Å; M131-Q201 HydrophobicContact CE-CB 4.23Å; M131-Q201 HydrophobicContact SD-CG 4.39Å; M131-C202 VanDerWaalsContact CE-SG 3.58Å
132	S	88.8	Confident	88	Confident	104 Å²	104	49.7 Å²	49.7	73%	0.727	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-27.2	177.1	73.4	0	0	0	0	112.6	D130	D130-S132 PolarHBondContact O-N 2.89Å; D130-S132 WeakPolarHBondContact OD1-CA 3.49Å; D130-S132 WeakPolarHBondContact OD1-CB 3.34Å; D130-S132 PolarHBondContact OD1-N 3.44Å; D130-S132 PolarHBondContact OD1-OG 3.34Å
133	N	90.2	Very high	88.4	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.027	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-12.9	-176.1	68.8	21.8	0	0	0	114.4	M119 Q126 W128 L129 D130 E135 Q136 A137	M119-N133 HydrophobicContact CE-CB 3.82Å; M119-N133 WeakPolarHBondContact CE-O 3.35Å; Q126-N133 PolarHBondContact NE2-ND2 3.16Å; W128-N133 PolarHBondContact O-ND2 3.24Å; L129-N133 WeakPolarHBondContact CA-OD1 3.46Å; D130-N133 PolarHBondContact N-OD1 3.21Å; D130-N133 PolarHBondContact O-N 2.67Å; D130-N133 PolarHBondContact O-OD1 3.44Å; D130-N133 VanDerWaalsContact O-OD1 3.06Å; D130-N133 PolarHBondContact OD1-N 2.99Å; N133-E135 VanDerWaalsContact C-N 3.25Å; N133-E135 PolarHBondContact O-N 2.87Å; N133-E135 VanDerWaalsContact O-N 3.16Å; N133-Q136 PolarHBondContact O-N 2.63Å; N133-Q136 VanDerWaalsContact O-N 3.16Å; N133-A137 PolarHBondContact O-N 3.26Å
134	V	93.6	Very high	88.9	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-56.1	-35	-177.6	63.1	0	0	0	0	114.1	I88 F92 D130 M131 A137 L138 L205	I88-V134 HydrophobicContact CD1-CB 4.17Å; I88-V134 HydrophobicContact CD1-CG2 4.24Å; I88-V134 HydrophobicContact CG1-CG2 4.32Å; I88-V134 HydrophobicContact CG2-CB 4.46Å; I88-V134 HydrophobicContact CG2-CG2 3.67Å; F92-V134 HydrophobicContact CD2-CG2 4.06Å; F92-V134 HydrophobicContact CE2-CG2 3.77Å; D130-V134 WeakPolarHBondContact O-CB 3.29Å; D130-V134 PolarHBondContact O-N 2.68Å; M131-V134 HydrophobicContact SD-CG1 3.97Å; V134-A137 PolarHBondContact O-N 3.26Å; V134-L138 VanDerWaalsContact O-CB 3.31Å; V134-L138 WeakPolarHBondContact O-CB 3.49Å; V134-L138 PolarHBondContact O-N 2.81Å; V134-L205 HydrophobicContact CG1-CD1 3.55Å; V134-L205 HydrophobicContact CG2-CD1 4.31Å
135	E	92.4	Very high	89.8	Confident	108 Å²	108	43.6 Å²	43.6	51%	0.505	23%	0.228	S	C	.	.	H	α-helix	trans	-70	-43.1	-179.7	-172.1	170.4	-164.8	0	0	111.5	N133 A137 L138 F139 L205	N133-E135 VanDerWaalsContact C-N 3.25Å; N133-E135 PolarHBondContact O-N 2.87Å; N133-E135 VanDerWaalsContact O-N 3.16Å; E135-A137 VanDerWaalsContact C-N 3.34Å; E135-L138 PolarHBondContact O-N 3.47Å; E135-F139 WeakPolarHBondContact O-CB 3.39Å; E135-F139 PolarHBondContact O-N 3.31Å; E135-L205 HydrophobicContact CB-CD2 4.11Å; E135-L205 HydrophobicContact CG-CD2 4.06Å
136	Q	91.7	Very high	90.7	Very high	97 Å²	97	41.8 Å²	41.8	45%	0.453	22%	0.218	S	C	.	.	H	α-helix	trans	-63.8	-41	173.3	-176.8	179.5	-3	0	0	111.1	M119 E122 N133 F139 A140	M119-Q136 HydrophobicContact CE-CB 3.97Å; M119-Q136 HydrophobicContact CE-CG 4.02Å; M119-Q136 HydrophobicContact SD-CG 4.18Å; E122-Q136 PolarHBondContact OE2-NE2 2.91Å; N133-Q136 PolarHBondContact O-N 2.63Å; N133-Q136 VanDerWaalsContact O-N 3.16Å; Q136-F139 PolarHBondContact O-N 2.77Å; Q136-A140 WeakPolarHBondContact O-CB 3.47Å; Q136-A140 PolarHBondContact O-N 3.39Å
137	A	92.9	Very high	91.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-43.4	178.1	0	0	0	0	0	112.2	I94 L116 M119 L129 N133 V134 E135 A140 R141	I94-A137 HydrophobicContact CD1-CB 3.77Å; L116-A137 HydrophobicContact CD1-CB 3.78Å; L116-A137 WeakPolarHBondContact CD1-O 3.09Å; M119-A137 HydrophobicContact CE-CB 3.82Å; M119-A137 WeakPolarHBondContact SD-CA 3.09Å; M119-A137 HydrophobicContact SD-CB 3.57Å; M119-A137 VanDerWaalsContact SD-CB 3.57Å; L129-A137 HydrophobicContact CD2-CB 3.53Å; N133-A137 PolarHBondContact O-N 3.26Å; V134-A137 PolarHBondContact O-N 3.26Å; E135-A137 VanDerWaalsContact C-N 3.34Å; A137-A140 PolarHBondContact O-N 2.87Å; A137-R141 WeakPolarHBondContact O-CB 3.43Å; A137-R141 PolarHBondContact O-N 3.46Å
138	L	95	Very high	91.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-45.2	175	-175.6	58.2	0	0	0	110.8	F92 V134 E135 A140 R141 L142 Y176 L177 N209	F92-L138 HydrophobicContact CD1-CD1 3.6Å; F92-L138 HydrophobicContact CD1-CD2 4.03Å; F92-L138 HydrophobicContact CD1-CG 4.4Å; F92-L138 HydrophobicContact CE1-CD1 3.99Å; F92-L138 HydrophobicContact CE1-CD2 3.52Å; F92-L138 HydrophobicContact CE1-CG 4.36Å; F92-L138 HydrophobicContact CG-CD1 4.36Å; F92-L138 HydrophobicContact CZ-CD2 4.09Å; V134-L138 VanDerWaalsContact O-CB 3.31Å; V134-L138 WeakPolarHBondContact O-CB 3.49Å; V134-L138 PolarHBondContact O-N 2.81Å; E135-L138 PolarHBondContact O-N 3.47Å; L138-A140 PolarHBondContact O-N 3.21Å; L138-R141 WeakPolarHBondContact O-CB 3.31Å; L138-R141 PolarHBondContact O-N 2.86Å; L138-R141 VanDerWaalsContact O-N 3.16Å; L138-L142 WeakPolarHBondContact O-CG 3.47Å; L138-L142 PolarHBondContact O-N 2.82Å; L138-Y176 HydrophobicContact CD1-CE1 3.8Å; L138-L177 HydrophobicContact CD1-CD2 4.4Å; L138-L177 HydrophobicContact CD2-CD2 4.47Å; L138-N209 HydrophobicContact CD2-CB 4.08Å; L138-N209 WeakPolarHBondContact CD2-ND2 3.3Å
139	F	93.6	Very high	91.8	Very high	73 Å²	73	44.2 Å²	44.2	32%	0.32	24%	0.241	S	C	.	.	H	α-helix	trans	-59.8	-46.4	176.9	-174.8	-110.6	0	0	0	112.1	E135 Q136 R141 L142 L143 I219	E135-F139 WeakPolarHBondContact O-CB 3.39Å; E135-F139 PolarHBondContact O-N 3.31Å; Q136-F139 PolarHBondContact O-N 2.77Å; F139-R141 VanDerWaalsContact C-N 3.3Å; F139-R141 PolarHBondContact O-N 3.07Å; F139-L142 PolarHBondContact O-N 3.49Å; F139-L143 HydrophobicContact CD1-CD1 4.01Å; F139-L143 HydrophobicContact CE1-CD1 3.54Å; F139-L143 HydrophobicContact CE1-CG 4.25Å; F139-L143 HydrophobicContact CZ-CD1 3.93Å; F139-L143 HydrophobicContact CZ-CD2 4.24Å; F139-L143 HydrophobicContact CZ-CG 4.28Å; F139-L143 WeakPolarHBondContact O-CG 3.46Å; F139-L143 PolarHBondContact O-N 3.19Å; F139-L143 VanDerWaalsContact O-N 3.16Å; F139-I219 HydrophobicContact CZ-CG2 4.41Å
140	A	92.9	Very high	91.9	Very high	30 Å²	30	47.4 Å²	47.4	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-42.7	174.3	0	0	0	0	0	111.7	L116 Q136 A137 L138 L142 L143 L144	L116-A140 HydrophobicContact CD1-CB 4.47Å; Q136-A140 WeakPolarHBondContact O-CB 3.47Å; Q136-A140 PolarHBondContact O-N 3.39Å; A137-A140 PolarHBondContact O-N 2.87Å; L138-A140 PolarHBondContact O-N 3.21Å; A140-L142 VanDerWaalsContact C-N 3.28Å; A140-L142 PolarHBondContact O-N 3.23Å; A140-L143 PolarHBondContact O-N 3.36Å; A140-L144 PolarHBondContact O-N 2.91Å
141	R	94.4	Very high	91.9	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-35.2	175.1	173.6	58.8	-176.7	78.4	-2.1	113.1	I94 L116 A137 L138 F139 P147 A168 E170 Y176	I94-R141 HydrophobicContact CG2-CB 3.8Å; I94-R141 HydrophobicContact CG2-CG 3.55Å; L116-R141 HydrophobicContact CD2-CB 4.1Å; A137-R141 WeakPolarHBondContact O-CB 3.43Å; A137-R141 PolarHBondContact O-N 3.46Å; L138-R141 WeakPolarHBondContact O-CB 3.31Å; L138-R141 PolarHBondContact O-N 2.86Å; L138-R141 VanDerWaalsContact O-N 3.16Å; F139-R141 VanDerWaalsContact C-N 3.3Å; F139-R141 PolarHBondContact O-N 3.07Å; R141-P147 VanDerWaalsContact CZ-CG 3.45Å; R141-A168 PolarHBondContact NH2-O 3.22Å; R141-E170 PolarHBondContact NH2-O 3.32Å; R141-Y176 HydrophobicContact CG-CE1 3.97Å
142	L	94.4	Very high	91.9	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-75.5	-24.9	179	-63	-175.3	0	0	0	113	L138 F139 A140 I173 Y176 L177 N209 V213 Y220	L138-L142 WeakPolarHBondContact O-CG 3.47Å; L138-L142 PolarHBondContact O-N 2.82Å; F139-L142 PolarHBondContact O-N 3.49Å; A140-L142 VanDerWaalsContact C-N 3.28Å; A140-L142 PolarHBondContact O-N 3.23Å; L142-I173 HydrophobicContact CD1-CG2 4.37Å; L142-I173 HydrophobicContact CD2-CG1 4.44Å; L142-I173 HydrophobicContact CD2-CG2 3.87Å; L142-I173 WeakPolarHBondContact O-CD1 3.33Å; L142-Y176 HydrophobicContact CD2-CD1 3.64Å; L142-Y176 HydrophobicContact CD2-CE1 3.8Å; L142-L177 HydrophobicContact CD1-CD1 4.08Å; L142-L177 HydrophobicContact CD1-CD2 4.27Å; L142-L177 HydrophobicContact CD2-CD1 4.43Å; L142-L177 HydrophobicContact CD2-CD2 4.22Å; L142-L177 HydrophobicContact CD2-CG 4.19Å; L142-N209 HydrophobicContact CD1-CB 4.27Å; L142-V213 HydrophobicContact CD1-CG2 3.95Å; L142-Y220 HydrophobicContact CB-CD1 4.43Å; L142-Y220 HydrophobicContact CB-CE1 3.72Å
143	L	93.2	Very high	91.8	Very high	76 Å²	76	46.3 Å²	46.3	40%	0.398	24%	0.241	S	C	.	.	H	α-helix	trans	-80.4	-14.3	177.4	-65.8	-179.3	0	0	0	113.9	F139 A140 Q145 I219 Y220	F139-L143 HydrophobicContact CD1-CD1 4.01Å; F139-L143 HydrophobicContact CE1-CD1 3.54Å; F139-L143 HydrophobicContact CE1-CG 4.25Å; F139-L143 HydrophobicContact CZ-CD1 3.93Å; F139-L143 HydrophobicContact CZ-CD2 4.24Å; F139-L143 HydrophobicContact CZ-CG 4.28Å; F139-L143 WeakPolarHBondContact O-CG 3.46Å; F139-L143 PolarHBondContact O-N 3.19Å; F139-L143 VanDerWaalsContact O-N 3.16Å; A140-L143 PolarHBondContact O-N 3.36Å; L143-Q145 PolarHBondContact O-N 2.99Å; L143-I219 HydrophobicContact CD2-CG2 3.64Å; L143-Y220 HydrophobicContact CD2-CD1 4.07Å; L143-Y220 HydrophobicContact CD2-CE1 3.98Å
144	L	92.2	Very high	91.5	Very high	40 Å²	40	46.2 Å²	46.2	21%	0.209	24%	0.241	C	C	.	.			trans	-66.8	120	177.1	-68.6	177.1	0	0	0	111.3	V114 L116 A140 P147	V114-L144 HydrophobicContact CG1-CD1 3.64Å; L116-L144 HydrophobicContact CD2-CD1 3.95Å; A140-L144 PolarHBondContact O-N 2.91Å; L144-P147 HydrophobicContact CB-CG 4.21Å
145	Q	87.3	Confident	90.9	Very high	111 Å²	111	47.9 Å²	47.9	52%	0.519	25%	0.251	S	S	.	.	S	Bend	trans	-67.7	-36.7	179.1	-67.2	-172.1	-13.7	0	0	113.3	L143 R171	L143-Q145 PolarHBondContact O-N 2.99Å; Q145-R171 PolarHBondContact O-NE 3.44Å; Q145-R171 VanDerWaalsContact O-NE 3.17Å
146	D	89.9	Confident	89.9	Confident	66 Å²	66	46.7 Å²	46.7	35%	0.353	26%	0.255	S	S	.	.			trans	-134.8	83.3	178.4	-166.4	5.2	0	0	0	111	G148 N149 H150	D146-G148 PolarHBondContact O-N 3.21Å; D146-G148 PolarHBondContact OD1-N 3.27Å; D146-N149 VanDerWaalsContact CG-ND2 3.31Å; D146-N149 PolarHBondContact O-N 3.48Å; D146-N149 VanDerWaalsContact OD2-CG 3.31Å; D146-N149 PolarHBondContact OD2-ND2 3.19Å; D146-N149 PolarHBondContact OD2-OD1 3.44Å; D146-H150 PolarHBondContact O-ND1 2.56Å
147	P	91.6	Very high	88.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-61.9	-24.7	-179.3	-21.2	33.1	0	0	0	113.2	V114 R141 L144 N149 H150	V114-P147 HydrophobicContact CG2-CB 4.1Å; R141-P147 VanDerWaalsContact CZ-CG 3.45Å; L144-P147 HydrophobicContact CB-CG 4.21Å; P147-N149 PolarHBondContact O-N 2.85Å; P147-H150 PolarHBondContact O-N 2.86Å
148	G	90.3	Very high	87	Confident	29 Å²	29	52.1 Å²	52.1	30%	0.299	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-60	-30.9	177.9	0	0	0	0	0	113.7	D146 H150 L151	D146-G148 PolarHBondContact O-N 3.21Å; D146-G148 PolarHBondContact OD1-N 3.27Å; G148-H150 PolarHBondContact O-N 2.93Å; G148-L151 WeakPolarHBondContact O-CG 3.37Å
149	N	92.2	Very high	85.5	Confident	126 Å²	126	57.1 Å²	57.1	67%	0.674	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-74	-13	177.9	-66.7	-27.6	0	0	0	113.6	D146 P147	D146-N149 VanDerWaalsContact CG-ND2 3.31Å; D146-N149 PolarHBondContact O-N 3.48Å; D146-N149 VanDerWaalsContact OD2-CG 3.31Å; D146-N149 PolarHBondContact OD2-ND2 3.19Å; D146-N149 PolarHBondContact OD2-OD1 3.44Å; P147-N149 PolarHBondContact O-N 2.85Å
150	H	91.9	Very high	84.3	Confident	67 Å²	67	60.2 Å²	60.2	31%	0.31	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-108	13.3	-175.4	-57.1	85.3	0	0	0	111.7	V114 Y115 D146 P147 G148	V114-H150 WeakPolarHBondContact CA-O 3.5Å; V114-H150 HydrophobicContact CG1-CB 3.87Å; Y115-H150 PolarHBondContact N-O 3.2Å; D146-H150 PolarHBondContact O-ND1 2.56Å; P147-H150 PolarHBondContact O-N 2.86Å; G148-H150 PolarHBondContact O-N 2.93Å
151	L	91.4	Very high	83.6	Confident	37 Å²	37	62.3 Å²	62.3	19%	0.194	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.5	-178	-70.7	174.5	0	0	0	112.1	C113 V114 G148 D165 A168	C113-L151 WeakPolarHBondContact O-CA 3.4Å; V114-L151 HydrophobicContact CG2-CD2 3.79Å; G148-L151 WeakPolarHBondContact O-CG 3.37Å; L151-D165 HydrophobicContact CD1-CB 4.42Å; L151-A168 HydrophobicContact CD2-CB 3.51Å
152	I	89.5	Confident	82.9	Confident	26 Å²	26	68.1 Å²	68.1	13%	0.133	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	154.7	172	68.2	166.2	0	0	0	111.7	T95 D97 R112 C113 M154	T95-I152 HydrophobicContact CG2-CD1 3.52Å; T95-I152 HydrophobicContact CG2-CG1 3.94Å; D97-I152 WeakPolarHBondContact O-CD1 3.44Å; R112-I152 WeakPolarHBondContact CD-O 3.27Å; C113-I152 PolarHBondContact N-O 2.79Å; C113-I152 PolarHBondContact O-N 3.09Å; I152-M154 HydrophobicContact CD1-SD 3.78Å; I152-M154 HydrophobicContact CG1-SD 4.03Å
153	N	86.6	Confident	82.4	Confident	72 Å²	72	69.9 Å²	69.9	39%	0.385	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	132.5	169.8	-73.1	-26.6	0	0	0	109	P101 R112	P101-N153 HydrophobicContact CG-CB 4.04Å; P101-N153 WeakPolarHBondContact CG-O 3.31Å; R112-N153 VanDerWaalsContact CD-OD1 3.32Å; R112-N153 WeakPolarHBondContact CD-OD1 3.47Å; R112-N153 PolarHBondContact NE-OD1 3.22Å; R112-N153 PolarHBondContact NH1-OD1 3.06Å
154	M	84.1	Confident	82	Confident	3 Å²	3	67 Å²	67	2%	0.015	39%	0.385	C	S	.	.			trans	-104.8	-14.8	177.4	-66.2	-61.6	-78.3	0	0	112.5	T95 K104 I109 P110 S111 C113 I152	T95-M154 HydrophobicContact CG2-CE 4.23Å; T95-M154 HydrophobicContact CG2-SD 3.85Å; K104-M154 HydrophobicContact CD-CE 4.36Å; K104-M154 HydrophobicContact CD-SD 4.45Å; K104-M154 PolarHBondContact NZ-SD 2.98Å; K104-M154 VanDerWaalsContact NZ-SD 3.41Å; I109-M154 HydrophobicContact CG2-CB 3.91Å; I109-M154 HydrophobicContact CG2-CE 3.81Å; I109-M154 HydrophobicContact CG2-CG 4.41Å; P110-M154 WeakPolarHBondContact O-CB 3.42Å; S111-M154 PolarHBondContact O-N 3.33Å; C113-M154 HydrophobicContact CB-CG 3.88Å; C113-M154 HydrophobicContact CB-SD 4.23Å; I152-M154 HydrophobicContact CD1-SD 3.78Å; I152-M154 HydrophobicContact CG1-SD 4.03Å
155	T	81.4	Confident	81.6	Confident	37 Å²	37	66.5 Å²	66.5	23%	0.227	38%	0.382	C	S	.	.	S	Bend	trans	-125.5	147.4	178.3	59.3	0	0	0	0	109.9	S157	T155-S157 PolarHBondContact O-N 3.42Å
156	S	71.9	Confident	81.6	Confident	83 Å²	83	68 Å²	68	58%	0.58	38%	0.383	S	S	*	.	S	Bend	trans	-70.3	7.1	-176.1	-14.5	0	0	0	0	114.9	P101 T158	P101-S156 PolarHBondContact O-OG 3.31Å; S156-T158 PolarHBondContact O-N 3.16Å
157	S	65.8	Low	81.5	Confident	65 Å²	65	67.3 Å²	67.3	46%	0.455	38%	0.379	S	S	.	.			trans	-72.5	124.6	179.7	-171.6	0	0	0	0	111.6	T155 T159	T155-S157 PolarHBondContact O-N 3.42Å; S157-T159 PolarHBondContact OG-OG1 3.24Å
158	T	56.8	Low	81.4	Confident	146 Å²	146	67.3 Å²	67.3	90%	0.896	38%	0.379	S	S	*	.			trans	-87.4	0.8	179.9	41.7	0	0	0	0	114	S156	S156-T158 PolarHBondContact O-N 3.16Å
159	T	64.1	Low	81.5	Confident	105 Å²	105	66.6 Å²	66.6	64%	0.644	37%	0.373	S	S	*	.	S	Bend	trans	-77.2	124.8	175.7	48.4	0	0	0	0	111.3	S157 N161	S157-T159 PolarHBondContact OG-OG1 3.24Å; T159-N161 PolarHBondContact O-N 3.4Å; T159-N161 VanDerWaalsContact O-N 3.07Å
160	L	68.5	Low	81.5	Confident	138 Å²	138	62.7 Å²	62.7	72%	0.723	35%	0.35	S	S	*	.			trans	-58.2	108.8	174	-115.4	131.8	0	0	0	110.6	L162	L160-L162 HydrophobicContact CD2-CD2 3.61Å; L160-L162 HydrophobicContact CD2-CG 4.21Å
161	N	77.4	Confident	81.6	Confident	73 Å²	73	65.2 Å²	65.2	39%	0.39	36%	0.357	S	S	.	.			trans	-100.6	80	175.6	-171.4	-14.3	0	0	0	109.9	T159 S163 A164 D165	T159-N161 PolarHBondContact O-N 3.4Å; T159-N161 VanDerWaalsContact O-N 3.07Å; N161-S163 PolarHBondContact O-N 3.41Å; N161-S163 VanDerWaalsContact O-N 3.08Å; N161-S163 PolarHBondContact OD1-N 3.23Å; N161-A164 HydrophobicContact CB-CB 4.04Å; N161-A164 PolarHBondContact O-N 3.12Å; N161-A164 PolarHBondContact OD1-N 2.98Å; N161-D165 PolarHBondContact O-N 3.34Å; N161-D165 VanDerWaalsContact O-OD1 3.09Å
162	L	81.1	Confident	81.7	Confident	127 Å²	127	67.7 Å²	67.7	67%	0.665	37%	0.367	S	S	*	.	H	α-helix	trans	-55.2	-28.5	-177.8	-66.5	170.1	0	0	0	113.6	L160 R166	L160-L162 HydrophobicContact CD2-CD2 3.61Å; L160-L162 HydrophobicContact CD2-CG 4.21Å; L162-R166 WeakPolarHBondContact O-CB 3.3Å; L162-R166 PolarHBondContact O-N 2.57Å; L162-R166 VanDerWaalsContact O-N 3.15Å
163	S	83.4	Confident	81.9	Confident	41 Å²	41	66.7 Å²	66.7	29%	0.287	36%	0.362	S	S	.	.	H	α-helix	trans	-70.1	-47.3	174.9	-169	0	0	0	0	111	N161 D165 R166 D167	N161-S163 PolarHBondContact O-N 3.41Å; N161-S163 VanDerWaalsContact O-N 3.08Å; N161-S163 PolarHBondContact OD1-N 3.23Å; S163-D165 VanDerWaalsContact C-N 3.33Å; S163-D165 PolarHBondContact O-N 3.02Å; S163-R166 PolarHBondContact O-N 3.09Å; S163-D167 WeakPolarHBondContact O-CB 3.36Å; S163-D167 PolarHBondContact O-N 3.42Å; S163-D167 PolarHBondContact OG-OD2 3.45Å
164	A	83.8	Confident	82.2	Confident	15 Å²	15	63.2 Å²	63.2	12%	0.124	34%	0.344	C	S	.	.	H	α-helix	trans	-66.1	-36.4	179.8	0	0	0	0	0	112.3	S111 R112 N161 A168	S111-A164 WeakPolarHBondContact OG-CB 3.46Å; R112-A164 HydrophobicContact CB-CB 4.12Å; R112-A164 HydrophobicContact CG-CB 3.85Å; N161-A164 HydrophobicContact CB-CB 4.04Å; N161-A164 PolarHBondContact O-N 3.12Å; N161-A164 PolarHBondContact OD1-N 2.98Å; A164-A168 WeakPolarHBondContact O-CB 3.31Å; A164-A168 PolarHBondContact O-N 3.01Å
165	D	85.3	Confident	82.6	Confident	30 Å²	30	64 Å²	64	16%	0.16	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-46.3	174.5	-67	19	0	0	0	110.6	R112 L151 N161 S163 G169	R112-D165 VanDerWaalsContact CG-OD1 3.31Å; R112-D165 WeakPolarHBondContact CG-OD1 3.47Å; R112-D165 IonicContact CZ-OD1 3.32Å; R112-D165 IonicContact CZ-OD2 3.48Å; R112-D165 IonicContact NE-OD1 2.92Å; R112-D165 PolarHBondContact NE-OD1 3.45Å; R112-D165 IonicContact NE-OD2 2.92Å; R112-D165 IonicContact NH2-OD1 2.72Å; R112-D165 PolarHBondContact NH2-OD1 3.33Å; R112-D165 IonicContact NH2-OD2 3.74Å; R112-D165 PolarHBondContact NH2-OD2 2.91Å; L151-D165 HydrophobicContact CD1-CB 4.42Å; N161-D165 PolarHBondContact O-N 3.34Å; N161-D165 VanDerWaalsContact O-OD1 3.09Å; S163-D165 VanDerWaalsContact C-N 3.33Å; S163-D165 PolarHBondContact O-N 3.02Å; D165-G169 WeakPolarHBondContact O-CA 3.47Å; D165-G169 PolarHBondContact O-N 3.02Å
166	R	87.2	Confident	83.3	Confident	143 Å²	143	62.3 Å²	62.3	54%	0.54	34%	0.339	S	S	.	.	H	α-helix	trans	-65.2	-46.8	177.4	-175.6	-166.8	65.5	177.8	5.1	112	L162 S163 G169 E170	L162-R166 WeakPolarHBondContact O-CB 3.3Å; L162-R166 PolarHBondContact O-N 2.57Å; L162-R166 VanDerWaalsContact O-N 3.15Å; S163-R166 PolarHBondContact O-N 3.09Å; R166-G169 CarbonylContact O-C 3.58Å; R166-G169 PolarHBondContact O-N 3.03Å; R166-E170 PolarHBondContact O-N 2.94Å
167	D	87.8	Confident	84.4	Confident	50 Å²	50	58.3 Å²	58.3	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-70	-36.8	-173.3	-59.5	-17.4	0	0	0	111.4	L93 S163	L93-D167 HydrophobicContact CD1-CB 4.22Å; S163-D167 WeakPolarHBondContact O-CB 3.36Å; S163-D167 PolarHBondContact O-N 3.42Å; S163-D167 PolarHBondContact OG-OD2 3.45Å
168	A	89.7	Confident	85.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-77.4	-37.6	173.8	0	0	0	0	0	112.3	L93 R112 V114 R141 L151 A164 E170	L93-A168 HydrophobicContact CB-CB 4.02Å; L93-A168 HydrophobicContact CD1-CB 4.1Å; R112-A168 HydrophobicContact CB-CB 4.04Å; V114-A168 VanDerWaalsContact CG2-O 3.31Å; V114-A168 WeakPolarHBondContact CG2-O 3.31Å; R141-A168 PolarHBondContact NH2-O 3.22Å; L151-A168 HydrophobicContact CD2-CB 3.51Å; A164-A168 WeakPolarHBondContact O-CB 3.31Å; A164-A168 PolarHBondContact O-N 3.01Å; A168-E170 VanDerWaalsContact C-N 3.29Å; A168-E170 PolarHBondContact O-N 2.92Å
169	G	91.6	Very high	87.6	Confident	15 Å²	15	50 Å²	50	16%	0.155	26%	0.258	C	S	.	.	S	Bend	trans	-83.8	8.2	-179	0	0	0	0	0	115	D165 R166 R171	D165-G169 WeakPolarHBondContact O-CA 3.47Å; D165-G169 PolarHBondContact O-N 3.02Å; R166-G169 CarbonylContact O-C 3.58Å; R166-G169 PolarHBondContact O-N 3.03Å; G169-R171 PolarHBondContact O-N 2.9Å
170	E	93	Very high	89.1	Confident	44 Å²	44	45 Å²	45	21%	0.206	23%	0.228	C	C	.	.			trans	-54.7	124.8	-178.4	179	55.6	-104.9	0	0	110.8	R141 R166 A168 H172 C175	R141-E170 PolarHBondContact NH2-O 3.32Å; R166-E170 PolarHBondContact O-N 2.94Å; A168-E170 VanDerWaalsContact C-N 3.29Å; A168-E170 PolarHBondContact O-N 2.92Å; E170-H172 WeakPolarHBondContact OE1-CB 3.43Å; E170-H172 IonicContact OE1-CG 3.96Å; E170-H172 PolarHBondContact OE1-N 3.46Å; E170-H172 IonicContact OE1-ND1 3Å; E170-H172 PolarHBondContact OE1-ND1 3.34Å; E170-C175 HydrophobicContact CG-CB 4.16Å
171	R	92.5	Very high	90.4	Very high	120 Å²	120	38.5 Å²	38.5	45%	0.453	19%	0.194	S	C	.	.			trans	-90.8	-30.4	-173.9	-176.2	176.1	179.2	-156.3	-7.2	112	Q145 G169 I173 Q223	Q145-R171 PolarHBondContact O-NE 3.44Å; Q145-R171 VanDerWaalsContact O-NE 3.17Å; G169-R171 PolarHBondContact O-N 2.9Å; R171-I173 PolarHBondContact O-N 3.46Å; R171-Q223 PolarHBondContact O-NE2 3.49Å; R171-Q223 VanDerWaalsContact O-NE2 3.08Å; R171-Q223 PolarHBondContact O-OE1 3.28Å
172	H	93.6	Very high	91.1	Very high	88 Å²	88	37 Å²	37	41%	0.407	18%	0.184	S	C	.	.			trans	-80.3	111.8	179.6	-57.4	97.3	0	0	0	109.3	E170 F174 C175 Y176 Q228	E170-H172 WeakPolarHBondContact OE1-CB 3.43Å; E170-H172 IonicContact OE1-CG 3.96Å; E170-H172 PolarHBondContact OE1-N 3.46Å; E170-H172 IonicContact OE1-ND1 3Å; E170-H172 PolarHBondContact OE1-ND1 3.34Å; H172-F174 VanDerWaalsContact C-N 3.27Å; H172-F174 PolarHBondContact O-N 2.85Å; H172-C175 HydrophobicContact CB-CB 4.02Å; H172-C175 PolarHBondContact O-N 3.38Å; H172-Y176 WeakPolarHBondContact O-CB 3.44Å; H172-Y176 PolarHBondContact O-N 2.88Å; H172-Q228 HydrophobicContact CB-CG 4.05Å
173	I	94.8	Very high	91.7	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-54.6	-44.2	-175.4	-69.5	168.2	0	0	0	111.5	L142 R171 Y176 L177 V213 Y220 Q223 I225	L142-I173 HydrophobicContact CD1-CG2 4.37Å; L142-I173 HydrophobicContact CD2-CG1 4.44Å; L142-I173 HydrophobicContact CD2-CG2 3.87Å; L142-I173 WeakPolarHBondContact O-CD1 3.33Å; R171-I173 PolarHBondContact O-N 3.46Å; I173-Y176 PolarHBondContact O-N 2.93Å; I173-L177 HydrophobicContact CG2-CD1 3.87Å; I173-L177 HydrophobicContact CG2-CG 4.49Å; I173-L177 WeakPolarHBondContact O-CG 3.37Å; I173-L177 PolarHBondContact O-N 2.94Å; I173-V213 HydrophobicContact CG2-CB 4.42Å; I173-V213 HydrophobicContact CG2-CG1 3.87Å; I173-V213 HydrophobicContact CG2-CG2 3.67Å; I173-Y220 HydrophobicContact CD1-CD1 3.3Å; I173-Y220 HydrophobicContact CD1-CE1 4.06Å; I173-Y220 HydrophobicContact CD1-CG 3.55Å; I173-Q223 HydrophobicContact CD1-CB 4.38Å; I173-Q223 HydrophobicContact CD1-CG 3.87Å; I173-I225 HydrophobicContact CB-CD1 4.25Å; I173-I225 HydrophobicContact CD1-CD1 4.23Å
174	F	93.1	Very high	92.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-42.7	-177.1	-146.4	-79.7	0	0	0	111.8	H172 L177 Y178 T210 L214 I225 Q228 L229 L232 F255 L256	H172-F174 VanDerWaalsContact C-N 3.27Å; H172-F174 PolarHBondContact O-N 2.85Å; F174-L177 PolarHBondContact O-N 3.33Å; F174-Y178 WeakPolarHBondContact O-CB 3.33Å; F174-Y178 PolarHBondContact O-N 3.44Å; F174-T210 HydrophobicContact CD2-CG2 4.24Å; F174-T210 HydrophobicContact CE1-CG2 4.29Å; F174-T210 HydrophobicContact CE2-CG2 3.53Å; F174-T210 HydrophobicContact CZ-CG2 3.55Å; F174-L214 HydrophobicContact CE2-CD1 3.92Å; F174-L214 HydrophobicContact CE2-CD2 3.93Å; F174-L214 HydrophobicContact CE2-CG 3.92Å; F174-L214 HydrophobicContact CZ-CD1 4.31Å; F174-I225 HydrophobicContact CD2-CG2 3.95Å; F174-I225 HydrophobicContact CE2-CG2 4.47Å; F174-Q228 HydrophobicContact CB-CB 3.77Å; F174-L229 HydrophobicContact CD1-CB 4.5Å; F174-L229 HydrophobicContact CD1-CD1 4.42Å; F174-L229 HydrophobicContact CE1-CB 4.36Å; F174-L229 HydrophobicContact CE1-CD1 3.66Å; F174-L229 HydrophobicContact CE2-CB 4.39Å; F174-L229 HydrophobicContact CZ-CB 4.31Å; F174-L229 HydrophobicContact CZ-CD1 3.8Å; F174-L229 HydrophobicContact CZ-CG 4.44Å; F174-L232 HydrophobicContact CD1-CD2 3.94Å; F174-L232 HydrophobicContact CE1-CD2 4.27Å; F174-F255 HydrophobicContact CD1-CE1 4.43Å; F174-F255 AromaticContact CE1-CE1 3.77Å; F174-F255 HydrophobicContact CE1-CE1 3.77Å; F174-F255 HydrophobicContact CZ-CE1 4.35Å; F174-L256 HydrophobicContact CE1-CD2 4.08Å; F174-L256 HydrophobicContact CZ-CD2 4.09Å
175	C	92.6	Very high	92.6	Very high	20 Å²	20	33.4 Å²	33.4	14%	0.135	15%	0.154	C	C	.	.	H	α-helix	trans	-65.7	-39.1	176.6	-59	0	0	0	0	111.8	E170 H172 S179	E170-C175 HydrophobicContact CG-CB 4.16Å; H172-C175 HydrophobicContact CB-CB 4.02Å; H172-C175 PolarHBondContact O-N 3.38Å; C175-S179 WeakPolarHBondContact O-CB 3.39Å; C175-S179 PolarHBondContact O-N 3.44Å; C175-S179 PolarHBondContact O-OG 3.09Å
176	Y	95.1	Very high	92.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.9	-48.8	175.3	169.1	-103.7	0	0	0	111.5	F92 L138 R141 L142 H172 I173 Y178 S179 C180	F92-Y176 WeakPolarHBondContact O-CE2 3.47Å; F92-Y176 PolarHBondContact O-OH 2.95Å; L138-Y176 HydrophobicContact CD1-CE1 3.8Å; R141-Y176 HydrophobicContact CG-CE1 3.97Å; L142-Y176 HydrophobicContact CD2-CD1 3.64Å; L142-Y176 HydrophobicContact CD2-CE1 3.8Å; H172-Y176 WeakPolarHBondContact O-CB 3.44Å; H172-Y176 PolarHBondContact O-N 2.88Å; I173-Y176 PolarHBondContact O-N 2.93Å; Y176-Y178 PolarHBondContact O-N 2.87Å; Y176-S179 CarbonylContact O-C 3.43Å; Y176-S179 WeakPolarHBondContact O-CB 3.45Å; Y176-S179 PolarHBondContact O-N 2.94Å; Y176-S179 VanDerWaalsContact O-N 3.14Å; Y176-C180 PolarHBondContact O-N 2.91Å; Y176-C180 PolarHBondContact O-SG 3.22Å
177	L	96.3	Very high	93.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-40	179.2	-72.5	171	0	0	0	112.6	L138 L142 I173 F174 S179 C180 F181 N209 T210 V213	L138-L177 HydrophobicContact CD1-CD2 4.4Å; L138-L177 HydrophobicContact CD2-CD2 4.47Å; L142-L177 HydrophobicContact CD1-CD1 4.08Å; L142-L177 HydrophobicContact CD1-CD2 4.27Å; L142-L177 HydrophobicContact CD2-CD1 4.43Å; L142-L177 HydrophobicContact CD2-CD2 4.22Å; L142-L177 HydrophobicContact CD2-CG 4.19Å; I173-L177 HydrophobicContact CG2-CD1 3.87Å; I173-L177 HydrophobicContact CG2-CG 4.49Å; I173-L177 WeakPolarHBondContact O-CG 3.37Å; I173-L177 PolarHBondContact O-N 2.94Å; F174-L177 PolarHBondContact O-N 3.33Å; L177-S179 VanDerWaalsContact C-N 3.33Å; L177-S179 PolarHBondContact O-N 3.33Å; L177-C180 WeakPolarHBondContact O-CB 3.36Å; L177-C180 PolarHBondContact O-N 2.96Å; L177-F181 PolarHBondContact O-N 2.95Å; L177-N209 HydrophobicContact CD1-CB 4.45Å; L177-N209 HydrophobicContact CD2-CB 4.06Å; L177-T210 WeakPolarHBondContact CB-OG1 3.41Å; L177-T210 WeakPolarHBondContact CD1-OG1 3.43Å; L177-V213 HydrophobicContact CD1-CG2 3.97Å
178	Y	94.9	Very high	93.4	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-59.8	-44.2	171.1	171.4	-105.3	0	0	0	111.8	F174 Y176 C180 F181 Q182 L232 I247 D251 V252 F255	F174-Y178 WeakPolarHBondContact O-CB 3.33Å; F174-Y178 PolarHBondContact O-N 3.44Å; Y176-Y178 PolarHBondContact O-N 2.87Å; Y178-C180 VanDerWaalsContact C-N 3.3Å; Y178-C180 PolarHBondContact O-N 3.11Å; Y178-F181 WeakPolarHBondContact O-CB 3.36Å; Y178-F181 PolarHBondContact O-N 3.11Å; Y178-F181 VanDerWaalsContact O-N 3.13Å; Y178-Q182 VanDerWaalsContact CE1-CD 3.42Å; Y178-Q182 HydrophobicContact CE1-CG 3.99Å; Y178-Q182 HydrophobicContact CE2-CG 4.08Å; Y178-Q182 VanDerWaalsContact CZ-CD 3.46Å; Y178-Q182 PolarHBondContact O-N 2.96Å; Y178-Q182 PolarHBondContact OH-NE2 2.88Å; Y178-L232 HydrophobicContact CD1-CD1 3.86Å; Y178-L232 HydrophobicContact CD1-CD2 4.24Å; Y178-L232 HydrophobicContact CD2-CD2 4.32Å; Y178-L232 HydrophobicContact CE1-CD1 4.27Å; Y178-L232 HydrophobicContact CG-CD1 4.33Å; Y178-L232 HydrophobicContact CG-CD2 3.85Å; Y178-I247 HydrophobicContact CE1-CG1 4.39Å; Y178-I247 HydrophobicContact CE1-CG2 4.03Å; Y178-D251 WeakPolarHBondContact OH-CB 3.42Å; Y178-V252 HydrophobicContact CD2-CG2 4.46Å; Y178-V252 HydrophobicContact CE1-CG2 4.17Å; Y178-V252 HydrophobicContact CE2-CB 4.28Å; Y178-V252 HydrophobicContact CE2-CG2 3.68Å; Y178-V252 VanDerWaalsContact CZ-CG2 3.49Å; Y178-V252 WeakPolarHBondContact OH-CG2 3.37Å; Y178-F255 HydrophobicContact CD2-CB 4.02Å; Y178-F255 AromaticContact CD2-CD1 3.65Å; Y178-F255 HydrophobicContact CD2-CD1 3.65Å; Y178-F255 HydrophobicContact CD2-CE1 4.25Å; Y178-F255 AromaticContact CD2-CG 3.91Å; Y178-F255 HydrophobicContact CD2-CG 3.91Å; Y178-F255 HydrophobicContact CE2-CB 4.23Å; Y178-F255 HydrophobicContact CG-CD1 4.43Å
179	S	93.3	Very high	93.5	Very high	34 Å²	34	36.3 Å²	36.3	24%	0.238	18%	0.18	C	C	.	.	H	α-helix	trans	-64.4	-36.6	177.1	-56.3	0	0	0	0	111.8	C175 Y176 L177 Q182 R183	C175-S179 WeakPolarHBondContact O-CB 3.39Å; C175-S179 PolarHBondContact O-N 3.44Å; C175-S179 PolarHBondContact O-OG 3.09Å; Y176-S179 CarbonylContact O-C 3.43Å; Y176-S179 WeakPolarHBondContact O-CB 3.45Å; Y176-S179 PolarHBondContact O-N 2.94Å; Y176-S179 VanDerWaalsContact O-N 3.14Å; L177-S179 VanDerWaalsContact C-N 3.33Å; L177-S179 PolarHBondContact O-N 3.33Å; S179-Q182 PolarHBondContact O-N 3.38Å; S179-R183 WeakPolarHBondContact O-CG 3.39Å; S179-R183 PolarHBondContact O-N 3.31Å
180	C	95.5	Very high	93.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-42.4	171.7	-66	0	0	0	0	111.3	F92 Y176 L177 Y178 R183 A184 T206	F92-C180 HydrophobicContact CD1-CB 3.99Å; F92-C180 HydrophobicContact CE1-CB 4.19Å; Y176-C180 PolarHBondContact O-N 2.91Å; Y176-C180 PolarHBondContact O-SG 3.22Å; L177-C180 WeakPolarHBondContact O-CB 3.36Å; L177-C180 PolarHBondContact O-N 2.96Å; Y178-C180 VanDerWaalsContact C-N 3.3Å; Y178-C180 PolarHBondContact O-N 3.11Å; C180-R183 PolarHBondContact O-N 3.24Å; C180-R183 PolarHBondContact SG-NH2 3.34Å; C180-A184 WeakPolarHBondContact O-CB 3.39Å; C180-A184 PolarHBondContact O-N 3.05Å; C180-T206 HydrophobicContact CB-CG2 3.47Å; C180-T206 VanDerWaalsContact CB-CG2 3.47Å
181	F	95.6	Very high	93.2	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-60.2	-45.6	176.2	178.2	-92.8	0	0	0	111.4	L177 Y178 A184 K185 R203 V207 F255 E258	L177-F181 PolarHBondContact O-N 2.95Å; Y178-F181 WeakPolarHBondContact O-CB 3.36Å; Y178-F181 PolarHBondContact O-N 3.11Å; Y178-F181 VanDerWaalsContact O-N 3.13Å; F181-A184 PolarHBondContact O-N 3.01Å; F181-K185 WeakPolarHBondContact O-CB 3.33Å; F181-K185 PolarHBondContact O-N 2.86Å; F181-R203 HydrophobicContact CD2-CG 3.6Å; F181-R203 HydrophobicContact CE2-CG 3.6Å; F181-V207 HydrophobicContact CD2-CG2 4Å; F181-V207 HydrophobicContact CE2-CG2 3.96Å; F181-F255 HydrophobicContact CB-CD2 3.76Å; F181-F255 HydrophobicContact CB-CE2 3.89Å; F181-F255 HydrophobicContact CD1-CB 3.88Å; F181-F255 AromaticContact CD1-CD2 3.8Å; F181-F255 HydrophobicContact CD1-CD2 3.8Å; F181-F255 HydrophobicContact CD1-CG 4.17Å; F181-F255 AromaticContact CD2-CD2 3.59Å; F181-F255 HydrophobicContact CD2-CD2 3.59Å; F181-F255 HydrophobicContact CD2-CE2 4.11Å; F181-F255 HydrophobicContact CE1-CB 3.86Å; F181-F255 HydrophobicContact CE1-CD2 4.27Å; F181-F255 HydrophobicContact CE2-CD2 4.07Å; F181-F255 HydrophobicContact CG-CB 4.41Å; F181-F255 AromaticContact CG-CD2 3.44Å; F181-F255 HydrophobicContact CG-CD2 3.44Å; F181-F255 VanDerWaalsContact CG-CD2 3.44Å; F181-F255 HydrophobicContact CG-CE2 4.02Å; F181-F255 HydrophobicContact CG-CG 4.24Å; F181-F255 HydrophobicContact CZ-CB 4.37Å; F181-F255 HydrophobicContact CZ-CD2 4.39Å; F181-E258 WeakPolarHBondContact CZ-OE1 3.25Å
182	Q	93.4	Very high	92.9	Very high	41 Å²	41	38.3 Å²	38.3	19%	0.192	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-46.9	175	-71.4	-169.8	-48.9	0	0	111.9	Y178 S179 A184 K185 E186	Y178-Q182 VanDerWaalsContact CE1-CD 3.42Å; Y178-Q182 HydrophobicContact CE1-CG 3.99Å; Y178-Q182 HydrophobicContact CE2-CG 4.08Å; Y178-Q182 VanDerWaalsContact CZ-CD 3.46Å; Y178-Q182 PolarHBondContact O-N 2.96Å; Y178-Q182 PolarHBondContact OH-NE2 2.88Å; S179-Q182 PolarHBondContact O-N 3.38Å; Q182-A184 VanDerWaalsContact C-N 3.34Å; Q182-A184 PolarHBondContact O-N 3.11Å; Q182-K185 WeakPolarHBondContact O-CB 3.47Å; Q182-K185 PolarHBondContact O-N 3.38Å; Q182-E186 PolarHBondContact O-N 2.96Å
183	R	93.4	Very high	92.5	Very high	46 Å²	46	42.6 Å²	42.6	17%	0.174	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-39.6	177.3	-71.7	-175.6	-62	-98.2	0.4	112.1	R90 I91 S179 C180 E186 E187	R90-R183 WeakPolarHBondContact O-CD 3.27Å; I91-R183 PolarHBondContact O-NE 3.04Å; I91-R183 PolarHBondContact O-NH2 3.4Å; I91-R183 VanDerWaalsContact O-NH2 3.11Å; S179-R183 WeakPolarHBondContact O-CG 3.39Å; S179-R183 PolarHBondContact O-N 3.31Å; C180-R183 PolarHBondContact O-N 3.24Å; C180-R183 PolarHBondContact SG-NH2 3.34Å; R183-E186 PolarHBondContact O-N 3.31Å; R183-E187 WeakPolarHBondContact O-CB 3.42Å; R183-E187 WeakPolarHBondContact O-CG 3.45Å; R183-E187 PolarHBondContact O-N 3.46Å
184	A	94.3	Very high	92.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-43.8	174.7	0	0	0	0	0	111.8	I91 C180 F181 Q182 E186 E187 I188 R203	I91-A184 HydrophobicContact CD1-CB 4.11Å; I91-A184 HydrophobicContact CG1-CB 4.36Å; I91-A184 HydrophobicContact CG2-CB 3.85Å; C180-A184 WeakPolarHBondContact O-CB 3.39Å; C180-A184 PolarHBondContact O-N 3.05Å; F181-A184 PolarHBondContact O-N 3.01Å; Q182-A184 VanDerWaalsContact C-N 3.34Å; Q182-A184 PolarHBondContact O-N 3.11Å; A184-E186 VanDerWaalsContact C-N 3.34Å; A184-E186 PolarHBondContact O-N 3.02Å; A184-E187 PolarHBondContact O-N 3.35Å; A184-I188 VanDerWaalsContact O-CG1 3.25Å; A184-I188 WeakPolarHBondContact O-CG1 3.37Å; A184-I188 PolarHBondContact O-N 3.31Å; A184-R203 HydrophobicContact CB-CB 3.85Å; A184-R203 HydrophobicContact CB-CG 4.14Å
185	K	92.6	Very high	91.9	Very high	63 Å²	63	46.8 Å²	46.8	27%	0.274	24%	0.239	S	C	.	.	H	α-helix	trans	-58.9	-44.6	174.8	-177.6	179.3	175.9	-179.2	0	111.3	F181 Q182 D251 E254	F181-K185 WeakPolarHBondContact O-CB 3.33Å; F181-K185 PolarHBondContact O-N 2.86Å; Q182-K185 WeakPolarHBondContact O-CB 3.47Å; Q182-K185 PolarHBondContact O-N 3.38Å; K185-D251 IonicContact NZ-OD1 3.05Å; K185-D251 PolarHBondContact NZ-OD1 2.85Å; K185-E254 IonicContact NZ-OE1 3.21Å; K185-E254 IonicContact NZ-OE2 3.82Å; K185-E254 PolarHBondContact NZ-OE2 3.49Å
186	E	91.6	Very high	91.9	Very high	108 Å²	108	49.1 Å²	49.1	51%	0.505	25%	0.25	S	C	.	.	H	α-helix	trans	-64.4	-45	174.4	-75.5	-170.2	-155.6	0	0	112.8	Q182 R183 A184 I188 T189 K190	Q182-E186 PolarHBondContact O-N 2.96Å; R183-E186 PolarHBondContact O-N 3.31Å; A184-E186 VanDerWaalsContact C-N 3.34Å; A184-E186 PolarHBondContact O-N 3.02Å; E186-I188 VanDerWaalsContact C-N 3.33Å; E186-I188 PolarHBondContact O-N 3.32Å; E186-T189 PolarHBondContact O-N 3.29Å; E186-T189 VanDerWaalsContact O-N 3.14Å; E186-T189 PolarHBondContact O-OG1 3.28Å; E186-K190 WeakPolarHBondContact O-CG 3.28Å; E186-K190 IonicContact OE2-NZ 3.05Å; E186-K190 PolarHBondContact OE2-NZ 2.82Å
187	E	91.6	Very high	91.8	Very high	22 Å²	22	53.1 Å²	53.1	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-40.1	179.1	-80	-68.1	142	0	0	111.7	R90 I91 R183 A184 T189 K190 V191	R90-E187 WeakPolarHBondContact CD-OE1 3.4Å; R90-E187 IonicContact CZ-OE1 2.91Å; R90-E187 IonicContact CZ-OE2 3.39Å; R90-E187 VanDerWaalsContact NE-CD 3.27Å; R90-E187 IonicContact NE-OE1 2.97Å; R90-E187 PolarHBondContact NE-OE1 2.94Å; R90-E187 IonicContact NE-OE2 3.8Å; R90-E187 PolarHBondContact NE-OE2 3.19Å; R90-E187 IonicContact NH2-OE1 3.84Å; R90-E187 IonicContact NH2-OE2 2.82Å; R90-E187 PolarHBondContact NH2-OE2 2.89Å; I91-E187 HydrophobicContact CD1-CB 4.2Å; I91-E187 HydrophobicContact CD1-CG 4.31Å; I91-E187 HydrophobicContact CG1-CB 4.25Å; I91-E187 HydrophobicContact CG1-CG 3.87Å; R183-E187 WeakPolarHBondContact O-CB 3.42Å; R183-E187 WeakPolarHBondContact O-CG 3.45Å; R183-E187 PolarHBondContact O-N 3.46Å; A184-E187 PolarHBondContact O-N 3.35Å; E187-T189 PolarHBondContact O-N 2.97Å; E187-T189 VanDerWaalsContact O-N 3.07Å; E187-K190 PolarHBondContact O-N 3.2Å; E187-V191 HydrophobicContact CB-CG1 4.42Å; E187-V191 WeakPolarHBondContact O-CG1 3.47Å; E187-V191 WeakPolarHBondContact O-CG2 3.49Å; E187-V191 PolarHBondContact O-N 2.92Å
188	I	93.4	Very high	91.6	Very high	39 Å²	39	55.8 Å²	55.8	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-52.8	-32.9	175.3	-75.3	165.2	0	0	0	112.2	A184 E186 L196 A199 V200 R203	A184-I188 VanDerWaalsContact O-CG1 3.25Å; A184-I188 WeakPolarHBondContact O-CG1 3.37Å; A184-I188 PolarHBondContact O-N 3.31Å; E186-I188 VanDerWaalsContact C-N 3.33Å; E186-I188 PolarHBondContact O-N 3.32Å; I188-L196 HydrophobicContact CB-CD1 4.48Å; I188-L196 HydrophobicContact CG2-CD1 3.82Å; I188-A199 HydrophobicContact CG1-CB 3.74Å; I188-V200 HydrophobicContact CD1-CG2 4.05Å; I188-V200 HydrophobicContact CG1-CG2 4.23Å; I188-R203 HydrophobicContact CD1-CB 4.15Å
189	T	91.8	Very high	91.5	Very high	114 Å²	114	55.8 Å²	55.8	70%	0.699	29%	0.287	S	S	*	.	H	α-helix	trans	-80.3	-16.3	178.4	69.6	0	0	0	0	114.1	E186 E187	E186-T189 PolarHBondContact O-N 3.29Å; E186-T189 VanDerWaalsContact O-N 3.14Å; E186-T189 PolarHBondContact O-OG1 3.28Å; E187-T189 PolarHBondContact O-N 2.97Å; E187-T189 VanDerWaalsContact O-N 3.07Å
190	K	88.9	Confident	91.6	Very high	126 Å²	126	56.4 Å²	56.4	55%	0.548	29%	0.29	S	S	.	.	H	α-helix	trans	-109.6	-28.2	-171.2	-63.4	168.9	-169.1	164.6	0	112.7	E186 E187	E186-K190 WeakPolarHBondContact O-CG 3.28Å; E186-K190 IonicContact OE2-NZ 3.05Å; E186-K190 PolarHBondContact OE2-NZ 2.82Å; E187-K190 PolarHBondContact O-N 3.2Å
191	V	88.2	Confident	91.5	Very high	20 Å²	20	60.3 Å²	60.3	12%	0.121	31%	0.308	C	S	.	.	S	Bend	trans	-72.6	145.8	-174.3	-68	0	0	0	0	112.8	M87 E187 L195 L196 A199	M87-V191 HydrophobicContact CG-CG1 4.44Å; M87-V191 HydrophobicContact SD-CG1 4.23Å; E187-V191 HydrophobicContact CB-CG1 4.42Å; E187-V191 WeakPolarHBondContact O-CG1 3.47Å; E187-V191 WeakPolarHBondContact O-CG2 3.49Å; E187-V191 PolarHBondContact O-N 2.92Å; V191-L195 HydrophobicContact CB-CB 4.09Å; V191-L196 HydrophobicContact CG2-CB 4.4Å; V191-L196 HydrophobicContact CG2-CD1 4.32Å; V191-A199 HydrophobicContact CG2-CB 3.93Å
192	P	86.8	Confident	91.5	Very high	76 Å²	76	60.2 Å²	60.2	49%	0.494	31%	0.307	S	S	.	.			trans	-61.7	158.5	171.2	-21	32.7	0	0	0	113.1	N194 L195 L196	P192-N194 WeakPolarHBondContact CB-OD1 3.4Å; P192-N194 PolarHBondContact O-N 3.47Å; P192-N194 VanDerWaalsContact O-N 3.08Å; P192-L195 PolarHBondContact O-N 2.84Å; P192-L196 PolarHBondContact O-N 3.16Å; P192-L196 VanDerWaalsContact O-N 3.17Å
193	E	86.1	Confident	91.6	Very high	178 Å²	178	61 Å²	61	83%	0.832	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-33.4	-175.9	-71.3	-174	169.3	0	0	114.1	L195	E193-L195 VanDerWaalsContact C-N 3.32Å; E193-L195 PolarHBondContact O-N 3.45Å
194	N	86.4	Confident	91.6	Very high	85 Å²	85	62.8 Å²	62.8	46%	0.455	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.8	178.6	67.2	-56.8	0	0	0	113.4	P192	P192-N194 WeakPolarHBondContact CB-OD1 3.4Å; P192-N194 PolarHBondContact O-N 3.47Å; P192-N194 VanDerWaalsContact O-N 3.08Å
195	L	88.3	Confident	91.7	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.042	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-12.2	177.6	-63.4	-180	0	0	0	113.3	N83 I84 V191 P192 E193 F198 A199	N83-L195 HydrophobicContact CB-CD1 3.74Å; N83-L195 HydrophobicContact CB-CD2 4.38Å; I84-L195 HydrophobicContact CG1-CD2 3.83Å; V191-L195 HydrophobicContact CB-CB 4.09Å; P192-L195 PolarHBondContact O-N 2.84Å; E193-L195 VanDerWaalsContact C-N 3.32Å; E193-L195 PolarHBondContact O-N 3.45Å; L195-F198 HydrophobicContact CD2-CD2 4.16Å; L195-F198 WeakPolarHBondContact O-CB 3.1Å; L195-F198 PolarHBondContact O-N 2.89Å; L195-F198 VanDerWaalsContact O-N 3.13Å; L195-A199 PolarHBondContact O-N 2.97Å
196	L	91.6	Very high	91.8	Very high	69 Å²	69	60.5 Å²	60.5	36%	0.361	31%	0.312	S	S	.	.	H	α-helix	trans	-55.5	-45.5	-178.9	-179.6	65.4	0	0	0	114.1	I188 V191 P192 F198 A199 V200	I188-L196 HydrophobicContact CB-CD1 4.48Å; I188-L196 HydrophobicContact CG2-CD1 3.82Å; V191-L196 HydrophobicContact CG2-CB 4.4Å; V191-L196 HydrophobicContact CG2-CD1 4.32Å; P192-L196 PolarHBondContact O-N 3.16Å; P192-L196 VanDerWaalsContact O-N 3.17Å; L196-F198 PolarHBondContact O-N 2.87Å; L196-A199 PolarHBondContact O-N 2.66Å; L196-V200 HydrophobicContact CD1-CG2 4.31Å; L196-V200 WeakPolarHBondContact O-CG2 3.41Å; L196-V200 PolarHBondContact O-N 3.49Å
197	P	93.6	Very high	92	Very high	83 Å²	83	55.9 Å²	55.9	54%	0.539	29%	0.291	S	S	.	.	H	α-helix	trans	-59.7	-36.5	178.4	-22.7	34.3	0	0	0	112.3	Q201	P197-Q201 WeakPolarHBondContact O-CB 3.14Å; P197-Q201 PolarHBondContact O-N 2.81Å
198	F	93.1	Very high	92.1	Very high	57 Å²	57	56.9 Å²	56.9	25%	0.25	30%	0.301	C	S	.	.	H	α-helix	trans	-70.6	-43.2	179	-61.9	-56.7	0	0	0	111.6	I84 M87 M131 L195 L196 V200 Q201 C202	I84-F198 HydrophobicContact CD1-CD2 3.95Å; I84-F198 HydrophobicContact CD1-CE1 4.47Å; I84-F198 HydrophobicContact CD1-CE2 3.76Å; I84-F198 HydrophobicContact CD1-CG 4.42Å; I84-F198 HydrophobicContact CD1-CZ 4.02Å; I84-F198 HydrophobicContact CG1-CD2 4.06Å; I84-F198 HydrophobicContact CG1-CE2 4.35Å; I84-F198 HydrophobicContact CG1-CG 4.46Å; M87-F198 HydrophobicContact CE-CB 3.59Å; M87-F198 HydrophobicContact SD-CB 4.42Å; M131-F198 VanDerWaalsContact CE-CA 3.46Å; M131-F198 HydrophobicContact CE-CB 3.37Å; M131-F198 HydrophobicContact CE-CD1 3.82Å; M131-F198 HydrophobicContact CE-CG 4.02Å; M131-F198 WeakPolarHBondContact CE-O 3.26Å; M131-F198 HydrophobicContact CG-CD1 3.71Å; M131-F198 HydrophobicContact CG-CE1 4.18Å; L195-F198 HydrophobicContact CD2-CD2 4.16Å; L195-F198 WeakPolarHBondContact O-CB 3.1Å; L195-F198 PolarHBondContact O-N 2.89Å; L195-F198 VanDerWaalsContact O-N 3.13Å; L196-F198 PolarHBondContact O-N 2.87Å; F198-V200 VanDerWaalsContact C-N 3.32Å; F198-V200 PolarHBondContact O-N 3.39Å; F198-Q201 WeakPolarHBondContact O-CB 3.37Å; F198-Q201 PolarHBondContact O-N 3.43Å; F198-Q201 VanDerWaalsContact O-N 3.15Å; F198-C202 PolarHBondContact O-N 3.39Å; F198-C202 PolarHBondContact O-SG 3.47Å
199	A	93.1	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-40.4	175.2	0	0	0	0	0	112.2	M87 I188 V191 L195 L196 C202 R203	M87-A199 HydrophobicContact SD-CB 3.72Å; I188-A199 HydrophobicContact CG1-CB 3.74Å; V191-A199 HydrophobicContact CG2-CB 3.93Å; L195-A199 PolarHBondContact O-N 2.97Å; L196-A199 PolarHBondContact O-N 2.66Å; A199-C202 PolarHBondContact O-N 3.32Å; A199-R203 PolarHBondContact O-N 2.95Å
200	V	94.1	Very high	92.4	Very high	48 Å²	48	49.8 Å²	49.8	29%	0.291	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-41.8	173.3	173.8	0	0	0	0	111	I188 L196 F198 C202 R203 N204	I188-V200 HydrophobicContact CD1-CG2 4.05Å; I188-V200 HydrophobicContact CG1-CG2 4.23Å; L196-V200 HydrophobicContact CD1-CG2 4.31Å; L196-V200 WeakPolarHBondContact O-CG2 3.41Å; L196-V200 PolarHBondContact O-N 3.49Å; F198-V200 VanDerWaalsContact C-N 3.32Å; F198-V200 PolarHBondContact O-N 3.39Å; V200-C202 PolarHBondContact O-N 3.19Å; V200-R203 WeakPolarHBondContact O-CB 3.14Å; V200-R203 PolarHBondContact O-N 3.3Å; V200-N204 PolarHBondContact O-N 2.77Å; V200-N204 PolarHBondContact O-OD1 3.05Å
201	Q	94.3	Very high	92.7	Very high	81 Å²	81	45.4 Å²	45.4	38%	0.379	24%	0.239	S	C	.	.	H	α-helix	trans	-61.9	-41.9	174.9	-173.1	178.5	-4.8	0	0	111.9	M131 P197 F198 R203 N204 L205	M131-Q201 HydrophobicContact CE-CB 4.23Å; M131-Q201 HydrophobicContact SD-CG 4.39Å; P197-Q201 WeakPolarHBondContact O-CB 3.14Å; P197-Q201 PolarHBondContact O-N 2.81Å; F198-Q201 WeakPolarHBondContact O-CB 3.37Å; F198-Q201 PolarHBondContact O-N 3.43Å; F198-Q201 VanDerWaalsContact O-N 3.15Å; Q201-R203 VanDerWaalsContact C-N 3.32Å; Q201-R203 PolarHBondContact O-N 2.96Å; Q201-N204 PolarHBondContact O-N 3.46Å; Q201-L205 WeakPolarHBondContact O-CG 3.39Å; Q201-L205 PolarHBondContact O-N 3.13Å
202	C	94.8	Very high	92.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-41.3	173.5	-68.5	0	0	0	0	112.1	I91 F92 M131 F198 A199 V200 L205 T206	I91-C202 HydrophobicContact CD1-CB 3.62Å; I91-C202 HydrophobicContact CG2-CB 4.34Å; F92-C202 HydrophobicContact CE2-CB 3.86Å; F92-C202 HydrophobicContact CZ-CB 4.04Å; M131-C202 VanDerWaalsContact CE-SG 3.58Å; F198-C202 PolarHBondContact O-N 3.39Å; F198-C202 PolarHBondContact O-SG 3.47Å; A199-C202 PolarHBondContact O-N 3.32Å; V200-C202 PolarHBondContact O-N 3.19Å; C202-L205 WeakPolarHBondContact O-CB 3.05Å; C202-L205 PolarHBondContact O-N 2.87Å; C202-T206 PolarHBondContact O-N 2.84Å; C202-T206 VanDerWaalsContact O-N 3.09Å
203	R	95.1	Very high	93.2	Very high	59 Å²	59	43 Å²	43	22%	0.223	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-46.9	174	-164.1	-171.1	79.3	-168.9	14.7	111.1	F181 A184 I188 A199 V200 Q201 L205 T206 V207 E258	F181-R203 HydrophobicContact CD2-CG 3.6Å; F181-R203 HydrophobicContact CE2-CG 3.6Å; A184-R203 HydrophobicContact CB-CB 3.85Å; A184-R203 HydrophobicContact CB-CG 4.14Å; I188-R203 HydrophobicContact CD1-CB 4.15Å; A199-R203 PolarHBondContact O-N 2.95Å; V200-R203 WeakPolarHBondContact O-CB 3.14Å; V200-R203 PolarHBondContact O-N 3.3Å; Q201-R203 VanDerWaalsContact C-N 3.32Å; Q201-R203 PolarHBondContact O-N 2.96Å; R203-L205 VanDerWaalsContact C-N 3.25Å; R203-L205 PolarHBondContact O-N 3.41Å; R203-T206 WeakPolarHBondContact O-CB 3.17Å; R203-T206 PolarHBondContact O-N 3.25Å; R203-T206 PolarHBondContact O-OG1 2.78Å; R203-V207 PolarHBondContact O-N 2.8Å; R203-E258 IonicContact CZ-OE1 3.71Å; R203-E258 IonicContact CZ-OE2 3.75Å; R203-E258 IonicContact NE-OE1 3.87Å; R203-E258 IonicContact NE-OE2 3.58Å; R203-E258 IonicContact NH2-OE1 3.36Å; R203-E258 PolarHBondContact NH2-OE1 3.31Å; R203-E258 IonicContact NH2-OE2 3.16Å; R203-E258 PolarHBondContact NH2-OE2 2.99Å; R203-E258 VanDerWaalsContact NH2-OE2 3.16Å
204	N	94.8	Very high	93.6	Very high	82 Å²	82	34.6 Å²	34.6	44%	0.439	18%	0.184	S	C	.	.	H	α-helix	trans	-61.9	-34.7	177.4	-66.4	-10.9	0	0	0	112.1	V200 Q201 T206 V207 S208	V200-N204 PolarHBondContact O-N 2.77Å; V200-N204 PolarHBondContact O-OD1 3.05Å; Q201-N204 PolarHBondContact O-N 3.46Å; N204-T206 VanDerWaalsContact C-N 3.34Å; N204-V207 PolarHBondContact O-N 3.41Å; N204-S208 WeakPolarHBondContact O-CB 3.43Å; N204-S208 PolarHBondContact O-N 2.93Å
205	L	95.6	Very high	93.9	Very high	15 Å²	15	30.8 Å²	30.8	8%	0.079	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-37.7	173	-76.8	169.1	0	0	0	112	F92 V134 E135 Q201 C202 R203 S208 N209	F92-L205 HydrophobicContact CZ-CB 4.29Å; V134-L205 HydrophobicContact CG1-CD1 3.55Å; V134-L205 HydrophobicContact CG2-CD1 4.31Å; E135-L205 HydrophobicContact CB-CD2 4.11Å; E135-L205 HydrophobicContact CG-CD2 4.06Å; Q201-L205 WeakPolarHBondContact O-CG 3.39Å; Q201-L205 PolarHBondContact O-N 3.13Å; C202-L205 WeakPolarHBondContact O-CB 3.05Å; C202-L205 PolarHBondContact O-N 2.87Å; R203-L205 VanDerWaalsContact C-N 3.25Å; R203-L205 PolarHBondContact O-N 3.41Å; L205-S208 PolarHBondContact O-N 3.34Å; L205-N209 VanDerWaalsContact O-CB 3.31Å; L205-N209 WeakPolarHBondContact O-CB 3.49Å; L205-N209 PolarHBondContact O-N 2.88Å; L205-N209 PolarHBondContact O-ND2 3.13Å
206	T	95.4	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.3	-47.5	174.2	62.5	0	0	0	0	111.3	F92 C180 C202 R203 N204 N209 T210	F92-T206 HydrophobicContact CD1-CG2 4.47Å; F92-T206 HydrophobicContact CE1-CG2 3.52Å; F92-T206 HydrophobicContact CZ-CG2 4.1Å; C180-T206 HydrophobicContact CB-CG2 3.47Å; C180-T206 VanDerWaalsContact CB-CG2 3.47Å; C202-T206 PolarHBondContact O-N 2.84Å; C202-T206 VanDerWaalsContact O-N 3.09Å; R203-T206 WeakPolarHBondContact O-CB 3.17Å; R203-T206 PolarHBondContact O-N 3.25Å; R203-T206 PolarHBondContact O-OG1 2.78Å; N204-T206 VanDerWaalsContact C-N 3.34Å; T206-N209 PolarHBondContact O-N 3.12Å; T206-T210 PolarHBondContact O-N 3.11Å; T206-T210 PolarHBondContact O-OG1 3.09Å
207	V	95.6	Very high	94.1	Very high	11 Å²	11	29.5 Å²	29.5	7%	0.067	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-46.3	177.9	177.6	0	0	0	0	111.3	F181 R203 N204 N209 T210 R211 E258 V259 A262	F181-V207 HydrophobicContact CD2-CG2 4Å; F181-V207 HydrophobicContact CE2-CG2 3.96Å; R203-V207 PolarHBondContact O-N 2.8Å; N204-V207 PolarHBondContact O-N 3.41Å; V207-N209 PolarHBondContact O-N 2.95Å; V207-T210 PolarHBondContact O-N 3.26Å; V207-R211 WeakPolarHBondContact O-CB 3.47Å; V207-R211 PolarHBondContact O-N 3.24Å; V207-E258 HydrophobicContact CG1-CB 4.23Å; V207-E258 HydrophobicContact CG2-CB 4.05Å; V207-V259 HydrophobicContact CG1-CG2 4.01Å; V207-A262 HydrophobicContact CG1-CB 3.97Å
208	S	94.3	Very high	94	Very high	43 Å²	43	31.4 Å²	31.4	30%	0.301	16%	0.161	S	C	.	.	H	α-helix	trans	-60.8	-42.8	178	-172.7	0	0	0	0	112	N204 L205 R211 T212	N204-S208 WeakPolarHBondContact O-CB 3.43Å; N204-S208 PolarHBondContact O-N 2.93Å; L205-S208 PolarHBondContact O-N 3.34Å; S208-R211 WeakPolarHBondContact O-CB 3.36Å; S208-R211 PolarHBondContact O-N 3.28Å; S208-T212 PolarHBondContact O-N 3.5Å; S208-T212 PolarHBondContact O-OG1 3.37Å; S208-T212 VanDerWaalsContact O-OG1 3.11Å
209	N	95.1	Very high	94	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.027	17%	0.168	C	C	.	.	H	α-helix	trans	-70.1	-37.6	177.5	-82.7	-93.5	0	0	0	111.8	L138 L142 L177 L205 T206 V207 R211 T212 V213	L138-N209 HydrophobicContact CD2-CB 4.08Å; L138-N209 WeakPolarHBondContact CD2-ND2 3.3Å; L142-N209 HydrophobicContact CD1-CB 4.27Å; L177-N209 HydrophobicContact CD1-CB 4.45Å; L177-N209 HydrophobicContact CD2-CB 4.06Å; L205-N209 VanDerWaalsContact O-CB 3.31Å; L205-N209 WeakPolarHBondContact O-CB 3.49Å; L205-N209 PolarHBondContact O-N 2.88Å; L205-N209 PolarHBondContact O-ND2 3.13Å; T206-N209 PolarHBondContact O-N 3.12Å; V207-N209 PolarHBondContact O-N 2.95Å; N209-R211 VanDerWaalsContact C-N 3.3Å; N209-R211 PolarHBondContact O-N 3.05Å; N209-T212 PolarHBondContact O-N 2.84Å; N209-V213 WeakPolarHBondContact O-CB 3.41Å; N209-V213 WeakPolarHBondContact O-CG2 3.25Å; N209-V213 PolarHBondContact O-N 2.99Å
210	T	95.4	Very high	93.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.7	-40	173	-56.6	0	0	0	0	111.6	F174 L177 T206 V207 V213 L214 F255 V259	F174-T210 HydrophobicContact CD2-CG2 4.24Å; F174-T210 HydrophobicContact CE1-CG2 4.29Å; F174-T210 HydrophobicContact CE2-CG2 3.53Å; F174-T210 HydrophobicContact CZ-CG2 3.55Å; L177-T210 WeakPolarHBondContact CB-OG1 3.41Å; L177-T210 WeakPolarHBondContact CD1-OG1 3.43Å; T206-T210 PolarHBondContact O-N 3.11Å; T206-T210 PolarHBondContact O-OG1 3.09Å; V207-T210 PolarHBondContact O-N 3.26Å; T210-V213 PolarHBondContact O-N 2.62Å; T210-L214 HydrophobicContact CG2-CD1 4.31Å; T210-L214 WeakPolarHBondContact O-CG 3.42Å; T210-L214 PolarHBondContact O-N 3.09Å; T210-F255 HydrophobicContact CG2-CE1 4.27Å; T210-F255 HydrophobicContact CG2-CZ 3.81Å; T210-F255 WeakPolarHBondContact OG1-CZ 3.25Å; T210-V259 HydrophobicContact CG2-CG1 3.98Å; T210-V259 HydrophobicContact CG2-CG2 3.85Å
211	R	94.5	Very high	93.6	Very high	33 Å²	33	34.9 Å²	34.9	13%	0.125	18%	0.182	C	C	.	.	H	α-helix	trans	-57.2	-51.8	170.8	173.1	-172.2	173.8	-97.1	-19.4	110.9	V207 S208 N209 V213 L214 L215 A262 L263 D266	V207-R211 WeakPolarHBondContact O-CB 3.47Å; V207-R211 PolarHBondContact O-N 3.24Å; S208-R211 WeakPolarHBondContact O-CB 3.36Å; S208-R211 PolarHBondContact O-N 3.28Å; N209-R211 VanDerWaalsContact C-N 3.3Å; N209-R211 PolarHBondContact O-N 3.05Å; R211-V213 VanDerWaalsContact C-N 3.31Å; R211-V213 PolarHBondContact O-N 3.08Å; R211-L214 PolarHBondContact O-N 3.05Å; R211-L214 VanDerWaalsContact O-N 3.11Å; R211-L215 HydrophobicContact CG-CD1 3.79Å; R211-L215 HydrophobicContact CG-CG 4.4Å; R211-L215 VanDerWaalsContact CZ-CD1 3.43Å; R211-L215 WeakPolarHBondContact O-CG 3.36Å; R211-L215 PolarHBondContact O-N 2.87Å; R211-A262 WeakPolarHBondContact CD-O 3.44Å; R211-A262 PolarHBondContact NE-O 2.9Å; R211-L263 HydrophobicContact CB-CD2 4.48Å; R211-L263 HydrophobicContact CG-CD2 3.81Å; R211-L263 HydrophobicContact CG-CG 4.2Å; R211-D266 VanDerWaalsContact CZ-CG 3.5Å; R211-D266 IonicContact CZ-OD2 3.11Å; R211-D266 IonicContact NH1-OD2 3.1Å; R211-D266 PolarHBondContact NH1-OD2 3.28Å; R211-D266 VanDerWaalsContact NH1-OD2 3.1Å; R211-D266 PolarHBondContact NH2-O 3.24Å; R211-D266 IonicContact NH2-OD1 3.69Å; R211-D266 PolarHBondContact NH2-OD1 2.86Å; R211-D266 IonicContact NH2-OD2 2.7Å; R211-D266 PolarHBondContact NH2-OD2 3.01Å
212	T	92.7	Very high	93.3	Very high	45 Å²	45	36.7 Å²	36.7	28%	0.276	19%	0.194	S	C	.	.	H	α-helix	trans	-58.3	-43.3	178.2	-59	0	0	0	0	111.8	S208 N209 L214 L215 T216	S208-T212 PolarHBondContact O-N 3.5Å; S208-T212 PolarHBondContact O-OG1 3.37Å; S208-T212 VanDerWaalsContact O-OG1 3.11Å; N209-T212 PolarHBondContact O-N 2.84Å; T212-L214 VanDerWaalsContact C-N 3.27Å; T212-L214 PolarHBondContact O-N 3.49Å; T212-L215 PolarHBondContact O-N 2.99Å; T212-T216 PolarHBondContact O-N 2.55Å; T212-T216 PolarHBondContact O-OG1 2.94Å; T212-T216 VanDerWaalsContact O-OG1 3.05Å
213	V	94.1	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.3	-39.1	176.4	168.1	0	0	0	0	112.1	L142 I173 L177 N209 T210 R211 P217 Y220 I225	L142-V213 HydrophobicContact CD1-CG2 3.95Å; I173-V213 HydrophobicContact CG2-CB 4.42Å; I173-V213 HydrophobicContact CG2-CG1 3.87Å; I173-V213 HydrophobicContact CG2-CG2 3.67Å; L177-V213 HydrophobicContact CD1-CG2 3.97Å; N209-V213 WeakPolarHBondContact O-CB 3.41Å; N209-V213 WeakPolarHBondContact O-CG2 3.25Å; N209-V213 PolarHBondContact O-N 2.99Å; T210-V213 PolarHBondContact O-N 2.62Å; R211-V213 VanDerWaalsContact C-N 3.31Å; R211-V213 PolarHBondContact O-N 3.08Å; V213-P217 WeakPolarHBondContact O-CA 3.5Å; V213-Y220 HydrophobicContact CB-CE2 4.15Å; V213-Y220 HydrophobicContact CG1-CE2 4.34Å; V213-Y220 HydrophobicContact CG2-CE1 4.37Å; V213-Y220 HydrophobicContact CG2-CE2 3.75Å; V213-Y220 WeakPolarHBondContact CG2-OH 3.5Å; V213-I225 HydrophobicContact CG1-CB 4.32Å; V213-I225 HydrophobicContact CG1-CD1 3.61Å; V213-I225 HydrophobicContact CG1-CG1 3.79Å; V213-I225 HydrophobicContact CG1-CG2 3.54Å
214	L	93.5	Very high	93.1	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-77	-29.1	178.1	-76.8	172.2	0	0	0	113.7	F174 T210 R211 T212 I225 V259 L263 V275	F174-L214 HydrophobicContact CE2-CD1 3.92Å; F174-L214 HydrophobicContact CE2-CD2 3.93Å; F174-L214 HydrophobicContact CE2-CG 3.92Å; F174-L214 HydrophobicContact CZ-CD1 4.31Å; T210-L214 HydrophobicContact CG2-CD1 4.31Å; T210-L214 WeakPolarHBondContact O-CG 3.42Å; T210-L214 PolarHBondContact O-N 3.09Å; R211-L214 PolarHBondContact O-N 3.05Å; R211-L214 VanDerWaalsContact O-N 3.11Å; T212-L214 VanDerWaalsContact C-N 3.27Å; T212-L214 PolarHBondContact O-N 3.49Å; L214-I225 HydrophobicContact CD2-CG2 3.83Å; L214-I225 HydrophobicContact CG-CG2 4.49Å; L214-V259 HydrophobicContact CD1-CG1 3.8Å; L214-L263 HydrophobicContact CB-CD2 4.4Å; L214-L263 HydrophobicContact CD1-CD1 3.91Å; L214-V275 HydrophobicContact CB-CG1 3.72Å; L214-V275 HydrophobicContact CD1-CG1 4.47Å; L214-V275 HydrophobicContact CD2-CG1 4.18Å; L214-V275 HydrophobicContact CG-CG1 4.35Å
215	L	93.2	Very high	93.1	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-79.2	-34.6	178	-70.5	171.6	0	0	0	113	R211 T212 P217 L263 V269 R270 V275	R211-L215 HydrophobicContact CG-CD1 3.79Å; R211-L215 HydrophobicContact CG-CG 4.4Å; R211-L215 VanDerWaalsContact CZ-CD1 3.43Å; R211-L215 WeakPolarHBondContact O-CG 3.36Å; R211-L215 PolarHBondContact O-N 2.87Å; T212-L215 PolarHBondContact O-N 2.99Å; L215-P217 VanDerWaalsContact C-CD 3.45Å; L215-L263 HydrophobicContact CD2-CD2 3.95Å; L215-L263 HydrophobicContact CG-CD2 3.96Å; L215-V269 HydrophobicContact CB-CG1 4.38Å; L215-V269 HydrophobicContact CD2-CB 4.47Å; L215-R270 HydrophobicContact CD2-CB 3.88Å; L215-R270 WeakPolarHBondContact O-CD 3.14Å; L215-R270 VanDerWaalsContact O-CZ 3.28Å; L215-R270 PolarHBondContact O-NE 3.22Å; L215-V275 HydrophobicContact CD2-CG2 3.91Å
216	T	92.6	Very high	93	Very high	34 Å²	34	35.1 Å²	35.1	21%	0.209	19%	0.189	C	C	.	.			trans	-131.4	62	-178	59	0	0	0	0	111.6	T212 E218 I219 V269	T212-T216 PolarHBondContact O-N 2.55Å; T212-T216 PolarHBondContact O-OG1 2.94Å; T212-T216 VanDerWaalsContact O-OG1 3.05Å; T216-E218 PolarHBondContact O-N 3.33Å; T216-I219 HydrophobicContact CG2-CD1 4.38Å; T216-I219 PolarHBondContact O-N 2.84Å; T216-I219 WeakPolarHBondContact OG1-CD1 3.33Å; T216-V269 HydrophobicContact CG2-CG1 4.18Å
217	P	92.4	Very high	93.1	Very high	15 Å²	15	38.5 Å²	38.5	10%	0.097	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-64.2	-22.2	-178.1	26.3	-34.1	0	0	0	112.7	V213 L215 I219 Y220 I225	V213-P217 WeakPolarHBondContact O-CA 3.5Å; L215-P217 VanDerWaalsContact C-CD 3.45Å; P217-I219 PolarHBondContact O-N 3.34Å; P217-Y220 PolarHBondContact O-N 3.16Å; P217-Y220 VanDerWaalsContact O-N 3.16Å; P217-I225 HydrophobicContact CB-CB 4.28Å; P217-I225 HydrophobicContact CB-CG1 3.92Å
218	E	90.9	Very high	93.1	Very high	123 Å²	123	38.4 Å²	38.4	58%	0.575	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-68.9	-17.3	-176.9	-56.1	75.5	-161.8	0	0	113.8	T216 Y220 R270	T216-E218 PolarHBondContact O-N 3.33Å; E218-Y220 PolarHBondContact O-N 2.78Å; E218-R270 IonicContact OE1-CZ 2.81Å; E218-R270 IonicContact OE1-NH1 2.86Å; E218-R270 PolarHBondContact OE1-NH1 2.8Å; E218-R270 VanDerWaalsContact OE1-NH1 3.15Å; E218-R270 IonicContact OE1-NH2 3.84Å; E218-R270 PolarHBondContact OE1-NH2 3.23Å; E218-R270 IonicContact OE2-CZ 3.45Å; E218-R270 IonicContact OE2-NH2 3.21Å; E218-R270 PolarHBondContact OE2-NH2 2.97Å
219	I	92.6	Very high	93.1	Very high	80 Å²	80	36.5 Å²	36.5	41%	0.41	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-68.4	-28.4	176.1	-59.1	-179.6	0	0	0	110.4	F139 L143 T216 P217 V221	F139-I219 HydrophobicContact CZ-CG2 4.41Å; L143-I219 HydrophobicContact CD2-CG2 3.64Å; T216-I219 HydrophobicContact CG2-CD1 4.38Å; T216-I219 PolarHBondContact O-N 2.84Å; T216-I219 WeakPolarHBondContact OG1-CD1 3.33Å; P217-I219 PolarHBondContact O-N 3.34Å; I219-V221 PolarHBondContact O-N 3.29Å
220	Y	91.9	Very high	93.1	Very high	9 Å²	9	36.2 Å²	36.2	4%	0.035	19%	0.188	C	C	.	.	S	Bend	trans	-96.4	86.4	-174.2	-52.8	-78.5	0	0	0	110.5	L142 L143 I173 V213 P217 E218 Q223	L142-Y220 HydrophobicContact CB-CD1 4.43Å; L142-Y220 HydrophobicContact CB-CE1 3.72Å; L143-Y220 HydrophobicContact CD2-CD1 4.07Å; L143-Y220 HydrophobicContact CD2-CE1 3.98Å; I173-Y220 HydrophobicContact CD1-CD1 3.3Å; I173-Y220 HydrophobicContact CD1-CE1 4.06Å; I173-Y220 HydrophobicContact CD1-CG 3.55Å; V213-Y220 HydrophobicContact CB-CE2 4.15Å; V213-Y220 HydrophobicContact CG1-CE2 4.34Å; V213-Y220 HydrophobicContact CG2-CE1 4.37Å; V213-Y220 HydrophobicContact CG2-CE2 3.75Å; V213-Y220 WeakPolarHBondContact CG2-OH 3.5Å; P217-Y220 PolarHBondContact O-N 3.16Å; P217-Y220 VanDerWaalsContact O-N 3.16Å; E218-Y220 PolarHBondContact O-N 2.78Å; Y220-Q223 WeakPolarHBondContact O-CB 3.32Å; Y220-Q223 PolarHBondContact O-N 2.93Å
221	V	87.1	Confident	93	Very high	89 Å²	89	39.2 Å²	39.2	54%	0.539	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	141.6	-179.1	-172.6	0	0	0	0	110.9	I219 Q223	I219-V221 PolarHBondContact O-N 3.29Å; V221-Q223 PolarHBondContact O-N 3.41Å
222	D	87.2	Confident	93	Very high	119 Å²	119	37.7 Å²	37.7	64%	0.636	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	17.9	-178.5	-56.9	-40.7	0	0	0	115.4
223	Q	91.7	Very high	92.9	Very high	30 Å²	30	35.6 Å²	35.6	14%	0.14	19%	0.186	C	C	.	.			trans	-116.5	130.7	177.3	-60.2	-78.7	-28.1	0	0	110.4	R171 I173 Y220 V221 I225	R171-Q223 PolarHBondContact O-NE2 3.49Å; R171-Q223 VanDerWaalsContact O-NE2 3.08Å; R171-Q223 PolarHBondContact O-OE1 3.28Å; I173-Q223 HydrophobicContact CD1-CB 4.38Å; I173-Q223 HydrophobicContact CD1-CG 3.87Å; Y220-Q223 WeakPolarHBondContact O-CB 3.32Å; Y220-Q223 PolarHBondContact O-N 2.93Å; V221-Q223 PolarHBondContact O-N 3.41Å; Q223-I225 HydrophobicContact CB-CD1 4.03Å
224	N	93.9	Very high	92.8	Very high	71 Å²	71	36.4 Å²	36.4	38%	0.38	19%	0.19	S	C	.	.			trans	-104	89.7	169.6	-171.2	-12.6	0	0	0	109.9	H226 E227 Q228	N224-H226 PolarHBondContact O-N 3.32Å; N224-E227 HydrophobicContact CB-CB 3.85Å; N224-E227 WeakPolarHBondContact ND2-CB 3.41Å; N224-E227 PolarHBondContact ND2-OE2 3.27Å; N224-E227 PolarHBondContact O-N 2.8Å; N224-E227 PolarHBondContact OD1-N 3.34Å; N224-Q228 WeakPolarHBondContact O-CG 3.45Å; N224-Q228 PolarHBondContact O-N 2.79Å
225	I	95	Very high	92.7	Very high	2 Å²	2	41 Å²	41	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-44.1	-174	-58.4	-51.2	0	0	0	112.2	I173 F174 V213 L214 P217 Q223 E227 Q228 L229	I173-I225 HydrophobicContact CB-CD1 4.25Å; I173-I225 HydrophobicContact CD1-CD1 4.23Å; F174-I225 HydrophobicContact CD2-CG2 3.95Å; F174-I225 HydrophobicContact CE2-CG2 4.47Å; V213-I225 HydrophobicContact CG1-CB 4.32Å; V213-I225 HydrophobicContact CG1-CD1 3.61Å; V213-I225 HydrophobicContact CG1-CG1 3.79Å; V213-I225 HydrophobicContact CG1-CG2 3.54Å; L214-I225 HydrophobicContact CD2-CG2 3.83Å; L214-I225 HydrophobicContact CG-CG2 4.49Å; P217-I225 HydrophobicContact CB-CB 4.28Å; P217-I225 HydrophobicContact CB-CG1 3.92Å; Q223-I225 HydrophobicContact CB-CD1 4.03Å; I225-E227 VanDerWaalsContact C-N 3.28Å; I225-E227 PolarHBondContact O-N 3.15Å; I225-Q228 PolarHBondContact O-N 3.42Å; I225-L229 PolarHBondContact O-N 3.29Å; I225-L229 VanDerWaalsContact O-N 3.09Å
226	H	95	Very high	92.3	Very high	21 Å²	21	40.8 Å²	40.8	10%	0.097	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-34.3	-178.6	-54.8	-68	0	0	0	111.7	N224 V230 V275 P278 V279 V282	N224-H226 PolarHBondContact O-N 3.32Å; H226-V230 WeakPolarHBondContact O-CG2 3.39Å; H226-V230 PolarHBondContact O-N 3.16Å; H226-V275 PolarHBondContact CE1-O 3.03Å; H226-V275 VanDerWaalsContact CE1-O 3.29Å; H226-V275 PolarHBondContact ND1-O 3.23Å; H226-P278 HydrophobicContact CB-CB 4.3Å; H226-P278 VanDerWaalsContact CD2-CB 3.48Å; H226-P278 WeakPolarHBondContact CD2-CB 3.33Å; H226-V279 HydrophobicContact CB-CG2 4.1Å; H226-V282 HydrophobicContact CB-CG2 4.36Å
227	E	96	Very high	91.9	Very high	70 Å²	70	39.7 Å²	39.7	33%	0.327	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-41.9	175	-169.6	167.1	-165	0	0	112.2	N224 I225 L229 V230 D231 V282 R286	N224-E227 HydrophobicContact CB-CB 3.85Å; N224-E227 WeakPolarHBondContact ND2-CB 3.41Å; N224-E227 PolarHBondContact ND2-OE2 3.27Å; N224-E227 PolarHBondContact O-N 2.8Å; N224-E227 PolarHBondContact OD1-N 3.34Å; I225-E227 VanDerWaalsContact C-N 3.28Å; I225-E227 PolarHBondContact O-N 3.15Å; E227-L229 VanDerWaalsContact C-N 3.29Å; E227-L229 PolarHBondContact O-N 2.91Å; E227-V230 PolarHBondContact O-N 3.01Å; E227-V230 VanDerWaalsContact O-N 3.1Å; E227-D231 PolarHBondContact O-N 3.35Å; E227-V282 HydrophobicContact CG-CG1 4.38Å; E227-R286 IonicContact OE1-CZ 3.7Å; E227-R286 IonicContact OE1-NE 2.87Å; E227-R286 IonicContact OE1-NH2 3.37Å; E227-R286 PolarHBondContact OE1-NH2 2.99Å
228	Q	95.4	Very high	91.4	Very high	9 Å²	9	43.2 Å²	43.2	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-39.2	174.7	-70.1	171.9	28.1	0	0	112.7	H172 F174 N224 I225 D231 L232	H172-Q228 HydrophobicContact CB-CG 4.05Å; F174-Q228 HydrophobicContact CB-CB 3.77Å; N224-Q228 WeakPolarHBondContact O-CG 3.45Å; N224-Q228 PolarHBondContact O-N 2.79Å; I225-Q228 PolarHBondContact O-N 3.42Å; Q228-D231 PolarHBondContact O-N 3.06Å; Q228-L232 WeakPolarHBondContact O-CB 3.21Å; Q228-L232 PolarHBondContact O-N 2.95Å
229	L	94.9	Very high	90.3	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-47.5	173.9	170	59.7	0	0	0	111.3	F174 I225 E227 D231 L232 M233 L256 M276 V279	F174-L229 HydrophobicContact CD1-CB 4.5Å; F174-L229 HydrophobicContact CD1-CD1 4.42Å; F174-L229 HydrophobicContact CE1-CB 4.36Å; F174-L229 HydrophobicContact CE1-CD1 3.66Å; F174-L229 HydrophobicContact CE2-CB 4.39Å; F174-L229 HydrophobicContact CZ-CB 4.31Å; F174-L229 HydrophobicContact CZ-CD1 3.8Å; F174-L229 HydrophobicContact CZ-CG 4.44Å; I225-L229 PolarHBondContact O-N 3.29Å; I225-L229 VanDerWaalsContact O-N 3.09Å; E227-L229 VanDerWaalsContact C-N 3.29Å; E227-L229 PolarHBondContact O-N 2.91Å; L229-D231 VanDerWaalsContact C-N 3.33Å; L229-D231 PolarHBondContact O-N 3.47Å; L229-L232 PolarHBondContact O-N 3.37Å; L229-M233 HydrophobicContact CD1-CG 4.27Å; L229-M233 HydrophobicContact CD1-SD 4.24Å; L229-M233 WeakPolarHBondContact O-CG 3.38Å; L229-M233 PolarHBondContact O-N 3.38Å; L229-M233 VanDerWaalsContact O-N 3.09Å; L229-L256 HydrophobicContact CD1-CD1 4.01Å; L229-L256 HydrophobicContact CD1-CD2 3.46Å; L229-L256 VanDerWaalsContact CD1-CD2 3.46Å; L229-L256 HydrophobicContact CD1-CG 4.37Å; L229-M276 HydrophobicContact CD2-CE 4.32Å; L229-V279 HydrophobicContact CD2-CG1 4.13Å; L229-V279 HydrophobicContact CD2-CG2 3.85Å
230	V	95.3	Very high	88.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-40.8	178.3	176.6	0	0	0	0	111	H226 E227 M233 L234 V279 V282 L283 Y300	H226-V230 WeakPolarHBondContact O-CG2 3.39Å; H226-V230 PolarHBondContact O-N 3.16Å; E227-V230 PolarHBondContact O-N 3.01Å; E227-V230 VanDerWaalsContact O-N 3.1Å; V230-M233 PolarHBondContact O-N 3.29Å; V230-L234 VanDerWaalsContact O-CB 3.28Å; V230-L234 WeakPolarHBondContact O-CB 3.34Å; V230-L234 PolarHBondContact O-N 3.02Å; V230-V279 HydrophobicContact CG2-CG1 3.79Å; V230-V282 HydrophobicContact CB-CG1 4.27Å; V230-V282 HydrophobicContact CG1-CG1 4.47Å; V230-V282 HydrophobicContact CG2-CB 4.36Å; V230-V282 HydrophobicContact CG2-CG1 3.99Å; V230-L283 HydrophobicContact CG1-CD2 3.73Å; V230-L283 HydrophobicContact CG1-CG 4.43Å; V230-L283 HydrophobicContact CG2-CD2 4.34Å; V230-L283 HydrophobicContact CG2-CG 4.19Å; V230-Y300 HydrophobicContact CG1-CE1 4.06Å
231	D	94.3	Very high	86.8	Confident	62 Å²	62	43.5 Å²	43.5	33%	0.332	23%	0.228	S	C	.	.	H	α-helix	trans	-64.7	-43.3	178.4	-71.3	-26.5	0	0	0	112.2	E227 Q228 L229 M233 L234 E235 R286	E227-D231 PolarHBondContact O-N 3.35Å; Q228-D231 PolarHBondContact O-N 3.06Å; L229-D231 VanDerWaalsContact C-N 3.33Å; L229-D231 PolarHBondContact O-N 3.47Å; D231-M233 PolarHBondContact O-N 3.4Å; D231-L234 WeakPolarHBondContact O-CB 3.45Å; D231-L234 PolarHBondContact O-N 2.88Å; D231-E235 WeakPolarHBondContact O-CB 3.33Å; D231-E235 PolarHBondContact O-N 3.16Å; D231-R286 IonicContact OD1-CZ 3.57Å; D231-R286 IonicContact OD1-NH1 3.37Å; D231-R286 PolarHBondContact OD1-NH1 3.12Å; D231-R286 IonicContact OD1-NH2 2.67Å; D231-R286 PolarHBondContact OD1-NH2 3.08Å; D231-R286 IonicContact OD2-NH2 3.81Å; D231-R286 PolarHBondContact OD2-NH2 3.35Å
232	L	92.6	Very high	84.9	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-45.6	175.8	179.5	65.5	0	0	0	111.5	F174 Y178 Q228 L229 L234 E235 A236 I247 V252	F174-L232 HydrophobicContact CD1-CD2 3.94Å; F174-L232 HydrophobicContact CE1-CD2 4.27Å; Y178-L232 HydrophobicContact CD1-CD1 3.86Å; Y178-L232 HydrophobicContact CD1-CD2 4.24Å; Y178-L232 HydrophobicContact CD2-CD2 4.32Å; Y178-L232 HydrophobicContact CE1-CD1 4.27Å; Y178-L232 HydrophobicContact CG-CD1 4.33Å; Y178-L232 HydrophobicContact CG-CD2 3.85Å; Q228-L232 WeakPolarHBondContact O-CB 3.21Å; Q228-L232 PolarHBondContact O-N 2.95Å; L229-L232 PolarHBondContact O-N 3.37Å; L232-L234 VanDerWaalsContact C-N 3.32Å; L232-L234 PolarHBondContact O-N 2.67Å; L232-E235 PolarHBondContact O-N 3.46Å; L232-A236 WeakPolarHBondContact O-CB 3.2Å; L232-A236 PolarHBondContact O-N 3.19Å; L232-I247 HydrophobicContact CD1-CD1 4.12Å; L232-V252 HydrophobicContact CD2-CG1 4.41Å; L232-V252 HydrophobicContact CG-CG1 4.4Å; L232-V252 HydrophobicContact CG-CG2 4.41Å
233	M	92.5	Very high	82.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.6	-38.4	176.5	-69	-174.5	78.2	0	0	112.1	L229 V230 D231 A236 I237 V252 L256 I303 Y306 F307	L229-M233 HydrophobicContact CD1-CG 4.27Å; L229-M233 HydrophobicContact CD1-SD 4.24Å; L229-M233 WeakPolarHBondContact O-CG 3.38Å; L229-M233 PolarHBondContact O-N 3.38Å; L229-M233 VanDerWaalsContact O-N 3.09Å; V230-M233 PolarHBondContact O-N 3.29Å; D231-M233 PolarHBondContact O-N 3.4Å; M233-A236 PolarHBondContact O-N 3.04Å; M233-I237 WeakPolarHBondContact O-CG1 3.3Å; M233-I237 PolarHBondContact O-N 2.94Å; M233-I237 VanDerWaalsContact O-N 3.09Å; M233-V252 HydrophobicContact CG-CG1 4.24Å; M233-L256 HydrophobicContact CE-CD1 4.18Å; M233-L256 HydrophobicContact CG-CD1 4.08Å; M233-L256 HydrophobicContact SD-CD1 3.89Å; M233-I303 HydrophobicContact CB-CD1 3.91Å; M233-I303 HydrophobicContact CB-CG1 4.14Å; M233-I303 HydrophobicContact CE-CG2 3.8Å; M233-I303 HydrophobicContact SD-CG2 4.04Å; M233-Y306 HydrophobicContact CE-CD1 3.5Å; M233-Y306 VanDerWaalsContact CE-CD1 3.5Å; M233-Y306 HydrophobicContact CE-CE1 3.91Å; M233-Y306 HydrophobicContact CE-CG 4.33Å; M233-F307 HydrophobicContact CE-CE1 3.74Å; M233-F307 HydrophobicContact CE-CZ 3.95Å; M233-F307 HydrophobicContact SD-CE1 3.82Å; M233-F307 HydrophobicContact SD-CZ 3.58Å; M233-F307 VanDerWaalsContact SD-CZ 3.58Å
234	L	91.9	Very high	80.7	Confident	17 Å²	17	60 Å²	60	9%	0.089	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-44.9	177.8	-176.2	65	0	0	0	111.3	V230 D231 L232 A236 I237 Q238 L296 A299 Y300 I303	V230-L234 VanDerWaalsContact O-CB 3.28Å; V230-L234 WeakPolarHBondContact O-CB 3.34Å; V230-L234 PolarHBondContact O-N 3.02Å; D231-L234 WeakPolarHBondContact O-CB 3.45Å; D231-L234 PolarHBondContact O-N 2.88Å; L232-L234 VanDerWaalsContact C-N 3.32Å; L232-L234 PolarHBondContact O-N 2.67Å; L234-A236 VanDerWaalsContact C-N 3.32Å; L234-A236 PolarHBondContact O-N 3.41Å; L234-I237 PolarHBondContact O-N 3.34Å; L234-Q238 HydrophobicContact CD1-CG 4.45Å; L234-Q238 WeakPolarHBondContact O-CB 3.45Å; L234-Q238 WeakPolarHBondContact O-CG 3.41Å; L234-Q238 PolarHBondContact O-N 2.92Å; L234-L296 HydrophobicContact CD1-CD1 3.95Å; L234-L296 HydrophobicContact CD2-CD1 3.99Å; L234-A299 HydrophobicContact CD1-CB 3.54Å; L234-Y300 HydrophobicContact CD1-CD1 4.48Å; L234-Y300 HydrophobicContact CD1-CE1 4.23Å; L234-Y300 HydrophobicContact CD2-CE1 4.19Å; L234-I303 HydrophobicContact CB-CD1 4.31Å
235	E	89.5	Confident	78.7	Confident	100 Å²	100	58 Å²	58	47%	0.467	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-40.4	175.5	-171.4	176	-176.4	0	0	111.2	D231 L232 I237 Q238 G239 I247	D231-E235 WeakPolarHBondContact O-CB 3.33Å; D231-E235 PolarHBondContact O-N 3.16Å; L232-E235 PolarHBondContact O-N 3.46Å; E235-I237 PolarHBondContact O-N 3.3Å; E235-Q238 PolarHBondContact O-N 3.31Å; E235-G239 WeakPolarHBondContact O-CA 3.39Å; E235-G239 PolarHBondContact O-N 3.17Å; E235-I247 HydrophobicContact CG-CD1 4.15Å
236	A	86.6	Confident	76.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-40.1	176.8	0	0	0	0	0	112.9	L232 M233 L234 A240 I247 F249 V252	L232-A236 WeakPolarHBondContact O-CB 3.2Å; L232-A236 PolarHBondContact O-N 3.19Å; M233-A236 PolarHBondContact O-N 3.04Å; L234-A236 VanDerWaalsContact C-N 3.32Å; L234-A236 PolarHBondContact O-N 3.41Å; A236-A240 PolarHBondContact O-N 3.4Å; A236-A240 VanDerWaalsContact O-N 3.13Å; A236-I247 HydrophobicContact CB-CG2 3.72Å; A236-F249 HydrophobicContact CB-CB 4.42Å; A236-F249 HydrophobicContact CB-CD2 4.13Å; A236-V252 HydrophobicContact CB-CB 4.36Å; A236-V252 HydrophobicContact CB-CG2 3.8Å
237	I	84.3	Confident	75.6	Confident	12 Å²	12	64.8 Å²	64.8	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	-73.1	-39.1	178.4	-70.1	165.9	0	0	0	111.7	M233 L234 E235 F249 A299 D302 I303	M233-I237 WeakPolarHBondContact O-CG1 3.3Å; M233-I237 PolarHBondContact O-N 2.94Å; M233-I237 VanDerWaalsContact O-N 3.09Å; L234-I237 PolarHBondContact O-N 3.34Å; E235-I237 PolarHBondContact O-N 3.3Å; I237-F249 HydrophobicContact CD1-CD2 4.2Å; I237-F249 HydrophobicContact CD1-CE2 3.69Å; I237-F249 HydrophobicContact CD1-CZ 4.34Å; I237-F249 HydrophobicContact CG1-CD2 3.48Å; I237-F249 VanDerWaalsContact CG1-CD2 3.48Å; I237-F249 HydrophobicContact CG1-CE2 3.49Å; I237-F249 VanDerWaalsContact CG1-CE2 3.49Å; I237-F249 HydrophobicContact CG1-CG 4.3Å; I237-F249 HydrophobicContact CG1-CZ 4.32Å; I237-A299 HydrophobicContact CG2-CB 4.09Å; I237-D302 HydrophobicContact CD1-CB 3.88Å; I237-D302 HydrophobicContact CG2-CB 4.1Å; I237-I303 HydrophobicContact CD1-CB 4.3Å; I237-I303 HydrophobicContact CD1-CD1 4.28Å; I237-I303 HydrophobicContact CD1-CG1 3.28Å
238	Q	81.2	Confident	74.5	Confident	89 Å²	89	68.4 Å²	68.4	42%	0.416	32%	0.322	S	S	.	.	H	α-helix	trans	-71.5	-41.9	177.1	-70.6	179.7	4.4	0	0	111.2	L234 E235 A240 R241	L234-Q238 HydrophobicContact CD1-CG 4.45Å; L234-Q238 WeakPolarHBondContact O-CB 3.45Å; L234-Q238 WeakPolarHBondContact O-CG 3.41Å; L234-Q238 PolarHBondContact O-N 2.92Å; E235-Q238 PolarHBondContact O-N 3.31Å; Q238-A240 VanDerWaalsContact C-N 3.3Å; Q238-A240 PolarHBondContact O-N 3.36Å; Q238-R241 WeakPolarHBondContact O-CB 3.34Å; Q238-R241 PolarHBondContact O-N 3.19Å
239	G	66.6	Low	73.9	Confident	9 Å²	9	70.7 Å²	70.7	9%	0.093	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-33.2	176.2	0	0	0	0	0	113.4	E235 R241 E242	E235-G239 WeakPolarHBondContact O-CA 3.39Å; E235-G239 PolarHBondContact O-N 3.17Å; G239-R241 PolarHBondContact O-N 2.96Å; G239-R241 VanDerWaalsContact O-N 3.1Å; G239-E242 CarbonylContact O-C 3.57Å; G239-E242 PolarHBondContact O-N 3.36Å; G239-E242 VanDerWaalsContact O-N 3.08Å
240	A	57.3	Low	73.4	Confident	75 Å²	75	78 Å²	78	62%	0.62	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.7	171.9	0	0	0	0	0	113.9	A236 Q238	A236-A240 PolarHBondContact O-N 3.4Å; A236-A240 VanDerWaalsContact O-N 3.13Å; Q238-A240 VanDerWaalsContact C-N 3.3Å; Q238-A240 PolarHBondContact O-N 3.36Å
241	R	53.8	Low	73	Confident	134 Å²	134	79.8 Å²	79.8	51%	0.506	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-13.9	176.9	-59	-179	-177.5	178.4	3.1	113.1	Q238 G239 D302	Q238-R241 WeakPolarHBondContact O-CB 3.34Å; Q238-R241 PolarHBondContact O-N 3.19Å; G239-R241 PolarHBondContact O-N 2.96Å; G239-R241 VanDerWaalsContact O-N 3.1Å; R241-D302 IonicContact NH2-OD2 3.55Å; R241-D302 PolarHBondContact NH2-OD2 3.42Å
242	E	48.1	Very low	72.9	Confident	147 Å²	147	76.9 Å²	76.9	69%	0.687	36%	0.359	S	S	*	.	S	Bend	trans	-119.1	116.9	178.6	-68.1	-175.5	174.5	0	0	109.9	G239 M244 S245	G239-E242 CarbonylContact O-C 3.57Å; G239-E242 PolarHBondContact O-N 3.36Å; G239-E242 VanDerWaalsContact O-N 3.08Å; E242-M244 PolarHBondContact O-N 3.29Å; E242-S245 PolarHBondContact O-N 3.08Å
243	Y	45.2	Very low	72.8	Confident	254 Å²	254	77.7 Å²	77.7	100%	0.996	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	8.2	-176.5	-86.3	-93.8	0	0	0	116.3
244	M	44.7	Very low	72.8	Confident	182 Å²	182	80.9 Å²	80.9	90%	0.897	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-2.1	-175.6	-110.1	-174.2	-64.3	0	0	115	E242	E242-M244 PolarHBondContact O-N 3.29Å
245	S	52	Low	73	Confident	30 Å²	30	80.1 Å²	80.1	21%	0.21	38%	0.375	C	S	.	.			trans	-75.1	135.9	178	-176.8	0	0	0	0	112.3	E242 I247	E242-S245 PolarHBondContact O-N 3.08Å; S245-I247 VanDerWaalsContact C-N 3.29Å; S245-I247 PolarHBondContact OG-N 2.77Å
246	K	58.3	Low	73.2	Confident	142 Å²	142	75.9 Å²	75.9	62%	0.617	36%	0.356	S	S	*	.	S	Bend	trans	-82.6	-1.3	173.4	-73.4	-175.8	177.4	-179	0	113.2
247	I	67.3	Low	73.6	Confident	24 Å²	24	80.5 Å²	80.5	12%	0.123	38%	0.377	C	S	.	.			trans	-112.5	114.6	-177.1	-56.4	179.3	0	0	0	108.9	Y178 L232 E235 A236 S245 V252	Y178-I247 HydrophobicContact CE1-CG1 4.39Å; Y178-I247 HydrophobicContact CE1-CG2 4.03Å; L232-I247 HydrophobicContact CD1-CD1 4.12Å; E235-I247 HydrophobicContact CG-CD1 4.15Å; A236-I247 HydrophobicContact CB-CG2 3.72Å; S245-I247 VanDerWaalsContact C-N 3.29Å; S245-I247 PolarHBondContact OG-N 2.77Å; I247-V252 HydrophobicContact CG2-CG2 3.6Å
248	Y	73.8	Confident	74.1	Confident	146 Å²	146	81.9 Å²	81.9	57%	0.573	38%	0.384	S	S	*	.			trans	-96.1	134.9	175.7	-59.6	-77.8	0	0	0	110.2	E250 D251 V252	Y248-E250 PolarHBondContact O-N 3.33Å; Y248-D251 WeakPolarHBondContact CD2-OD2 3.21Å; Y248-D251 PolarHBondContact O-N 3.36Å; Y248-D251 VanDerWaalsContact O-N 3.16Å; Y248-V252 PolarHBondContact O-N 3.45Å
249	F	82.8	Confident	74.8	Confident	56 Å²	56	77.7 Å²	77.7	25%	0.246	36%	0.364	C	S	.	.	H	α-helix	trans	-56.9	-37.1	179	-173.8	-110.2	0	0	0	112.7	A236 I237 V252 T253 Y306	A236-F249 HydrophobicContact CB-CB 4.42Å; A236-F249 HydrophobicContact CB-CD2 4.13Å; I237-F249 HydrophobicContact CD1-CD2 4.2Å; I237-F249 HydrophobicContact CD1-CE2 3.69Å; I237-F249 HydrophobicContact CD1-CZ 4.34Å; I237-F249 HydrophobicContact CG1-CD2 3.48Å; I237-F249 VanDerWaalsContact CG1-CD2 3.48Å; I237-F249 HydrophobicContact CG1-CE2 3.49Å; I237-F249 VanDerWaalsContact CG1-CE2 3.49Å; I237-F249 HydrophobicContact CG1-CG 4.3Å; I237-F249 HydrophobicContact CG1-CZ 4.32Å; F249-V252 PolarHBondContact O-N 3.03Å; F249-T253 HydrophobicContact CD1-CG2 4.2Å; F249-T253 HydrophobicContact CE1-CG2 3.82Å; F249-T253 HydrophobicContact CE2-CG2 4.22Å; F249-T253 HydrophobicContact CZ-CG2 3.84Å; F249-T253 WeakPolarHBondContact O-CG2 3.38Å; F249-T253 PolarHBondContact O-N 3.2Å; F249-T253 PolarHBondContact O-OG1 3.36Å; F249-Y306 HydrophobicContact CZ-CG 4.29Å
250	E	84.1	Confident	76.1	Confident	158 Å²	158	77.8 Å²	77.8	74%	0.738	36%	0.362	S	S	*	.	H	α-helix	trans	-61.9	-43.4	178	-64.7	178.5	175.2	0	0	112.2	Y248 T253 E254	Y248-E250 PolarHBondContact O-N 3.33Å; E250-T253 WeakPolarHBondContact CA-OG1 3.36Å; E250-T253 PolarHBondContact O-N 3.16Å; E250-T253 PolarHBondContact O-OG1 3.41Å; E250-E254 PolarHBondContact O-N 2.97Å
251	D	87	Confident	77.9	Confident	37 Å²	37	80.4 Å²	80.4	20%	0.198	36%	0.362	C	S	.	.	H	α-helix	trans	-67.2	-38.1	178	-71.6	-42.7	0	0	0	111.9	Y178 K185 Y248 E254 F255	Y178-D251 WeakPolarHBondContact OH-CB 3.42Å; K185-D251 IonicContact NZ-OD1 3.05Å; K185-D251 PolarHBondContact NZ-OD1 2.85Å; Y248-D251 WeakPolarHBondContact CD2-OD2 3.21Å; Y248-D251 PolarHBondContact O-N 3.36Å; Y248-D251 VanDerWaalsContact O-N 3.16Å; D251-E254 PolarHBondContact O-N 2.82Å; D251-F255 PolarHBondContact O-N 3.13Å
252	V	91.1	Very high	79.7	Confident	0 Å²	0	75 Å²	75	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-64.3	-43.2	174.4	176.3	0	0	0	0	110.4	Y178 L232 M233 A236 I247 Y248 F249 F255 L256	Y178-V252 HydrophobicContact CD2-CG2 4.46Å; Y178-V252 HydrophobicContact CE1-CG2 4.17Å; Y178-V252 HydrophobicContact CE2-CB 4.28Å; Y178-V252 HydrophobicContact CE2-CG2 3.68Å; Y178-V252 VanDerWaalsContact CZ-CG2 3.49Å; Y178-V252 WeakPolarHBondContact OH-CG2 3.37Å; L232-V252 HydrophobicContact CD2-CG1 4.41Å; L232-V252 HydrophobicContact CG-CG1 4.4Å; L232-V252 HydrophobicContact CG-CG2 4.41Å; M233-V252 HydrophobicContact CG-CG1 4.24Å; A236-V252 HydrophobicContact CB-CB 4.36Å; A236-V252 HydrophobicContact CB-CG2 3.8Å; I247-V252 HydrophobicContact CG2-CG2 3.6Å; Y248-V252 PolarHBondContact O-N 3.45Å; F249-V252 PolarHBondContact O-N 3.03Å; V252-F255 PolarHBondContact O-N 2.85Å; V252-L256 HydrophobicContact CG1-CD1 3.99Å; V252-L256 HydrophobicContact CG1-CG 4.36Å; V252-L256 WeakPolarHBondContact O-CB 3.38Å; V252-L256 VanDerWaalsContact O-CG 3.25Å; V252-L256 WeakPolarHBondContact O-CG 3.38Å; V252-L256 PolarHBondContact O-N 3.04Å
253	T	90.9	Very high	81.9	Confident	20 Å²	20	68.2 Å²	68.2	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-65.6	-39.5	177.9	52.5	0	0	0	0	112.6	F249 E250 L256 E257 Y306	F249-T253 HydrophobicContact CD1-CG2 4.2Å; F249-T253 HydrophobicContact CE1-CG2 3.82Å; F249-T253 HydrophobicContact CE2-CG2 4.22Å; F249-T253 HydrophobicContact CZ-CG2 3.84Å; F249-T253 WeakPolarHBondContact O-CG2 3.38Å; F249-T253 PolarHBondContact O-N 3.2Å; F249-T253 PolarHBondContact O-OG1 3.36Å; E250-T253 WeakPolarHBondContact CA-OG1 3.36Å; E250-T253 PolarHBondContact O-N 3.16Å; E250-T253 PolarHBondContact O-OG1 3.41Å; T253-L256 PolarHBondContact O-N 3.41Å; T253-E257 VanDerWaalsContact O-CG 3.31Å; T253-E257 WeakPolarHBondContact O-CG 3.46Å; T253-E257 PolarHBondContact O-N 2.85Å; T253-Y306 HydrophobicContact CG2-CD2 3.53Å; T253-Y306 HydrophobicContact CG2-CE1 4.47Å; T253-Y306 HydrophobicContact CG2-CE2 3.31Å; T253-Y306 HydrophobicContact CG2-CG 4.21Å
254	E	93	Very high	84.1	Confident	67 Å²	67	59 Å²	59	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-48	175.1	-179.6	-175.7	172.6	0	0	111.4	K185 E250 D251 L256 E257 E258	K185-E254 IonicContact NZ-OE1 3.21Å; K185-E254 IonicContact NZ-OE2 3.82Å; K185-E254 PolarHBondContact NZ-OE2 3.49Å; E250-E254 PolarHBondContact O-N 2.97Å; D251-E254 PolarHBondContact O-N 2.82Å; E254-L256 VanDerWaalsContact C-N 3.33Å; E254-L256 PolarHBondContact O-N 3.34Å; E254-E257 PolarHBondContact O-N 3.25Å; E254-E258 PolarHBondContact O-N 2.95Å; E254-E258 VanDerWaalsContact O-N 3.16Å
255	F	94.7	Very high	86.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-44.8	175.7	171.6	-117.9	0	0	0	112.1	F174 Y178 F181 T210 D251 V252 E257 E258 V259	F174-F255 HydrophobicContact CD1-CE1 4.43Å; F174-F255 AromaticContact CE1-CE1 3.77Å; F174-F255 HydrophobicContact CE1-CE1 3.77Å; F174-F255 HydrophobicContact CZ-CE1 4.35Å; Y178-F255 HydrophobicContact CD2-CB 4.02Å; Y178-F255 AromaticContact CD2-CD1 3.65Å; Y178-F255 HydrophobicContact CD2-CD1 3.65Å; Y178-F255 HydrophobicContact CD2-CE1 4.25Å; Y178-F255 AromaticContact CD2-CG 3.91Å; Y178-F255 HydrophobicContact CD2-CG 3.91Å; Y178-F255 HydrophobicContact CE2-CB 4.23Å; Y178-F255 HydrophobicContact CG-CD1 4.43Å; F181-F255 HydrophobicContact CB-CD2 3.76Å; F181-F255 HydrophobicContact CB-CE2 3.89Å; F181-F255 HydrophobicContact CD1-CB 3.88Å; F181-F255 AromaticContact CD1-CD2 3.8Å; F181-F255 HydrophobicContact CD1-CD2 3.8Å; F181-F255 HydrophobicContact CD1-CG 4.17Å; F181-F255 AromaticContact CD2-CD2 3.59Å; F181-F255 HydrophobicContact CD2-CD2 3.59Å; F181-F255 HydrophobicContact CD2-CE2 4.11Å; F181-F255 HydrophobicContact CE1-CB 3.86Å; F181-F255 HydrophobicContact CE1-CD2 4.27Å; F181-F255 HydrophobicContact CE2-CD2 4.07Å; F181-F255 HydrophobicContact CG-CB 4.41Å; F181-F255 AromaticContact CG-CD2 3.44Å; F181-F255 HydrophobicContact CG-CD2 3.44Å; F181-F255 VanDerWaalsContact CG-CD2 3.44Å; F181-F255 HydrophobicContact CG-CE2 4.02Å; F181-F255 HydrophobicContact CG-CG 4.24Å; F181-F255 HydrophobicContact CZ-CB 4.37Å; F181-F255 HydrophobicContact CZ-CD2 4.39Å; T210-F255 HydrophobicContact CG2-CE1 4.27Å; T210-F255 HydrophobicContact CG2-CZ 3.81Å; T210-F255 WeakPolarHBondContact OG1-CZ 3.25Å; D251-F255 PolarHBondContact O-N 3.13Å; V252-F255 PolarHBondContact O-N 2.85Å; F255-E257 VanDerWaalsContact C-N 3.35Å; F255-E257 PolarHBondContact O-N 3.29Å; F255-E258 PolarHBondContact O-N 3.04Å; F255-V259 HydrophobicContact CD2-CG2 4.2Å; F255-V259 HydrophobicContact CE1-CG2 4.42Å; F255-V259 HydrophobicContact CE2-CG2 3.85Å; F255-V259 HydrophobicContact CZ-CG2 3.99Å; F255-V259 WeakPolarHBondContact O-CG2 3.48Å; F255-V259 PolarHBondContact O-N 3.48Å; F255-V259 VanDerWaalsContact O-N 3.09Å
256	L	94.8	Very high	87.5	Confident	11 Å²	11	58.7 Å²	58.7	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-34.7	178.8	-68.8	176.9	0	0	0	112.5	F174 L229 M233 V252 T253 E254 V259 I260 Y306	F174-L256 HydrophobicContact CE1-CD2 4.08Å; F174-L256 HydrophobicContact CZ-CD2 4.09Å; L229-L256 HydrophobicContact CD1-CD1 4.01Å; L229-L256 HydrophobicContact CD1-CD2 3.46Å; L229-L256 VanDerWaalsContact CD1-CD2 3.46Å; L229-L256 HydrophobicContact CD1-CG 4.37Å; M233-L256 HydrophobicContact CE-CD1 4.18Å; M233-L256 HydrophobicContact CG-CD1 4.08Å; M233-L256 HydrophobicContact SD-CD1 3.89Å; V252-L256 HydrophobicContact CG1-CD1 3.99Å; V252-L256 HydrophobicContact CG1-CG 4.36Å; V252-L256 WeakPolarHBondContact O-CB 3.38Å; V252-L256 VanDerWaalsContact O-CG 3.25Å; V252-L256 WeakPolarHBondContact O-CG 3.38Å; V252-L256 PolarHBondContact O-N 3.04Å; T253-L256 PolarHBondContact O-N 3.41Å; E254-L256 VanDerWaalsContact C-N 3.33Å; E254-L256 PolarHBondContact O-N 3.34Å; L256-V259 PolarHBondContact O-N 2.9Å; L256-I260 WeakPolarHBondContact O-CB 3.36Å; L256-I260 WeakPolarHBondContact O-CD1 3.48Å; L256-I260 WeakPolarHBondContact O-CG1 3.34Å; L256-I260 PolarHBondContact O-N 3.13Å; L256-Y306 HydrophobicContact CD1-CE1 4.38Å
257	E	94.7	Very high	88.6	Confident	97 Å²	97	56.4 Å²	56.4	45%	0.453	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-46.8	174.7	-76.3	175.7	177.4	0	0	111	T253 E254 F255 V259 I260 E261	T253-E257 VanDerWaalsContact O-CG 3.31Å; T253-E257 WeakPolarHBondContact O-CG 3.46Å; T253-E257 PolarHBondContact O-N 2.85Å; E254-E257 PolarHBondContact O-N 3.25Å; F255-E257 VanDerWaalsContact C-N 3.35Å; F255-E257 PolarHBondContact O-N 3.29Å; E257-V259 VanDerWaalsContact C-N 3.34Å; E257-V259 PolarHBondContact O-N 3.25Å; E257-I260 PolarHBondContact O-N 3.35Å; E257-E261 WeakPolarHBondContact O-CG 3.28Å; E257-E261 PolarHBondContact O-N 3.3Å
258	E	94.9	Very high	89.4	Confident	41 Å²	41	63.9 Å²	63.9	19%	0.192	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-39.8	175.5	-70.4	-167.8	-138.4	0	0	112.1	F181 R203 V207 E254 F255 A262	F181-E258 WeakPolarHBondContact CZ-OE1 3.25Å; R203-E258 IonicContact CZ-OE1 3.71Å; R203-E258 IonicContact CZ-OE2 3.75Å; R203-E258 IonicContact NE-OE1 3.87Å; R203-E258 IonicContact NE-OE2 3.58Å; R203-E258 IonicContact NH2-OE1 3.36Å; R203-E258 PolarHBondContact NH2-OE1 3.31Å; R203-E258 IonicContact NH2-OE2 3.16Å; R203-E258 PolarHBondContact NH2-OE2 2.99Å; R203-E258 VanDerWaalsContact NH2-OE2 3.16Å; V207-E258 HydrophobicContact CG1-CB 4.23Å; V207-E258 HydrophobicContact CG2-CB 4.05Å; E254-E258 PolarHBondContact O-N 2.95Å; E254-E258 VanDerWaalsContact O-N 3.16Å; F255-E258 PolarHBondContact O-N 3.04Å; E258-A262 WeakPolarHBondContact O-CB 3.37Å; E258-A262 PolarHBondContact O-N 2.87Å
259	V	95.1	Very high	90	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.012	31%	0.305	C	S	.	.	H	α-helix	trans	-68.2	-40.7	177.3	173.6	0	0	0	0	111.8	V207 T210 L214 F255 L256 E257 A262 L263	V207-V259 HydrophobicContact CG1-CG2 4.01Å; T210-V259 HydrophobicContact CG2-CG1 3.98Å; T210-V259 HydrophobicContact CG2-CG2 3.85Å; L214-V259 HydrophobicContact CD1-CG1 3.8Å; F255-V259 HydrophobicContact CD2-CG2 4.2Å; F255-V259 HydrophobicContact CE1-CG2 4.42Å; F255-V259 HydrophobicContact CE2-CG2 3.85Å; F255-V259 HydrophobicContact CZ-CG2 3.99Å; F255-V259 WeakPolarHBondContact O-CG2 3.48Å; F255-V259 PolarHBondContact O-N 3.48Å; F255-V259 VanDerWaalsContact O-N 3.09Å; L256-V259 PolarHBondContact O-N 2.9Å; E257-V259 VanDerWaalsContact C-N 3.34Å; E257-V259 PolarHBondContact O-N 3.25Å; V259-A262 PolarHBondContact O-N 2.68Å; V259-L263 HydrophobicContact CG1-CD1 3.99Å; V259-L263 HydrophobicContact CG1-CG 4.46Å; V259-L263 WeakPolarHBondContact O-CG 3.35Å; V259-L263 PolarHBondContact O-N 3.2Å
260	I	94.9	Very high	90.4	Very high	10 Å²	10	61.5 Å²	61.5	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-45.6	176.6	-73.7	165.2	0	0	0	110.2	L256 E257 A262 L263 I264 F272 Q310 D312 M313	L256-I260 WeakPolarHBondContact O-CB 3.36Å; L256-I260 WeakPolarHBondContact O-CD1 3.48Å; L256-I260 WeakPolarHBondContact O-CG1 3.34Å; L256-I260 PolarHBondContact O-N 3.13Å; E257-I260 PolarHBondContact O-N 3.35Å; I260-A262 VanDerWaalsContact C-N 3.3Å; I260-A262 PolarHBondContact O-N 2.95Å; I260-L263 PolarHBondContact O-N 3.05Å; I260-I264 HydrophobicContact CG2-CD1 3.62Å; I260-I264 HydrophobicContact CG2-CG1 4.43Å; I260-I264 VanDerWaalsContact O-CG1 3.3Å; I260-I264 WeakPolarHBondContact O-CG1 3.44Å; I260-I264 PolarHBondContact O-N 3.39Å; I260-F272 HydrophobicContact CB-CE2 4.24Å; I260-F272 HydrophobicContact CB-CZ 4.29Å; I260-F272 HydrophobicContact CG1-CE2 3.98Å; I260-F272 HydrophobicContact CG1-CZ 3.97Å; I260-F272 HydrophobicContact CG2-CE2 3.84Å; I260-F272 HydrophobicContact CG2-CZ 3.56Å; I260-Q310 HydrophobicContact CD1-CG 4.44Å; I260-D312 HydrophobicContact CG2-CB 4.5Å; I260-M313 HydrophobicContact CD1-CG 4.15Å
261	E	94.4	Very high	90.8	Very high	131 Å²	131	56.4 Å²	56.4	61%	0.612	29%	0.285	S	S	*	.	H	α-helix	trans	-58.3	-44.1	175.5	-73.8	-176.2	177.2	0	0	111.4	E257 L263 I264 L265	E257-E261 WeakPolarHBondContact O-CG 3.28Å; E257-E261 PolarHBondContact O-N 3.3Å; E261-L263 PolarHBondContact O-N 3.2Å; E261-I264 PolarHBondContact O-N 3.28Å; E261-L265 VanDerWaalsContact O-CG 3.31Å; E261-L265 WeakPolarHBondContact O-CG 3.2Å; E261-L265 PolarHBondContact O-N 3.37Å; E261-L265 VanDerWaalsContact O-N 3.13Å
262	A	92.7	Very high	91.2	Very high	21 Å²	21	55.1 Å²	55.1	17%	0.174	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-37.3	177.4	0	0	0	0	0	113.1	V207 R211 E258 V259 I260	V207-A262 HydrophobicContact CG1-CB 3.97Å; R211-A262 WeakPolarHBondContact CD-O 3.44Å; R211-A262 PolarHBondContact NE-O 2.9Å; E258-A262 WeakPolarHBondContact O-CB 3.37Å; E258-A262 PolarHBondContact O-N 2.87Å; V259-A262 PolarHBondContact O-N 2.68Å; I260-A262 VanDerWaalsContact C-N 3.3Å; I260-A262 PolarHBondContact O-N 2.95Å
263	L	93.4	Very high	91.3	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-67.3	-39.2	176.2	-76.4	164	0	0	0	112.3	R211 L214 L215 V259 I260 E261 D266 F272 V275	R211-L263 HydrophobicContact CB-CD2 4.48Å; R211-L263 HydrophobicContact CG-CD2 3.81Å; R211-L263 HydrophobicContact CG-CG 4.2Å; L214-L263 HydrophobicContact CB-CD2 4.4Å; L214-L263 HydrophobicContact CD1-CD1 3.91Å; L215-L263 HydrophobicContact CD2-CD2 3.95Å; L215-L263 HydrophobicContact CG-CD2 3.96Å; V259-L263 HydrophobicContact CG1-CD1 3.99Å; V259-L263 HydrophobicContact CG1-CG 4.46Å; V259-L263 WeakPolarHBondContact O-CG 3.35Å; V259-L263 PolarHBondContact O-N 3.2Å; I260-L263 PolarHBondContact O-N 3.05Å; E261-L263 PolarHBondContact O-N 3.2Å; L263-D266 CarbonylContact O-C 3.59Å; L263-F272 HydrophobicContact CB-CD2 3.87Å; L263-F272 HydrophobicContact CB-CE2 4.29Å; L263-F272 HydrophobicContact CD1-CD2 4.22Å; L263-F272 HydrophobicContact CD1-CE2 4.15Å; L263-V275 HydrophobicContact CD1-CG1 4.23Å; L263-V275 HydrophobicContact CD2-CG1 4.39Å; L263-V275 HydrophobicContact CD2-CG2 4.34Å
264	I	91.9	Very high	91.5	Very high	61 Å²	61	60.8 Å²	60.8	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-72	-31.5	-178.9	-67.7	166.4	0	0	0	111.6	I260 E261 D266 F272 D312	I260-I264 HydrophobicContact CG2-CD1 3.62Å; I260-I264 HydrophobicContact CG2-CG1 4.43Å; I260-I264 VanDerWaalsContact O-CG1 3.3Å; I260-I264 WeakPolarHBondContact O-CG1 3.44Å; I260-I264 PolarHBondContact O-N 3.39Å; E261-I264 PolarHBondContact O-N 3.28Å; I264-D266 VanDerWaalsContact C-N 3.29Å; I264-D266 PolarHBondContact O-N 3.33Å; I264-F272 HydrophobicContact CG1-CB 4.41Å; I264-F272 HydrophobicContact CG1-CD1 4.41Å; I264-F272 HydrophobicContact CG1-CD2 4.2Å; I264-F272 HydrophobicContact CG1-CE2 4.49Å; I264-F272 HydrophobicContact CG1-CG 4.12Å; I264-D312 HydrophobicContact CD1-CB 3.73Å; I264-D312 VanDerWaalsContact CD1-CG 3.41Å
265	L	89.7	Confident	91.5	Very high	152 Å²	152	57.6 Å²	57.6	80%	0.796	29%	0.29	S	S	*	.	H	α-helix	trans	-69.8	-25	179.9	-76.1	170.2	0	0	0	113.6	E261	E261-L265 VanDerWaalsContact O-CG 3.31Å; E261-L265 WeakPolarHBondContact O-CG 3.2Å; E261-L265 PolarHBondContact O-N 3.37Å; E261-L265 VanDerWaalsContact O-N 3.13Å
266	D	78.8	Confident	91.6	Very high	53 Å²	53	58 Å²	58	28%	0.283	29%	0.293	S	S	.	.			trans	-141	91.6	-176	178.3	-2.3	0	0	0	110.6	R211 L263 I264 E268	R211-D266 VanDerWaalsContact CZ-CG 3.5Å; R211-D266 IonicContact CZ-OD2 3.11Å; R211-D266 IonicContact NH1-OD2 3.1Å; R211-D266 PolarHBondContact NH1-OD2 3.28Å; R211-D266 VanDerWaalsContact NH1-OD2 3.1Å; R211-D266 PolarHBondContact NH2-O 3.24Å; R211-D266 IonicContact NH2-OD1 3.69Å; R211-D266 PolarHBondContact NH2-OD1 2.86Å; R211-D266 IonicContact NH2-OD2 2.7Å; R211-D266 PolarHBondContact NH2-OD2 3.01Å; L263-D266 CarbonylContact O-C 3.59Å; I264-D266 VanDerWaalsContact C-N 3.29Å; I264-D266 PolarHBondContact O-N 3.33Å; D266-E268 WeakPolarHBondContact OD1-CB 3.44Å; D266-E268 WeakPolarHBondContact OD1-CG 3.49Å; D266-E268 PolarHBondContact OD1-N 2.86Å
267	E	81.6	Confident	91.6	Very high	95 Å²	95	60.6 Å²	60.6	44%	0.444	31%	0.305	S	S	.	.			trans	-97.1	21.4	177.8	-59.9	-167.3	137.2	0	0	112.8	V269 F272	E267-V269 VanDerWaalsContact C-N 3.34Å; E267-V269 PolarHBondContact O-N 3.44Å; E267-F272 PolarHBondContact OE1-N 2.98Å
268	E	83	Confident	91.7	Very high	180 Å²	180	57.8 Å²	57.8	84%	0.841	30%	0.296	S	S	*	.	S	Bend	trans	-67.3	-33.3	-176.4	-68.5	-170.4	171.6	0	0	113.2	D266	D266-E268 WeakPolarHBondContact OD1-CB 3.44Å; D266-E268 WeakPolarHBondContact OD1-CG 3.49Å; D266-E268 PolarHBondContact OD1-N 2.86Å
269	V	86.6	Confident	91.8	Very high	91 Å²	91	55.8 Å²	55.8	55%	0.552	29%	0.286	S	S	*	.	S	Bend	trans	-93	-51.7	-175.8	-177.8	0	0	0	0	111.9	L215 T216 E267	L215-V269 HydrophobicContact CB-CG1 4.38Å; L215-V269 HydrophobicContact CD2-CB 4.47Å; T216-V269 HydrophobicContact CG2-CG1 4.18Å; E267-V269 VanDerWaalsContact C-N 3.34Å; E267-V269 PolarHBondContact O-N 3.44Å
270	R	91.4	Very high	91.9	Very high	62 Å²	62	55.7 Å²	55.7	23%	0.234	29%	0.286	C	S	.	.	S	Bend	trans	-142.3	146.1	174.6	-69.7	-175.2	-171.9	179.7	6.3	108.7	L215 E218 E274 V275	L215-R270 HydrophobicContact CD2-CB 3.88Å; L215-R270 WeakPolarHBondContact O-CD 3.14Å; L215-R270 VanDerWaalsContact O-CZ 3.28Å; L215-R270 PolarHBondContact O-NE 3.22Å; E218-R270 IonicContact OE1-CZ 2.81Å; E218-R270 IonicContact OE1-NH1 2.86Å; E218-R270 PolarHBondContact OE1-NH1 2.8Å; E218-R270 VanDerWaalsContact OE1-NH1 3.15Å; E218-R270 IonicContact OE1-NH2 3.84Å; E218-R270 PolarHBondContact OE1-NH2 3.23Å; E218-R270 IonicContact OE2-CZ 3.45Å; E218-R270 IonicContact OE2-NH2 3.21Å; E218-R270 PolarHBondContact OE2-NH2 2.97Å; R270-E274 WeakPolarHBondContact CA-OE2 3.32Å; R270-E274 HydrophobicContact CB-CB 4.24Å; R270-V275 HydrophobicContact CB-CG2 3.96Å
271	T	92.9	Very high	92	Very high	51 Å²	51	59 Å²	59	31%	0.313	30%	0.304	S	S	.	.			trans	-72.7	154.2	171.1	62.4	0	0	0	0	110.4	P273 E274 V275	T271-P273 VanDerWaalsContact C-CD 3.46Å; T271-P273 VanDerWaalsContact C-N 3.32Å; T271-E274 PolarHBondContact N-OE2 3.03Å; T271-E274 WeakPolarHBondContact O-CB 3.46Å; T271-E274 PolarHBondContact O-N 2.95Å; T271-E274 VanDerWaalsContact OG1-CD 3.25Å; T271-E274 VanDerWaalsContact OG1-CG 3.28Å; T271-E274 WeakPolarHBondContact OG1-CG 3.19Å; T271-E274 PolarHBondContact OG1-OE2 3.06Å; T271-V275 PolarHBondContact O-N 3.35Å
272	F	94.1	Very high	92.2	Very high	9 Å²	9	54 Å²	54	4%	0.039	28%	0.282	C	S	.	.	H	α-helix	trans	-54.6	-39.6	178.2	-177.5	-114.7	0	0	0	114.3	I260 L263 I264 E267 E274 V275 M276 D312 M313 V316	I260-F272 HydrophobicContact CB-CE2 4.24Å; I260-F272 HydrophobicContact CB-CZ 4.29Å; I260-F272 HydrophobicContact CG1-CE2 3.98Å; I260-F272 HydrophobicContact CG1-CZ 3.97Å; I260-F272 HydrophobicContact CG2-CE2 3.84Å; I260-F272 HydrophobicContact CG2-CZ 3.56Å; L263-F272 HydrophobicContact CB-CD2 3.87Å; L263-F272 HydrophobicContact CB-CE2 4.29Å; L263-F272 HydrophobicContact CD1-CD2 4.22Å; L263-F272 HydrophobicContact CD1-CE2 4.15Å; I264-F272 HydrophobicContact CG1-CB 4.41Å; I264-F272 HydrophobicContact CG1-CD1 4.41Å; I264-F272 HydrophobicContact CG1-CD2 4.2Å; I264-F272 HydrophobicContact CG1-CE2 4.49Å; I264-F272 HydrophobicContact CG1-CG 4.12Å; E267-F272 PolarHBondContact OE1-N 2.98Å; F272-E274 PolarHBondContact O-N 3.49Å; F272-V275 PolarHBondContact O-N 3.4Å; F272-M276 HydrophobicContact CD2-CG 4.13Å; F272-M276 HydrophobicContact CE2-CG 3.88Å; F272-M276 HydrophobicContact CZ-CG 4.17Å; F272-M276 WeakPolarHBondContact O-CG 3.17Å; F272-M276 PolarHBondContact O-N 3.34Å; F272-D312 HydrophobicContact CD1-CB 4.26Å; F272-D312 HydrophobicContact CE1-CB 3.53Å; F272-D312 HydrophobicContact CZ-CB 4.13Å; F272-M313 HydrophobicContact CD1-CE 4.22Å; F272-M313 HydrophobicContact CE1-CE 3.18Å; F272-M313 HydrophobicContact CE2-CE 3.87Å; F272-M313 HydrophobicContact CZ-CE 2.98Å; F272-V316 HydrophobicContact CD1-CG2 3.75Å; F272-V316 HydrophobicContact CE1-CG2 3.96Å
273	P	94.6	Very high	92.4	Very high	34 Å²	34	53 Å²	53	22%	0.221	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-42.9	171.9	-24.3	34	0	0	0	114.1	T271 V275 M276 I277 V316	T271-P273 VanDerWaalsContact C-CD 3.46Å; T271-P273 VanDerWaalsContact C-N 3.32Å; P273-V275 PolarHBondContact O-N 3.18Å; P273-M276 PolarHBondContact O-N 2.76Å; P273-M276 VanDerWaalsContact O-N 3.13Å; P273-I277 HydrophobicContact CB-CD1 4.36Å; P273-I277 WeakPolarHBondContact O-CB 3.18Å; P273-I277 WeakPolarHBondContact O-CD1 3.45Å; P273-I277 WeakPolarHBondContact O-CG1 3.27Å; P273-I277 PolarHBondContact O-N 3.14Å; P273-V316 HydrophobicContact CB-CG1 4.15Å; P273-V316 HydrophobicContact CB-CG2 4.3Å; P273-V316 HydrophobicContact CG-CG2 4.13Å
274	E	94.1	Very high	92.6	Very high	106 Å²	106	54.7 Å²	54.7	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-31.7	-179.3	-72.8	167.4	150.9	0	0	112.3	R270 T271 F272 P278	R270-E274 WeakPolarHBondContact CA-OE2 3.32Å; R270-E274 HydrophobicContact CB-CB 4.24Å; T271-E274 PolarHBondContact N-OE2 3.03Å; T271-E274 WeakPolarHBondContact O-CB 3.46Å; T271-E274 PolarHBondContact O-N 2.95Å; T271-E274 VanDerWaalsContact OG1-CD 3.25Å; T271-E274 VanDerWaalsContact OG1-CG 3.28Å; T271-E274 WeakPolarHBondContact OG1-CG 3.19Å; T271-E274 PolarHBondContact OG1-OE2 3.06Å; F272-E274 PolarHBondContact O-N 3.49Å; E274-P278 VanDerWaalsContact O-CD 3.31Å; E274-P278 WeakPolarHBondContact O-CD 3.42Å
275	V	93.8	Very high	92.8	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-72.9	-36.2	176.1	175.4	0	0	0	0	112	L214 L215 H226 L263 R270 T271 F272 P273	L214-V275 HydrophobicContact CB-CG1 3.72Å; L214-V275 HydrophobicContact CD1-CG1 4.47Å; L214-V275 HydrophobicContact CD2-CG1 4.18Å; L214-V275 HydrophobicContact CG-CG1 4.35Å; L215-V275 HydrophobicContact CD2-CG2 3.91Å; H226-V275 PolarHBondContact CE1-O 3.03Å; H226-V275 VanDerWaalsContact CE1-O 3.29Å; H226-V275 PolarHBondContact ND1-O 3.23Å; L263-V275 HydrophobicContact CD1-CG1 4.23Å; L263-V275 HydrophobicContact CD2-CG1 4.39Å; L263-V275 HydrophobicContact CD2-CG2 4.34Å; R270-V275 HydrophobicContact CB-CG2 3.96Å; T271-V275 PolarHBondContact O-N 3.35Å; F272-V275 PolarHBondContact O-N 3.4Å; P273-V275 PolarHBondContact O-N 3.18Å
276	M	95.3	Very high	93.1	Very high	9 Å²	9	48.7 Å²	48.7	4%	0.044	26%	0.255	C	S	.	.	H	α-helix	trans	-100.5	-22.5	-166.5	-62.1	-59	-57.4	0	0	114	L229 F272 P273 V279 F280 M313 V316	L229-M276 HydrophobicContact CD2-CE 4.32Å; F272-M276 HydrophobicContact CD2-CG 4.13Å; F272-M276 HydrophobicContact CE2-CG 3.88Å; F272-M276 HydrophobicContact CZ-CG 4.17Å; F272-M276 WeakPolarHBondContact O-CG 3.17Å; F272-M276 PolarHBondContact O-N 3.34Å; P273-M276 PolarHBondContact O-N 2.76Å; P273-M276 VanDerWaalsContact O-N 3.13Å; M276-V279 HydrophobicContact CE-CB 4.39Å; M276-V279 HydrophobicContact CE-CG2 4.02Å; M276-V279 VanDerWaalsContact O-CB 3.32Å; M276-V279 WeakPolarHBondContact O-CB 3.48Å; M276-V279 PolarHBondContact O-N 3.36Å; M276-V279 VanDerWaalsContact O-N 3.09Å; M276-V279 HydrophobicContact SD-CG2 4.33Å; M276-F280 PolarHBondContact O-N 2.94Å; M276-M313 HydrophobicContact CB-CE 3.69Å; M276-M313 HydrophobicContact CB-SD 4.5Å; M276-M313 HydrophobicContact CE-CE 3.65Å; M276-M313 HydrophobicContact CE-SD 3.45Å; M276-M313 WeakPolarHBondContact CE-SD 3.46Å; M276-M313 HydrophobicContact CG-CE 3.37Å; M276-M313 HydrophobicContact CG-SD 4.42Å; M276-M313 HydrophobicContact SD-CE 4.13Å; M276-V316 HydrophobicContact CB-CG1 4.32Å
277	I	96.1	Very high	93.9	Very high	64 Å²	64	46.1 Å²	46.1	33%	0.328	24%	0.242	S	C	.	.	H	α-helix	trans	-53	-46.3	172.5	-75.7	165.9	0	0	0	112.4	P273 V279 F280 D281 V316 Y320	P273-I277 HydrophobicContact CB-CD1 4.36Å; P273-I277 WeakPolarHBondContact O-CB 3.18Å; P273-I277 WeakPolarHBondContact O-CD1 3.45Å; P273-I277 WeakPolarHBondContact O-CG1 3.27Å; P273-I277 PolarHBondContact O-N 3.14Å; I277-V279 PolarHBondContact O-N 3.37Å; I277-F280 WeakPolarHBondContact O-CB 3.33Å; I277-F280 PolarHBondContact O-N 3.04Å; I277-D281 PolarHBondContact O-N 3.31Å; I277-V316 HydrophobicContact CG1-CG1 4.28Å; I277-Y320 HydrophobicContact CB-CD2 4.42Å; I277-Y320 HydrophobicContact CG1-CD2 4.14Å; I277-Y320 HydrophobicContact CG2-CD2 3.97Å; I277-Y320 HydrophobicContact CG2-CE2 3.95Å
278	P	96.6	Very high	94.5	Very high	38 Å²	38	47 Å²	47	25%	0.247	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-30.2	177.3	-26.3	35.7	0	0	0	114.2	H226 E274 F280 D281 V282	H226-P278 HydrophobicContact CB-CB 4.3Å; H226-P278 VanDerWaalsContact CD2-CB 3.48Å; H226-P278 WeakPolarHBondContact CD2-CB 3.33Å; E274-P278 VanDerWaalsContact O-CD 3.31Å; E274-P278 WeakPolarHBondContact O-CD 3.42Å; P278-F280 VanDerWaalsContact C-N 3.34Å; P278-D281 PolarHBondContact O-N 3.32Å; P278-V282 WeakPolarHBondContact O-CG2 3.39Å; P278-V282 PolarHBondContact O-N 3.15Å
279	V	96.8	Very high	94.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-41.8	175	-176.7	0	0	0	0	110.1	H226 L229 V230 M276 I277 V282 L283 F307	H226-V279 HydrophobicContact CB-CG2 4.1Å; L229-V279 HydrophobicContact CD2-CG1 4.13Å; L229-V279 HydrophobicContact CD2-CG2 3.85Å; V230-V279 HydrophobicContact CG2-CG1 3.79Å; M276-V279 HydrophobicContact CE-CB 4.39Å; M276-V279 HydrophobicContact CE-CG2 4.02Å; M276-V279 VanDerWaalsContact O-CB 3.32Å; M276-V279 WeakPolarHBondContact O-CB 3.48Å; M276-V279 PolarHBondContact O-N 3.36Å; M276-V279 VanDerWaalsContact O-N 3.09Å; M276-V279 HydrophobicContact SD-CG2 4.33Å; I277-V279 PolarHBondContact O-N 3.37Å; V279-V282 PolarHBondContact O-N 3.31Å; V279-L283 PolarHBondContact O-N 3.44Å; V279-L283 VanDerWaalsContact O-N 3.12Å; V279-F307 HydrophobicContact CG1-CE2 4.4Å; V279-F307 HydrophobicContact CG1-CZ 4.32Å
280	F	97.8	Very high	95.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.8	-32.6	174.2	-61.9	-49.7	0	0	0	112.8	M276 I277 P278 L283 L284 F307 M313 V316 F317 Y320 L336	M276-F280 PolarHBondContact O-N 2.94Å; I277-F280 WeakPolarHBondContact O-CB 3.33Å; I277-F280 PolarHBondContact O-N 3.04Å; P278-F280 VanDerWaalsContact C-N 3.34Å; F280-L283 HydrophobicContact CD1-CD1 4.33Å; F280-L283 PolarHBondContact O-N 3.34Å; F280-L284 VanDerWaalsContact O-CB 3.31Å; F280-L284 WeakPolarHBondContact O-CB 3.35Å; F280-L284 PolarHBondContact O-N 2.89Å; F280-F307 HydrophobicContact CD1-CD2 4.41Å; F280-F307 HydrophobicContact CE1-CB 4.43Å; F280-F307 AromaticContact CE1-CD2 3.6Å; F280-F307 HydrophobicContact CE1-CD2 3.6Å; F280-F307 HydrophobicContact CE1-CE2 4.07Å; F280-F307 HydrophobicContact CE1-CG 4.24Å; F280-F307 HydrophobicContact CZ-CD2 4.46Å; F280-M313 HydrophobicContact CZ-SD 4.24Å; F280-V316 HydrophobicContact CD2-CG1 4.4Å; F280-V316 HydrophobicContact CE2-CB 4.17Å; F280-V316 HydrophobicContact CE2-CG1 3.8Å; F280-F317 HydrophobicContact CD1-CD2 4.29Å; F280-F317 AromaticContact CE1-CD2 3.91Å; F280-F317 HydrophobicContact CE1-CD2 3.91Å; F280-F317 HydrophobicContact CE2-CB 4.37Å; F280-F317 HydrophobicContact CZ-CB 3.97Å; F280-F317 HydrophobicContact CZ-CD2 4.18Å; F280-Y320 HydrophobicContact CB-CD1 3.66Å; F280-Y320 HydrophobicContact CB-CD2 4.14Å; F280-Y320 HydrophobicContact CB-CE1 3.47Å; F280-Y320 VanDerWaalsContact CB-CE1 3.47Å; F280-Y320 HydrophobicContact CB-CE2 3.97Å; F280-Y320 HydrophobicContact CB-CG 3.99Å; F280-Y320 HydrophobicContact CD2-CD1 4.24Å; F280-Y320 HydrophobicContact CD2-CD2 4.42Å; F280-Y320 AromaticContact CD2-CG 4Å; F280-Y320 HydrophobicContact CD2-CG 4Å; F280-Y320 HydrophobicContact CG-CD1 4.12Å; F280-Y320 HydrophobicContact CG-CE1 4.4Å; F280-Y320 HydrophobicContact CG-CG 4.3Å; F280-L336 HydrophobicContact CB-CD2 4.11Å; F280-L336 HydrophobicContact CD1-CD2 4.07Å; F280-L336 HydrophobicContact CG-CD2 4.4Å
281	D	97.3	Very high	95.2	Very high	79 Å²	79	40.3 Å²	40.3	42%	0.422	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-41.2	173.3	-72.2	-33.4	0	0	0	112.1	I277 P278 L284 G285 Y320	I277-D281 PolarHBondContact O-N 3.31Å; P278-D281 PolarHBondContact O-N 3.32Å; D281-L284 PolarHBondContact O-N 3.46Å; D281-G285 PolarHBondContact O-N 3.26Å; D281-Y320 WeakPolarHBondContact CA-OH 3.16Å; D281-Y320 PolarHBondContact N-OH 2.88Å; D281-Y320 WeakPolarHBondContact OD1-CE2 3.24Å; D281-Y320 PolarHBondContact OD1-OH 2.85Å
282	V	97.3	Very high	95.3	Very high	26 Å²	26	38 Å²	38	16%	0.158	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-47.5	173.1	172.1	0	0	0	0	110.6	H226 E227 V230 P278 V279 G285 R286	H226-V282 HydrophobicContact CB-CG2 4.36Å; E227-V282 HydrophobicContact CG-CG1 4.38Å; V230-V282 HydrophobicContact CB-CG1 4.27Å; V230-V282 HydrophobicContact CG1-CG1 4.47Å; V230-V282 HydrophobicContact CG2-CB 4.36Å; V230-V282 HydrophobicContact CG2-CG1 3.99Å; P278-V282 WeakPolarHBondContact O-CG2 3.39Å; P278-V282 PolarHBondContact O-N 3.15Å; V279-V282 PolarHBondContact O-N 3.31Å; V282-G285 PolarHBondContact O-N 3.4Å; V282-R286 WeakPolarHBondContact O-CG 3.27Å; V282-R286 PolarHBondContact O-N 3.32Å
283	L	97.3	Very high	95.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-44.5	177.3	-74.4	173.3	0	0	0	112.3	V230 V279 F280 G285 R286 I287 Y300 I303 L304 F307	V230-L283 HydrophobicContact CG1-CD2 3.73Å; V230-L283 HydrophobicContact CG1-CG 4.43Å; V230-L283 HydrophobicContact CG2-CD2 4.34Å; V230-L283 HydrophobicContact CG2-CG 4.19Å; V279-L283 PolarHBondContact O-N 3.44Å; V279-L283 VanDerWaalsContact O-N 3.12Å; F280-L283 HydrophobicContact CD1-CD1 4.33Å; F280-L283 PolarHBondContact O-N 3.34Å; L283-G285 VanDerWaalsContact C-N 3.32Å; L283-G285 PolarHBondContact O-N 3Å; L283-R286 PolarHBondContact O-N 2.87Å; L283-I287 HydrophobicContact CB-CD1 4.32Å; L283-I287 WeakPolarHBondContact O-CB 3.4Å; L283-I287 WeakPolarHBondContact O-CD1 3.45Å; L283-I287 WeakPolarHBondContact O-CG1 3.34Å; L283-I287 PolarHBondContact O-N 3.42Å; L283-Y300 HydrophobicContact CD2-CD1 3.64Å; L283-Y300 HydrophobicContact CD2-CE1 4.17Å; L283-I303 HydrophobicContact CD1-CG2 4.29Å; L283-L304 HydrophobicContact CD1-CD2 3.9Å; L283-F307 HydrophobicContact CD1-CD2 4.25Å; L283-F307 HydrophobicContact CD1-CE2 3.72Å
284	L	97.3	Very high	95.3	Very high	39 Å²	39	41.3 Å²	41.3	20%	0.204	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-46.9	174.9	176.5	67	0	0	0	111	F280 D281 R286 K288 Y320 L336 V339	F280-L284 VanDerWaalsContact O-CB 3.31Å; F280-L284 WeakPolarHBondContact O-CB 3.35Å; F280-L284 PolarHBondContact O-N 2.89Å; D281-L284 PolarHBondContact O-N 3.46Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-R286 PolarHBondContact O-N 3.39Å; L284-K288 WeakPolarHBondContact O-CB 3.16Å; L284-K288 PolarHBondContact O-N 3.15Å; L284-Y320 WeakPolarHBondContact CD2-OH 3.37Å; L284-L336 HydrophobicContact CB-CD1 4.23Å; L284-L336 HydrophobicContact CD1-CB 4.25Å; L284-L336 HydrophobicContact CD1-CD1 4.39Å; L284-V339 HydrophobicContact CD1-CB 4.09Å; L284-V339 HydrophobicContact CD1-CG1 4.5Å; L284-V339 HydrophobicContact CD1-CG2 3.67Å
285	G	96.8	Very high	95.2	Very high	32 Å²	32	41.9 Å²	41.9	33%	0.33	22%	0.221	S	C	.	.	H	α-helix	trans	-60.4	-38.7	178.2	0	0	0	0	0	113.4	D281 V282 L283 K288	D281-G285 PolarHBondContact O-N 3.26Å; V282-G285 PolarHBondContact O-N 3.4Å; L283-G285 VanDerWaalsContact C-N 3.32Å; L283-G285 PolarHBondContact O-N 3Å; G285-K288 VanDerWaalsContact O-CE 3.3Å; G285-K288 WeakPolarHBondContact O-CE 3.16Å; G285-K288 WeakPolarHBondContact O-CG 3.13Å
286	R	95.6	Very high	95.2	Very high	54 Å²	54	44.9 Å²	44.9	20%	0.204	24%	0.237	C	C	.	.	H	α-helix	trans	-81.9	-34.1	-178.6	-71	172.5	169.1	-154.3	-1.9	113.4	E227 D231 V282 L283 L284 L290 Y300	E227-R286 IonicContact OE1-CZ 3.7Å; E227-R286 IonicContact OE1-NE 2.87Å; E227-R286 IonicContact OE1-NH2 3.37Å; E227-R286 PolarHBondContact OE1-NH2 2.99Å; D231-R286 IonicContact OD1-CZ 3.57Å; D231-R286 IonicContact OD1-NH1 3.37Å; D231-R286 PolarHBondContact OD1-NH1 3.12Å; D231-R286 IonicContact OD1-NH2 2.67Å; D231-R286 PolarHBondContact OD1-NH2 3.08Å; D231-R286 IonicContact OD2-NH2 3.81Å; D231-R286 PolarHBondContact OD2-NH2 3.35Å; V282-R286 WeakPolarHBondContact O-CG 3.27Å; V282-R286 PolarHBondContact O-N 3.32Å; L283-R286 PolarHBondContact O-N 2.87Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-R286 PolarHBondContact O-N 3.39Å; R286-L290 WeakPolarHBondContact O-CG 3.4Å; R286-Y300 HydrophobicContact CB-CE2 4.33Å
287	I	96.5	Very high	95.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-80	-33.8	-176.4	-67.5	167.2	0	0	0	112.3	L283 D289 L290 L297 Y300 L304 L336 V339 I340 I343	L283-I287 HydrophobicContact CB-CD1 4.32Å; L283-I287 WeakPolarHBondContact O-CB 3.4Å; L283-I287 WeakPolarHBondContact O-CD1 3.45Å; L283-I287 WeakPolarHBondContact O-CG1 3.34Å; L283-I287 PolarHBondContact O-N 3.42Å; I287-D289 PolarHBondContact O-N 3.31Å; I287-L290 WeakPolarHBondContact O-CB 3.49Å; I287-L290 PolarHBondContact O-N 3.19Å; I287-L297 HydrophobicContact CG2-CD1 4.21Å; I287-Y300 HydrophobicContact CD1-CG 4.48Å; I287-Y300 HydrophobicContact CG1-CD2 4.15Å; I287-Y300 HydrophobicContact CG1-CG 4.06Å; I287-L304 HydrophobicContact CD1-CD1 3.92Å; I287-L336 HydrophobicContact CD1-CD1 4.04Å; I287-V339 HydrophobicContact CG2-CG1 4.27Å; I287-I340 HydrophobicContact CG2-CG1 4.07Å; I287-I343 HydrophobicContact CG2-CD1 3.94Å
288	K	93.1	Very high	95.2	Very high	114 Å²	114	42 Å²	42	50%	0.496	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.9	-171	73.3	-171.6	-177.7	-176.7	0	115.3	L284 G285 V339	L284-K288 WeakPolarHBondContact O-CB 3.16Å; L284-K288 PolarHBondContact O-N 3.15Å; G285-K288 VanDerWaalsContact O-CE 3.3Å; G285-K288 WeakPolarHBondContact O-CE 3.16Å; G285-K288 WeakPolarHBondContact O-CG 3.13Å; K288-V339 HydrophobicContact CB-CG1 3.9Å
289	D	89.7	Confident	95.1	Very high	108 Å²	108	40.2 Å²	40.2	58%	0.578	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-4.3	-175.2	-63.5	-44.4	0	0	0	112.9	I287	I287-D289 PolarHBondContact O-N 3.31Å
290	L	93.9	Very high	95.1	Very high	17 Å²	17	40.9 Å²	40.9	9%	0.089	21%	0.212	C	C	.	.			trans	-74.9	160.7	-179.1	-59.3	177.5	0	0	0	112.6	R286 I287 L296 L297 Y300	R286-L290 WeakPolarHBondContact O-CG 3.4Å; I287-L290 WeakPolarHBondContact O-CB 3.49Å; I287-L290 PolarHBondContact O-N 3.19Å; L290-L296 HydrophobicContact CD2-CD2 4.24Å; L290-L297 HydrophobicContact CB-CB 4.42Å; L290-L297 HydrophobicContact CB-CD1 4.4Å; L290-L297 HydrophobicContact CD1-CB 4.09Å; L290-L297 HydrophobicContact CD1-CD1 4.14Å; L290-Y300 HydrophobicContact CD1-CD2 3.62Å; L290-Y300 HydrophobicContact CD1-CE2 3.91Å
291	E	93.2	Very high	95	Very high	66 Å²	66	40.9 Å²	40.9	31%	0.308	21%	0.212	S	C	.	.			trans	-118.1	156.4	177.8	-60	-176.7	163	0	0	111.6	C293 Q294	E291-C293 VanDerWaalsContact C-N 3.28Å; E291-C293 PolarHBondContact O-N 3.43Å; E291-Q294 HydrophobicContact CB-CG 4.11Å; E291-Q294 VanDerWaalsContact N-OE1 3.15Å; E291-Q294 WeakPolarHBondContact O-CB 3.41Å; E291-Q294 PolarHBondContact O-N 2.94Å
292	L	95.2	Very high	94.9	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-40.6	-174.8	178.2	66.6	0	0	0	114	Q294 Y298 I343 I377 F380 M381 F384	L292-Q294 VanDerWaalsContact C-N 3.34Å; L292-Y298 VanDerWaalsContact O-CE2 3.3Å; L292-Y298 WeakPolarHBondContact O-CE2 3.48Å; L292-Y298 PolarHBondContact O-OH 2.83Å; L292-I343 HydrophobicContact CB-CG2 4.09Å; L292-I377 HydrophobicContact CD2-CG2 4.16Å; L292-F380 HydrophobicContact CG-CB 4.13Å; L292-M381 HydrophobicContact CD2-CG 3.58Å; L292-F384 HydrophobicContact CD1-CB 3.74Å; L292-F384 HydrophobicContact CD1-CD1 3.93Å; L292-F384 HydrophobicContact CD1-CD2 4.29Å; L292-F384 HydrophobicContact CD1-CG 3.73Å
293	C	94.6	Very high	94.8	Very high	41 Å²	41	37.4 Å²	37.4	28%	0.277	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	5.5	-176	-61.1	0	0	0	0	114	E291 F380	E291-C293 VanDerWaalsContact C-N 3.28Å; E291-C293 PolarHBondContact O-N 3.43Å; C293-F380 HydrophobicContact CB-CD2 4.04Å; C293-F380 HydrophobicContact CB-CE2 4.06Å; C293-F380 HydrophobicContact CB-CG 4.37Å; C293-F380 HydrophobicContact CB-CZ 4.41Å
294	Q	93.9	Very high	94.8	Very high	72 Å²	72	37.4 Å²	37.4	34%	0.336	19%	0.193	S	C	.	.			trans	-85.5	125.7	178.9	-68.2	175.9	-6.6	0	0	111	E291 L292 L296 L297 Y298	E291-Q294 HydrophobicContact CB-CG 4.11Å; E291-Q294 VanDerWaalsContact N-OE1 3.15Å; E291-Q294 WeakPolarHBondContact O-CB 3.41Å; E291-Q294 PolarHBondContact O-N 2.94Å; L292-Q294 VanDerWaalsContact C-N 3.34Å; Q294-L296 PolarHBondContact O-N 3.2Å; Q294-L297 VanDerWaalsContact O-CB 3.31Å; Q294-L297 WeakPolarHBondContact O-CB 3.39Å; Q294-L297 PolarHBondContact O-N 2.88Å; Q294-L297 VanDerWaalsContact O-N 3.17Å; Q294-Y298 WeakPolarHBondContact O-CD2 3.33Å
295	I	91.8	Very high	94.8	Very high	118 Å²	118	36.6 Å²	36.6	61%	0.605	19%	0.189	S	C	*	.	H	α-helix	trans	-60.1	-35.4	-177.9	-60.7	170.3	0	0	0	111.8	L297 Y298	I295-L297 PolarHBondContact O-N 3.37Å; I295-Y298 PolarHBondContact O-N 2.91Å; I295-Y298 VanDerWaalsContact O-N 3.1Å
296	L	93.6	Very high	94.7	Very high	63 Å²	63	36.1 Å²	36.1	33%	0.33	18%	0.177	S	C	.	.	H	α-helix	trans	-58.6	-34.1	180	-178.1	61.3	0	0	0	112.7	L234 L290 Q294 Y298 A299 Y300	L234-L296 HydrophobicContact CD1-CD1 3.95Å; L234-L296 HydrophobicContact CD2-CD1 3.99Å; L290-L296 HydrophobicContact CD2-CD2 4.24Å; Q294-L296 PolarHBondContact O-N 3.2Å; L296-Y298 VanDerWaalsContact C-N 3.3Å; L296-Y298 PolarHBondContact O-N 3.42Å; L296-A299 PolarHBondContact O-N 2.88Å; L296-Y300 HydrophobicContact CD1-CD2 4.39Å; L296-Y300 HydrophobicContact CD1-CE2 3.8Å; L296-Y300 HydrophobicContact CD2-CE2 3.95Å; L296-Y300 HydrophobicContact CG-CD2 4.1Å; L296-Y300 HydrophobicContact CG-CE2 3.55Å; L296-Y300 VanDerWaalsContact O-CD2 3.3Å; L296-Y300 WeakPolarHBondContact O-CD2 3.44Å; L296-Y300 PolarHBondContact O-N 3.2Å
297	L	95.9	Very high	94.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-55.2	-46.9	175.1	173.8	61	0	0	0	111.3	I287 L290 Q294 I295 A299 Y300 L301 I343 F384	I287-L297 HydrophobicContact CG2-CD1 4.21Å; L290-L297 HydrophobicContact CB-CB 4.42Å; L290-L297 HydrophobicContact CB-CD1 4.4Å; L290-L297 HydrophobicContact CD1-CB 4.09Å; L290-L297 HydrophobicContact CD1-CD1 4.14Å; Q294-L297 VanDerWaalsContact O-CB 3.31Å; Q294-L297 WeakPolarHBondContact O-CB 3.39Å; Q294-L297 PolarHBondContact O-N 2.88Å; Q294-L297 VanDerWaalsContact O-N 3.17Å; I295-L297 PolarHBondContact O-N 3.37Å; L297-A299 VanDerWaalsContact C-N 3.28Å; L297-A299 PolarHBondContact O-N 2.92Å; L297-Y300 PolarHBondContact O-N 3.2Å; L297-Y300 VanDerWaalsContact O-N 3.15Å; L297-L301 HydrophobicContact CD1-CG 4.34Å; L297-L301 HydrophobicContact CG-CD1 4.21Å; L297-L301 HydrophobicContact CG-CG 4.45Å; L297-L301 WeakPolarHBondContact O-CG 3.15Å; L297-L301 PolarHBondContact O-N 3.33Å; L297-I343 HydrophobicContact CD1-CD1 3.55Å; L297-I343 HydrophobicContact CD2-CD1 4.09Å; L297-I343 HydrophobicContact CD2-CG2 3.93Å; L297-I343 HydrophobicContact CG-CD1 4.48Å; L297-F384 HydrophobicContact CD2-CD2 4.16Å; L297-F384 HydrophobicContact CD2-CE2 3.98Å
298	Y	95.3	Very high	94.7	Very high	12 Å²	12	33.8 Å²	33.8	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-30.4	-175.8	-62.2	-89.3	0	0	0	112.4	L292 Q294 I295 L296 L301 D302 F380 Q383 F384	L292-Y298 VanDerWaalsContact O-CE2 3.3Å; L292-Y298 WeakPolarHBondContact O-CE2 3.48Å; L292-Y298 PolarHBondContact O-OH 2.83Å; Q294-Y298 WeakPolarHBondContact O-CD2 3.33Å; I295-Y298 PolarHBondContact O-N 2.91Å; I295-Y298 VanDerWaalsContact O-N 3.1Å; L296-Y298 VanDerWaalsContact C-N 3.3Å; L296-Y298 PolarHBondContact O-N 3.42Å; Y298-L301 HydrophobicContact CD1-CD1 4.33Å; Y298-L301 PolarHBondContact O-N 2.87Å; Y298-D302 PolarHBondContact O-N 2.96Å; Y298-F380 AromaticContact CE2-CD1 3.69Å; Y298-F380 HydrophobicContact CE2-CD1 3.69Å; Y298-F380 HydrophobicContact CE2-CE1 4.07Å; Y298-F380 AromaticContact CZ-CD1 3.7Å; Y298-F380 WeakPolarHBondContact OH-CB 3.38Å; Y298-F380 WeakPolarHBondContact OH-CD1 3.43Å; Y298-F380 PolarHBondContact OH-O 3.43Å; Y298-Q383 HydrophobicContact CE1-CB 4Å; Y298-F384 HydrophobicContact CE1-CB 4.25Å
299	A	94.2	Very high	94.8	Very high	2 Å²	2	37.4 Å²	37.4	2%	0.017	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-41.7	173.2	0	0	0	0	0	111.4	L234 I237 L296 L297 L301 D302 I303	L234-A299 HydrophobicContact CD1-CB 3.54Å; I237-A299 HydrophobicContact CG2-CB 4.09Å; L296-A299 PolarHBondContact O-N 2.88Å; L297-A299 VanDerWaalsContact C-N 3.28Å; L297-A299 PolarHBondContact O-N 2.92Å; A299-L301 PolarHBondContact O-N 3.49Å; A299-D302 WeakPolarHBondContact O-CB 3.48Å; A299-D302 PolarHBondContact O-N 3.45Å; A299-I303 PolarHBondContact O-N 3.12Å; A299-I303 VanDerWaalsContact O-N 3.13Å
300	Y	96.6	Very high	95	Very high	13 Å²	13	33.7 Å²	33.7	5%	0.051	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-35.8	172.9	-68.5	-58.3	0	0	0	113	V230 L234 L283 R286 I287 L290 L296 L297 D302 I303 L304	V230-Y300 HydrophobicContact CG1-CE1 4.06Å; L234-Y300 HydrophobicContact CD1-CD1 4.48Å; L234-Y300 HydrophobicContact CD1-CE1 4.23Å; L234-Y300 HydrophobicContact CD2-CE1 4.19Å; L283-Y300 HydrophobicContact CD2-CD1 3.64Å; L283-Y300 HydrophobicContact CD2-CE1 4.17Å; R286-Y300 HydrophobicContact CB-CE2 4.33Å; I287-Y300 HydrophobicContact CD1-CG 4.48Å; I287-Y300 HydrophobicContact CG1-CD2 4.15Å; I287-Y300 HydrophobicContact CG1-CG 4.06Å; L290-Y300 HydrophobicContact CD1-CD2 3.62Å; L290-Y300 HydrophobicContact CD1-CE2 3.91Å; L296-Y300 HydrophobicContact CD1-CD2 4.39Å; L296-Y300 HydrophobicContact CD1-CE2 3.8Å; L296-Y300 HydrophobicContact CD2-CE2 3.95Å; L296-Y300 HydrophobicContact CG-CD2 4.1Å; L296-Y300 HydrophobicContact CG-CE2 3.55Å; L296-Y300 VanDerWaalsContact O-CD2 3.3Å; L296-Y300 WeakPolarHBondContact O-CD2 3.44Å; L296-Y300 PolarHBondContact O-N 3.2Å; L297-Y300 PolarHBondContact O-N 3.2Å; L297-Y300 VanDerWaalsContact O-N 3.15Å; Y300-D302 VanDerWaalsContact C-N 3.29Å; Y300-D302 PolarHBondContact O-N 2.99Å; Y300-I303 HydrophobicContact CD1-CD1 4.15Å; Y300-I303 WeakPolarHBondContact O-CB 3.28Å; Y300-I303 PolarHBondContact O-N 2.9Å; Y300-L304 WeakPolarHBondContact O-CG 3.25Å; Y300-L304 PolarHBondContact O-N 3.27Å
301	L	96.8	Very high	94.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-35.4	173.3	-63	177	0	0	0	111.8	L297 Y298 A299 L304 L305 I340 F384 K387	L297-L301 HydrophobicContact CD1-CG 4.34Å; L297-L301 HydrophobicContact CG-CD1 4.21Å; L297-L301 HydrophobicContact CG-CG 4.45Å; L297-L301 WeakPolarHBondContact O-CG 3.15Å; L297-L301 PolarHBondContact O-N 3.33Å; Y298-L301 HydrophobicContact CD1-CD1 4.33Å; Y298-L301 PolarHBondContact O-N 2.87Å; A299-L301 PolarHBondContact O-N 3.49Å; L301-L304 HydrophobicContact CD2-CD1 4.45Å; L301-L304 PolarHBondContact O-N 3.35Å; L301-L305 WeakPolarHBondContact O-CG 3.27Å; L301-L305 PolarHBondContact O-N 3Å; L301-I340 HydrophobicContact CD2-CD1 4.3Å; L301-I340 HydrophobicContact CD2-CG1 4.37Å; L301-I340 HydrophobicContact CD2-CG2 3.86Å; L301-F384 HydrophobicContact CD1-CD2 3.59Å; L301-F384 HydrophobicContact CD1-CE2 3.69Å; L301-F384 HydrophobicContact CD2-CE2 4.47Å; L301-K387 HydrophobicContact CB-CB 4.25Å; L301-K387 HydrophobicContact CB-CG 4.34Å; L301-K387 HydrophobicContact CD1-CB 3.98Å; L301-K387 HydrophobicContact CD1-CG 4.16Å
302	D	95.2	Very high	95	Very high	32 Å²	32	38.4 Å²	38.4	17%	0.171	18%	0.179	C	C	.	.	H	α-helix	trans	-64.7	-39.4	174.5	-70.9	-28.8	0	0	0	111.5	I237 R241 Y298 A299 Y300 L305 Y306 K387	I237-D302 HydrophobicContact CD1-CB 3.88Å; I237-D302 HydrophobicContact CG2-CB 4.1Å; R241-D302 IonicContact NH2-OD2 3.55Å; R241-D302 PolarHBondContact NH2-OD2 3.42Å; Y298-D302 PolarHBondContact O-N 2.96Å; A299-D302 WeakPolarHBondContact O-CB 3.48Å; A299-D302 PolarHBondContact O-N 3.45Å; Y300-D302 VanDerWaalsContact C-N 3.29Å; Y300-D302 PolarHBondContact O-N 2.99Å; D302-L305 WeakPolarHBondContact O-CB 3.27Å; D302-L305 PolarHBondContact O-N 3.24Å; D302-Y306 PolarHBondContact O-N 3.12Å; D302-K387 WeakPolarHBondContact OD1-CE 3.28Å; D302-K387 IonicContact OD1-NZ 3.91Å; D302-K387 PolarHBondContact OD1-NZ 3.1Å
303	I	95.5	Very high	95	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-48.1	171.1	-63.6	177.2	0	0	0	110.8	M233 L234 I237 L283 A299 Y300 L305 Y306 F307	M233-I303 HydrophobicContact CB-CD1 3.91Å; M233-I303 HydrophobicContact CB-CG1 4.14Å; M233-I303 HydrophobicContact CE-CG2 3.8Å; M233-I303 HydrophobicContact SD-CG2 4.04Å; L234-I303 HydrophobicContact CB-CD1 4.31Å; I237-I303 HydrophobicContact CD1-CB 4.3Å; I237-I303 HydrophobicContact CD1-CD1 4.28Å; I237-I303 HydrophobicContact CD1-CG1 3.28Å; L283-I303 HydrophobicContact CD1-CG2 4.29Å; A299-I303 PolarHBondContact O-N 3.12Å; A299-I303 VanDerWaalsContact O-N 3.13Å; Y300-I303 HydrophobicContact CD1-CD1 4.15Å; Y300-I303 WeakPolarHBondContact O-CB 3.28Å; Y300-I303 PolarHBondContact O-N 2.9Å; I303-L305 VanDerWaalsContact C-N 3.29Å; I303-L305 PolarHBondContact O-N 3.22Å; I303-Y306 WeakPolarHBondContact O-CB 3.44Å; I303-Y306 PolarHBondContact O-N 3.24Å; I303-Y306 VanDerWaalsContact O-N 3.15Å; I303-F307 HydrophobicContact CG2-CD2 4Å; I303-F307 HydrophobicContact CG2-CE2 3.51Å; I303-F307 HydrophobicContact CG2-CZ 3.81Å; I303-F307 PolarHBondContact O-N 3.22Å; I303-F307 VanDerWaalsContact O-N 3.08Å
304	L	97	Very high	95	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.5	-30.8	179.9	-68.6	172.4	0	0	0	112.8	L283 I287 Y300 L301 Y306 F307 T308 F317 L336 I340 M391	L283-L304 HydrophobicContact CD1-CD2 3.9Å; I287-L304 HydrophobicContact CD1-CD1 3.92Å; Y300-L304 WeakPolarHBondContact O-CG 3.25Å; Y300-L304 PolarHBondContact O-N 3.27Å; L301-L304 HydrophobicContact CD2-CD1 4.45Å; L301-L304 PolarHBondContact O-N 3.35Å; L304-Y306 VanDerWaalsContact C-N 3.32Å; L304-F307 HydrophobicContact CD2-CD2 4.27Å; L304-F307 PolarHBondContact O-N 3.02Å; L304-T308 VanDerWaalsContact O-CG2 3.32Å; L304-T308 WeakPolarHBondContact O-CG2 3.38Å; L304-T308 PolarHBondContact O-N 3Å; L304-T308 PolarHBondContact O-OG1 3.21Å; L304-F317 HydrophobicContact CD2-CE2 4.05Å; L304-L336 HydrophobicContact CD2-CD2 4.07Å; L304-I340 HydrophobicContact CD1-CD1 3.33Å; L304-I340 HydrophobicContact CD1-CG1 4.48Å; L304-M391 HydrophobicContact CB-CE 3.84Å; L304-M391 HydrophobicContact CB-SD 4.22Å; L304-M391 HydrophobicContact CD1-CE 4.22Å
305	L	96.6	Very high	95.1	Very high	22 Å²	22	38.8 Å²	38.8	12%	0.115	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-38.4	172.6	-79.6	175.9	0	0	0	112.2	L301 D302 I303 T308 R309 K387 Q390 M391	L301-L305 WeakPolarHBondContact O-CG 3.27Å; L301-L305 PolarHBondContact O-N 3Å; D302-L305 WeakPolarHBondContact O-CB 3.27Å; D302-L305 PolarHBondContact O-N 3.24Å; I303-L305 VanDerWaalsContact C-N 3.29Å; I303-L305 PolarHBondContact O-N 3.22Å; L305-T308 WeakPolarHBondContact CA-OG1 3.26Å; L305-T308 PolarHBondContact O-OG1 2.86Å; L305-T308 VanDerWaalsContact O-OG1 3.12Å; L305-R309 WeakPolarHBondContact O-CB 3.47Å; L305-R309 PolarHBondContact O-N 3.3Å; L305-K387 HydrophobicContact CD1-CD 3.41Å; L305-K387 VanDerWaalsContact CD1-CD 3.41Å; L305-Q390 HydrophobicContact CD2-CB 3.52Å; L305-M391 HydrophobicContact CD2-CB 4.37Å; L305-M391 HydrophobicContact CD2-CG 3.53Å; L305-M391 HydrophobicContact CG-CG 4.15Å
306	Y	94.9	Very high	95.3	Very high	23 Å²	23	33.3 Å²	33.3	9%	0.09	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-50.1	171.4	166.6	-101	0	0	0	111.1	M233 F249 T253 L256 D302 I303 L304 T308 R309 Q310	M233-Y306 HydrophobicContact CE-CD1 3.5Å; M233-Y306 VanDerWaalsContact CE-CD1 3.5Å; M233-Y306 HydrophobicContact CE-CE1 3.91Å; M233-Y306 HydrophobicContact CE-CG 4.33Å; F249-Y306 HydrophobicContact CZ-CG 4.29Å; T253-Y306 HydrophobicContact CG2-CD2 3.53Å; T253-Y306 HydrophobicContact CG2-CE1 4.47Å; T253-Y306 HydrophobicContact CG2-CE2 3.31Å; T253-Y306 HydrophobicContact CG2-CG 4.21Å; L256-Y306 HydrophobicContact CD1-CE1 4.38Å; D302-Y306 PolarHBondContact O-N 3.12Å; I303-Y306 WeakPolarHBondContact O-CB 3.44Å; I303-Y306 PolarHBondContact O-N 3.24Å; I303-Y306 VanDerWaalsContact O-N 3.15Å; L304-Y306 VanDerWaalsContact C-N 3.32Å; Y306-T308 VanDerWaalsContact C-N 3.32Å; Y306-T308 PolarHBondContact O-N 3.03Å; Y306-R309 WeakPolarHBondContact O-CB 3.41Å; Y306-R309 PolarHBondContact O-N 3.06Å; Y306-Q310 PolarHBondContact O-N 2.94Å
307	F	95.6	Very high	95.5	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-37.1	179.9	-66	-27.4	0	0	0	113.7	M233 V279 F280 L283 I303 L304 R309 M313 A314	M233-F307 HydrophobicContact CE-CE1 3.74Å; M233-F307 HydrophobicContact CE-CZ 3.95Å; M233-F307 HydrophobicContact SD-CE1 3.82Å; M233-F307 HydrophobicContact SD-CZ 3.58Å; M233-F307 VanDerWaalsContact SD-CZ 3.58Å; V279-F307 HydrophobicContact CG1-CE2 4.4Å; V279-F307 HydrophobicContact CG1-CZ 4.32Å; F280-F307 HydrophobicContact CD1-CD2 4.41Å; F280-F307 HydrophobicContact CE1-CB 4.43Å; F280-F307 AromaticContact CE1-CD2 3.6Å; F280-F307 HydrophobicContact CE1-CD2 3.6Å; F280-F307 HydrophobicContact CE1-CE2 4.07Å; F280-F307 HydrophobicContact CE1-CG 4.24Å; F280-F307 HydrophobicContact CZ-CD2 4.46Å; L283-F307 HydrophobicContact CD1-CD2 4.25Å; L283-F307 HydrophobicContact CD1-CE2 3.72Å; I303-F307 HydrophobicContact CG2-CD2 4Å; I303-F307 HydrophobicContact CG2-CE2 3.51Å; I303-F307 HydrophobicContact CG2-CZ 3.81Å; I303-F307 PolarHBondContact O-N 3.22Å; I303-F307 VanDerWaalsContact O-N 3.08Å; L304-F307 HydrophobicContact CD2-CD2 4.27Å; L304-F307 PolarHBondContact O-N 3.02Å; F307-R309 PolarHBondContact O-N 3.41Å; F307-M313 HydrophobicContact CB-CB 4.23Å; F307-M313 HydrophobicContact CD1-CB 4.45Å; F307-M313 HydrophobicContact CD1-CG 4.02Å; F307-M313 HydrophobicContact CD1-SD 4.09Å; F307-M313 HydrophobicContact CE1-SD 4.38Å; F307-M313 VanDerWaalsContact O-CB 3.3Å; F307-M313 WeakPolarHBondContact O-CB 3.48Å; F307-A314 PolarHBondContact O-N 3.25Å; F307-A314 VanDerWaalsContact O-N 3.16Å
308	T	96	Very high	95.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-73.7	-15.5	176.6	54.8	0	0	0	0	113.6	L304 L305 Y306 F317 M391 N394 L395	L304-T308 VanDerWaalsContact O-CG2 3.32Å; L304-T308 WeakPolarHBondContact O-CG2 3.38Å; L304-T308 PolarHBondContact O-N 3Å; L304-T308 PolarHBondContact O-OG1 3.21Å; L305-T308 WeakPolarHBondContact CA-OG1 3.26Å; L305-T308 PolarHBondContact O-OG1 2.86Å; L305-T308 VanDerWaalsContact O-OG1 3.12Å; Y306-T308 VanDerWaalsContact C-N 3.32Å; Y306-T308 PolarHBondContact O-N 3.03Å; T308-F317 HydrophobicContact CG2-CD1 4.15Å; T308-F317 HydrophobicContact CG2-CE1 4.15Å; T308-M391 HydrophobicContact CG2-CB 4.27Å; T308-M391 HydrophobicContact CG2-CE 4.16Å; T308-M391 HydrophobicContact CG2-CG 4.38Å; T308-N394 WeakPolarHBondContact O-CB 3.5Å; T308-N394 PolarHBondContact OG1-ND2 3.23Å; T308-L395 HydrophobicContact CG2-CD1 4.22Å; T308-L395 HydrophobicContact CG2-CD2 4.01Å; T308-L395 HydrophobicContact CG2-CG 4.07Å
309	R	94.8	Very high	95.5	Very high	191 Å²	191	34.6 Å²	34.6	72%	0.721	15%	0.152	S	C	*	.	H	α-helix	trans	-92.2	-30.9	177.3	-173.1	178	177.6	-175.5	-3.6	112.6	L305 Y306 F307 L398	L305-R309 WeakPolarHBondContact O-CB 3.47Å; L305-R309 PolarHBondContact O-N 3.3Å; Y306-R309 WeakPolarHBondContact O-CB 3.41Å; Y306-R309 PolarHBondContact O-N 3.06Å; F307-R309 PolarHBondContact O-N 3.41Å; R309-L398 WeakPolarHBondContact O-CD1 3.29Å
310	Q	94.2	Very high	95.6	Very high	29 Å²	29	36.4 Å²	36.4	14%	0.136	16%	0.159	C	C	.	.	S	Bend	trans	-78.3	131.1	175.8	-162.9	-70.7	-29.5	0	0	109.7	I260 Y306 D312 M313 A314	I260-Q310 HydrophobicContact CD1-CG 4.44Å; Y306-Q310 PolarHBondContact O-N 2.94Å; Q310-D312 PolarHBondContact NE2-OD2 3.49Å; Q310-D312 PolarHBondContact O-N 3.49Å; Q310-M313 HydrophobicContact CB-CB 4.18Å; Q310-M313 HydrophobicContact CB-CG 4.45Å; Q310-M313 VanDerWaalsContact OE1-CB 3.31Å; Q310-A314 WeakPolarHBondContact O-CB 3.47Å; Q310-A314 PolarHBondContact O-N 3.43Å
311	K	93.2	Very high	95.6	Very high	133 Å²	133	35.8 Å²	35.8	58%	0.578	16%	0.156	S	C	*	.	H	α-helix	trans	-59.3	-48.4	-167	-175.3	-176.1	170.3	-165.5	0	114.1	K315	K311-K315 PolarHBondContact O-N 3.31Å
312	D	94	Very high	95.6	Very high	49 Å²	49	39.4 Å²	39.4	26%	0.262	17%	0.173	S	C	.	.	H	α-helix	trans	-79.3	-39.6	-172.2	-50.9	-69.8	0	0	0	110.7	I260 I264 F272 Q310 K315 V316	I260-D312 HydrophobicContact CG2-CB 4.5Å; I264-D312 HydrophobicContact CD1-CB 3.73Å; I264-D312 VanDerWaalsContact CD1-CG 3.41Å; F272-D312 HydrophobicContact CD1-CB 4.26Å; F272-D312 HydrophobicContact CE1-CB 3.53Å; F272-D312 HydrophobicContact CZ-CB 4.13Å; Q310-D312 PolarHBondContact NE2-OD2 3.49Å; Q310-D312 PolarHBondContact O-N 3.49Å; D312-K315 WeakPolarHBondContact O-CB 3.49Å; D312-K315 PolarHBondContact O-N 3.5Å; D312-V316 WeakPolarHBondContact O-CG2 3.29Å; D312-V316 PolarHBondContact O-N 3.35Å; D312-V316 VanDerWaalsContact O-N 3.08Å
313	M	94.9	Very high	95.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-45.6	170	-79.2	-64.9	95.3	0	0	112.8	I260 F272 M276 F280 F307 Q310 K315 V316 F317	I260-M313 HydrophobicContact CD1-CG 4.15Å; F272-M313 HydrophobicContact CD1-CE 4.22Å; F272-M313 HydrophobicContact CE1-CE 3.18Å; F272-M313 HydrophobicContact CE2-CE 3.87Å; F272-M313 HydrophobicContact CZ-CE 2.98Å; M276-M313 HydrophobicContact CB-CE 3.69Å; M276-M313 HydrophobicContact CB-SD 4.5Å; M276-M313 HydrophobicContact CE-CE 3.65Å; M276-M313 HydrophobicContact CE-SD 3.45Å; M276-M313 WeakPolarHBondContact CE-SD 3.46Å; M276-M313 HydrophobicContact CG-CE 3.37Å; M276-M313 HydrophobicContact CG-SD 4.42Å; M276-M313 HydrophobicContact SD-CE 4.13Å; F280-M313 HydrophobicContact CZ-SD 4.24Å; F307-M313 HydrophobicContact CB-CB 4.23Å; F307-M313 HydrophobicContact CD1-CB 4.45Å; F307-M313 HydrophobicContact CD1-CG 4.02Å; F307-M313 HydrophobicContact CD1-SD 4.09Å; F307-M313 HydrophobicContact CE1-SD 4.38Å; F307-M313 VanDerWaalsContact O-CB 3.3Å; F307-M313 WeakPolarHBondContact O-CB 3.48Å; Q310-M313 HydrophobicContact CB-CB 4.18Å; Q310-M313 HydrophobicContact CB-CG 4.45Å; Q310-M313 VanDerWaalsContact OE1-CB 3.31Å; M313-K315 VanDerWaalsContact C-N 3.25Å; M313-K315 PolarHBondContact O-N 3.29Å; M313-V316 HydrophobicContact CE-CG2 4.44Å; M313-V316 PolarHBondContact O-N 3.46Å; M313-F317 VanDerWaalsContact O-CB 3.25Å; M313-F317 WeakPolarHBondContact O-CB 3.39Å; M313-F317 PolarHBondContact O-N 3.03Å
314	A	96.2	Very high	95.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-38.6	176.5	0	0	0	0	0	111.4	F307 Q310 F317 V318 L395 L398 T402	F307-A314 PolarHBondContact O-N 3.25Å; F307-A314 VanDerWaalsContact O-N 3.16Å; Q310-A314 WeakPolarHBondContact O-CB 3.47Å; Q310-A314 PolarHBondContact O-N 3.43Å; A314-F317 PolarHBondContact O-N 3.34Å; A314-V318 VanDerWaalsContact O-CG2 3.28Å; A314-V318 WeakPolarHBondContact O-CG2 3.31Å; A314-V318 PolarHBondContact O-N 3.09Å; A314-L395 HydrophobicContact CB-CD2 3.79Å; A314-L398 HydrophobicContact CB-CD2 3.2Å; A314-T402 HydrophobicContact CB-CG2 4.41Å
315	K	95.1	Very high	95.1	Very high	123 Å²	123	51.2 Å²	51.2	54%	0.535	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-51.2	175.8	-173.5	-173.4	172.4	-164.9	0	111.2	K311 D312 M313 F317 V318 E319	K311-K315 PolarHBondContact O-N 3.31Å; D312-K315 WeakPolarHBondContact O-CB 3.49Å; D312-K315 PolarHBondContact O-N 3.5Å; M313-K315 VanDerWaalsContact C-N 3.25Å; M313-K315 PolarHBondContact O-N 3.29Å; K315-F317 VanDerWaalsContact C-N 3.29Å; K315-F317 PolarHBondContact O-N 2.87Å; K315-V318 PolarHBondContact O-N 3.13Å; K315-E319 WeakPolarHBondContact CE-OE1 2.89Å; K315-E319 WeakPolarHBondContact O-CG 3.49Å; K315-E319 PolarHBondContact O-N 3.39Å; K315-E319 VanDerWaalsContact O-N 3.17Å
316	V	96.3	Very high	94.8	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-39.6	176.5	-174.1	0	0	0	0	111	F272 P273 M276 I277 F280 D312 M313 V318 E319 Y320	F272-V316 HydrophobicContact CD1-CG2 3.75Å; F272-V316 HydrophobicContact CE1-CG2 3.96Å; P273-V316 HydrophobicContact CB-CG1 4.15Å; P273-V316 HydrophobicContact CB-CG2 4.3Å; P273-V316 HydrophobicContact CG-CG2 4.13Å; M276-V316 HydrophobicContact CB-CG1 4.32Å; I277-V316 HydrophobicContact CG1-CG1 4.28Å; F280-V316 HydrophobicContact CD2-CG1 4.4Å; F280-V316 HydrophobicContact CE2-CB 4.17Å; F280-V316 HydrophobicContact CE2-CG1 3.8Å; D312-V316 WeakPolarHBondContact O-CG2 3.29Å; D312-V316 PolarHBondContact O-N 3.35Å; D312-V316 VanDerWaalsContact O-N 3.08Å; M313-V316 HydrophobicContact CE-CG2 4.44Å; M313-V316 PolarHBondContact O-N 3.46Å; V316-V318 PolarHBondContact O-N 2.9Å; V316-E319 PolarHBondContact O-N 2.92Å; V316-Y320 VanDerWaalsContact O-CB 3.29Å; V316-Y320 WeakPolarHBondContact O-CB 3.44Å; V316-Y320 PolarHBondContact O-N 3.32Å
317	F	97.6	Very high	94.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-46.5	178	-179.8	-95.2	0	0	0	111.8	F280 L304 T308 M313 A314 K315 E319 Y320 I321 L336 L337 M391 L395	F280-F317 HydrophobicContact CD1-CD2 4.29Å; F280-F317 AromaticContact CE1-CD2 3.91Å; F280-F317 HydrophobicContact CE1-CD2 3.91Å; F280-F317 HydrophobicContact CE2-CB 4.37Å; F280-F317 HydrophobicContact CZ-CB 3.97Å; F280-F317 HydrophobicContact CZ-CD2 4.18Å; L304-F317 HydrophobicContact CD2-CE2 4.05Å; T308-F317 HydrophobicContact CG2-CD1 4.15Å; T308-F317 HydrophobicContact CG2-CE1 4.15Å; M313-F317 VanDerWaalsContact O-CB 3.25Å; M313-F317 WeakPolarHBondContact O-CB 3.39Å; M313-F317 PolarHBondContact O-N 3.03Å; A314-F317 PolarHBondContact O-N 3.34Å; K315-F317 VanDerWaalsContact C-N 3.29Å; K315-F317 PolarHBondContact O-N 2.87Å; F317-E319 VanDerWaalsContact C-N 3.3Å; F317-E319 PolarHBondContact O-N 3.08Å; F317-Y320 PolarHBondContact O-N 3.31Å; F317-I321 HydrophobicContact CD1-CG2 4.36Å; F317-I321 HydrophobicContact CD2-CG2 4.46Å; F317-I321 HydrophobicContact CE1-CD1 4.13Å; F317-I321 HydrophobicContact CE1-CG2 3.96Å; F317-I321 HydrophobicContact CE2-CG2 4.07Å; F317-I321 HydrophobicContact CZ-CG2 3.81Å; F317-I321 WeakPolarHBondContact O-CG1 3.24Å; F317-I321 WeakPolarHBondContact O-CG2 3.23Å; F317-I321 PolarHBondContact O-N 2.68Å; F317-L336 HydrophobicContact CD2-CD2 4.38Å; F317-L336 HydrophobicContact CE2-CD2 3.79Å; F317-L336 HydrophobicContact CE2-CG 4.24Å; F317-L337 HydrophobicContact CZ-CB 4.47Å; F317-M391 HydrophobicContact CZ-CE 3.92Å; F317-L395 HydrophobicContact CD1-CD1 4.06Å; F317-L395 HydrophobicContact CD1-CD2 4.4Å; F317-L395 HydrophobicContact CE1-CD1 3.96Å
318	V	96.4	Very high	94.4	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.018	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-32.1	179.6	-171.5	0	0	0	0	111.9	A314 K315 V316 I321 Q322 L395 C405	A314-V318 VanDerWaalsContact O-CG2 3.28Å; A314-V318 WeakPolarHBondContact O-CG2 3.31Å; A314-V318 PolarHBondContact O-N 3.09Å; K315-V318 PolarHBondContact O-N 3.13Å; V316-V318 PolarHBondContact O-N 2.9Å; V318-I321 WeakPolarHBondContact O-CG1 3.44Å; V318-Q322 PolarHBondContact O-NE2 3.31Å; V318-L395 HydrophobicContact CG2-CD1 4.19Å; V318-L395 HydrophobicContact CG2-CD2 3.79Å; V318-L395 HydrophobicContact CG2-CG 4.48Å; V318-C405 HydrophobicContact CB-CB 4.29Å; V318-C405 HydrophobicContact CG1-CB 3.31Å
319	E	94.8	Very high	94.2	Very high	98 Å²	98	58.8 Å²	58.8	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-69	-41.5	172.3	-69.9	172.9	-166.8	0	0	111.6	K315 V316 F317 I321 Q322	K315-E319 WeakPolarHBondContact CE-OE1 2.89Å; K315-E319 WeakPolarHBondContact O-CG 3.49Å; K315-E319 PolarHBondContact O-N 3.39Å; K315-E319 VanDerWaalsContact O-N 3.17Å; V316-E319 PolarHBondContact O-N 2.92Å; F317-E319 VanDerWaalsContact C-N 3.3Å; F317-E319 PolarHBondContact O-N 3.08Å; E319-I321 PolarHBondContact O-N 3.22Å; E319-Q322 WeakPolarHBondContact O-CB 3.37Å; E319-Q322 VanDerWaalsContact O-CG 3.31Å; E319-Q322 WeakPolarHBondContact O-CG 3.32Å; E319-Q322 PolarHBondContact O-N 3.47Å
320	Y	96.9	Very high	94.1	Very high	40 Å²	40	51.9 Å²	51.9	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-37.1	-179.6	178.3	-99	0	0	0	113.3	I277 F280 D281 L284 V316 F317 Q322 L336	I277-Y320 HydrophobicContact CB-CD2 4.42Å; I277-Y320 HydrophobicContact CG1-CD2 4.14Å; I277-Y320 HydrophobicContact CG2-CD2 3.97Å; I277-Y320 HydrophobicContact CG2-CE2 3.95Å; F280-Y320 HydrophobicContact CB-CD1 3.66Å; F280-Y320 HydrophobicContact CB-CD2 4.14Å; F280-Y320 HydrophobicContact CB-CE1 3.47Å; F280-Y320 VanDerWaalsContact CB-CE1 3.47Å; F280-Y320 HydrophobicContact CB-CE2 3.97Å; F280-Y320 HydrophobicContact CB-CG 3.99Å; F280-Y320 HydrophobicContact CD2-CD1 4.24Å; F280-Y320 HydrophobicContact CD2-CD2 4.42Å; F280-Y320 AromaticContact CD2-CG 4Å; F280-Y320 HydrophobicContact CD2-CG 4Å; F280-Y320 HydrophobicContact CG-CD1 4.12Å; F280-Y320 HydrophobicContact CG-CE1 4.4Å; F280-Y320 HydrophobicContact CG-CG 4.3Å; D281-Y320 WeakPolarHBondContact CA-OH 3.16Å; D281-Y320 PolarHBondContact N-OH 2.88Å; D281-Y320 WeakPolarHBondContact OD1-CE2 3.24Å; D281-Y320 PolarHBondContact OD1-OH 2.85Å; L284-Y320 WeakPolarHBondContact CD2-OH 3.37Å; V316-Y320 VanDerWaalsContact O-CB 3.29Å; V316-Y320 WeakPolarHBondContact O-CB 3.44Å; V316-Y320 PolarHBondContact O-N 3.32Å; F317-Y320 PolarHBondContact O-N 3.31Å; Y320-Q322 PolarHBondContact O-N 2.83Å; Y320-L336 HydrophobicContact CD1-CB 4.23Å; Y320-L336 HydrophobicContact CD1-CD2 4.33Å; Y320-L336 HydrophobicContact CE1-CB 3.73Å; Y320-L336 HydrophobicContact CE1-CD2 4.03Å
321	I	96.8	Very high	94.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	3.9	179.5	67	171.9	0	0	0	113.7	F317 V318 E319 T335 L336 L337 I406 W409	F317-I321 HydrophobicContact CD1-CG2 4.36Å; F317-I321 HydrophobicContact CD2-CG2 4.46Å; F317-I321 HydrophobicContact CE1-CD1 4.13Å; F317-I321 HydrophobicContact CE1-CG2 3.96Å; F317-I321 HydrophobicContact CE2-CG2 4.07Å; F317-I321 HydrophobicContact CZ-CG2 3.81Å; F317-I321 WeakPolarHBondContact O-CG1 3.24Å; F317-I321 WeakPolarHBondContact O-CG2 3.23Å; F317-I321 PolarHBondContact O-N 2.68Å; V318-I321 WeakPolarHBondContact O-CG1 3.44Å; E319-I321 PolarHBondContact O-N 3.22Å; I321-T335 WeakPolarHBondContact O-CG2 3.27Å; I321-L336 HydrophobicContact CG2-CB 4.38Å; I321-L337 HydrophobicContact CB-CB 4.39Å; I321-L337 HydrophobicContact CD1-CB 4.24Å; I321-L337 HydrophobicContact CD1-CD2 3.85Å; I321-L337 HydrophobicContact CG2-CB 4Å; I321-I406 HydrophobicContact CD1-CD1 4.02Å; I321-W409 HydrophobicContact CD1-CG 4.43Å; I321-W409 PolarHBondContact O-NE1 3.45Å
322	Q	95.5	Very high	94.3	Very high	77 Å²	77	46.4 Å²	46.4	36%	0.36	23%	0.231	S	C	.	.			trans	-67.2	130.1	175	-62.4	-54.6	-45.1	0	0	110	V318 E319 Y320	V318-Q322 PolarHBondContact O-NE2 3.31Å; E319-Q322 WeakPolarHBondContact O-CB 3.37Å; E319-Q322 VanDerWaalsContact O-CG 3.31Å; E319-Q322 WeakPolarHBondContact O-CG 3.32Å; E319-Q322 PolarHBondContact O-N 3.47Å; Y320-Q322 PolarHBondContact O-N 2.83Å
323	P	95.1	Very high	94.3	Very high	11 Å²	11	45.9 Å²	45.9	7%	0.071	23%	0.227	C	C	.	.			trans	-69.1	146.3	179.8	31.8	-38.2	0	0	0	110.8	D325 P326 M331 Y332 T335	P323-D325 PolarHBondContact O-N 3.5Å; P323-P326 HydrophobicContact CG-CB 4.26Å; P323-P326 HydrophobicContact CG-CG 4.31Å; P323-M331 HydrophobicContact CB-CB 3.99Å; P323-Y332 HydrophobicContact CB-CD1 4.46Å; P323-Y332 HydrophobicContact CB-CD2 4.3Å; P323-Y332 HydrophobicContact CB-CE2 4.37Å; P323-Y332 HydrophobicContact CB-CG 4.35Å; P323-Y332 HydrophobicContact CG-CD1 4.02Å; P323-Y332 HydrophobicContact CG-CD2 4.21Å; P323-Y332 HydrophobicContact CG-CE1 3.65Å; P323-Y332 HydrophobicContact CG-CE2 3.86Å; P323-Y332 HydrophobicContact CG-CG 4.28Å; P323-T335 HydrophobicContact CB-CG2 4.27Å
324	K	90.8	Very high	94.3	Very high	208 Å²	208	51.4 Å²	51.4	90%	0.904	25%	0.251	S	S	*	.	S	Bend	trans	-59.7	-35.6	175.4	-65.6	-176	178	-177.3	0	112.9
325	D	92.2	Very high	94.3	Very high	60 Å²	60	51.9 Å²	51.9	32%	0.321	25%	0.254	S	S	.	.	S	Bend	trans	-126.9	103	172.1	174.1	6.2	0	0	0	109.2	P323 T327 N328 M331	P323-D325 PolarHBondContact O-N 3.5Å; D325-T327 PolarHBondContact O-N 3.29Å; D325-T327 WeakPolarHBondContact OD1-CB 3.29Å; D325-T327 PolarHBondContact OD1-N 3.29Å; D325-T327 PolarHBondContact OD1-OG1 3.22Å; D325-T327 PolarHBondContact OD2-OG1 3.16Å; D325-N328 HydrophobicContact CB-CB 4.3Å; D325-N328 PolarHBondContact O-N 3.46Å; D325-N328 WeakPolarHBondContact OD2-CB 3.43Å; D325-M331 HydrophobicContact CB-CG 4.14Å
326	P	90.7	Very high	94.4	Very high	70 Å²	70	46 Å²	46	46%	0.455	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.3	-179.2	-22.8	33.6	0	0	0	115.3	P323 Y332	P323-P326 HydrophobicContact CG-CB 4.26Å; P323-P326 HydrophobicContact CG-CG 4.31Å; P326-Y332 VanDerWaalsContact O-CE2 3.31Å; P326-Y332 WeakPolarHBondContact O-CE2 3.24Å; P326-Y332 PolarHBondContact O-OH 3.22Å
327	T	90.3	Very high	94.5	Very high	111 Å²	111	46 Å²	46	68%	0.681	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-16.7	179.8	69.4	0	0	0	0	112.9	D325	D325-T327 PolarHBondContact O-N 3.29Å; D325-T327 WeakPolarHBondContact OD1-CB 3.29Å; D325-T327 PolarHBondContact OD1-N 3.29Å; D325-T327 PolarHBondContact OD1-OG1 3.22Å; D325-T327 PolarHBondContact OD2-OG1 3.16Å
328	N	91.4	Very high	94.4	Very high	27 Å²	27	46 Å²	46	14%	0.144	23%	0.228	C	C	.	.			trans	-100.9	113.4	-177.6	-175.8	-24.5	0	0	0	110.8	D325 Q330 M331 Y332 M435	D325-N328 HydrophobicContact CB-CB 4.3Å; D325-N328 PolarHBondContact O-N 3.46Å; D325-N328 WeakPolarHBondContact OD2-CB 3.43Å; N328-Q330 PolarHBondContact O-N 3.34Å; N328-Q330 WeakPolarHBondContact OD1-CB 3.31Å; N328-Q330 PolarHBondContact OD1-N 3.24Å; N328-M331 HydrophobicContact CB-CB 4.45Å; N328-M331 HydrophobicContact CB-CG 3.92Å; N328-M331 WeakPolarHBondContact O-CB 3.48Å; N328-M331 PolarHBondContact O-N 2.84Å; N328-Y332 WeakPolarHBondContact O-CD2 3.43Å; N328-M435 PolarHBondContact OD1-O 3.34Å; N328-M435 VanDerWaalsContact OD1-O 3.05Å
329	G	92	Very high	94.4	Very high	1 Å²	1	47 Å²	47	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-57.2	-34.6	-179	0	0	0	0	0	113.7	M331 Y332 N417 M435	G329-M331 VanDerWaalsContact C-N 3.27Å; G329-M331 PolarHBondContact O-N 2.94Å; G329-Y332 PolarHBondContact O-N 3.07Å; G329-N417 VanDerWaalsContact CA-ND2 3.34Å; G329-N417 WeakPolarHBondContact CA-ND2 3.35Å; G329-M435 WeakPolarHBondContact CA-O 3.44Å; G329-M435 PolarHBondContact N-O 3.45Å; G329-M435 VanDerWaalsContact N-O 3.13Å
330	Q	91.7	Very high	94.6	Very high	45 Å²	45	42.3 Å²	42.3	21%	0.21	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-28.5	177.9	-163.4	-165.9	50.9	0	0	112.6	N328 Y332 Q333 K334 Q434 M435	N328-Q330 PolarHBondContact O-N 3.34Å; N328-Q330 WeakPolarHBondContact OD1-CB 3.31Å; N328-Q330 PolarHBondContact OD1-N 3.24Å; Q330-Y332 VanDerWaalsContact C-N 3.3Å; Q330-Y332 PolarHBondContact O-N 3.47Å; Q330-Q333 WeakPolarHBondContact O-CB 3.33Å; Q330-Q333 PolarHBondContact O-N 3.26Å; Q330-K334 PolarHBondContact O-N 2.99Å; Q330-Q434 WeakPolarHBondContact CB-O 3.46Å; Q330-Q434 WeakPolarHBondContact CG-O 3.42Å; Q330-Q434 PolarHBondContact NE2-O 3.43Å; Q330-Q434 PolarHBondContact OE1-O 3.15Å; Q330-Q434 VanDerWaalsContact OE1-O 3.07Å; Q330-M435 PolarHBondContact N-O 3.15Å; Q330-M435 VanDerWaalsContact N-O 3.16Å
331	M	94.8	Very high	94.6	Very high	47 Å²	47	40.4 Å²	40.4	23%	0.232	21%	0.205	C	C	.	.	H	α-helix	trans	-70.3	-29	-180	-65.6	-60	166.2	0	0	112.1	P323 D325 N328 G329 Q333 K334	P323-M331 HydrophobicContact CB-CB 3.99Å; D325-M331 HydrophobicContact CB-CG 4.14Å; N328-M331 HydrophobicContact CB-CB 4.45Å; N328-M331 HydrophobicContact CB-CG 3.92Å; N328-M331 WeakPolarHBondContact O-CB 3.48Å; N328-M331 PolarHBondContact O-N 2.84Å; G329-M331 VanDerWaalsContact C-N 3.27Å; G329-M331 PolarHBondContact O-N 2.94Å; M331-Q333 VanDerWaalsContact C-N 3.31Å; M331-Q333 PolarHBondContact O-N 3.18Å; M331-K334 PolarHBondContact O-N 3.29Å; M331-K334 HydrophobicContact SD-CD 3.97Å
332	Y	96.5	Very high	94.6	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-40.5	170.4	-70.2	-96.8	0	0	0	111.3	P323 P326 N328 G329 Q330 K334 T335 G338 W409 N412 C413 A416	P323-Y332 HydrophobicContact CB-CD1 4.46Å; P323-Y332 HydrophobicContact CB-CD2 4.3Å; P323-Y332 HydrophobicContact CB-CE2 4.37Å; P323-Y332 HydrophobicContact CB-CG 4.35Å; P323-Y332 HydrophobicContact CG-CD1 4.02Å; P323-Y332 HydrophobicContact CG-CD2 4.21Å; P323-Y332 HydrophobicContact CG-CE1 3.65Å; P323-Y332 HydrophobicContact CG-CE2 3.86Å; P323-Y332 HydrophobicContact CG-CG 4.28Å; P326-Y332 VanDerWaalsContact O-CE2 3.31Å; P326-Y332 WeakPolarHBondContact O-CE2 3.24Å; P326-Y332 PolarHBondContact O-OH 3.22Å; N328-Y332 WeakPolarHBondContact O-CD2 3.43Å; G329-Y332 PolarHBondContact O-N 3.07Å; Q330-Y332 VanDerWaalsContact C-N 3.3Å; Q330-Y332 PolarHBondContact O-N 3.47Å; Y332-K334 PolarHBondContact O-N 3.02Å; Y332-T335 WeakPolarHBondContact O-CB 3.32Å; Y332-T335 WeakPolarHBondContact O-CG2 3.42Å; Y332-T335 PolarHBondContact O-N 3.38Å; Y332-T335 PolarHBondContact O-OG1 3.13Å; Y332-G338 WeakPolarHBondContact O-CA 3.29Å; Y332-W409 HydrophobicContact CD1-CD2 4.26Å; Y332-W409 AromaticContact CD1-CE2 3.68Å; Y332-W409 AromaticContact CD1-CZ2 3.87Å; Y332-W409 HydrophobicContact CD1-CZ2 3.87Å; Y332-W409 AromaticContact CD1-NE1 3.76Å; Y332-W409 HydrophobicContact CE1-CD2 4.49Å; Y332-W409 HydrophobicContact CE1-CG 4.48Å; Y332-N412 WeakPolarHBondContact OH-CB 3.12Å; Y332-C413 HydrophobicContact CD1-CB 3.46Å; Y332-C413 VanDerWaalsContact CD1-CB 3.46Å; Y332-C413 HydrophobicContact CE1-CB 3.55Å; Y332-C413 HydrophobicContact CG-CB 3.99Å; Y332-A416 HydrophobicContact CD2-CB 4.4Å; Y332-A416 HydrophobicContact CE2-CB 3.83Å
333	Q	94.4	Very high	94.6	Very high	38 Å²	38	39 Å²	39	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-25.3	177.9	-171.5	-179	-44.2	0	0	112.9	Q330 M331 G338 V339 N342 A437 F441	Q330-Q333 WeakPolarHBondContact O-CB 3.33Å; Q330-Q333 PolarHBondContact O-N 3.26Å; M331-Q333 VanDerWaalsContact C-N 3.31Å; M331-Q333 PolarHBondContact O-N 3.18Å; Q333-G338 CarbonylContact O-C 3.53Å; Q333-V339 WeakPolarHBondContact O-CG2 3.31Å; Q333-V339 PolarHBondContact O-N 2.91Å; Q333-V339 VanDerWaalsContact O-N 3.13Å; Q333-N342 HydrophobicContact CG-CB 4Å; Q333-N342 PolarHBondContact NE2-ND2 3.31Å; Q333-N342 PolarHBondContact NE2-OD1 3.09Å; Q333-A437 HydrophobicContact CB-CB 4.2Å; Q333-F441 HydrophobicContact CB-CD2 4.46Å; Q333-F441 HydrophobicContact CG-CD2 4.49Å
334	K	94.1	Very high	94.6	Very high	115 Å²	115	39.1 Å²	39.1	50%	0.5	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.3	179.3	-65.6	-178.5	-174.4	169.5	0	114	Q330 M331 Y332	Q330-K334 PolarHBondContact O-N 2.99Å; M331-K334 PolarHBondContact O-N 3.29Å; M331-K334 HydrophobicContact SD-CD 3.97Å; Y332-K334 PolarHBondContact O-N 3.02Å
335	T	96.7	Very high	94.8	Very high	11 Å²	11	29.2 Å²	29.2	7%	0.067	16%	0.158	C	C	.	.	S	Bend	trans	-71.3	161.7	173.9	69.3	0	0	0	0	110.1	I321 P323 Y332 L337 G338 V339	I321-T335 WeakPolarHBondContact O-CG2 3.27Å; P323-T335 HydrophobicContact CB-CG2 4.27Å; Y332-T335 WeakPolarHBondContact O-CB 3.32Å; Y332-T335 WeakPolarHBondContact O-CG2 3.42Å; Y332-T335 PolarHBondContact O-N 3.38Å; Y332-T335 PolarHBondContact O-OG1 3.13Å; T335-L337 PolarHBondContact O-N 2.86Å; T335-G338 CarbonylContact O-C 3.58Å; T335-G338 WeakPolarHBondContact O-CA 3.4Å; T335-G338 PolarHBondContact O-N 3.03Å; T335-G338 PolarHBondContact OG1-N 3.26Å; T335-V339 WeakPolarHBondContact O-CG2 3.36Å; T335-V339 PolarHBondContact O-N 3.31Å
336	L	97.5	Very high	94.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-46.6	178.3	172.9	60	0	0	0	113.2	F280 L284 I287 L304 F317 Y320 I321 G338 V339 I340	F280-L336 HydrophobicContact CB-CD2 4.11Å; F280-L336 HydrophobicContact CD1-CD2 4.07Å; F280-L336 HydrophobicContact CG-CD2 4.4Å; L284-L336 HydrophobicContact CB-CD1 4.23Å; L284-L336 HydrophobicContact CD1-CB 4.25Å; L284-L336 HydrophobicContact CD1-CD1 4.39Å; I287-L336 HydrophobicContact CD1-CD1 4.04Å; L304-L336 HydrophobicContact CD2-CD2 4.07Å; F317-L336 HydrophobicContact CD2-CD2 4.38Å; F317-L336 HydrophobicContact CE2-CD2 3.79Å; F317-L336 HydrophobicContact CE2-CG 4.24Å; Y320-L336 HydrophobicContact CD1-CB 4.23Å; Y320-L336 HydrophobicContact CD1-CD2 4.33Å; Y320-L336 HydrophobicContact CE1-CB 3.73Å; Y320-L336 HydrophobicContact CE1-CD2 4.03Å; I321-L336 HydrophobicContact CG2-CB 4.38Å; L336-G338 VanDerWaalsContact C-N 3.28Å; L336-G338 PolarHBondContact O-N 2.69Å; L336-V339 PolarHBondContact O-N 3.22Å; L336-I340 HydrophobicContact CD1-CD1 4.25Å; L336-I340 HydrophobicContact CG-CD1 4.44Å; L336-I340 WeakPolarHBondContact O-CD1 3.41Å; L336-I340 WeakPolarHBondContact O-CG1 3.45Å; L336-I340 PolarHBondContact O-N 3.46Å
337	L	97.8	Very high	94.6	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.016	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-38.6	173.4	-178.6	60	0	0	0	111.5	F317 I321 T335 I340 L341 L392 I406 W409	F317-L337 HydrophobicContact CZ-CB 4.47Å; I321-L337 HydrophobicContact CB-CB 4.39Å; I321-L337 HydrophobicContact CD1-CB 4.24Å; I321-L337 HydrophobicContact CD1-CD2 3.85Å; I321-L337 HydrophobicContact CG2-CB 4Å; T335-L337 PolarHBondContact O-N 2.86Å; L337-I340 PolarHBondContact O-N 3.4Å; L337-L341 HydrophobicContact CD1-CD1 4.47Å; L337-L341 HydrophobicContact CD1-CG 4.48Å; L337-L341 HydrophobicContact CG-CD1 4.06Å; L337-L341 VanDerWaalsContact O-CG 3.28Å; L337-L341 WeakPolarHBondContact O-CG 3.29Å; L337-L341 PolarHBondContact O-N 3.08Å; L337-L392 HydrophobicContact CD2-CD2 4.31Å; L337-I406 HydrophobicContact CD2-CD1 4.18Å; L337-W409 HydrophobicContact CD2-CE3 4.3Å; L337-W409 HydrophobicContact CD2-CH2 3.88Å; L337-W409 HydrophobicContact CD2-CZ2 4.2Å; L337-W409 HydrophobicContact CD2-CZ3 3.93Å; L337-W409 HydrophobicContact CG-CH2 4.21Å
338	G	96.9	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-70.2	-35	179.2	0	0	0	0	0	114.9	Y332 Q333 T335 L336 I340 L341 N342	Y332-G338 WeakPolarHBondContact O-CA 3.29Å; Q333-G338 CarbonylContact O-C 3.53Å; T335-G338 CarbonylContact O-C 3.58Å; T335-G338 WeakPolarHBondContact O-CA 3.4Å; T335-G338 PolarHBondContact O-N 3.03Å; T335-G338 PolarHBondContact OG1-N 3.26Å; L336-G338 VanDerWaalsContact C-N 3.28Å; L336-G338 PolarHBondContact O-N 2.69Å; G338-I340 VanDerWaalsContact C-N 3.34Å; G338-L341 PolarHBondContact O-N 3.34Å; G338-N342 WeakPolarHBondContact O-CB 3.31Å; G338-N342 PolarHBondContact O-N 2.81Å
339	V	96.7	Very high	93.1	Very high	23 Å²	23	28.4 Å²	28.4	14%	0.139	14%	0.142	C	C	.	.	H	α-helix	trans	-63.9	-43.8	173.9	164.5	0	0	0	0	109.8	L284 I287 K288 Q333 T335 L336 N342	L284-V339 HydrophobicContact CD1-CB 4.09Å; L284-V339 HydrophobicContact CD1-CG1 4.5Å; L284-V339 HydrophobicContact CD1-CG2 3.67Å; I287-V339 HydrophobicContact CG2-CG1 4.27Å; K288-V339 HydrophobicContact CB-CG1 3.9Å; Q333-V339 WeakPolarHBondContact O-CG2 3.31Å; Q333-V339 PolarHBondContact O-N 2.91Å; Q333-V339 VanDerWaalsContact O-N 3.13Å; T335-V339 WeakPolarHBondContact O-CG2 3.36Å; T335-V339 PolarHBondContact O-N 3.31Å; L336-V339 PolarHBondContact O-N 3.22Å; V339-N342 WeakPolarHBondContact O-CB 3.48Å; V339-N342 PolarHBondContact O-N 3.46Å
340	I	97.8	Very high	92.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-53	173.5	-65.1	161.5	0	0	0	109.6	I287 L301 L304 L336 L337 G338 N342 I343 F384 I388 M391	I287-I340 HydrophobicContact CG2-CG1 4.07Å; L301-I340 HydrophobicContact CD2-CD1 4.3Å; L301-I340 HydrophobicContact CD2-CG1 4.37Å; L301-I340 HydrophobicContact CD2-CG2 3.86Å; L304-I340 HydrophobicContact CD1-CD1 3.33Å; L304-I340 HydrophobicContact CD1-CG1 4.48Å; L336-I340 HydrophobicContact CD1-CD1 4.25Å; L336-I340 HydrophobicContact CG-CD1 4.44Å; L336-I340 WeakPolarHBondContact O-CD1 3.41Å; L336-I340 WeakPolarHBondContact O-CG1 3.45Å; L336-I340 PolarHBondContact O-N 3.46Å; L337-I340 PolarHBondContact O-N 3.4Å; G338-I340 VanDerWaalsContact C-N 3.34Å; I340-N342 PolarHBondContact O-N 3.31Å; I340-I343 WeakPolarHBondContact O-CB 3.23Å; I340-I343 PolarHBondContact O-N 3.28Å; I340-F384 HydrophobicContact CG2-CE2 4.09Å; I340-F384 HydrophobicContact CG2-CZ 3.82Å; I340-F384 VanDerWaalsContact O-CZ 3.28Å; I340-F384 WeakPolarHBondContact O-CZ 3.49Å; I340-I388 HydrophobicContact CG2-CD1 4.33Å; I340-I388 HydrophobicContact CG2-CG1 4.13Å; I340-M391 HydrophobicContact CD1-CE 4.36Å
341	L	97.6	Very high	90.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-26.2	178.7	-71.9	169.2	0	0	0	112.8	L337 G338 I388 W409 A440 F441 N444 L445	L337-L341 HydrophobicContact CD1-CD1 4.47Å; L337-L341 HydrophobicContact CD1-CG 4.48Å; L337-L341 HydrophobicContact CG-CD1 4.06Å; L337-L341 VanDerWaalsContact O-CG 3.28Å; L337-L341 WeakPolarHBondContact O-CG 3.29Å; L337-L341 PolarHBondContact O-N 3.08Å; G338-L341 PolarHBondContact O-N 3.34Å; L341-I388 HydrophobicContact CD2-CD1 4.17Å; L341-I388 HydrophobicContact CD2-CG2 3.93Å; L341-W409 HydrophobicContact CD1-CH2 4.02Å; L341-A440 CarbonylContact O-C 3.49Å; L341-F441 HydrophobicContact CB-CD2 3.53Å; L341-F441 HydrophobicContact CB-CE2 3.88Å; L341-F441 HydrophobicContact CB-CG 4.06Å; L341-F441 HydrophobicContact CD1-CD2 4.09Å; L341-F441 HydrophobicContact CD1-CE1 4.34Å; L341-F441 HydrophobicContact CD1-CE2 3.58Å; L341-F441 HydrophobicContact CD1-CZ 3.7Å; L341-F441 HydrophobicContact CG-CD2 4.47Å; L341-F441 HydrophobicContact CG-CE2 4.39Å; L341-F441 VanDerWaalsContact O-CA 3.24Å; L341-F441 WeakPolarHBondContact O-CA 3.34Å; L341-F441 PolarHBondContact O-N 2.89Å; L341-N444 HydrophobicContact CD2-CB 4.08Å; L341-N444 WeakPolarHBondContact O-CB 3.46Å; L341-N444 PolarHBondContact O-ND2 3.15Å; L341-L445 HydrophobicContact CD1-CB 4.41Å; L341-L445 HydrophobicContact CD1-CD1 4.3Å; L341-L445 HydrophobicContact CD2-CB 4.03Å; L341-L445 HydrophobicContact CD2-CD1 4.45Å
342	N	95.4	Very high	90	Very high	36 Å²	36	33.1 Å²	33.1	19%	0.193	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-9.6	178.6	-168.6	56.8	0	0	0	114.7	Q333 G338 V339 I340 S344 S438	Q333-N342 HydrophobicContact CG-CB 4Å; Q333-N342 PolarHBondContact NE2-ND2 3.31Å; Q333-N342 PolarHBondContact NE2-OD1 3.09Å; G338-N342 WeakPolarHBondContact O-CB 3.31Å; G338-N342 PolarHBondContact O-N 2.81Å; V339-N342 WeakPolarHBondContact O-CB 3.48Å; V339-N342 PolarHBondContact O-N 3.46Å; I340-N342 PolarHBondContact O-N 3.31Å; N342-S344 PolarHBondContact O-N 3.48Å; N342-S438 WeakPolarHBondContact OD1-CB 3.31Å; N342-S438 PolarHBondContact OD1-OG 2.94Å
343	I	95.9	Very high	89.1	Confident	10 Å²	10	34.5 Å²	34.5	5%	0.051	20%	0.195	C	C	.	.			trans	-75	120.4	-179.9	-62	172.4	0	0	0	110	I287 L292 L297 I340 F384 N444	I287-I343 HydrophobicContact CG2-CD1 3.94Å; L292-I343 HydrophobicContact CB-CG2 4.09Å; L297-I343 HydrophobicContact CD1-CD1 3.55Å; L297-I343 HydrophobicContact CD2-CD1 4.09Å; L297-I343 HydrophobicContact CD2-CG2 3.93Å; L297-I343 HydrophobicContact CG-CD1 4.48Å; I340-I343 WeakPolarHBondContact O-CB 3.23Å; I340-I343 PolarHBondContact O-N 3.28Å; I343-F384 HydrophobicContact CB-CZ 4Å; I343-N444 PolarHBondContact O-ND2 3.48Å
344	S	94.9	Very high	88.2	Confident	15 Å²	15	39.1 Å²	39.1	11%	0.105	22%	0.217	C	C	.	.	S	Bend	trans	-157.9	172.1	-177.2	-173.7	0	0	0	0	111.8	N342 L346	N342-S344 PolarHBondContact O-N 3.48Å; S344-L346 PolarHBondContact OG-N 3.41Å
345	C	94.8	Very high	87.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-81.4	-0.4	164.7	67.5	0	0	0	0	113.2	H356 Y358 I377 S577	C345-H356 PolarHBondContact O-CE1 2.99Å; C345-H356 PolarHBondContact O-NE2 3.01Å; C345-Y358 HydrophobicContact CB-CD1 4.14Å; C345-Y358 HydrophobicContact CB-CD2 4.11Å; C345-Y358 HydrophobicContact CB-CE1 4.16Å; C345-Y358 HydrophobicContact CB-CE2 4.15Å; C345-Y358 HydrophobicContact CB-CG 4.11Å; C345-I377 HydrophobicContact CB-CG2 3.83Å; C345-S577 WeakPolarHBondContact O-CB 3.37Å
346	L	93	Very high	86.6	Confident	16 Å²	16	41.7 Å²	41.7	8%	0.084	24%	0.235	C	C	.	.	S	Bend	trans	-73	161.8	170	-62.6	-175.6	0	0	0	111.7	S344 K348 D439 A440 L443 L532 A581	S344-L346 PolarHBondContact OG-N 3.41Å; L346-K348 PolarHBondContact O-N 3.42Å; L346-D439 HydrophobicContact CD1-CB 4.27Å; L346-A440 HydrophobicContact CB-CB 4.47Å; L346-A440 HydrophobicContact CD1-CB 4.22Å; L346-L443 HydrophobicContact CD1-CD1 3.93Å; L346-L532 HydrophobicContact CD1-CD2 4.39Å; L346-A581 HydrophobicContact CD2-CB 3.69Å; L346-A581 HydrophobicContact CG-CB 3.98Å
347	L	85.8	Confident	86	Confident	34 Å²	34	43.6 Å²	43.6	18%	0.178	26%	0.255	C	S	.	.			trans	-62.8	131.4	174.1	-69	-176.3	0	0	0	111	T349 V353 H356 I574	L347-T349 VanDerWaalsContact C-N 3.34Å; L347-V353 HydrophobicContact CD1-CG2 4.24Å; L347-V353 HydrophobicContact CD2-CG2 4.46Å; L347-H356 HydrophobicContact CD2-CB 3.83Å; L347-I574 HydrophobicContact CD1-CD1 3.86Å; L347-I574 HydrophobicContact CD1-CG1 3.54Å; L347-I574 HydrophobicContact CG-CG1 4.28Å
348	K	77.4	Confident	85.6	Confident	121 Å²	121	44.3 Å²	44.3	53%	0.526	26%	0.258	S	S	.	.	S	Bend	trans	-64.3	-39.9	173.7	-70.1	-174.6	177.8	-177.7	0	111.7	L346	L346-K348 PolarHBondContact O-N 3.42Å
349	T	74.6	Confident	85.4	Confident	79 Å²	79	44.4 Å²	44.4	49%	0.485	26%	0.258	S	S	.	.	S	Bend	trans	-121.1	123.8	177.7	-55.5	0	0	0	0	109.2	L347 G351 V352	L347-T349 VanDerWaalsContact C-N 3.34Å; T349-G351 PolarHBondContact O-N 2.89Å; T349-V352 HydrophobicContact CG2-CB 4.25Å; T349-V352 HydrophobicContact CG2-CG2 3.75Å; T349-V352 PolarHBondContact O-N 3.03Å
350	P	69.9	Low	84.9	Confident	81 Å²	81	48.8 Å²	48.8	53%	0.526	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	133.7	177.1	-27.5	34.9	0	0	0	111.8	V352	P350-V352 PolarHBondContact O-N 2.65Å; P350-V352 VanDerWaalsContact O-N 3.15Å
351	G	67.1	Low	84.2	Confident	45 Å²	45	52.9 Å²	52.9	46%	0.464	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-15.2	178	0	0	0	0	0	116.1	T349	T349-G351 PolarHBondContact O-N 2.89Å
352	V	76.3	Confident	83.6	Confident	66 Å²	66	53.2 Å²	53.2	40%	0.4	30%	0.304	S	S	.	.			trans	-97.1	102	179.9	-175.3	0	0	0	0	109.9	T349 P350 E354	T349-V352 HydrophobicContact CG2-CB 4.25Å; T349-V352 HydrophobicContact CG2-CG2 3.75Å; T349-V352 PolarHBondContact O-N 3.03Å; P350-V352 PolarHBondContact O-N 2.65Å; P350-V352 VanDerWaalsContact O-N 3.15Å; V352-E354 HydrophobicContact CG1-CB 4.17Å
353	V	77.6	Confident	83.1	Confident	31 Å²	31	54.2 Å²	54.2	19%	0.188	31%	0.314	C	S	.	.			trans	-90.6	-12.1	178.1	-170.1	0	0	0	0	111.8	L347 N355 H356 R570 T573 I574	L347-V353 HydrophobicContact CD1-CG2 4.24Å; L347-V353 HydrophobicContact CD2-CG2 4.46Å; V353-N355 PolarHBondContact O-N 2.79Å; V353-H356 HydrophobicContact CG1-CB 4.29Å; V353-H356 VanDerWaalsContact O-CB 3.28Å; V353-H356 WeakPolarHBondContact O-CB 3.47Å; V353-H356 PolarHBondContact O-N 2.95Å; V353-R570 HydrophobicContact CG2-CB 4.06Å; V353-R570 HydrophobicContact CG2-CG 4.25Å; V353-T573 HydrophobicContact CG1-CG2 3.86Å; V353-I574 HydrophobicContact CG2-CD1 4.26Å; V353-I574 HydrophobicContact CG2-CG1 4.29Å
354	E	73.9	Confident	82.7	Confident	134 Å²	134	62.6 Å²	62.6	63%	0.626	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	126.6	177.8	-68.3	158.6	-166.1	0	0	109.7	V352 H356	V352-E354 HydrophobicContact CG1-CB 4.17Å; E354-H356 VanDerWaalsContact C-N 3.29Å; E354-H356 PolarHBondContact O-N 3.06Å
355	N	72.3	Confident	82.4	Confident	163 Å²	163	63.6 Å²	63.6	87%	0.872	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	12.7	-173.8	-45.1	-48.3	0	0	0	115.8	V353 G357	V353-N355 PolarHBondContact O-N 2.79Å; N355-G357 PolarHBondContact O-N 2.98Å
356	H	85.4	Confident	82.2	Confident	17 Å²	17	65.6 Å²	65.6	8%	0.079	37%	0.366	C	S	.	.			trans	-73.1	115.1	170.7	-167.8	58.5	0	0	0	110.8	C345 L347 V353 E354 Y358 L360 S577	C345-H356 PolarHBondContact O-CE1 2.99Å; C345-H356 PolarHBondContact O-NE2 3.01Å; L347-H356 HydrophobicContact CD2-CB 3.83Å; V353-H356 HydrophobicContact CG1-CB 4.29Å; V353-H356 VanDerWaalsContact O-CB 3.28Å; V353-H356 WeakPolarHBondContact O-CB 3.47Å; V353-H356 PolarHBondContact O-N 2.95Å; E354-H356 VanDerWaalsContact C-N 3.29Å; E354-H356 PolarHBondContact O-N 3.06Å; H356-Y358 PolarHBondContact CD2-O 3.21Å; H356-Y358 AromaticContact CE1-CD2 3.55Å; H356-Y358 AromaticContact NE2-CD2 3.8Å; H356-Y358 PolarHBondContact O-N 3.22Å; H356-L360 VanDerWaalsContact O-CD2 3.29Å; H356-L360 WeakPolarHBondContact O-CD2 3.5Å; H356-S577 PolarHBondContact NE2-OG 3.36Å
357	G	84.4	Confident	82	Confident	41 Å²	41	69.8 Å²	69.8	42%	0.423	39%	0.394	S	S	.	.			trans	-74	-2.8	-174.2	0	0	0	0	0	116.1	N355	N355-G357 PolarHBondContact O-N 2.98Å
358	Y	90.9	Very high	82.3	Confident	17 Å²	17	75.7 Å²	75.7	7%	0.067	42%	0.421	C	S	.	.	S	Bend	trans	-114.5	146	-172.3	-52	-86.5	0	0	0	112.4	C345 H356 L360 I377 T573	C345-Y358 HydrophobicContact CB-CD1 4.14Å; C345-Y358 HydrophobicContact CB-CD2 4.11Å; C345-Y358 HydrophobicContact CB-CE1 4.16Å; C345-Y358 HydrophobicContact CB-CE2 4.15Å; C345-Y358 HydrophobicContact CB-CG 4.11Å; H356-Y358 PolarHBondContact CD2-O 3.21Å; H356-Y358 AromaticContact CE1-CD2 3.55Å; H356-Y358 AromaticContact NE2-CD2 3.8Å; H356-Y358 PolarHBondContact O-N 3.22Å; Y358-L360 PolarHBondContact O-N 2.87Å; Y358-I377 HydrophobicContact CD1-CD1 3.68Å; Y358-I377 HydrophobicContact CD1-CG1 4.05Å; Y358-I377 HydrophobicContact CE1-CD1 4.32Å; Y358-I377 HydrophobicContact CE1-CG1 4.22Å; Y358-I377 HydrophobicContact CG-CD1 4.49Å; Y358-T573 WeakPolarHBondContact O-CG2 3.15Å
359	F	91.4	Very high	83	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.009	42%	0.42	C	S	.	.	S	Bend	trans	47.2	56.5	177.4	-55	-75.7	0	0	0	113.9	P362 I370 Q373 I377 T573 L576 T580	F359-P362 WeakPolarHBondContact O-CD 3.31Å; F359-I370 HydrophobicContact CD1-CG2 4.46Å; F359-I370 HydrophobicContact CE1-CG2 4.15Å; F359-Q373 HydrophobicContact CD1-CG 4.22Å; F359-Q373 VanDerWaalsContact CD1-OE1 3.27Å; F359-Q373 HydrophobicContact CE1-CB 4.04Å; F359-Q373 HydrophobicContact CE1-CG 3.79Å; F359-Q373 HydrophobicContact CZ-CG 4.13Å; F359-I377 HydrophobicContact CE2-CD1 3.7Å; F359-I377 HydrophobicContact CZ-CD1 3.71Å; F359-T573 HydrophobicContact CB-CG2 4.47Å; F359-T573 PolarHBondContact O-OG1 3.41Å; F359-L576 HydrophobicContact CB-CB 4.25Å; F359-L576 HydrophobicContact CB-CD1 4.22Å; F359-L576 HydrophobicContact CD1-CB 3.99Å; F359-L576 HydrophobicContact CD1-CD1 4.02Å; F359-L576 HydrophobicContact CD2-CB 3.94Å; F359-L576 HydrophobicContact CE1-CB 4.34Å; F359-L576 HydrophobicContact CE2-CB 4.3Å; F359-L576 HydrophobicContact CG-CB 3.78Å; F359-L576 HydrophobicContact CG-CD1 4.23Å; F359-L576 HydrophobicContact CZ-CB 4.49Å; F359-T580 WeakPolarHBondContact CE2-OG1 3.36Å; F359-T580 HydrophobicContact CZ-CG2 4.29Å; F359-T580 WeakPolarHBondContact CZ-OG1 3.39Å
360	L	85.6	Confident	83.8	Confident	116 Å²	116	72.8 Å²	72.8	61%	0.607	40%	0.404	S	S	*	.			trans	-71.3	125.7	179.1	-63.5	173.8	0	0	0	111.2	H356 Y358	H356-L360 VanDerWaalsContact O-CD2 3.29Å; H356-L360 WeakPolarHBondContact O-CD2 3.5Å; Y358-L360 PolarHBondContact O-N 2.87Å
361	N	83.9	Confident	84.9	Confident	85 Å²	85	75.9 Å²	75.9	46%	0.455	41%	0.41	S	S	.	.	S	Bend	trans	51.6	58.2	-179.8	-58.4	-65	0	0	0	113.8	S363 R364	N361-S363 PolarHBondContact O-N 3.48Å; N361-S363 VanDerWaalsContact O-N 3.1Å; N361-R364 PolarHBondContact O-N 3.42Å
362	P	85.6	Confident	86.2	Confident	8 Å²	8	78.7 Å²	78.7	5%	0.052	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-62.6	-23.5	-168.9	27.4	-36.5	0	0	0	114	F359 R364 S365 E569 M572 T573 L576	F359-P362 WeakPolarHBondContact O-CD 3.31Å; P362-R364 PolarHBondContact O-N 2.87Å; P362-S365 PolarHBondContact O-N 2.85Å; P362-E569 WeakPolarHBondContact CD-OE2 3.43Å; P362-M572 HydrophobicContact CB-CB 4.41Å; P362-M572 HydrophobicContact CB-CG 3.71Å; P362-M572 HydrophobicContact CG-CB 3.63Å; P362-M572 HydrophobicContact CG-CG 3.48Å; P362-M572 VanDerWaalsContact CG-CG 3.48Å; P362-T573 WeakPolarHBondContact CD-OG1 3.48Å; P362-L576 HydrophobicContact CB-CD1 3.52Å; P362-L576 HydrophobicContact CG-CD1 4.45Å
363	S	84.8	Confident	87.1	Confident	57 Å²	57	78.4 Å²	78.4	40%	0.399	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-65	-20.6	175.7	80.6	0	0	0	0	114	N361 E569	N361-S363 PolarHBondContact O-N 3.48Å; N361-S363 VanDerWaalsContact O-N 3.1Å; S363-E569 WeakPolarHBondContact CB-OE1 3.28Å; S363-E569 WeakPolarHBondContact CB-OE2 3.37Å; S363-E569 PolarHBondContact N-OE2 3.22Å; S363-E569 VanDerWaalsContact OG-CD 3.25Å; S363-E569 PolarHBondContact OG-OE1 3.02Å; S363-E569 PolarHBondContact OG-OE2 2.9Å
364	R	86.5	Confident	87.9	Confident	186 Å²	186	77.9 Å²	77.9	70%	0.702	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-93	-18.3	-179.1	-61.2	-175.4	177.8	-172.8	-1.1	112.9	N361 P362	N361-R364 PolarHBondContact O-N 3.42Å; P362-R364 PolarHBondContact O-N 2.87Å
365	S	88.9	Confident	89	Confident	37 Å²	37	74.2 Å²	74.2	26%	0.259	40%	0.4	S	S	.	.	S	Bend	trans	-80.7	141.5	-179.5	-58	0	0	0	0	111	P362 E369	P362-S365 PolarHBondContact O-N 2.85Å; S365-E369 WeakPolarHBondContact CA-OE2 3.29Å
366	S	90.6	Very high	90.1	Very high	42 Å²	42	70.4 Å²	70.4	29%	0.294	38%	0.379	S	S	.	.			trans	-72.1	155	172.4	71.9	0	0	0	0	111.1	Q368 E369 I370	S366-Q368 PolarHBondContact O-N 3.21Å; S366-Q368 VanDerWaalsContact O-N 3.12Å; S366-E369 PolarHBondContact N-OE2 3.1Å; S366-E369 PolarHBondContact O-N 3.12Å; S366-E369 VanDerWaalsContact O-N 3.14Å; S366-E369 VanDerWaalsContact OG-CG 3.3Å; S366-E369 WeakPolarHBondContact OG-CG 3.42Å; S366-E369 PolarHBondContact OG-N 3.19Å; S366-E369 PolarHBondContact OG-OE2 3.2Å; S366-I370 PolarHBondContact O-N 3.18Å; S366-I370 VanDerWaalsContact O-N 3.11Å
367	P	89.5	Confident	90.7	Very high	103 Å²	103	69.8 Å²	69.8	67%	0.669	38%	0.377	S	S	*	.	H	α-helix	trans	-57.8	-26.3	174.8	-26.5	35.1	0	0	0	114.3	K371	P367-K371 WeakPolarHBondContact O-CG 3.45Å; P367-K371 PolarHBondContact O-N 3.22Å
368	Q	90.9	Very high	91.3	Very high	158 Å²	158	68.8 Å²	68.8	74%	0.738	36%	0.361	S	S	*	.	H	α-helix	trans	-73.9	-43.6	176.6	-71.4	179.5	-17.9	0	0	111.6	S366 I370 K371 V372	S366-Q368 PolarHBondContact O-N 3.21Å; S366-Q368 VanDerWaalsContact O-N 3.12Å; Q368-I370 VanDerWaalsContact C-N 3.34Å; Q368-I370 PolarHBondContact O-N 3.11Å; Q368-K371 PolarHBondContact O-N 3.44Å; Q368-V372 WeakPolarHBondContact O-CG2 3.42Å; Q368-V372 PolarHBondContact O-N 2.99Å
369	E	92.1	Very high	91.6	Very high	111 Å²	111	73.5 Å²	73.5	52%	0.519	38%	0.384	S	S	.	.	H	α-helix	trans	-61.5	-43.4	176	-71.9	163.7	163.9	0	0	111.5	S365 S366 K371 V372 Q373	S365-E369 WeakPolarHBondContact CA-OE2 3.29Å; S366-E369 PolarHBondContact N-OE2 3.1Å; S366-E369 PolarHBondContact O-N 3.12Å; S366-E369 VanDerWaalsContact O-N 3.14Å; S366-E369 VanDerWaalsContact OG-CG 3.3Å; S366-E369 WeakPolarHBondContact OG-CG 3.42Å; S366-E369 PolarHBondContact OG-N 3.19Å; S366-E369 PolarHBondContact OG-OE2 3.2Å; E369-K371 VanDerWaalsContact C-N 3.3Å; E369-K371 PolarHBondContact O-N 3.38Å; E369-V372 PolarHBondContact O-N 3.4Å; E369-Q373 PolarHBondContact O-N 3.4Å
370	I	92.8	Very high	91.9	Very high	28 Å²	28	75.4 Å²	75.4	14%	0.144	39%	0.392	C	S	.	.	H	α-helix	trans	-58.4	-44.1	175.8	-65.7	171.8	0	0	0	110.4	F359 S366 Q368 Q373 E374 L576	F359-I370 HydrophobicContact CD1-CG2 4.46Å; F359-I370 HydrophobicContact CE1-CG2 4.15Å; S366-I370 PolarHBondContact O-N 3.18Å; S366-I370 VanDerWaalsContact O-N 3.11Å; Q368-I370 VanDerWaalsContact C-N 3.34Å; Q368-I370 PolarHBondContact O-N 3.11Å; I370-Q373 PolarHBondContact O-N 3.48Å; I370-E374 VanDerWaalsContact O-CB 3.31Å; I370-E374 WeakPolarHBondContact O-CB 3.31Å; I370-E374 PolarHBondContact O-N 3Å; I370-L576 HydrophobicContact CD1-CD1 4.16Å; I370-L576 HydrophobicContact CG2-CD1 4.29Å; I370-L576 HydrophobicContact CG2-CD2 3.96Å
371	K	92.1	Very high	92.5	Very high	147 Å²	147	70 Å²	70	64%	0.639	36%	0.363	S	S	*	.	H	α-helix	trans	-65	-39	177.5	-77.9	-178.2	177.5	-167.2	0	113.2	P367 Q368 E369 E374 A375	P367-K371 WeakPolarHBondContact O-CG 3.45Å; P367-K371 PolarHBondContact O-N 3.22Å; Q368-K371 PolarHBondContact O-N 3.44Å; E369-K371 VanDerWaalsContact C-N 3.3Å; E369-K371 PolarHBondContact O-N 3.38Å; K371-E374 PolarHBondContact O-N 3.23Å; K371-A375 WeakPolarHBondContact O-CB 3.46Å; K371-A375 PolarHBondContact O-N 3.27Å
372	V	94.7	Very high	93.1	Very high	104 Å²	104	67.3 Å²	67.3	63%	0.63	35%	0.354	S	S	*	.	H	α-helix	trans	-66.1	-41.9	176.3	171.7	0	0	0	0	110.5	Q368 E369 A375 N376	Q368-V372 WeakPolarHBondContact O-CG2 3.42Å; Q368-V372 PolarHBondContact O-N 2.99Å; E369-V372 PolarHBondContact O-N 3.4Å; V372-A375 PolarHBondContact O-N 3.24Å; V372-N376 WeakPolarHBondContact O-CB 3.39Å; V372-N376 PolarHBondContact O-N 2.88Å
373	Q	94.7	Very high	93.6	Very high	60 Å²	60	71 Å²	71	28%	0.28	37%	0.37	S	S	.	.	H	α-helix	trans	-63.4	-44.3	174.9	-175.3	170.3	17.4	0	0	111.7	F359 E369 I370 N376 I377	F359-Q373 HydrophobicContact CD1-CG 4.22Å; F359-Q373 VanDerWaalsContact CD1-OE1 3.27Å; F359-Q373 HydrophobicContact CE1-CB 4.04Å; F359-Q373 HydrophobicContact CE1-CG 3.79Å; F359-Q373 HydrophobicContact CZ-CG 4.13Å; E369-Q373 PolarHBondContact O-N 3.4Å; I370-Q373 PolarHBondContact O-N 3.48Å; Q373-N376 PolarHBondContact O-N 3.31Å; Q373-I377 HydrophobicContact CG-CD1 3.98Å; Q373-I377 VanDerWaalsContact O-CG1 3.3Å; Q373-I377 WeakPolarHBondContact O-CG1 3.37Å; Q373-I377 PolarHBondContact O-N 3.3Å
374	E	95.3	Very high	94.3	Very high	20 Å²	20	68.3 Å²	68.3	9%	0.093	35%	0.351	C	S	.	.	H	α-helix	trans	-55.7	-50.7	174.2	-179.8	170.3	-165.5	0	0	110.8	I370 K371 N376 I377 H378 K579 T580 T583	I370-E374 VanDerWaalsContact O-CB 3.31Å; I370-E374 WeakPolarHBondContact O-CB 3.31Å; I370-E374 PolarHBondContact O-N 3Å; K371-E374 PolarHBondContact O-N 3.23Å; E374-N376 PolarHBondContact O-N 3.05Å; E374-I377 PolarHBondContact O-N 3.13Å; E374-H378 VanDerWaalsContact CG-CE1 3.43Å; E374-H378 WeakPolarHBondContact CG-CE1 3.43Å; E374-H378 PolarHBondContact O-N 3.48Å; E374-K579 WeakPolarHBondContact OE1-CE 3.32Å; E374-K579 IonicContact OE1-NZ 3.84Å; E374-K579 PolarHBondContact OE1-NZ 3.3Å; E374-K579 IonicContact OE2-NZ 2.66Å; E374-K579 PolarHBondContact OE2-NZ 2.86Å; E374-T580 HydrophobicContact CB-CG2 4.43Å; E374-T580 HydrophobicContact CG-CG2 4.1Å; E374-T583 PolarHBondContact OE1-OG1 3.01Å
375	A	95.8	Very high	94.8	Very high	57 Å²	57	59.6 Å²	59.6	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-38.2	179.1	0	0	0	0	0	113.7	K371 V372 H378 Q379	K371-A375 WeakPolarHBondContact O-CB 3.46Å; K371-A375 PolarHBondContact O-N 3.27Å; V372-A375 PolarHBondContact O-N 3.24Å; A375-H378 PolarHBondContact O-N 3.38Å; A375-Q379 PolarHBondContact O-N 3.31Å; A375-Q379 VanDerWaalsContact O-N 3.13Å
376	N	96.3	Very high	95.2	Very high	82 Å²	82	60.7 Å²	60.7	44%	0.439	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-45.7	176.4	-171.2	0.9	0	0	0	111.1	V372 Q373 E374 H378 Q379 F380	V372-N376 WeakPolarHBondContact O-CB 3.39Å; V372-N376 PolarHBondContact O-N 2.88Å; Q373-N376 PolarHBondContact O-N 3.31Å; E374-N376 PolarHBondContact O-N 3.05Å; N376-H378 VanDerWaalsContact C-N 3.32Å; N376-H378 PolarHBondContact O-N 3.21Å; N376-Q379 WeakPolarHBondContact O-CB 3.34Å; N376-Q379 PolarHBondContact O-N 3.44Å; N376-F380 WeakPolarHBondContact O-CD2 3.47Å; N376-F380 PolarHBondContact O-N 3.44Å; N376-F380 WeakPolarHBondContact OD1-CE2 3.25Å
377	I	97.4	Very high	95.5	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-43.6	175.8	-65.6	163.6	0	0	0	110.4	L292 C345 Y358 F359 Q373 E374 Q379 F380 M381 T580	L292-I377 HydrophobicContact CD2-CG2 4.16Å; C345-I377 HydrophobicContact CB-CG2 3.83Å; Y358-I377 HydrophobicContact CD1-CD1 3.68Å; Y358-I377 HydrophobicContact CD1-CG1 4.05Å; Y358-I377 HydrophobicContact CE1-CD1 4.32Å; Y358-I377 HydrophobicContact CE1-CG1 4.22Å; Y358-I377 HydrophobicContact CG-CD1 4.49Å; F359-I377 HydrophobicContact CE2-CD1 3.7Å; F359-I377 HydrophobicContact CZ-CD1 3.71Å; Q373-I377 HydrophobicContact CG-CD1 3.98Å; Q373-I377 VanDerWaalsContact O-CG1 3.3Å; Q373-I377 WeakPolarHBondContact O-CG1 3.37Å; Q373-I377 PolarHBondContact O-N 3.3Å; E374-I377 PolarHBondContact O-N 3.13Å; I377-Q379 VanDerWaalsContact C-N 3.29Å; I377-Q379 PolarHBondContact O-N 3.09Å; I377-F380 PolarHBondContact O-N 2.85Å; I377-M381 HydrophobicContact CG2-CG 4.14Å; I377-M381 HydrophobicContact CG2-SD 4Å; I377-M381 WeakPolarHBondContact O-CG 3.24Å; I377-M381 PolarHBondContact O-N 2.89Å; I377-T580 HydrophobicContact CB-CG2 3.78Å; I377-T580 HydrophobicContact CD1-CG2 4.02Å; I377-T580 HydrophobicContact CG2-CG2 3.6Å
378	H	97.7	Very high	95.9	Very high	20 Å²	20	56 Å²	56	9%	0.093	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-39.7	176.8	-68.6	165.3	0	0	0	113	E374 A375 N376 F380 M381 A382 T580 T583 E584	E374-H378 VanDerWaalsContact CG-CE1 3.43Å; E374-H378 WeakPolarHBondContact CG-CE1 3.43Å; E374-H378 PolarHBondContact O-N 3.48Å; A375-H378 PolarHBondContact O-N 3.38Å; N376-H378 VanDerWaalsContact C-N 3.32Å; N376-H378 PolarHBondContact O-N 3.21Å; H378-F380 PolarHBondContact O-N 2.89Å; H378-M381 PolarHBondContact O-N 3.01Å; H378-A382 WeakPolarHBondContact O-CB 3.5Å; H378-A382 PolarHBondContact O-N 3.22Å; H378-T580 PolarHBondContact CD2-O 2.91Å; H378-T580 PolarHBondContact NE2-O 3.47Å; H378-T583 PolarHBondContact CE1-O 3.39Å; H378-E584 HydrophobicContact CB-CG 4.16Å; H378-E584 PolarHBondContact NE2-N 3.23Å
379	Q	96.9	Very high	96.3	Very high	117 Å²	117	50.2 Å²	50.2	55%	0.547	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-46.5	176.8	-177.4	178.9	-1.3	0	0	112	A375 N376 I377 A382 Q383	A375-Q379 PolarHBondContact O-N 3.31Å; A375-Q379 VanDerWaalsContact O-N 3.13Å; N376-Q379 WeakPolarHBondContact O-CB 3.34Å; N376-Q379 PolarHBondContact O-N 3.44Å; I377-Q379 VanDerWaalsContact C-N 3.29Å; I377-Q379 PolarHBondContact O-N 3.09Å; Q379-A382 PolarHBondContact O-N 3.35Å; Q379-Q383 WeakPolarHBondContact O-CG 3.36Å; Q379-Q383 PolarHBondContact O-N 3.28Å
380	F	97.6	Very high	96.6	Very high	41 Å²	41	47.9 Å²	47.9	18%	0.18	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-41.4	176.4	-77.9	-73.4	0	0	0	111.7	L292 C293 Y298 N376 I377 H378 A382 Q383 F384	L292-F380 HydrophobicContact CG-CB 4.13Å; C293-F380 HydrophobicContact CB-CD2 4.04Å; C293-F380 HydrophobicContact CB-CE2 4.06Å; C293-F380 HydrophobicContact CB-CG 4.37Å; C293-F380 HydrophobicContact CB-CZ 4.41Å; Y298-F380 AromaticContact CE2-CD1 3.69Å; Y298-F380 HydrophobicContact CE2-CD1 3.69Å; Y298-F380 HydrophobicContact CE2-CE1 4.07Å; Y298-F380 AromaticContact CZ-CD1 3.7Å; Y298-F380 WeakPolarHBondContact OH-CB 3.38Å; Y298-F380 WeakPolarHBondContact OH-CD1 3.43Å; Y298-F380 PolarHBondContact OH-O 3.43Å; N376-F380 WeakPolarHBondContact O-CD2 3.47Å; N376-F380 PolarHBondContact O-N 3.44Å; N376-F380 WeakPolarHBondContact OD1-CE2 3.25Å; I377-F380 PolarHBondContact O-N 2.85Å; H378-F380 PolarHBondContact O-N 2.89Å; F380-A382 PolarHBondContact O-N 3.06Å; F380-Q383 PolarHBondContact O-N 2.72Å; F380-F384 WeakPolarHBondContact O-CB 3.48Å; F380-F384 PolarHBondContact O-N 3.48Å
381	M	97.7	Very high	96.8	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-47.4	174.7	-71.8	-176.9	72.6	0	0	112.2	L292 I377 H378 Q383 F384 H385 A581 E584	L292-M381 HydrophobicContact CD2-CG 3.58Å; I377-M381 HydrophobicContact CG2-CG 4.14Å; I377-M381 HydrophobicContact CG2-SD 4Å; I377-M381 WeakPolarHBondContact O-CG 3.24Å; I377-M381 PolarHBondContact O-N 2.89Å; H378-M381 PolarHBondContact O-N 3.01Å; M381-Q383 VanDerWaalsContact C-N 3.33Å; M381-Q383 PolarHBondContact O-N 2.61Å; M381-F384 PolarHBondContact O-N 3.25Å; M381-H385 WeakPolarHBondContact O-CB 3.46Å; M381-H385 VanDerWaalsContact O-CG 3.23Å; M381-H385 PolarHBondContact O-N 2.92Å; M381-H385 PolarHBondContact O-ND1 3.45Å; M381-A581 HydrophobicContact CE-CB 4.29Å; M381-A581 VanDerWaalsContact CE-O 3.31Å; M381-A581 WeakPolarHBondContact CE-O 3.45Å; M381-E584 HydrophobicContact CB-CG 3.95Å; M381-E584 HydrophobicContact CE-CB 4.27Å; M381-E584 HydrophobicContact SD-CB 4.37Å
382	A	97.1	Very high	97.1	Very high	30 Å²	30	39.7 Å²	39.7	25%	0.248	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-42.1	-179.7	0	0	0	0	0	112.2	H378 Q379 F380 E386	H378-A382 WeakPolarHBondContact O-CB 3.5Å; H378-A382 PolarHBondContact O-N 3.22Å; Q379-A382 PolarHBondContact O-N 3.35Å; F380-A382 PolarHBondContact O-N 3.06Å; A382-E386 PolarHBondContact O-N 3.49Å; A382-E386 VanDerWaalsContact O-N 3.16Å
383	Q	96.6	Very high	97.2	Very high	86 Å²	86	38.1 Å²	38.1	40%	0.402	19%	0.192	S	C	.	.	H	α-helix	trans	-66.1	-44	174.7	-68.8	178.8	13.8	0	0	111.6	Y298 Q379 F380 M381 E386 K387	Y298-Q383 HydrophobicContact CE1-CB 4Å; Q379-Q383 WeakPolarHBondContact O-CG 3.36Å; Q379-Q383 PolarHBondContact O-N 3.28Å; F380-Q383 PolarHBondContact O-N 2.72Å; M381-Q383 VanDerWaalsContact C-N 3.33Å; M381-Q383 PolarHBondContact O-N 2.61Å; Q383-E386 WeakPolarHBondContact O-CB 3.37Å; Q383-E386 PolarHBondContact O-N 2.65Å; Q383-K387 WeakPolarHBondContact O-CG 3.38Å; Q383-K387 PolarHBondContact O-N 2.88Å; Q383-K387 VanDerWaalsContact O-N 3.15Å
384	F	98	Very high	97.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-47.6	180	-175.9	-113.1	0	0	0	112.1	L292 L297 Y298 L301 I340 I343 F380 M381 E386 K387 I388	L292-F384 HydrophobicContact CD1-CB 3.74Å; L292-F384 HydrophobicContact CD1-CD1 3.93Å; L292-F384 HydrophobicContact CD1-CD2 4.29Å; L292-F384 HydrophobicContact CD1-CG 3.73Å; L297-F384 HydrophobicContact CD2-CD2 4.16Å; L297-F384 HydrophobicContact CD2-CE2 3.98Å; Y298-F384 HydrophobicContact CE1-CB 4.25Å; L301-F384 HydrophobicContact CD1-CD2 3.59Å; L301-F384 HydrophobicContact CD1-CE2 3.69Å; L301-F384 HydrophobicContact CD2-CE2 4.47Å; I340-F384 HydrophobicContact CG2-CE2 4.09Å; I340-F384 HydrophobicContact CG2-CZ 3.82Å; I340-F384 VanDerWaalsContact O-CZ 3.28Å; I340-F384 WeakPolarHBondContact O-CZ 3.49Å; I343-F384 HydrophobicContact CB-CZ 4Å; F380-F384 WeakPolarHBondContact O-CB 3.48Å; F380-F384 PolarHBondContact O-N 3.48Å; M381-F384 PolarHBondContact O-N 3.25Å; F384-E386 VanDerWaalsContact C-N 3.26Å; F384-E386 PolarHBondContact O-N 3.48Å; F384-K387 PolarHBondContact O-N 3.3Å; F384-K387 VanDerWaalsContact O-N 3.15Å; F384-I388 HydrophobicContact CD1-CD1 3.76Å; F384-I388 HydrophobicContact CE1-CD1 3.33Å; F384-I388 HydrophobicContact CE1-CG1 4.45Å; F384-I388 HydrophobicContact CE2-CD1 4.3Å; F384-I388 HydrophobicContact CG-CD1 4.41Å; F384-I388 HydrophobicContact CZ-CD1 3.63Å; F384-I388 HydrophobicContact CZ-CG1 4.4Å; F384-I388 PolarHBondContact O-N 3.36Å; F384-I388 VanDerWaalsContact O-N 3.14Å
385	H	97.7	Very high	97.4	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-31.5	175.8	-64.3	162.9	0	0	0	112.6	M381 Y389 N444 A447	M381-H385 WeakPolarHBondContact O-CB 3.46Å; M381-H385 VanDerWaalsContact O-CG 3.23Å; M381-H385 PolarHBondContact O-N 2.92Å; M381-H385 PolarHBondContact O-ND1 3.45Å; H385-Y389 VanDerWaalsContact O-CB 3.25Å; H385-Y389 WeakPolarHBondContact O-CB 3.49Å; H385-Y389 PolarHBondContact O-N 3.3Å; H385-N444 PolarHBondContact CD2-OD1 2.93Å; H385-N444 PolarHBondContact NE2-OD1 3.34Å; H385-A447 HydrophobicContact CB-CB 4.22Å; H385-A447 WeakPolarHBondContact ND1-CB 3.26Å
386	E	97.4	Very high	97.4	Very high	60 Å²	60	34.4 Å²	34.4	28%	0.28	17%	0.167	S	C	.	.	H	α-helix	trans	-63.2	-44.5	172.3	-175.5	57.4	-153.4	0	0	112.2	A382 Q383 F384 Y389 Q390 K451	A382-E386 PolarHBondContact O-N 3.49Å; A382-E386 VanDerWaalsContact O-N 3.16Å; Q383-E386 WeakPolarHBondContact O-CB 3.37Å; Q383-E386 PolarHBondContact O-N 2.65Å; F384-E386 VanDerWaalsContact C-N 3.26Å; F384-E386 PolarHBondContact O-N 3.48Å; E386-Y389 PolarHBondContact O-N 3.38Å; E386-Q390 VanDerWaalsContact O-CG 3.29Å; E386-Q390 WeakPolarHBondContact O-CG 3.4Å; E386-Q390 PolarHBondContact O-N 2.86Å; E386-Q390 PolarHBondContact OE1-NE2 3Å; E386-K451 VanDerWaalsContact CA-NZ 3.33Å; E386-K451 IonicContact OE2-NZ 3.56Å; E386-K451 PolarHBondContact OE2-NZ 3.37Å
387	K	97.6	Very high	97.3	Very high	47 Å²	47	37.2 Å²	37.2	20%	0.204	18%	0.177	C	C	.	.	H	α-helix	trans	-63	-45.9	178.2	-62.6	-66.7	178.4	178	0	111.7	L301 D302 L305 Q383 F384 Y389 Q390 M391	L301-K387 HydrophobicContact CB-CB 4.25Å; L301-K387 HydrophobicContact CB-CG 4.34Å; L301-K387 HydrophobicContact CD1-CB 3.98Å; L301-K387 HydrophobicContact CD1-CG 4.16Å; D302-K387 WeakPolarHBondContact OD1-CE 3.28Å; D302-K387 IonicContact OD1-NZ 3.91Å; D302-K387 PolarHBondContact OD1-NZ 3.1Å; L305-K387 HydrophobicContact CD1-CD 3.41Å; L305-K387 VanDerWaalsContact CD1-CD 3.41Å; Q383-K387 WeakPolarHBondContact O-CG 3.38Å; Q383-K387 PolarHBondContact O-N 2.88Å; Q383-K387 VanDerWaalsContact O-N 3.15Å; F384-K387 PolarHBondContact O-N 3.3Å; F384-K387 VanDerWaalsContact O-N 3.15Å; K387-Y389 PolarHBondContact O-N 3.01Å; K387-Q390 PolarHBondContact O-N 3.33Å; K387-M391 WeakPolarHBondContact O-CG 3.48Å; K387-M391 PolarHBondContact O-N 3.24Å
388	I	98.1	Very high	97.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-45.1	177.5	-62.3	165.3	0	0	0	111	I340 L341 F384 Q390 M391 L392 N444 A448	I340-I388 HydrophobicContact CG2-CD1 4.33Å; I340-I388 HydrophobicContact CG2-CG1 4.13Å; L341-I388 HydrophobicContact CD2-CD1 4.17Å; L341-I388 HydrophobicContact CD2-CG2 3.93Å; F384-I388 HydrophobicContact CD1-CD1 3.76Å; F384-I388 HydrophobicContact CE1-CD1 3.33Å; F384-I388 HydrophobicContact CE1-CG1 4.45Å; F384-I388 HydrophobicContact CE2-CD1 4.3Å; F384-I388 HydrophobicContact CG-CD1 4.41Å; F384-I388 HydrophobicContact CZ-CD1 3.63Å; F384-I388 HydrophobicContact CZ-CG1 4.4Å; F384-I388 PolarHBondContact O-N 3.36Å; F384-I388 VanDerWaalsContact O-N 3.14Å; I388-Q390 VanDerWaalsContact C-N 3.31Å; I388-Q390 PolarHBondContact O-N 3.49Å; I388-M391 PolarHBondContact O-N 3.1Å; I388-L392 HydrophobicContact CG2-CD1 4.37Å; I388-L392 WeakPolarHBondContact O-CG 3.37Å; I388-L392 PolarHBondContact O-N 3.09Å; I388-N444 HydrophobicContact CD1-CB 4.29Å; I388-A448 HydrophobicContact CB-CB 4.22Å; I388-A448 HydrophobicContact CG2-CB 3.62Å
389	Y	98.1	Very high	96.9	Very high	36 Å²	36	40 Å²	40	14%	0.141	19%	0.194	C	C	.	.	H	α-helix	trans	-55.6	-46.3	175.1	156.7	-103.9	0	0	0	111.8	H385 E386 K387 L392 K393 K451 L452	H385-Y389 VanDerWaalsContact O-CB 3.25Å; H385-Y389 WeakPolarHBondContact O-CB 3.49Å; H385-Y389 PolarHBondContact O-N 3.3Å; E386-Y389 PolarHBondContact O-N 3.38Å; K387-Y389 PolarHBondContact O-N 3.01Å; Y389-L392 PolarHBondContact O-N 3.08Å; Y389-K393 HydrophobicContact CE1-CD 4.26Å; Y389-K393 HydrophobicContact CE2-CD 4.38Å; Y389-K393 VanDerWaalsContact O-CB 3.26Å; Y389-K393 WeakPolarHBondContact O-CB 3.28Å; Y389-K393 PolarHBondContact O-N 3.16Å; Y389-K393 WeakPolarHBondContact OH-CD 3.46Å; Y389-K393 PolarHBondContact OH-NZ 3.03Å; Y389-K451 HydrophobicContact CD1-CD 4.25Å; Y389-K451 HydrophobicContact CD2-CB 3.42Å; Y389-K451 VanDerWaalsContact CD2-CB 3.42Å; Y389-K451 HydrophobicContact CD2-CD 4.47Å; Y389-K451 HydrophobicContact CE2-CB 3.92Å; Y389-K451 HydrophobicContact CG-CB 3.77Å; Y389-K451 HydrophobicContact CG-CD 3.94Å; Y389-L452 HydrophobicContact CD2-CD2 3.95Å; Y389-L452 HydrophobicContact CD2-CG 3.96Å; Y389-L452 HydrophobicContact CE2-CD2 3.67Å; Y389-L452 HydrophobicContact CE2-CG 4.05Å
390	Q	98.1	Very high	96.6	Very high	62 Å²	62	38.9 Å²	38.9	29%	0.29	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-42.3	179.2	-73.2	175.2	4.1	0	0	111.9	L305 E386 K387 I388 K393 N394	L305-Q390 HydrophobicContact CD2-CB 3.52Å; E386-Q390 VanDerWaalsContact O-CG 3.29Å; E386-Q390 WeakPolarHBondContact O-CG 3.4Å; E386-Q390 PolarHBondContact O-N 2.86Å; E386-Q390 PolarHBondContact OE1-NE2 3Å; K387-Q390 PolarHBondContact O-N 3.33Å; I388-Q390 VanDerWaalsContact C-N 3.31Å; I388-Q390 PolarHBondContact O-N 3.49Å; Q390-K393 PolarHBondContact O-N 3.15Å; Q390-N394 WeakPolarHBondContact O-CB 3.29Å; Q390-N394 PolarHBondContact O-N 3.12Å; Q390-N394 PolarHBondContact O-ND2 3.21Å; Q390-N394 PolarHBondContact O-OD1 3.41Å
391	M	98	Very high	96.4	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-51.7	174.5	-69	174.4	66.7	0	0	111.5	L304 L305 T308 F317 I340 K387 I388 K393 N394 L395	L304-M391 HydrophobicContact CB-CE 3.84Å; L304-M391 HydrophobicContact CB-SD 4.22Å; L304-M391 HydrophobicContact CD1-CE 4.22Å; L305-M391 HydrophobicContact CD2-CB 4.37Å; L305-M391 HydrophobicContact CD2-CG 3.53Å; L305-M391 HydrophobicContact CG-CG 4.15Å; T308-M391 HydrophobicContact CG2-CB 4.27Å; T308-M391 HydrophobicContact CG2-CE 4.16Å; T308-M391 HydrophobicContact CG2-CG 4.38Å; F317-M391 HydrophobicContact CZ-CE 3.92Å; I340-M391 HydrophobicContact CD1-CE 4.36Å; K387-M391 WeakPolarHBondContact O-CG 3.48Å; K387-M391 PolarHBondContact O-N 3.24Å; I388-M391 PolarHBondContact O-N 3.1Å; M391-K393 VanDerWaalsContact C-N 3.32Å; M391-K393 PolarHBondContact O-N 3.1Å; M391-N394 PolarHBondContact O-N 3.41Å; M391-L395 WeakPolarHBondContact O-CG 3.35Å; M391-L395 PolarHBondContact O-N 3.17Å; M391-L395 VanDerWaalsContact O-N 3.12Å
392	L	97.8	Very high	96.2	Very high	3 Å²	3	42 Å²	42	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-41.1	178.8	-67.1	-179.2	0	0	0	111.7	L337 I388 Y389 L395 L396 I406 L445 A448 L449 L452	L337-L392 HydrophobicContact CD2-CD2 4.31Å; I388-L392 HydrophobicContact CG2-CD1 4.37Å; I388-L392 WeakPolarHBondContact O-CG 3.37Å; I388-L392 PolarHBondContact O-N 3.09Å; Y389-L392 PolarHBondContact O-N 3.08Å; L392-L395 PolarHBondContact O-N 3.45Å; L392-L396 WeakPolarHBondContact O-CB 3.47Å; L392-L396 VanDerWaalsContact O-CG 3.23Å; L392-L396 WeakPolarHBondContact O-CG 3.37Å; L392-L396 PolarHBondContact O-N 3.19Å; L392-I406 HydrophobicContact CD2-CD1 4.18Å; L392-I406 HydrophobicContact CD2-CG1 4.21Å; L392-L445 HydrophobicContact CD1-CD1 4.33Å; L392-A448 HydrophobicContact CD1-CB 3.91Å; L392-L449 HydrophobicContact CD1-CD2 4.37Å; L392-L452 HydrophobicContact CB-CD1 4.3Å
393	K	97.2	Very high	96.1	Very high	71 Å²	71	42.9 Å²	42.9	31%	0.309	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-44.8	177.5	-177.2	-175.3	-178.4	179.5	0	111.8	Y389 Q390 M391 L396 Q397 L452	Y389-K393 HydrophobicContact CE1-CD 4.26Å; Y389-K393 HydrophobicContact CE2-CD 4.38Å; Y389-K393 VanDerWaalsContact O-CB 3.26Å; Y389-K393 WeakPolarHBondContact O-CB 3.28Å; Y389-K393 PolarHBondContact O-N 3.16Å; Y389-K393 WeakPolarHBondContact OH-CD 3.46Å; Y389-K393 PolarHBondContact OH-NZ 3.03Å; Q390-K393 PolarHBondContact O-N 3.15Å; M391-K393 VanDerWaalsContact C-N 3.32Å; M391-K393 PolarHBondContact O-N 3.1Å; K393-L396 PolarHBondContact O-N 2.82Å; K393-Q397 HydrophobicContact CG-CG 4.48Å; K393-Q397 WeakPolarHBondContact O-CB 3.19Å; K393-Q397 VanDerWaalsContact O-CG 3.3Å; K393-Q397 WeakPolarHBondContact O-CG 3.41Å; K393-Q397 PolarHBondContact O-N 3.33Å; K393-Q397 VanDerWaalsContact O-N 3.15Å; K393-L452 HydrophobicContact CB-CD2 4.17Å
394	N	97	Very high	96	Very high	41 Å²	41	40.2 Å²	40.2	22%	0.219	20%	0.199	C	C	.	.	H	α-helix	trans	-58	-51.9	177.4	-68.8	-13.2	0	0	0	110	T308 Q390 M391 L396 Q397 L398	T308-N394 WeakPolarHBondContact O-CB 3.5Å; T308-N394 PolarHBondContact OG1-ND2 3.23Å; Q390-N394 WeakPolarHBondContact O-CB 3.29Å; Q390-N394 PolarHBondContact O-N 3.12Å; Q390-N394 PolarHBondContact O-ND2 3.21Å; Q390-N394 PolarHBondContact O-OD1 3.41Å; M391-N394 PolarHBondContact O-N 3.41Å; N394-L396 VanDerWaalsContact C-N 3.29Å; N394-L396 PolarHBondContact O-N 3.23Å; N394-Q397 PolarHBondContact O-N 3.41Å; N394-Q397 VanDerWaalsContact O-N 3.08Å; N394-L398 WeakPolarHBondContact O-CB 3.47Å; N394-L398 PolarHBondContact O-N 3.28Å
395	L	96.7	Very high	95.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-34	179.9	-64.7	176.4	0	0	0	113.5	T308 A314 F317 V318 M391 L392 T402 K403 I406	T308-L395 HydrophobicContact CG2-CD1 4.22Å; T308-L395 HydrophobicContact CG2-CD2 4.01Å; T308-L395 HydrophobicContact CG2-CG 4.07Å; A314-L395 HydrophobicContact CB-CD2 3.79Å; F317-L395 HydrophobicContact CD1-CD1 4.06Å; F317-L395 HydrophobicContact CD1-CD2 4.4Å; F317-L395 HydrophobicContact CE1-CD1 3.96Å; V318-L395 HydrophobicContact CG2-CD1 4.19Å; V318-L395 HydrophobicContact CG2-CD2 3.79Å; V318-L395 HydrophobicContact CG2-CG 4.48Å; M391-L395 WeakPolarHBondContact O-CG 3.35Å; M391-L395 PolarHBondContact O-N 3.17Å; M391-L395 VanDerWaalsContact O-N 3.12Å; L392-L395 PolarHBondContact O-N 3.45Å; L395-T402 CarbonylContact O-C 3.52Å; L395-T402 PolarHBondContact O-OG1 3.33Å; L395-K403 PolarHBondContact O-N 2.91Å; L395-I406 HydrophobicContact CB-CB 4.46Å; L395-I406 HydrophobicContact CB-CG1 4.46Å; L395-I406 HydrophobicContact CB-CG2 4.32Å; L395-I406 HydrophobicContact CD1-CD1 4.12Å; L395-I406 HydrophobicContact CD1-CG1 4.28Å
396	L	95.6	Very high	95.9	Very high	16 Å²	16	42.4 Å²	42.4	8%	0.084	21%	0.214	C	C	.	.	H	α-helix	trans	-74.6	-23.3	177.2	-73.2	170	0	0	0	113.8	L392 K393 N394 K403 I406 L407 L452	L392-L396 WeakPolarHBondContact O-CB 3.47Å; L392-L396 VanDerWaalsContact O-CG 3.23Å; L392-L396 WeakPolarHBondContact O-CG 3.37Å; L392-L396 PolarHBondContact O-N 3.19Å; K393-L396 PolarHBondContact O-N 2.82Å; N394-L396 VanDerWaalsContact C-N 3.29Å; N394-L396 PolarHBondContact O-N 3.23Å; L396-K403 HydrophobicContact CD2-CG 4.06Å; L396-I406 HydrophobicContact CD2-CG2 3.61Å; L396-I406 HydrophobicContact CG-CG2 4.12Å; L396-L407 HydrophobicContact CD2-CD1 4.25Å; L396-L407 HydrophobicContact CD2-CD2 3.79Å; L396-L407 HydrophobicContact CD2-CG 3.77Å; L396-L452 HydrophobicContact CD1-CD1 3.78Å; L396-L452 HydrophobicContact CD1-CD2 4.22Å
397	Q	94.7	Very high	95.8	Very high	141 Å²	141	39.6 Å²	39.6	66%	0.659	20%	0.201	S	C	*	.	H	α-helix	trans	-103.6	-16.3	-172.7	-69.2	-175.6	-15.6	0	0	113.9	K393 N394	K393-Q397 HydrophobicContact CG-CG 4.48Å; K393-Q397 WeakPolarHBondContact O-CB 3.19Å; K393-Q397 VanDerWaalsContact O-CG 3.3Å; K393-Q397 WeakPolarHBondContact O-CG 3.41Å; K393-Q397 PolarHBondContact O-N 3.33Å; K393-Q397 VanDerWaalsContact O-N 3.15Å; N394-Q397 PolarHBondContact O-N 3.41Å; N394-Q397 VanDerWaalsContact O-N 3.08Å
398	L	92.9	Very high	95.7	Very high	59 Å²	59	38 Å²	38	31%	0.309	20%	0.196	S	C	.	.	H	α-helix	trans	-75.2	-50.5	-168.5	-165.3	65.5	0	0	0	113.9	R309 A314 N394	R309-L398 WeakPolarHBondContact O-CD1 3.29Å; A314-L398 HydrophobicContact CB-CD2 3.2Å; N394-L398 WeakPolarHBondContact O-CB 3.47Å; N394-L398 PolarHBondContact O-N 3.28Å
399	S	93.4	Very high	95.7	Very high	23 Å²	23	38 Å²	38	16%	0.161	20%	0.196	C	C	.	.			trans	-150.5	158.9	175.5	73.1	0	0	0	0	112.3	E401 T402 K403	S399-E401 PolarHBondContact O-N 3.23Å; S399-T402 PolarHBondContact N-OG1 3.09Å; S399-T402 PolarHBondContact O-N 2.87Å; S399-T402 PolarHBondContact O-OG1 3.45Å; S399-T402 WeakPolarHBondContact OG-CG2 3.48Å; S399-T402 PolarHBondContact OG-N 2.86Å; S399-T402 VanDerWaalsContact OG-N 3.11Å; S399-T402 PolarHBondContact OG-OG1 3.23Å; S399-K403 VanDerWaalsContact O-CB 3.27Å; S399-K403 WeakPolarHBondContact O-CB 3.35Å; S399-K403 PolarHBondContact O-N 2.97Å
400	P	92.3	Very high	95.7	Very high	95 Å²	95	36.5 Å²	36.5	62%	0.617	19%	0.19	S	C	*	.	H	α-helix	trans	-57.6	-36.1	173.7	-24.4	35	0	0	0	113.3	H404	P400-H404 WeakPolarHBondContact O-CB 3.31Å; P400-H404 PolarHBondContact O-N 3.22Å
401	E	91.6	Very high	95.6	Very high	103 Å²	103	33.6 Å²	33.6	48%	0.481	18%	0.176	S	C	.	.	H	α-helix	trans	-69.3	-50.2	179.6	-66.3	67.1	-145	0	0	111.5	S399 K403 H404 C405	S399-E401 PolarHBondContact O-N 3.23Å; E401-K403 VanDerWaalsContact C-N 3.3Å; E401-K403 PolarHBondContact O-N 3.18Å; E401-H404 PolarHBondContact O-N 3.37Å; E401-C405 PolarHBondContact O-N 2.58Å; E401-C405 PolarHBondContact O-SG 3.47Å
402	T	94.4	Very high	95.5	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-42.1	177.9	47.5	0	0	0	0	111	A314 L395 S399 C405 I406	A314-T402 HydrophobicContact CB-CG2 4.41Å; L395-T402 CarbonylContact O-C 3.52Å; L395-T402 PolarHBondContact O-OG1 3.33Å; S399-T402 PolarHBondContact N-OG1 3.09Å; S399-T402 PolarHBondContact O-N 2.87Å; S399-T402 PolarHBondContact O-OG1 3.45Å; S399-T402 WeakPolarHBondContact OG-CG2 3.48Å; S399-T402 PolarHBondContact OG-N 2.86Å; S399-T402 VanDerWaalsContact OG-N 3.11Å; S399-T402 PolarHBondContact OG-OG1 3.23Å; T402-C405 PolarHBondContact O-N 2.98Å; T402-I406 WeakPolarHBondContact O-CG2 3.43Å; T402-I406 PolarHBondContact O-N 3.27Å
403	K	95.4	Very high	95.5	Very high	48 Å²	48	34.7 Å²	34.7	21%	0.209	18%	0.182	C	C	.	.	H	α-helix	trans	-57.3	-48.9	172.9	-178.6	-172	172.2	-164.1	0	112.1	L395 L396 S399 E401 I406 L407	L395-K403 PolarHBondContact O-N 2.91Å; L396-K403 HydrophobicContact CD2-CG 4.06Å; S399-K403 VanDerWaalsContact O-CB 3.27Å; S399-K403 WeakPolarHBondContact O-CB 3.35Å; S399-K403 PolarHBondContact O-N 2.97Å; E401-K403 VanDerWaalsContact C-N 3.3Å; E401-K403 PolarHBondContact O-N 3.18Å; K403-I406 WeakPolarHBondContact O-CG2 3.49Å; K403-L407 HydrophobicContact CD-CD1 4.47Å; K403-L407 HydrophobicContact CG-CD1 3.82Å; K403-L407 WeakPolarHBondContact O-CB 3.29Å; K403-L407 VanDerWaalsContact O-CG 3.25Å; K403-L407 WeakPolarHBondContact O-CG 3.36Å; K403-L407 PolarHBondContact O-N 3.22Å
404	H	94.6	Very high	95.5	Very high	31 Å²	31	31.3 Å²	31.3	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-47.2	178.3	173.5	65.1	0	0	0	111.2	P400 E401 I406 L407 S408 H488	P400-H404 WeakPolarHBondContact O-CB 3.31Å; P400-H404 PolarHBondContact O-N 3.22Å; E401-H404 PolarHBondContact O-N 3.37Å; H404-I406 PolarHBondContact O-N 3.44Å; H404-L407 PolarHBondContact O-N 3.33Å; H404-S408 PolarHBondContact CE1-OG 3.08Å; H404-S408 VanDerWaalsContact O-CB 3.27Å; H404-S408 WeakPolarHBondContact O-CB 3.31Å; H404-S408 PolarHBondContact O-N 3.11Å; H404-S408 PolarHBondContact O-OG 2.69Å; H404-S408 VanDerWaalsContact O-OG 3.13Å; H404-H488 AromaticContact CE1-CD2 3.93Å; H404-H488 AromaticContact CE1-NE2 3.57Å; H404-H488 AromaticContact CG-NE2 3.84Å; H404-H488 AromaticContact ND1-CD2 3.57Å; H404-H488 AromaticContact ND1-CE1 3.97Å; H404-H488 AromaticContact ND1-NE2 2.82Å; H404-H488 PolarHBondContact ND1-NE2 3.28Å
405	C	95.2	Very high	95.4	Very high	48 Å²	48	32 Å²	32	32%	0.324	17%	0.169	S	C	.	.	H	α-helix	trans	-65.5	-40.9	-177.6	-65.5	0	0	0	0	112.6	V318 E401 T402 W409	V318-C405 HydrophobicContact CB-CB 4.29Å; V318-C405 HydrophobicContact CG1-CB 3.31Å; E401-C405 PolarHBondContact O-N 2.58Å; E401-C405 PolarHBondContact O-SG 3.47Å; T402-C405 PolarHBondContact O-N 2.98Å; C405-W409 WeakPolarHBondContact O-CB 3.48Å; C405-W409 PolarHBondContact O-N 2.68Å
406	I	96.9	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70.8	-38	177.3	-167.6	60.5	0	0	0	112.2	I321 L337 L392 L395 L396 T402 K403 H404 W409 L410	I321-I406 HydrophobicContact CD1-CD1 4.02Å; L337-I406 HydrophobicContact CD2-CD1 4.18Å; L392-I406 HydrophobicContact CD2-CD1 4.18Å; L392-I406 HydrophobicContact CD2-CG1 4.21Å; L395-I406 HydrophobicContact CB-CB 4.46Å; L395-I406 HydrophobicContact CB-CG1 4.46Å; L395-I406 HydrophobicContact CB-CG2 4.32Å; L395-I406 HydrophobicContact CD1-CD1 4.12Å; L395-I406 HydrophobicContact CD1-CG1 4.28Å; L396-I406 HydrophobicContact CD2-CG2 3.61Å; L396-I406 HydrophobicContact CG-CG2 4.12Å; T402-I406 WeakPolarHBondContact O-CG2 3.43Å; T402-I406 PolarHBondContact O-N 3.27Å; K403-I406 WeakPolarHBondContact O-CG2 3.49Å; H404-I406 PolarHBondContact O-N 3.44Å; I406-W409 HydrophobicContact CD1-CE3 4.49Å; I406-W409 WeakPolarHBondContact O-CB 3.49Å; I406-W409 PolarHBondContact O-N 3.36Å; I406-L410 VanDerWaalsContact O-CG 3.31Å; I406-L410 WeakPolarHBondContact O-CG 3.16Å; I406-L410 PolarHBondContact O-N 2.92Å
407	L	96.8	Very high	95.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-67.3	-40	174.9	-70.1	171.3	0	0	0	111.4	L396 K403 H404 W409 L410 G411 H488 L513 L520	L396-L407 HydrophobicContact CD2-CD1 4.25Å; L396-L407 HydrophobicContact CD2-CD2 3.79Å; L396-L407 HydrophobicContact CD2-CG 3.77Å; K403-L407 HydrophobicContact CD-CD1 4.47Å; K403-L407 HydrophobicContact CG-CD1 3.82Å; K403-L407 WeakPolarHBondContact O-CB 3.29Å; K403-L407 VanDerWaalsContact O-CG 3.25Å; K403-L407 WeakPolarHBondContact O-CG 3.36Å; K403-L407 PolarHBondContact O-N 3.22Å; H404-L407 PolarHBondContact O-N 3.33Å; L407-W409 VanDerWaalsContact C-N 3.34Å; L407-L410 HydrophobicContact CD2-CD1 4.44Å; L407-L410 PolarHBondContact O-N 2.95Å; L407-G411 PolarHBondContact O-N 3.3Å; L407-H488 HydrophobicContact CB-CB 3.83Å; L407-H488 VanDerWaalsContact CB-CG 3.42Å; L407-H488 WeakPolarHBondContact CB-ND1 3.36Å; L407-H488 WeakPolarHBondContact O-CB 3.39Å; L407-L513 HydrophobicContact CD1-CD1 4.04Å; L407-L513 HydrophobicContact CD2-CD1 4.35Å; L407-L520 HydrophobicContact CD2-CD1 3.72Å
408	S	95.9	Very high	95.1	Very high	14 Å²	14	26 Å²	26	10%	0.098	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-44.8	171	-76.9	0	0	0	0	111.7	H404 G411 N412 H488	H404-S408 PolarHBondContact CE1-OG 3.08Å; H404-S408 VanDerWaalsContact O-CB 3.27Å; H404-S408 WeakPolarHBondContact O-CB 3.31Å; H404-S408 PolarHBondContact O-N 3.11Å; H404-S408 PolarHBondContact O-OG 2.69Å; H404-S408 VanDerWaalsContact O-OG 3.13Å; S408-G411 PolarHBondContact O-N 2.94Å; S408-N412 VanDerWaalsContact O-CB 3.29Å; S408-N412 WeakPolarHBondContact O-CB 3.35Å; S408-N412 PolarHBondContact O-N 3.19Å; S408-N412 PolarHBondContact O-ND2 3.28Å; S408-H488 PolarHBondContact OG-CD2 2.67Å
409	W	97	Very high	94.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-48.3	175.9	-175	96.6	0	0	0	111.3	I321 Y332 L337 L341 C405 I406 L407 C413 F441	I321-W409 HydrophobicContact CD1-CG 4.43Å; I321-W409 PolarHBondContact O-NE1 3.45Å; Y332-W409 HydrophobicContact CD1-CD2 4.26Å; Y332-W409 AromaticContact CD1-CE2 3.68Å; Y332-W409 AromaticContact CD1-CZ2 3.87Å; Y332-W409 HydrophobicContact CD1-CZ2 3.87Å; Y332-W409 AromaticContact CD1-NE1 3.76Å; Y332-W409 HydrophobicContact CE1-CD2 4.49Å; Y332-W409 HydrophobicContact CE1-CG 4.48Å; L337-W409 HydrophobicContact CD2-CE3 4.3Å; L337-W409 HydrophobicContact CD2-CH2 3.88Å; L337-W409 HydrophobicContact CD2-CZ2 4.2Å; L337-W409 HydrophobicContact CD2-CZ3 3.93Å; L337-W409 HydrophobicContact CG-CH2 4.21Å; L341-W409 HydrophobicContact CD1-CH2 4.02Å; C405-W409 WeakPolarHBondContact O-CB 3.48Å; C405-W409 PolarHBondContact O-N 2.68Å; I406-W409 HydrophobicContact CD1-CE3 4.49Å; I406-W409 WeakPolarHBondContact O-CB 3.49Å; I406-W409 PolarHBondContact O-N 3.36Å; L407-W409 VanDerWaalsContact C-N 3.34Å; W409-C413 HydrophobicContact CE3-CB 4.47Å; W409-C413 HydrophobicContact CZ3-CB 4.46Å; W409-C413 WeakPolarHBondContact O-CB 3.39Å; W409-C413 PolarHBondContact O-N 2.75Å; W409-F441 HydrophobicContact CH2-CE2 4.28Å; W409-F441 AromaticContact CH2-CZ 3.82Å; W409-F441 HydrophobicContact CH2-CZ 3.82Å
410	L	97.9	Very high	94.6	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-50.5	178.4	-69.8	168.3	0	0	0	111.6	I406 L407 N412 C413 L414 L445 L449 L520	I406-L410 VanDerWaalsContact O-CG 3.31Å; I406-L410 WeakPolarHBondContact O-CG 3.16Å; I406-L410 PolarHBondContact O-N 2.92Å; L407-L410 HydrophobicContact CD2-CD1 4.44Å; L407-L410 PolarHBondContact O-N 2.95Å; L410-N412 PolarHBondContact O-N 3.09Å; L410-C413 WeakPolarHBondContact O-CB 3.41Å; L410-C413 PolarHBondContact O-N 3.15Å; L410-L414 WeakPolarHBondContact O-CG 3.35Å; L410-L414 PolarHBondContact O-N 3.12Å; L410-L445 HydrophobicContact CD2-CD1 3.72Å; L410-L445 HydrophobicContact CD2-CD2 4.26Å; L410-L449 HydrophobicContact CD1-CD2 4.3Å; L410-L520 HydrophobicContact CB-CD2 3.83Å; L410-L520 HydrophobicContact CD1-CD1 4.43Å
411	G	96.3	Very high	94.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.9	-39.9	-178.5	0	0	0	0	0	113.5	L407 S408 H415 H488	L407-G411 PolarHBondContact O-N 3.3Å; S408-G411 PolarHBondContact O-N 2.94Å; G411-H415 WeakPolarHBondContact O-CB 3.14Å; G411-H415 PolarHBondContact O-N 3.33Å; G411-H415 VanDerWaalsContact O-N 3.09Å; G411-H488 WeakPolarHBondContact CA-O 3.47Å
412	N	95.9	Very high	93.6	Very high	27 Å²	27	19.9 Å²	19.9	14%	0.144	11%	0.108	C	C	.	.	H	α-helix	trans	-70.5	-37.3	174.9	-64.6	-24.4	0	0	0	111.5	Y332 S408 L410 H415 A416 R482 R490	Y332-N412 WeakPolarHBondContact OH-CB 3.12Å; S408-N412 VanDerWaalsContact O-CB 3.29Å; S408-N412 WeakPolarHBondContact O-CB 3.35Å; S408-N412 PolarHBondContact O-N 3.19Å; S408-N412 PolarHBondContact O-ND2 3.28Å; L410-N412 PolarHBondContact O-N 3.09Å; N412-H415 PolarHBondContact O-N 3.1Å; N412-A416 WeakPolarHBondContact O-CB 3.49Å; N412-A416 PolarHBondContact O-N 2.98Å; N412-R482 PolarHBondContact OD1-NH1 3.17Å; N412-R482 PolarHBondContact OD1-NH2 3.14Å; N412-R490 VanDerWaalsContact OD1-CD 3.31Å; N412-R490 WeakPolarHBondContact OD1-CD 3.29Å
413	C	97.3	Very high	92.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.1	-48.9	175.2	-177.5	0	0	0	0	111.5	Y332 W409 L410 H415 A416 N417	Y332-C413 HydrophobicContact CD1-CB 3.46Å; Y332-C413 VanDerWaalsContact CD1-CB 3.46Å; Y332-C413 HydrophobicContact CE1-CB 3.55Å; Y332-C413 HydrophobicContact CG-CB 3.99Å; W409-C413 HydrophobicContact CE3-CB 4.47Å; W409-C413 HydrophobicContact CZ3-CB 4.46Å; W409-C413 WeakPolarHBondContact O-CB 3.39Å; W409-C413 PolarHBondContact O-N 2.75Å; L410-C413 WeakPolarHBondContact O-CB 3.41Å; L410-C413 PolarHBondContact O-N 3.15Å; C413-H415 VanDerWaalsContact C-N 3.35Å; C413-H415 PolarHBondContact O-N 3.26Å; C413-A416 PolarHBondContact O-N 3.44Å; C413-N417 WeakPolarHBondContact O-CB 3.48Å; C413-N417 PolarHBondContact O-N 3.12Å; C413-N417 PolarHBondContact O-ND2 3.28Å
414	L	97	Very high	90.3	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-40.6	178.5	-63.8	-174.9	0	0	0	111.6	L410 N417 A418 F442 L445 M489 L520 Y523 T524 L527	L410-L414 WeakPolarHBondContact O-CG 3.35Å; L410-L414 PolarHBondContact O-N 3.12Å; L414-N417 CarbonylContact O-C 3.51Å; L414-N417 PolarHBondContact O-N 3.32Å; L414-N417 VanDerWaalsContact O-N 3.13Å; L414-A418 PolarHBondContact O-N 3.32Å; L414-F442 HydrophobicContact CD2-CD1 4.5Å; L414-F442 HydrophobicContact CD2-CE1 3.61Å; L414-F442 HydrophobicContact CD2-CZ 4.4Å; L414-L445 HydrophobicContact CD2-CD2 4.48Å; L414-M489 HydrophobicContact CD1-CE 3.97Å; L414-M489 HydrophobicContact CD1-SD 3.78Å; L414-L520 HydrophobicContact CD1-CD2 3.8Å; L414-Y523 HydrophobicContact CB-CD1 3.84Å; L414-Y523 HydrophobicContact CB-CE1 4.12Å; L414-Y523 HydrophobicContact CD1-CD1 4.04Å; L414-Y523 HydrophobicContact CG-CD1 4.43Å; L414-T524 WeakPolarHBondContact CD2-OG1 3.33Å; L414-L527 HydrophobicContact CB-CD1 4.4Å; L414-L527 HydrophobicContact CD2-CD1 4.26Å
415	H	94.9	Very high	88.5	Confident	54 Å²	54	27.4 Å²	27.4	25%	0.25	14%	0.142	C	C	.	.	H	α-helix	trans	-62.2	-45.4	176.9	-173.2	66.8	0	0	0	112.8	G411 N412 C413 N417 A418 R490	G411-H415 WeakPolarHBondContact O-CB 3.14Å; G411-H415 PolarHBondContact O-N 3.33Å; G411-H415 VanDerWaalsContact O-N 3.09Å; N412-H415 PolarHBondContact O-N 3.1Å; C413-H415 VanDerWaalsContact C-N 3.35Å; C413-H415 PolarHBondContact O-N 3.26Å; H415-N417 PolarHBondContact O-N 3.1Å; H415-N417 VanDerWaalsContact O-N 3.14Å; H415-A418 VanDerWaalsContact O-CB 3.31Å; H415-A418 WeakPolarHBondContact O-CB 3.36Å; H415-A418 PolarHBondContact O-N 3.47Å; H415-R490 HydrophobicContact CB-CB 4.02Å; H415-R490 PolarHBondContact ND1-O 3.17Å
416	A	94.8	Very high	86.4	Confident	14 Å²	14	28 Å²	28	12%	0.116	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-19.8	176.2	0	0	0	0	0	113.1	Y332 N412 C413	Y332-A416 HydrophobicContact CD2-CB 4.4Å; Y332-A416 HydrophobicContact CE2-CB 3.83Å; N412-A416 WeakPolarHBondContact O-CB 3.49Å; N412-A416 PolarHBondContact O-N 2.98Å; C413-A416 PolarHBondContact O-N 3.44Å
417	N	94.1	Very high	84.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	5.7	-179	-78	-76.8	0	0	0	113.9	G329 C413 L414 H415 G419 R420 Y436 A437 F442 L527	G329-N417 VanDerWaalsContact CA-ND2 3.34Å; G329-N417 WeakPolarHBondContact CA-ND2 3.35Å; C413-N417 WeakPolarHBondContact O-CB 3.48Å; C413-N417 PolarHBondContact O-N 3.12Å; C413-N417 PolarHBondContact O-ND2 3.28Å; L414-N417 CarbonylContact O-C 3.51Å; L414-N417 PolarHBondContact O-N 3.32Å; L414-N417 VanDerWaalsContact O-N 3.13Å; H415-N417 PolarHBondContact O-N 3.1Å; H415-N417 VanDerWaalsContact O-N 3.14Å; N417-G419 PolarHBondContact O-N 2.98Å; N417-R420 HydrophobicContact CB-CG 4.39Å; N417-R420 WeakPolarHBondContact O-CB 3.12Å; N417-R420 VanDerWaalsContact O-CG 3.26Å; N417-R420 WeakPolarHBondContact O-CG 3.31Å; N417-R420 PolarHBondContact O-N 3.11Å; N417-Y436 WeakPolarHBondContact OD1-CA 3.35Å; N417-Y436 WeakPolarHBondContact OD1-CB 3.34Å; N417-A437 PolarHBondContact OD1-N 3.22Å; N417-F442 HydrophobicContact CB-CE2 3.94Å; N417-F442 HydrophobicContact CB-CZ 3.43Å; N417-F442 VanDerWaalsContact CB-CZ 3.43Å; N417-L527 HydrophobicContact CB-CD1 4.24Å
418	A	92.1	Very high	82.3	Confident	20 Å²	20	38.8 Å²	38.8	17%	0.165	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-59.5	-17.6	-179.1	0	0	0	0	0	113.8	L414 H415 R420 Y523	L414-A418 PolarHBondContact O-N 3.32Å; H415-A418 VanDerWaalsContact O-CB 3.31Å; H415-A418 WeakPolarHBondContact O-CB 3.36Å; H415-A418 PolarHBondContact O-N 3.47Å; A418-R420 VanDerWaalsContact C-N 3.31Å; A418-R420 PolarHBondContact O-N 3.09Å; A418-Y523 VanDerWaalsContact CB-OH 3.27Å; A418-Y523 WeakPolarHBondContact CB-OH 3.46Å
419	G	88.6	Confident	80.2	Confident	8 Å²	8	42 Å²	42	8%	0.082	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-75.2	-12.1	175.3	0	0	0	0	0	115.2	N417 T421 K422 A425 Y436	N417-G419 PolarHBondContact O-N 2.98Å; G419-T421 VanDerWaalsContact C-N 3.31Å; G419-T421 PolarHBondContact O-N 3.14Å; G419-K422 PolarHBondContact O-N 3.34Å; G419-A425 WeakPolarHBondContact O-CB 3.41Å; G419-Y436 WeakPolarHBondContact CA-OH 3.46Å
420	R	88.3	Confident	78.3	Confident	5 Å²	5	48.3 Å²	48.3	2%	0.019	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.3	-30.3	-173.7	-75.4	171.3	56.9	73.5	4.1	114.7	N417 A418 Y436 A437 D439 F442 L527 R531	N417-R420 HydrophobicContact CB-CG 4.39Å; N417-R420 WeakPolarHBondContact O-CB 3.12Å; N417-R420 VanDerWaalsContact O-CG 3.26Å; N417-R420 WeakPolarHBondContact O-CG 3.31Å; N417-R420 PolarHBondContact O-N 3.11Å; A418-R420 VanDerWaalsContact C-N 3.31Å; A418-R420 PolarHBondContact O-N 3.09Å; R420-Y436 HydrophobicContact CG-CD1 4.16Å; R420-Y436 HydrophobicContact CG-CD2 4.15Å; R420-Y436 HydrophobicContact CG-CG 3.78Å; R420-A437 PolarHBondContact NH1-O 3.44Å; R420-D439 IonicContact CZ-OD1 3.89Å; R420-D439 IonicContact NH1-OD1 2.67Å; R420-D439 PolarHBondContact NH1-OD1 3.13Å; R420-D439 IonicContact NH2-OD1 3.37Å; R420-D439 PolarHBondContact NH2-OD1 3.39Å; R420-F442 VanDerWaalsContact NE-CD2 3.33Å; R420-F442 VanDerWaalsContact NE-CE2 3.32Å; R420-L527 HydrophobicContact CB-CD2 4.4Å; R420-L527 PolarHBondContact NE-O 3.27Å; R420-L527 PolarHBondContact NH2-O 3.32Å; R420-R531 WeakPolarHBondContact O-CD 3.21Å; R420-R531 PolarHBondContact O-NH1 3.49Å
421	T	81.1	Confident	75.9	Confident	27 Å²	27	54 Å²	54	17%	0.166	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-94.8	-5.7	-178.2	51.9	0	0	0	0	113.2	G419 Y526 L527	G419-T421 VanDerWaalsContact C-N 3.31Å; G419-T421 PolarHBondContact O-N 3.14Å; T421-Y526 HydrophobicContact CG2-CD1 3.98Å; T421-Y526 HydrophobicContact CG2-CE1 3.76Å; T421-Y526 HydrophobicContact CG2-CE2 4.32Å; T421-Y526 HydrophobicContact CG2-CG 4.35Å; T421-Y526 VanDerWaalsContact CG2-O 3.25Å; T421-Y526 WeakPolarHBondContact CG2-O 3.21Å; T421-Y526 WeakPolarHBondContact OG1-CE1 3.45Å; T421-L527 HydrophobicContact CG2-CD2 3.86Å
422	K	80.9	Confident	73.8	Confident	111 Å²	111	59.5 Å²	59.5	48%	0.483	30%	0.296	S	S	.	.	S	Bend	trans	-72.2	142.2	-179.3	-61.9	-174.9	-179.9	179.5	0	110.9	G419 W424 A425	G419-K422 PolarHBondContact O-N 3.34Å; K422-W424 HydrophobicContact CB-CG 4.36Å; K422-W424 VanDerWaalsContact CB-NE1 3.28Å; K422-W424 VanDerWaalsContact CD-NE1 3.33Å; K422-W424 PolarHBondContact O-N 3.14Å; K422-W424 VanDerWaalsContact O-N 3.12Å; K422-A425 WeakPolarHBondContact O-CB 3.37Å; K422-A425 PolarHBondContact O-N 3.45Å
423	I	63	Low	72.1	Confident	129 Å²	129	60.9 Å²	60.9	66%	0.662	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-51.9	-40.9	-176.7	-63.5	169.3	0	0	0	112.3	A425 N426	I423-A425 VanDerWaalsContact C-N 3.3Å; I423-A425 PolarHBondContact O-N 2.95Å; I423-N426 WeakPolarHBondContact O-CB 3.34Å; I423-N426 PolarHBondContact O-N 3.02Å; I423-N426 VanDerWaalsContact O-N 3.12Å
424	W	57.7	Low	70.5	Confident	108 Å²	108	66.7 Å²	66.7	41%	0.409	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-64.9	-30.6	180	65.3	-95.2	0	0	0	113.1	K422 N426 Q427 M428 Y436	K422-W424 HydrophobicContact CB-CG 4.36Å; K422-W424 VanDerWaalsContact CB-NE1 3.28Å; K422-W424 VanDerWaalsContact CD-NE1 3.33Å; K422-W424 PolarHBondContact O-N 3.14Å; K422-W424 VanDerWaalsContact O-N 3.12Å; W424-N426 PolarHBondContact O-N 3.44Å; W424-Q427 PolarHBondContact O-N 2.93Å; W424-M428 HydrophobicContact CE3-CE 3.73Å; W424-M428 HydrophobicContact CE3-CG 3.67Å; W424-M428 HydrophobicContact CE3-SD 4.46Å; W424-M428 HydrophobicContact CZ3-CE 4.13Å; W424-M428 HydrophobicContact CZ3-CG 4.08Å; W424-M428 VanDerWaalsContact O-CG 3.24Å; W424-M428 WeakPolarHBondContact O-CG 3.41Å; W424-M428 PolarHBondContact O-N 3.42Å; W424-Y436 HydrophobicContact CH2-CE2 4.39Å; W424-Y436 WeakPolarHBondContact CH2-OH 3.41Å; W424-Y436 WeakPolarHBondContact CZ2-OH 3.38Å
425	A	56.3	Low	69.6	Low	4 Å²	4	71.8 Å²	71.8	3%	0.033	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-66.4	-24.7	176.5	0	0	0	0	0	112	G419 K422 I423 F433	G419-A425 WeakPolarHBondContact O-CB 3.41Å; K422-A425 WeakPolarHBondContact O-CB 3.37Å; K422-A425 PolarHBondContact O-N 3.45Å; I423-A425 VanDerWaalsContact C-N 3.3Å; I423-A425 PolarHBondContact O-N 2.95Å; A425-F433 WeakPolarHBondContact O-CZ 3.43Å
426	N	52.8	Low	69.4	Low	62 Å²	62	70.9 Å²	70.9	33%	0.332	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-83.5	-11	174	-69.5	-24.9	0	0	0	113.6	I423 W424 R531	I423-N426 WeakPolarHBondContact O-CB 3.34Å; I423-N426 PolarHBondContact O-N 3.02Å; I423-N426 VanDerWaalsContact O-N 3.12Å; W424-N426 PolarHBondContact O-N 3.44Å; N426-R531 PolarHBondContact OD1-NH1 3.46Å
427	Q	51.1	Low	69.3	Low	152 Å²	152	70.2 Å²	70.2	71%	0.71	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-11.2	-177.2	-65.8	176.6	-15.6	0	0	113	W424	W424-Q427 PolarHBondContact O-N 2.93Å
428	M	56.2	Low	69.2	Low	75 Å²	75	71.6 Å²	71.6	37%	0.369	35%	0.352	S	S	.	.	S	Bend	trans	-70	143	179	-81.3	-82.4	170.5	0	0	111.7	W424 F432	W424-M428 HydrophobicContact CE3-CE 3.73Å; W424-M428 HydrophobicContact CE3-CG 3.67Å; W424-M428 HydrophobicContact CE3-SD 4.46Å; W424-M428 HydrophobicContact CZ3-CE 4.13Å; W424-M428 HydrophobicContact CZ3-CG 4.08Å; W424-M428 VanDerWaalsContact O-CG 3.24Å; W424-M428 WeakPolarHBondContact O-CG 3.41Å; W424-M428 PolarHBondContact O-N 3.42Å; M428-F432 HydrophobicContact CB-CB 4.27Å; M428-F432 HydrophobicContact SD-CB 4.18Å; M428-F432 HydrophobicContact SD-CD2 3.91Å; M428-F432 HydrophobicContact SD-CG 4.06Å
429	P	51.7	Low	69.2	Low	80 Å²	80	72.3 Å²	72.3	52%	0.519	35%	0.353	S	S	.	.			trans	-53.7	144.8	167.4	-23.5	32.5	0	0	0	111.6	I431 F432	P429-I431 PolarHBondContact O-N 3.49Å; P429-F432 HydrophobicContact CB-CD2 4.41Å; P429-F432 HydrophobicContact CG-CD2 4.43Å; P429-F432 PolarHBondContact O-N 3.36Å
430	E	56.1	Low	69.5	Low	133 Å²	133	72.2 Å²	72.2	62%	0.621	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-51.1	-25.4	-174.9	-74.4	-178.7	164.2	0	0	114.7	F432 F433	E430-F432 VanDerWaalsContact C-N 3.29Å; E430-F432 PolarHBondContact O-N 2.69Å; E430-F433 WeakPolarHBondContact O-CB 3.47Å; E430-F433 PolarHBondContact O-N 3.39Å
431	I	48.1	Very low	69.9	Low	124 Å²	124	72 Å²	72	64%	0.636	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-63.2	-31.3	179.3	-60.6	164.1	0	0	0	112.3	P429 Q434	P429-I431 PolarHBondContact O-N 3.49Å; I431-Q434 WeakPolarHBondContact O-CG 3.32Å
432	F	52.4	Low	70.6	Confident	115 Å²	115	70.8 Å²	70.8	50%	0.504	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-85	-7.2	179.3	-66.6	-78.9	0	0	0	113.7	M428 P429 E430 Q434 M435	M428-F432 HydrophobicContact CB-CB 4.27Å; M428-F432 HydrophobicContact SD-CB 4.18Å; M428-F432 HydrophobicContact SD-CD2 3.91Å; M428-F432 HydrophobicContact SD-CG 4.06Å; P429-F432 HydrophobicContact CB-CD2 4.41Å; P429-F432 HydrophobicContact CG-CD2 4.43Å; P429-F432 PolarHBondContact O-N 3.36Å; E430-F432 VanDerWaalsContact C-N 3.29Å; E430-F432 PolarHBondContact O-N 2.69Å; F432-Q434 PolarHBondContact O-N 2.96Å; F432-M435 PolarHBondContact O-N 3.16Å
433	F	58.7	Low	71.4	Confident	57 Å²	57	65.8 Å²	65.8	25%	0.25	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-64.5	-14.8	170.1	-88.2	-78	0	0	0	113	A425 E430 M435 Y436	A425-F433 WeakPolarHBondContact O-CZ 3.43Å; E430-F433 WeakPolarHBondContact O-CB 3.47Å; E430-F433 PolarHBondContact O-N 3.39Å; F433-M435 PolarHBondContact O-N 3.23Å; F433-Y436 PolarHBondContact O-N 2.62Å
434	Q	64.3	Low	73	Confident	122 Å²	122	59.8 Å²	59.8	57%	0.57	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-67.1	-3.2	178.7	-63.1	-175.1	0.4	0	0	114.3	Q330 I431 F432	Q330-Q434 WeakPolarHBondContact CB-O 3.46Å; Q330-Q434 WeakPolarHBondContact CG-O 3.42Å; Q330-Q434 PolarHBondContact NE2-O 3.43Å; Q330-Q434 PolarHBondContact OE1-O 3.15Å; Q330-Q434 VanDerWaalsContact OE1-O 3.07Å; I431-Q434 WeakPolarHBondContact O-CG 3.32Å; F432-Q434 PolarHBondContact O-N 2.96Å
435	M	79.5	Confident	75	Confident	108 Å²	108	54.7 Å²	54.7	53%	0.532	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-89.4	-14.1	176.4	-61.7	-170.7	75.5	0	0	114	N328 G329 Q330 F432 F433	N328-M435 PolarHBondContact OD1-O 3.34Å; N328-M435 VanDerWaalsContact OD1-O 3.05Å; G329-M435 WeakPolarHBondContact CA-O 3.44Å; G329-M435 PolarHBondContact N-O 3.45Å; G329-M435 VanDerWaalsContact N-O 3.13Å; Q330-M435 PolarHBondContact N-O 3.15Å; Q330-M435 VanDerWaalsContact N-O 3.16Å; F432-M435 PolarHBondContact O-N 3.16Å; F433-M435 PolarHBondContact O-N 3.23Å
436	Y	89.8	Confident	76.9	Confident	34 Å²	34	54.6 Å²	54.6	13%	0.133	27%	0.272	C	S	.	.	S	Bend	trans	-116.5	157.2	-175.5	-57.4	-55.7	0	0	0	111.8	N417 G419 R420 W424 F433	N417-Y436 WeakPolarHBondContact OD1-CA 3.35Å; N417-Y436 WeakPolarHBondContact OD1-CB 3.34Å; G419-Y436 WeakPolarHBondContact CA-OH 3.46Å; R420-Y436 HydrophobicContact CG-CD1 4.16Å; R420-Y436 HydrophobicContact CG-CD2 4.15Å; R420-Y436 HydrophobicContact CG-CG 3.78Å; W424-Y436 HydrophobicContact CH2-CE2 4.39Å; W424-Y436 WeakPolarHBondContact CH2-OH 3.41Å; W424-Y436 WeakPolarHBondContact CZ2-OH 3.38Å; F433-Y436 PolarHBondContact O-N 2.62Å
437	A	92.6	Very high	79.1	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.008	26%	0.257	C	S	.	.			trans	-69.7	156.9	168.6	0	0	0	0	0	110.5	Q333 N417 R420 F441 F442	Q333-A437 HydrophobicContact CB-CB 4.2Å; N417-A437 PolarHBondContact OD1-N 3.22Å; R420-A437 PolarHBondContact NH1-O 3.44Å; A437-F441 HydrophobicContact CB-CB 4.19Å; A437-F441 HydrophobicContact CB-CD1 3.87Å; A437-F441 HydrophobicContact CB-CD2 4.28Å; A437-F441 HydrophobicContact CB-CE1 4.32Å; A437-F441 HydrophobicContact CB-CG 3.87Å; A437-F442 HydrophobicContact CB-CD2 4.5Å; A437-F442 HydrophobicContact CB-CE2 3.97Å
438	S	91.6	Very high	81.3	Confident	28 Å²	28	44.6 Å²	44.6	20%	0.196	22%	0.223	C	C	.	.			trans	-71.5	167.3	-174.2	73.4	0	0	0	0	114.2	N342 A440 F441 F442	N342-S438 WeakPolarHBondContact OD1-CB 3.31Å; N342-S438 PolarHBondContact OD1-OG 2.94Å; S438-A440 VanDerWaalsContact C-N 3.3Å; S438-A440 PolarHBondContact O-N 3.22Å; S438-A440 PolarHBondContact OG-N 3.34Å; S438-F441 WeakPolarHBondContact O-CB 3.33Å; S438-F441 PolarHBondContact O-N 3.3Å; S438-F441 PolarHBondContact OG-N 2.8Å; S438-F441 VanDerWaalsContact OG-N 3.12Å; S438-F442 WeakPolarHBondContact O-CD2 3.48Å; S438-F442 PolarHBondContact O-N 2.84Å
439	D	92.3	Very high	83.3	Confident	35 Å²	35	41 Å²	41	19%	0.187	21%	0.206	C	C	.	.	H	α-helix	trans	-67.3	-32.6	173.4	-57.5	-46.4	0	0	0	111.9	L346 R420 F441 F442 L443 R531 L532	L346-D439 HydrophobicContact CD1-CB 4.27Å; R420-D439 IonicContact CZ-OD1 3.89Å; R420-D439 IonicContact NH1-OD1 2.67Å; R420-D439 PolarHBondContact NH1-OD1 3.13Å; R420-D439 IonicContact NH2-OD1 3.37Å; R420-D439 PolarHBondContact NH2-OD1 3.39Å; D439-F441 PolarHBondContact O-N 3.29Å; D439-F442 PolarHBondContact O-N 3.2Å; D439-L443 WeakPolarHBondContact O-CG 3.44Å; D439-L443 PolarHBondContact O-N 3.23Å; D439-R531 IonicContact OD1-NE 2.84Å; D439-R531 PolarHBondContact OD1-NE 2.8Å; D439-L532 HydrophobicContact CB-CD1 4.08Å
440	A	94.6	Very high	85.5	Confident	7 Å²	7	37.3 Å²	37.3	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-58.6	-46.2	173.3	0	0	0	0	0	111.8	L341 L346 S438 F442 L443 N444	L341-A440 CarbonylContact O-C 3.49Å; L346-A440 HydrophobicContact CB-CB 4.47Å; L346-A440 HydrophobicContact CD1-CB 4.22Å; S438-A440 VanDerWaalsContact C-N 3.3Å; S438-A440 PolarHBondContact O-N 3.22Å; S438-A440 PolarHBondContact OG-N 3.34Å; A440-F442 PolarHBondContact O-N 2.83Å; A440-L443 PolarHBondContact O-N 3.16Å; A440-N444 WeakPolarHBondContact O-CB 3.36Å; A440-N444 PolarHBondContact O-N 3.47Å; A440-N444 PolarHBondContact O-ND2 2.96Å
441	F	96.5	Very high	87.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-54	-50.7	176	178.9	-78	0	0	0	111.8	Q333 L341 W409 A437 S438 D439 L445	Q333-F441 HydrophobicContact CB-CD2 4.46Å; Q333-F441 HydrophobicContact CG-CD2 4.49Å; L341-F441 HydrophobicContact CB-CD2 3.53Å; L341-F441 HydrophobicContact CB-CE2 3.88Å; L341-F441 HydrophobicContact CB-CG 4.06Å; L341-F441 HydrophobicContact CD1-CD2 4.09Å; L341-F441 HydrophobicContact CD1-CE1 4.34Å; L341-F441 HydrophobicContact CD1-CE2 3.58Å; L341-F441 HydrophobicContact CD1-CZ 3.7Å; L341-F441 HydrophobicContact CG-CD2 4.47Å; L341-F441 HydrophobicContact CG-CE2 4.39Å; L341-F441 VanDerWaalsContact O-CA 3.24Å; L341-F441 WeakPolarHBondContact O-CA 3.34Å; L341-F441 PolarHBondContact O-N 2.89Å; W409-F441 HydrophobicContact CH2-CE2 4.28Å; W409-F441 AromaticContact CH2-CZ 3.82Å; W409-F441 HydrophobicContact CH2-CZ 3.82Å; A437-F441 HydrophobicContact CB-CB 4.19Å; A437-F441 HydrophobicContact CB-CD1 3.87Å; A437-F441 HydrophobicContact CB-CD2 4.28Å; A437-F441 HydrophobicContact CB-CE1 4.32Å; A437-F441 HydrophobicContact CB-CG 3.87Å; S438-F441 WeakPolarHBondContact O-CB 3.33Å; S438-F441 PolarHBondContact O-N 3.3Å; S438-F441 PolarHBondContact OG-N 2.8Å; S438-F441 VanDerWaalsContact OG-N 3.12Å; D439-F441 PolarHBondContact O-N 3.29Å; F441-L445 HydrophobicContact CE1-CD2 3.92Å; F441-L445 VanDerWaalsContact O-CB 3.32Å; F441-L445 WeakPolarHBondContact O-CB 3.17Å; F441-L445 PolarHBondContact O-N 3.22Å
442	F	97.1	Very high	89.7	Confident	1 Å²	1	27.5 Å²	27.5	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-73.1	-33.7	-176.1	-85	-84.2	0	0	0	113.7	L414 N417 R420 A437 S438 D439 A440 G446 T524 L527	L414-F442 HydrophobicContact CD2-CD1 4.5Å; L414-F442 HydrophobicContact CD2-CE1 3.61Å; L414-F442 HydrophobicContact CD2-CZ 4.4Å; N417-F442 HydrophobicContact CB-CE2 3.94Å; N417-F442 HydrophobicContact CB-CZ 3.43Å; N417-F442 VanDerWaalsContact CB-CZ 3.43Å; R420-F442 VanDerWaalsContact NE-CD2 3.33Å; R420-F442 VanDerWaalsContact NE-CE2 3.32Å; A437-F442 HydrophobicContact CB-CD2 4.5Å; A437-F442 HydrophobicContact CB-CE2 3.97Å; S438-F442 WeakPolarHBondContact O-CD2 3.48Å; S438-F442 PolarHBondContact O-N 2.84Å; D439-F442 PolarHBondContact O-N 3.2Å; A440-F442 PolarHBondContact O-N 2.83Å; F442-G446 PolarHBondContact O-N 2.97Å; F442-T524 HydrophobicContact CD1-CG2 4.03Å; F442-L527 HydrophobicContact CD1-CB 3.88Å; F442-L527 HydrophobicContact CE1-CB 3.67Å; F442-L527 HydrophobicContact CE1-CD1 3.91Å; F442-L527 HydrophobicContact CE1-CG 4.46Å; F442-L527 HydrophobicContact CZ-CB 4.28Å; F442-L527 HydrophobicContact CZ-CD1 4.21Å
443	L	96.4	Very high	91.8	Very high	7 Å²	7	22 Å²	22	4%	0.037	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-47.9	173.1	-75.4	-173.7	0	0	0	111.3	L346 D439 A440 G446 A447 F529 L532 A581 M582	L346-L443 HydrophobicContact CD1-CD1 3.93Å; D439-L443 WeakPolarHBondContact O-CG 3.44Å; D439-L443 PolarHBondContact O-N 3.23Å; A440-L443 PolarHBondContact O-N 3.16Å; L443-G446 PolarHBondContact O-N 3.49Å; L443-A447 WeakPolarHBondContact O-CB 3.41Å; L443-A447 PolarHBondContact O-N 3.24Å; L443-F529 HydrophobicContact CD2-CD2 4.3Å; L443-L532 HydrophobicContact CD1-CD2 3.57Å; L443-L532 HydrophobicContact CD2-CD2 4.08Å; L443-L532 HydrophobicContact CG-CD2 3.99Å; L443-A581 HydrophobicContact CD1-CB 3.87Å; L443-M582 HydrophobicContact CD1-CG 4.44Å
444	N	97.8	Very high	93.6	Very high	3 Å²	3	21 Å²	21	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-67.4	-40.9	-179	-71.4	-27.5	0	0	0	112	L341 I343 H385 I388 A440 A447 A448	L341-N444 HydrophobicContact CD2-CB 4.08Å; L341-N444 WeakPolarHBondContact O-CB 3.46Å; L341-N444 PolarHBondContact O-ND2 3.15Å; I343-N444 PolarHBondContact O-ND2 3.48Å; H385-N444 PolarHBondContact CD2-OD1 2.93Å; H385-N444 PolarHBondContact NE2-OD1 3.34Å; I388-N444 HydrophobicContact CD1-CB 4.29Å; A440-N444 WeakPolarHBondContact O-CB 3.36Å; A440-N444 PolarHBondContact O-N 3.47Å; A440-N444 PolarHBondContact O-ND2 2.96Å; N444-A447 PolarHBondContact O-N 3.14Å; N444-A448 PolarHBondContact O-N 3.27Å; N444-A448 VanDerWaalsContact O-N 3.16Å
445	L	98.3	Very high	95	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-63.7	-46.1	174.3	-178	59.7	0	0	0	110.9	L341 L392 L410 L414 F441 A447 A448 L449 T524	L341-L445 HydrophobicContact CD1-CB 4.41Å; L341-L445 HydrophobicContact CD1-CD1 4.3Å; L341-L445 HydrophobicContact CD2-CB 4.03Å; L341-L445 HydrophobicContact CD2-CD1 4.45Å; L392-L445 HydrophobicContact CD1-CD1 4.33Å; L410-L445 HydrophobicContact CD2-CD1 3.72Å; L410-L445 HydrophobicContact CD2-CD2 4.26Å; L414-L445 HydrophobicContact CD2-CD2 4.48Å; F441-L445 HydrophobicContact CE1-CD2 3.92Å; F441-L445 VanDerWaalsContact O-CB 3.32Å; F441-L445 WeakPolarHBondContact O-CB 3.17Å; F441-L445 PolarHBondContact O-N 3.22Å; L445-A447 VanDerWaalsContact C-N 3.33Å; L445-A447 PolarHBondContact O-N 3.36Å; L445-A448 PolarHBondContact O-N 3.15Å; L445-L449 HydrophobicContact CD1-CD1 4.23Å; L445-L449 HydrophobicContact CD1-CG 4.14Å; L445-L449 HydrophobicContact CG-CD1 4.04Å; L445-L449 HydrophobicContact CG-CG 4.34Å; L445-L449 WeakPolarHBondContact O-CG 3.47Å; L445-L449 PolarHBondContact O-N 2.92Å; L445-T524 HydrophobicContact CB-CG2 4.21Å; L445-T524 HydrophobicContact CD2-CG2 4.11Å; L445-T524 HydrophobicContact CG-CG2 3.98Å
446	G	97.6	Very high	95.7	Very high	2 Å²	2	14.1 Å²	14.1	2%	0.021	8%	0.079	C	C	.	.	H	α-helix	trans	-57.6	-44	176.8	0	0	0	0	0	112.2	F442 L443 A448 L449 L450	F442-G446 PolarHBondContact O-N 2.97Å; L443-G446 PolarHBondContact O-N 3.49Å; G446-A448 PolarHBondContact O-N 2.8Å; G446-L449 PolarHBondContact O-N 3.36Å; G446-L450 VanDerWaalsContact O-CB 3.23Å; G446-L450 WeakPolarHBondContact O-CB 3.26Å; G446-L450 WeakPolarHBondContact O-CG 3.33Å; G446-L450 PolarHBondContact O-N 3.4Å
447	A	97.8	Very high	95.9	Very high	3 Å²	3	12.9 Å²	12.9	3%	0.025	7%	0.074	C	C	.	.	H	α-helix	trans	-62.7	-40.2	177.2	0	0	0	0	0	113	H385 L443 N444 L445 L450 K451 M587	H385-A447 HydrophobicContact CB-CB 4.22Å; H385-A447 WeakPolarHBondContact ND1-CB 3.26Å; L443-A447 WeakPolarHBondContact O-CB 3.41Å; L443-A447 PolarHBondContact O-N 3.24Å; N444-A447 PolarHBondContact O-N 3.14Å; L445-A447 VanDerWaalsContact C-N 3.33Å; L445-A447 PolarHBondContact O-N 3.36Å; A447-L450 WeakPolarHBondContact O-CB 3.39Å; A447-K451 PolarHBondContact O-N 3.41Å; A447-M587 HydrophobicContact CB-CG 4.12Å; A447-M587 HydrophobicContact CB-SD 4.09Å
448	A	97.9	Very high	95.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-69.7	-43	177	0	0	0	0	0	112.4	I388 L392 N444 L445 G446 K451 L452	I388-A448 HydrophobicContact CB-CB 4.22Å; I388-A448 HydrophobicContact CG2-CB 3.62Å; L392-A448 HydrophobicContact CD1-CB 3.91Å; N444-A448 PolarHBondContact O-N 3.27Å; N444-A448 VanDerWaalsContact O-N 3.16Å; L445-A448 PolarHBondContact O-N 3.15Å; G446-A448 PolarHBondContact O-N 2.8Å; A448-K451 WeakPolarHBondContact O-CB 3.4Å; A448-K451 PolarHBondContact O-N 3.27Å; A448-L452 PolarHBondContact O-N 2.86Å
449	L	98.1	Very high	95.1	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-66.4	-36.9	176	-67	-177.7	0	0	0	112.1	L392 L410 L445 G446 K451 L452 C453 L520 T521 T524	L392-L449 HydrophobicContact CD1-CD2 4.37Å; L410-L449 HydrophobicContact CD1-CD2 4.3Å; L445-L449 HydrophobicContact CD1-CD1 4.23Å; L445-L449 HydrophobicContact CD1-CG 4.14Å; L445-L449 HydrophobicContact CG-CD1 4.04Å; L445-L449 HydrophobicContact CG-CG 4.34Å; L445-L449 WeakPolarHBondContact O-CG 3.47Å; L445-L449 PolarHBondContact O-N 2.92Å; G446-L449 PolarHBondContact O-N 3.36Å; L449-K451 VanDerWaalsContact C-N 3.3Å; L449-K451 PolarHBondContact O-N 3.17Å; L449-L452 HydrophobicContact CD2-CD1 4Å; L449-L452 WeakPolarHBondContact O-CB 3.47Å; L449-L452 PolarHBondContact O-N 3.41Å; L449-L452 VanDerWaalsContact O-N 3.1Å; L449-C453 PolarHBondContact O-N 3.45Å; L449-C453 VanDerWaalsContact O-N 3.12Å; L449-C453 PolarHBondContact O-SG 2.77Å; L449-L520 HydrophobicContact CD1-CB 4.43Å; L449-T521 HydrophobicContact CB-CG2 4.11Å; L449-T521 WeakPolarHBondContact CB-OG1 3.45Å; L449-T524 HydrophobicContact CD1-CG2 4.21Å; L449-T524 VanDerWaalsContact CD1-OG1 3.29Å; L449-T524 WeakPolarHBondContact CD1-OG1 3.34Å
450	L	97.5	Very high	94.6	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-56.2	-43.5	171.1	-86	170.7	0	0	0	111.7	G446 A447 C453 Q454 T521 L525 M587 N590 C591 L594	G446-L450 VanDerWaalsContact O-CB 3.23Å; G446-L450 WeakPolarHBondContact O-CB 3.26Å; G446-L450 WeakPolarHBondContact O-CG 3.33Å; G446-L450 PolarHBondContact O-N 3.4Å; A447-L450 WeakPolarHBondContact O-CB 3.39Å; L450-C453 PolarHBondContact O-N 2.83Å; L450-Q454 WeakPolarHBondContact O-CG 3.43Å; L450-Q454 PolarHBondContact O-N 2.66Å; L450-Q454 PolarHBondContact O-NE2 2.72Å; L450-T521 HydrophobicContact CD2-CG2 4.13Å; L450-T521 HydrophobicContact CG-CG2 4.14Å; L450-L525 HydrophobicContact CD1-CD2 4.07Å; L450-L525 HydrophobicContact CD2-CD1 4.2Å; L450-L525 HydrophobicContact CG-CD2 4.41Å; L450-M587 HydrophobicContact CD1-CG 4.2Å; L450-N590 HydrophobicContact CB-CB 4.38Å; L450-C591 HydrophobicContact CD1-CB 4.03Å; L450-C591 HydrophobicContact CD2-CB 4.32Å; L450-L594 HydrophobicContact CD2-CB 3.93Å; L450-L594 HydrophobicContact CD2-CD2 3.46Å; L450-L594 VanDerWaalsContact CD2-CD2 3.46Å; L450-L594 HydrophobicContact CD2-CG 4.32Å
451	K	97	Very high	94.4	Very high	30 Å²	30	29 Å²	29	13%	0.13	14%	0.139	C	C	.	.	H	α-helix	trans	-63.3	-38.5	175.2	-78.3	-174.1	171.2	-177.9	0	112.5	E386 Y389 A447 A448 L449 C453 Q454	E386-K451 VanDerWaalsContact CA-NZ 3.33Å; E386-K451 IonicContact OE2-NZ 3.56Å; E386-K451 PolarHBondContact OE2-NZ 3.37Å; Y389-K451 HydrophobicContact CD1-CD 4.25Å; Y389-K451 HydrophobicContact CD2-CB 3.42Å; Y389-K451 VanDerWaalsContact CD2-CB 3.42Å; Y389-K451 HydrophobicContact CD2-CD 4.47Å; Y389-K451 HydrophobicContact CE2-CB 3.92Å; Y389-K451 HydrophobicContact CG-CB 3.77Å; Y389-K451 HydrophobicContact CG-CD 3.94Å; A447-K451 PolarHBondContact O-N 3.41Å; A448-K451 WeakPolarHBondContact O-CB 3.4Å; A448-K451 PolarHBondContact O-N 3.27Å; L449-K451 VanDerWaalsContact C-N 3.3Å; L449-K451 PolarHBondContact O-N 3.17Å; K451-C453 PolarHBondContact O-N 2.94Å; K451-Q454 PolarHBondContact O-N 3.49Å
452	L	96.5	Very high	94.2	Very high	20 Å²	20	31.5 Å²	31.5	11%	0.105	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-26	174.6	-70.6	169.8	0	0	0	113	Y389 L392 K393 L396 A448 L449 P455	Y389-L452 HydrophobicContact CD2-CD2 3.95Å; Y389-L452 HydrophobicContact CD2-CG 3.96Å; Y389-L452 HydrophobicContact CE2-CD2 3.67Å; Y389-L452 HydrophobicContact CE2-CG 4.05Å; L392-L452 HydrophobicContact CB-CD1 4.3Å; K393-L452 HydrophobicContact CB-CD2 4.17Å; L396-L452 HydrophobicContact CD1-CD1 3.78Å; L396-L452 HydrophobicContact CD1-CD2 4.22Å; A448-L452 PolarHBondContact O-N 2.86Å; L449-L452 HydrophobicContact CD2-CD1 4Å; L449-L452 WeakPolarHBondContact O-CB 3.47Å; L449-L452 PolarHBondContact O-N 3.41Å; L449-L452 VanDerWaalsContact O-N 3.1Å; L452-P455 WeakPolarHBondContact O-CD 3.21Å
453	C	96.7	Very high	94	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-82.8	-23.8	177.5	-66.1	0	0	0	0	114.2	L449 L450 K451 P455 F456 C457 T521 L594	L449-C453 PolarHBondContact O-N 3.45Å; L449-C453 VanDerWaalsContact O-N 3.12Å; L449-C453 PolarHBondContact O-SG 2.77Å; L450-C453 PolarHBondContact O-N 2.83Å; K451-C453 PolarHBondContact O-N 2.94Å; C453-P455 VanDerWaalsContact C-N 3.29Å; C453-P455 WeakPolarHBondContact O-CD 3.23Å; C453-F456 VanDerWaalsContact CA-CZ 3.48Å; C453-F456 HydrophobicContact CB-CE1 4.23Å; C453-F456 HydrophobicContact CB-CE2 3.81Å; C453-F456 HydrophobicContact CB-CZ 3.55Å; C453-F456 WeakPolarHBondContact O-CD1 3.38Å; C453-F456 WeakPolarHBondContact O-CD2 3.41Å; C453-F456 WeakPolarHBondContact O-CG 3.49Å; C453-F456 PolarHBondContact O-N 3.42Å; C453-F456 VanDerWaalsContact SG-CZ 3.5Å; C453-C457 VanDerWaalsContact C-SG 3.54Å; C453-C457 PolarHBondContact O-N 3.22Å; C453-C457 PolarHBondContact O-SG 3.22Å; C453-T521 PolarHBondContact SG-OG1 3.32Å; C453-L594 HydrophobicContact CB-CD1 4.31Å
454	Q	95.6	Very high	93.9	Very high	37 Å²	37	38.7 Å²	38.7	17%	0.173	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-35.2	-175.3	-62.9	-51.8	-58.9	0	0	115.8	L450 K451 F456 C457 N590 N593	L450-Q454 WeakPolarHBondContact O-CG 3.43Å; L450-Q454 PolarHBondContact O-N 2.66Å; L450-Q454 PolarHBondContact O-NE2 2.72Å; K451-Q454 PolarHBondContact O-N 3.49Å; Q454-F456 PolarHBondContact O-N 3Å; Q454-C457 PolarHBondContact O-N 3.03Å; Q454-N590 HydrophobicContact CG-CB 4.47Å; Q454-N590 PolarHBondContact NE2-O 3.18Å; Q454-N590 PolarHBondContact OE1-OD1 3.28Å; Q454-N593 PolarHBondContact OE1-ND2 3.41Å; Q454-N593 VanDerWaalsContact OE1-ND2 3.14Å
455	P	94.2	Very high	93.7	Very high	77 Å²	77	39.5 Å²	39.5	50%	0.5	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22	177.4	-26.9	36.6	0	0	0	115.1	L452 C453	L452-P455 WeakPolarHBondContact O-CD 3.21Å; C453-P455 VanDerWaalsContact C-N 3.29Å; C453-P455 WeakPolarHBondContact O-CD 3.23Å
456	F	94	Very high	93.5	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.035	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-4.2	178.2	58.3	-102.5	0	0	0	114.5	C453 Q454 K458 S461 R463 L464 V514 N517 L518	C453-F456 VanDerWaalsContact CA-CZ 3.48Å; C453-F456 HydrophobicContact CB-CE1 4.23Å; C453-F456 HydrophobicContact CB-CE2 3.81Å; C453-F456 HydrophobicContact CB-CZ 3.55Å; C453-F456 WeakPolarHBondContact O-CD1 3.38Å; C453-F456 WeakPolarHBondContact O-CD2 3.41Å; C453-F456 WeakPolarHBondContact O-CG 3.49Å; C453-F456 PolarHBondContact O-N 3.42Å; C453-F456 VanDerWaalsContact SG-CZ 3.5Å; Q454-F456 PolarHBondContact O-N 3Å; F456-K458 PolarHBondContact O-N 3.19Å; F456-S461 WeakPolarHBondContact O-CB 3.38Å; F456-S461 PolarHBondContact O-OG 3.33Å; F456-R463 HydrophobicContact CB-CB 3.92Å; F456-L464 HydrophobicContact CD2-CD1 4.08Å; F456-V514 HydrophobicContact CD1-CG1 4.09Å; F456-V514 HydrophobicContact CD1-CG2 4.2Å; F456-V514 HydrophobicContact CD2-CG1 4.23Å; F456-V514 HydrophobicContact CE1-CG1 4.07Å; F456-V514 HydrophobicContact CE1-CG2 4.4Å; F456-V514 HydrophobicContact CE2-CG1 4.23Å; F456-V514 HydrophobicContact CG-CG1 4.15Å; F456-V514 HydrophobicContact CZ-CG1 4.13Å; F456-N517 HydrophobicContact CZ-CB 4.45Å; F456-L518 HydrophobicContact CE2-CD1 4.38Å
457	C	94.3	Very high	93.4	Very high	7 Å²	7	42.1 Å²	42.1	5%	0.047	20%	0.202	C	C	.	.			trans	-76.8	65.9	175	-63.6	0	0	0	0	112.3	C453 Q454 N593 L594 S597	C453-C457 VanDerWaalsContact C-SG 3.54Å; C453-C457 PolarHBondContact O-N 3.22Å; C453-C457 PolarHBondContact O-SG 3.22Å; Q454-C457 PolarHBondContact O-N 3.03Å; C457-N593 HydrophobicContact CB-CB 4.07Å; C457-L594 VanDerWaalsContact SG-CD1 3.59Å; C457-S597 WeakPolarHBondContact CA-OG 3.43Å
458	K	88	Confident	93.2	Very high	136 Å²	136	44.3 Å²	44.3	59%	0.591	21%	0.213	S	C	*	.	S	Bend	trans	-133.6	141	173.6	-59.4	-178.8	-177.4	-179	0	109	F456 R460 S461 S597	F456-K458 PolarHBondContact O-N 3.19Å; K458-R460 PolarHBondContact O-N 3.09Å; K458-S461 WeakPolarHBondContact O-CB 3.48Å; K458-S461 PolarHBondContact O-N 2.94Å; K458-S597 PolarHBondContact N-OG 2.68Å
459	P	78.3	Confident	93	Very high	44 Å²	44	44.7 Å²	44.7	29%	0.286	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.8	-174.3	-28.1	34.1	0	0	0	115.8	V596 V600 H663	P459-V596 HydrophobicContact CG-CG1 4.31Å; P459-V600 HydrophobicContact CB-CG2 4.22Å; P459-V600 WeakPolarHBondContact O-CG1 3.48Å; P459-H663 WeakPolarHBondContact CB-NE2 3.15Å
460	R	83.4	Confident	92.9	Very high	212 Å²	212	45.2 Å²	45.2	80%	0.8	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.9	27.6	178	-62.4	-173.9	178.7	-169.1	-2.1	113.3	K458 S462	K458-R460 PolarHBondContact O-N 3.09Å; R460-S462 PolarHBondContact O-N 3.49Å
461	S	90.1	Very high	92.8	Very high	17 Å²	17	45.3 Å²	45.3	12%	0.119	22%	0.219	C	C	.	.			trans	-74.2	112.8	-179.5	179.2	0	0	0	0	111.5	F456 K458 R463 L464	F456-S461 WeakPolarHBondContact O-CB 3.38Å; F456-S461 PolarHBondContact O-OG 3.33Å; K458-S461 WeakPolarHBondContact O-CB 3.48Å; K458-S461 PolarHBondContact O-N 2.94Å; S461-R463 PolarHBondContact O-N 2.84Å; S461-L464 WeakPolarHBondContact O-CB 3.38Å; S461-L464 PolarHBondContact O-N 2.98Å; S461-L464 PolarHBondContact OG-N 2.97Å
462	S	91.4	Very high	92.6	Very high	54 Å²	54	44 Å²	44	38%	0.378	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.7	172.1	55.9	0	0	0	0	112.8	R460 L464 L465 S612	R460-S462 PolarHBondContact O-N 3.49Å; S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L465 PolarHBondContact O-N 3.33Å; S462-S612 VanDerWaalsContact CA-O 3.26Å; S462-S612 WeakPolarHBondContact CA-O 3.31Å; S462-S612 WeakPolarHBondContact CB-O 3.31Å
463	R	93.1	Very high	92.5	Very high	157 Å²	157	44.2 Å²	44.2	59%	0.592	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-37.7	176.3	-68.3	-175.7	179.9	-178.4	-0.5	111.8	F456 S461 L465 T466	F456-R463 HydrophobicContact CB-CB 3.92Å; S461-R463 PolarHBondContact O-N 2.84Å; R463-L465 VanDerWaalsContact C-N 3.3Å; R463-L465 PolarHBondContact O-N 3.41Å; R463-T466 WeakPolarHBondContact O-CB 3.29Å; R463-T466 PolarHBondContact O-N 3.13Å; R463-T466 VanDerWaalsContact O-N 3.13Å; R463-T466 PolarHBondContact O-OG1 3.06Å
464	L	94.1	Very high	92.3	Very high	1 Å²	1	45 Å²	45	1%	0.005	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-61.9	-40.6	178.4	179.3	69.5	0	0	0	111.5	F456 S461 S462 T466 F467 L518 S597 L601	F456-L464 HydrophobicContact CD2-CD1 4.08Å; S461-L464 WeakPolarHBondContact O-CB 3.38Å; S461-L464 PolarHBondContact O-N 2.98Å; S461-L464 PolarHBondContact OG-N 2.97Å; S462-L464 VanDerWaalsContact C-N 3.34Å; L464-T466 PolarHBondContact O-N 2.78Å; L464-T466 VanDerWaalsContact O-N 3.12Å; L464-F467 VanDerWaalsContact O-CB 3.27Å; L464-F467 WeakPolarHBondContact O-CB 3.49Å; L464-F467 PolarHBondContact O-N 2.66Å; L464-L518 HydrophobicContact CD1-CD2 4.43Å; L464-S597 WeakPolarHBondContact CD2-O 3.43Å; L464-L601 HydrophobicContact CD1-CD2 4.22Å; L464-L601 HydrophobicContact CD2-CB 4.21Å; L464-L601 HydrophobicContact CG-CB 4.29Å
465	L	94.1	Very high	92	Very high	21 Å²	21	51 Å²	51	11%	0.11	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-70.7	-2.7	178.5	-58	-179.8	0	0	0	113.7	S462 R463 L601 Q604 Q613 P614	S462-L465 PolarHBondContact O-N 3.33Å; R463-L465 VanDerWaalsContact C-N 3.3Å; R463-L465 PolarHBondContact O-N 3.41Å; L465-L601 HydrophobicContact CD2-CD1 4.14Å; L465-Q604 HydrophobicContact CD2-CB 3.9Å; L465-Q604 HydrophobicContact CD2-CG 3.85Å; L465-Q613 VanDerWaalsContact CD1-C 3.41Å; L465-P614 HydrophobicContact CD1-CB 4.19Å
466	T	94.3	Very high	91.6	Very high	47 Å²	47	52.7 Å²	52.7	29%	0.288	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-83.4	-1.1	168.6	72.1	0	0	0	0	112.9	R463 L464 N468 N512	R463-T466 WeakPolarHBondContact O-CB 3.29Å; R463-T466 PolarHBondContact O-N 3.13Å; R463-T466 VanDerWaalsContact O-N 3.13Å; R463-T466 PolarHBondContact O-OG1 3.06Å; L464-T466 PolarHBondContact O-N 2.78Å; L464-T466 VanDerWaalsContact O-N 3.12Å; T466-N468 PolarHBondContact O-N 3.4Å; T466-N512 WeakPolarHBondContact CB-ND2 3.44Å; T466-N512 PolarHBondContact O-ND2 3.17Å; T466-N512 PolarHBondContact OG1-ND2 3.04Å
467	F	94.8	Very high	91.4	Very high	11 Å²	11	54.1 Å²	54.1	5%	0.048	26%	0.257	C	S	.	.			trans	-60	127.7	171.8	174.7	-103.7	0	0	0	110.5	L464 P469 T515 L518 L601 F635	L464-F467 VanDerWaalsContact O-CB 3.27Å; L464-F467 WeakPolarHBondContact O-CB 3.49Å; L464-F467 PolarHBondContact O-N 2.66Å; F467-P469 HydrophobicContact CE1-CB 3.81Å; F467-P469 HydrophobicContact CZ-CB 4.47Å; F467-T515 HydrophobicContact CD2-CG2 3.87Å; F467-T515 HydrophobicContact CE2-CG2 3.9Å; F467-L518 HydrophobicContact CB-CD2 4.37Å; F467-L518 HydrophobicContact CD2-CB 4.34Å; F467-L518 HydrophobicContact CD2-CD2 3.56Å; F467-L518 HydrophobicContact CD2-CG 4.41Å; F467-L518 HydrophobicContact CE2-CD2 3.93Å; F467-L518 HydrophobicContact CE2-CG 4.49Å; F467-L518 HydrophobicContact CG-CD2 3.95Å; F467-L601 HydrophobicContact CB-CD1 4.24Å; F467-L601 HydrophobicContact CB-CD2 3.96Å; F467-L601 HydrophobicContact CD1-CD1 4.42Å; F467-L601 HydrophobicContact CD1-CD2 3.68Å; F467-L601 HydrophobicContact CD1-CG 4.42Å; F467-L601 HydrophobicContact CE1-CD2 4.36Å; F467-L601 HydrophobicContact CG-CD2 3.88Å; F467-F635 HydrophobicContact CZ-CE1 4Å; F467-F635 HydrophobicContact CZ-CZ 4.21Å
468	N	94.5	Very high	91.2	Very high	48 Å²	48	57.9 Å²	57.9	26%	0.257	28%	0.277	S	S	.	.			trans	-110.2	110.1	175.6	-171.4	-21.3	0	0	0	110.9	T466 T470 Y471 Y511 T515	T466-N468 PolarHBondContact O-N 3.4Å; N468-T470 PolarHBondContact O-N 3.27Å; N468-T470 PolarHBondContact OD1-N 2.94Å; N468-T470 PolarHBondContact OD1-OG1 3.43Å; N468-Y471 VanDerWaalsContact O-CB 3.27Å; N468-Y471 WeakPolarHBondContact O-CB 3.49Å; N468-Y471 PolarHBondContact O-N 3.43Å; N468-Y511 HydrophobicContact CB-CD1 4.08Å; N468-Y511 HydrophobicContact CB-CE1 3.93Å; N468-T515 PolarHBondContact N-OG1 2.94Å
469	P	94.2	Very high	91.1	Very high	8 Å²	8	56.3 Å²	56.3	5%	0.052	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-67.3	-19.1	-176.7	28.1	-34.7	0	0	0	113.4	F467 Y471 C472 L605 Y630 V631	F467-P469 HydrophobicContact CE1-CB 3.81Å; F467-P469 HydrophobicContact CZ-CB 4.47Å; P469-Y471 PolarHBondContact O-N 3.17Å; P469-C472 PolarHBondContact O-N 3.44Å; P469-L605 HydrophobicContact CG-CD2 4.49Å; P469-Y630 WeakPolarHBondContact O-CB 3.33Å; P469-V631 HydrophobicContact CB-CG2 3.75Å
470	T	94.6	Very high	91.6	Very high	12 Å²	12	60.4 Å²	60.4	7%	0.074	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-62	-15.7	175.9	67.7	0	0	0	0	112.7	N468 C472 A473 P505 F507 Y511 Y630	N468-T470 PolarHBondContact O-N 3.27Å; N468-T470 PolarHBondContact OD1-N 2.94Å; N468-T470 PolarHBondContact OD1-OG1 3.43Å; T470-C472 PolarHBondContact O-N 2.9Å; T470-A473 PolarHBondContact O-N 2.85Å; T470-A473 VanDerWaalsContact O-N 3.13Å; T470-P505 HydrophobicContact CG2-CB 3.81Å; T470-F507 WeakPolarHBondContact O-CE1 3.48Å; T470-Y511 PolarHBondContact O-OH 2.98Å; T470-Y511 PolarHBondContact OG1-OH 3.42Å; T470-Y630 HydrophobicContact CG2-CD2 4.03Å; T470-Y630 HydrophobicContact CG2-CE2 4.36Å; T470-Y630 HydrophobicContact CG2-CG 4.49Å
471	Y	95.3	Very high	91.9	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.016	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-53.7	-40.7	170.7	-176.8	-96.2	0	0	0	112.4	N468 P469 A473 L474 V487 H488 M489 L492 Y511 T515 E516 A519	N468-Y471 VanDerWaalsContact O-CB 3.27Å; N468-Y471 WeakPolarHBondContact O-CB 3.49Å; N468-Y471 PolarHBondContact O-N 3.43Å; P469-Y471 PolarHBondContact O-N 3.17Å; Y471-A473 VanDerWaalsContact C-N 3.26Å; Y471-A473 PolarHBondContact O-N 2.8Å; Y471-L474 PolarHBondContact O-N 2.87Å; Y471-V487 HydrophobicContact CD2-CG1 4.43Å; Y471-V487 HydrophobicContact CD2-CG2 4.19Å; Y471-V487 HydrophobicContact CE2-CB 4.05Å; Y471-V487 HydrophobicContact CE2-CG1 3.8Å; Y471-V487 HydrophobicContact CE2-CG2 3.88Å; Y471-H488 PolarHBondContact OH-N 3.26Å; Y471-M489 HydrophobicContact CE1-CB 3.69Å; Y471-M489 HydrophobicContact CE1-CG 3.85Å; Y471-M489 WeakPolarHBondContact OH-CB 3.4Å; Y471-M489 PolarHBondContact OH-N 2.98Å; Y471-M489 VanDerWaalsContact OH-N 3.08Å; Y471-L492 HydrophobicContact CD1-CD1 4.32Å; Y471-L492 HydrophobicContact CE1-CD1 4.2Å; Y471-Y511 AromaticContact CD2-CD1 3.83Å; Y471-Y511 HydrophobicContact CD2-CD1 3.83Å; Y471-Y511 HydrophobicContact CD2-CD2 4.03Å; Y471-Y511 HydrophobicContact CD2-CE1 4.19Å; Y471-Y511 HydrophobicContact CD2-CE2 4.41Å; Y471-Y511 AromaticContact CD2-CG 3.71Å; Y471-Y511 HydrophobicContact CD2-CG 3.71Å; Y471-Y511 HydrophobicContact CE2-CG 4.48Å; Y471-Y511 HydrophobicContact CG-CD1 4.35Å; Y471-Y511 HydrophobicContact CG-CE1 4.44Å; Y471-Y511 PolarHBondContact N-OH 3.34Å; Y471-T515 HydrophobicContact CD1-CG2 4.3Å; Y471-T515 HydrophobicContact CD2-CG2 4.04Å; Y471-T515 HydrophobicContact CG-CG2 3.73Å; Y471-E516 HydrophobicContact CE2-CG 3.9Å; Y471-A519 HydrophobicContact CD1-CB 3.95Å; Y471-A519 HydrophobicContact CE1-CB 3.74Å
472	C	94.3	Very high	91.8	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.014	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-75.2	-15	-178.8	-61	0	0	0	0	113.2	P469 T470 L492 D493 Y630 P632	P469-C472 PolarHBondContact O-N 3.44Å; T470-C472 PolarHBondContact O-N 2.9Å; C472-L492 HydrophobicContact CB-CB 4.28Å; C472-L492 HydrophobicContact CB-CD1 4.42Å; C472-L492 CarbonylContact O-C 3.55Å; C472-D493 WeakPolarHBondContact O-CA 3.21Å; C472-D493 PolarHBondContact O-N 3.03Å; C472-Y630 WeakPolarHBondContact CB-O 3.42Å; C472-P632 HydrophobicContact CB-CG 3.84Å
473	A	93.5	Very high	91.8	Very high	26 Å²	26	55.1 Å²	55.1	22%	0.215	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-94.2	-1.6	179.2	0	0	0	0	0	113.4	T470 Y471 K475 P505 F507 Y630	T470-A473 PolarHBondContact O-N 2.85Å; T470-A473 VanDerWaalsContact O-N 3.13Å; Y471-A473 VanDerWaalsContact C-N 3.26Å; Y471-A473 PolarHBondContact O-N 2.8Å; A473-K475 PolarHBondContact O-N 3.1Å; A473-P505 HydrophobicContact CB-CG 4.3Å; A473-F507 HydrophobicContact CB-CE1 4.34Å; A473-Y630 HydrophobicContact CB-CD1 3.66Å; A473-Y630 HydrophobicContact CB-CE1 4.42Å; A473-Y630 HydrophobicContact CB-CG 4.27Å
474	L	91.9	Very high	91.7	Very high	17 Å²	17	53.3 Å²	53.3	9%	0.089	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-70.8	127.4	178.2	-74.7	170.1	0	0	0	110.9	Y471 V487 F507 Y511	Y471-L474 PolarHBondContact O-N 2.87Å; L474-V487 HydrophobicContact CD1-CB 4.28Å; L474-V487 HydrophobicContact CD1-CG1 3.77Å; L474-V487 HydrophobicContact CD1-CG2 3.53Å; L474-F507 HydrophobicContact CD2-CD1 3.53Å; L474-F507 HydrophobicContact CD2-CD2 4.39Å; L474-F507 HydrophobicContact CD2-CE1 3.56Å; L474-F507 HydrophobicContact CD2-CE2 4.43Å; L474-F507 HydrophobicContact CD2-CG 3.93Å; L474-F507 HydrophobicContact CD2-CZ 4.01Å; L474-F507 HydrophobicContact CG-CD1 4.07Å; L474-F507 HydrophobicContact CG-CE1 3.91Å; L474-Y511 HydrophobicContact CD1-CD2 4.4Å; L474-Y511 HydrophobicContact CD1-CE2 3.6Å
475	K	89.9	Confident	91.6	Very high	162 Å²	162	56.2 Å²	56.2	70%	0.704	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-70.3	171.5	170	-63.7	-178.8	-179.7	175.1	0	110.7	A473 L477	A473-K475 PolarHBondContact O-N 3.1Å; K475-L477 PolarHBondContact O-N 3.3Å
476	E	86.4	Confident	91.6	Very high	113 Å²	113	57.3 Å²	57.3	53%	0.528	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-53.8	128.5	176.2	-69.2	-166.5	134.1	0	0	112	R490	E476-R490 IonicContact OE1-CZ 2.68Å; E476-R490 IonicContact OE1-NE 3.92Å; E476-R490 IonicContact OE1-NH2 3.54Å; E476-R490 PolarHBondContact OE1-NH2 2.78Å
477	L	89.2	Confident	91.6	Very high	37 Å²	37	55.4 Å²	55.4	19%	0.194	27%	0.273	C	S	.	.			trans	-110.8	151.9	177.8	-62.6	177.6	0	0	0	109	K475 E481 R482 K485 V487	K475-L477 PolarHBondContact O-N 3.3Å; L477-E481 HydrophobicContact CB-CB 4.07Å; L477-R482 HydrophobicContact CB-CG 3.68Å; L477-R482 HydrophobicContact CD1-CG 4.47Å; L477-K485 HydrophobicContact CD1-CD 4.09Å; L477-V487 HydrophobicContact CD1-CB 3.99Å; L477-V487 HydrophobicContact CD1-CG1 4.09Å; L477-V487 HydrophobicContact CD1-CG2 4.3Å
478	N	89.8	Confident	91.6	Very high	87 Å²	87	55 Å²	55	47%	0.465	27%	0.271	S	S	.	.			trans	-74.3	164.8	169.3	67.1	55.1	0	0	0	111.2	E480 E481 R482	N478-E480 VanDerWaalsContact C-N 3.33Å; N478-E480 PolarHBondContact O-N 3.13Å; N478-E480 PolarHBondContact OD1-N 2.84Å; N478-E481 PolarHBondContact N-OE2 3.17Å; N478-E481 PolarHBondContact ND2-OE2 3.48Å; N478-E481 PolarHBondContact O-N 3.27Å; N478-E481 WeakPolarHBondContact OD1-CB 3.4Å; N478-E481 WeakPolarHBondContact OD1-CG 3.44Å; N478-E481 PolarHBondContact OD1-N 3.44Å; N478-R482 VanDerWaalsContact O-CG 3.27Å; N478-R482 WeakPolarHBondContact O-CG 3.3Å; N478-R482 PolarHBondContact O-N 3.26Å
479	D	85.8	Confident	91.6	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-63.1	-35.3	-172	-70.3	-28.7	0	0	0	113.9	R482 K483	D479-R482 PolarHBondContact O-N 2.67Å; D479-R482 IonicContact OD1-NH1 3.95Å; D479-R482 PolarHBondContact OD1-NH1 3.03Å; D479-K483 PolarHBondContact O-N 3.13Å
480	E	88.7	Confident	91.5	Very high	129 Å²	129	56.7 Å²	56.7	60%	0.603	27%	0.274	S	S	*	.	H	α-helix	trans	-65.5	-43.9	175.2	-69.3	-59.4	142.4	0	0	111.6	N478 R482 K483 I484	N478-E480 VanDerWaalsContact C-N 3.33Å; N478-E480 PolarHBondContact O-N 3.13Å; N478-E480 PolarHBondContact OD1-N 2.84Å; E480-R482 VanDerWaalsContact C-N 3.33Å; E480-R482 PolarHBondContact O-N 3.2Å; E480-K483 PolarHBondContact O-N 3.45Å; E480-I484 VanDerWaalsContact O-CG1 3.3Å; E480-I484 WeakPolarHBondContact O-CG1 3.43Å; E480-I484 PolarHBondContact O-N 3.32Å
481	E	89.6	Confident	91.3	Very high	75 Å²	75	56.5 Å²	56.5	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-39	175.3	-73.9	175.8	155.1	0	0	112	L477 N478 K483 I484 K485	L477-E481 HydrophobicContact CB-CB 4.07Å; N478-E481 PolarHBondContact N-OE2 3.17Å; N478-E481 PolarHBondContact ND2-OE2 3.48Å; N478-E481 PolarHBondContact O-N 3.27Å; N478-E481 WeakPolarHBondContact OD1-CB 3.4Å; N478-E481 WeakPolarHBondContact OD1-CG 3.44Å; N478-E481 PolarHBondContact OD1-N 3.44Å; E481-K483 VanDerWaalsContact C-N 3.32Å; E481-I484 PolarHBondContact O-N 3.5Å; E481-K485 VanDerWaalsContact O-CB 3.27Å; E481-K485 WeakPolarHBondContact O-CB 3.38Å; E481-K485 WeakPolarHBondContact O-CG 3.48Å; E481-K485 PolarHBondContact O-N 3.02Å
482	R	89.1	Confident	91.2	Very high	7 Å²	7	56.7 Å²	56.7	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-42.6	176.5	-70.6	174.2	81.9	-169.2	7.2	111.2	N412 L477 N478 D479 E480 N486 V487 H488 R490	N412-R482 PolarHBondContact OD1-NH1 3.17Å; N412-R482 PolarHBondContact OD1-NH2 3.14Å; L477-R482 HydrophobicContact CB-CG 3.68Å; L477-R482 HydrophobicContact CD1-CG 4.47Å; N478-R482 VanDerWaalsContact O-CG 3.27Å; N478-R482 WeakPolarHBondContact O-CG 3.3Å; N478-R482 PolarHBondContact O-N 3.26Å; D479-R482 PolarHBondContact O-N 2.67Å; D479-R482 IonicContact OD1-NH1 3.95Å; D479-R482 PolarHBondContact OD1-NH1 3.03Å; E480-R482 VanDerWaalsContact C-N 3.33Å; E480-R482 PolarHBondContact O-N 3.2Å; R482-N486 WeakPolarHBondContact O-CA 3.4Å; R482-N486 PolarHBondContact O-N 3.36Å; R482-V487 WeakPolarHBondContact CB-O 3.32Å; R482-V487 WeakPolarHBondContact CG-O 3.28Å; R482-V487 PolarHBondContact NE-O 3.28Å; R482-V487 PolarHBondContact O-N 3.22Å; R482-H488 PolarHBondContact NH2-O 3.47Å; R482-R490 VanDerWaalsContact NH2-CG 3.35Å
483	K	90.1	Very high	91	Very high	90 Å²	90	59.4 Å²	59.4	39%	0.391	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-45.9	176.1	-169.6	175.5	-179.6	179.8	0	112	D479 E480 E481	D479-K483 PolarHBondContact O-N 3.13Å; E480-K483 PolarHBondContact O-N 3.45Å; E481-K483 VanDerWaalsContact C-N 3.32Å
484	I	91.1	Very high	90.9	Very high	120 Å²	120	65.2 Å²	65.2	62%	0.615	31%	0.31	S	S	*	.	H	α-helix	trans	-68.1	-43	-179	-67.7	165.7	0	0	0	111.6	E480 E481	E480-I484 VanDerWaalsContact O-CG1 3.3Å; E480-I484 WeakPolarHBondContact O-CG1 3.43Å; E480-I484 PolarHBondContact O-N 3.32Å; E481-I484 PolarHBondContact O-N 3.5Å
485	K	92.1	Very high	91	Very high	62 Å²	62	66.9 Å²	66.9	27%	0.27	32%	0.318	S	S	.	.	H	α-helix	trans	-85.2	-8.8	-175.9	-64.8	-173.5	174.9	175.2	0	113.9	L477 E481 V487 N510 Y511	L477-K485 HydrophobicContact CD1-CD 4.09Å; E481-K485 VanDerWaalsContact O-CB 3.27Å; E481-K485 WeakPolarHBondContact O-CB 3.38Å; E481-K485 WeakPolarHBondContact O-CG 3.48Å; E481-K485 PolarHBondContact O-N 3.02Å; K485-V487 HydrophobicContact CB-CG2 3.82Å; K485-N510 CarbonylContact O-C 3.57Å; K485-N510 WeakPolarHBondContact O-CA 3.44Å; K485-Y511 PolarHBondContact O-N 3.16Å
486	N	93.6	Very high	91.1	Very high	44 Å²	44	63.3 Å²	63.3	24%	0.235	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	60.6	-169.6	-64.1	-36.8	0	0	0	111.7	R482 Y511 E516	R482-N486 WeakPolarHBondContact O-CA 3.4Å; R482-N486 PolarHBondContact O-N 3.36Å; N486-Y511 WeakPolarHBondContact CB-O 3.31Å; N486-Y511 PolarHBondContact ND2-O 2.79Å; N486-Y511 VanDerWaalsContact ND2-O 3.09Å; N486-E516 WeakPolarHBondContact CB-OE1 3.31Å; N486-E516 VanDerWaalsContact O-OE1 3.11Å
487	V	94.3	Very high	91.5	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.036	30%	0.295	C	S	.	.			trans	-133.7	101.4	-177.7	-178.2	0	0	0	0	110.2	Y471 L474 L477 R482 K485 Y511	Y471-V487 HydrophobicContact CD2-CG1 4.43Å; Y471-V487 HydrophobicContact CD2-CG2 4.19Å; Y471-V487 HydrophobicContact CE2-CB 4.05Å; Y471-V487 HydrophobicContact CE2-CG1 3.8Å; Y471-V487 HydrophobicContact CE2-CG2 3.88Å; L474-V487 HydrophobicContact CD1-CB 4.28Å; L474-V487 HydrophobicContact CD1-CG1 3.77Å; L474-V487 HydrophobicContact CD1-CG2 3.53Å; L477-V487 HydrophobicContact CD1-CB 3.99Å; L477-V487 HydrophobicContact CD1-CG1 4.09Å; L477-V487 HydrophobicContact CD1-CG2 4.3Å; R482-V487 WeakPolarHBondContact CB-O 3.32Å; R482-V487 WeakPolarHBondContact CG-O 3.28Å; R482-V487 PolarHBondContact NE-O 3.28Å; R482-V487 PolarHBondContact O-N 3.22Å; K485-V487 HydrophobicContact CB-CG2 3.82Å; V487-Y511 HydrophobicContact CG2-CD2 3.67Å; V487-Y511 HydrophobicContact CG2-CE2 4.06Å
488	H	95.3	Very high	91.9	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.009	29%	0.286	C	S	.	.			trans	-109.9	-17	-176.8	-54.4	89.7	0	0	0	113.2	H404 L407 S408 G411 Y471 R482 E516	H404-H488 AromaticContact CE1-CD2 3.93Å; H404-H488 AromaticContact CE1-NE2 3.57Å; H404-H488 AromaticContact CG-NE2 3.84Å; H404-H488 AromaticContact ND1-CD2 3.57Å; H404-H488 AromaticContact ND1-CE1 3.97Å; H404-H488 AromaticContact ND1-NE2 2.82Å; H404-H488 PolarHBondContact ND1-NE2 3.28Å; L407-H488 HydrophobicContact CB-CB 3.83Å; L407-H488 VanDerWaalsContact CB-CG 3.42Å; L407-H488 WeakPolarHBondContact CB-ND1 3.36Å; L407-H488 WeakPolarHBondContact O-CB 3.39Å; S408-H488 PolarHBondContact OG-CD2 2.67Å; G411-H488 WeakPolarHBondContact CA-O 3.47Å; Y471-H488 PolarHBondContact OH-N 3.26Å; R482-H488 PolarHBondContact NH2-O 3.47Å; H488-E516 IonicContact CE1-OE1 2.88Å; H488-E516 IonicContact CE1-OE2 2.67Å; H488-E516 IonicContact CG-OE2 3.42Å; H488-E516 IonicContact ND1-OE1 2.73Å; H488-E516 IonicContact ND1-OE2 2.63Å; H488-E516 PolarHBondContact ND1-OE2 3.22Å
489	M	94.3	Very high	92.1	Very high	13 Å²	13	54.3 Å²	54.3	6%	0.064	27%	0.267	C	S	.	.			trans	-70.7	149.7	172.2	-74.7	-65.4	-76.3	0	0	112	L414 Y471 L492 A519 L520 Y523	L414-M489 HydrophobicContact CD1-CE 3.97Å; L414-M489 HydrophobicContact CD1-SD 3.78Å; Y471-M489 HydrophobicContact CE1-CB 3.69Å; Y471-M489 HydrophobicContact CE1-CG 3.85Å; Y471-M489 WeakPolarHBondContact OH-CB 3.4Å; Y471-M489 PolarHBondContact OH-N 2.98Å; Y471-M489 VanDerWaalsContact OH-N 3.08Å; M489-L492 HydrophobicContact CB-CD1 3.75Å; M489-L492 HydrophobicContact CB-CG 4.32Å; M489-L492 HydrophobicContact CE-CD1 4.02Å; M489-L492 HydrophobicContact CE-CD2 3.89Å; M489-L492 HydrophobicContact CE-CG 4.12Å; M489-L492 HydrophobicContact CG-CD1 4.2Å; M489-A519 HydrophobicContact CG-CB 4.42Å; M489-L520 HydrophobicContact CG-CD2 4.06Å; M489-L520 HydrophobicContact CG-CG 4.11Å; M489-L520 HydrophobicContact SD-CD2 3.35Å; M489-L520 WeakPolarHBondContact SD-CD2 3.29Å; M489-L520 HydrophobicContact SD-CG 3.94Å; M489-Y523 HydrophobicContact CE-CD1 3.6Å; M489-Y523 HydrophobicContact CE-CE1 4.39Å; M489-Y523 HydrophobicContact CE-CG 3.83Å
490	R	91.8	Very high	92.4	Very high	80 Å²	80	53.6 Å²	53.6	30%	0.302	27%	0.268	S	S	.	.			trans	-133.1	143.6	179.9	-63.6	179.3	63.9	-178.6	0.4	111.9	N412 H415 E476 R482 L492	N412-R490 VanDerWaalsContact OD1-CD 3.31Å; N412-R490 WeakPolarHBondContact OD1-CD 3.29Å; H415-R490 HydrophobicContact CB-CB 4.02Å; H415-R490 PolarHBondContact ND1-O 3.17Å; E476-R490 IonicContact OE1-CZ 2.68Å; E476-R490 IonicContact OE1-NE 3.92Å; E476-R490 IonicContact OE1-NH2 3.54Å; E476-R490 PolarHBondContact OE1-NH2 2.78Å; R482-R490 VanDerWaalsContact NH2-CG 3.35Å; R490-L492 VanDerWaalsContact C-N 3.3Å; R490-L492 PolarHBondContact O-N 3.21Å
491	G	90.7	Very high	92.2	Very high	8 Å²	8	50.5 Å²	50.5	8%	0.082	27%	0.265	C	S	.	.	S	Bend	trans	78.2	7.5	171.4	0	0	0	0	0	115.3	D493 K494	G491-D493 WeakPolarHBondContact CA-OD1 3.27Å; G491-D493 PolarHBondContact O-N 3.01Å; G491-K494 WeakPolarHBondContact O-CB 3.45Å; G491-K494 PolarHBondContact O-N 3.41Å
492	L	92.9	Very high	91.8	Very high	7 Å²	7	53.5 Å²	53.5	4%	0.037	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-65.9	-24.7	175.7	-66.3	179.9	0	0	0	112.3	Y471 C472 M489 R490 K494 E495 A519 Y523 F634	Y471-L492 HydrophobicContact CD1-CD1 4.32Å; Y471-L492 HydrophobicContact CE1-CD1 4.2Å; C472-L492 HydrophobicContact CB-CB 4.28Å; C472-L492 HydrophobicContact CB-CD1 4.42Å; C472-L492 CarbonylContact O-C 3.55Å; M489-L492 HydrophobicContact CB-CD1 3.75Å; M489-L492 HydrophobicContact CB-CG 4.32Å; M489-L492 HydrophobicContact CE-CD1 4.02Å; M489-L492 HydrophobicContact CE-CD2 3.89Å; M489-L492 HydrophobicContact CE-CG 4.12Å; M489-L492 HydrophobicContact CG-CD1 4.2Å; R490-L492 VanDerWaalsContact C-N 3.3Å; R490-L492 PolarHBondContact O-N 3.21Å; L492-K494 PolarHBondContact O-N 3.11Å; L492-E495 WeakPolarHBondContact O-CB 3.34Å; L492-E495 PolarHBondContact O-N 3.4Å; L492-E495 VanDerWaalsContact O-N 3.11Å; L492-A519 HydrophobicContact CD1-CB 4.46Å; L492-Y523 HydrophobicContact CD2-CD2 4.08Å; L492-Y523 HydrophobicContact CD2-CE2 4.24Å; L492-Y523 HydrophobicContact CD2-CG 4.34Å; L492-F634 HydrophobicContact CD2-CE1 4.21Å; L492-F634 HydrophobicContact CD2-CZ 4.18Å
493	D	91.7	Very high	91.2	Very high	60 Å²	60	60.4 Å²	60.4	32%	0.321	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-64.5	-16.1	175.5	64.8	-50	0	0	0	113.4	C472 G491	C472-D493 WeakPolarHBondContact O-CA 3.21Å; C472-D493 PolarHBondContact O-N 3.03Å; G491-D493 WeakPolarHBondContact CA-OD1 3.27Å; G491-D493 PolarHBondContact O-N 3.01Å
494	K	91.4	Very high	90.7	Very high	147 Å²	147	64.9 Å²	64.9	64%	0.639	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-91.5	-11.7	177.9	-59.2	175.4	-175.8	171.5	0	112.9	G491 L492	G491-K494 WeakPolarHBondContact O-CB 3.45Å; G491-K494 PolarHBondContact O-N 3.41Å; L492-K494 PolarHBondContact O-N 3.11Å
495	E	92.5	Very high	90.4	Very high	53 Å²	53	60.5 Å²	60.5	25%	0.248	32%	0.322	C	S	.	.	S	Bend	trans	-78	147.7	179.7	-60.6	-64.5	164.5	0	0	110.7	L492 Y523 P632 F634	L492-E495 WeakPolarHBondContact O-CB 3.34Å; L492-E495 PolarHBondContact O-N 3.4Å; L492-E495 VanDerWaalsContact O-N 3.11Å; E495-Y523 PolarHBondContact OE1-OH 3.23Å; E495-P632 HydrophobicContact CB-CB 4.15Å; E495-F634 HydrophobicContact CG-CD1 4.48Å; E495-F634 HydrophobicContact CG-CE1 4.2Å
496	T	92.9	Very high	90.1	Very high	86 Å²	86	67 Å²	67	53%	0.528	35%	0.35	S	S	.	.			trans	-69.5	138	172.8	49	0	0	0	0	109.6	P632 E633	T496-P632 CarbonylContact O-C 3.4Å; T496-P632 VanDerWaalsContact O-CA 3.29Å; T496-P632 WeakPolarHBondContact O-CA 3.49Å; T496-E633 PolarHBondContact O-N 2.82Å; T496-E633 VanDerWaalsContact OG1-CD 3.31Å; T496-E633 PolarHBondContact OG1-OE2 3.23Å
497	C	95.8	Very high	90.1	Very high	33 Å²	33	69.4 Å²	69.4	22%	0.223	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-104.6	160.8	177.6	-68.4	0	0	0	0	111.5	I499 A629 V631	C497-I499 PolarHBondContact O-N 3.5Å; C497-I499 VanDerWaalsContact O-N 3.1Å; C497-A629 VanDerWaalsContact CB-O 3.29Å; C497-A629 WeakPolarHBondContact CB-O 3.34Å; C497-V631 CarbonylContact C-O 3.6Å; C497-V631 WeakPolarHBondContact CA-O 3.43Å; C497-V631 VanDerWaalsContact CB-O 3.31Å; C497-V631 WeakPolarHBondContact CB-O 3.47Å
498	L	95.8	Very high	89.9	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.37	C	S	.	.	S	Bend	trans	-53.7	-35.9	-176.9	-66.9	177.8	0	0	0	113	L602 L628 V631 E633 A636 F671 M678 K679 L683	L498-L602 HydrophobicContact CD1-CD2 4.18Å; L498-L628 HydrophobicContact CB-CB 4.45Å; L498-L628 HydrophobicContact CD1-CD2 4.05Å; L498-V631 HydrophobicContact CD1-CB 4.03Å; L498-V631 HydrophobicContact CD1-CG1 3.82Å; L498-V631 HydrophobicContact CG-CB 4.34Å; L498-V631 HydrophobicContact CG-CG1 4.24Å; L498-V631 PolarHBondContact N-O 3.45Å; L498-E633 HydrophobicContact CD2-CG 4.45Å; L498-A636 HydrophobicContact CD2-CB 4.07Å; L498-F671 HydrophobicContact CD1-CE1 4.26Å; L498-M678 HydrophobicContact CD2-CE 3.92Å; L498-M678 HydrophobicContact CD2-CG 4.36Å; L498-M678 CarbonylContact O-C 3.59Å; L498-M678 WeakPolarHBondContact O-CA 3.39Å; L498-K679 PolarHBondContact O-N 3.42Å; L498-L683 HydrophobicContact CD2-CD2 4.01Å
499	I	95	Very high	89.7	Confident	15 Å²	15	79.3 Å²	79.3	8%	0.077	41%	0.408	C	S	.	.	S	Bend	trans	-136.7	154.5	174.1	68	176.2	0	0	0	110.1	C497 Y625 L628 A629 E676 R677	C497-I499 PolarHBondContact O-N 3.5Å; C497-I499 VanDerWaalsContact O-N 3.1Å; I499-Y625 HydrophobicContact CD1-CD2 3.79Å; I499-Y625 HydrophobicContact CD1-CE2 4.19Å; I499-L628 HydrophobicContact CD1-CB 3.96Å; I499-L628 HydrophobicContact CG1-CB 4.07Å; I499-A629 HydrophobicContact CD1-CB 4.09Å; I499-A629 HydrophobicContact CG1-CB 3.68Å; I499-A629 VanDerWaalsContact CG1-N 3.33Å; I499-A629 WeakPolarHBondContact O-CA 3.24Å; I499-E676 VanDerWaalsContact CG2-O 3.3Å; I499-E676 WeakPolarHBondContact CG2-O 3.43Å; I499-R677 WeakPolarHBondContact CG2-O 3.49Å
500	P	91.1	Very high	89.7	Confident	89 Å²	89	83.4 Å²	83.4	58%	0.578	43%	0.431	S	S	*	.			trans	-69.3	140.1	175.2	27.9	-34.2	0	0	0	111.6	V502	P500-V502 PolarHBondContact O-N 3.24Å
501	A	86.1	Confident	89.8	Confident	64 Å²	64	80 Å²	80	53%	0.529	42%	0.418	S	S	.	.			trans	-69.3	127	174.5	0	0	0	0	0	111.5	A629 Y630	A501-A629 HydrophobicContact CB-CB 4.2Å; A501-Y630 HydrophobicContact CB-CE1 4.11Å
502	V	80.1	Confident	90	Very high	137 Å²	137	82.4 Å²	82.4	83%	0.83	43%	0.428	S	S	*	.			trans	-96.9	-26.3	178.1	-173.9	0	0	0	0	111.6	P500	P500-V502 PolarHBondContact O-N 3.24Å
503	Q	77.3	Confident	90	Very high	153 Å²	153	84.7 Å²	84.7	72%	0.715	44%	0.44	S	S	*	.	S	Bend	trans	-135.9	156.1	-176.9	-63.1	-178.7	8.6	0	0	111.2	Y630	Q503-Y630 PolarHBondContact O-OH 3.27Å
504	E	79.1	Confident	90.2	Very high	183 Å²	183	83 Å²	83	86%	0.855	43%	0.432	S	S	*	.			trans	-67.3	129.9	172.7	-74.6	-164.2	158	0	0	110.8
505	P	84.8	Confident	90.4	Very high	28 Å²	28	76 Å²	76	18%	0.182	40%	0.402	C	S	.	.			trans	-67.2	145.2	178.5	23.8	-30.7	0	0	0	111.7	T470 A473 F507 Y630	T470-P505 HydrophobicContact CG2-CB 3.81Å; A473-P505 HydrophobicContact CB-CG 4.3Å; P505-F507 HydrophobicContact CB-CE1 4.17Å; P505-F507 HydrophobicContact CB-CZ 4.29Å; P505-F507 HydrophobicContact CG-CD1 4.5Å; P505-F507 HydrophobicContact CG-CE1 3.7Å; P505-F507 HydrophobicContact CG-CE2 3.98Å; P505-F507 HydrophobicContact CG-CZ 3.42Å; P505-F507 VanDerWaalsContact CG-CZ 3.42Å; P505-Y630 HydrophobicContact CB-CD1 4.36Å; P505-Y630 HydrophobicContact CB-CE1 3.74Å; P505-Y630 HydrophobicContact CB-CE2 3.97Å; P505-Y630 HydrophobicContact CG-CD1 4.33Å; P505-Y630 HydrophobicContact CG-CE1 3.72Å
506	K	86.6	Confident	90.5	Very high	199 Å²	199	73.5 Å²	73.5	87%	0.865	39%	0.39	S	S	*	.			trans	-84.9	113.5	165.6	-68.8	179.3	-177.9	172.8	0	109.1
507	F	92.1	Very high	90.6	Very high	94 Å²	94	70 Å²	70	41%	0.412	37%	0.369	S	S	.	.			trans	-85.6	136.6	179.6	-59	-69.6	0	0	0	111.9	T470 A473 L474 P505	T470-F507 WeakPolarHBondContact O-CE1 3.48Å; A473-F507 HydrophobicContact CB-CE1 4.34Å; L474-F507 HydrophobicContact CD2-CD1 3.53Å; L474-F507 HydrophobicContact CD2-CD2 4.39Å; L474-F507 HydrophobicContact CD2-CE1 3.56Å; L474-F507 HydrophobicContact CD2-CE2 4.43Å; L474-F507 HydrophobicContact CD2-CG 3.93Å; L474-F507 HydrophobicContact CD2-CZ 4.01Å; L474-F507 HydrophobicContact CG-CD1 4.07Å; L474-F507 HydrophobicContact CG-CE1 3.91Å; P505-F507 HydrophobicContact CB-CE1 4.17Å; P505-F507 HydrophobicContact CB-CZ 4.29Å; P505-F507 HydrophobicContact CG-CD1 4.5Å; P505-F507 HydrophobicContact CG-CE1 3.7Å; P505-F507 HydrophobicContact CG-CE2 3.98Å; P505-F507 HydrophobicContact CG-CZ 3.42Å; P505-F507 VanDerWaalsContact CG-CZ 3.42Å
508	P	91.6	Very high	90.6	Very high	41 Å²	41	68.5 Å²	68.5	27%	0.266	36%	0.358	S	S	.	.			trans	-68.6	164.6	170.2	31.8	-36.7	0	0	0	111.7	Y511	P508-Y511 WeakPolarHBondContact CD-OH 3.44Å; P508-Y511 HydrophobicContact CG-CD1 4Å; P508-Y511 HydrophobicContact CG-CD2 4.19Å; P508-Y511 HydrophobicContact CG-CE1 3.57Å; P508-Y511 HydrophobicContact CG-CE2 3.74Å; P508-Y511 HydrophobicContact CG-CG 4.32Å; P508-Y511 VanDerWaalsContact CG-CZ 3.46Å
509	Q	90.3	Very high	90.7	Very high	176 Å²	176	68.5 Å²	68.5	82%	0.822	36%	0.358	S	S	*	.	S	Bend	trans	-65.7	-42.1	176.1	-72.2	-174	-6.8	0	0	112.3
510	N	93.3	Very high	90.8	Very high	99 Å²	99	67.9 Å²	67.9	53%	0.529	36%	0.355	S	S	.	.	S	Bend	trans	-143.1	155.6	175.4	59.9	2	0	0	0	110.9	K485	K485-N510 CarbonylContact O-C 3.57Å; K485-N510 WeakPolarHBondContact O-CA 3.44Å
511	Y	95.2	Very high	91.2	Very high	8 Å²	8	63.7 Å²	63.7	3%	0.031	33%	0.328	C	S	.	.			trans	-101	155.9	173.7	-67.4	-94.8	0	0	0	110.8	N468 T470 Y471 L474 K485 N486 V487 P508 T515	N468-Y511 HydrophobicContact CB-CD1 4.08Å; N468-Y511 HydrophobicContact CB-CE1 3.93Å; T470-Y511 PolarHBondContact O-OH 2.98Å; T470-Y511 PolarHBondContact OG1-OH 3.42Å; Y471-Y511 AromaticContact CD2-CD1 3.83Å; Y471-Y511 HydrophobicContact CD2-CD1 3.83Å; Y471-Y511 HydrophobicContact CD2-CD2 4.03Å; Y471-Y511 HydrophobicContact CD2-CE1 4.19Å; Y471-Y511 HydrophobicContact CD2-CE2 4.41Å; Y471-Y511 AromaticContact CD2-CG 3.71Å; Y471-Y511 HydrophobicContact CD2-CG 3.71Å; Y471-Y511 HydrophobicContact CE2-CG 4.48Å; Y471-Y511 HydrophobicContact CG-CD1 4.35Å; Y471-Y511 HydrophobicContact CG-CE1 4.44Å; Y471-Y511 PolarHBondContact N-OH 3.34Å; L474-Y511 HydrophobicContact CD1-CD2 4.4Å; L474-Y511 HydrophobicContact CD1-CE2 3.6Å; K485-Y511 PolarHBondContact O-N 3.16Å; N486-Y511 WeakPolarHBondContact CB-O 3.31Å; N486-Y511 PolarHBondContact ND2-O 2.79Å; N486-Y511 VanDerWaalsContact ND2-O 3.09Å; V487-Y511 HydrophobicContact CG2-CD2 3.67Å; V487-Y511 HydrophobicContact CG2-CE2 4.06Å; P508-Y511 WeakPolarHBondContact CD-OH 3.44Å; P508-Y511 HydrophobicContact CG-CD1 4Å; P508-Y511 HydrophobicContact CG-CD2 4.19Å; P508-Y511 HydrophobicContact CG-CE1 3.57Å; P508-Y511 HydrophobicContact CG-CE2 3.74Å; P508-Y511 HydrophobicContact CG-CG 4.32Å; P508-Y511 VanDerWaalsContact CG-CZ 3.46Å; Y511-T515 HydrophobicContact CD1-CG2 4.09Å
512	N	94.4	Very high	91.7	Very high	58 Å²	58	60.6 Å²	60.6	31%	0.31	30%	0.303	S	S	.	.			trans	-87.8	158.6	176.3	63.1	39.2	0	0	0	110.8	T466 V514 T515 E516	T466-N512 WeakPolarHBondContact CB-ND2 3.44Å; T466-N512 PolarHBondContact O-ND2 3.17Å; T466-N512 PolarHBondContact OG1-ND2 3.04Å; N512-V514 PolarHBondContact O-N 3.42Å; N512-V514 PolarHBondContact OD1-N 2.96Å; N512-T515 PolarHBondContact O-N 3.36Å; N512-T515 VanDerWaalsContact O-N 3.15Å; N512-T515 WeakPolarHBondContact OD1-CB 3.49Å; N512-T515 PolarHBondContact OD1-N 2.66Å; N512-T515 PolarHBondContact OD1-OG1 3.46Å; N512-E516 PolarHBondContact O-N 3.47Å
513	L	93.9	Very high	92.5	Very high	55 Å²	55	54.2 Å²	54.2	29%	0.288	26%	0.264	S	S	.	.	H	α-helix	trans	-63.8	-24.9	179.4	-174.6	60.4	0	0	0	112.8	L407 T515 E516 N517	L407-L513 HydrophobicContact CD1-CD1 4.04Å; L407-L513 HydrophobicContact CD2-CD1 4.35Å; L513-T515 VanDerWaalsContact C-N 3.34Å; L513-E516 PolarHBondContact O-N 3.1Å; L513-N517 WeakPolarHBondContact CD1-OD1 3.5Å; L513-N517 VanDerWaalsContact O-CB 3.24Å; L513-N517 WeakPolarHBondContact O-CB 3.49Å; L513-N517 PolarHBondContact O-N 3.31Å; L513-N517 PolarHBondContact O-OD1 2.88Å
514	V	94	Very high	93.5	Very high	25 Å²	25	47 Å²	47	15%	0.152	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-43.8	175.6	176.2	0	0	0	0	110.3	F456 N512 L518	F456-V514 HydrophobicContact CD1-CG1 4.09Å; F456-V514 HydrophobicContact CD1-CG2 4.2Å; F456-V514 HydrophobicContact CD2-CG1 4.23Å; F456-V514 HydrophobicContact CE1-CG1 4.07Å; F456-V514 HydrophobicContact CE1-CG2 4.4Å; F456-V514 HydrophobicContact CE2-CG1 4.23Å; F456-V514 HydrophobicContact CG-CG1 4.15Å; F456-V514 HydrophobicContact CZ-CG1 4.13Å; N512-V514 PolarHBondContact O-N 3.42Å; N512-V514 PolarHBondContact OD1-N 2.96Å; V514-L518 VanDerWaalsContact O-CB 3.29Å; V514-L518 WeakPolarHBondContact O-CB 3.47Å; V514-L518 PolarHBondContact O-N 3.47Å
515	T	95.6	Very high	94.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-47.3	178.5	-58.3	0	0	0	0	111	F467 N468 Y471 Y511 N512 L513 L518 A519	F467-T515 HydrophobicContact CD2-CG2 3.87Å; F467-T515 HydrophobicContact CE2-CG2 3.9Å; N468-T515 PolarHBondContact N-OG1 2.94Å; Y471-T515 HydrophobicContact CD1-CG2 4.3Å; Y471-T515 HydrophobicContact CD2-CG2 4.04Å; Y471-T515 HydrophobicContact CG-CG2 3.73Å; Y511-T515 HydrophobicContact CD1-CG2 4.09Å; N512-T515 PolarHBondContact O-N 3.36Å; N512-T515 VanDerWaalsContact O-N 3.15Å; N512-T515 WeakPolarHBondContact OD1-CB 3.49Å; N512-T515 PolarHBondContact OD1-N 2.66Å; N512-T515 PolarHBondContact OD1-OG1 3.46Å; L513-T515 VanDerWaalsContact C-N 3.34Å; T515-L518 PolarHBondContact O-N 3.29Å; T515-A519 WeakPolarHBondContact O-CB 3.39Å; T515-A519 PolarHBondContact O-N 3.23Å
516	E	94.9	Very high	94.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-51	177.4	-66.5	-160.5	-113.4	0	0	112.4	Y471 N486 H488 N512 L513 L518 A519 L520	Y471-E516 HydrophobicContact CE2-CG 3.9Å; N486-E516 WeakPolarHBondContact CB-OE1 3.31Å; N486-E516 VanDerWaalsContact O-OE1 3.11Å; H488-E516 IonicContact CE1-OE1 2.88Å; H488-E516 IonicContact CE1-OE2 2.67Å; H488-E516 IonicContact CG-OE2 3.42Å; H488-E516 IonicContact ND1-OE1 2.73Å; H488-E516 IonicContact ND1-OE2 2.63Å; H488-E516 PolarHBondContact ND1-OE2 3.22Å; N512-E516 PolarHBondContact O-N 3.47Å; L513-E516 PolarHBondContact O-N 3.1Å; E516-L518 VanDerWaalsContact C-N 3.27Å; E516-L518 PolarHBondContact O-N 2.91Å; E516-A519 PolarHBondContact O-N 2.89Å; E516-L520 VanDerWaalsContact O-CB 3.29Å; E516-L520 WeakPolarHBondContact O-CB 3.39Å; E516-L520 WeakPolarHBondContact O-CD1 3.48Å; E516-L520 VanDerWaalsContact O-CG 3.24Å; E516-L520 WeakPolarHBondContact O-CG 3.35Å; E516-L520 PolarHBondContact O-N 3.27Å
517	N	95.8	Very high	95.2	Very high	14 Å²	14	29.8 Å²	29.8	8%	0.075	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-40.6	-179	-75.5	-0	0	0	0	111.3	F456 L513 T521	F456-N517 HydrophobicContact CZ-CB 4.45Å; L513-N517 WeakPolarHBondContact CD1-OD1 3.5Å; L513-N517 VanDerWaalsContact O-CB 3.24Å; L513-N517 WeakPolarHBondContact O-CB 3.49Å; L513-N517 PolarHBondContact O-N 3.31Å; L513-N517 PolarHBondContact O-OD1 2.88Å; N517-T521 VanDerWaalsContact O-CB 3.29Å; N517-T521 WeakPolarHBondContact O-CB 3.33Å; N517-T521 PolarHBondContact O-N 3.42Å; N517-T521 PolarHBondContact O-OG1 2.84Å
518	L	96.7	Very high	95.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.5	-48.2	179.3	-175.5	64.1	0	0	0	111.4	F456 L464 F467 V514 T515 E516 L520 T521 E522 L594 M598 L601	F456-L518 HydrophobicContact CE2-CD1 4.38Å; L464-L518 HydrophobicContact CD1-CD2 4.43Å; F467-L518 HydrophobicContact CB-CD2 4.37Å; F467-L518 HydrophobicContact CD2-CB 4.34Å; F467-L518 HydrophobicContact CD2-CD2 3.56Å; F467-L518 HydrophobicContact CD2-CG 4.41Å; F467-L518 HydrophobicContact CE2-CD2 3.93Å; F467-L518 HydrophobicContact CE2-CG 4.49Å; F467-L518 HydrophobicContact CG-CD2 3.95Å; V514-L518 VanDerWaalsContact O-CB 3.29Å; V514-L518 WeakPolarHBondContact O-CB 3.47Å; V514-L518 PolarHBondContact O-N 3.47Å; T515-L518 PolarHBondContact O-N 3.29Å; E516-L518 VanDerWaalsContact C-N 3.27Å; E516-L518 PolarHBondContact O-N 2.91Å; L518-L520 PolarHBondContact O-N 3.46Å; L518-T521 PolarHBondContact O-N 3.31Å; L518-E522 HydrophobicContact CD1-CG 4.21Å; L518-E522 WeakPolarHBondContact O-CB 3.43Å; L518-E522 PolarHBondContact O-N 2.92Å; L518-L594 HydrophobicContact CD1-CD1 3.59Å; L518-M598 HydrophobicContact CD1-CE 4.41Å; L518-M598 HydrophobicContact CD1-SD 3.46Å; L518-M598 WeakPolarHBondContact CD1-SD 3.41Å; L518-M598 HydrophobicContact CD2-CE 4Å; L518-M598 HydrophobicContact CD2-SD 3.75Å; L518-M598 HydrophobicContact CG-CE 4.49Å; L518-M598 HydrophobicContact CG-SD 4.08Å; L518-L601 HydrophobicContact CD2-CD2 3.77Å
519	A	97.1	Very high	95.5	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-41.7	177.9	0	0	0	0	0	112.3	Y471 M489 L492 T515 E516 Y523	Y471-A519 HydrophobicContact CD1-CB 3.95Å; Y471-A519 HydrophobicContact CE1-CB 3.74Å; M489-A519 HydrophobicContact CG-CB 4.42Å; L492-A519 HydrophobicContact CD1-CB 4.46Å; T515-A519 WeakPolarHBondContact O-CB 3.39Å; T515-A519 PolarHBondContact O-N 3.23Å; E516-A519 PolarHBondContact O-N 2.89Å; A519-Y523 VanDerWaalsContact O-CB 3.29Å; A519-Y523 WeakPolarHBondContact O-CB 3.17Å; A519-Y523 PolarHBondContact O-N 3.48Å; A519-Y523 VanDerWaalsContact O-N 3.1Å
520	L	97.8	Very high	95.5	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-60.2	-47	174.4	-77.8	163.6	0	0	0	111.2	L407 L410 L414 L449 M489 E516 L518 T524	L407-L520 HydrophobicContact CD2-CD1 3.72Å; L410-L520 HydrophobicContact CB-CD2 3.83Å; L410-L520 HydrophobicContact CD1-CD1 4.43Å; L414-L520 HydrophobicContact CD1-CD2 3.8Å; L449-L520 HydrophobicContact CD1-CB 4.43Å; M489-L520 HydrophobicContact CG-CD2 4.06Å; M489-L520 HydrophobicContact CG-CG 4.11Å; M489-L520 HydrophobicContact SD-CD2 3.35Å; M489-L520 WeakPolarHBondContact SD-CD2 3.29Å; M489-L520 HydrophobicContact SD-CG 3.94Å; E516-L520 VanDerWaalsContact O-CB 3.29Å; E516-L520 WeakPolarHBondContact O-CB 3.39Å; E516-L520 WeakPolarHBondContact O-CD1 3.48Å; E516-L520 VanDerWaalsContact O-CG 3.24Å; E516-L520 WeakPolarHBondContact O-CG 3.35Å; E516-L520 PolarHBondContact O-N 3.27Å; L518-L520 PolarHBondContact O-N 3.46Å; L520-T524 VanDerWaalsContact O-CB 3.31Å; L520-T524 WeakPolarHBondContact O-CB 3.43Å; L520-T524 PolarHBondContact O-N 3.39Å; L520-T524 PolarHBondContact O-OG1 3.48Å
521	T	98.1	Very high	95.3	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.006	6%	0.062	C	C	.	.	H	α-helix	trans	-67.8	-50.4	-176.1	-54.8	0	0	0	0	111.1	L449 L450 C453 N517 L518 Y523 T524 L525 L594	L449-T521 HydrophobicContact CB-CG2 4.11Å; L449-T521 WeakPolarHBondContact CB-OG1 3.45Å; L450-T521 HydrophobicContact CD2-CG2 4.13Å; L450-T521 HydrophobicContact CG-CG2 4.14Å; C453-T521 PolarHBondContact SG-OG1 3.32Å; N517-T521 VanDerWaalsContact O-CB 3.29Å; N517-T521 WeakPolarHBondContact O-CB 3.33Å; N517-T521 PolarHBondContact O-N 3.42Å; N517-T521 PolarHBondContact O-OG1 2.84Å; L518-T521 PolarHBondContact O-N 3.31Å; T521-Y523 VanDerWaalsContact C-N 3.33Å; T521-Y523 PolarHBondContact O-N 3.43Å; T521-T524 WeakPolarHBondContact O-CB 3.47Å; T521-T524 PolarHBondContact O-N 2.99Å; T521-T524 VanDerWaalsContact O-N 3.17Å; T521-L525 HydrophobicContact CG2-CD1 4.38Å; T521-L525 WeakPolarHBondContact O-CG 3.31Å; T521-L525 PolarHBondContact O-N 3.35Å; T521-L594 HydrophobicContact CG2-CD2 3.73Å
522	E	97.5	Very high	95	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.6	-42.5	179.6	-74.4	-61.5	155.9	0	0	111.8	L518 T524 L525 Y526 L594 Q595 M598 F634 F635 N638	L518-E522 HydrophobicContact CD1-CG 4.21Å; L518-E522 WeakPolarHBondContact O-CB 3.43Å; L518-E522 PolarHBondContact O-N 2.92Å; E522-T524 PolarHBondContact O-N 3.44Å; E522-L525 PolarHBondContact O-N 2.71Å; E522-Y526 WeakPolarHBondContact O-CB 3.43Å; E522-Y526 PolarHBondContact O-N 3.31Å; E522-L594 WeakPolarHBondContact OE1-CD2 3.36Å; E522-L594 WeakPolarHBondContact OE1-CG 3.39Å; E522-Q595 PolarHBondContact OE1-NE2 3.35Å; E522-M598 VanDerWaalsContact OE1-CG 3.26Å; E522-M598 WeakPolarHBondContact OE1-CG 3.34Å; E522-F634 HydrophobicContact CB-CD2 4.49Å; E522-F634 HydrophobicContact CB-CE2 3.91Å; E522-F635 HydrophobicContact CB-CE1 4.44Å; E522-F635 HydrophobicContact CB-CE2 4.3Å; E522-F635 HydrophobicContact CB-CZ 4.2Å; E522-F635 HydrophobicContact CG-CD1 4.27Å; E522-F635 HydrophobicContact CG-CE1 4.08Å; E522-F635 HydrophobicContact CG-CZ 4.34Å; E522-N638 PolarHBondContact O-ND2 2.86Å; E522-N638 PolarHBondContact OE2-ND2 2.84Å
523	Y	97.6	Very high	94.9	Very high	3 Å²	3	9.7 Å²	9.7	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-69.9	-33.7	177.6	-161.2	-115.4	0	0	0	112.4	L414 A418 M489 L492 E495 A519 T521 Y526 L527 F634	L414-Y523 HydrophobicContact CB-CD1 3.84Å; L414-Y523 HydrophobicContact CB-CE1 4.12Å; L414-Y523 HydrophobicContact CD1-CD1 4.04Å; L414-Y523 HydrophobicContact CG-CD1 4.43Å; A418-Y523 VanDerWaalsContact CB-OH 3.27Å; A418-Y523 WeakPolarHBondContact CB-OH 3.46Å; M489-Y523 HydrophobicContact CE-CD1 3.6Å; M489-Y523 HydrophobicContact CE-CE1 4.39Å; M489-Y523 HydrophobicContact CE-CG 3.83Å; L492-Y523 HydrophobicContact CD2-CD2 4.08Å; L492-Y523 HydrophobicContact CD2-CE2 4.24Å; L492-Y523 HydrophobicContact CD2-CG 4.34Å; E495-Y523 PolarHBondContact OE1-OH 3.23Å; A519-Y523 VanDerWaalsContact O-CB 3.29Å; A519-Y523 WeakPolarHBondContact O-CB 3.17Å; A519-Y523 PolarHBondContact O-N 3.48Å; A519-Y523 VanDerWaalsContact O-N 3.1Å; T521-Y523 VanDerWaalsContact C-N 3.33Å; T521-Y523 PolarHBondContact O-N 3.43Å; Y523-Y526 HydrophobicContact CD2-CD1 4.23Å; Y523-Y526 HydrophobicContact CE2-CD1 4.13Å; Y523-Y526 PolarHBondContact O-N 3.2Å; Y523-L527 HydrophobicContact CD1-CD1 3.91Å; Y523-L527 HydrophobicContact CD1-CG 4.29Å; Y523-L527 HydrophobicContact CE1-CD1 3.63Å; Y523-L527 HydrophobicContact CE1-CD2 4.47Å; Y523-L527 HydrophobicContact CE1-CG 4.13Å; Y523-L527 WeakPolarHBondContact O-CG 3.13Å; Y523-L527 PolarHBondContact O-N 3.32Å; Y523-F634 HydrophobicContact CD2-CD1 4.29Å; Y523-F634 AromaticContact CD2-CE1 3.7Å; Y523-F634 HydrophobicContact CD2-CE1 3.7Å; Y523-F634 HydrophobicContact CD2-CE2 4.05Å; Y523-F634 AromaticContact CD2-CZ 3.57Å; Y523-F634 HydrophobicContact CD2-CZ 3.57Å; Y523-F634 HydrophobicContact CE2-CE1 4.15Å; Y523-F634 HydrophobicContact CE2-CZ 4.45Å; Y523-F634 HydrophobicContact CG-CZ 4.31Å
524	T	97.8	Very high	94.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-64.3	-42.1	172.7	-57.8	0	0	0	0	111.6	L414 F442 L445 L449 L520 T521 E522 Y526 L527 G528	L414-T524 WeakPolarHBondContact CD2-OG1 3.33Å; F442-T524 HydrophobicContact CD1-CG2 4.03Å; L445-T524 HydrophobicContact CB-CG2 4.21Å; L445-T524 HydrophobicContact CD2-CG2 4.11Å; L445-T524 HydrophobicContact CG-CG2 3.98Å; L449-T524 HydrophobicContact CD1-CG2 4.21Å; L449-T524 VanDerWaalsContact CD1-OG1 3.29Å; L449-T524 WeakPolarHBondContact CD1-OG1 3.34Å; L520-T524 VanDerWaalsContact O-CB 3.31Å; L520-T524 WeakPolarHBondContact O-CB 3.43Å; L520-T524 PolarHBondContact O-N 3.39Å; L520-T524 PolarHBondContact O-OG1 3.48Å; T521-T524 WeakPolarHBondContact O-CB 3.47Å; T521-T524 PolarHBondContact O-N 2.99Å; T521-T524 VanDerWaalsContact O-N 3.17Å; E522-T524 PolarHBondContact O-N 3.44Å; T524-Y526 VanDerWaalsContact C-N 3.31Å; T524-Y526 PolarHBondContact O-N 3.27Å; T524-L527 PolarHBondContact O-N 3.5Å; T524-G528 PolarHBondContact O-N 3.41Å
525	L	96.9	Very high	94.2	Very high	12 Å²	12	11.2 Å²	11.2	6%	0.063	5%	0.054	C	C	.	.	H	α-helix	trans	-63.9	-38.2	175.5	-68.2	177.4	0	0	0	111.7	L450 T521 E522 G528 F529 H530 L594	L450-L525 HydrophobicContact CD1-CD2 4.07Å; L450-L525 HydrophobicContact CD2-CD1 4.2Å; L450-L525 HydrophobicContact CG-CD2 4.41Å; T521-L525 HydrophobicContact CG2-CD1 4.38Å; T521-L525 WeakPolarHBondContact O-CG 3.31Å; T521-L525 PolarHBondContact O-N 3.35Å; E522-L525 PolarHBondContact O-N 2.71Å; L525-G528 CarbonylContact O-C 3.2Å; L525-G528 PolarHBondContact O-N 2.91Å; L525-F529 HydrophobicContact CD2-CB 4.23Å; L525-F529 PolarHBondContact O-N 3.2Å; L525-H530 PolarHBondContact O-N 3.1Å; L525-L594 HydrophobicContact CD1-CD2 3.78Å
526	Y	95.4	Very high	93.9	Very high	38 Å²	38	11.2 Å²	11.2	15%	0.149	5%	0.054	C	C	.	.	I	π-helix	trans	-63.5	-46.6	175.4	-177.1	-119.2	0	0	0	112.2	T421 E522 Y523 T524 G528 H530 F634 N638	T421-Y526 HydrophobicContact CG2-CD1 3.98Å; T421-Y526 HydrophobicContact CG2-CE1 3.76Å; T421-Y526 HydrophobicContact CG2-CE2 4.32Å; T421-Y526 HydrophobicContact CG2-CG 4.35Å; T421-Y526 VanDerWaalsContact CG2-O 3.25Å; T421-Y526 WeakPolarHBondContact CG2-O 3.21Å; T421-Y526 WeakPolarHBondContact OG1-CE1 3.45Å; E522-Y526 WeakPolarHBondContact O-CB 3.43Å; E522-Y526 PolarHBondContact O-N 3.31Å; Y523-Y526 HydrophobicContact CD2-CD1 4.23Å; Y523-Y526 HydrophobicContact CE2-CD1 4.13Å; Y523-Y526 PolarHBondContact O-N 3.2Å; T524-Y526 VanDerWaalsContact C-N 3.31Å; T524-Y526 PolarHBondContact O-N 3.27Å; Y526-G528 VanDerWaalsContact C-N 3.3Å; Y526-G528 PolarHBondContact O-N 2.88Å; Y526-H530 HydrophobicContact CD2-CB 4.33Å; Y526-H530 AromaticContact CD2-CD2 3.82Å; Y526-H530 AromaticContact CD2-CG 3.97Å; Y526-H530 AromaticContact CE2-CD2 3.71Å; Y526-H530 AromaticContact CE2-NE2 3.73Å; Y526-F634 HydrophobicContact CD1-CB 4.16Å; Y526-F634 HydrophobicContact CD1-CG 4.31Å; Y526-F634 HydrophobicContact CD2-CB 3.67Å; Y526-F634 HydrophobicContact CE1-CB 4.36Å; Y526-F634 HydrophobicContact CE2-CB 3.91Å; Y526-F634 HydrophobicContact CG-CB 3.82Å; Y526-F634 HydrophobicContact CG-CD2 4.41Å; Y526-F634 HydrophobicContact CG-CG 4.18Å; Y526-N638 WeakPolarHBondContact CA-OD1 3.49Å
527	L	94.6	Very high	93.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	I	π-helix	trans	-74.1	-18.2	177.9	-63.2	-175.6	0	0	0	114.1	L414 N417 R420 T421 F442 Y523 T524	L414-L527 HydrophobicContact CB-CD1 4.4Å; L414-L527 HydrophobicContact CD2-CD1 4.26Å; N417-L527 HydrophobicContact CB-CD1 4.24Å; R420-L527 HydrophobicContact CB-CD2 4.4Å; R420-L527 PolarHBondContact NE-O 3.27Å; R420-L527 PolarHBondContact NH2-O 3.32Å; T421-L527 HydrophobicContact CG2-CD2 3.86Å; F442-L527 HydrophobicContact CD1-CB 3.88Å; F442-L527 HydrophobicContact CE1-CB 3.67Å; F442-L527 HydrophobicContact CE1-CD1 3.91Å; F442-L527 HydrophobicContact CE1-CG 4.46Å; F442-L527 HydrophobicContact CZ-CB 4.28Å; F442-L527 HydrophobicContact CZ-CD1 4.21Å; Y523-L527 HydrophobicContact CD1-CD1 3.91Å; Y523-L527 HydrophobicContact CD1-CG 4.29Å; Y523-L527 HydrophobicContact CE1-CD1 3.63Å; Y523-L527 HydrophobicContact CE1-CD2 4.47Å; Y523-L527 HydrophobicContact CE1-CG 4.13Å; Y523-L527 WeakPolarHBondContact O-CG 3.13Å; Y523-L527 PolarHBondContact O-N 3.32Å; T524-L527 PolarHBondContact O-N 3.5Å
528	G	93.9	Very high	93.2	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.01	8%	0.08	C	C	.	.	I	π-helix	trans	-110.4	-84.9	-175.2	0	0	0	0	0	113.6	T524 L525 Y526 R531 L532	T524-G528 PolarHBondContact O-N 3.41Å; L525-G528 CarbonylContact O-C 3.2Å; L525-G528 PolarHBondContact O-N 2.91Å; Y526-G528 VanDerWaalsContact C-N 3.3Å; Y526-G528 PolarHBondContact O-N 2.88Å; G528-R531 PolarHBondContact O-N 2.83Å; G528-L532 WeakPolarHBondContact O-CB 3.43Å; G528-L532 PolarHBondContact O-N 2.85Å
529	F	94.2	Very high	92.8	Very high	16 Å²	16	18.1 Å²	18.1	7%	0.07	9%	0.087	C	C	.	.	I	π-helix	trans	-60.3	-47.9	-172	-172.6	-82.6	0	0	0	112.7	L443 L525 L532 H533 M582 L588 F642 F645	L443-F529 HydrophobicContact CD2-CD2 4.3Å; L525-F529 HydrophobicContact CD2-CB 4.23Å; L525-F529 PolarHBondContact O-N 3.2Å; F529-L532 PolarHBondContact O-N 2.91Å; F529-H533 PolarHBondContact O-N 2.98Å; F529-M582 HydrophobicContact CD1-CE 4.15Å; F529-M582 HydrophobicContact CD2-CE 3.76Å; F529-M582 HydrophobicContact CE1-CE 3.96Å; F529-M582 HydrophobicContact CE2-CB 4.36Å; F529-M582 HydrophobicContact CE2-CE 3.56Å; F529-M582 HydrophobicContact CG-CE 4.05Å; F529-M582 HydrophobicContact CZ-CE 3.66Å; F529-L588 HydrophobicContact CE2-CD2 4.46Å; F529-F642 AromaticContact CE1-CD2 3.86Å; F529-F642 HydrophobicContact CE1-CD2 3.86Å; F529-F642 AromaticContact CZ-CD2 3.87Å; F529-F642 HydrophobicContact CZ-CD2 3.87Å; F529-F642 HydrophobicContact CZ-CE2 4.23Å; F529-F645 HydrophobicContact CE1-CB 4.3Å; F529-F645 HydrophobicContact CE1-CD1 4.37Å; F529-F645 HydrophobicContact CE1-CD2 4.35Å; F529-F645 HydrophobicContact CE1-CG 4.08Å; F529-F645 HydrophobicContact CE2-CE1 4.49Å; F529-F645 HydrophobicContact CZ-CB 4.42Å; F529-F645 AromaticContact CZ-CD1 3.67Å; F529-F645 HydrophobicContact CZ-CD1 3.67Å; F529-F645 HydrophobicContact CZ-CD2 4.01Å; F529-F645 AromaticContact CZ-CE1 3.87Å; F529-F645 HydrophobicContact CZ-CE1 3.87Å; F529-F645 HydrophobicContact CZ-CE2 4.19Å; F529-F645 AromaticContact CZ-CG 3.75Å; F529-F645 HydrophobicContact CZ-CG 3.75Å; F529-F645 HydrophobicContact CZ-CZ 4.12Å
530	H	91.6	Very high	92.4	Very high	20 Å²	20	21.4 Å²	21.4	9%	0.093	10%	0.104	C	C	.	.	I	π-helix	trans	-57.5	-52.4	179.8	165.4	90.5	0	0	0	111.4	L525 Y526 L532 H533 D534 D637 D641	L525-H530 PolarHBondContact O-N 3.1Å; Y526-H530 HydrophobicContact CD2-CB 4.33Å; Y526-H530 AromaticContact CD2-CD2 3.82Å; Y526-H530 AromaticContact CD2-CG 3.97Å; Y526-H530 AromaticContact CE2-CD2 3.71Å; Y526-H530 AromaticContact CE2-NE2 3.73Å; H530-L532 VanDerWaalsContact C-N 3.31Å; H530-L532 PolarHBondContact O-N 3.39Å; H530-H533 WeakPolarHBondContact O-CB 3.3Å; H530-H533 PolarHBondContact O-N 3.09Å; H530-D534 PolarHBondContact O-N 2.94Å; H530-D637 IonicContact CE1-OD2 3.15Å; H530-D637 PolarHBondContact CE1-OD2 2.99Å; H530-D637 VanDerWaalsContact CE1-OD2 3.27Å; H530-D637 IonicContact ND1-OD2 3.44Å; H530-D641 IonicContact CE1-OD2 2.74Å; H530-D641 PolarHBondContact CE1-OD2 3.29Å; H530-D641 IonicContact CG-OD2 3.87Å; H530-D641 IonicContact ND1-OD2 3.4Å; H530-D641 PolarHBondContact ND1-OD2 3.5Å
531	R	88.1	Confident	92	Very high	8 Å²	8	26 Å²	26	3%	0.03	13%	0.126	C	C	.	.	H	α-helix	trans	-56.7	-43.5	175.9	174.3	-172.3	156.4	78.8	15.8	112.3	R420 N426 D439 G528 D534 Q535	R420-R531 WeakPolarHBondContact O-CD 3.21Å; R420-R531 PolarHBondContact O-NH1 3.49Å; N426-R531 PolarHBondContact OD1-NH1 3.46Å; D439-R531 IonicContact OD1-NE 2.84Å; D439-R531 PolarHBondContact OD1-NE 2.8Å; G528-R531 PolarHBondContact O-N 2.83Å; R531-D534 PolarHBondContact O-N 3.24Å; R531-Q535 PolarHBondContact O-N 3.19Å
532	L	89.8	Confident	91.5	Very high	5 Å²	5	29.2 Å²	29.2	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-71.2	-34.5	-177.3	-167.9	63.6	0	0	0	112	L346 D439 L443 G528 F529 H530 D534 Q535 M536 T578 M582	L346-L532 HydrophobicContact CD1-CD2 4.39Å; D439-L532 HydrophobicContact CB-CD1 4.08Å; L443-L532 HydrophobicContact CD1-CD2 3.57Å; L443-L532 HydrophobicContact CD2-CD2 4.08Å; L443-L532 HydrophobicContact CG-CD2 3.99Å; G528-L532 WeakPolarHBondContact O-CB 3.43Å; G528-L532 PolarHBondContact O-N 2.85Å; F529-L532 PolarHBondContact O-N 2.91Å; H530-L532 VanDerWaalsContact C-N 3.31Å; H530-L532 PolarHBondContact O-N 3.39Å; L532-D534 PolarHBondContact O-N 2.95Å; L532-Q535 PolarHBondContact O-N 3.32Å; L532-M536 WeakPolarHBondContact O-CB 3.27Å; L532-M536 PolarHBondContact O-N 2.77Å; L532-T578 HydrophobicContact CD1-CG2 3.92Å; L532-T578 HydrophobicContact CD2-CG2 4.1Å; L532-T578 HydrophobicContact CG-CG2 3.89Å; L532-M582 HydrophobicContact CB-CE 4.23Å; L532-M582 HydrophobicContact CB-SD 4.02Å; L532-M582 HydrophobicContact CD2-CG 3.65Å; L532-M582 HydrophobicContact CD2-SD 3.61Å; L532-M582 HydrophobicContact CG-CE 4.43Å; L532-M582 HydrophobicContact CG-CG 4.31Å; L532-M582 HydrophobicContact CG-SD 3.57Å; L532-M582 VanDerWaalsContact CG-SD 3.57Å
533	H	91.8	Very high	91.2	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.019	15%	0.145	C	C	.	.	H	α-helix	trans	-57.8	-47.9	172.5	176.1	-148.6	0	0	0	111.1	F529 H530 Q535 M536 V537 M582 F645	F529-H533 PolarHBondContact O-N 2.98Å; H530-H533 WeakPolarHBondContact O-CB 3.3Å; H530-H533 PolarHBondContact O-N 3.09Å; H533-Q535 VanDerWaalsContact C-N 3.32Å; H533-Q535 PolarHBondContact O-N 3.11Å; H533-M536 WeakPolarHBondContact O-CB 3.17Å; H533-M536 PolarHBondContact O-N 3.36Å; H533-M536 VanDerWaalsContact O-N 3.15Å; H533-V537 WeakPolarHBondContact O-CG2 3.46Å; H533-V537 PolarHBondContact O-N 3.17Å; H533-M582 HydrophobicContact CB-CE 4.01Å; H533-F645 HydrophobicContact CB-CD2 4.48Å; H533-F645 AromaticContact CD2-CD2 3.68Å
534	D	86.5	Confident	90.6	Very high	65 Å²	65	35.1 Å²	35.1	35%	0.348	17%	0.171	S	C	.	.	H	α-helix	trans	-58	-43.1	176.3	-91.6	0.8	0	0	0	112.7	H530 R531 L532 K538	H530-D534 PolarHBondContact O-N 2.94Å; R531-D534 PolarHBondContact O-N 3.24Å; L532-D534 PolarHBondContact O-N 2.95Å; D534-K538 WeakPolarHBondContact O-CG 3.37Å; D534-K538 PolarHBondContact O-N 2.9Å
535	Q	85.8	Confident	90.1	Very high	46 Å²	46	42.6 Å²	42.6	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-65.7	-41.6	176	-71	-172	-32.6	0	0	111.8	R531 L532 H533 V537 K538 I539	R531-Q535 PolarHBondContact O-N 3.19Å; L532-Q535 PolarHBondContact O-N 3.32Å; H533-Q535 VanDerWaalsContact C-N 3.32Å; H533-Q535 PolarHBondContact O-N 3.11Å; Q535-V537 VanDerWaalsContact C-N 3.32Å; Q535-V537 PolarHBondContact O-N 2.98Å; Q535-K538 WeakPolarHBondContact O-CB 3.36Å; Q535-K538 PolarHBondContact O-N 2.96Å; Q535-K538 VanDerWaalsContact O-N 3.17Å; Q535-I539 VanDerWaalsContact O-CG1 3.29Å; Q535-I539 WeakPolarHBondContact O-CG1 3.36Å; Q535-I539 PolarHBondContact O-N 3.14Å
536	M	89.4	Confident	89.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-40	178.9	-172.2	178.5	-178.7	0	0	111.9	L532 H533 I539 N540 Y575 T578 K579 M582 F645 F649	L532-M536 WeakPolarHBondContact O-CB 3.27Å; L532-M536 PolarHBondContact O-N 2.77Å; H533-M536 WeakPolarHBondContact O-CB 3.17Å; H533-M536 PolarHBondContact O-N 3.36Å; H533-M536 VanDerWaalsContact O-N 3.15Å; M536-I539 PolarHBondContact O-N 3.5Å; M536-N540 WeakPolarHBondContact O-CB 3.34Å; M536-N540 PolarHBondContact O-N 3.38Å; M536-Y575 HydrophobicContact CE-CD2 4.31Å; M536-Y575 HydrophobicContact CE-CE2 3.65Å; M536-Y575 HydrophobicContact CG-CD2 4.38Å; M536-Y575 HydrophobicContact CG-CE2 4.16Å; M536-T578 HydrophobicContact CB-CG2 4.28Å; M536-T578 HydrophobicContact CG-CG2 4.33Å; M536-T578 HydrophobicContact SD-CG2 4.43Å; M536-K579 HydrophobicContact CE-CB 3.48Å; M536-K579 VanDerWaalsContact CE-CB 3.48Å; M536-K579 HydrophobicContact CE-CG 3.78Å; M536-M582 HydrophobicContact SD-SD 3.97Å; M536-F645 HydrophobicContact SD-CE2 4.09Å; M536-F649 HydrophobicContact CE-CD1 3.67Å; M536-F649 HydrophobicContact CE-CE1 3.5Å; M536-F649 VanDerWaalsContact CE-CE1 3.5Å; M536-F649 HydrophobicContact CE-CE2 4.37Å; M536-F649 HydrophobicContact CE-CG 4.2Å; M536-F649 HydrophobicContact CE-CZ 3.87Å; M536-F649 HydrophobicContact CG-CZ 4.25Å; M536-F649 HydrophobicContact SD-CD2 4.45Å; M536-F649 HydrophobicContact SD-CE1 4.26Å; M536-F649 HydrophobicContact SD-CE2 4.12Å; M536-F649 HydrophobicContact SD-CZ 4.02Å
537	V	88.1	Confident	89.3	Confident	33 Å²	33	44.7 Å²	44.7	20%	0.2	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-44.2	174.4	173.8	0	0	0	0	111	H533 Q535 N540 Q541	H533-V537 WeakPolarHBondContact O-CG2 3.46Å; H533-V537 PolarHBondContact O-N 3.17Å; Q535-V537 VanDerWaalsContact C-N 3.32Å; Q535-V537 PolarHBondContact O-N 2.98Å; V537-N540 PolarHBondContact O-N 2.76Å; V537-Q541 WeakPolarHBondContact O-CG 3.46Å; V537-Q541 PolarHBondContact O-N 3.22Å
538	K	87.9	Confident	88.9	Confident	99 Å²	99	47.8 Å²	47.8	43%	0.43	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-42.8	176.7	-68.2	171.2	-173.7	170.7	0	112.2	D534 Q535 N540 Q541 N542	D534-K538 WeakPolarHBondContact O-CG 3.37Å; D534-K538 PolarHBondContact O-N 2.9Å; Q535-K538 WeakPolarHBondContact O-CB 3.36Å; Q535-K538 PolarHBondContact O-N 2.96Å; Q535-K538 VanDerWaalsContact O-N 3.17Å; K538-N540 VanDerWaalsContact C-N 3.33Å; K538-N540 PolarHBondContact O-N 3.32Å; K538-Q541 PolarHBondContact O-N 3.06Å; K538-N542 WeakPolarHBondContact O-CB 3.34Å; K538-N542 PolarHBondContact O-N 2.88Å; K538-N542 PolarHBondContact O-ND2 3.07Å
539	I	88.9	Confident	88.5	Confident	27 Å²	27	49.7 Å²	49.7	14%	0.138	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-45.7	176	-70.7	162.8	0	0	0	110.2	Q535 M536 Q541 N542 L543 L571 I574 Y575	Q535-I539 VanDerWaalsContact O-CG1 3.29Å; Q535-I539 WeakPolarHBondContact O-CG1 3.36Å; Q535-I539 PolarHBondContact O-N 3.14Å; M536-I539 PolarHBondContact O-N 3.5Å; I539-Q541 PolarHBondContact O-N 3.34Å; I539-N542 PolarHBondContact O-N 3.4Å; I539-L543 HydrophobicContact CG2-CD1 4.28Å; I539-L543 PolarHBondContact O-N 2.78Å; I539-L571 HydrophobicContact CG1-CD1 4.44Å; I539-L571 HydrophobicContact CG2-CD1 3.87Å; I539-L571 HydrophobicContact CG2-CG 4.1Å; I539-I574 HydrophobicContact CD1-CG2 4Å; I539-Y575 HydrophobicContact CG2-CD2 4.01Å; I539-Y575 HydrophobicContact CG2-CG 4.35Å
540	N	89.9	Confident	88.1	Confident	70 Å²	70	51.2 Å²	51.2	37%	0.374	25%	0.25	S	S	.	.	H	α-helix	trans	-62.7	-41.3	178.9	-168.8	31.3	0	0	0	112.4	M536 V537 K538 L543 H544 Y575	M536-N540 WeakPolarHBondContact O-CB 3.34Å; M536-N540 PolarHBondContact O-N 3.38Å; V537-N540 PolarHBondContact O-N 2.76Å; K538-N540 VanDerWaalsContact C-N 3.33Å; K538-N540 PolarHBondContact O-N 3.32Å; N540-L543 PolarHBondContact O-N 2.99Å; N540-H544 PolarHBondContact O-N 3.05Å; N540-H544 VanDerWaalsContact O-N 3.08Å; N540-Y575 HydrophobicContact CB-CD2 4.48Å; N540-Y575 HydrophobicContact CB-CE2 3.99Å
541	Q	88.2	Confident	87.8	Confident	97 Å²	97	56.3 Å²	56.3	45%	0.453	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-43.5	174.4	-70.5	173.5	3.2	0	0	112.1	V537 K538 I539 H544 R545	V537-Q541 WeakPolarHBondContact O-CG 3.46Å; V537-Q541 PolarHBondContact O-N 3.22Å; K538-Q541 PolarHBondContact O-N 3.06Å; I539-Q541 PolarHBondContact O-N 3.34Å; Q541-H544 PolarHBondContact O-N 3.37Å; Q541-R545 WeakPolarHBondContact O-CG 3.32Å; Q541-R545 PolarHBondContact O-N 2.98Å; Q541-R545 VanDerWaalsContact O-N 3.09Å
542	N	88.4	Confident	87.6	Confident	70 Å²	70	60.2 Å²	60.2	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-66.4	-38	177.7	-72.8	-18.3	0	0	0	112	K538 I539 H544 R545 L546 L571	K538-N542 WeakPolarHBondContact O-CB 3.34Å; K538-N542 PolarHBondContact O-N 2.88Å; K538-N542 PolarHBondContact O-ND2 3.07Å; I539-N542 PolarHBondContact O-N 3.4Å; N542-H544 VanDerWaalsContact C-N 3.35Å; N542-H544 PolarHBondContact O-N 2.92Å; N542-R545 PolarHBondContact O-N 3.42Å; N542-L546 WeakPolarHBondContact O-CB 3.37Å; N542-L546 WeakPolarHBondContact O-CG 3.46Å; N542-L546 PolarHBondContact O-N 3.42Å; N542-L571 HydrophobicContact CB-CD2 3.83Å
543	L	89.8	Confident	87.4	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-45.2	172.9	-84.1	174.7	0	0	0	111.9	I539 N540 R545 L546 Q547 F568 L571 M572 Y575	I539-L543 HydrophobicContact CG2-CD1 4.28Å; I539-L543 PolarHBondContact O-N 2.78Å; N540-L543 PolarHBondContact O-N 2.99Å; L543-R545 PolarHBondContact O-N 3.49Å; L543-L546 PolarHBondContact O-N 2.98Å; L543-Q547 VanDerWaalsContact O-CB 3.28Å; L543-Q547 WeakPolarHBondContact O-CB 3.46Å; L543-Q547 PolarHBondContact O-N 2.91Å; L543-F568 HydrophobicContact CD2-CD2 3.98Å; L543-F568 HydrophobicContact CD2-CE2 3.96Å; L543-L571 HydrophobicContact CB-CD2 4.44Å; L543-L571 HydrophobicContact CD2-CB 3.75Å; L543-L571 HydrophobicContact CD2-CD2 3.78Å; L543-L571 HydrophobicContact CD2-CG 3.71Å; L543-L571 HydrophobicContact CG-CB 4.39Å; L543-L571 HydrophobicContact CG-CD2 3.7Å; L543-L571 HydrophobicContact CG-CG 3.78Å; L543-M572 HydrophobicContact CD1-CE 4.16Å; L543-M572 HydrophobicContact CD1-SD 4.18Å; L543-M572 HydrophobicContact CD2-CB 4.25Å; L543-M572 HydrophobicContact CD2-CE 4.11Å; L543-Y575 VanDerWaalsContact CD1-CB 3.48Å; L543-Y575 HydrophobicContact CD1-CD1 3.97Å; L543-Y575 HydrophobicContact CD1-CD2 4.13Å; L543-Y575 HydrophobicContact CD1-CG 3.58Å
544	H	86.8	Confident	87.1	Confident	120 Å²	120	66 Å²	66	56%	0.556	32%	0.319	S	S	*	.	H	α-helix	trans	-63.1	-43.3	178.1	-167.4	59.9	0	0	0	111.7	N540 Q541 N542 Q547 V548	N540-H544 PolarHBondContact O-N 3.05Å; N540-H544 VanDerWaalsContact O-N 3.08Å; Q541-H544 PolarHBondContact O-N 3.37Å; N542-H544 VanDerWaalsContact C-N 3.35Å; N542-H544 PolarHBondContact O-N 2.92Å; H544-Q547 PolarHBondContact O-N 3.41Å; H544-V548 WeakPolarHBondContact O-CG2 3.3Å; H544-V548 PolarHBondContact O-N 3.38Å; H544-V548 VanDerWaalsContact O-N 3.11Å
545	R	86.5	Confident	87.1	Confident	156 Å²	156	70.4 Å²	70.4	59%	0.589	34%	0.338	S	S	*	.	H	α-helix	trans	-61	-47.8	175.8	-70.3	173.1	-179.2	176.1	-1.4	112.2	Q541 N542 L543 Q547 V548 A549	Q541-R545 WeakPolarHBondContact O-CG 3.32Å; Q541-R545 PolarHBondContact O-N 2.98Å; Q541-R545 VanDerWaalsContact O-N 3.09Å; N542-R545 PolarHBondContact O-N 3.42Å; L543-R545 PolarHBondContact O-N 3.49Å; R545-Q547 VanDerWaalsContact C-N 3.32Å; R545-Q547 PolarHBondContact O-N 3.31Å; R545-V548 PolarHBondContact O-N 3.18Å; R545-A549 PolarHBondContact O-N 3.39Å
546	L	87.4	Confident	86.9	Confident	35 Å²	35	72.1 Å²	72.1	18%	0.183	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-38.5	177.7	-79	171.1	0	0	0	111.9	N542 L543 V548 A549 W550 L564 F568 L571	N542-L546 WeakPolarHBondContact O-CB 3.37Å; N542-L546 WeakPolarHBondContact O-CG 3.46Å; N542-L546 PolarHBondContact O-N 3.42Å; L543-L546 PolarHBondContact O-N 2.98Å; L546-V548 PolarHBondContact O-N 2.95Å; L546-A549 PolarHBondContact O-N 3.46Å; L546-W550 VanDerWaalsContact O-CB 3.23Å; L546-W550 WeakPolarHBondContact O-CB 3.43Å; L546-W550 PolarHBondContact O-N 3.12Å; L546-L564 HydrophobicContact CD2-CD2 4.12Å; L546-F568 HydrophobicContact CB-CD2 4.46Å; L546-L571 HydrophobicContact CD1-CD2 3.71Å
547	Q	88	Confident	86.5	Confident	59 Å²	59	77.4 Å²	77.4	28%	0.276	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-43.2	177.5	-170.6	-179.8	33.6	0	0	111.8	L543 H544 R545 R551 F568	L543-Q547 VanDerWaalsContact O-CB 3.28Å; L543-Q547 WeakPolarHBondContact O-CB 3.46Å; L543-Q547 PolarHBondContact O-N 2.91Å; H544-Q547 PolarHBondContact O-N 3.41Å; R545-Q547 VanDerWaalsContact C-N 3.32Å; R545-Q547 PolarHBondContact O-N 3.31Å; Q547-R551 WeakPolarHBondContact O-CG 3.31Å; Q547-R551 PolarHBondContact O-N 3.48Å; Q547-R551 VanDerWaalsContact O-N 3.14Å; Q547-F568 HydrophobicContact CB-CD2 4.36Å; Q547-F568 HydrophobicContact CB-CE2 3.9Å; Q547-F568 HydrophobicContact CG-CE2 4.25Å
548	V	86	Confident	86.3	Confident	65 Å²	65	77.8 Å²	77.8	39%	0.394	40%	0.396	S	S	.	.	H	α-helix	trans	-64.7	-51.1	176.3	174.8	0	0	0	0	110.2	H544 R545 L546 W550 R551 D552	H544-V548 WeakPolarHBondContact O-CG2 3.3Å; H544-V548 PolarHBondContact O-N 3.38Å; H544-V548 VanDerWaalsContact O-N 3.11Å; R545-V548 PolarHBondContact O-N 3.18Å; L546-V548 PolarHBondContact O-N 2.95Å; V548-W550 VanDerWaalsContact C-N 3.3Å; V548-W550 PolarHBondContact O-N 3.19Å; V548-R551 PolarHBondContact O-N 2.9Å; V548-R551 VanDerWaalsContact O-N 3.16Å; V548-D552 PolarHBondContact O-N 2.96Å
549	A	85.6	Confident	85.9	Confident	41 Å²	41	79 Å²	79	34%	0.339	41%	0.413	S	S	.	.	H	α-helix	trans	-59.3	-38.9	179.9	0	0	0	0	0	113	R545 L546 A553 L564	R545-A549 PolarHBondContact O-N 3.39Å; L546-A549 PolarHBondContact O-N 3.46Å; A549-A553 WeakPolarHBondContact O-CB 3.07Å; A549-A553 PolarHBondContact O-N 3.35Å; A549-L564 HydrophobicContact CB-CD1 4.49Å
550	W	85.3	Confident	85.7	Confident	49 Å²	49	79.9 Å²	79.9	19%	0.186	43%	0.425	C	S	.	.	H	α-helix	trans	-65.5	-44.6	176.7	175.3	40.5	0	0	0	112	L546 V548 D552 A553 Q554 A561 L564 R565 F568	L546-W550 VanDerWaalsContact O-CB 3.23Å; L546-W550 WeakPolarHBondContact O-CB 3.43Å; L546-W550 PolarHBondContact O-N 3.12Å; V548-W550 VanDerWaalsContact C-N 3.3Å; V548-W550 PolarHBondContact O-N 3.19Å; W550-D552 VanDerWaalsContact C-N 3.35Å; W550-D552 PolarHBondContact O-N 2.93Å; W550-A553 PolarHBondContact O-N 3.03Å; W550-Q554 WeakPolarHBondContact O-CB 2.92Å; W550-Q554 PolarHBondContact O-N 3.43Å; W550-A561 VanDerWaalsContact CD1-O 3.31Å; W550-A561 PolarHBondContact NE1-O 3.48Å; W550-L564 HydrophobicContact CB-CB 4.13Å; W550-L564 HydrophobicContact CG-CB 4.45Å; W550-R565 HydrophobicContact CH2-CG 4.25Å; W550-R565 HydrophobicContact CZ2-CB 4.15Å; W550-R565 HydrophobicContact CZ2-CG 3.68Å; W550-F568 HydrophobicContact CE3-CD1 4.48Å; W550-F568 HydrophobicContact CZ3-CD1 4.34Å; W550-F568 HydrophobicContact CZ3-CE1 4.46Å
551	R	85.4	Confident	85.6	Confident	127 Å²	127	77.2 Å²	77.2	48%	0.479	41%	0.413	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.2	-74.5	-179.4	-165.9	174.8	6.7	111.9	Q547 V548 Q554 Q555	Q547-R551 WeakPolarHBondContact O-CG 3.31Å; Q547-R551 PolarHBondContact O-N 3.48Å; Q547-R551 VanDerWaalsContact O-N 3.14Å; V548-R551 PolarHBondContact O-N 2.9Å; V548-R551 VanDerWaalsContact O-N 3.16Å; R551-Q554 PolarHBondContact O-N 2.99Å; R551-Q555 WeakPolarHBondContact O-CG 3.3Å; R551-Q555 PolarHBondContact O-N 3Å
552	D	84.3	Confident	85.4	Confident	90 Å²	90	77.8 Å²	77.8	48%	0.481	42%	0.419	S	S	.	.	H	α-helix	trans	-65.4	-45	179.3	-67.5	-13.4	0	0	0	111.2	V548 W550 Q554 Q555 S556	V548-D552 PolarHBondContact O-N 2.96Å; W550-D552 VanDerWaalsContact C-N 3.35Å; W550-D552 PolarHBondContact O-N 2.93Å; D552-Q554 VanDerWaalsContact C-N 3.27Å; D552-Q554 PolarHBondContact O-N 3.22Å; D552-Q555 PolarHBondContact O-N 2.89Å; D552-S556 PolarHBondContact O-N 3.39Å; D552-S556 PolarHBondContact O-OG 3.31Å
553	A	86.2	Confident	85.4	Confident	11 Å²	11	78.6 Å²	78.6	9%	0.091	42%	0.423	C	S	.	.	H	α-helix	trans	-62	-34.6	176.1	0	0	0	0	0	112.6	A549 W550 S556 S557 S558 A561 L564	A549-A553 WeakPolarHBondContact O-CB 3.07Å; A549-A553 PolarHBondContact O-N 3.35Å; W550-A553 PolarHBondContact O-N 3.03Å; A553-S556 WeakPolarHBondContact CA-OG 3.49Å; A553-S556 PolarHBondContact O-OG 3.05Å; A553-S557 PolarHBondContact O-N 3.38Å; A553-S558 PolarHBondContact O-N 3.16Å; A553-A561 HydrophobicContact CB-CB 4.16Å; A553-L564 HydrophobicContact CB-CD1 3.82Å
554	Q	85.3	Confident	85.4	Confident	119 Å²	119	79.8 Å²	79.8	56%	0.556	43%	0.429	S	S	*	.	H	α-helix	trans	-69.3	-41.8	175.2	-170.5	179.5	14.9	0	0	111.5	W550 R551 D552 S556 S557	W550-Q554 WeakPolarHBondContact O-CB 2.92Å; W550-Q554 PolarHBondContact O-N 3.43Å; R551-Q554 PolarHBondContact O-N 2.99Å; D552-Q554 VanDerWaalsContact C-N 3.27Å; D552-Q554 PolarHBondContact O-N 3.22Å; Q554-S556 VanDerWaalsContact C-N 3.3Å; Q554-S556 PolarHBondContact O-N 3.49Å; Q554-S557 PolarHBondContact O-N 3.01Å
555	Q	86	Confident	85.4	Confident	158 Å²	158	77.8 Å²	77.8	74%	0.738	42%	0.417	S	S	*	.	H	α-helix	trans	-66.3	-33.4	175.6	-71.4	176	23.6	0	0	112.3	R551 D552 S557	R551-Q555 WeakPolarHBondContact O-CG 3.3Å; R551-Q555 PolarHBondContact O-N 3Å; D552-Q555 PolarHBondContact O-N 2.89Å; Q555-S557 VanDerWaalsContact C-N 3.31Å
556	S	82.1	Confident	85.5	Confident	82 Å²	82	74.7 Å²	74.7	57%	0.573	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	5.7	177.3	74.6	0	0	0	0	114.1	D552 A553 Q554 S558	D552-S556 PolarHBondContact O-N 3.39Å; D552-S556 PolarHBondContact O-OG 3.31Å; A553-S556 WeakPolarHBondContact CA-OG 3.49Å; A553-S556 PolarHBondContact O-OG 3.05Å; Q554-S556 VanDerWaalsContact C-N 3.3Å; Q554-S556 PolarHBondContact O-N 3.49Å; S556-S558 PolarHBondContact O-N 3.07Å
557	S	81.6	Confident	85.6	Confident	110 Å²	110	76.8 Å²	76.8	77%	0.769	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	39.4	-175.7	-62.6	0	0	0	0	114.1	A553 Q554 Q555	A553-S557 PolarHBondContact O-N 3.38Å; Q554-S557 PolarHBondContact O-N 3.01Å; Q555-S557 VanDerWaalsContact C-N 3.31Å
558	S	82.9	Confident	85.7	Confident	42 Å²	42	74.6 Å²	74.6	29%	0.294	41%	0.408	S	S	.	.			trans	-77.9	138.3	-178.1	177.5	0	0	0	0	111.8	A553 S556 A560 A561	A553-S558 PolarHBondContact O-N 3.16Å; S556-S558 PolarHBondContact O-N 3.07Å; S558-A560 PolarHBondContact O-N 2.98Å; S558-A560 VanDerWaalsContact O-N 3.08Å; S558-A560 PolarHBondContact OG-N 3.35Å; S558-A561 WeakPolarHBondContact O-CB 3.48Å; S558-A561 PolarHBondContact O-N 3.33Å; S558-A561 VanDerWaalsContact O-N 3.1Å
559	P	80.1	Confident	85.8	Confident	123 Å²	123	72.1 Å²	72.1	80%	0.799	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.1	172.1	-20.4	30.9	0	0	0	113.9	A561	P559-A561 PolarHBondContact O-N 3.3Å
560	A	84.6	Confident	86	Confident	46 Å²	46	75 Å²	75	38%	0.38	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-11.6	178.1	0	0	0	0	0	113.7	S558 D562 N563 L564	S558-A560 PolarHBondContact O-N 2.98Å; S558-A560 VanDerWaalsContact O-N 3.08Å; S558-A560 PolarHBondContact OG-N 3.35Å; A560-D562 VanDerWaalsContact C-N 3.33Å; A560-D562 PolarHBondContact O-N 3.15Å; A560-N563 PolarHBondContact O-N 3.17Å; A560-L564 WeakPolarHBondContact O-CG 3.28Å; A560-L564 PolarHBondContact O-N 3.14Å
561	A	86.3	Confident	86.3	Confident	14 Å²	14	74.1 Å²	74.1	12%	0.116	39%	0.393	C	S	.	.	H	α-helix	trans	-61.4	-37.6	-176.1	0	0	0	0	0	112.9	W550 A553 S558 P559 L564 R565	W550-A561 VanDerWaalsContact CD1-O 3.31Å; W550-A561 PolarHBondContact NE1-O 3.48Å; A553-A561 HydrophobicContact CB-CB 4.16Å; S558-A561 WeakPolarHBondContact O-CB 3.48Å; S558-A561 PolarHBondContact O-N 3.33Å; S558-A561 VanDerWaalsContact O-N 3.1Å; P559-A561 PolarHBondContact O-N 3.3Å; A561-L564 PolarHBondContact O-N 2.98Å; A561-R565 WeakPolarHBondContact O-CB 3.49Å; A561-R565 PolarHBondContact O-N 3.48Å
562	D	85.5	Confident	86.6	Confident	110 Å²	110	70 Å²	70	59%	0.588	38%	0.379	S	S	*	.	H	α-helix	trans	-69.9	-40.2	179.2	-77.7	-39.2	0	0	0	112.7	A560 R565 E566	A560-D562 VanDerWaalsContact C-N 3.33Å; A560-D562 PolarHBondContact O-N 3.15Å; D562-R565 WeakPolarHBondContact O-CB 3.32Å; D562-R565 PolarHBondContact O-N 3.27Å; D562-E566 PolarHBondContact O-N 3.35Å
563	N	88.8	Confident	87	Confident	87 Å²	87	66.1 Å²	66.1	47%	0.465	36%	0.359	S	S	.	.	H	α-helix	trans	-64.3	-43	174.4	179.4	35.8	0	0	0	111.3	A560 R565 E566 Q567	A560-N563 PolarHBondContact O-N 3.17Å; N563-R565 VanDerWaalsContact C-N 3.31Å; N563-R565 PolarHBondContact O-N 2.96Å; N563-E566 PolarHBondContact O-N 3.43Å; N563-Q567 PolarHBondContact ND2-NE2 3.48Å; N563-Q567 WeakPolarHBondContact O-CG 3.45Å; N563-Q567 PolarHBondContact O-N 3.09Å; N563-Q567 PolarHBondContact OD1-NE2 3.35Å; N563-Q567 VanDerWaalsContact OD1-NE2 3.16Å
564	L	88.6	Confident	87.3	Confident	32 Å²	32	67.2 Å²	67.2	17%	0.168	36%	0.363	C	S	.	.	H	α-helix	trans	-63.4	-37.9	175.3	-71.4	172.9	0	0	0	112	L546 A549 W550 A553 A560 A561 Q567 F568	L546-L564 HydrophobicContact CD2-CD2 4.12Å; A549-L564 HydrophobicContact CB-CD1 4.49Å; W550-L564 HydrophobicContact CB-CB 4.13Å; W550-L564 HydrophobicContact CG-CB 4.45Å; A553-L564 HydrophobicContact CB-CD1 3.82Å; A560-L564 WeakPolarHBondContact O-CG 3.28Å; A560-L564 PolarHBondContact O-N 3.14Å; A561-L564 PolarHBondContact O-N 2.98Å; L564-Q567 PolarHBondContact O-N 3.32Å; L564-F568 WeakPolarHBondContact O-CB 3.18Å; L564-F568 PolarHBondContact O-N 3.27Å
565	R	87.4	Confident	87.6	Confident	78 Å²	78	63.2 Å²	63.2	29%	0.294	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-48.6	173.5	-171.9	179.3	66.8	77.7	3.4	111	W550 A561 D562 N563 Q567 F568 E569	W550-R565 HydrophobicContact CH2-CG 4.25Å; W550-R565 HydrophobicContact CZ2-CB 4.15Å; W550-R565 HydrophobicContact CZ2-CG 3.68Å; A561-R565 WeakPolarHBondContact O-CB 3.49Å; A561-R565 PolarHBondContact O-N 3.48Å; D562-R565 WeakPolarHBondContact O-CB 3.32Å; D562-R565 PolarHBondContact O-N 3.27Å; N563-R565 VanDerWaalsContact C-N 3.31Å; N563-R565 PolarHBondContact O-N 2.96Å; R565-Q567 VanDerWaalsContact C-N 3.35Å; R565-Q567 PolarHBondContact O-N 3.48Å; R565-F568 WeakPolarHBondContact O-CB 3.48Å; R565-F568 PolarHBondContact O-N 3.16Å; R565-F568 VanDerWaalsContact O-N 3.15Å; R565-E569 IonicContact NH1-OE1 2.78Å; R565-E569 WeakPolarHBondContact O-CG 3.5Å; R565-E569 PolarHBondContact O-N 3.36Å
566	E	87.6	Confident	88	Confident	90 Å²	90	56.3 Å²	56.3	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-42.5	179.3	-170.2	-178.7	172	0	0	112.2	D562 N563 F568 E569 R570	D562-E566 PolarHBondContact O-N 3.35Å; N563-E566 PolarHBondContact O-N 3.43Å; E566-F568 VanDerWaalsContact C-N 3.31Å; E566-F568 PolarHBondContact O-N 3.05Å; E566-E569 PolarHBondContact O-N 3.47Å; E566-R570 WeakPolarHBondContact O-CG 3.25Å; E566-R570 PolarHBondContact O-N 3.1Å; E566-R570 IonicContact OE1-CZ 3.97Å; E566-R570 IonicContact OE1-NE 3.54Å; E566-R570 PolarHBondContact OE1-NE 3.22Å; E566-R570 IonicContact OE1-NH2 3.69Å; E566-R570 PolarHBondContact OE1-NH2 2.8Å
567	Q	89.1	Confident	88.6	Confident	80 Å²	80	52.4 Å²	52.4	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-40.1	173.8	-70.1	176.1	25.2	0	0	112.1	N563 L564 R565 L571	N563-Q567 PolarHBondContact ND2-NE2 3.48Å; N563-Q567 WeakPolarHBondContact O-CG 3.45Å; N563-Q567 PolarHBondContact O-N 3.09Å; N563-Q567 PolarHBondContact OD1-NE2 3.35Å; N563-Q567 VanDerWaalsContact OD1-NE2 3.16Å; L564-Q567 PolarHBondContact O-N 3.32Å; R565-Q567 VanDerWaalsContact C-N 3.35Å; R565-Q567 PolarHBondContact O-N 3.48Å; Q567-L571 WeakPolarHBondContact O-CB 3.43Å; Q567-L571 PolarHBondContact O-N 3.38Å
568	F	90.4	Very high	89.2	Confident	13 Å²	13	47.7 Å²	47.7	6%	0.057	25%	0.25	C	S	.	.	H	α-helix	trans	-63.6	-45.3	175.4	178.4	-93.7	0	0	0	112	L543 L546 Q547 W550 L564 R565 E566 L571 M572	L543-F568 HydrophobicContact CD2-CD2 3.98Å; L543-F568 HydrophobicContact CD2-CE2 3.96Å; L546-F568 HydrophobicContact CB-CD2 4.46Å; Q547-F568 HydrophobicContact CB-CD2 4.36Å; Q547-F568 HydrophobicContact CB-CE2 3.9Å; Q547-F568 HydrophobicContact CG-CE2 4.25Å; W550-F568 HydrophobicContact CE3-CD1 4.48Å; W550-F568 HydrophobicContact CZ3-CD1 4.34Å; W550-F568 HydrophobicContact CZ3-CE1 4.46Å; L564-F568 WeakPolarHBondContact O-CB 3.18Å; L564-F568 PolarHBondContact O-N 3.27Å; R565-F568 WeakPolarHBondContact O-CB 3.48Å; R565-F568 PolarHBondContact O-N 3.16Å; R565-F568 VanDerWaalsContact O-N 3.15Å; E566-F568 VanDerWaalsContact C-N 3.31Å; E566-F568 PolarHBondContact O-N 3.05Å; F568-L571 PolarHBondContact O-N 3.35Å; F568-M572 HydrophobicContact CE1-CE 3.99Å; F568-M572 HydrophobicContact CE2-CE 3.9Å; F568-M572 HydrophobicContact CZ-CE 3.35Å; F568-M572 VanDerWaalsContact O-CB 3.23Å; F568-M572 WeakPolarHBondContact O-CB 3.24Å; F568-M572 PolarHBondContact O-N 2.83Å
569	E	89.6	Confident	89.8	Confident	13 Å²	13	47.8 Å²	47.8	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-57.9	-50.6	175.6	-62.9	-66.5	176.8	0	0	111.2	P362 S363 R565 E566 L571 M572 T573	P362-E569 WeakPolarHBondContact CD-OE2 3.43Å; S363-E569 WeakPolarHBondContact CB-OE1 3.28Å; S363-E569 WeakPolarHBondContact CB-OE2 3.37Å; S363-E569 PolarHBondContact N-OE2 3.22Å; S363-E569 VanDerWaalsContact OG-CD 3.25Å; S363-E569 PolarHBondContact OG-OE1 3.02Å; S363-E569 PolarHBondContact OG-OE2 2.9Å; R565-E569 IonicContact NH1-OE1 2.78Å; R565-E569 WeakPolarHBondContact O-CG 3.5Å; R565-E569 PolarHBondContact O-N 3.36Å; E566-E569 PolarHBondContact O-N 3.47Å; E569-L571 VanDerWaalsContact C-N 3.35Å; E569-L571 PolarHBondContact O-N 3.13Å; E569-M572 PolarHBondContact O-N 3.11Å; E569-M572 VanDerWaalsContact O-N 3.17Å; E569-T573 PolarHBondContact O-N 3.42Å; E569-T573 PolarHBondContact O-OG1 3.24Å
570	R	90	Very high	90.6	Very high	100 Å²	100	42 Å²	42	38%	0.377	21%	0.208	S	C	.	.	H	α-helix	trans	-57.3	-48.7	-179.5	-71.3	174	-176.5	-143.4	0.3	110.8	V353 E566 M572 T573 I574	V353-R570 HydrophobicContact CG2-CB 4.06Å; V353-R570 HydrophobicContact CG2-CG 4.25Å; E566-R570 WeakPolarHBondContact O-CG 3.25Å; E566-R570 PolarHBondContact O-N 3.1Å; E566-R570 IonicContact OE1-CZ 3.97Å; E566-R570 IonicContact OE1-NE 3.54Å; E566-R570 PolarHBondContact OE1-NE 3.22Å; E566-R570 IonicContact OE1-NH2 3.69Å; E566-R570 PolarHBondContact OE1-NH2 2.8Å; R570-M572 VanDerWaalsContact C-N 3.33Å; R570-M572 PolarHBondContact O-N 3.15Å; R570-T573 PolarHBondContact O-N 3.15Å; R570-I574 WeakPolarHBondContact O-CG1 3.39Å; R570-I574 PolarHBondContact O-N 2.99Å; R570-I574 VanDerWaalsContact O-N 3.15Å
571	L	90.7	Very high	91.1	Very high	31 Å²	31	39.8 Å²	39.8	16%	0.162	19%	0.19	C	C	.	.	H	α-helix	trans	-68.5	-33	-179.9	-167.8	63.9	0	0	0	112.3	I539 N542 L543 L546 Q567 F568 E569 I574 Y575	I539-L571 HydrophobicContact CG1-CD1 4.44Å; I539-L571 HydrophobicContact CG2-CD1 3.87Å; I539-L571 HydrophobicContact CG2-CG 4.1Å; N542-L571 HydrophobicContact CB-CD2 3.83Å; L543-L571 HydrophobicContact CB-CD2 4.44Å; L543-L571 HydrophobicContact CD2-CB 3.75Å; L543-L571 HydrophobicContact CD2-CD2 3.78Å; L543-L571 HydrophobicContact CD2-CG 3.71Å; L543-L571 HydrophobicContact CG-CB 4.39Å; L543-L571 HydrophobicContact CG-CD2 3.7Å; L543-L571 HydrophobicContact CG-CG 3.78Å; L546-L571 HydrophobicContact CD1-CD2 3.71Å; Q567-L571 WeakPolarHBondContact O-CB 3.43Å; Q567-L571 PolarHBondContact O-N 3.38Å; F568-L571 PolarHBondContact O-N 3.35Å; E569-L571 VanDerWaalsContact C-N 3.35Å; E569-L571 PolarHBondContact O-N 3.13Å; L571-I574 PolarHBondContact O-N 3.23Å; L571-Y575 WeakPolarHBondContact O-CB 3.47Å; L571-Y575 PolarHBondContact O-N 3.49Å
572	M	91.7	Very high	91.6	Very high	41 Å²	41	39.1 Å²	39.1	20%	0.202	18%	0.184	C	C	.	.	H	α-helix	trans	-68.7	-40.9	176.6	-174.6	63.4	71.1	0	0	111.2	P362 L543 F568 E569 R570 I574 Y575 L576	P362-M572 HydrophobicContact CB-CB 4.41Å; P362-M572 HydrophobicContact CB-CG 3.71Å; P362-M572 HydrophobicContact CG-CB 3.63Å; P362-M572 HydrophobicContact CG-CG 3.48Å; P362-M572 VanDerWaalsContact CG-CG 3.48Å; L543-M572 HydrophobicContact CD1-CE 4.16Å; L543-M572 HydrophobicContact CD1-SD 4.18Å; L543-M572 HydrophobicContact CD2-CB 4.25Å; L543-M572 HydrophobicContact CD2-CE 4.11Å; F568-M572 HydrophobicContact CE1-CE 3.99Å; F568-M572 HydrophobicContact CE2-CE 3.9Å; F568-M572 HydrophobicContact CZ-CE 3.35Å; F568-M572 VanDerWaalsContact O-CB 3.23Å; F568-M572 WeakPolarHBondContact O-CB 3.24Å; F568-M572 PolarHBondContact O-N 2.83Å; E569-M572 PolarHBondContact O-N 3.11Å; E569-M572 VanDerWaalsContact O-N 3.17Å; R570-M572 VanDerWaalsContact C-N 3.33Å; R570-M572 PolarHBondContact O-N 3.15Å; M572-I574 VanDerWaalsContact C-N 3.32Å; M572-I574 PolarHBondContact O-N 3.05Å; M572-Y575 PolarHBondContact O-N 3.32Å; M572-Y575 HydrophobicContact SD-CD1 4.08Å; M572-L576 HydrophobicContact CG-CD1 4.05Å; M572-L576 HydrophobicContact CG-CG 4.3Å; M572-L576 WeakPolarHBondContact O-CB 3.41Å; M572-L576 WeakPolarHBondContact O-CG 3.3Å; M572-L576 PolarHBondContact O-N 2.89Å; M572-L576 HydrophobicContact SD-CD1 4.43Å; M572-L576 HydrophobicContact SD-CG 4.2Å
573	T	92.5	Very high	92	Very high	8 Å²	8	34.4 Å²	34.4	5%	0.049	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-42.8	173.4	-65.8	0	0	0	0	111.1	V353 Y358 F359 P362 E569 R570 S577	V353-T573 HydrophobicContact CG1-CG2 3.86Å; Y358-T573 WeakPolarHBondContact O-CG2 3.15Å; F359-T573 HydrophobicContact CB-CG2 4.47Å; F359-T573 PolarHBondContact O-OG1 3.41Å; P362-T573 WeakPolarHBondContact CD-OG1 3.48Å; E569-T573 PolarHBondContact O-N 3.42Å; E569-T573 PolarHBondContact O-OG1 3.24Å; R570-T573 PolarHBondContact O-N 3.15Å; T573-S577 VanDerWaalsContact O-CB 3.26Å; T573-S577 WeakPolarHBondContact O-CB 3.31Å; T573-S577 PolarHBondContact O-N 3.49Å; T573-S577 PolarHBondContact O-OG 3.33Å
574	I	92.1	Very high	92.4	Very high	34 Å²	34	30.8 Å²	30.8	17%	0.174	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-47.9	174.5	-65.7	169.1	0	0	0	110.7	L347 V353 I539 R570 L571 M572 S577 T578	L347-I574 HydrophobicContact CD1-CD1 3.86Å; L347-I574 HydrophobicContact CD1-CG1 3.54Å; L347-I574 HydrophobicContact CG-CG1 4.28Å; V353-I574 HydrophobicContact CG2-CD1 4.26Å; V353-I574 HydrophobicContact CG2-CG1 4.29Å; I539-I574 HydrophobicContact CD1-CG2 4Å; R570-I574 WeakPolarHBondContact O-CG1 3.39Å; R570-I574 PolarHBondContact O-N 2.99Å; R570-I574 VanDerWaalsContact O-N 3.15Å; L571-I574 PolarHBondContact O-N 3.23Å; M572-I574 VanDerWaalsContact C-N 3.32Å; M572-I574 PolarHBondContact O-N 3.05Å; I574-S577 PolarHBondContact O-N 3.19Å; I574-T578 WeakPolarHBondContact O-CB 3.33Å; I574-T578 PolarHBondContact O-N 3.22Å; I574-T578 PolarHBondContact O-OG1 3.33Å
575	Y	93	Very high	92.7	Very high	35 Å²	35	32.6 Å²	32.6	14%	0.137	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-47.8	-179.6	175.4	-103.9	0	0	0	112.6	M536 I539 N540 L543 L571 M572 T578 K579	M536-Y575 HydrophobicContact CE-CD2 4.31Å; M536-Y575 HydrophobicContact CE-CE2 3.65Å; M536-Y575 HydrophobicContact CG-CD2 4.38Å; M536-Y575 HydrophobicContact CG-CE2 4.16Å; I539-Y575 HydrophobicContact CG2-CD2 4.01Å; I539-Y575 HydrophobicContact CG2-CG 4.35Å; N540-Y575 HydrophobicContact CB-CD2 4.48Å; N540-Y575 HydrophobicContact CB-CE2 3.99Å; L543-Y575 VanDerWaalsContact CD1-CB 3.48Å; L543-Y575 HydrophobicContact CD1-CD1 3.97Å; L543-Y575 HydrophobicContact CD1-CD2 4.13Å; L543-Y575 HydrophobicContact CD1-CG 3.58Å; L571-Y575 WeakPolarHBondContact O-CB 3.47Å; L571-Y575 PolarHBondContact O-N 3.49Å; M572-Y575 PolarHBondContact O-N 3.32Å; M572-Y575 HydrophobicContact SD-CD1 4.08Å; Y575-T578 PolarHBondContact O-N 3.12Å; Y575-K579 VanDerWaalsContact O-CB 3.29Å; Y575-K579 WeakPolarHBondContact O-CB 3.37Å; Y575-K579 PolarHBondContact O-N 3.02Å
576	L	94.2	Very high	93	Very high	13 Å²	13	33.4 Å²	33.4	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-39.9	179.7	-69.3	176.1	0	0	0	111.9	F359 P362 I370 M572 T580	F359-L576 HydrophobicContact CB-CB 4.25Å; F359-L576 HydrophobicContact CB-CD1 4.22Å; F359-L576 HydrophobicContact CD1-CB 3.99Å; F359-L576 HydrophobicContact CD1-CD1 4.02Å; F359-L576 HydrophobicContact CD2-CB 3.94Å; F359-L576 HydrophobicContact CE1-CB 4.34Å; F359-L576 HydrophobicContact CE2-CB 4.3Å; F359-L576 HydrophobicContact CG-CB 3.78Å; F359-L576 HydrophobicContact CG-CD1 4.23Å; F359-L576 HydrophobicContact CZ-CB 4.49Å; P362-L576 HydrophobicContact CB-CD1 3.52Å; P362-L576 HydrophobicContact CG-CD1 4.45Å; I370-L576 HydrophobicContact CD1-CD1 4.16Å; I370-L576 HydrophobicContact CG2-CD1 4.29Å; I370-L576 HydrophobicContact CG2-CD2 3.96Å; M572-L576 HydrophobicContact CG-CD1 4.05Å; M572-L576 HydrophobicContact CG-CG 4.3Å; M572-L576 WeakPolarHBondContact O-CB 3.41Å; M572-L576 WeakPolarHBondContact O-CG 3.3Å; M572-L576 PolarHBondContact O-N 2.89Å; M572-L576 HydrophobicContact SD-CD1 4.43Å; M572-L576 HydrophobicContact SD-CG 4.2Å; L576-T580 VanDerWaalsContact O-CB 3.3Å; L576-T580 WeakPolarHBondContact O-CB 3.26Å; L576-T580 PolarHBondContact O-N 3.16Å; L576-T580 PolarHBondContact O-OG1 3.48Å
577	S	94.8	Very high	93.4	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-62.4	-45.6	174.5	-60	0	0	0	0	111.5	C345 H356 T573 I574 T580 A581	C345-S577 WeakPolarHBondContact O-CB 3.37Å; H356-S577 PolarHBondContact NE2-OG 3.36Å; T573-S577 VanDerWaalsContact O-CB 3.26Å; T573-S577 WeakPolarHBondContact O-CB 3.31Å; T573-S577 PolarHBondContact O-N 3.49Å; T573-S577 PolarHBondContact O-OG 3.33Å; I574-S577 PolarHBondContact O-N 3.19Å; S577-T580 PolarHBondContact O-N 2.9Å; S577-A581 WeakPolarHBondContact O-CB 3.48Å; S577-A581 PolarHBondContact O-N 3.34Å
578	T	94.1	Very high	93.7	Very high	10 Å²	10	25.9 Å²	25.9	6%	0.061	13%	0.126	C	C	.	.	H	α-helix	trans	-64.6	-46.8	177.9	-54	0	0	0	0	111.6	L532 M536 I574 Y575 T580 A581 M582	L532-T578 HydrophobicContact CD1-CG2 3.92Å; L532-T578 HydrophobicContact CD2-CG2 4.1Å; L532-T578 HydrophobicContact CG-CG2 3.89Å; M536-T578 HydrophobicContact CB-CG2 4.28Å; M536-T578 HydrophobicContact CG-CG2 4.33Å; M536-T578 HydrophobicContact SD-CG2 4.43Å; I574-T578 WeakPolarHBondContact O-CB 3.33Å; I574-T578 PolarHBondContact O-N 3.22Å; I574-T578 PolarHBondContact O-OG1 3.33Å; Y575-T578 PolarHBondContact O-N 3.12Å; T578-T580 PolarHBondContact O-N 3.42Å; T578-A581 PolarHBondContact O-N 3.09Å; T578-M582 HydrophobicContact CG2-SD 4.09Å; T578-M582 WeakPolarHBondContact O-CG 3.49Å; T578-M582 PolarHBondContact O-N 3.36Å
579	K	94.7	Very high	93.9	Very high	45 Å²	45	28.2 Å²	28.2	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-55.5	-52.3	175	-176.7	-170.4	166.8	-138.8	0	110.4	E374 M536 Y575 A581 M582 T583	E374-K579 WeakPolarHBondContact OE1-CE 3.32Å; E374-K579 IonicContact OE1-NZ 3.84Å; E374-K579 PolarHBondContact OE1-NZ 3.3Å; E374-K579 IonicContact OE2-NZ 2.66Å; E374-K579 PolarHBondContact OE2-NZ 2.86Å; M536-K579 HydrophobicContact CE-CB 3.48Å; M536-K579 VanDerWaalsContact CE-CB 3.48Å; M536-K579 HydrophobicContact CE-CG 3.78Å; Y575-K579 VanDerWaalsContact O-CB 3.29Å; Y575-K579 WeakPolarHBondContact O-CB 3.37Å; Y575-K579 PolarHBondContact O-N 3.02Å; K579-A581 VanDerWaalsContact C-N 3.34Å; K579-A581 PolarHBondContact O-N 3.16Å; K579-M582 PolarHBondContact O-N 3.48Å; K579-M582 VanDerWaalsContact O-N 3.16Å; K579-T583 HydrophobicContact CG-CG2 4.15Å; K579-T583 WeakPolarHBondContact O-CB 3.46Å; K579-T583 VanDerWaalsContact O-CG2 3.3Å; K579-T583 WeakPolarHBondContact O-CG2 3.37Å; K579-T583 PolarHBondContact O-N 3.16Å; K579-T583 PolarHBondContact O-OG1 2.91Å
580	T	96	Very high	94.2	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-58.9	-47	-177.1	-59.3	0	0	0	0	110.8	F359 E374 I377 H378 L576 S577 T578 M582 T583	F359-T580 WeakPolarHBondContact CE2-OG1 3.36Å; F359-T580 HydrophobicContact CZ-CG2 4.29Å; F359-T580 WeakPolarHBondContact CZ-OG1 3.39Å; E374-T580 HydrophobicContact CB-CG2 4.43Å; E374-T580 HydrophobicContact CG-CG2 4.1Å; I377-T580 HydrophobicContact CB-CG2 3.78Å; I377-T580 HydrophobicContact CD1-CG2 4.02Å; I377-T580 HydrophobicContact CG2-CG2 3.6Å; H378-T580 PolarHBondContact CD2-O 2.91Å; H378-T580 PolarHBondContact NE2-O 3.47Å; L576-T580 VanDerWaalsContact O-CB 3.3Å; L576-T580 WeakPolarHBondContact O-CB 3.26Å; L576-T580 PolarHBondContact O-N 3.16Å; L576-T580 PolarHBondContact O-OG1 3.48Å; S577-T580 PolarHBondContact O-N 2.9Å; T578-T580 PolarHBondContact O-N 3.42Å; T580-M582 VanDerWaalsContact C-N 3.3Å; T580-M582 PolarHBondContact O-N 3.45Å; T580-T583 PolarHBondContact O-N 3.49Å
581	A	95.9	Very high	94.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.8	-34.9	178.4	0	0	0	0	0	113.5	L346 M381 L443 S577 T578 K579	L346-A581 HydrophobicContact CD2-CB 3.69Å; L346-A581 HydrophobicContact CG-CB 3.98Å; M381-A581 HydrophobicContact CE-CB 4.29Å; M381-A581 VanDerWaalsContact CE-O 3.31Å; M381-A581 WeakPolarHBondContact CE-O 3.45Å; L443-A581 HydrophobicContact CD1-CB 3.87Å; S577-A581 WeakPolarHBondContact O-CB 3.48Å; S577-A581 PolarHBondContact O-N 3.34Å; T578-A581 PolarHBondContact O-N 3.09Å; K579-A581 VanDerWaalsContact C-N 3.34Å; K579-A581 PolarHBondContact O-N 3.16Å
582	M	95.9	Very high	94.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-86.9	-11.9	-178.8	-66.5	-173.6	76.2	0	0	114	L443 F529 L532 H533 M536 T578 K579 T580 L588 F645	L443-M582 HydrophobicContact CD1-CG 4.44Å; F529-M582 HydrophobicContact CD1-CE 4.15Å; F529-M582 HydrophobicContact CD2-CE 3.76Å; F529-M582 HydrophobicContact CE1-CE 3.96Å; F529-M582 HydrophobicContact CE2-CB 4.36Å; F529-M582 HydrophobicContact CE2-CE 3.56Å; F529-M582 HydrophobicContact CG-CE 4.05Å; F529-M582 HydrophobicContact CZ-CE 3.66Å; L532-M582 HydrophobicContact CB-CE 4.23Å; L532-M582 HydrophobicContact CB-SD 4.02Å; L532-M582 HydrophobicContact CD2-CG 3.65Å; L532-M582 HydrophobicContact CD2-SD 3.61Å; L532-M582 HydrophobicContact CG-CE 4.43Å; L532-M582 HydrophobicContact CG-CG 4.31Å; L532-M582 HydrophobicContact CG-SD 3.57Å; L532-M582 VanDerWaalsContact CG-SD 3.57Å; H533-M582 HydrophobicContact CB-CE 4.01Å; M536-M582 HydrophobicContact SD-SD 3.97Å; T578-M582 HydrophobicContact CG2-SD 4.09Å; T578-M582 WeakPolarHBondContact O-CG 3.49Å; T578-M582 PolarHBondContact O-N 3.36Å; K579-M582 PolarHBondContact O-N 3.48Å; K579-M582 VanDerWaalsContact O-N 3.16Å; T580-M582 VanDerWaalsContact C-N 3.3Å; T580-M582 PolarHBondContact O-N 3.45Å; M582-L588 VanDerWaalsContact O-CD2 3.31Å; M582-L588 WeakPolarHBondContact O-CD2 3.16Å; M582-F645 HydrophobicContact CB-CE2 4.01Å; M582-F645 HydrophobicContact CB-CZ 3.73Å; M582-F645 HydrophobicContact CE-CD2 4.08Å; M582-F645 HydrophobicContact CE-CE2 3.71Å; M582-F645 HydrophobicContact CE-CZ 4.37Å; M582-F645 HydrophobicContact SD-CE2 4.14Å
583	T	95.9	Very high	94.9	Very high	11 Å²	11	22.3 Å²	22.3	7%	0.067	11%	0.114	C	C	.	.			trans	-112.8	17.1	-172.3	55.3	0	0	0	0	114.3	E374 H378 K579 T580 P585 F645 F649	E374-T583 PolarHBondContact OE1-OG1 3.01Å; H378-T583 PolarHBondContact CE1-O 3.39Å; K579-T583 HydrophobicContact CG-CG2 4.15Å; K579-T583 WeakPolarHBondContact O-CB 3.46Å; K579-T583 VanDerWaalsContact O-CG2 3.3Å; K579-T583 WeakPolarHBondContact O-CG2 3.37Å; K579-T583 PolarHBondContact O-N 3.16Å; K579-T583 PolarHBondContact O-OG1 2.91Å; T580-T583 PolarHBondContact O-N 3.49Å; T583-P585 WeakPolarHBondContact O-CD 3.33Å; T583-F645 HydrophobicContact CG2-CE1 4.32Å; T583-F645 HydrophobicContact CG2-CZ 3.86Å; T583-F649 HydrophobicContact CG2-CB 4.24Å
584	E	95.8	Very high	95.1	Very high	10 Å²	10	22 Å²	22	5%	0.047	11%	0.112	C	C	.	.			trans	-59	119.7	173.1	-166.3	-75	120.5	0	0	109.8	H378 M381 Q586 M587 L588	H378-E584 HydrophobicContact CB-CG 4.16Å; H378-E584 PolarHBondContact NE2-N 3.23Å; M381-E584 HydrophobicContact CB-CG 3.95Å; M381-E584 HydrophobicContact CE-CB 4.27Å; M381-E584 HydrophobicContact SD-CB 4.37Å; E584-Q586 PolarHBondContact O-N 3.34Å; E584-Q586 WeakPolarHBondContact OE1-CB 3.4Å; E584-Q586 PolarHBondContact OE1-N 2.91Å; E584-Q586 PolarHBondContact OE2-N 3.28Å; E584-M587 HydrophobicContact CB-CB 4.31Å; E584-M587 PolarHBondContact O-N 3.07Å; E584-M587 WeakPolarHBondContact OE2-CB 3.16Å; E584-M587 PolarHBondContact OE2-N 3.2Å; E584-L588 WeakPolarHBondContact O-CG 3.08Å; E584-L588 PolarHBondContact O-N 3.14Å
585	P	94.6	Very high	95.3	Very high	71 Å²	71	20.5 Å²	20.5	46%	0.461	11%	0.105	S	C	.	.	H	α-helix	trans	-59	-40.6	-168.5	-28.7	35.7	0	0	0	115.1	T583 L588 Q589	T583-P585 WeakPolarHBondContact O-CD 3.33Å; P585-L588 PolarHBondContact O-N 3.17Å; P585-Q589 WeakPolarHBondContact O-CB 3.1Å; P585-Q589 PolarHBondContact O-N 3.48Å
586	Q	94.3	Very high	95.4	Very high	95 Å²	95	19 Å²	19	44%	0.444	10%	0.099	S	C	.	.	H	α-helix	trans	-70.6	-40.3	-177.1	-174.4	62	58	0	0	111.7	E584 Q589 N590	E584-Q586 PolarHBondContact O-N 3.34Å; E584-Q586 WeakPolarHBondContact OE1-CB 3.4Å; E584-Q586 PolarHBondContact OE1-N 2.91Å; E584-Q586 PolarHBondContact OE2-N 3.28Å; Q586-Q589 PolarHBondContact O-N 3.42Å; Q586-N590 PolarHBondContact NE2-OD1 3.18Å; Q586-N590 VanDerWaalsContact NE2-OD1 3.09Å; Q586-N590 WeakPolarHBondContact O-CB 3.45Å; Q586-N590 PolarHBondContact O-N 3.47Å; Q586-N590 PolarHBondContact O-ND2 2.98Å; Q586-N590 PolarHBondContact O-OD1 3.45Å
587	M	95.2	Very high	95.5	Very high	10 Å²	10	18.3 Å²	18.3	5%	0.049	10%	0.095	C	C	.	.	H	α-helix	trans	-62.2	-45.9	173.3	-178.6	-170.7	69.7	0	0	110.4	A447 L450 E584 Q589 N590 C591	A447-M587 HydrophobicContact CB-CG 4.12Å; A447-M587 HydrophobicContact CB-SD 4.09Å; L450-M587 HydrophobicContact CD1-CG 4.2Å; E584-M587 HydrophobicContact CB-CB 4.31Å; E584-M587 PolarHBondContact O-N 3.07Å; E584-M587 WeakPolarHBondContact OE2-CB 3.16Å; E584-M587 PolarHBondContact OE2-N 3.2Å; M587-Q589 PolarHBondContact O-N 3.24Å; M587-N590 PolarHBondContact O-N 3.26Å; M587-C591 WeakPolarHBondContact O-CB 3.44Å; M587-C591 PolarHBondContact O-N 3.31Å
588	L	96.1	Very high	95.6	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-61.3	-43.3	176.5	-73.9	-172	0	0	0	111.8	F529 M582 E584 P585 C591 L592 F642 F645 L646 A650 I653	F529-L588 HydrophobicContact CE2-CD2 4.46Å; M582-L588 VanDerWaalsContact O-CD2 3.31Å; M582-L588 WeakPolarHBondContact O-CD2 3.16Å; E584-L588 WeakPolarHBondContact O-CG 3.08Å; E584-L588 PolarHBondContact O-N 3.14Å; P585-L588 PolarHBondContact O-N 3.17Å; L588-C591 PolarHBondContact O-N 2.84Å; L588-L592 WeakPolarHBondContact O-CB 3.43Å; L588-L592 PolarHBondContact O-N 3.15Å; L588-F642 HydrophobicContact CD2-CE2 3.71Å; L588-F642 HydrophobicContact CD2-CZ 4.23Å; L588-F642 WeakPolarHBondContact O-CZ 3.08Å; L588-F645 HydrophobicContact CD1-CE1 4.44Å; L588-F645 HydrophobicContact CD2-CD1 4.46Å; L588-F645 HydrophobicContact CD2-CE1 3.89Å; L588-L646 HydrophobicContact CD1-CD2 4.17Å; L588-L646 HydrophobicContact CD2-CD2 4.21Å; L588-A650 HydrophobicContact CD1-CB 3.72Å; L588-I653 HydrophobicContact CB-CD1 3.53Å; L588-I653 HydrophobicContact CD1-CD1 3.5Å; L588-I653 VanDerWaalsContact CD1-CD1 3.5Å; L588-I653 HydrophobicContact CG-CD1 4.18Å
589	Q	94.9	Very high	95.7	Very high	61 Å²	61	17.8 Å²	17.8	29%	0.285	9%	0.092	S	C	.	.	H	α-helix	trans	-63.3	-43.5	175.9	-172.1	61.6	54.1	0	0	111.9	P585 Q586 M587 C591 L592 N593	P585-Q589 WeakPolarHBondContact O-CB 3.1Å; P585-Q589 PolarHBondContact O-N 3.48Å; Q586-Q589 PolarHBondContact O-N 3.42Å; M587-Q589 PolarHBondContact O-N 3.24Å; Q589-C591 VanDerWaalsContact C-N 3.31Å; Q589-C591 PolarHBondContact O-N 2.95Å; Q589-L592 PolarHBondContact O-N 2.93Å; Q589-N593 PolarHBondContact NE2-OD1 2.81Å; Q589-N593 VanDerWaalsContact NE2-OD1 3.12Å; Q589-N593 PolarHBondContact O-N 2.88Å; Q589-N593 PolarHBondContact O-ND2 3.03Å; Q589-N593 PolarHBondContact O-OD1 3.12Å
590	N	95.9	Very high	95.8	Very high	10 Å²	10	16.4 Å²	16.4	5%	0.053	9%	0.087	C	C	.	.	H	α-helix	trans	-62.7	-39.3	176.8	-73.7	-13.2	0	0	0	111.9	L450 Q454 Q586 M587 L594	L450-N590 HydrophobicContact CB-CB 4.38Å; Q454-N590 HydrophobicContact CG-CB 4.47Å; Q454-N590 PolarHBondContact NE2-O 3.18Å; Q454-N590 PolarHBondContact OE1-OD1 3.28Å; Q586-N590 PolarHBondContact NE2-OD1 3.18Å; Q586-N590 VanDerWaalsContact NE2-OD1 3.09Å; Q586-N590 WeakPolarHBondContact O-CB 3.45Å; Q586-N590 PolarHBondContact O-N 3.47Å; Q586-N590 PolarHBondContact O-ND2 2.98Å; Q586-N590 PolarHBondContact O-OD1 3.45Å; M587-N590 PolarHBondContact O-N 3.26Å; N590-L594 PolarHBondContact O-N 2.94Å; N590-L594 VanDerWaalsContact O-N 3.11Å
591	C	96.4	Very high	95.8	Very high	5 Å²	5	16.5 Å²	16.5	3%	0.034	9%	0.088	C	C	.	.	H	α-helix	trans	-66.6	-44.5	175.3	-166.4	0	0	0	0	111	L450 M587 L588 Q589 N593 L594 Q595 F642	L450-C591 HydrophobicContact CD1-CB 4.03Å; L450-C591 HydrophobicContact CD2-CB 4.32Å; M587-C591 WeakPolarHBondContact O-CB 3.44Å; M587-C591 PolarHBondContact O-N 3.31Å; L588-C591 PolarHBondContact O-N 2.84Å; Q589-C591 VanDerWaalsContact C-N 3.31Å; Q589-C591 PolarHBondContact O-N 2.95Å; C591-N593 PolarHBondContact O-N 3.25Å; C591-L594 WeakPolarHBondContact O-CB 3.34Å; C591-L594 PolarHBondContact O-N 3.21Å; C591-L594 VanDerWaalsContact O-N 3.14Å; C591-Q595 WeakPolarHBondContact O-CG 3.48Å; C591-Q595 PolarHBondContact O-N 2.91Å; C591-F642 HydrophobicContact CB-CD2 4.25Å; C591-F642 HydrophobicContact CB-CE1 4.31Å; C591-F642 HydrophobicContact CB-CE2 3.61Å; C591-F642 HydrophobicContact CB-CZ 3.65Å; C591-F642 WeakPolarHBondContact SG-CD2 3.5Å; C591-F642 WeakPolarHBondContact SG-CE2 3.49Å
592	L	95.7	Very high	95.8	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-58.7	-46.6	175	-179	63.7	0	0	0	111.8	L588 Q589 L594 Q595 V596 F642 L643 L646 I653 S657	L588-L592 WeakPolarHBondContact O-CB 3.43Å; L588-L592 PolarHBondContact O-N 3.15Å; Q589-L592 PolarHBondContact O-N 2.93Å; L592-L594 VanDerWaalsContact C-N 3.26Å; L592-L594 PolarHBondContact O-N 3.19Å; L592-Q595 PolarHBondContact O-N 2.93Å; L592-V596 HydrophobicContact CD1-CG2 3.82Å; L592-V596 HydrophobicContact CG-CG2 4.16Å; L592-V596 WeakPolarHBondContact O-CB 3.4Å; L592-V596 WeakPolarHBondContact O-CG2 3.35Å; L592-V596 PolarHBondContact O-N 3.4Å; L592-F642 VanDerWaalsContact CA-CE1 3.5Å; L592-F642 HydrophobicContact CB-CE1 3.8Å; L592-F642 HydrophobicContact CB-CZ 4.2Å; L592-F642 HydrophobicContact CD1-CE1 4.06Å; L592-L643 HydrophobicContact CD1-CD2 4.29Å; L592-L646 HydrophobicContact CD1-CD1 4.14Å; L592-I653 HydrophobicContact CD2-CG2 3.88Å; L592-S657 WeakPolarHBondContact CD2-OG 3.49Å
593	N	95.7	Very high	95.8	Very high	43 Å²	43	16.9 Å²	16.9	23%	0.23	9%	0.09	C	C	.	.	H	α-helix	trans	-58.2	-41	176.9	-65.3	-14.8	0	0	0	111.6	Q454 C457 Q589 C591 S597	Q454-N593 PolarHBondContact OE1-ND2 3.41Å; Q454-N593 VanDerWaalsContact OE1-ND2 3.14Å; C457-N593 HydrophobicContact CB-CB 4.07Å; Q589-N593 PolarHBondContact NE2-OD1 2.81Å; Q589-N593 VanDerWaalsContact NE2-OD1 3.12Å; Q589-N593 PolarHBondContact O-N 2.88Å; Q589-N593 PolarHBondContact O-ND2 3.03Å; Q589-N593 PolarHBondContact O-OD1 3.12Å; C591-N593 PolarHBondContact O-N 3.25Å; N593-S597 VanDerWaalsContact O-CB 3.31Å; N593-S597 WeakPolarHBondContact O-CB 3.39Å; N593-S597 PolarHBondContact O-N 3.23Å; N593-S597 VanDerWaalsContact O-N 3.09Å; N593-S597 PolarHBondContact O-OG 2.69Å
594	L	96.6	Very high	95.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.9	-55.2	175.1	178.6	66.8	0	0	0	110.7	L450 C453 C457 L518 T521 E522 L525 N590 C591 L592 V596 S597 M598	L450-L594 HydrophobicContact CD2-CB 3.93Å; L450-L594 HydrophobicContact CD2-CD2 3.46Å; L450-L594 VanDerWaalsContact CD2-CD2 3.46Å; L450-L594 HydrophobicContact CD2-CG 4.32Å; C453-L594 HydrophobicContact CB-CD1 4.31Å; C457-L594 VanDerWaalsContact SG-CD1 3.59Å; L518-L594 HydrophobicContact CD1-CD1 3.59Å; T521-L594 HydrophobicContact CG2-CD2 3.73Å; E522-L594 WeakPolarHBondContact OE1-CD2 3.36Å; E522-L594 WeakPolarHBondContact OE1-CG 3.39Å; L525-L594 HydrophobicContact CD1-CD2 3.78Å; N590-L594 PolarHBondContact O-N 2.94Å; N590-L594 VanDerWaalsContact O-N 3.11Å; C591-L594 WeakPolarHBondContact O-CB 3.34Å; C591-L594 PolarHBondContact O-N 3.21Å; C591-L594 VanDerWaalsContact O-N 3.14Å; L592-L594 VanDerWaalsContact C-N 3.26Å; L592-L594 PolarHBondContact O-N 3.19Å; L594-V596 VanDerWaalsContact C-N 3.3Å; L594-V596 PolarHBondContact O-N 3.37Å; L594-S597 CarbonylContact O-C 2.95Å; L594-S597 WeakPolarHBondContact O-CA 3.47Å; L594-S597 VanDerWaalsContact O-CB 3.28Å; L594-S597 WeakPolarHBondContact O-CB 3.19Å; L594-S597 PolarHBondContact O-N 3.38Å; L594-M598 HydrophobicContact CD1-CG 4.36Å; L594-M598 HydrophobicContact CD1-SD 4.42Å; L594-M598 HydrophobicContact CG-CG 4.36Å; L594-M598 WeakPolarHBondContact O-CG 3.33Å; L594-M598 PolarHBondContact O-N 3.1Å
595	Q	95.9	Very high	95.7	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.019	9%	0.091	C	C	.	.	H	α-helix	trans	-62.9	-34.8	-175.4	-63.8	-49.4	-35.3	0	0	112.9	E522 C591 L592 M598 A599 L639 F642	E522-Q595 PolarHBondContact OE1-NE2 3.35Å; C591-Q595 WeakPolarHBondContact O-CG 3.48Å; C591-Q595 PolarHBondContact O-N 2.91Å; L592-Q595 PolarHBondContact O-N 2.93Å; Q595-M598 WeakPolarHBondContact O-CB 3.4Å; Q595-M598 PolarHBondContact O-N 3.42Å; Q595-A599 PolarHBondContact O-N 2.63Å; Q595-L639 HydrophobicContact CB-CG 4.36Å; Q595-L639 WeakPolarHBondContact O-CD1 3.39Å; Q595-L639 VanDerWaalsContact OE1-CB 3.32Å; Q595-F642 HydrophobicContact CB-CD1 4.21Å; Q595-F642 HydrophobicContact CG-CB 4.15Å; Q595-F642 HydrophobicContact CG-CD1 3.8Å; Q595-F642 HydrophobicContact CG-CG 4.1Å
596	V	95.6	Very high	95.8	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.012	7%	0.069	C	C	.	.	H	α-helix	trans	-67.5	-40.6	172.5	172.6	0	0	0	0	111.1	P459 L592 L594 M598 A599 V600 H663 V664	P459-V596 HydrophobicContact CG-CG1 4.31Å; L592-V596 HydrophobicContact CD1-CG2 3.82Å; L592-V596 HydrophobicContact CG-CG2 4.16Å; L592-V596 WeakPolarHBondContact O-CB 3.4Å; L592-V596 WeakPolarHBondContact O-CG2 3.35Å; L592-V596 PolarHBondContact O-N 3.4Å; L594-V596 VanDerWaalsContact C-N 3.3Å; L594-V596 PolarHBondContact O-N 3.37Å; V596-M598 VanDerWaalsContact C-N 3.28Å; V596-M598 PolarHBondContact O-N 3.47Å; V596-A599 WeakPolarHBondContact O-CB 3.44Å; V596-A599 PolarHBondContact O-N 3.24Å; V596-V600 PolarHBondContact O-N 2.9Å; V596-V600 VanDerWaalsContact O-N 3.1Å; V596-H663 HydrophobicContact CG1-CB 4.1Å; V596-V664 HydrophobicContact CG2-CG2 4.34Å
597	S	95.8	Very high	95.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63.3	-38.5	173.7	-60.4	0	0	0	0	110.9	C457 K458 L464 N593 L594 V600 L601	C457-S597 WeakPolarHBondContact CA-OG 3.43Å; K458-S597 PolarHBondContact N-OG 2.68Å; L464-S597 WeakPolarHBondContact CD2-O 3.43Å; N593-S597 VanDerWaalsContact O-CB 3.31Å; N593-S597 WeakPolarHBondContact O-CB 3.39Å; N593-S597 PolarHBondContact O-N 3.23Å; N593-S597 VanDerWaalsContact O-N 3.09Å; N593-S597 PolarHBondContact O-OG 2.69Å; L594-S597 CarbonylContact O-C 2.95Å; L594-S597 WeakPolarHBondContact O-CA 3.47Å; L594-S597 VanDerWaalsContact O-CB 3.28Å; L594-S597 WeakPolarHBondContact O-CB 3.19Å; L594-S597 PolarHBondContact O-N 3.38Å; S597-V600 WeakPolarHBondContact O-CB 3.36Å; S597-V600 PolarHBondContact O-N 2.63Å; S597-L601 PolarHBondContact O-N 3.24Å
598	M	95.8	Very high	95.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.9	-42.1	173.7	-64.7	-43.3	-63.3	0	0	112.6	L518 E522 L594 Q595 V596 V600 L601 L602 F635 L639	L518-M598 HydrophobicContact CD1-CE 4.41Å; L518-M598 HydrophobicContact CD1-SD 3.46Å; L518-M598 WeakPolarHBondContact CD1-SD 3.41Å; L518-M598 HydrophobicContact CD2-CE 4Å; L518-M598 HydrophobicContact CD2-SD 3.75Å; L518-M598 HydrophobicContact CG-CE 4.49Å; L518-M598 HydrophobicContact CG-SD 4.08Å; E522-M598 VanDerWaalsContact OE1-CG 3.26Å; E522-M598 WeakPolarHBondContact OE1-CG 3.34Å; L594-M598 HydrophobicContact CD1-CG 4.36Å; L594-M598 HydrophobicContact CD1-SD 4.42Å; L594-M598 HydrophobicContact CG-CG 4.36Å; L594-M598 WeakPolarHBondContact O-CG 3.33Å; L594-M598 PolarHBondContact O-N 3.1Å; Q595-M598 WeakPolarHBondContact O-CB 3.4Å; Q595-M598 PolarHBondContact O-N 3.42Å; V596-M598 VanDerWaalsContact C-N 3.28Å; V596-M598 PolarHBondContact O-N 3.47Å; M598-V600 VanDerWaalsContact C-N 3.26Å; M598-V600 PolarHBondContact O-N 3.27Å; M598-L601 HydrophobicContact CE-CD2 3.82Å; M598-L601 PolarHBondContact O-N 3.26Å; M598-L601 HydrophobicContact SD-CD2 4.2Å; M598-L602 WeakPolarHBondContact O-CB 3.48Å; M598-L602 VanDerWaalsContact O-CG 3.26Å; M598-L602 WeakPolarHBondContact O-CG 3.33Å; M598-L602 PolarHBondContact O-N 2.88Å; M598-F635 HydrophobicContact CE-CD1 3.34Å; M598-F635 HydrophobicContact CE-CE1 3.73Å; M598-F635 HydrophobicContact CE-CG 4.49Å; M598-L639 HydrophobicContact CB-CD1 4.46Å
599	A	96.8	Very high	95.4	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-52.9	-48.1	171.9	0	0	0	0	0	110.7	Q595 V596 V603 L639 F667	Q595-A599 PolarHBondContact O-N 2.63Å; V596-A599 WeakPolarHBondContact O-CB 3.44Å; V596-A599 PolarHBondContact O-N 3.24Å; A599-V603 WeakPolarHBondContact O-CB 3.45Å; A599-V603 WeakPolarHBondContact O-CG2 3.4Å; A599-V603 PolarHBondContact O-N 3.22Å; A599-L639 HydrophobicContact CB-CD1 3.81Å; A599-F667 HydrophobicContact CB-CB 3.89Å; A599-F667 HydrophobicContact CB-CG 4.34Å
600	V	96.1	Very high	94.9	Very high	15 Å²	15	16.8 Å²	16.8	9%	0.091	9%	0.091	C	C	.	.	H	α-helix	trans	-63.3	-49	177.2	176.8	0	0	0	0	111.7	P459 V596 S597 M598 L602 V603 Q604 H663	P459-V600 HydrophobicContact CB-CG2 4.22Å; P459-V600 WeakPolarHBondContact O-CG1 3.48Å; V596-V600 PolarHBondContact O-N 2.9Å; V596-V600 VanDerWaalsContact O-N 3.1Å; S597-V600 WeakPolarHBondContact O-CB 3.36Å; S597-V600 PolarHBondContact O-N 2.63Å; M598-V600 VanDerWaalsContact C-N 3.26Å; M598-V600 PolarHBondContact O-N 3.27Å; V600-L602 VanDerWaalsContact C-N 3.35Å; V600-L602 PolarHBondContact O-N 3.48Å; V600-V603 PolarHBondContact O-N 3.03Å; V600-Q604 HydrophobicContact CG1-CG 4.11Å; V600-Q604 VanDerWaalsContact O-CG 3.24Å; V600-Q604 WeakPolarHBondContact O-CG 3.46Å; V600-Q604 PolarHBondContact O-N 3.23Å; V600-H663 HydrophobicContact CG2-CB 3.78Å
601	L	95.9	Very high	94.4	Very high	4 Å²	4	18 Å²	18	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-58.9	-46.3	-178.9	178.6	62.3	0	0	0	111.3	L464 L465 F467 L518 S597 M598 V603 Q604 L605	L464-L601 HydrophobicContact CD1-CD2 4.22Å; L464-L601 HydrophobicContact CD2-CB 4.21Å; L464-L601 HydrophobicContact CG-CB 4.29Å; L465-L601 HydrophobicContact CD2-CD1 4.14Å; F467-L601 HydrophobicContact CB-CD1 4.24Å; F467-L601 HydrophobicContact CB-CD2 3.96Å; F467-L601 HydrophobicContact CD1-CD1 4.42Å; F467-L601 HydrophobicContact CD1-CD2 3.68Å; F467-L601 HydrophobicContact CD1-CG 4.42Å; F467-L601 HydrophobicContact CE1-CD2 4.36Å; F467-L601 HydrophobicContact CG-CD2 3.88Å; L518-L601 HydrophobicContact CD2-CD2 3.77Å; S597-L601 PolarHBondContact O-N 3.24Å; M598-L601 HydrophobicContact CE-CD2 3.82Å; M598-L601 PolarHBondContact O-N 3.26Å; M598-L601 HydrophobicContact SD-CD2 4.2Å; L601-V603 VanDerWaalsContact C-N 3.35Å; L601-V603 PolarHBondContact O-N 3.5Å; L601-Q604 PolarHBondContact O-N 3.37Å; L601-L605 HydrophobicContact CD1-CD1 4.46Å; L601-L605 HydrophobicContact CD1-CG 4.4Å; L601-L605 HydrophobicContact CG-CD1 4.3Å; L601-L605 WeakPolarHBondContact O-CG 3.38Å; L601-L605 PolarHBondContact O-N 3.34Å
602	L	96.5	Very high	94	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-64.1	-39.3	178.1	-66	178	0	0	0	111.9	L498 M598 V600 L605 A606 V631 A636 F667 F671	L498-L602 HydrophobicContact CD1-CD2 4.18Å; M598-L602 WeakPolarHBondContact O-CB 3.48Å; M598-L602 VanDerWaalsContact O-CG 3.26Å; M598-L602 WeakPolarHBondContact O-CG 3.33Å; M598-L602 PolarHBondContact O-N 2.88Å; V600-L602 VanDerWaalsContact C-N 3.35Å; V600-L602 PolarHBondContact O-N 3.48Å; L602-L605 PolarHBondContact O-N 2.56Å; L602-A606 VanDerWaalsContact O-CB 3.28Å; L602-A606 WeakPolarHBondContact O-CB 3.37Å; L602-A606 PolarHBondContact O-N 3.24Å; L602-V631 HydrophobicContact CD2-CG1 3.72Å; L602-A636 HydrophobicContact CD1-CB 4.37Å; L602-F667 HydrophobicContact CB-CD2 4.09Å; L602-F667 HydrophobicContact CB-CE2 4.1Å; L602-F667 HydrophobicContact CD1-CD2 4.2Å; L602-F667 HydrophobicContact CD1-CE2 3.56Å; L602-F667 HydrophobicContact CD1-CZ 4.23Å; L602-F667 HydrophobicContact CG-CE2 4.49Å; L602-F671 HydrophobicContact CB-CE2 3.99Å; L602-F671 HydrophobicContact CB-CZ 4.05Å
603	V	96.1	Very high	93.7	Very high	7 Å²	7	26.8 Å²	26.8	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-62	-44.5	172.8	166.3	0	0	0	0	111	A599 V600 L601 A606 I607 H666 F667 I670	A599-V603 WeakPolarHBondContact O-CB 3.45Å; A599-V603 WeakPolarHBondContact O-CG2 3.4Å; A599-V603 PolarHBondContact O-N 3.22Å; V600-V603 PolarHBondContact O-N 3.03Å; L601-V603 VanDerWaalsContact C-N 3.35Å; L601-V603 PolarHBondContact O-N 3.5Å; V603-A606 WeakPolarHBondContact O-CB 3.36Å; V603-A606 PolarHBondContact O-N 3.46Å; V603-I607 WeakPolarHBondContact O-CG1 3.44Å; V603-I607 PolarHBondContact O-N 2.57Å; V603-H666 HydrophobicContact CG2-CB 4.22Å; V603-F667 HydrophobicContact CG2-CB 4.01Å; V603-I670 HydrophobicContact CB-CD1 4.28Å; V603-I670 HydrophobicContact CG1-CD1 3.67Å; V603-I670 HydrophobicContact CG2-CD1 4.03Å
604	Q	95.6	Very high	93.5	Very high	13 Å²	13	27.4 Å²	27.4	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-42.1	179	-68.1	-66	-52.2	0	0	111.9	L465 V600 L601 A606 I607 G608 N609 I615	L465-Q604 HydrophobicContact CD2-CB 3.9Å; L465-Q604 HydrophobicContact CD2-CG 3.85Å; V600-Q604 HydrophobicContact CG1-CG 4.11Å; V600-Q604 VanDerWaalsContact O-CG 3.24Å; V600-Q604 WeakPolarHBondContact O-CG 3.46Å; V600-Q604 PolarHBondContact O-N 3.23Å; L601-Q604 PolarHBondContact O-N 3.37Å; Q604-A606 VanDerWaalsContact C-N 3.34Å; Q604-I607 VanDerWaalsContact O-CG1 3.28Å; Q604-I607 WeakPolarHBondContact O-CG1 3.41Å; Q604-I607 PolarHBondContact O-N 3.24Å; Q604-G608 PolarHBondContact O-N 3.35Å; Q604-N609 HydrophobicContact CB-CB 4.15Å; Q604-N609 VanDerWaalsContact O-CB 3.27Å; Q604-N609 WeakPolarHBondContact O-CB 3.4Å; Q604-N609 PolarHBondContact O-N 3.3Å; Q604-N609 PolarHBondContact OE1-ND2 3.37Å; Q604-I615 PolarHBondContact NE2-O 2.92Å
605	L	95	Very high	93.3	Very high	12 Å²	12	31.3 Å²	31.3	6%	0.063	18%	0.179	C	C	.	.	H	α-helix	trans	-65.5	-37	173.4	-67.3	176.3	0	0	0	111.9	P469 L601 L602 G608 L628 V631	P469-L605 HydrophobicContact CG-CD2 4.49Å; L601-L605 HydrophobicContact CD1-CD1 4.46Å; L601-L605 HydrophobicContact CD1-CG 4.4Å; L601-L605 HydrophobicContact CG-CD1 4.3Å; L601-L605 WeakPolarHBondContact O-CG 3.38Å; L601-L605 PolarHBondContact O-N 3.34Å; L602-L605 PolarHBondContact O-N 2.56Å; L605-G608 PolarHBondContact O-N 2.96Å; L605-L628 HydrophobicContact CB-CD2 3.76Å; L605-V631 HydrophobicContact CD1-CG2 3.9Å
606	A	95.1	Very high	93.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65	-38.4	176	0	0	0	0	0	112.1	L602 V603 Q604 G608 L628 I670 F671 R677	L602-A606 VanDerWaalsContact O-CB 3.28Å; L602-A606 WeakPolarHBondContact O-CB 3.37Å; L602-A606 PolarHBondContact O-N 3.24Å; V603-A606 WeakPolarHBondContact O-CB 3.36Å; V603-A606 PolarHBondContact O-N 3.46Å; Q604-A606 VanDerWaalsContact C-N 3.34Å; A606-G608 PolarHBondContact O-N 2.86Å; A606-L628 HydrophobicContact CB-CD1 4.12Å; A606-I670 HydrophobicContact CB-CG2 3.96Å; A606-F671 HydrophobicContact CB-CE2 4.14Å; A606-F671 HydrophobicContact CB-CZ 3.8Å; A606-R677 PolarHBondContact O-NH1 3.17Å
607	I	94.3	Very high	93	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.077	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	7.2	176.3	67.2	179.2	0	0	0	113.6	V603 Q604 I615 L617 L621 P622	V603-I607 WeakPolarHBondContact O-CG1 3.44Å; V603-I607 PolarHBondContact O-N 2.57Å; Q604-I607 VanDerWaalsContact O-CG1 3.28Å; Q604-I607 WeakPolarHBondContact O-CG1 3.41Å; Q604-I607 PolarHBondContact O-N 3.24Å; I607-I615 HydrophobicContact CD1-CB 3.86Å; I607-I615 HydrophobicContact CD1-CG2 4Å; I607-L617 HydrophobicContact CG2-CD1 3.88Å; I607-L621 HydrophobicContact CG2-CD2 4.07Å; I607-P622 HydrophobicContact CB-CG 4.13Å; I607-P622 WeakPolarHBondContact O-CG 3.44Å
608	G	91.4	Very high	92.8	Very high	27 Å²	27	44.1 Å²	44.1	28%	0.278	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	30.3	176.2	0	0	0	0	0	115.4	Q604 L605 A606 E610 G624	Q604-G608 PolarHBondContact O-N 3.35Å; L605-G608 PolarHBondContact O-N 2.96Å; A606-G608 PolarHBondContact O-N 2.86Å; G608-E610 PolarHBondContact O-N 3.2Å; G608-G624 WeakPolarHBondContact CA-O 3.21Å
609	N	92.3	Very high	92.7	Very high	17 Å²	17	47.1 Å²	47.1	9%	0.091	26%	0.258	C	S	.	.			trans	-74.9	114.1	172.1	-169.3	5.3	0	0	0	111.2	Q604 G611 Q613 I615	Q604-N609 HydrophobicContact CB-CB 4.15Å; Q604-N609 VanDerWaalsContact O-CB 3.27Å; Q604-N609 WeakPolarHBondContact O-CB 3.4Å; Q604-N609 PolarHBondContact O-N 3.3Å; Q604-N609 PolarHBondContact OE1-ND2 3.37Å; N609-G611 WeakPolarHBondContact OD1-CA 3.21Å; N609-G611 PolarHBondContact OD1-N 2.69Å; N609-G611 PolarHBondContact OD1-O 3.49Å; N609-Q613 PolarHBondContact ND2-O 3.08Å; N609-I615 HydrophobicContact CB-CD1 3.69Å; N609-I615 HydrophobicContact CB-CG1 4.21Å
610	E	84.8	Confident	92.4	Very high	173 Å²	173	53 Å²	53	81%	0.808	30%	0.297	S	S	*	.			trans	-101.3	-3.6	171.1	-61.1	-174.2	165.2	0	0	112.7	G608	G608-E610 PolarHBondContact O-N 3.2Å
611	G	85.7	Confident	92.2	Very high	35 Å²	35	54.2 Å²	54.2	36%	0.361	30%	0.303	S	S	.	.	S	Bend	trans	-93.6	166	-177.6	0	0	0	0	0	113.8	N609 Q613	N609-G611 WeakPolarHBondContact OD1-CA 3.21Å; N609-G611 PolarHBondContact OD1-N 2.69Å; N609-G611 PolarHBondContact OD1-O 3.49Å; G611-Q613 VanDerWaalsContact C-N 3.26Å; G611-Q613 PolarHBondContact O-N 2.65Å
612	S	86.8	Confident	91.9	Very high	59 Å²	59	56.9 Å²	56.9	41%	0.413	32%	0.32	S	S	.	.	S	Bend	trans	-84.6	6	177.7	-46	0	0	0	0	114.2	S462	S462-S612 VanDerWaalsContact CA-O 3.26Å; S462-S612 WeakPolarHBondContact CA-O 3.31Å; S462-S612 WeakPolarHBondContact CB-O 3.31Å
613	Q	91	Very high	91.2	Very high	135 Å²	135	63.3 Å²	63.3	63%	0.631	36%	0.355	S	S	*	.	S	Bend	trans	-113.3	137.9	179.4	-64.8	-61.8	-28.5	0	0	109.7	L465 N609 G611 I615	L465-Q613 VanDerWaalsContact CD1-C 3.41Å; N609-Q613 PolarHBondContact ND2-O 3.08Å; G611-Q613 VanDerWaalsContact C-N 3.26Å; G611-Q613 PolarHBondContact O-N 2.65Å; Q613-I615 PolarHBondContact O-N 3.12Å
614	P	90.7	Very high	90.4	Very high	56 Å²	56	64.8 Å²	64.8	36%	0.364	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-68.2	133.5	-179.6	27.7	-33.1	0	0	0	110.7	L465	L465-P614 HydrophobicContact CD1-CB 4.19Å
615	I	92.5	Very high	90	Very high	83 Å²	83	66.8 Å²	66.8	43%	0.426	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-93	137	172.2	-60.1	176.7	0	0	0	108.2	Q604 I607 N609 Q613	Q604-I615 PolarHBondContact NE2-O 2.92Å; I607-I615 HydrophobicContact CD1-CB 3.86Å; I607-I615 HydrophobicContact CD1-CG2 4Å; N609-I615 HydrophobicContact CB-CD1 3.69Å; N609-I615 HydrophobicContact CB-CG1 4.21Å; Q613-I615 PolarHBondContact O-N 3.12Å
616	E	91.1	Very high	89.6	Confident	167 Å²	167	69.7 Å²	69.7	78%	0.78	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-67	133.4	174.8	-70.2	-171.6	165.9	0	0	110.9	T618	E616-T618 PolarHBondContact O-N 3.23Å
617	L	93.1	Very high	89.4	Confident	18 Å²	18	70.8 Å²	70.8	9%	0.094	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-66.9	130.8	175.8	178.8	60.7	0	0	0	109.1	I607 F619 L621 H666 I670 Y721	I607-L617 HydrophobicContact CG2-CD1 3.88Å; L617-F619 HydrophobicContact CD1-CE2 4.38Å; L617-F619 HydrophobicContact CD2-CE2 4.11Å; L617-F619 HydrophobicContact CG-CE2 4.16Å; L617-L621 HydrophobicContact CD1-CD2 3.63Å; L617-H666 HydrophobicContact CD2-CB 4.04Å; L617-H666 VanDerWaalsContact CD2-CD2 3.43Å; L617-H666 WeakPolarHBondContact CD2-CD2 3.43Å; L617-I670 HydrophobicContact CD1-CD1 3.58Å; L617-I670 HydrophobicContact CD1-CG1 4.44Å; L617-I670 HydrophobicContact CD2-CD1 4.14Å; L617-Y721 HydrophobicContact CB-CE2 4.4Å; L617-Y721 HydrophobicContact CD2-CD2 4.01Å; L617-Y721 HydrophobicContact CD2-CE2 3.79Å; L617-Y721 HydrophobicContact CG-CE2 4.08Å; L617-Y721 PolarHBondContact O-OH 2.85Å
618	T	93.1	Very high	89.4	Confident	89 Å²	89	70 Å²	70	55%	0.546	40%	0.404	S	S	.	.			trans	-142.2	151.7	173.5	53	0	0	0	0	109.5	E616	E616-T618 PolarHBondContact O-N 3.23Å
619	F	91.8	Very high	89.6	Confident	63 Å²	63	69.1 Å²	69.1	28%	0.276	39%	0.394	S	S	.	.	S	Bend	trans	-113.3	144.5	175.7	-73	-93	0	0	0	110.2	L617 L621 T669 I670 Y721 Q724	L617-F619 HydrophobicContact CD1-CE2 4.38Å; L617-F619 HydrophobicContact CD2-CE2 4.11Å; L617-F619 HydrophobicContact CG-CE2 4.16Å; F619-L621 HydrophobicContact CD1-CD1 4.48Å; F619-L621 HydrophobicContact CD1-CD2 4Å; F619-L621 HydrophobicContact CD1-CG 3.82Å; F619-L621 HydrophobicContact CE1-CD1 3.93Å; F619-L621 HydrophobicContact CE1-CD2 3.79Å; F619-L621 HydrophobicContact CE1-CG 3.7Å; F619-L621 HydrophobicContact CZ-CD2 4.12Å; F619-L621 HydrophobicContact CZ-CG 4.49Å; F619-T669 HydrophobicContact CZ-CG2 3.85Å; F619-I670 HydrophobicContact CZ-CG1 4.31Å; F619-Y721 AromaticContact CD2-CD1 3.42Å; F619-Y721 HydrophobicContact CD2-CD1 3.42Å; F619-Y721 VanDerWaalsContact CD2-CD1 3.42Å; F619-Y721 AromaticContact CD2-CE1 3.57Å; F619-Y721 HydrophobicContact CD2-CE1 3.57Å; F619-Y721 HydrophobicContact CD2-CG 4.09Å; F619-Y721 AromaticContact CE2-CD1 3.49Å; F619-Y721 HydrophobicContact CE2-CD1 3.49Å; F619-Y721 VanDerWaalsContact CE2-CD1 3.49Å; F619-Y721 HydrophobicContact CE2-CD2 4.21Å; F619-Y721 AromaticContact CE2-CE1 3.92Å; F619-Y721 HydrophobicContact CE2-CE1 3.92Å; F619-Y721 AromaticContact CE2-CG 3.65Å; F619-Y721 HydrophobicContact CE2-CG 3.65Å; F619-Q724 HydrophobicContact CD1-CG 3.88Å; F619-Q724 HydrophobicContact CD2-CG 4.11Å; F619-Q724 HydrophobicContact CE1-CB 4.22Å; F619-Q724 HydrophobicContact CE1-CG 3.99Å; F619-Q724 HydrophobicContact CE2-CB 4.46Å; F619-Q724 HydrophobicContact CE2-CG 4.22Å; F619-Q724 HydrophobicContact CG-CG 3.94Å; F619-Q724 HydrophobicContact CZ-CB 4.15Å; F619-Q724 HydrophobicContact CZ-CG 4.16Å
620	P	90.9	Very high	89.7	Confident	125 Å²	125	69.6 Å²	69.6	81%	0.812	39%	0.394	S	S	*	.	S	Bend	cis	-69.5	151.8	0.3	30.7	-35.8	0	0	0	113
621	L	91.6	Very high	90.3	Very high	40 Å²	40	61.4 Å²	61.4	21%	0.209	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-73.7	146.7	-177.1	-58.8	172.9	0	0	0	111.3	I607 L617 F619 I670	I607-L621 HydrophobicContact CG2-CD2 4.07Å; L617-L621 HydrophobicContact CD1-CD2 3.63Å; F619-L621 HydrophobicContact CD1-CD1 4.48Å; F619-L621 HydrophobicContact CD1-CD2 4Å; F619-L621 HydrophobicContact CD1-CG 3.82Å; F619-L621 HydrophobicContact CE1-CD1 3.93Å; F619-L621 HydrophobicContact CE1-CD2 3.79Å; F619-L621 HydrophobicContact CE1-CG 3.7Å; F619-L621 HydrophobicContact CZ-CD2 4.12Å; F619-L621 HydrophobicContact CZ-CG 4.49Å; L621-I670 HydrophobicContact CD1-CB 4.4Å; L621-I670 HydrophobicContact CD1-CG1 4.08Å; L621-I670 HydrophobicContact CD1-CG2 3.9Å; L621-I670 HydrophobicContact CD2-CD1 4.24Å; L621-I670 HydrophobicContact CD2-CG1 4.34Å
622	P	89.5	Confident	90.8	Very high	59 Å²	59	59.7 Å²	59.7	38%	0.383	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-78.8	156.5	178.9	32.5	-36.2	0	0	0	113.4	I607 G624 R677	I607-P622 HydrophobicContact CB-CG 4.13Å; I607-P622 WeakPolarHBondContact O-CG 3.44Å; P622-G624 PolarHBondContact O-N 3.07Å; P622-R677 PolarHBondContact O-NH2 3.35Å
623	D	83.3	Confident	91.2	Very high	137 Å²	137	58.4 Å²	58.4	73%	0.733	33%	0.326	S	S	*	.	S	Bend	trans	-77.9	4.6	-177.2	-61.2	-32	0	0	0	114.8	Y625	D623-Y625 VanDerWaalsContact C-CD1 3.48Å; D623-Y625 VanDerWaalsContact C-N 3.31Å; D623-Y625 HydrophobicContact CB-CE1 4.5Å; D623-Y625 VanDerWaalsContact O-CD1 3.24Å; D623-Y625 WeakPolarHBondContact O-CD1 3.33Å; D623-Y625 WeakPolarHBondContact O-CE1 3.35Å; D623-Y625 PolarHBondContact O-N 3.29Å
624	G	79.1	Confident	91.4	Very high	38 Å²	38	52.5 Å²	52.5	39%	0.392	30%	0.298	S	S	.	.			trans	-80.1	44.2	-171.6	0	0	0	0	0	116.4	G608 P622	G608-G624 WeakPolarHBondContact CA-O 3.21Å; P622-G624 PolarHBondContact O-N 3.07Å
625	Y	86.4	Confident	91.7	Very high	54 Å²	54	49.9 Å²	49.9	21%	0.212	28%	0.281	C	S	.	.			trans	-105.4	16.9	-167	56.1	-97.7	0	0	0	116.5	I499 D623 S627 L628 E676 R677	I499-Y625 HydrophobicContact CD1-CD2 3.79Å; I499-Y625 HydrophobicContact CD1-CE2 4.19Å; D623-Y625 VanDerWaalsContact C-CD1 3.48Å; D623-Y625 VanDerWaalsContact C-N 3.31Å; D623-Y625 HydrophobicContact CB-CE1 4.5Å; D623-Y625 VanDerWaalsContact O-CD1 3.24Å; D623-Y625 WeakPolarHBondContact O-CD1 3.33Å; D623-Y625 WeakPolarHBondContact O-CE1 3.35Å; D623-Y625 PolarHBondContact O-N 3.29Å; Y625-S627 PolarHBondContact O-N 3.47Å; Y625-S627 VanDerWaalsContact O-N 3.12Å; Y625-L628 WeakPolarHBondContact O-CB 3.32Å; Y625-L628 PolarHBondContact O-N 3.21Å; Y625-L628 VanDerWaalsContact O-N 3.1Å; Y625-E676 HydrophobicContact CE2-CB 4.36Å; Y625-E676 WeakPolarHBondContact CE2-O 3.18Å; Y625-R677 VanDerWaalsContact CG-NH1 3.34Å
626	S	86.9	Confident	91.9	Very high	74 Å²	74	45.9 Å²	45.9	52%	0.517	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-57.7	-28.8	-176.7	49.9	0	0	0	0	114	L628 A629	S626-L628 PolarHBondContact O-N 3.37Å; S626-A629 WeakPolarHBondContact O-CB 3.39Å; S626-A629 PolarHBondContact O-N 3.03Å
627	S	91.1	Very high	92	Very high	22 Å²	22	39.5 Å²	39.5	15%	0.154	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-62.7	-25.4	179.2	-59.6	0	0	0	0	113.4	Y625 A629 Y630	Y625-S627 PolarHBondContact O-N 3.47Å; Y625-S627 VanDerWaalsContact O-N 3.12Å; S627-A629 PolarHBondContact O-N 3.17Å; S627-Y630 PolarHBondContact O-N 2.99Å
628	L	94.9	Very high	92.2	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-64.2	-19.8	174.6	-61.5	178.4	0	0	0	112.4	L498 I499 L605 A606 Y625 S626 Y630 V631 F671 R677	L498-L628 HydrophobicContact CB-CB 4.45Å; L498-L628 HydrophobicContact CD1-CD2 4.05Å; I499-L628 HydrophobicContact CD1-CB 3.96Å; I499-L628 HydrophobicContact CG1-CB 4.07Å; L605-L628 HydrophobicContact CB-CD2 3.76Å; A606-L628 HydrophobicContact CB-CD1 4.12Å; Y625-L628 WeakPolarHBondContact O-CB 3.32Å; Y625-L628 PolarHBondContact O-N 3.21Å; Y625-L628 VanDerWaalsContact O-N 3.1Å; S626-L628 PolarHBondContact O-N 3.37Å; L628-Y630 PolarHBondContact O-N 2.7Å; L628-Y630 VanDerWaalsContact O-N 3.16Å; L628-V631 PolarHBondContact O-N 2.78Å; L628-V631 VanDerWaalsContact O-N 3.15Å; L628-F671 HydrophobicContact CD1-CE1 3.9Å; L628-F671 HydrophobicContact CD1-CZ 4.2Å; L628-F671 HydrophobicContact CD2-CE1 4.37Å; L628-F671 HydrophobicContact CD2-CZ 4.15Å; L628-R677 HydrophobicContact CD1-CB 4.01Å; L628-R677 HydrophobicContact CD1-CG 4.38Å
629	A	94.5	Very high	92.3	Very high	8 Å²	8	34.8 Å²	34.8	7%	0.066	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-66.7	-14.1	178.2	0	0	0	0	0	113.7	C497 I499 A501 S626 S627	C497-A629 VanDerWaalsContact CB-O 3.29Å; C497-A629 WeakPolarHBondContact CB-O 3.34Å; I499-A629 HydrophobicContact CD1-CB 4.09Å; I499-A629 HydrophobicContact CG1-CB 3.68Å; I499-A629 VanDerWaalsContact CG1-N 3.33Å; I499-A629 WeakPolarHBondContact O-CA 3.24Å; A501-A629 HydrophobicContact CB-CB 4.2Å; S626-A629 WeakPolarHBondContact O-CB 3.39Å; S626-A629 PolarHBondContact O-N 3.03Å; S627-A629 PolarHBondContact O-N 3.17Å
630	Y	94.9	Very high	92.4	Very high	26 Å²	26	31.8 Å²	31.8	10%	0.102	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-114.8	11.8	179.6	-44.2	-63.3	0	0	0	111.6	P469 T470 C472 A473 A501 Q503 P505 S627 L628 P632	P469-Y630 WeakPolarHBondContact O-CB 3.33Å; T470-Y630 HydrophobicContact CG2-CD2 4.03Å; T470-Y630 HydrophobicContact CG2-CE2 4.36Å; T470-Y630 HydrophobicContact CG2-CG 4.49Å; C472-Y630 WeakPolarHBondContact CB-O 3.42Å; A473-Y630 HydrophobicContact CB-CD1 3.66Å; A473-Y630 HydrophobicContact CB-CE1 4.42Å; A473-Y630 HydrophobicContact CB-CG 4.27Å; A501-Y630 HydrophobicContact CB-CE1 4.11Å; Q503-Y630 PolarHBondContact O-OH 3.27Å; P505-Y630 HydrophobicContact CB-CD1 4.36Å; P505-Y630 HydrophobicContact CB-CE1 3.74Å; P505-Y630 HydrophobicContact CB-CE2 3.97Å; P505-Y630 HydrophobicContact CG-CD1 4.33Å; P505-Y630 HydrophobicContact CG-CE1 3.72Å; S627-Y630 PolarHBondContact O-N 2.99Å; L628-Y630 PolarHBondContact O-N 2.7Å; L628-Y630 VanDerWaalsContact O-N 3.16Å; Y630-P632 WeakPolarHBondContact O-CD 3.31Å
631	V	96.4	Very high	92.6	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	16%	0.155	C	C	.	.	S	Bend	trans	-101	114.2	175.1	178.8	0	0	0	0	108.7	P469 C497 L498 L602 L605 L628 F635	P469-V631 HydrophobicContact CB-CG2 3.75Å; C497-V631 CarbonylContact C-O 3.6Å; C497-V631 WeakPolarHBondContact CA-O 3.43Å; C497-V631 VanDerWaalsContact CB-O 3.31Å; C497-V631 WeakPolarHBondContact CB-O 3.47Å; L498-V631 HydrophobicContact CD1-CB 4.03Å; L498-V631 HydrophobicContact CD1-CG1 3.82Å; L498-V631 HydrophobicContact CG-CB 4.34Å; L498-V631 HydrophobicContact CG-CG1 4.24Å; L498-V631 PolarHBondContact N-O 3.45Å; L602-V631 HydrophobicContact CD2-CG1 3.72Å; L605-V631 HydrophobicContact CD1-CG2 3.9Å; L628-V631 PolarHBondContact O-N 2.78Å; L628-V631 VanDerWaalsContact O-N 3.15Å; V631-F635 HydrophobicContact CG1-CB 4.03Å; V631-F635 HydrophobicContact CG1-CD1 4.29Å; V631-F635 HydrophobicContact CG1-CG 4.07Å
632	P	96.7	Very high	92.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-59	145.2	175.4	-26.7	36.3	0	0	0	113	C472 E495 T496 Y630 F634 F635	C472-P632 HydrophobicContact CB-CG 3.84Å; E495-P632 HydrophobicContact CB-CB 4.15Å; T496-P632 CarbonylContact O-C 3.4Å; T496-P632 VanDerWaalsContact O-CA 3.29Å; T496-P632 WeakPolarHBondContact O-CA 3.49Å; Y630-P632 WeakPolarHBondContact O-CD 3.31Å; P632-F634 HydrophobicContact CB-CD1 3.41Å; P632-F634 VanDerWaalsContact CB-CD1 3.41Å; P632-F634 HydrophobicContact CB-CE1 3.2Å; P632-F634 HydrophobicContact CB-CG 4.3Å; P632-F634 HydrophobicContact CB-CZ 3.94Å; P632-F634 HydrophobicContact CG-CD1 4.42Å; P632-F634 HydrophobicContact CG-CE1 3.73Å; P632-F634 HydrophobicContact CG-CZ 4.16Å; P632-F634 PolarHBondContact O-N 2.82Å; P632-F635 HydrophobicContact CB-CD2 4.09Å; P632-F635 HydrophobicContact CB-CE2 4.37Å; P632-F635 HydrophobicContact CG-CD2 4.32Å; P632-F635 HydrophobicContact CG-CE2 4.15Å; P632-F635 WeakPolarHBondContact O-CB 3.46Å; P632-F635 PolarHBondContact O-N 3.46Å
633	E	96.1	Very high	93	Very high	32 Å²	32	22 Å²	22	15%	0.15	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-31.7	-177.7	-72.5	-178.2	173.5	0	0	112.7	T496 L498 F635 A636 D637 N680 L683	T496-E633 PolarHBondContact O-N 2.82Å; T496-E633 VanDerWaalsContact OG1-CD 3.31Å; T496-E633 PolarHBondContact OG1-OE2 3.23Å; L498-E633 HydrophobicContact CD2-CG 4.45Å; E633-F635 PolarHBondContact O-N 2.91Å; E633-F635 VanDerWaalsContact O-N 3.09Å; E633-A636 PolarHBondContact O-N 2.94Å; E633-D637 PolarHBondContact O-N 3.47Å; E633-N680 WeakPolarHBondContact OE1-CB 3.44Å; E633-N680 PolarHBondContact OE2-ND2 3.06Å; E633-L683 HydrophobicContact CB-CD2 4.16Å; E633-L683 HydrophobicContact CG-CD2 4.36Å
634	F	95.1	Very high	93.5	Very high	10 Å²	10	15.7 Å²	15.7	4%	0.044	10%	0.095	C	C	.	.	H	α-helix	trans	-60.9	-21.3	-179.7	70.9	-103.7	0	0	0	113.6	L492 E495 E522 Y523 Y526 P632 A636 D637 N638	L492-F634 HydrophobicContact CD2-CE1 4.21Å; L492-F634 HydrophobicContact CD2-CZ 4.18Å; E495-F634 HydrophobicContact CG-CD1 4.48Å; E495-F634 HydrophobicContact CG-CE1 4.2Å; E522-F634 HydrophobicContact CB-CD2 4.49Å; E522-F634 HydrophobicContact CB-CE2 3.91Å; Y523-F634 HydrophobicContact CD2-CD1 4.29Å; Y523-F634 AromaticContact CD2-CE1 3.7Å; Y523-F634 HydrophobicContact CD2-CE1 3.7Å; Y523-F634 HydrophobicContact CD2-CE2 4.05Å; Y523-F634 AromaticContact CD2-CZ 3.57Å; Y523-F634 HydrophobicContact CD2-CZ 3.57Å; Y523-F634 HydrophobicContact CE2-CE1 4.15Å; Y523-F634 HydrophobicContact CE2-CZ 4.45Å; Y523-F634 HydrophobicContact CG-CZ 4.31Å; Y526-F634 HydrophobicContact CD1-CB 4.16Å; Y526-F634 HydrophobicContact CD1-CG 4.31Å; Y526-F634 HydrophobicContact CD2-CB 3.67Å; Y526-F634 HydrophobicContact CE1-CB 4.36Å; Y526-F634 HydrophobicContact CE2-CB 3.91Å; Y526-F634 HydrophobicContact CG-CB 3.82Å; Y526-F634 HydrophobicContact CG-CD2 4.41Å; Y526-F634 HydrophobicContact CG-CG 4.18Å; P632-F634 HydrophobicContact CB-CD1 3.41Å; P632-F634 VanDerWaalsContact CB-CD1 3.41Å; P632-F634 HydrophobicContact CB-CE1 3.2Å; P632-F634 HydrophobicContact CB-CG 4.3Å; P632-F634 HydrophobicContact CB-CZ 3.94Å; P632-F634 HydrophobicContact CG-CD1 4.42Å; P632-F634 HydrophobicContact CG-CE1 3.73Å; P632-F634 HydrophobicContact CG-CZ 4.16Å; P632-F634 PolarHBondContact O-N 2.82Å; F634-A636 VanDerWaalsContact C-N 3.34Å; F634-D637 PolarHBondContact O-N 3.24Å; F634-N638 VanDerWaalsContact O-CB 3.3Å; F634-N638 WeakPolarHBondContact O-CB 3.45Å; F634-N638 PolarHBondContact O-N 3.3Å
635	F	96.9	Very high	94.3	Very high	1 Å²	1	13.9 Å²	13.9	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-61.9	-43.2	173.7	-83	-121.1	0	0	0	111.5	F467 E522 M598 V631 P632 E633	F467-F635 HydrophobicContact CZ-CE1 4Å; F467-F635 HydrophobicContact CZ-CZ 4.21Å; E522-F635 HydrophobicContact CB-CE1 4.44Å; E522-F635 HydrophobicContact CB-CE2 4.3Å; E522-F635 HydrophobicContact CB-CZ 4.2Å; E522-F635 HydrophobicContact CG-CD1 4.27Å; E522-F635 HydrophobicContact CG-CE1 4.08Å; E522-F635 HydrophobicContact CG-CZ 4.34Å; M598-F635 HydrophobicContact CE-CD1 3.34Å; M598-F635 HydrophobicContact CE-CE1 3.73Å; M598-F635 HydrophobicContact CE-CG 4.49Å; V631-F635 HydrophobicContact CG1-CB 4.03Å; V631-F635 HydrophobicContact CG1-CD1 4.29Å; V631-F635 HydrophobicContact CG1-CG 4.07Å; P632-F635 HydrophobicContact CB-CD2 4.09Å; P632-F635 HydrophobicContact CB-CE2 4.37Å; P632-F635 HydrophobicContact CG-CD2 4.32Å; P632-F635 HydrophobicContact CG-CE2 4.15Å; P632-F635 WeakPolarHBondContact O-CB 3.46Å; P632-F635 PolarHBondContact O-N 3.46Å; E633-F635 PolarHBondContact O-N 2.91Å; E633-F635 VanDerWaalsContact O-N 3.09Å
636	A	96.4	Very high	94.7	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-79.6	-30.7	175.9	0	0	0	0	0	111.7	L498 L602 E633 F634 G640 F667 M678 L683	L498-A636 HydrophobicContact CD2-CB 4.07Å; L602-A636 HydrophobicContact CD1-CB 4.37Å; E633-A636 PolarHBondContact O-N 2.94Å; F634-A636 VanDerWaalsContact C-N 3.34Å; A636-G640 PolarHBondContact O-N 3.35Å; A636-G640 VanDerWaalsContact O-N 3.11Å; A636-F667 HydrophobicContact CB-CZ 3.94Å; A636-M678 HydrophobicContact CB-CE 3.9Å; A636-L683 HydrophobicContact CB-CD1 4.46Å; A636-L683 HydrophobicContact CB-CD2 3.97Å; A636-L683 HydrophobicContact CB-CG 4.48Å
637	D	94.3	Very high	94.8	Very high	33 Å²	33	10.2 Å²	10.2	18%	0.176	5%	0.05	C	C	.	.	H	α-helix	trans	-66.4	-47.4	179	-150.8	38.7	0	0	0	112	H530 E633 F634 L639 G640 D641 L683 K686	H530-D637 IonicContact CE1-OD2 3.15Å; H530-D637 PolarHBondContact CE1-OD2 2.99Å; H530-D637 VanDerWaalsContact CE1-OD2 3.27Å; H530-D637 IonicContact ND1-OD2 3.44Å; E633-D637 PolarHBondContact O-N 3.47Å; F634-D637 PolarHBondContact O-N 3.24Å; D637-L639 VanDerWaalsContact C-N 3.32Å; D637-L639 PolarHBondContact O-N 3.04Å; D637-G640 PolarHBondContact O-N 2.82Å; D637-G640 VanDerWaalsContact O-N 3.14Å; D637-D641 PolarHBondContact O-N 3.08Å; D637-D641 VanDerWaalsContact O-OD2 3.12Å; D637-L683 HydrophobicContact CB-CD1 4.12Å; D637-L683 WeakPolarHBondContact OD1-CD1 3.15Å; D637-K686 WeakPolarHBondContact OD1-CD 3.3Å; D637-K686 WeakPolarHBondContact OD1-CE 3.26Å; D637-K686 IonicContact OD1-NZ 3.54Å; D637-K686 PolarHBondContact OD1-NZ 3.44Å; D637-K686 IonicContact OD2-NZ 3.74Å
638	N	95.6	Very high	94.7	Very high	6 Å²	6	14.7 Å²	14.7	3%	0.032	6%	0.064	C	C	.	.	H	α-helix	trans	-55.2	-45.9	175	-78.4	-13	0	0	0	112	E522 Y526 F634 G640 F642	E522-N638 PolarHBondContact O-ND2 2.86Å; E522-N638 PolarHBondContact OE2-ND2 2.84Å; Y526-N638 WeakPolarHBondContact CA-OD1 3.49Å; F634-N638 VanDerWaalsContact O-CB 3.3Å; F634-N638 WeakPolarHBondContact O-CB 3.45Å; F634-N638 PolarHBondContact O-N 3.3Å; N638-G640 PolarHBondContact O-N 3.29Å; N638-F642 WeakPolarHBondContact O-CB 3.3Å; N638-F642 PolarHBondContact O-N 3.17Å
639	L	95.3	Very high	94.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-58.1	-49.3	176.9	-176.3	163.2	0	0	0	110.5	Q595 M598 A599 D637 L643 F667	Q595-L639 HydrophobicContact CB-CG 4.36Å; Q595-L639 WeakPolarHBondContact O-CD1 3.39Å; Q595-L639 VanDerWaalsContact OE1-CB 3.32Å; M598-L639 HydrophobicContact CB-CD1 4.46Å; A599-L639 HydrophobicContact CB-CD1 3.81Å; D637-L639 VanDerWaalsContact C-N 3.32Å; D637-L639 PolarHBondContact O-N 3.04Å; L639-L643 HydrophobicContact CD2-CD1 3.72Å; L639-L643 WeakPolarHBondContact O-CG 3.45Å; L639-L643 PolarHBondContact O-N 3.02Å; L639-F667 HydrophobicContact CD1-CD1 4.13Å; L639-F667 HydrophobicContact CD1-CE1 4.08Å; L639-F667 HydrophobicContact CD1-CG 4.46Å; L639-F667 HydrophobicContact CD1-CZ 4.38Å; L639-F667 HydrophobicContact CD2-CD1 3.92Å; L639-F667 HydrophobicContact CD2-CE1 3.72Å
640	G	94.7	Very high	94.3	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.01	7%	0.074	C	C	.	.	H	α-helix	trans	-64.3	-48.6	-179.4	0	0	0	0	0	113	A636 D637 N638 F642 L643 I644	A636-G640 PolarHBondContact O-N 3.35Å; A636-G640 VanDerWaalsContact O-N 3.11Å; D637-G640 PolarHBondContact O-N 2.82Å; D637-G640 VanDerWaalsContact O-N 3.14Å; N638-G640 PolarHBondContact O-N 3.29Å; G640-F642 VanDerWaalsContact C-N 3.31Å; G640-F642 PolarHBondContact O-N 2.73Å; G640-L643 PolarHBondContact O-N 3.4Å; G640-I644 WeakPolarHBondContact O-CD1 3.42Å; G640-I644 VanDerWaalsContact O-CG1 3.31Å; G640-I644 WeakPolarHBondContact O-CG1 3.31Å; G640-I644 PolarHBondContact O-N 3.35Å; G640-I644 VanDerWaalsContact O-N 3.08Å
641	D	94.2	Very high	93.9	Very high	11 Å²	11	17 Å²	17	6%	0.059	8%	0.077	C	C	.	.	H	α-helix	trans	-61.9	-40.2	179.3	-75.4	-46.3	0	0	0	112.9	H530 D637 I644 F645 K686	H530-D641 IonicContact CE1-OD2 2.74Å; H530-D641 PolarHBondContact CE1-OD2 3.29Å; H530-D641 IonicContact CG-OD2 3.87Å; H530-D641 IonicContact ND1-OD2 3.4Å; H530-D641 PolarHBondContact ND1-OD2 3.5Å; D637-D641 PolarHBondContact O-N 3.08Å; D637-D641 VanDerWaalsContact O-OD2 3.12Å; D641-I644 PolarHBondContact O-N 3.41Å; D641-F645 VanDerWaalsContact O-CB 3.27Å; D641-F645 WeakPolarHBondContact O-CB 3.14Å; D641-F645 PolarHBondContact O-N 2.8Å; D641-K686 WeakPolarHBondContact OD1-CE 3.32Å; D641-K686 IonicContact OD1-NZ 3.15Å; D641-K686 PolarHBondContact OD1-NZ 3.49Å; D641-K686 IonicContact OD2-NZ 3.78Å; D641-K686 PolarHBondContact OD2-NZ 3Å
642	F	96	Very high	93.4	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-43.4	-180	179.6	-105.5	0	0	0	111.7	F529 L588 C591 L592 Q595 N638 G640 F645 L646	F529-F642 AromaticContact CE1-CD2 3.86Å; F529-F642 HydrophobicContact CE1-CD2 3.86Å; F529-F642 AromaticContact CZ-CD2 3.87Å; F529-F642 HydrophobicContact CZ-CD2 3.87Å; F529-F642 HydrophobicContact CZ-CE2 4.23Å; L588-F642 HydrophobicContact CD2-CE2 3.71Å; L588-F642 HydrophobicContact CD2-CZ 4.23Å; L588-F642 WeakPolarHBondContact O-CZ 3.08Å; C591-F642 HydrophobicContact CB-CD2 4.25Å; C591-F642 HydrophobicContact CB-CE1 4.31Å; C591-F642 HydrophobicContact CB-CE2 3.61Å; C591-F642 HydrophobicContact CB-CZ 3.65Å; C591-F642 WeakPolarHBondContact SG-CD2 3.5Å; C591-F642 WeakPolarHBondContact SG-CE2 3.49Å; L592-F642 VanDerWaalsContact CA-CE1 3.5Å; L592-F642 HydrophobicContact CB-CE1 3.8Å; L592-F642 HydrophobicContact CB-CZ 4.2Å; L592-F642 HydrophobicContact CD1-CE1 4.06Å; Q595-F642 HydrophobicContact CB-CD1 4.21Å; Q595-F642 HydrophobicContact CG-CB 4.15Å; Q595-F642 HydrophobicContact CG-CD1 3.8Å; Q595-F642 HydrophobicContact CG-CG 4.1Å; N638-F642 WeakPolarHBondContact O-CB 3.3Å; N638-F642 PolarHBondContact O-N 3.17Å; G640-F642 VanDerWaalsContact C-N 3.31Å; G640-F642 PolarHBondContact O-N 2.73Å; F642-F645 WeakPolarHBondContact O-CB 3.42Å; F642-F645 PolarHBondContact O-N 3.06Å; F642-L646 HydrophobicContact CD1-CD1 4.15Å; F642-L646 HydrophobicContact CD1-CG 4.39Å; F642-L646 HydrophobicContact CE1-CD1 3.46Å; F642-L646 VanDerWaalsContact CE1-CD1 3.46Å; F642-L646 HydrophobicContact CE1-CD2 4.35Å; F642-L646 HydrophobicContact CE1-CG 3.88Å; F642-L646 HydrophobicContact CE2-CD2 4.18Å; F642-L646 HydrophobicContact CE2-CG 4.27Å; F642-L646 HydrophobicContact CZ-CD1 3.77Å; F642-L646 HydrophobicContact CZ-CD2 3.8Å; F642-L646 HydrophobicContact CZ-CG 3.82Å; F642-L646 WeakPolarHBondContact O-CG 3.48Å; F642-L646 PolarHBondContact O-N 3.14Å
643	L	95.2	Very high	92.9	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-66.7	-39.7	177.6	-68.4	173.7	0	0	0	112.2	L592 L639 G640 F645 L646 R647 L654 V664 V690 V694	L592-L643 HydrophobicContact CD1-CD2 4.29Å; L639-L643 HydrophobicContact CD2-CD1 3.72Å; L639-L643 WeakPolarHBondContact O-CG 3.45Å; L639-L643 PolarHBondContact O-N 3.02Å; G640-L643 PolarHBondContact O-N 3.4Å; L643-F645 VanDerWaalsContact C-N 3.33Å; L643-L646 PolarHBondContact O-N 2.94Å; L643-R647 PolarHBondContact O-N 3.33Å; L643-R647 VanDerWaalsContact O-N 3.13Å; L643-L654 HydrophobicContact CD2-CD2 3.94Å; L643-V664 HydrophobicContact CD1-CG1 3.53Å; L643-V664 HydrophobicContact CD1-CG2 4.19Å; L643-V690 HydrophobicContact CB-CG1 4.02Å; L643-V690 HydrophobicContact CD1-CG1 3.48Å; L643-V690 VanDerWaalsContact CD1-CG1 3.48Å; L643-V690 HydrophobicContact CG-CG1 4.41Å; L643-V694 HydrophobicContact CB-CG1 4.26Å; L643-V694 HydrophobicContact CD1-CG1 4.23Å; L643-V694 HydrophobicContact CD2-CG1 4.28Å
644	I	94.1	Very high	92.3	Very high	5 Å²	5	23 Å²	23	3%	0.026	11%	0.11	C	C	.	.	H	α-helix	trans	-63.7	-40.8	173.7	-66.3	164.3	0	0	0	110.6	G640 D641 R647 R648 K686 E689 V690 A693	G640-I644 WeakPolarHBondContact O-CD1 3.42Å; G640-I644 VanDerWaalsContact O-CG1 3.31Å; G640-I644 WeakPolarHBondContact O-CG1 3.31Å; G640-I644 PolarHBondContact O-N 3.35Å; G640-I644 VanDerWaalsContact O-N 3.08Å; D641-I644 PolarHBondContact O-N 3.41Å; I644-R647 PolarHBondContact O-N 3Å; I644-R648 WeakPolarHBondContact O-CG 3.48Å; I644-R648 PolarHBondContact O-N 3.13Å; I644-K686 HydrophobicContact CD1-CG 4.31Å; I644-E689 HydrophobicContact CD1-CB 4.14Å; I644-E689 HydrophobicContact CD1-CG 3.79Å; I644-E689 HydrophobicContact CG1-CG 4.14Å; I644-V690 HydrophobicContact CD1-CG2 4.04Å; I644-V690 HydrophobicContact CG1-CG2 4.23Å; I644-A693 HydrophobicContact CG1-CB 4.26Å
645	F	95.3	Very high	91.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60	-48.8	174.8	171.6	-85.2	0	0	0	111.1	F529 H533 M536 M582 T583 L588 D641 F642 L643 R647 R648 F649	F529-F645 HydrophobicContact CE1-CB 4.3Å; F529-F645 HydrophobicContact CE1-CD1 4.37Å; F529-F645 HydrophobicContact CE1-CD2 4.35Å; F529-F645 HydrophobicContact CE1-CG 4.08Å; F529-F645 HydrophobicContact CE2-CE1 4.49Å; F529-F645 HydrophobicContact CZ-CB 4.42Å; F529-F645 AromaticContact CZ-CD1 3.67Å; F529-F645 HydrophobicContact CZ-CD1 3.67Å; F529-F645 HydrophobicContact CZ-CD2 4.01Å; F529-F645 AromaticContact CZ-CE1 3.87Å; F529-F645 HydrophobicContact CZ-CE1 3.87Å; F529-F645 HydrophobicContact CZ-CE2 4.19Å; F529-F645 AromaticContact CZ-CG 3.75Å; F529-F645 HydrophobicContact CZ-CG 3.75Å; F529-F645 HydrophobicContact CZ-CZ 4.12Å; H533-F645 HydrophobicContact CB-CD2 4.48Å; H533-F645 AromaticContact CD2-CD2 3.68Å; M536-F645 HydrophobicContact SD-CE2 4.09Å; M582-F645 HydrophobicContact CB-CE2 4.01Å; M582-F645 HydrophobicContact CB-CZ 3.73Å; M582-F645 HydrophobicContact CE-CD2 4.08Å; M582-F645 HydrophobicContact CE-CE2 3.71Å; M582-F645 HydrophobicContact CE-CZ 4.37Å; M582-F645 HydrophobicContact SD-CE2 4.14Å; T583-F645 HydrophobicContact CG2-CE1 4.32Å; T583-F645 HydrophobicContact CG2-CZ 3.86Å; L588-F645 HydrophobicContact CD1-CE1 4.44Å; L588-F645 HydrophobicContact CD2-CD1 4.46Å; L588-F645 HydrophobicContact CD2-CE1 3.89Å; D641-F645 VanDerWaalsContact O-CB 3.27Å; D641-F645 WeakPolarHBondContact O-CB 3.14Å; D641-F645 PolarHBondContact O-N 2.8Å; F642-F645 WeakPolarHBondContact O-CB 3.42Å; F642-F645 PolarHBondContact O-N 3.06Å; L643-F645 VanDerWaalsContact C-N 3.33Å; F645-R647 VanDerWaalsContact C-N 3.29Å; F645-R647 PolarHBondContact O-N 3.28Å; F645-R648 PolarHBondContact O-N 3.08Å; F645-F649 AromaticContact CD2-CD2 3.42Å; F645-F649 HydrophobicContact CD2-CD2 3.42Å; F645-F649 VanDerWaalsContact CD2-CD2 3.42Å; F645-F649 AromaticContact CD2-CE2 3.95Å; F645-F649 HydrophobicContact CD2-CE2 3.95Å; F645-F649 HydrophobicContact CD2-CG 4.39Å; F645-F649 HydrophobicContact CE1-CB 4.22Å; F645-F649 HydrophobicContact CE2-CB 4.19Å; F645-F649 AromaticContact CE2-CD2 3.47Å; F645-F649 HydrophobicContact CE2-CD2 3.47Å; F645-F649 VanDerWaalsContact CE2-CD2 3.47Å; F645-F649 HydrophobicContact CE2-CE2 4.14Å; F645-F649 HydrophobicContact CE2-CG 4.06Å; F645-F649 HydrophobicContact CG-CD2 4.03Å; F645-F649 HydrophobicContact CZ-CB 3.95Å; F645-F649 HydrophobicContact CZ-CD2 4.11Å; F645-F649 HydrophobicContact CZ-CG 4.33Å; F645-F649 WeakPolarHBondContact O-CD2 3.49Å; F645-F649 PolarHBondContact O-N 3.39Å
646	L	93.4	Very high	91.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.2	-43.3	179.9	-72	-176.9	0	0	0	111.1	L588 L592 F642 L643 R648 F649 A650 D651 I653 L654	L588-L646 HydrophobicContact CD1-CD2 4.17Å; L588-L646 HydrophobicContact CD2-CD2 4.21Å; L592-L646 HydrophobicContact CD1-CD1 4.14Å; F642-L646 HydrophobicContact CD1-CD1 4.15Å; F642-L646 HydrophobicContact CD1-CG 4.39Å; F642-L646 HydrophobicContact CE1-CD1 3.46Å; F642-L646 VanDerWaalsContact CE1-CD1 3.46Å; F642-L646 HydrophobicContact CE1-CD2 4.35Å; F642-L646 HydrophobicContact CE1-CG 3.88Å; F642-L646 HydrophobicContact CE2-CD2 4.18Å; F642-L646 HydrophobicContact CE2-CG 4.27Å; F642-L646 HydrophobicContact CZ-CD1 3.77Å; F642-L646 HydrophobicContact CZ-CD2 3.8Å; F642-L646 HydrophobicContact CZ-CG 3.82Å; F642-L646 WeakPolarHBondContact O-CG 3.48Å; F642-L646 PolarHBondContact O-N 3.14Å; L643-L646 PolarHBondContact O-N 2.94Å; L646-R648 PolarHBondContact O-N 3.05Å; L646-F649 PolarHBondContact O-N 3.4Å; L646-A650 HydrophobicContact CD2-CB 3.84Å; L646-A650 CarbonylContact O-C 3.42Å; L646-A650 WeakPolarHBondContact O-CA 3.43Å; L646-A650 PolarHBondContact O-N 3.16Å; L646-D651 PolarHBondContact O-N 3.11Å; L646-I653 HydrophobicContact CD1-CG2 4.34Å; L646-I653 HydrophobicContact CD2-CB 4.4Å; L646-I653 HydrophobicContact CD2-CD1 4.44Å; L646-I653 HydrophobicContact CD2-CG2 4.41Å; L646-L654 HydrophobicContact CB-CD1 3.68Å; L646-L654 HydrophobicContact CB-CD2 4.03Å; L646-L654 HydrophobicContact CB-CG 3.64Å; L646-L654 HydrophobicContact CD1-CD2 3.61Å; L646-L654 HydrophobicContact CD1-CG 3.93Å; L646-L654 HydrophobicContact CG-CD2 4.5Å; L646-L654 HydrophobicContact CG-CG 4.46Å
647	R	90.7	Very high	90.5	Very high	51 Å²	51	30.2 Å²	30.2	19%	0.192	15%	0.153	C	C	.	.	H	α-helix	trans	-56.7	-38.3	177	173.8	58.8	-174.5	137.1	-3.7	112.9	L643 I644 F645 D651 L654 A693 H697 Q700	L643-R647 PolarHBondContact O-N 3.33Å; L643-R647 VanDerWaalsContact O-N 3.13Å; I644-R647 PolarHBondContact O-N 3Å; F645-R647 VanDerWaalsContact C-N 3.29Å; F645-R647 PolarHBondContact O-N 3.28Å; R647-D651 VanDerWaalsContact CD-OD1 3.31Å; R647-D651 WeakPolarHBondContact CD-OD1 3.41Å; R647-D651 IonicContact CZ-OD1 3.14Å; R647-D651 IonicContact NE-OD1 3.32Å; R647-D651 IonicContact NH1-OD1 3.29Å; R647-D651 PolarHBondContact NH1-OD1 3.48Å; R647-D651 IonicContact NH1-OD2 3.04Å; R647-D651 PolarHBondContact NH1-OD2 3.33Å; R647-L654 HydrophobicContact CB-CD1 4.09Å; R647-A693 HydrophobicContact CB-CB 3.8Å; R647-A693 WeakPolarHBondContact CD-O 3.27Å; R647-A693 HydrophobicContact CG-CB 4.08Å; R647-H697 PolarHBondContact NE-CD2 2.96Å; R647-H697 VanDerWaalsContact NE-CD2 3.33Å; R647-H697 PolarHBondContact NE-NE2 3.26Å; R647-H697 PolarHBondContact NH2-CD2 2.95Å; R647-H697 PolarHBondContact NH2-NE2 3.06Å; R647-Q700 VanDerWaalsContact NH1-NE2 3.17Å; R647-Q700 VanDerWaalsContact NH2-NE2 3.16Å
648	R	88.8	Confident	89.6	Confident	117 Å²	117	28.9 Å²	28.9	44%	0.442	15%	0.146	S	C	.	.	H	α-helix	trans	-83	-35.6	-175.7	-67.5	175.6	-175.9	174.8	5.4	113.1	I644 F645 L646 E689	I644-R648 WeakPolarHBondContact O-CG 3.48Å; I644-R648 PolarHBondContact O-N 3.13Å; F645-R648 PolarHBondContact O-N 3.08Å; L646-R648 PolarHBondContact O-N 3.05Å; R648-E689 IonicContact NH2-OE1 2.71Å; R648-E689 PolarHBondContact NH2-OE1 3.44Å
649	F	90.1	Very high	88.8	Confident	35 Å²	35	34.9 Å²	34.9	15%	0.154	18%	0.179	C	C	.	.	H	α-helix	trans	-124.3	-15.6	-166.4	-56.9	-68.9	0	0	0	115	M536 T583 F645 L646	M536-F649 HydrophobicContact CE-CD1 3.67Å; M536-F649 HydrophobicContact CE-CE1 3.5Å; M536-F649 VanDerWaalsContact CE-CE1 3.5Å; M536-F649 HydrophobicContact CE-CE2 4.37Å; M536-F649 HydrophobicContact CE-CG 4.2Å; M536-F649 HydrophobicContact CE-CZ 3.87Å; M536-F649 HydrophobicContact CG-CZ 4.25Å; M536-F649 HydrophobicContact SD-CD2 4.45Å; M536-F649 HydrophobicContact SD-CE1 4.26Å; M536-F649 HydrophobicContact SD-CE2 4.12Å; M536-F649 HydrophobicContact SD-CZ 4.02Å; T583-F649 HydrophobicContact CG2-CB 4.24Å; F645-F649 AromaticContact CD2-CD2 3.42Å; F645-F649 HydrophobicContact CD2-CD2 3.42Å; F645-F649 VanDerWaalsContact CD2-CD2 3.42Å; F645-F649 AromaticContact CD2-CE2 3.95Å; F645-F649 HydrophobicContact CD2-CE2 3.95Å; F645-F649 HydrophobicContact CD2-CG 4.39Å; F645-F649 HydrophobicContact CE1-CB 4.22Å; F645-F649 HydrophobicContact CE2-CB 4.19Å; F645-F649 AromaticContact CE2-CD2 3.47Å; F645-F649 HydrophobicContact CE2-CD2 3.47Å; F645-F649 VanDerWaalsContact CE2-CD2 3.47Å; F645-F649 HydrophobicContact CE2-CE2 4.14Å; F645-F649 HydrophobicContact CE2-CG 4.06Å; F645-F649 HydrophobicContact CG-CD2 4.03Å; F645-F649 HydrophobicContact CZ-CB 3.95Å; F645-F649 HydrophobicContact CZ-CD2 4.11Å; F645-F649 HydrophobicContact CZ-CG 4.33Å; F645-F649 WeakPolarHBondContact O-CD2 3.49Å; F645-F649 PolarHBondContact O-N 3.39Å; L646-F649 PolarHBondContact O-N 3.4Å
650	A	89.5	Confident	88.4	Confident	15 Å²	15	35.9 Å²	35.9	12%	0.124	19%	0.186	C	C	.	.			trans	-151.5	49.6	-175.6	0	0	0	0	0	112.8	L588 L646 D652 I653	L588-A650 HydrophobicContact CD1-CB 3.72Å; L646-A650 HydrophobicContact CD2-CB 3.84Å; L646-A650 CarbonylContact O-C 3.42Å; L646-A650 WeakPolarHBondContact O-CA 3.43Å; L646-A650 PolarHBondContact O-N 3.16Å; A650-D652 PolarHBondContact O-N 3.01Å; A650-D652 VanDerWaalsContact O-N 3.14Å; A650-I653 HydrophobicContact CB-CD1 4.09Å; A650-I653 HydrophobicContact CB-CG1 4.39Å; A650-I653 PolarHBondContact O-N 2.96Å
651	D	87.3	Confident	88.2	Confident	31 Å²	31	36.5 Å²	36.5	17%	0.166	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-29	-174.5	-162.2	54.8	0	0	0	112.7	L646 R647 I653 L654 E655 R712	L646-D651 PolarHBondContact O-N 3.11Å; R647-D651 VanDerWaalsContact CD-OD1 3.31Å; R647-D651 WeakPolarHBondContact CD-OD1 3.41Å; R647-D651 IonicContact CZ-OD1 3.14Å; R647-D651 IonicContact NE-OD1 3.32Å; R647-D651 IonicContact NH1-OD1 3.29Å; R647-D651 PolarHBondContact NH1-OD1 3.48Å; R647-D651 IonicContact NH1-OD2 3.04Å; R647-D651 PolarHBondContact NH1-OD2 3.33Å; D651-I653 VanDerWaalsContact C-N 3.26Å; D651-I653 PolarHBondContact O-N 3.09Å; D651-L654 WeakPolarHBondContact O-CB 3.35Å; D651-L654 PolarHBondContact O-N 3.41Å; D651-L654 VanDerWaalsContact O-N 3.1Å; D651-E655 PolarHBondContact O-N 2.97Å; D651-E655 VanDerWaalsContact O-N 3.08Å; D651-R712 IonicContact OD1-CZ 2.79Å; D651-R712 IonicContact OD1-NH1 3.99Å; D651-R712 PolarHBondContact OD1-NH1 2.95Å; D651-R712 IonicContact OD1-NH2 3.62Å; D651-R712 IonicContact OD2-NH2 3.01Å; D651-R712 PolarHBondContact OD2-NH2 3.09Å
652	D	85.4	Confident	88.1	Confident	120 Å²	120	40 Å²	40	64%	0.642	21%	0.205	S	C	*	.	H	α-helix	trans	-59.8	-33.7	177.2	-64.5	-31.8	0	0	0	112.7	A650 E655 T656	A650-D652 PolarHBondContact O-N 3.01Å; A650-D652 VanDerWaalsContact O-N 3.14Å; D652-E655 PolarHBondContact O-N 2.81Å; D652-T656 WeakPolarHBondContact O-CG2 3.08Å; D652-T656 PolarHBondContact O-N 2.87Å; D652-T656 VanDerWaalsContact O-N 3.13Å; D652-T656 PolarHBondContact O-OG1 2.93Å
653	I	87.1	Confident	88	Confident	26 Å²	26	41.9 Å²	41.9	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-70.2	-36.3	177.7	-62.8	-178.5	0	0	0	110.6	L588 L592 L646 A650 D651 T656 S657	L588-I653 HydrophobicContact CB-CD1 3.53Å; L588-I653 HydrophobicContact CD1-CD1 3.5Å; L588-I653 VanDerWaalsContact CD1-CD1 3.5Å; L588-I653 HydrophobicContact CG-CD1 4.18Å; L592-I653 HydrophobicContact CD2-CG2 3.88Å; L646-I653 HydrophobicContact CD1-CG2 4.34Å; L646-I653 HydrophobicContact CD2-CB 4.4Å; L646-I653 HydrophobicContact CD2-CD1 4.44Å; L646-I653 HydrophobicContact CD2-CG2 4.41Å; A650-I653 HydrophobicContact CB-CD1 4.09Å; A650-I653 HydrophobicContact CB-CG1 4.39Å; A650-I653 PolarHBondContact O-N 2.96Å; D651-I653 VanDerWaalsContact C-N 3.26Å; D651-I653 PolarHBondContact O-N 3.09Å; I653-T656 PolarHBondContact O-OG1 3.22Å; I653-S657 VanDerWaalsContact O-CB 3.29Å; I653-S657 WeakPolarHBondContact O-CB 3.41Å; I653-S657 PolarHBondContact O-N 3.28Å; I653-S657 PolarHBondContact O-OG 3.36Å
654	L	83.8	Confident	88	Confident	15 Å²	15	41.9 Å²	41.9	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-67.8	-43.1	175.4	-72.2	172.1	0	0	0	111.5	L643 L646 R647 D651 T656 S657	L643-L654 HydrophobicContact CD2-CD2 3.94Å; L646-L654 HydrophobicContact CB-CD1 3.68Å; L646-L654 HydrophobicContact CB-CD2 4.03Å; L646-L654 HydrophobicContact CB-CG 3.64Å; L646-L654 HydrophobicContact CD1-CD2 3.61Å; L646-L654 HydrophobicContact CD1-CG 3.93Å; L646-L654 HydrophobicContact CG-CD2 4.5Å; L646-L654 HydrophobicContact CG-CG 4.46Å; R647-L654 HydrophobicContact CB-CD1 4.09Å; D651-L654 WeakPolarHBondContact O-CB 3.35Å; D651-L654 PolarHBondContact O-N 3.41Å; D651-L654 VanDerWaalsContact O-N 3.1Å; L654-T656 VanDerWaalsContact C-N 3.34Å; L654-T656 PolarHBondContact O-N 3.35Å; L654-S657 PolarHBondContact O-N 3.04Å
655	E	84.3	Confident	88.1	Confident	42 Å²	42	41.7 Å²	41.7	20%	0.196	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-34.7	-178.3	-163	64.2	-121.3	0	0	112.4	D651 D652 S657 H711 R712	D651-E655 PolarHBondContact O-N 2.97Å; D651-E655 VanDerWaalsContact O-N 3.08Å; D652-E655 PolarHBondContact O-N 2.81Å; E655-S657 VanDerWaalsContact C-N 3.32Å; E655-S657 PolarHBondContact O-N 3.32Å; E655-H711 WeakPolarHBondContact O-CB 3.29Å; E655-H711 PolarHBondContact O-ND1 2.61Å; E655-H711 PolarHBondContact OE1-N 2.97Å; E655-R712 PolarHBondContact OE1-N 2.9Å; E655-R712 VanDerWaalsContact OE1-N 3.09Å; E655-R712 IonicContact OE1-NE 3.14Å; E655-R712 IonicContact OE2-CZ 3.63Å; E655-R712 IonicContact OE2-NE 3.45Å; E655-R712 PolarHBondContact OE2-NE 3.19Å; E655-R712 IonicContact OE2-NH2 3.89Å; E655-R712 PolarHBondContact OE2-NH2 3.34Å
656	T	83.9	Confident	88.2	Confident	101 Å²	101	42.7 Å²	42.7	62%	0.62	22%	0.217	S	C	*	.	H	α-helix	trans	-77	-16.3	179.2	49.5	0	0	0	0	113.7	D652 I653 L654 A658	D652-T656 WeakPolarHBondContact O-CG2 3.08Å; D652-T656 PolarHBondContact O-N 2.87Å; D652-T656 VanDerWaalsContact O-N 3.13Å; D652-T656 PolarHBondContact O-OG1 2.93Å; I653-T656 PolarHBondContact O-OG1 3.22Å; L654-T656 VanDerWaalsContact C-N 3.34Å; L654-T656 PolarHBondContact O-N 3.35Å; T656-A658 PolarHBondContact O-N 3.42Å
657	S	82.3	Confident	88.4	Confident	18 Å²	18	42.7 Å²	42.7	13%	0.126	22%	0.217	C	C	.	.			trans	-103.2	44	-172.1	-59.3	0	0	0	0	114.4	L592 I653 L654 E655 D659 S660 L661	L592-S657 WeakPolarHBondContact CD2-OG 3.49Å; I653-S657 VanDerWaalsContact O-CB 3.29Å; I653-S657 WeakPolarHBondContact O-CB 3.41Å; I653-S657 PolarHBondContact O-N 3.28Å; I653-S657 PolarHBondContact O-OG 3.36Å; L654-S657 PolarHBondContact O-N 3.04Å; E655-S657 VanDerWaalsContact C-N 3.32Å; E655-S657 PolarHBondContact O-N 3.32Å; S657-D659 VanDerWaalsContact C-N 3.34Å; S657-D659 PolarHBondContact O-N 2.85Å; S657-S660 WeakPolarHBondContact O-CB 3.34Å; S657-S660 PolarHBondContact O-N 3.44Å; S657-S660 VanDerWaalsContact O-N 3.16Å; S657-L661 PolarHBondContact O-N 3Å
658	A	74.4	Confident	88.7	Confident	5 Å²	5	40.2 Å²	40.2	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-55.5	-43.1	-174.1	0	0	0	0	0	113.9	T656 S660 L661 H711 V715	T656-A658 PolarHBondContact O-N 3.42Å; A658-S660 PolarHBondContact O-N 3.25Å; A658-L661 WeakPolarHBondContact O-CB 3.47Å; A658-L661 PolarHBondContact O-N 3.16Å; A658-L661 VanDerWaalsContact O-N 3.11Å; A658-H711 HydrophobicContact CB-CB 3.61Å; A658-V715 HydrophobicContact CB-CG2 4.14Å; A658-V715 WeakPolarHBondContact O-CG2 3.36Å
659	D	79.1	Confident	89.1	Confident	132 Å²	132	35 Å²	35	71%	0.706	19%	0.189	S	C	*	.	H	α-helix	trans	-65	-26.6	-175.8	-61.4	-18.4	0	0	0	112.2	S657	S657-D659 VanDerWaalsContact C-N 3.34Å; S657-D659 PolarHBondContact O-N 2.85Å
660	S	86.1	Confident	89.4	Confident	23 Å²	23	33.6 Å²	33.6	16%	0.161	18%	0.183	C	C	.	.	H	α-helix	trans	-78.5	-26.5	177.3	-67.5	0	0	0	0	113.2	S657 A658 E662 H663	S657-S660 WeakPolarHBondContact O-CB 3.34Å; S657-S660 PolarHBondContact O-N 3.44Å; S657-S660 VanDerWaalsContact O-N 3.16Å; A658-S660 PolarHBondContact O-N 3.25Å; S660-E662 VanDerWaalsContact C-N 3.33Å; S660-E662 PolarHBondContact O-N 2.86Å; S660-H663 PolarHBondContact O-N 3.41Å
661	L	90.4	Very high	89.8	Confident	14 Å²	14	32.9 Å²	32.9	7%	0.073	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-34.5	-173	178.4	58.7	0	0	0	112.4	S657 A658 H663 V664 L665 V694 R712 V715 F716	S657-L661 PolarHBondContact O-N 3Å; A658-L661 WeakPolarHBondContact O-CB 3.47Å; A658-L661 PolarHBondContact O-N 3.16Å; A658-L661 VanDerWaalsContact O-N 3.11Å; L661-H663 VanDerWaalsContact C-N 3.27Å; L661-H663 PolarHBondContact O-N 3.13Å; L661-V664 WeakPolarHBondContact O-CB 3.27Å; L661-V664 PolarHBondContact O-N 2.82Å; L661-V664 VanDerWaalsContact O-N 3.1Å; L661-L665 HydrophobicContact CD1-CG 4.43Å; L661-L665 HydrophobicContact CG-CG 4.43Å; L661-L665 WeakPolarHBondContact O-CG 3.33Å; L661-L665 PolarHBondContact O-N 3.41Å; L661-V694 HydrophobicContact CD1-CB 3.68Å; L661-V694 HydrophobicContact CD1-CG1 4.33Å; L661-V694 HydrophobicContact CD1-CG2 3.82Å; L661-R712 HydrophobicContact CD2-CB 4.12Å; L661-R712 HydrophobicContact CD2-CG 3.96Å; L661-V715 HydrophobicContact CB-CG1 4.24Å; L661-V715 HydrophobicContact CD2-CB 4.02Å; L661-V715 HydrophobicContact CD2-CG1 4.04Å; L661-V715 HydrophobicContact CD2-CG2 4.4Å; L661-V715 HydrophobicContact CG-CG1 4Å; L661-F716 HydrophobicContact CD1-CE2 4.46Å; L661-F716 HydrophobicContact CD2-CD2 4.17Å; L661-F716 HydrophobicContact CD2-CE2 3.94Å; L661-F716 HydrophobicContact CG-CE2 4.48Å
662	E	92.4	Very high	90.2	Very high	85 Å²	85	31.5 Å²	31.5	40%	0.397	17%	0.17	S	C	.	.	H	α-helix	trans	-57.7	-41.4	178.1	-169.5	-173.9	159	0	0	111.7	S660 V664 L665 H666 V715 F719	S660-E662 VanDerWaalsContact C-N 3.33Å; S660-E662 PolarHBondContact O-N 2.86Å; E662-V664 VanDerWaalsContact C-N 3.34Å; E662-V664 PolarHBondContact O-N 3.32Å; E662-L665 PolarHBondContact O-N 3.08Å; E662-H666 PolarHBondContact O-N 2.63Å; E662-H666 PolarHBondContact O-ND1 3.41Å; E662-H666 IonicContact OE1-CE1 2.84Å; E662-H666 PolarHBondContact OE1-CE1 3.33Å; E662-H666 IonicContact OE1-NE2 2.81Å; E662-V715 HydrophobicContact CB-CG1 4.42Å; E662-F719 HydrophobicContact CG-CD2 4.38Å; E662-F719 HydrophobicContact CG-CE2 4.37Å
663	H	94.3	Very high	90.4	Very high	41 Å²	41	26.1 Å²	26.1	19%	0.19	14%	0.143	C	C	.	.	H	α-helix	trans	-66.1	-35.9	177.2	-60.5	-57.9	0	0	0	112.8	P459 V596 V600 S660 L661 H666 F667	P459-H663 WeakPolarHBondContact CB-NE2 3.15Å; V596-H663 HydrophobicContact CG1-CB 4.1Å; V600-H663 HydrophobicContact CG2-CB 3.78Å; S660-H663 PolarHBondContact O-N 3.41Å; L661-H663 VanDerWaalsContact C-N 3.27Å; L661-H663 PolarHBondContact O-N 3.13Å; H663-H666 PolarHBondContact O-N 3.34Å; H663-F667 PolarHBondContact O-N 3.36Å; H663-F667 VanDerWaalsContact O-N 3.12Å
664	V	95.6	Very high	90.6	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.024	14%	0.141	C	C	.	.	H	α-helix	trans	-65.8	-42.1	173.4	175.7	0	0	0	0	110.5	V596 L643 L661 E662 H666 F667 I668	V596-V664 HydrophobicContact CG2-CG2 4.34Å; L643-V664 HydrophobicContact CD1-CG1 3.53Å; L643-V664 HydrophobicContact CD1-CG2 4.19Å; L661-V664 WeakPolarHBondContact O-CB 3.27Å; L661-V664 PolarHBondContact O-N 2.82Å; L661-V664 VanDerWaalsContact O-N 3.1Å; E662-V664 VanDerWaalsContact C-N 3.34Å; E662-V664 PolarHBondContact O-N 3.32Å; V664-H666 PolarHBondContact O-N 3Å; V664-F667 WeakPolarHBondContact O-CB 3.44Å; V664-F667 PolarHBondContact O-N 3.06Å; V664-I668 HydrophobicContact CG1-CD1 3.86Å; V664-I668 HydrophobicContact CG1-CG1 4.43Å; V664-I668 WeakPolarHBondContact O-CG1 3.36Å; V664-I668 PolarHBondContact O-N 3.02Å
665	L	96.3	Very high	91	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-38.4	176.2	-65.5	-179.3	0	0	0	112.3	L661 E662 I668 T669 L691 V694 V715 F716 F719 L725	L661-L665 HydrophobicContact CD1-CG 4.43Å; L661-L665 HydrophobicContact CG-CG 4.43Å; L661-L665 WeakPolarHBondContact O-CG 3.33Å; L661-L665 PolarHBondContact O-N 3.41Å; E662-L665 PolarHBondContact O-N 3.08Å; L665-I668 PolarHBondContact O-N 2.93Å; L665-T669 VanDerWaalsContact O-CB 3.31Å; L665-T669 WeakPolarHBondContact O-CB 3.49Å; L665-T669 PolarHBondContact O-N 3.06Å; L665-T669 PolarHBondContact O-OG1 3.41Å; L665-L691 HydrophobicContact CD2-CD1 3.88Å; L665-V694 HydrophobicContact CD2-CG2 4.48Å; L665-V715 HydrophobicContact CD1-CG1 3.95Å; L665-F716 HydrophobicContact CD1-CD2 4.33Å; L665-F716 HydrophobicContact CD1-CE2 4.29Å; L665-F716 HydrophobicContact CD1-CZ 4.44Å; L665-F716 HydrophobicContact CD2-CE1 4.01Å; L665-F716 HydrophobicContact CD2-CE2 4.12Å; L665-F716 HydrophobicContact CD2-CZ 3.64Å; L665-F719 HydrophobicContact CB-CD2 4.06Å; L665-F719 HydrophobicContact CB-CE1 4.14Å; L665-F719 HydrophobicContact CB-CE2 3.55Å; L665-F719 HydrophobicContact CB-CZ 3.59Å; L665-F719 HydrophobicContact CD1-CB 4.36Å; L665-F719 HydrophobicContact CD1-CD1 4.41Å; L665-F719 HydrophobicContact CD1-CD2 3.85Å; L665-F719 HydrophobicContact CD1-CE2 4.24Å; L665-F719 HydrophobicContact CD1-CG 3.96Å; L665-L725 HydrophobicContact CD2-CD2 4.19Å
666	H	96.6	Very high	91.4	Very high	21 Å²	21	31.4 Å²	31.4	10%	0.097	17%	0.17	C	C	.	.	H	α-helix	trans	-58.4	-46.9	171.7	-68.7	142.2	0	0	0	112	V603 L617 E662 H663 V664 T669 I670 F719 Y721	V603-H666 HydrophobicContact CG2-CB 4.22Å; L617-H666 HydrophobicContact CD2-CB 4.04Å; L617-H666 VanDerWaalsContact CD2-CD2 3.43Å; L617-H666 WeakPolarHBondContact CD2-CD2 3.43Å; E662-H666 PolarHBondContact O-N 2.63Å; E662-H666 PolarHBondContact O-ND1 3.41Å; E662-H666 IonicContact OE1-CE1 2.84Å; E662-H666 PolarHBondContact OE1-CE1 3.33Å; E662-H666 IonicContact OE1-NE2 2.81Å; H663-H666 PolarHBondContact O-N 3.34Å; V664-H666 PolarHBondContact O-N 3Å; H666-T669 PolarHBondContact O-N 3.28Å; H666-I670 WeakPolarHBondContact O-CG1 3.41Å; H666-I670 PolarHBondContact O-N 3.16Å; H666-I670 VanDerWaalsContact O-N 3.13Å; H666-F719 AromaticContact CD2-CE2 3.61Å; H666-F719 AromaticContact CD2-CZ 3.74Å; H666-F719 AromaticContact NE2-CE2 3.66Å; H666-Y721 AromaticContact CD2-CD2 3.59Å; H666-Y721 AromaticContact CD2-CE2 3.96Å; H666-Y721 AromaticContact NE2-CD2 3.47Å; H666-Y721 WeakPolarHBondContact NE2-CD2 3.48Å; H666-Y721 AromaticContact NE2-CE2 3.56Å
667	F	97.5	Very high	91.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.4	-50.4	176.5	169.6	-103.1	0	0	0	111.9	A599 L602 V603 A636 L639 H663 V664 T669 I670 F671 M678 L687	A599-F667 HydrophobicContact CB-CB 3.89Å; A599-F667 HydrophobicContact CB-CG 4.34Å; L602-F667 HydrophobicContact CB-CD2 4.09Å; L602-F667 HydrophobicContact CB-CE2 4.1Å; L602-F667 HydrophobicContact CD1-CD2 4.2Å; L602-F667 HydrophobicContact CD1-CE2 3.56Å; L602-F667 HydrophobicContact CD1-CZ 4.23Å; L602-F667 HydrophobicContact CG-CE2 4.49Å; V603-F667 HydrophobicContact CG2-CB 4.01Å; A636-F667 HydrophobicContact CB-CZ 3.94Å; L639-F667 HydrophobicContact CD1-CD1 4.13Å; L639-F667 HydrophobicContact CD1-CE1 4.08Å; L639-F667 HydrophobicContact CD1-CG 4.46Å; L639-F667 HydrophobicContact CD1-CZ 4.38Å; L639-F667 HydrophobicContact CD2-CD1 3.92Å; L639-F667 HydrophobicContact CD2-CE1 3.72Å; H663-F667 PolarHBondContact O-N 3.36Å; H663-F667 VanDerWaalsContact O-N 3.12Å; V664-F667 WeakPolarHBondContact O-CB 3.44Å; V664-F667 PolarHBondContact O-N 3.06Å; F667-T669 PolarHBondContact O-N 3.19Å; F667-I670 PolarHBondContact O-N 3.05Å; F667-F671 AromaticContact CD2-CD2 3.33Å; F667-F671 HydrophobicContact CD2-CD2 3.33Å; F667-F671 AromaticContact CD2-CE2 3.56Å; F667-F671 HydrophobicContact CD2-CE2 3.56Å; F667-F671 HydrophobicContact CD2-CG 4.27Å; F667-F671 HydrophobicContact CE2-CB 4.47Å; F667-F671 AromaticContact CE2-CD2 3.42Å; F667-F671 HydrophobicContact CE2-CD2 3.42Å; F667-F671 VanDerWaalsContact CE2-CD2 3.42Å; F667-F671 AromaticContact CE2-CE2 3.69Å; F667-F671 HydrophobicContact CE2-CE2 3.69Å; F667-F671 AromaticContact CE2-CG 3.96Å; F667-F671 HydrophobicContact CE2-CG 3.96Å; F667-F671 HydrophobicContact CE2-CZ 4.42Å; F667-F671 HydrophobicContact CG-CD2 4.23Å; F667-F671 HydrophobicContact CZ-CD2 4.39Å; F667-F671 WeakPolarHBondContact O-CD2 3.09Å; F667-F671 PolarHBondContact O-N 3.37Å; F667-F671 VanDerWaalsContact O-N 3.09Å; F667-M678 HydrophobicContact CZ-CE 4.41Å; F667-L687 HydrophobicContact CD1-CD2 4.48Å; F667-L687 HydrophobicContact CE1-CD1 4.2Å; F667-L687 HydrophobicContact CE1-CD2 3.54Å; F667-L687 HydrophobicContact CZ-CD1 4.39Å; F667-L687 HydrophobicContact CZ-CD2 4.12Å
668	I	97.9	Very high	92.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.5	-47.7	177.8	-64.9	167.5	0	0	0	110.5	V664 L665 I670 F671 T672 V690 L691 V694 L725	V664-I668 HydrophobicContact CG1-CD1 3.86Å; V664-I668 HydrophobicContact CG1-CG1 4.43Å; V664-I668 WeakPolarHBondContact O-CG1 3.36Å; V664-I668 PolarHBondContact O-N 3.02Å; L665-I668 PolarHBondContact O-N 2.93Å; I668-I670 VanDerWaalsContact C-N 3.3Å; I668-I670 PolarHBondContact O-N 2.93Å; I668-F671 PolarHBondContact O-N 2.89Å; I668-T672 WeakPolarHBondContact CG2-OG1 3.21Å; I668-T672 WeakPolarHBondContact O-CB 3.4Å; I668-T672 PolarHBondContact O-N 3.45Å; I668-T672 PolarHBondContact O-OG1 3.43Å; I668-V690 HydrophobicContact CD1-CG1 4.07Å; I668-L691 HydrophobicContact CD1-CB 4.17Å; I668-L691 HydrophobicContact CD1-CD1 4.21Å; I668-L691 HydrophobicContact CG2-CB 4.21Å; I668-L691 HydrophobicContact CG2-CD1 4.44Å; I668-L691 HydrophobicContact CG2-CD2 4.26Å; I668-V694 HydrophobicContact CD1-CG2 4.4Å; I668-L725 HydrophobicContact CB-CD1 4.48Å; I668-L725 HydrophobicContact CG2-CD1 3.77Å
669	T	97.2	Very high	93.4	Very high	8 Å²	8	31.6 Å²	31.6	5%	0.049	16%	0.158	C	C	.	.	H	α-helix	trans	-56.7	-42.3	-178.3	-56	0	0	0	0	112.3	F619 L665 H666 F667 Q724 L725	F619-T669 HydrophobicContact CZ-CG2 3.85Å; L665-T669 VanDerWaalsContact O-CB 3.31Å; L665-T669 WeakPolarHBondContact O-CB 3.49Å; L665-T669 PolarHBondContact O-N 3.06Å; L665-T669 PolarHBondContact O-OG1 3.41Å; H666-T669 PolarHBondContact O-N 3.28Å; F667-T669 PolarHBondContact O-N 3.19Å; T669-Q724 HydrophobicContact CG2-CB 3.61Å; T669-L725 HydrophobicContact CG2-CB 4.34Å
670	I	96.4	Very high	94	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-77.2	-41.3	-176.2	-67.2	178.7	0	0	0	112.3	V603 A606 L617 F619 L621 H666 F667 I668 S674	V603-I670 HydrophobicContact CB-CD1 4.28Å; V603-I670 HydrophobicContact CG1-CD1 3.67Å; V603-I670 HydrophobicContact CG2-CD1 4.03Å; A606-I670 HydrophobicContact CB-CG2 3.96Å; L617-I670 HydrophobicContact CD1-CD1 3.58Å; L617-I670 HydrophobicContact CD1-CG1 4.44Å; L617-I670 HydrophobicContact CD2-CD1 4.14Å; F619-I670 HydrophobicContact CZ-CG1 4.31Å; L621-I670 HydrophobicContact CD1-CB 4.4Å; L621-I670 HydrophobicContact CD1-CG1 4.08Å; L621-I670 HydrophobicContact CD1-CG2 3.9Å; L621-I670 HydrophobicContact CD2-CD1 4.24Å; L621-I670 HydrophobicContact CD2-CG1 4.34Å; H666-I670 WeakPolarHBondContact O-CG1 3.41Å; H666-I670 PolarHBondContact O-N 3.16Å; H666-I670 VanDerWaalsContact O-N 3.13Å; F667-I670 PolarHBondContact O-N 3.05Å; I668-I670 VanDerWaalsContact C-N 3.3Å; I668-I670 PolarHBondContact O-N 2.93Å; I670-S674 WeakPolarHBondContact O-CB 3.46Å
671	F	97.1	Very high	94.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-94.1	-35.3	-168.5	-75	-82.8	0	0	0	113.8	L498 L602 A606 L628 F667 I668 G673 S674 R677 M678 L687	L498-F671 HydrophobicContact CD1-CE1 4.26Å; L602-F671 HydrophobicContact CB-CE2 3.99Å; L602-F671 HydrophobicContact CB-CZ 4.05Å; A606-F671 HydrophobicContact CB-CE2 4.14Å; A606-F671 HydrophobicContact CB-CZ 3.8Å; L628-F671 HydrophobicContact CD1-CE1 3.9Å; L628-F671 HydrophobicContact CD1-CZ 4.2Å; L628-F671 HydrophobicContact CD2-CE1 4.37Å; L628-F671 HydrophobicContact CD2-CZ 4.15Å; F667-F671 AromaticContact CD2-CD2 3.33Å; F667-F671 HydrophobicContact CD2-CD2 3.33Å; F667-F671 AromaticContact CD2-CE2 3.56Å; F667-F671 HydrophobicContact CD2-CE2 3.56Å; F667-F671 HydrophobicContact CD2-CG 4.27Å; F667-F671 HydrophobicContact CE2-CB 4.47Å; F667-F671 AromaticContact CE2-CD2 3.42Å; F667-F671 HydrophobicContact CE2-CD2 3.42Å; F667-F671 VanDerWaalsContact CE2-CD2 3.42Å; F667-F671 AromaticContact CE2-CE2 3.69Å; F667-F671 HydrophobicContact CE2-CE2 3.69Å; F667-F671 AromaticContact CE2-CG 3.96Å; F667-F671 HydrophobicContact CE2-CG 3.96Å; F667-F671 HydrophobicContact CE2-CZ 4.42Å; F667-F671 HydrophobicContact CG-CD2 4.23Å; F667-F671 HydrophobicContact CZ-CD2 4.39Å; F667-F671 WeakPolarHBondContact O-CD2 3.09Å; F667-F671 PolarHBondContact O-N 3.37Å; F667-F671 VanDerWaalsContact O-N 3.09Å; I668-F671 PolarHBondContact O-N 2.89Å; F671-G673 PolarHBondContact O-N 3.32Å; F671-S674 PolarHBondContact O-N 3.25Å; F671-R677 HydrophobicContact CD1-CB 3.92Å; F671-R677 HydrophobicContact CE1-CB 3.94Å; F671-R677 WeakPolarHBondContact CE1-O 3.48Å; F671-M678 HydrophobicContact CB-CE 3.95Å; F671-M678 HydrophobicContact CD1-CB 3.98Å; F671-M678 HydrophobicContact CD1-CE 3.9Å; F671-M678 HydrophobicContact CG-CE 4.14Å; F671-L687 HydrophobicContact CB-CD1 3.73Å
672	T	95.3	Very high	94.2	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.018	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-47.2	-174.8	-65.5	0	0	0	0	112.5	I668 L687 V732	I668-T672 WeakPolarHBondContact CG2-OG1 3.21Å; I668-T672 WeakPolarHBondContact O-CB 3.4Å; I668-T672 PolarHBondContact O-N 3.45Å; I668-T672 PolarHBondContact O-OG1 3.43Å; T672-L687 VanDerWaalsContact OG1-CB 3.24Å; T672-L687 WeakPolarHBondContact OG1-CB 3.45Å; T672-V732 HydrophobicContact CG2-CB 3.69Å; T672-V732 HydrophobicContact CG2-CG1 3.39Å; T672-V732 HydrophobicContact CG2-CG2 4.19Å
673	G	89.4	Confident	94.2	Very high	6 Å²	6	26.6 Å²	26.6	6%	0.062	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	4.8	-178.9	0	0	0	0	0	115.2	F671 K731	F671-G673 PolarHBondContact O-N 3.32Å; G673-K731 WeakPolarHBondContact O-CD 3.15Å; G673-K731 WeakPolarHBondContact O-CE 3.42Å; G673-K731 PolarHBondContact O-NZ 3.3Å
674	S	92.7	Very high	94.2	Very high	15 Å²	15	25 Å²	25	11%	0.105	13%	0.125	C	C	.	.			trans	-116.7	98.8	-170	-171.6	0	0	0	0	113.8	I670 F671 E676 R677 M678	I670-S674 WeakPolarHBondContact O-CB 3.46Å; F671-S674 PolarHBondContact O-N 3.25Å; S674-E676 PolarHBondContact O-N 3.25Å; S674-R677 PolarHBondContact O-N 3.07Å; S674-R677 WeakPolarHBondContact OG-CG 3.48Å; S674-R677 PolarHBondContact OG-N 2.94Å; S674-M678 PolarHBondContact O-N 3.06Å
675	I	91.8	Very high	94	Very high	65 Å²	65	24.9 Å²	24.9	33%	0.333	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.8	171.6	-64.4	162.8	0	0	0	111.7	R677 K679 D735	I675-R677 VanDerWaalsContact C-N 3.32Å; I675-K679 HydrophobicContact CG2-CD 3.96Å; I675-D735 WeakPolarHBondContact CD1-OD2 3.18Å
676	E	92.3	Very high	93.9	Very high	115 Å²	115	26.3 Å²	26.3	54%	0.537	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.5	-179.4	-69.6	171.5	-176.4	0	0	112.9	I499 Y625 S674	I499-E676 VanDerWaalsContact CG2-O 3.3Å; I499-E676 WeakPolarHBondContact CG2-O 3.43Å; Y625-E676 HydrophobicContact CE2-CB 4.36Å; Y625-E676 WeakPolarHBondContact CE2-O 3.18Å; S674-E676 PolarHBondContact O-N 3.25Å
677	R	94.6	Very high	93.9	Very high	6 Å²	6	25.4 Å²	25.4	2%	0.023	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-22.5	-176.6	-61	179	-175.1	-64	0.2	113.1	I499 A606 P622 Y625 L628 F671 S674 I675	I499-R677 WeakPolarHBondContact CG2-O 3.49Å; A606-R677 PolarHBondContact O-NH1 3.17Å; P622-R677 PolarHBondContact O-NH2 3.35Å; Y625-R677 VanDerWaalsContact CG-NH1 3.34Å; L628-R677 HydrophobicContact CD1-CB 4.01Å; L628-R677 HydrophobicContact CD1-CG 4.38Å; F671-R677 HydrophobicContact CD1-CB 3.92Å; F671-R677 HydrophobicContact CE1-CB 3.94Å; F671-R677 WeakPolarHBondContact CE1-O 3.48Å; S674-R677 PolarHBondContact O-N 3.07Å; S674-R677 WeakPolarHBondContact OG-CG 3.48Å; S674-R677 PolarHBondContact OG-N 2.94Å; I675-R677 VanDerWaalsContact C-N 3.32Å
678	M	95.2	Very high	93.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.			trans	-146.4	105.2	173.7	-178.7	-178	-72.4	0	0	109.3	L498 A636 F667 F671 S674 L683 R684 L687	L498-M678 HydrophobicContact CD2-CE 3.92Å; L498-M678 HydrophobicContact CD2-CG 4.36Å; L498-M678 CarbonylContact O-C 3.59Å; L498-M678 WeakPolarHBondContact O-CA 3.39Å; A636-M678 HydrophobicContact CB-CE 3.9Å; F667-M678 HydrophobicContact CZ-CE 4.41Å; F671-M678 HydrophobicContact CB-CE 3.95Å; F671-M678 HydrophobicContact CD1-CB 3.98Å; F671-M678 HydrophobicContact CD1-CE 3.9Å; F671-M678 HydrophobicContact CG-CE 4.14Å; S674-M678 PolarHBondContact O-N 3.06Å; M678-L683 HydrophobicContact CE-CD2 3.82Å; M678-L683 HydrophobicContact CE-CG 3.99Å; M678-L683 HydrophobicContact CG-CD2 4.15Å; M678-L683 HydrophobicContact CG-CG 4.48Å; M678-L683 HydrophobicContact SD-CB 3.87Å; M678-L683 HydrophobicContact SD-CD2 3.74Å; M678-L683 HydrophobicContact SD-CG 3.57Å; M678-L683 VanDerWaalsContact SD-CG 3.57Å; M678-R684 HydrophobicContact CB-CG 3.96Å; M678-R684 HydrophobicContact CG-CG 3.73Å; M678-R684 WeakPolarHBondContact O-CD 3.31Å; M678-R684 PolarHBondContact O-NE 3.49Å; M678-R684 HydrophobicContact SD-CB 4.35Å; M678-R684 HydrophobicContact SD-CG 3.48Å; M678-R684 WeakPolarHBondContact SD-CG 3.42Å; M678-L687 HydrophobicContact CE-CD1 4.18Å; M678-L687 HydrophobicContact SD-CD1 4.26Å
679	K	93	Very high	93.7	Very high	121 Å²	121	28.5 Å²	28.5	53%	0.526	14%	0.14	S	C	.	.			trans	-71.6	-38.5	-174.2	-170.2	63.1	176.4	-179.5	0	111.9	L498 I675 P681	L498-K679 PolarHBondContact O-N 3.42Å; I675-K679 HydrophobicContact CG2-CD 3.96Å; K679-P681 VanDerWaalsContact O-CD 3.31Å; K679-P681 WeakPolarHBondContact O-CD 3.42Å
680	N	92	Very high	93.6	Very high	39 Å²	39	28.1 Å²	28.1	21%	0.209	14%	0.138	C	C	.	.			trans	-65.7	113.6	-175.6	-174.7	-21	0	0	0	111.6	E633 H682 L683 R684	E633-N680 WeakPolarHBondContact OE1-CB 3.44Å; E633-N680 PolarHBondContact OE2-ND2 3.06Å; N680-H682 VanDerWaalsContact C-N 3.35Å; N680-H682 PolarHBondContact O-N 3.25Å; N680-H682 WeakPolarHBondContact OD1-CB 3.44Å; N680-H682 PolarHBondContact OD1-N 3.39Å; N680-L683 HydrophobicContact CB-CB 4.1Å; N680-L683 PolarHBondContact OD1-N 2.82Å; N680-R684 PolarHBondContact O-N 3.34Å
681	P	90.2	Very high	93.6	Very high	36 Å²	36	28 Å²	28	23%	0.234	14%	0.138	C	C	.	.	H	α-helix	trans	-69.4	-30.3	-178.5	28.5	-34.5	0	0	0	113.1	K679 R684 A685 F738	K679-P681 VanDerWaalsContact O-CD 3.31Å; K679-P681 WeakPolarHBondContact O-CD 3.42Å; P681-R684 PolarHBondContact O-N 2.7Å; P681-A685 VanDerWaalsContact O-CB 3.3Å; P681-A685 WeakPolarHBondContact O-CB 3.4Å; P681-A685 PolarHBondContact O-N 3.11Å; P681-F738 HydrophobicContact CB-CE1 3.84Å; P681-F738 HydrophobicContact CB-CZ 4.1Å; P681-F738 HydrophobicContact CG-CE1 3.68Å; P681-F738 HydrophobicContact CG-CZ 4.26Å
682	H	89.9	Confident	93.5	Very high	67 Å²	67	30.5 Å²	30.5	31%	0.31	15%	0.149	S	C	.	.	H	α-helix	trans	-68.4	-39.9	179.2	-57.3	-67.3	0	0	0	111.1	N680 A685 K686 F738 Y751	N680-H682 VanDerWaalsContact C-N 3.35Å; N680-H682 PolarHBondContact O-N 3.25Å; N680-H682 WeakPolarHBondContact OD1-CB 3.44Å; N680-H682 PolarHBondContact OD1-N 3.39Å; H682-A685 PolarHBondContact O-N 3.29Å; H682-K686 WeakPolarHBondContact O-CB 3.33Å; H682-K686 PolarHBondContact O-N 3.46Å; H682-F738 AromaticContact CE1-CZ 3.81Å; H682-F738 AromaticContact ND1-CZ 3.97Å; H682-Y751 AromaticContact ND1-CE2 3.54Å; H682-Y751 AromaticContact ND1-CZ 3.45Å; H682-Y751 PolarHBondContact ND1-OH 2.99Å
683	L	92.9	Very high	93.4	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.037	15%	0.149	C	C	.	.	H	α-helix	trans	-67.2	-43.3	176.4	-170.3	59.7	0	0	0	111.3	L498 E633 A636 D637 M678 N680 A685 K686 L687	L498-L683 HydrophobicContact CD2-CD2 4.01Å; E633-L683 HydrophobicContact CB-CD2 4.16Å; E633-L683 HydrophobicContact CG-CD2 4.36Å; A636-L683 HydrophobicContact CB-CD1 4.46Å; A636-L683 HydrophobicContact CB-CD2 3.97Å; A636-L683 HydrophobicContact CB-CG 4.48Å; D637-L683 HydrophobicContact CB-CD1 4.12Å; D637-L683 WeakPolarHBondContact OD1-CD1 3.15Å; M678-L683 HydrophobicContact CE-CD2 3.82Å; M678-L683 HydrophobicContact CE-CG 3.99Å; M678-L683 HydrophobicContact CG-CD2 4.15Å; M678-L683 HydrophobicContact CG-CG 4.48Å; M678-L683 HydrophobicContact SD-CB 3.87Å; M678-L683 HydrophobicContact SD-CD2 3.74Å; M678-L683 HydrophobicContact SD-CG 3.57Å; M678-L683 VanDerWaalsContact SD-CG 3.57Å; N680-L683 HydrophobicContact CB-CB 4.1Å; N680-L683 PolarHBondContact OD1-N 2.82Å; L683-A685 VanDerWaalsContact C-N 3.32Å; L683-A685 PolarHBondContact O-N 2.87Å; L683-K686 WeakPolarHBondContact O-CB 3.43Å; L683-K686 PolarHBondContact O-N 3.38Å; L683-L687 PolarHBondContact O-N 3.15Å; L683-L687 VanDerWaalsContact O-N 3.15Å
684	R	94.6	Very high	93.5	Very high	9 Å²	9	30.2 Å²	30.2	3%	0.034	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-40.6	172.9	-71.1	-171.4	-66.1	128.6	-0.1	112.5	M678 N680 P681 L687 V732 D735	M678-R684 HydrophobicContact CB-CG 3.96Å; M678-R684 HydrophobicContact CG-CG 3.73Å; M678-R684 WeakPolarHBondContact O-CD 3.31Å; M678-R684 PolarHBondContact O-NE 3.49Å; M678-R684 HydrophobicContact SD-CB 4.35Å; M678-R684 HydrophobicContact SD-CG 3.48Å; M678-R684 WeakPolarHBondContact SD-CG 3.42Å; N680-R684 PolarHBondContact O-N 3.34Å; P681-R684 PolarHBondContact O-N 2.7Å; R684-L687 WeakPolarHBondContact O-CB 3.38Å; R684-L687 PolarHBondContact O-N 3Å; R684-V732 HydrophobicContact CB-CG2 4.23Å; R684-D735 IonicContact CZ-OD2 2.68Å; R684-D735 IonicContact NH1-OD2 2.79Å; R684-D735 PolarHBondContact NH1-OD2 2.88Å
685	A	92.1	Very high	93.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-39.8	176.3	0	0	0	0	0	112.3	P681 H682 L683 L687 A688 I736 Y751	P681-A685 VanDerWaalsContact O-CB 3.3Å; P681-A685 WeakPolarHBondContact O-CB 3.4Å; P681-A685 PolarHBondContact O-N 3.11Å; H682-A685 PolarHBondContact O-N 3.29Å; L683-A685 VanDerWaalsContact C-N 3.32Å; L683-A685 PolarHBondContact O-N 2.87Å; A685-L687 PolarHBondContact O-N 2.85Å; A685-A688 VanDerWaalsContact O-CB 3.29Å; A685-A688 WeakPolarHBondContact O-CB 3.47Å; A685-A688 PolarHBondContact O-N 3.29Å; A685-I736 HydrophobicContact CB-CG2 3.99Å; A685-Y751 HydrophobicContact CB-CD1 3.37Å; A685-Y751 HydrophobicContact CB-CD2 4.19Å; A685-Y751 HydrophobicContact CB-CE1 3.9Å; A685-Y751 HydrophobicContact CB-CG 3.55Å
686	K	93.7	Very high	93	Very high	30 Å²	30	27.4 Å²	27.4	13%	0.13	13%	0.132	C	C	.	.	H	α-helix	trans	-58.8	-33.9	173.4	-176.8	174.3	175.1	172.7	0	111.9	D637 D641 I644 H682 L683 A688 E689 V690	D637-K686 WeakPolarHBondContact OD1-CD 3.3Å; D637-K686 WeakPolarHBondContact OD1-CE 3.26Å; D637-K686 IonicContact OD1-NZ 3.54Å; D637-K686 PolarHBondContact OD1-NZ 3.44Å; D637-K686 IonicContact OD2-NZ 3.74Å; D641-K686 WeakPolarHBondContact OD1-CE 3.32Å; D641-K686 IonicContact OD1-NZ 3.15Å; D641-K686 PolarHBondContact OD1-NZ 3.49Å; D641-K686 IonicContact OD2-NZ 3.78Å; D641-K686 PolarHBondContact OD2-NZ 3Å; I644-K686 HydrophobicContact CD1-CG 4.31Å; H682-K686 WeakPolarHBondContact O-CB 3.33Å; H682-K686 PolarHBondContact O-N 3.46Å; L683-K686 WeakPolarHBondContact O-CB 3.43Å; L683-K686 PolarHBondContact O-N 3.38Å; K686-A688 PolarHBondContact O-N 3.38Å; K686-E689 WeakPolarHBondContact O-CA 3.3Å; K686-E689 WeakPolarHBondContact O-CB 3.49Å; K686-E689 PolarHBondContact O-N 3.21Å; K686-V690 WeakPolarHBondContact O-CG2 3.44Å; K686-V690 PolarHBondContact O-N 3.26Å
687	L	96.8	Very high	92.2	Very high	1 Å²	1	24 Å²	24	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-61.5	-23.8	174	-60.4	-174.3	0	0	0	113.6	F667 F671 T672 M678 L683 R684 A685 V690 L691	F667-L687 HydrophobicContact CD1-CD2 4.48Å; F667-L687 HydrophobicContact CE1-CD1 4.2Å; F667-L687 HydrophobicContact CE1-CD2 3.54Å; F667-L687 HydrophobicContact CZ-CD1 4.39Å; F667-L687 HydrophobicContact CZ-CD2 4.12Å; F671-L687 HydrophobicContact CB-CD1 3.73Å; T672-L687 VanDerWaalsContact OG1-CB 3.24Å; T672-L687 WeakPolarHBondContact OG1-CB 3.45Å; M678-L687 HydrophobicContact CE-CD1 4.18Å; M678-L687 HydrophobicContact SD-CD1 4.26Å; L683-L687 PolarHBondContact O-N 3.15Å; L683-L687 VanDerWaalsContact O-N 3.15Å; R684-L687 WeakPolarHBondContact O-CB 3.38Å; R684-L687 PolarHBondContact O-N 3Å; A685-L687 PolarHBondContact O-N 2.85Å; L687-V690 HydrophobicContact CD2-CG2 4.4Å; L687-V690 PolarHBondContact O-N 3.43Å; L687-L691 WeakPolarHBondContact O-CB 3.44Å; L687-L691 PolarHBondContact O-N 3.37Å
688	A	95.1	Very high	90.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-71.9	-36	170.5	0	0	0	0	0	111.9	A685 K686 V690 L691 E692 L729 P754 M755 I758	A685-A688 VanDerWaalsContact O-CB 3.29Å; A685-A688 WeakPolarHBondContact O-CB 3.47Å; A685-A688 PolarHBondContact O-N 3.29Å; K686-A688 PolarHBondContact O-N 3.38Å; A688-V690 VanDerWaalsContact C-N 3.34Å; A688-L691 PolarHBondContact O-N 3.11Å; A688-E692 PolarHBondContact O-N 3.17Å; A688-L729 HydrophobicContact CB-CD1 4.44Å; A688-P754 HydrophobicContact CB-CG 4.48Å; A688-M755 HydrophobicContact CB-CE 3.66Å; A688-M755 HydrophobicContact CB-CG 3.86Å; A688-I758 VanDerWaalsContact O-CD1 3.26Å; A688-I758 WeakPolarHBondContact O-CD1 3.41Å
689	E	94.6	Very high	88.3	Confident	66 Å²	66	36.7 Å²	36.7	31%	0.308	18%	0.183	S	C	.	.	H	α-helix	trans	-65.5	-39	169.8	-171	179.2	175.9	0	0	111.1	I644 R648 K686 L691 E692 A693 P754	I644-E689 HydrophobicContact CD1-CB 4.14Å; I644-E689 HydrophobicContact CD1-CG 3.79Å; I644-E689 HydrophobicContact CG1-CG 4.14Å; R648-E689 IonicContact NH2-OE1 2.71Å; R648-E689 PolarHBondContact NH2-OE1 3.44Å; K686-E689 WeakPolarHBondContact O-CA 3.3Å; K686-E689 WeakPolarHBondContact O-CB 3.49Å; K686-E689 PolarHBondContact O-N 3.21Å; E689-L691 VanDerWaalsContact C-N 3.35Å; E689-L691 PolarHBondContact O-N 2.82Å; E689-E692 PolarHBondContact O-N 3.41Å; E689-A693 WeakPolarHBondContact O-CB 3.42Å; E689-A693 PolarHBondContact O-N 2.86Å; E689-P754 HydrophobicContact CB-CB 4.39Å; E689-P754 HydrophobicContact CB-CG 4.23Å
690	V	96.3	Very high	86.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-44.4	173.8	-179.8	0	0	0	0	111	L643 I644 I668 K686 L687 A688 E692 A693 V694	L643-V690 HydrophobicContact CB-CG1 4.02Å; L643-V690 HydrophobicContact CD1-CG1 3.48Å; L643-V690 VanDerWaalsContact CD1-CG1 3.48Å; L643-V690 HydrophobicContact CG-CG1 4.41Å; I644-V690 HydrophobicContact CD1-CG2 4.04Å; I644-V690 HydrophobicContact CG1-CG2 4.23Å; I668-V690 HydrophobicContact CD1-CG1 4.07Å; K686-V690 WeakPolarHBondContact O-CG2 3.44Å; K686-V690 PolarHBondContact O-N 3.26Å; L687-V690 HydrophobicContact CD2-CG2 4.4Å; L687-V690 PolarHBondContact O-N 3.43Å; A688-V690 VanDerWaalsContact C-N 3.34Å; V690-E692 VanDerWaalsContact C-N 3.3Å; V690-E692 PolarHBondContact O-N 2.89Å; V690-A693 WeakPolarHBondContact O-CB 3.45Å; V690-A693 PolarHBondContact O-N 3.14Å; V690-A693 VanDerWaalsContact O-N 3.16Å; V690-V694 WeakPolarHBondContact O-CG2 3.3Å; V690-V694 PolarHBondContact O-N 3.12Å
691	L	96.5	Very high	84	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-61.4	-39.7	176.6	-177.1	57.9	0	0	0	111.7	L665 I668 L687 A688 E689 A693 V694 M695 F716 L725 I758 M762	L665-L691 HydrophobicContact CD2-CD1 3.88Å; I668-L691 HydrophobicContact CD1-CB 4.17Å; I668-L691 HydrophobicContact CD1-CD1 4.21Å; I668-L691 HydrophobicContact CG2-CB 4.21Å; I668-L691 HydrophobicContact CG2-CD1 4.44Å; I668-L691 HydrophobicContact CG2-CD2 4.26Å; L687-L691 WeakPolarHBondContact O-CB 3.44Å; L687-L691 PolarHBondContact O-N 3.37Å; A688-L691 PolarHBondContact O-N 3.11Å; E689-L691 VanDerWaalsContact C-N 3.35Å; E689-L691 PolarHBondContact O-N 2.82Å; L691-A693 VanDerWaalsContact C-N 3.34Å; L691-V694 PolarHBondContact O-N 2.76Å; L691-M695 WeakPolarHBondContact O-CB 3.35Å; L691-M695 PolarHBondContact O-N 3.29Å; L691-F716 HydrophobicContact CD1-CE1 3.92Å; L691-F716 HydrophobicContact CD1-CZ 3.98Å; L691-L725 HydrophobicContact CD1-CD2 4.23Å; L691-L725 HydrophobicContact CD2-CD1 4Å; L691-L725 HydrophobicContact CD2-CG 4.44Å; L691-I758 HydrophobicContact CB-CD1 3.89Å; L691-I758 HydrophobicContact CD2-CD1 3.96Å; L691-I758 HydrophobicContact CD2-CG2 3.84Å; L691-I758 HydrophobicContact CG-CD1 3.85Å; L691-I758 HydrophobicContact CG-CG1 4.31Å; L691-I758 HydrophobicContact CG-CG2 4.23Å; L691-M762 HydrophobicContact CD2-CE 4.17Å
692	E	94.6	Very high	81.8	Confident	51 Å²	51	44 Å²	44	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-36.9	174.5	-168	-83.6	163.2	0	0	111.6	A688 E689 V690 M695 H697 P754 P757 I758	A688-E692 PolarHBondContact O-N 3.17Å; E689-E692 PolarHBondContact O-N 3.41Å; V690-E692 VanDerWaalsContact C-N 3.3Å; V690-E692 PolarHBondContact O-N 2.89Å; E692-M695 HydrophobicContact CG-SD 4.43Å; E692-M695 WeakPolarHBondContact O-CG 3.3Å; E692-H697 PolarHBondContact O-CE1 3.42Å; E692-H697 PolarHBondContact O-NE2 3.05Å; E692-H697 IonicContact OE1-CE1 3.32Å; E692-H697 PolarHBondContact OE1-CE1 2.62Å; E692-H697 VanDerWaalsContact OE1-CE1 3.24Å; E692-H697 IonicContact OE1-ND1 2.77Å; E692-P754 HydrophobicContact CB-CB 3.79Å; E692-P754 HydrophobicContact CG-CB 4.12Å; E692-P757 HydrophobicContact CG-CB 4.49Å; E692-I758 HydrophobicContact CB-CD1 3.96Å; E692-I758 HydrophobicContact CB-CG1 4.09Å
693	A	92.3	Very high	79.7	Confident	2 Å²	2	45.7 Å²	45.7	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-34.9	178.2	0	0	0	0	0	113	I644 R647 E689 V690 L691	I644-A693 HydrophobicContact CG1-CB 4.26Å; R647-A693 HydrophobicContact CB-CB 3.8Å; R647-A693 WeakPolarHBondContact CD-O 3.27Å; R647-A693 HydrophobicContact CG-CB 4.08Å; E689-A693 WeakPolarHBondContact O-CB 3.42Å; E689-A693 PolarHBondContact O-N 2.86Å; V690-A693 WeakPolarHBondContact O-CB 3.45Å; V690-A693 PolarHBondContact O-N 3.14Å; V690-A693 VanDerWaalsContact O-N 3.16Å; L691-A693 VanDerWaalsContact C-N 3.34Å
694	V	92.1	Very high	77.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-94.6	-11.9	-178.1	-55.3	0	0	0	0	114	L643 L661 L665 I668 V690 L691 R712 F716	L643-V694 HydrophobicContact CB-CG1 4.26Å; L643-V694 HydrophobicContact CD1-CG1 4.23Å; L643-V694 HydrophobicContact CD2-CG1 4.28Å; L661-V694 HydrophobicContact CD1-CB 3.68Å; L661-V694 HydrophobicContact CD1-CG1 4.33Å; L661-V694 HydrophobicContact CD1-CG2 3.82Å; L665-V694 HydrophobicContact CD2-CG2 4.48Å; I668-V694 HydrophobicContact CD1-CG2 4.4Å; V690-V694 WeakPolarHBondContact O-CG2 3.3Å; V690-V694 PolarHBondContact O-N 3.12Å; L691-V694 PolarHBondContact O-N 2.76Å; V694-R712 WeakPolarHBondContact O-CD 3.32Å; V694-F716 HydrophobicContact CG2-CZ 4.2Å; V694-F716 WeakPolarHBondContact O-CE2 3.33Å
695	M	89.8	Confident	75.3	Confident	7 Å²	7	58.7 Å²	58.7	3%	0.034	32%	0.321	C	S	.	.	S	Bend	trans	-69.9	154.2	176.7	65.2	172.3	-87.4	0	0	112.5	L691 E692 H697 F716 I758 Y761	L691-M695 WeakPolarHBondContact O-CB 3.35Å; L691-M695 PolarHBondContact O-N 3.29Å; E692-M695 HydrophobicContact CG-SD 4.43Å; E692-M695 WeakPolarHBondContact O-CG 3.3Å; M695-H697 PolarHBondContact O-CD2 3.37Å; M695-H697 PolarHBondContact O-N 2.92Å; M695-F716 VanDerWaalsContact CA-CZ 3.48Å; M695-F716 HydrophobicContact CB-CE1 4.02Å; M695-F716 HydrophobicContact CB-CE2 4.39Å; M695-F716 HydrophobicContact CB-CZ 3.77Å; M695-I758 HydrophobicContact SD-CB 4.25Å; M695-I758 HydrophobicContact SD-CG1 3.62Å; M695-Y761 HydrophobicContact CE-CD2 4.2Å; M695-Y761 HydrophobicContact CE-CG 3.9Å
696	P	84.7	Confident	73.3	Confident	15 Å²	15	62.6 Å²	62.6	10%	0.097	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-69	125	173.1	-11.9	27.2	0	0	0	110.3	R712 K713 F716 Y761	P696-R712 HydrophobicContact CG-CB 4.06Å; P696-K713 HydrophobicContact CB-CB 4.18Å; P696-K713 VanDerWaalsContact CG-CA 3.5Å; P696-K713 HydrophobicContact CG-CB 3.99Å; P696-F716 HydrophobicContact CG-CD2 4.17Å; P696-F716 HydrophobicContact CG-CG 4.43Å; P696-Y761 HydrophobicContact CB-CE2 4.36Å; P696-Y761 HydrophobicContact CG-CE2 4.15Å
697	H	75.2	Confident	71	Confident	44 Å²	44	65.9 Å²	65.9	20%	0.204	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-89.1	125.8	176.6	-59.4	-85.3	0	0	0	111	R647 E692 M695 D699	R647-H697 PolarHBondContact NE-CD2 2.96Å; R647-H697 VanDerWaalsContact NE-CD2 3.33Å; R647-H697 PolarHBondContact NE-NE2 3.26Å; R647-H697 PolarHBondContact NH2-CD2 2.95Å; R647-H697 PolarHBondContact NH2-NE2 3.06Å; E692-H697 PolarHBondContact O-CE1 3.42Å; E692-H697 PolarHBondContact O-NE2 3.05Å; E692-H697 IonicContact OE1-CE1 3.32Å; E692-H697 PolarHBondContact OE1-CE1 2.62Å; E692-H697 VanDerWaalsContact OE1-CE1 3.24Å; E692-H697 IonicContact OE1-ND1 2.77Å; M695-H697 PolarHBondContact O-CD2 3.37Å; M695-H697 PolarHBondContact O-N 2.92Å; H697-D699 VanDerWaalsContact C-N 3.34Å; H697-D699 PolarHBondContact O-N 3.39Å
698	L	56.1	Low	68.8	Low	117 Å²	117	68.8 Å²	68.8	61%	0.613	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-19.5	-172.8	-66.2	164.8	0	0	0	114	Y761	L698-Y761 HydrophobicContact CD1-CD2 4.39Å; L698-Y761 HydrophobicContact CG-CD2 4.5Å
699	D	52.3	Low	66.9	Low	155 Å²	155	71.8 Å²	71.8	83%	0.829	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	5.3	-164.6	-66.6	-35.2	0	0	0	115.5	H697 T701	H697-D699 VanDerWaalsContact C-N 3.34Å; H697-D699 PolarHBondContact O-N 3.39Å; D699-T701 PolarHBondContact O-N 2.74Å
700	Q	51.9	Low	65.9	Low	108 Å²	108	74.9 Å²	74.9	51%	0.505	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-76	116.8	176.8	-72.5	-174	-12.8	0	0	110.3	R647 P702	R647-Q700 VanDerWaalsContact NH1-NE2 3.17Å; R647-Q700 VanDerWaalsContact NH2-NE2 3.16Å; Q700-P702 WeakPolarHBondContact O-CD 3.43Å; Q700-P702 VanDerWaalsContact O-N 3.15Å
701	T	42.1	Very low	65.2	Low	134 Å²	134	77.6 Å²	77.6	82%	0.822	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-52.3	119.8	169.7	-10.1	0	0	0	0	107.9	D699 N703	D699-T701 PolarHBondContact O-N 2.74Å; T701-N703 PolarHBondContact O-N 2.76Å
702	P	44.5	Very low	64.7	Low	106 Å²	106	78 Å²	78	69%	0.688	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-59.2	116.2	-175.7	19.9	-29.6	0	0	0	109	Q700 P704	Q700-P702 WeakPolarHBondContact O-CD 3.43Å; Q700-P702 VanDerWaalsContact O-N 3.15Å; P702-P704 WeakPolarHBondContact O-CD 3.4Å
703	N	45.6	Very low	64.4	Low	103 Å²	103	80.1 Å²	80.1	55%	0.551	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-68.1	117	170.9	-161.5	0.4	0	0	0	106.8	T701 L705 V706	T701-N703 PolarHBondContact O-N 2.76Å; N703-L705 PolarHBondContact O-N 2.95Å; N703-V706 PolarHBondContact O-N 3.13Å; N703-V706 VanDerWaalsContact O-N 3.09Å
704	P	46.1	Very low	64.2	Low	126 Å²	126	86 Å²	86	82%	0.818	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.4	-168.4	-21.2	31.5	0	0	0	114.4	P702	P702-P704 WeakPolarHBondContact O-CD 3.4Å
705	L	49	Very low	64.1	Low	164 Å²	164	86.9 Å²	86.9	86%	0.859	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-17.4	-177.5	-70.7	162.8	0	0	0	113.6	N703	N703-L705 PolarHBondContact O-N 2.95Å
706	V	50.5	Low	64.2	Low	83 Å²	83	86.7 Å²	86.7	50%	0.503	47%	0.471	S	S	.	.	S	Bend	trans	-105.7	101.9	174.1	-173.1	0	0	0	0	105.5	N703 S708	N703-V706 PolarHBondContact O-N 3.13Å; N703-V706 VanDerWaalsContact O-N 3.09Å; V706-S708 PolarHBondContact O-N 2.98Å
707	S	45.8	Very low	64.5	Low	99 Å²	99	88.4 Å²	88.4	69%	0.692	48%	0.483	S	S	*	.			trans	-46.4	117.5	162.2	-178	0	0	0	0	106.1	V709	S707-V709 WeakPolarHBondContact O-CG2 3.49Å; S707-V709 PolarHBondContact O-N 3.18Å
708	S	50.1	Low	65.2	Low	61 Å²	61	92.4 Å²	92.4	43%	0.427	51%	0.505	S	S	.	.			trans	-64.1	84.4	-177.6	54.9	0	0	0	0	108.3	V706 F710	V706-S708 PolarHBondContact O-N 2.98Å; S708-F710 VanDerWaalsContact C-N 3.32Å; S708-F710 WeakPolarHBondContact O-CD2 3.41Å; S708-F710 WeakPolarHBondContact O-CE2 3.46Å; S708-F710 PolarHBondContact O-N 3.33Å; S708-F710 WeakPolarHBondContact OG-CE2 3.42Å; S708-F710 WeakPolarHBondContact OG-CZ 3.44Å
709	V	54.5	Low	67	Low	63 Å²	63	87.4 Å²	87.4	38%	0.382	48%	0.479	S	S	.	.			trans	-71.2	96.3	173.2	177.3	0	0	0	0	104.8	S707 H711	S707-V709 WeakPolarHBondContact O-CG2 3.49Å; S707-V709 PolarHBondContact O-N 3.18Å; V709-H711 HydrophobicContact CG1-CB 4.09Å; V709-H711 WeakPolarHBondContact CG1-CD2 3.47Å; V709-H711 WeakPolarHBondContact CG1-CE1 3.36Å; V709-H711 WeakPolarHBondContact CG1-ND1 3.45Å; V709-H711 WeakPolarHBondContact CG1-NE2 3.47Å; V709-H711 PolarHBondContact O-N 2.88Å
710	F	73.8	Confident	69	Low	131 Å²	131	86.6 Å²	86.6	58%	0.575	47%	0.47	S	S	*	.			trans	-74.9	47.2	-177.5	-68.6	-73	0	0	0	112	S708 K713 R714	S708-F710 VanDerWaalsContact C-N 3.32Å; S708-F710 WeakPolarHBondContact O-CD2 3.41Å; S708-F710 WeakPolarHBondContact O-CE2 3.46Å; S708-F710 PolarHBondContact O-N 3.33Å; S708-F710 WeakPolarHBondContact OG-CE2 3.42Å; S708-F710 WeakPolarHBondContact OG-CZ 3.44Å; F710-K713 HydrophobicContact CB-CB 4.14Å; F710-K713 HydrophobicContact CD1-CD 4.2Å; F710-K713 PolarHBondContact O-N 2.91Å; F710-R714 WeakPolarHBondContact O-CB 3.33Å; F710-R714 PolarHBondContact O-N 3.18Å
711	H	81.4	Confident	71.1	Confident	58 Å²	58	82.5 Å²	82.5	27%	0.269	45%	0.45	S	S	.	.	H	α-helix	trans	-66.1	-48.7	-175.1	-87.7	174.1	0	0	0	111.3	E655 A658 V709 K713 R714 V715	E655-H711 WeakPolarHBondContact O-CB 3.29Å; E655-H711 PolarHBondContact O-ND1 2.61Å; E655-H711 PolarHBondContact OE1-N 2.97Å; A658-H711 HydrophobicContact CB-CB 3.61Å; V709-H711 HydrophobicContact CG1-CB 4.09Å; V709-H711 WeakPolarHBondContact CG1-CD2 3.47Å; V709-H711 WeakPolarHBondContact CG1-CE1 3.36Å; V709-H711 WeakPolarHBondContact CG1-ND1 3.45Å; V709-H711 WeakPolarHBondContact CG1-NE2 3.47Å; V709-H711 PolarHBondContact O-N 2.88Å; H711-K713 VanDerWaalsContact C-N 3.33Å; H711-K713 PolarHBondContact O-N 3.18Å; H711-R714 WeakPolarHBondContact O-CB 3.46Å; H711-R714 PolarHBondContact O-N 3.39Å; H711-V715 WeakPolarHBondContact O-CG2 3.36Å; H711-V715 PolarHBondContact O-N 3.08Å; H711-V715 VanDerWaalsContact O-N 3.15Å
712	R	86.9	Confident	73.6	Confident	9 Å²	9	76.1 Å²	76.1	3%	0.034	41%	0.411	C	S	.	.	H	α-helix	trans	-59.2	-46.4	175.7	-67.2	-169.9	-75	-169.4	-18.8	111.4	D651 E655 L661 V694 P696 R714 V715 F716	D651-R712 IonicContact OD1-CZ 2.79Å; D651-R712 IonicContact OD1-NH1 3.99Å; D651-R712 PolarHBondContact OD1-NH1 2.95Å; D651-R712 IonicContact OD1-NH2 3.62Å; D651-R712 IonicContact OD2-NH2 3.01Å; D651-R712 PolarHBondContact OD2-NH2 3.09Å; E655-R712 PolarHBondContact OE1-N 2.9Å; E655-R712 VanDerWaalsContact OE1-N 3.09Å; E655-R712 IonicContact OE1-NE 3.14Å; E655-R712 IonicContact OE2-CZ 3.63Å; E655-R712 IonicContact OE2-NE 3.45Å; E655-R712 PolarHBondContact OE2-NE 3.19Å; E655-R712 IonicContact OE2-NH2 3.89Å; E655-R712 PolarHBondContact OE2-NH2 3.34Å; L661-R712 HydrophobicContact CD2-CB 4.12Å; L661-R712 HydrophobicContact CD2-CG 3.96Å; V694-R712 WeakPolarHBondContact O-CD 3.32Å; P696-R712 HydrophobicContact CG-CB 4.06Å; R712-R714 VanDerWaalsContact C-N 3.31Å; R712-R714 PolarHBondContact O-N 3.09Å; R712-V715 PolarHBondContact O-N 3.46Å; R712-V715 VanDerWaalsContact O-N 3.14Å; R712-F716 WeakPolarHBondContact O-CD2 3.41Å; R712-F716 PolarHBondContact O-N 3.38Å
713	K	87.2	Confident	76.1	Confident	96 Å²	96	73.3 Å²	73.3	42%	0.417	39%	0.393	S	S	.	.	H	α-helix	trans	-59.5	-41.9	179.5	-173	178	-179.1	177.2	0	111.9	P696 F710 H711 V715 F716 C717	P696-K713 HydrophobicContact CB-CB 4.18Å; P696-K713 VanDerWaalsContact CG-CA 3.5Å; P696-K713 HydrophobicContact CG-CB 3.99Å; F710-K713 HydrophobicContact CB-CB 4.14Å; F710-K713 HydrophobicContact CD1-CD 4.2Å; F710-K713 PolarHBondContact O-N 2.91Å; H711-K713 VanDerWaalsContact C-N 3.33Å; H711-K713 PolarHBondContact O-N 3.18Å; K713-V715 PolarHBondContact O-N 3.44Å; K713-F716 PolarHBondContact O-N 2.67Å; K713-C717 WeakPolarHBondContact O-CB 3.35Å; K713-C717 PolarHBondContact O-N 2.97Å; K713-C717 PolarHBondContact O-SG 3.45Å
714	R	88.1	Confident	78.5	Confident	127 Å²	127	71.2 Å²	71.2	48%	0.479	38%	0.38	S	S	.	.	H	α-helix	trans	-59.8	-44.2	176	-175.8	-176	69.3	-173.7	1.5	112	F710 H711 R712 N718	F710-R714 WeakPolarHBondContact O-CB 3.33Å; F710-R714 PolarHBondContact O-N 3.18Å; H711-R714 WeakPolarHBondContact O-CB 3.46Å; H711-R714 PolarHBondContact O-N 3.39Å; R712-R714 VanDerWaalsContact C-N 3.31Å; R712-R714 PolarHBondContact O-N 3.09Å; R714-N718 WeakPolarHBondContact O-CB 3.37Å; R714-N718 PolarHBondContact O-N 2.95Å; R714-N718 PolarHBondContact O-ND2 3.41Å
715	V	90.9	Very high	81	Confident	19 Å²	19	65.2 Å²	65.2	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-64	-47.6	179.8	176	0	0	0	0	110.8	A658 L661 E662 L665 H711 R712 K713 N718 F719	A658-V715 HydrophobicContact CB-CG2 4.14Å; A658-V715 WeakPolarHBondContact O-CG2 3.36Å; L661-V715 HydrophobicContact CB-CG1 4.24Å; L661-V715 HydrophobicContact CD2-CB 4.02Å; L661-V715 HydrophobicContact CD2-CG1 4.04Å; L661-V715 HydrophobicContact CD2-CG2 4.4Å; L661-V715 HydrophobicContact CG-CG1 4Å; E662-V715 HydrophobicContact CB-CG1 4.42Å; L665-V715 HydrophobicContact CD1-CG1 3.95Å; H711-V715 WeakPolarHBondContact O-CG2 3.36Å; H711-V715 PolarHBondContact O-N 3.08Å; H711-V715 VanDerWaalsContact O-N 3.15Å; R712-V715 PolarHBondContact O-N 3.46Å; R712-V715 VanDerWaalsContact O-N 3.14Å; K713-V715 PolarHBondContact O-N 3.44Å; V715-N718 CarbonylContact O-C 3.55Å; V715-N718 PolarHBondContact O-N 3.44Å; V715-F719 WeakPolarHBondContact O-CB 3.4Å; V715-F719 PolarHBondContact O-N 2.95Å
716	F	92.3	Very high	83.3	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.013	30%	0.3	C	S	.	.	H	α-helix	trans	-63.4	-43.6	178.8	-87.5	-100.4	0	0	0	112.9	L661 L665 L691 V694 M695 P696 R712 K713 N718 F719 Y761 Y768	L661-F716 HydrophobicContact CD1-CE2 4.46Å; L661-F716 HydrophobicContact CD2-CD2 4.17Å; L661-F716 HydrophobicContact CD2-CE2 3.94Å; L661-F716 HydrophobicContact CG-CE2 4.48Å; L665-F716 HydrophobicContact CD1-CD2 4.33Å; L665-F716 HydrophobicContact CD1-CE2 4.29Å; L665-F716 HydrophobicContact CD1-CZ 4.44Å; L665-F716 HydrophobicContact CD2-CE1 4.01Å; L665-F716 HydrophobicContact CD2-CE2 4.12Å; L665-F716 HydrophobicContact CD2-CZ 3.64Å; L691-F716 HydrophobicContact CD1-CE1 3.92Å; L691-F716 HydrophobicContact CD1-CZ 3.98Å; V694-F716 HydrophobicContact CG2-CZ 4.2Å; V694-F716 WeakPolarHBondContact O-CE2 3.33Å; M695-F716 VanDerWaalsContact CA-CZ 3.48Å; M695-F716 HydrophobicContact CB-CE1 4.02Å; M695-F716 HydrophobicContact CB-CE2 4.39Å; M695-F716 HydrophobicContact CB-CZ 3.77Å; P696-F716 HydrophobicContact CG-CD2 4.17Å; P696-F716 HydrophobicContact CG-CG 4.43Å; R712-F716 WeakPolarHBondContact O-CD2 3.41Å; R712-F716 PolarHBondContact O-N 3.38Å; K713-F716 PolarHBondContact O-N 2.67Å; F716-N718 VanDerWaalsContact C-N 3.25Å; F716-N718 PolarHBondContact O-N 2.98Å; F716-F719 PolarHBondContact O-N 3.3Å; F716-Y761 HydrophobicContact CB-CE1 4.15Å; F716-Y761 WeakPolarHBondContact CB-OH 3.31Å; F716-Y761 AromaticContact CD1-CE1 3.87Å; F716-Y761 HydrophobicContact CD1-CE1 3.87Å; F716-Y761 HydrophobicContact CG-CE1 4.28Å; F716-Y768 PolarHBondContact O-OH 2.99Å
717	C	90.1	Very high	85.5	Confident	51 Å²	51	57.5 Å²	57.5	35%	0.345	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-29.1	178.6	-68.5	0	0	0	0	113.1	K713	K713-C717 WeakPolarHBondContact O-CB 3.35Å; K713-C717 PolarHBondContact O-N 2.97Å; K713-C717 PolarHBondContact O-SG 3.45Å
718	N	90.4	Very high	87.9	Confident	127 Å²	127	53.1 Å²	53.1	68%	0.679	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	9.4	-177.3	-63.9	-23.5	0	0	0	113.2	R714 V715 F716 Q720	R714-N718 WeakPolarHBondContact O-CB 3.37Å; R714-N718 PolarHBondContact O-N 2.95Å; R714-N718 PolarHBondContact O-ND2 3.41Å; V715-N718 CarbonylContact O-C 3.55Å; V715-N718 PolarHBondContact O-N 3.44Å; F716-N718 VanDerWaalsContact C-N 3.25Å; F716-N718 PolarHBondContact O-N 2.98Å; N718-Q720 PolarHBondContact O-N 3.22Å
719	F	94.2	Very high	90.2	Very high	12 Å²	12	50.4 Å²	50.4	5%	0.053	25%	0.245	C	C	.	.			trans	-69.6	117.4	-175.7	-175.1	-120.9	0	0	0	110.7	E662 L665 H666 V715 F716 Y721 A722 L725	E662-F719 HydrophobicContact CG-CD2 4.38Å; E662-F719 HydrophobicContact CG-CE2 4.37Å; L665-F719 HydrophobicContact CB-CD2 4.06Å; L665-F719 HydrophobicContact CB-CE1 4.14Å; L665-F719 HydrophobicContact CB-CE2 3.55Å; L665-F719 HydrophobicContact CB-CZ 3.59Å; L665-F719 HydrophobicContact CD1-CB 4.36Å; L665-F719 HydrophobicContact CD1-CD1 4.41Å; L665-F719 HydrophobicContact CD1-CD2 3.85Å; L665-F719 HydrophobicContact CD1-CE2 4.24Å; L665-F719 HydrophobicContact CD1-CG 3.96Å; H666-F719 AromaticContact CD2-CE2 3.61Å; H666-F719 AromaticContact CD2-CZ 3.74Å; H666-F719 AromaticContact NE2-CE2 3.66Å; V715-F719 WeakPolarHBondContact O-CB 3.4Å; V715-F719 PolarHBondContact O-N 2.95Å; F716-F719 PolarHBondContact O-N 3.3Å; F719-Y721 VanDerWaalsContact CE1-C 3.47Å; F719-Y721 HydrophobicContact CZ-CD2 4.29Å; F719-Y721 PolarHBondContact O-N 3.5Å; F719-A722 HydrophobicContact CD1-CB 4.45Å; F719-A722 WeakPolarHBondContact O-CB 3.39Å; F719-A722 PolarHBondContact O-N 3.47Å; F719-L725 HydrophobicContact CD1-CD2 4.18Å; F719-L725 HydrophobicContact CE1-CB 4.14Å; F719-L725 HydrophobicContact CE1-CD2 4.05Å
720	Q	93.6	Very high	92.2	Very high	138 Å²	138	47.5 Å²	47.5	65%	0.645	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-35	-174.3	-178.4	179.1	-9.6	0	0	113.1	N718	N718-Q720 PolarHBondContact O-N 3.22Å
721	Y	96.1	Very high	93.2	Very high	22 Å²	22	45 Å²	45	9%	0.086	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	28.1	-176.9	-54.1	-64.5	0	0	0	113	L617 F619 H666 F719 P723 Q724 L725	L617-Y721 HydrophobicContact CB-CE2 4.4Å; L617-Y721 HydrophobicContact CD2-CD2 4.01Å; L617-Y721 HydrophobicContact CD2-CE2 3.79Å; L617-Y721 HydrophobicContact CG-CE2 4.08Å; L617-Y721 PolarHBondContact O-OH 2.85Å; F619-Y721 AromaticContact CD2-CD1 3.42Å; F619-Y721 HydrophobicContact CD2-CD1 3.42Å; F619-Y721 VanDerWaalsContact CD2-CD1 3.42Å; F619-Y721 AromaticContact CD2-CE1 3.57Å; F619-Y721 HydrophobicContact CD2-CE1 3.57Å; F619-Y721 HydrophobicContact CD2-CG 4.09Å; F619-Y721 AromaticContact CE2-CD1 3.49Å; F619-Y721 HydrophobicContact CE2-CD1 3.49Å; F619-Y721 VanDerWaalsContact CE2-CD1 3.49Å; F619-Y721 HydrophobicContact CE2-CD2 4.21Å; F619-Y721 AromaticContact CE2-CE1 3.92Å; F619-Y721 HydrophobicContact CE2-CE1 3.92Å; F619-Y721 AromaticContact CE2-CG 3.65Å; F619-Y721 HydrophobicContact CE2-CG 3.65Å; H666-Y721 AromaticContact CD2-CD2 3.59Å; H666-Y721 AromaticContact CD2-CE2 3.96Å; H666-Y721 AromaticContact NE2-CD2 3.47Å; H666-Y721 WeakPolarHBondContact NE2-CD2 3.48Å; H666-Y721 AromaticContact NE2-CE2 3.56Å; F719-Y721 VanDerWaalsContact CE1-C 3.47Å; F719-Y721 HydrophobicContact CZ-CD2 4.29Å; F719-Y721 PolarHBondContact O-N 3.5Å; Y721-P723 VanDerWaalsContact C-CD 3.44Å; Y721-P723 VanDerWaalsContact C-N 3.3Å; Y721-Q724 VanDerWaalsContact CA-OE1 3.31Å; Y721-Q724 PolarHBondContact O-N 3.37Å; Y721-Q724 PolarHBondContact O-OE1 2.99Å; Y721-L725 PolarHBondContact O-N 3.31Å
722	A	95.7	Very high	93.8	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-50.2	-42.9	174.8	0	0	0	0	0	113.4	F719 L725 A726 Y768	F719-A722 HydrophobicContact CD1-CB 4.45Å; F719-A722 WeakPolarHBondContact O-CB 3.39Å; F719-A722 PolarHBondContact O-N 3.47Å; A722-L725 PolarHBondContact O-N 2.87Å; A722-A726 PolarHBondContact O-N 3Å; A722-Y768 VanDerWaalsContact CA-CE1 3.45Å; A722-Y768 HydrophobicContact CB-CD1 3.74Å; A722-Y768 HydrophobicContact CB-CD2 4.1Å; A722-Y768 HydrophobicContact CB-CE1 3.41Å; A722-Y768 VanDerWaalsContact CB-CE1 3.41Å; A722-Y768 HydrophobicContact CB-CE2 3.81Å; A722-Y768 HydrophobicContact CB-CG 4.08Å; A722-Y768 VanDerWaalsContact CB-CZ 3.45Å; A722-Y768 WeakPolarHBondContact O-CD1 3.46Å; A722-Y768 WeakPolarHBondContact O-CE1 3.48Å
723	P	95.8	Very high	94.2	Very high	47 Å²	47	41.9 Å²	41.9	31%	0.305	20%	0.202	S	C	.	.	H	α-helix	trans	-59.9	-48	175.7	-26.1	37	0	0	0	113.4	Y721 L725 A726 E727 S771	Y721-P723 VanDerWaalsContact C-CD 3.44Å; Y721-P723 VanDerWaalsContact C-N 3.3Å; P723-L725 VanDerWaalsContact C-N 3.28Å; P723-L725 PolarHBondContact O-N 3.24Å; P723-A726 PolarHBondContact O-N 2.82Å; P723-E727 PolarHBondContact O-N 3Å; P723-S771 WeakPolarHBondContact CA-OG 3.36Å; P723-S771 PolarHBondContact O-OG 3.23Å
724	Q	97.1	Very high	94.4	Very high	58 Å²	58	37.4 Å²	37.4	27%	0.271	18%	0.183	S	C	.	.	H	α-helix	trans	-65.4	-33.7	-179.6	-67.2	75.1	17.7	0	0	111.7	F619 T669 Y721 E727 A728	F619-Q724 HydrophobicContact CD1-CG 3.88Å; F619-Q724 HydrophobicContact CD2-CG 4.11Å; F619-Q724 HydrophobicContact CE1-CB 4.22Å; F619-Q724 HydrophobicContact CE1-CG 3.99Å; F619-Q724 HydrophobicContact CE2-CB 4.46Å; F619-Q724 HydrophobicContact CE2-CG 4.22Å; F619-Q724 HydrophobicContact CG-CG 3.94Å; F619-Q724 HydrophobicContact CZ-CB 4.15Å; F619-Q724 HydrophobicContact CZ-CG 4.16Å; T669-Q724 HydrophobicContact CG2-CB 3.61Å; Y721-Q724 VanDerWaalsContact CA-OE1 3.31Å; Y721-Q724 PolarHBondContact O-N 3.37Å; Y721-Q724 PolarHBondContact O-OE1 2.99Å; Q724-E727 PolarHBondContact O-N 3.41Å; Q724-A728 VanDerWaalsContact O-CB 3.27Å; Q724-A728 WeakPolarHBondContact O-CB 3.1Å; Q724-A728 PolarHBondContact O-N 3.12Å
725	L	97.6	Very high	94.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-68.6	-39.9	176	-178	57.8	0	0	0	111.9	L665 I668 T669 L691 F719 Y721 A722 P723 A728 L729 M762 Y768	L665-L725 HydrophobicContact CD2-CD2 4.19Å; I668-L725 HydrophobicContact CB-CD1 4.48Å; I668-L725 HydrophobicContact CG2-CD1 3.77Å; T669-L725 HydrophobicContact CG2-CB 4.34Å; L691-L725 HydrophobicContact CD1-CD2 4.23Å; L691-L725 HydrophobicContact CD2-CD1 4Å; L691-L725 HydrophobicContact CD2-CG 4.44Å; F719-L725 HydrophobicContact CD1-CD2 4.18Å; F719-L725 HydrophobicContact CE1-CB 4.14Å; F719-L725 HydrophobicContact CE1-CD2 4.05Å; Y721-L725 PolarHBondContact O-N 3.31Å; A722-L725 PolarHBondContact O-N 2.87Å; P723-L725 VanDerWaalsContact C-N 3.28Å; P723-L725 PolarHBondContact O-N 3.24Å; L725-A728 PolarHBondContact O-N 3.05Å; L725-L729 PolarHBondContact O-N 3.27Å; L725-L729 VanDerWaalsContact O-N 3.09Å; L725-M762 HydrophobicContact CD2-CE 4.29Å; L725-M762 HydrophobicContact CG-CE 3.85Å; L725-Y768 HydrophobicContact CB-CE1 4.32Å; L725-Y768 HydrophobicContact CD2-CE1 4.1Å; L725-Y768 HydrophobicContact CG-CE1 4.44Å
726	A	97.1	Very high	94.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-44.9	173.4	0	0	0	0	0	111.6	A722 P723 L729 I730 M762 Y768 I772	A722-A726 PolarHBondContact O-N 3Å; P723-A726 PolarHBondContact O-N 2.82Å; A726-L729 PolarHBondContact O-N 2.87Å; A726-I730 PolarHBondContact O-N 3.33Å; A726-I730 VanDerWaalsContact O-N 3.16Å; A726-M762 HydrophobicContact CB-SD 4.08Å; A726-Y768 HydrophobicContact CB-CD1 4.22Å; A726-I772 HydrophobicContact CB-CG1 4.13Å
727	E	96.8	Very high	93.7	Very high	85 Å²	85	34.6 Å²	34.6	40%	0.397	18%	0.176	S	C	.	.	H	α-helix	trans	-61.2	-44.8	175.5	-173.1	-176.3	163.1	0	0	111.7	P723 Q724 L729 I730 K731 L775 L790	P723-E727 PolarHBondContact O-N 3Å; Q724-E727 PolarHBondContact O-N 3.41Å; E727-L729 VanDerWaalsContact C-N 3.3Å; E727-L729 PolarHBondContact O-N 3.37Å; E727-I730 PolarHBondContact O-N 3.05Å; E727-K731 VanDerWaalsContact O-CB 3.32Å; E727-K731 WeakPolarHBondContact O-CB 3.44Å; E727-K731 PolarHBondContact O-N 3.19Å; E727-L775 HydrophobicContact CB-CD1 4.18Å; E727-L775 HydrophobicContact CG-CD1 4.19Å; E727-L775 HydrophobicContact CG-CD2 4.23Å; E727-L790 HydrophobicContact CG-CD2 4.05Å
728	A	97	Very high	92.8	Very high	7 Å²	7	33.6 Å²	33.6	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-39.2	178.4	0	0	0	0	0	112.4	Q724 L725 K731 V732	Q724-A728 VanDerWaalsContact O-CB 3.27Å; Q724-A728 WeakPolarHBondContact O-CB 3.1Å; Q724-A728 PolarHBondContact O-N 3.12Å; L725-A728 PolarHBondContact O-N 3.05Å; A728-K731 PolarHBondContact O-N 3.34Å; A728-V732 PolarHBondContact O-N 3.48Å
729	L	97.4	Very high	91	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-46.9	175.8	-176	68.5	0	0	0	111.9	A688 L725 A726 E727 K731 V732 F733 M755 I758 L759 M762	A688-L729 HydrophobicContact CB-CD1 4.44Å; L725-L729 PolarHBondContact O-N 3.27Å; L725-L729 VanDerWaalsContact O-N 3.09Å; A726-L729 PolarHBondContact O-N 2.87Å; E727-L729 VanDerWaalsContact C-N 3.3Å; E727-L729 PolarHBondContact O-N 3.37Å; L729-K731 VanDerWaalsContact C-N 3.31Å; L729-K731 PolarHBondContact O-N 2.83Å; L729-V732 WeakPolarHBondContact O-CG1 3.39Å; L729-V732 PolarHBondContact O-N 2.73Å; L729-F733 PolarHBondContact O-N 3.35Å; L729-M755 HydrophobicContact CD1-CB 4.09Å; L729-M755 HydrophobicContact CD1-CG 3.86Å; L729-M755 HydrophobicContact CD1-SD 4.42Å; L729-I758 HydrophobicContact CD1-CD1 4.22Å; L729-I758 HydrophobicContact CD1-CG2 4.49Å; L729-I758 HydrophobicContact CD2-CB 3.99Å; L729-I758 HydrophobicContact CD2-CG2 3.48Å; L729-I758 VanDerWaalsContact CD2-CG2 3.48Å; L729-L759 HydrophobicContact CD2-CD2 3.77Å; L729-L759 HydrophobicContact CD2-CG 3.88Å; L729-M762 HydrophobicContact CD2-CE 4.09Å; L729-M762 HydrophobicContact CD2-SD 3.67Å
730	I	96.9	Very high	88.9	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-65.1	-39	177.7	-67.5	171	0	0	0	110.4	A726 E727 F733 V734 I772 L775 L790 F791 F794	A726-I730 PolarHBondContact O-N 3.33Å; A726-I730 VanDerWaalsContact O-N 3.16Å; E727-I730 PolarHBondContact O-N 3.05Å; I730-F733 WeakPolarHBondContact O-CB 3.39Å; I730-F733 PolarHBondContact O-N 2.93Å; I730-V734 WeakPolarHBondContact O-CG2 3.09Å; I730-V734 PolarHBondContact O-N 3.23Å; I730-I772 HydrophobicContact CD1-CG1 4.07Å; I730-I772 HydrophobicContact CD1-CG2 4.24Å; I730-L775 HydrophobicContact CD1-CD1 3.8Å; I730-L790 HydrophobicContact CG2-CD1 4.3Å; I730-L790 HydrophobicContact CG2-CD2 4.1Å; I730-L790 HydrophobicContact CG2-CG 3.89Å; I730-F791 HydrophobicContact CD1-CD2 4.09Å; I730-F791 HydrophobicContact CD1-CE2 4.18Å; I730-F794 HydrophobicContact CG2-CB 3.71Å; I730-F794 HydrophobicContact CG2-CD1 4.43Å; I730-F794 HydrophobicContact CG2-CD2 4.11Å; I730-F794 HydrophobicContact CG2-CG 3.82Å
731	K	95.3	Very high	87	Confident	79 Å²	79	33.7 Å²	33.7	34%	0.343	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-48	177.5	-170.5	165.8	176.4	-166	0	112.3	G673 E727 A728 L729 F733 V734 D735 L790	G673-K731 WeakPolarHBondContact O-CD 3.15Å; G673-K731 WeakPolarHBondContact O-CE 3.42Å; G673-K731 PolarHBondContact O-NZ 3.3Å; E727-K731 VanDerWaalsContact O-CB 3.32Å; E727-K731 WeakPolarHBondContact O-CB 3.44Å; E727-K731 PolarHBondContact O-N 3.19Å; A728-K731 PolarHBondContact O-N 3.34Å; L729-K731 VanDerWaalsContact C-N 3.31Å; L729-K731 PolarHBondContact O-N 2.83Å; K731-F733 VanDerWaalsContact C-N 3.31Å; K731-F733 PolarHBondContact O-N 3.35Å; K731-V734 PolarHBondContact O-N 3.38Å; K731-D735 PolarHBondContact O-N 3.31Å; K731-L790 HydrophobicContact CB-CD1 4.34Å; K731-L790 HydrophobicContact CB-CD2 4.14Å
732	V	94.5	Very high	85.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-36.2	176.8	70.4	0	0	0	0	111.8	T672 R684 A728 L729 V734 D735 I736 M755	T672-V732 HydrophobicContact CG2-CB 3.69Å; T672-V732 HydrophobicContact CG2-CG1 3.39Å; T672-V732 HydrophobicContact CG2-CG2 4.19Å; R684-V732 HydrophobicContact CB-CG2 4.23Å; A728-V732 PolarHBondContact O-N 3.48Å; L729-V732 WeakPolarHBondContact O-CG1 3.39Å; L729-V732 PolarHBondContact O-N 2.73Å; V732-V734 PolarHBondContact O-N 3.24Å; V732-D735 PolarHBondContact O-N 2.89Å; V732-I736 HydrophobicContact CG2-CG2 4.04Å; V732-I736 VanDerWaalsContact O-CG1 3.31Å; V732-I736 WeakPolarHBondContact O-CG1 3.3Å; V732-I736 WeakPolarHBondContact O-CG2 3.47Å; V732-I736 PolarHBondContact O-N 2.94Å; V732-I736 VanDerWaalsContact O-N 3.11Å; V732-M755 HydrophobicContact CB-CE 4.46Å; V732-M755 HydrophobicContact CG1-CE 3.54Å; V732-M755 HydrophobicContact CG1-SD 4.32Å; V732-M755 HydrophobicContact CG2-CE 4.26Å
733	F	94.4	Very high	83.4	Confident	1 Å²	1	45.3 Å²	45.3	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-57	-39.7	175.4	-173.7	-75.6	0	0	0	111.9	L729 I730 K731 I736 R752 M755 Y756 F794 L797 L798	L729-F733 PolarHBondContact O-N 3.35Å; I730-F733 WeakPolarHBondContact O-CB 3.39Å; I730-F733 PolarHBondContact O-N 2.93Å; K731-F733 VanDerWaalsContact C-N 3.31Å; K731-F733 PolarHBondContact O-N 3.35Å; F733-I736 WeakPolarHBondContact O-CG1 3.24Å; F733-R752 HydrophobicContact CD2-CG 3.88Å; F733-R752 HydrophobicContact CE2-CB 4.13Å; F733-R752 HydrophobicContact CE2-CG 3.7Å; F733-R752 VanDerWaalsContact CZ-CD 3.49Å; F733-R752 HydrophobicContact CZ-CG 4.21Å; F733-R752 PolarHBondContact O-NE 3.48Å; F733-R752 PolarHBondContact O-NH2 2.86Å; F733-M755 HydrophobicContact CB-SD 3.83Å; F733-M755 HydrophobicContact CD2-SD 3.68Å; F733-M755 HydrophobicContact CG-SD 4.2Å; F733-Y756 HydrophobicContact CE2-CE1 4.27Å; F733-F794 HydrophobicContact CB-CD2 4.13Å; F733-F794 HydrophobicContact CB-CE2 4.29Å; F733-F794 AromaticContact CD1-CD2 3.38Å; F733-F794 HydrophobicContact CD1-CD2 3.38Å; F733-F794 AromaticContact CD1-CE2 3.63Å; F733-F794 HydrophobicContact CD1-CE2 3.63Å; F733-F794 HydrophobicContact CD2-CD2 4.38Å; F733-F794 AromaticContact CD2-CE2 3.85Å; F733-F794 HydrophobicContact CD2-CE2 3.85Å; F733-F794 AromaticContact CE1-CD2 3.79Å; F733-F794 HydrophobicContact CE1-CD2 3.79Å; F733-F794 AromaticContact CE1-CE2 3.81Å; F733-F794 HydrophobicContact CE1-CE2 3.81Å; F733-F794 HydrophobicContact CE2-CE2 4.02Å; F733-F794 AromaticContact CG-CD2 3.72Å; F733-F794 HydrophobicContact CG-CD2 3.72Å; F733-F794 AromaticContact CG-CE2 3.66Å; F733-F794 HydrophobicContact CG-CE2 3.66Å; F733-F794 HydrophobicContact CZ-CD2 4.45Å; F733-F794 HydrophobicContact CZ-CE2 4Å; F733-L797 HydrophobicContact CE1-CB 4.13Å; F733-L798 HydrophobicContact CZ-CD1 3.99Å
734	V	92.4	Very high	81.8	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	26%	0.26	C	S	.	.	H	α-helix	trans	-76.2	-38.5	178.4	173.1	0	0	0	0	111.9	I730 K731 V732 I736 L790 R793 F794 L797	I730-V734 WeakPolarHBondContact O-CG2 3.09Å; I730-V734 PolarHBondContact O-N 3.23Å; K731-V734 PolarHBondContact O-N 3.38Å; V732-V734 PolarHBondContact O-N 3.24Å; V734-I736 PolarHBondContact O-N 3.38Å; V734-L790 HydrophobicContact CB-CD1 4.15Å; V734-L790 HydrophobicContact CG1-CD1 4.45Å; V734-L790 HydrophobicContact CG2-CD1 3.92Å; V734-R793 HydrophobicContact CG1-CB 4Å; V734-R793 HydrophobicContact CG2-CB 4.25Å; V734-F794 HydrophobicContact CG2-CB 3.8Å; V734-L797 HydrophobicContact CB-CD1 4.3Å; V734-L797 HydrophobicContact CG1-CD1 4.18Å; V734-L797 HydrophobicContact CG2-CD1 4.27Å
735	D	88.6	Confident	80.3	Confident	36 Å²	36	47 Å²	47	19%	0.193	26%	0.262	C	S	.	.	H	α-helix	trans	-71.5	-25.5	-177	-75	-6.9	0	0	0	114	I675 R684 K731 V732 E737	I675-D735 WeakPolarHBondContact CD1-OD2 3.18Å; R684-D735 IonicContact CZ-OD2 2.68Å; R684-D735 IonicContact NH1-OD2 2.79Å; R684-D735 PolarHBondContact NH1-OD2 2.88Å; K731-D735 PolarHBondContact O-N 3.31Å; V732-D735 PolarHBondContact O-N 2.89Å; D735-E737 PolarHBondContact O-N 2.93Å
736	I	85.6	Confident	79.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	18.6	-179.9	62.7	178.6	0	0	0	113.9	A685 V732 F733 V734 F738 R752 M755	A685-I736 HydrophobicContact CB-CG2 3.99Å; V732-I736 HydrophobicContact CG2-CG2 4.04Å; V732-I736 VanDerWaalsContact O-CG1 3.31Å; V732-I736 WeakPolarHBondContact O-CG1 3.3Å; V732-I736 WeakPolarHBondContact O-CG2 3.47Å; V732-I736 PolarHBondContact O-N 2.94Å; V732-I736 VanDerWaalsContact O-N 3.11Å; F733-I736 WeakPolarHBondContact O-CG1 3.24Å; V734-I736 PolarHBondContact O-N 3.38Å; I736-F738 HydrophobicContact CB-CE2 4.3Å; I736-F738 WeakPolarHBondContact O-CD2 3.31Å; I736-F738 PolarHBondContact O-N 2.79Å; I736-F738 VanDerWaalsContact O-N 3.14Å; I736-R752 HydrophobicContact CD1-CG 3.59Å; I736-R752 HydrophobicContact CG1-CG 4.47Å; I736-M755 HydrophobicContact CD1-CE 3.66Å; I736-M755 HydrophobicContact CD1-SD 4.29Å
737	E	82.3	Confident	78.4	Confident	54 Å²	54	54.3 Å²	54.3	25%	0.252	30%	0.296	S	S	.	.			trans	-80.4	88.5	170.1	-161.4	67.4	-150	0	0	109.3	D735 T739 K748 R752 L797	D735-E737 PolarHBondContact O-N 2.93Å; E737-T739 PolarHBondContact O-N 3.38Å; E737-K748 IonicContact OE1-NZ 3.9Å; E737-K748 PolarHBondContact OE1-NZ 3.31Å; E737-K748 IonicContact OE2-NZ 2.63Å; E737-R752 IonicContact OE2-CZ 2.81Å; E737-R752 VanDerWaalsContact OE2-CZ 3.32Å; E737-R752 IonicContact OE2-NH1 2.69Å; E737-R752 PolarHBondContact OE2-NH1 3.18Å; E737-R752 IonicContact OE2-NH2 2.63Å; E737-R752 PolarHBondContact OE2-NH2 2.68Å; E737-L797 HydrophobicContact CB-CD1 4.37Å; E737-L797 HydrophobicContact CG-CD2 3.92Å
738	F	69.6	Low	77.9	Confident	30 Å²	30	50.5 Å²	50.5	13%	0.132	28%	0.278	C	S	.	.			trans	-74.3	115	178.1	-56.9	-73.6	0	0	0	110.7	P681 H682 I736 Q744 K748 Y751	P681-F738 HydrophobicContact CB-CE1 3.84Å; P681-F738 HydrophobicContact CB-CZ 4.1Å; P681-F738 HydrophobicContact CG-CE1 3.68Å; P681-F738 HydrophobicContact CG-CZ 4.26Å; H682-F738 AromaticContact CE1-CZ 3.81Å; H682-F738 AromaticContact ND1-CZ 3.97Å; I736-F738 HydrophobicContact CB-CE2 4.3Å; I736-F738 WeakPolarHBondContact O-CD2 3.31Å; I736-F738 PolarHBondContact O-N 2.79Å; I736-F738 VanDerWaalsContact O-N 3.14Å; F738-Q744 HydrophobicContact CB-CB 3.96Å; F738-Q744 HydrophobicContact CG-CB 4.4Å; F738-K748 HydrophobicContact CD2-CB 4.43Å; F738-Y751 AromaticContact CE2-CD2 3.91Å; F738-Y751 HydrophobicContact CE2-CD2 3.91Å; F738-Y751 AromaticContact CE2-CE2 3.91Å; F738-Y751 HydrophobicContact CE2-CE2 3.91Å; F738-Y751 HydrophobicContact CZ-CD2 4.47Å; F738-Y751 HydrophobicContact CZ-CE2 4.23Å
739	T	52.3	Low	77.5	Confident	132 Å²	132	50.2 Å²	50.2	81%	0.81	28%	0.275	S	S	*	.			trans	-92.7	119.2	176.7	56.1	0	0	0	0	110.9	E737	E737-T739 PolarHBondContact O-N 3.38Å
740	G	51.4	Low	77.1	Confident	82 Å²	82	54.2 Å²	54.2	85%	0.845	30%	0.297	S	S	*	.	S	Bend	trans	129.8	-27.1	157.2	0	0	0	0	0	118.5
741	D	53.1	Low	76.8	Confident	65 Å²	65	56.1 Å²	56.1	35%	0.348	30%	0.304	S	S	.	.			trans	-113.6	125	-179.6	-170.2	-31	0	0	0	111.6	H743 Q744 F745	D741-H743 VanDerWaalsContact C-N 3.26Å; D741-H743 PolarHBondContact O-N 3.33Å; D741-H743 IonicContact OD1-CG 3.37Å; D741-H743 PolarHBondContact OD1-N 2.91Å; D741-H743 IonicContact OD1-ND1 2.72Å; D741-H743 PolarHBondContact OD1-ND1 2.72Å; D741-Q744 HydrophobicContact CB-CB 4.16Å; D741-Q744 HydrophobicContact CB-CG 3.91Å; D741-Q744 PolarHBondContact O-N 3.47Å; D741-F745 PolarHBondContact O-N 2.85Å
742	P	57	Low	76.7	Confident	104 Å²	104	52.4 Å²	52.4	68%	0.675	29%	0.288	S	S	*	.	H	α-helix	trans	-54.1	-34.7	175.6	-25	33.1	0	0	0	114.8	Q744 F745	P742-Q744 VanDerWaalsContact C-N 3.3Å; P742-Q744 PolarHBondContact O-N 3Å; P742-F745 WeakPolarHBondContact O-CB 3.44Å; P742-F745 PolarHBondContact O-N 3.23Å
743	H	59.8	Low	76.6	Confident	163 Å²	163	59 Å²	59	76%	0.755	31%	0.313	S	S	*	.	H	α-helix	trans	-69.8	-30.6	178	-67.3	90.1	0	0	0	112.1	D741	D741-H743 VanDerWaalsContact C-N 3.26Å; D741-H743 PolarHBondContact O-N 3.33Å; D741-H743 IonicContact OD1-CG 3.37Å; D741-H743 PolarHBondContact OD1-N 2.91Å; D741-H743 IonicContact OD1-ND1 2.72Å; D741-H743 PolarHBondContact OD1-ND1 2.72Å
744	Q	60.8	Low	76.6	Confident	70 Å²	70	59.9 Å²	59.9	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-80.2	-25.3	176.8	-63.4	179.5	2.3	0	0	111.8	F738 D741 P742 Q747 K748	F738-Q744 HydrophobicContact CB-CB 3.96Å; F738-Q744 HydrophobicContact CG-CB 4.4Å; D741-Q744 HydrophobicContact CB-CB 4.16Å; D741-Q744 HydrophobicContact CB-CG 3.91Å; D741-Q744 PolarHBondContact O-N 3.47Å; P742-Q744 VanDerWaalsContact C-N 3.3Å; P742-Q744 PolarHBondContact O-N 3Å; Q744-Q747 WeakPolarHBondContact O-CB 3.15Å; Q744-Q747 PolarHBondContact O-N 2.91Å; Q744-K748 PolarHBondContact O-N 3.01Å
745	F	66.6	Low	76.7	Confident	70 Å²	70	59.8 Å²	59.8	31%	0.307	32%	0.318	S	S	.	.	H	α-helix	trans	-60.2	-49	-179.6	-179.2	-95.2	0	0	0	112.4	D741 P742 Q747 K748 F749 F804	D741-F745 PolarHBondContact O-N 2.85Å; P742-F745 WeakPolarHBondContact O-CB 3.44Å; P742-F745 PolarHBondContact O-N 3.23Å; F745-Q747 VanDerWaalsContact C-N 3.31Å; F745-Q747 PolarHBondContact O-N 2.74Å; F745-K748 WeakPolarHBondContact O-CD 3.35Å; F745-K748 WeakPolarHBondContact O-CG 3.26Å; F745-F749 HydrophobicContact CD1-CE2 4.41Å; F745-F749 AromaticContact CE1-CE2 3.94Å; F745-F749 HydrophobicContact CE1-CE2 3.94Å; F745-F749 HydrophobicContact CE1-CZ 4.34Å; F745-F749 HydrophobicContact CZ-CE2 4.45Å; F745-F749 HydrophobicContact CZ-CZ 4.44Å; F745-F804 HydrophobicContact CD1-CZ 4.44Å; F745-F804 HydrophobicContact CE1-CD1 4.14Å; F745-F804 HydrophobicContact CE1-CD2 4.1Å; F745-F804 AromaticContact CE1-CE1 3.77Å; F745-F804 HydrophobicContact CE1-CE1 3.77Å; F745-F804 AromaticContact CE1-CE2 3.72Å; F745-F804 HydrophobicContact CE1-CE2 3.72Å; F745-F804 HydrophobicContact CE1-CG 4.31Å; F745-F804 AromaticContact CE1-CZ 3.55Å; F745-F804 HydrophobicContact CE1-CZ 3.55Å; F745-F804 HydrophobicContact CZ-CD1 4.45Å; F745-F804 HydrophobicContact CZ-CD2 4.12Å; F745-F804 HydrophobicContact CZ-CE2 4.17Å; F745-F804 HydrophobicContact CZ-CG 4.27Å; F745-F804 HydrophobicContact CZ-CZ 4.38Å
746	E	75.4	Confident	77	Confident	89 Å²	89	58 Å²	58	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-73.5	-26.3	178.2	-69	-173.2	171.5	0	0	112.5	K748 F749	E746-K748 PolarHBondContact O-N 3.33Å; E746-F749 WeakPolarHBondContact O-CB 3.09Å; E746-F749 PolarHBondContact O-N 2.73Å; E746-F749 VanDerWaalsContact O-N 3.14Å
747	Q	79.8	Confident	77.5	Confident	65 Å²	65	59.7 Å²	59.7	30%	0.304	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-32.7	-179.1	-159.6	-178.6	19.4	0	0	112.2	Q744 F745 F749 N750 Y751	Q744-Q747 WeakPolarHBondContact O-CB 3.15Å; Q744-Q747 PolarHBondContact O-N 2.91Å; F745-Q747 VanDerWaalsContact C-N 3.31Å; F745-Q747 PolarHBondContact O-N 2.74Å; Q747-F749 PolarHBondContact O-N 3.07Å; Q747-N750 WeakPolarHBondContact O-CB 3.49Å; Q747-N750 PolarHBondContact O-N 3.47Å; Q747-N750 VanDerWaalsContact O-N 3.09Å; Q747-Y751 HydrophobicContact CB-CE2 4.48Å; Q747-Y751 HydrophobicContact CG-CD2 4.26Å; Q747-Y751 HydrophobicContact CG-CE2 3.61Å; Q747-Y751 PolarHBondContact NE2-OH 3.37Å; Q747-Y751 VanDerWaalsContact NE2-OH 3.11Å; Q747-Y751 WeakPolarHBondContact O-CD2 3.48Å; Q747-Y751 PolarHBondContact O-N 3.02Å
748	K	86	Confident	78.1	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-57.5	-35.1	177.4	82.8	-170.2	170.3	146.7	0	112.7	E737 F738 Q744 F745 E746 N750 Y751 R752 D801	E737-K748 IonicContact OE1-NZ 3.9Å; E737-K748 PolarHBondContact OE1-NZ 3.31Å; E737-K748 IonicContact OE2-NZ 2.63Å; F738-K748 HydrophobicContact CD2-CB 4.43Å; Q744-K748 PolarHBondContact O-N 3.01Å; F745-K748 WeakPolarHBondContact O-CD 3.35Å; F745-K748 WeakPolarHBondContact O-CG 3.26Å; E746-K748 PolarHBondContact O-N 3.33Å; K748-N750 VanDerWaalsContact C-N 3.34Å; K748-N750 PolarHBondContact O-N 3.09Å; K748-Y751 PolarHBondContact O-N 3.22Å; K748-R752 WeakPolarHBondContact O-CG 3.31Å; K748-R752 PolarHBondContact O-N 3.48Å; K748-D801 IonicContact NZ-OD1 3.3Å; K748-D801 PolarHBondContact NZ-OD1 3.2Å; K748-D801 VanDerWaalsContact NZ-OD1 3.14Å
749	F	89.4	Confident	79.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-68.2	-36.6	179.5	-62.6	-61.3	0	0	0	111.5	F745 E746 Q747 Y751 R752 R753 D801 F804 L805 F852 M856	F745-F749 HydrophobicContact CD1-CE2 4.41Å; F745-F749 AromaticContact CE1-CE2 3.94Å; F745-F749 HydrophobicContact CE1-CE2 3.94Å; F745-F749 HydrophobicContact CE1-CZ 4.34Å; F745-F749 HydrophobicContact CZ-CE2 4.45Å; F745-F749 HydrophobicContact CZ-CZ 4.44Å; E746-F749 WeakPolarHBondContact O-CB 3.09Å; E746-F749 PolarHBondContact O-N 2.73Å; E746-F749 VanDerWaalsContact O-N 3.14Å; Q747-F749 PolarHBondContact O-N 3.07Å; F749-Y751 VanDerWaalsContact C-N 3.3Å; F749-Y751 PolarHBondContact O-N 2.61Å; F749-R752 PolarHBondContact O-N 2.9Å; F749-R753 WeakPolarHBondContact O-CB 3.28Å; F749-R753 PolarHBondContact O-N 2.72Å; F749-D801 HydrophobicContact CE1-CB 3.94Å; F749-D801 VanDerWaalsContact CE1-CG 3.48Å; F749-D801 WeakPolarHBondContact CE1-OD1 3.29Å; F749-F804 HydrophobicContact CE1-CD1 4.47Å; F749-F804 AromaticContact CE2-CD1 3.69Å; F749-F804 HydrophobicContact CE2-CD1 3.69Å; F749-F804 AromaticContact CE2-CE1 3.65Å; F749-F804 HydrophobicContact CE2-CE1 3.65Å; F749-F804 AromaticContact CZ-CD1 3.44Å; F749-F804 HydrophobicContact CZ-CD1 3.44Å; F749-F804 VanDerWaalsContact CZ-CD1 3.44Å; F749-F804 AromaticContact CZ-CE1 3.92Å; F749-F804 HydrophobicContact CZ-CE1 3.92Å; F749-F804 HydrophobicContact CZ-CG 4.3Å; F749-L805 HydrophobicContact CD1-CD1 3.91Å; F749-L805 HydrophobicContact CD1-CD2 3.79Å; F749-L805 HydrophobicContact CD1-CG 4.05Å; F749-L805 HydrophobicContact CD2-CD2 4.24Å; F749-L805 HydrophobicContact CE1-CD1 3.84Å; F749-L805 HydrophobicContact CE1-CD2 3.8Å; F749-L805 HydrophobicContact CE1-CG 3.7Å; F749-L805 HydrophobicContact CE2-CD2 4.28Å; F749-L805 HydrophobicContact CG-CD2 4.02Å; F749-L805 HydrophobicContact CZ-CD2 4.06Å; F749-L805 HydrophobicContact CZ-CG 4.15Å; F749-F852 HydrophobicContact CB-CE1 3.91Å; F749-F852 HydrophobicContact CB-CZ 3.66Å; F749-M856 HydrophobicContact CB-CE 4.03Å; F749-M856 WeakPolarHBondContact O-CE 3.23Å
750	N	88.1	Confident	81.4	Confident	88 Å²	88	54.7 Å²	54.7	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-62.8	-39.5	173.3	-68.8	-56.4	0	0	0	111.5	Q747 K748 P754 F852	Q747-N750 WeakPolarHBondContact O-CB 3.49Å; Q747-N750 PolarHBondContact O-N 3.47Å; Q747-N750 VanDerWaalsContact O-N 3.09Å; K748-N750 VanDerWaalsContact C-N 3.34Å; K748-N750 PolarHBondContact O-N 3.09Å; N750-P754 WeakPolarHBondContact O-CD 3.4Å; N750-F852 WeakPolarHBondContact OD1-CE2 3.37Å
751	Y	90.4	Very high	83.4	Confident	42 Å²	42	51.4 Å²	51.4	17%	0.165	25%	0.245	C	C	.	.	H	α-helix	trans	-70.8	-34.7	175.5	-68	-48.2	0	0	0	113.9	H682 A685 F738 Q747 K748 F749 P754	H682-Y751 AromaticContact ND1-CE2 3.54Å; H682-Y751 AromaticContact ND1-CZ 3.45Å; H682-Y751 PolarHBondContact ND1-OH 2.99Å; A685-Y751 HydrophobicContact CB-CD1 3.37Å; A685-Y751 HydrophobicContact CB-CD2 4.19Å; A685-Y751 HydrophobicContact CB-CE1 3.9Å; A685-Y751 HydrophobicContact CB-CG 3.55Å; F738-Y751 AromaticContact CE2-CD2 3.91Å; F738-Y751 HydrophobicContact CE2-CD2 3.91Å; F738-Y751 AromaticContact CE2-CE2 3.91Å; F738-Y751 HydrophobicContact CE2-CE2 3.91Å; F738-Y751 HydrophobicContact CZ-CD2 4.47Å; F738-Y751 HydrophobicContact CZ-CE2 4.23Å; Q747-Y751 HydrophobicContact CB-CE2 4.48Å; Q747-Y751 HydrophobicContact CG-CD2 4.26Å; Q747-Y751 HydrophobicContact CG-CE2 3.61Å; Q747-Y751 PolarHBondContact NE2-OH 3.37Å; Q747-Y751 VanDerWaalsContact NE2-OH 3.11Å; Q747-Y751 WeakPolarHBondContact O-CD2 3.48Å; Q747-Y751 PolarHBondContact O-N 3.02Å; K748-Y751 PolarHBondContact O-N 3.22Å; F749-Y751 VanDerWaalsContact C-N 3.3Å; F749-Y751 PolarHBondContact O-N 2.61Å; Y751-P754 WeakPolarHBondContact O-CD 3.43Å; Y751-P754 WeakPolarHBondContact O-CG 3.34Å
752	R	92.7	Very high	85.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-74.9	-28.4	176.7	-73.5	179.6	171.7	149.4	8.7	113	F733 I736 E737 K748 F749 M755 Y756 D801	F733-R752 HydrophobicContact CD2-CG 3.88Å; F733-R752 HydrophobicContact CE2-CB 4.13Å; F733-R752 HydrophobicContact CE2-CG 3.7Å; F733-R752 VanDerWaalsContact CZ-CD 3.49Å; F733-R752 HydrophobicContact CZ-CG 4.21Å; F733-R752 PolarHBondContact O-NE 3.48Å; F733-R752 PolarHBondContact O-NH2 2.86Å; I736-R752 HydrophobicContact CD1-CG 3.59Å; I736-R752 HydrophobicContact CG1-CG 4.47Å; E737-R752 IonicContact OE2-CZ 2.81Å; E737-R752 VanDerWaalsContact OE2-CZ 3.32Å; E737-R752 IonicContact OE2-NH1 2.69Å; E737-R752 PolarHBondContact OE2-NH1 3.18Å; E737-R752 IonicContact OE2-NH2 2.63Å; E737-R752 PolarHBondContact OE2-NH2 2.68Å; K748-R752 WeakPolarHBondContact O-CG 3.31Å; K748-R752 PolarHBondContact O-N 3.48Å; F749-R752 PolarHBondContact O-N 2.9Å; R752-M755 HydrophobicContact CG-SD 4.45Å; R752-M755 WeakPolarHBondContact O-CA 3.31Å; R752-M755 VanDerWaalsContact O-CB 3.25Å; R752-M755 WeakPolarHBondContact O-CB 3.49Å; R752-M755 PolarHBondContact O-N 2.92Å; R752-Y756 HydrophobicContact CB-CE2 4.19Å; R752-Y756 WeakPolarHBondContact O-CD2 3.39Å; R752-D801 WeakPolarHBondContact CD-OD2 3.4Å; R752-D801 IonicContact CZ-OD2 3.54Å; R752-D801 IonicContact NE-OD2 2.67Å; R752-D801 IonicContact NH1-OD1 2.68Å; R752-D801 PolarHBondContact NH1-OD1 3.42Å; R752-D801 IonicContact NH1-OD2 3.06Å; R752-D801 PolarHBondContact NH1-OD2 3.03Å
753	R	92.8	Very high	87.3	Confident	140 Å²	140	44.3 Å²	44.3	53%	0.528	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47	-52.2	-178.9	-176	179.8	172.4	-147.4	-4.3	114.1	F749 M755 P757 M856	F749-R753 WeakPolarHBondContact O-CB 3.28Å; F749-R753 PolarHBondContact O-N 2.72Å; R753-M755 PolarHBondContact O-N 3Å; R753-P757 VanDerWaalsContact O-CD 3.28Å; R753-P757 WeakPolarHBondContact O-CD 3.25Å; R753-M856 HydrophobicContact CB-CE 4.1Å; R753-M856 HydrophobicContact CB-SD 3.73Å; R753-M856 HydrophobicContact CG-SD 3.82Å
754	P	93.9	Very high	88.8	Confident	19 Å²	19	39.3 Å²	39.3	12%	0.123	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.9	177.9	25.2	-35.5	0	0	0	113.6	A688 E689 E692 N750 Y751 Y756 P757 I758	A688-P754 HydrophobicContact CB-CG 4.48Å; E689-P754 HydrophobicContact CB-CB 4.39Å; E689-P754 HydrophobicContact CB-CG 4.23Å; E692-P754 HydrophobicContact CB-CB 3.79Å; E692-P754 HydrophobicContact CG-CB 4.12Å; N750-P754 WeakPolarHBondContact O-CD 3.4Å; Y751-P754 WeakPolarHBondContact O-CD 3.43Å; Y751-P754 WeakPolarHBondContact O-CG 3.34Å; P754-Y756 PolarHBondContact O-N 3.33Å; P754-P757 WeakPolarHBondContact O-CD 3.3Å; P754-I758 VanDerWaalsContact O-CD1 3.3Å; P754-I758 WeakPolarHBondContact O-CD1 3.28Å; P754-I758 VanDerWaalsContact O-CG1 3.32Å; P754-I758 WeakPolarHBondContact O-CG1 3.43Å
755	M	95.8	Very high	90.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-71	-29.4	-177.7	-54.4	-179.9	-179.2	0	0	112.8	A688 L729 V732 F733 I736 R752 R753 I758 L759	A688-M755 HydrophobicContact CB-CE 3.66Å; A688-M755 HydrophobicContact CB-CG 3.86Å; L729-M755 HydrophobicContact CD1-CB 4.09Å; L729-M755 HydrophobicContact CD1-CG 3.86Å; L729-M755 HydrophobicContact CD1-SD 4.42Å; V732-M755 HydrophobicContact CB-CE 4.46Å; V732-M755 HydrophobicContact CG1-CE 3.54Å; V732-M755 HydrophobicContact CG1-SD 4.32Å; V732-M755 HydrophobicContact CG2-CE 4.26Å; F733-M755 HydrophobicContact CB-SD 3.83Å; F733-M755 HydrophobicContact CD2-SD 3.68Å; F733-M755 HydrophobicContact CG-SD 4.2Å; I736-M755 HydrophobicContact CD1-CE 3.66Å; I736-M755 HydrophobicContact CD1-SD 4.29Å; R752-M755 HydrophobicContact CG-SD 4.45Å; R752-M755 WeakPolarHBondContact O-CA 3.31Å; R752-M755 VanDerWaalsContact O-CB 3.25Å; R752-M755 WeakPolarHBondContact O-CB 3.49Å; R752-M755 PolarHBondContact O-N 2.92Å; R753-M755 PolarHBondContact O-N 3Å; M755-I758 PolarHBondContact O-N 2.88Å; M755-L759 WeakPolarHBondContact O-CB 3.29Å; M755-L759 VanDerWaalsContact O-CG 3.3Å; M755-L759 WeakPolarHBondContact O-CG 3.1Å; M755-L759 PolarHBondContact O-N 3.09Å
756	Y	95.3	Very high	91.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-47.8	-178	-63.2	-65.7	0	0	0	113.7	F733 R752 P754 I758 L759 R760 L798 M856 E859 T860 T863	F733-Y756 HydrophobicContact CE2-CE1 4.27Å; R752-Y756 HydrophobicContact CB-CE2 4.19Å; R752-Y756 WeakPolarHBondContact O-CD2 3.39Å; P754-Y756 PolarHBondContact O-N 3.33Å; Y756-I758 VanDerWaalsContact C-N 3.28Å; Y756-I758 PolarHBondContact O-N 3.49Å; Y756-L759 PolarHBondContact O-N 3.46Å; Y756-R760 PolarHBondContact O-N 3.21Å; Y756-L798 HydrophobicContact CE1-CD1 3.76Å; Y756-M856 HydrophobicContact CD2-CE 4.26Å; Y756-M856 HydrophobicContact CE2-CE 3.58Å; Y756-M856 HydrophobicContact CE2-SD 4.49Å; Y756-E859 HydrophobicContact CD1-CB 4.37Å; Y756-E859 HydrophobicContact CD2-CB 3.75Å; Y756-E859 HydrophobicContact CE2-CB 4.39Å; Y756-E859 HydrophobicContact CG-CB 3.73Å; Y756-T860 PolarHBondContact OH-OG1 3.42Å; Y756-T863 VanDerWaalsContact CD1-OG1 3.31Å; Y756-T863 WeakPolarHBondContact CD1-OG1 3.47Å
757	P	94.3	Very high	92.4	Very high	34 Å²	34	38 Å²	38	22%	0.221	20%	0.198	C	C	.	.	H	α-helix	trans	-56.8	-39.9	169.8	-26.4	34	0	0	0	113.3	E692 R753 P754 R760 Y761	E692-P757 HydrophobicContact CG-CB 4.49Å; R753-P757 VanDerWaalsContact O-CD 3.28Å; R753-P757 WeakPolarHBondContact O-CD 3.25Å; P754-P757 WeakPolarHBondContact O-CD 3.3Å; P757-R760 PolarHBondContact O-N 3.24Å; P757-Y761 PolarHBondContact O-N 3.42Å
758	I	95.8	Very high	93.2	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-48.8	178.3	-59.8	161.9	0	0	0	110.5	A688 L691 E692 M695 L729 P754 M755 Y756 R760 Y761 M762	A688-I758 VanDerWaalsContact O-CD1 3.26Å; A688-I758 WeakPolarHBondContact O-CD1 3.41Å; L691-I758 HydrophobicContact CB-CD1 3.89Å; L691-I758 HydrophobicContact CD2-CD1 3.96Å; L691-I758 HydrophobicContact CD2-CG2 3.84Å; L691-I758 HydrophobicContact CG-CD1 3.85Å; L691-I758 HydrophobicContact CG-CG1 4.31Å; L691-I758 HydrophobicContact CG-CG2 4.23Å; E692-I758 HydrophobicContact CB-CD1 3.96Å; E692-I758 HydrophobicContact CB-CG1 4.09Å; M695-I758 HydrophobicContact SD-CB 4.25Å; M695-I758 HydrophobicContact SD-CG1 3.62Å; L729-I758 HydrophobicContact CD1-CD1 4.22Å; L729-I758 HydrophobicContact CD1-CG2 4.49Å; L729-I758 HydrophobicContact CD2-CB 3.99Å; L729-I758 HydrophobicContact CD2-CG2 3.48Å; L729-I758 VanDerWaalsContact CD2-CG2 3.48Å; P754-I758 VanDerWaalsContact O-CD1 3.3Å; P754-I758 WeakPolarHBondContact O-CD1 3.28Å; P754-I758 VanDerWaalsContact O-CG1 3.32Å; P754-I758 WeakPolarHBondContact O-CG1 3.43Å; M755-I758 PolarHBondContact O-N 2.88Å; Y756-I758 VanDerWaalsContact C-N 3.28Å; Y756-I758 PolarHBondContact O-N 3.49Å; I758-R760 VanDerWaalsContact C-N 3.29Å; I758-R760 PolarHBondContact O-N 3.27Å; I758-Y761 PolarHBondContact O-N 2.87Å; I758-Y761 VanDerWaalsContact O-N 3.12Å; I758-M762 HydrophobicContact CG2-CE 3.66Å; I758-M762 HydrophobicContact CG2-CG 4.16Å; I758-M762 HydrophobicContact CG2-SD 3.93Å; I758-M762 WeakPolarHBondContact O-CB 3.44Å; I758-M762 WeakPolarHBondContact O-CG 3.46Å; I758-M762 PolarHBondContact O-N 3.45Å
759	L	96.3	Very high	93.7	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-41.8	178.1	-76	169.4	0	0	0	111.3	L729 M755 Y756 M762 W763 F794 T863 F866	L729-L759 HydrophobicContact CD2-CD2 3.77Å; L729-L759 HydrophobicContact CD2-CG 3.88Å; M755-L759 WeakPolarHBondContact O-CB 3.29Å; M755-L759 VanDerWaalsContact O-CG 3.3Å; M755-L759 WeakPolarHBondContact O-CG 3.1Å; M755-L759 PolarHBondContact O-N 3.09Å; Y756-L759 PolarHBondContact O-N 3.46Å; L759-M762 PolarHBondContact O-N 3.32Å; L759-W763 VanDerWaalsContact O-CB 3.28Å; L759-W763 WeakPolarHBondContact O-CB 3.47Å; L759-W763 PolarHBondContact O-N 2.97Å; L759-F794 HydrophobicContact CD1-CE2 4.32Å; L759-F794 HydrophobicContact CD1-CZ 4.02Å; L759-T863 HydrophobicContact CD1-CG2 4.32Å; L759-F866 HydrophobicContact CB-CZ 4.16Å
760	R	95	Very high	94.1	Very high	102 Å²	102	40.9 Å²	40.9	39%	0.385	21%	0.209	S	C	.	.	H	α-helix	trans	-61	-44.6	174.8	-176.6	-174.8	-65.1	123.7	7	111.7	Y756 P757 I758 W763 G764 E859 F866	Y756-R760 PolarHBondContact O-N 3.21Å; P757-R760 PolarHBondContact O-N 3.24Å; I758-R760 VanDerWaalsContact C-N 3.29Å; I758-R760 PolarHBondContact O-N 3.27Å; R760-W763 PolarHBondContact O-N 3.42Å; R760-G764 PolarHBondContact O-N 3.08Å; R760-G764 VanDerWaalsContact O-N 3.08Å; R760-E859 IonicContact CZ-OE2 3.3Å; R760-E859 IonicContact NH1-OE1 3.53Å; R760-E859 IonicContact NH1-OE2 2.69Å; R760-E859 PolarHBondContact NH1-OE2 3.17Å; R760-E859 IonicContact NH2-OE1 3.49Å; R760-E859 IonicContact NH2-OE2 3.55Å; R760-E859 PolarHBondContact NH2-OE2 2.86Å; R760-F866 HydrophobicContact CB-CE1 4.15Å
761	Y	93.6	Very high	94.4	Very high	12 Å²	12	37.2 Å²	37.2	5%	0.047	19%	0.191	C	C	.	.	H	α-helix	trans	-65.6	-46.3	177.9	175.5	-91.3	0	0	0	112.4	M695 P696 L698 F716 P757 I758 W763 G764 T765	M695-Y761 HydrophobicContact CE-CD2 4.2Å; M695-Y761 HydrophobicContact CE-CG 3.9Å; P696-Y761 HydrophobicContact CB-CE2 4.36Å; P696-Y761 HydrophobicContact CG-CE2 4.15Å; L698-Y761 HydrophobicContact CD1-CD2 4.39Å; L698-Y761 HydrophobicContact CG-CD2 4.5Å; F716-Y761 HydrophobicContact CB-CE1 4.15Å; F716-Y761 WeakPolarHBondContact CB-OH 3.31Å; F716-Y761 AromaticContact CD1-CE1 3.87Å; F716-Y761 HydrophobicContact CD1-CE1 3.87Å; F716-Y761 HydrophobicContact CG-CE1 4.28Å; P757-Y761 PolarHBondContact O-N 3.42Å; I758-Y761 PolarHBondContact O-N 2.87Å; I758-Y761 VanDerWaalsContact O-N 3.12Å; Y761-W763 VanDerWaalsContact C-N 3.32Å; Y761-W763 PolarHBondContact O-N 3.02Å; Y761-G764 WeakPolarHBondContact O-CA 3.36Å; Y761-G764 PolarHBondContact O-N 3.27Å; Y761-G764 VanDerWaalsContact O-N 3.09Å; Y761-T765 PolarHBondContact O-N 3.46Å; Y761-T765 PolarHBondContact O-OG1 2.78Å
762	M	95.1	Very high	94.8	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-43.1	175.8	-76.2	-176.8	173.9	0	0	111	L691 L725 A726 L729 I758 L759 G764 T765 Y768 I772	L691-M762 HydrophobicContact CD2-CE 4.17Å; L725-M762 HydrophobicContact CD2-CE 4.29Å; L725-M762 HydrophobicContact CG-CE 3.85Å; A726-M762 HydrophobicContact CB-SD 4.08Å; L729-M762 HydrophobicContact CD2-CE 4.09Å; L729-M762 HydrophobicContact CD2-SD 3.67Å; I758-M762 HydrophobicContact CG2-CE 3.66Å; I758-M762 HydrophobicContact CG2-CG 4.16Å; I758-M762 HydrophobicContact CG2-SD 3.93Å; I758-M762 WeakPolarHBondContact O-CB 3.44Å; I758-M762 WeakPolarHBondContact O-CG 3.46Å; I758-M762 PolarHBondContact O-N 3.45Å; L759-M762 PolarHBondContact O-N 3.32Å; M762-G764 VanDerWaalsContact C-N 3.26Å; M762-G764 PolarHBondContact O-N 2.81Å; M762-T765 PolarHBondContact O-N 3.4Å; M762-Y768 HydrophobicContact CB-CG 4.19Å; M762-Y768 HydrophobicContact CE-CD1 4.04Å; M762-Y768 HydrophobicContact CE-CE1 4.08Å; M762-Y768 HydrophobicContact CG-CD1 3.84Å; M762-Y768 HydrophobicContact CG-CE1 4.45Å; M762-Y768 HydrophobicContact CG-CG 3.94Å; M762-Y768 WeakPolarHBondContact O-CB 3.25Å; M762-Y768 HydrophobicContact SD-CD1 4.14Å; M762-I772 HydrophobicContact CB-CD1 4.42Å
763	W	95.6	Very high	95	Very high	19 Å²	19	37.5 Å²	37.5	7%	0.072	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-35.7	175	-163.3	-99.5	0	0	0	112	L759 R760 Y761 T765 R769 I772 K773 F866 L867 E870 I871	L759-W763 VanDerWaalsContact O-CB 3.28Å; L759-W763 WeakPolarHBondContact O-CB 3.47Å; L759-W763 PolarHBondContact O-N 2.97Å; R760-W763 PolarHBondContact O-N 3.42Å; Y761-W763 VanDerWaalsContact C-N 3.32Å; Y761-W763 PolarHBondContact O-N 3.02Å; W763-T765 PolarHBondContact O-N 3.4Å; W763-R769 HydrophobicContact CD2-CG 3.94Å; W763-R769 HydrophobicContact CE3-CG 3.86Å; W763-R769 HydrophobicContact CH2-CG 4.25Å; W763-R769 HydrophobicContact CZ2-CG 4.35Å; W763-R769 HydrophobicContact CZ3-CG 4Å; W763-R769 VanDerWaalsContact O-CZ 3.28Å; W763-R769 PolarHBondContact O-NE 3.24Å; W763-R769 PolarHBondContact O-NH2 3.27Å; W763-I772 HydrophobicContact CE3-CD1 4.25Å; W763-I772 HydrophobicContact CE3-CG2 4.32Å; W763-I772 HydrophobicContact CZ3-CB 4.18Å; W763-I772 HydrophobicContact CZ3-CG2 3.78Å; W763-K773 HydrophobicContact CH2-CG 4.42Å; W763-F866 HydrophobicContact CB-CD2 3.79Å; W763-F866 HydrophobicContact CB-CE2 3.7Å; W763-F866 HydrophobicContact CB-CZ 4.35Å; W763-F866 AromaticContact CD1-CD2 3.48Å; W763-F866 VanDerWaalsContact CD1-CD2 3.48Å; W763-F866 AromaticContact CD1-CG 3.9Å; W763-F866 AromaticContact CD2-CD2 3.51Å; W763-F866 HydrophobicContact CD2-CD2 3.51Å; W763-F866 AromaticContact CD2-CE2 3.88Å; W763-F866 HydrophobicContact CD2-CE2 3.88Å; W763-F866 AromaticContact CE2-CD2 3.81Å; W763-F866 HydrophobicContact CE3-CD2 4.19Å; W763-F866 HydrophobicContact CE3-CE2 4.19Å; W763-F866 HydrophobicContact CG-CB 4.49Å; W763-F866 AromaticContact CG-CD2 3.29Å; W763-F866 HydrophobicContact CG-CD2 3.29Å; W763-F866 AromaticContact CG-CE2 3.67Å; W763-F866 HydrophobicContact CG-CE2 3.67Å; W763-F866 HydrophobicContact CG-CG 4.1Å; W763-F866 VanDerWaalsContact CZ2-O 3.31Å; W763-F866 WeakPolarHBondContact CZ2-O 3.44Å; W763-F866 AromaticContact NE1-CD2 3.77Å; W763-F866 PolarHBondContact NE1-O 3Å; W763-L867 HydrophobicContact CD2-CD2 4.47Å; W763-L867 HydrophobicContact CE3-CD2 3.79Å; W763-L867 HydrophobicContact CH2-CD2 4.02Å; W763-L867 HydrophobicContact CZ3-CD2 3.55Å; W763-E870 HydrophobicContact CH2-CB 4.41Å; W763-E870 HydrophobicContact CZ2-CB 4Å; W763-E870 HydrophobicContact CZ2-CG 4.32Å; W763-I871 HydrophobicContact CH2-CD1 3.61Å; W763-I871 HydrophobicContact CH2-CG1 3.96Å; W763-I871 HydrophobicContact CZ3-CD1 3.89Å
764	G	92.3	Very high	95.1	Very high	58 Å²	58	35.7 Å²	35.7	60%	0.598	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-7.8	174.2	0	0	0	0	0	115.4	R760 Y761 M762	R760-G764 PolarHBondContact O-N 3.08Å; R760-G764 VanDerWaalsContact O-N 3.08Å; Y761-G764 WeakPolarHBondContact O-CA 3.36Å; Y761-G764 PolarHBondContact O-N 3.27Å; Y761-G764 VanDerWaalsContact O-N 3.09Å; M762-G764 VanDerWaalsContact C-N 3.26Å; M762-G764 PolarHBondContact O-N 2.81Å
765	T	92	Very high	95.2	Very high	23 Å²	23	36.1 Å²	36.1	14%	0.141	20%	0.195	C	C	.	.	S	Bend	trans	-123.1	123.7	-172.9	-52.7	0	0	0	0	111.2	Y761 M762 W763 T767 Y768 R769	Y761-T765 PolarHBondContact O-N 3.46Å; Y761-T765 PolarHBondContact O-OG1 2.78Å; M762-T765 PolarHBondContact O-N 3.4Å; W763-T765 PolarHBondContact O-N 3.4Å; T765-T767 PolarHBondContact O-N 3.19Å; T765-Y768 HydrophobicContact CG2-CD2 3.73Å; T765-Y768 HydrophobicContact CG2-CE2 4.14Å; T765-Y768 PolarHBondContact O-N 3.24Å; T765-R769 WeakPolarHBondContact O-CB 3.32Å; T765-R769 PolarHBondContact O-N 3.12Å
766	D	93.3	Very high	95.2	Very high	109 Å²	109	36.1 Å²	36.1	58%	0.583	20%	0.195	S	C	*	.	H	α-helix	trans	-58.2	-44.6	-166	-61.5	-24	0	0	0	114.4	Y768 R769 E770	D766-Y768 VanDerWaalsContact C-N 3.34Å; D766-Y768 PolarHBondContact O-N 2.9Å; D766-R769 PolarHBondContact O-N 3.09Å; D766-R769 IonicContact OD1-CZ 2.65Å; D766-R769 IonicContact OD1-NH2 3.65Å; D766-R769 PolarHBondContact OD1-NH2 2.93Å; D766-E770 WeakPolarHBondContact O-CG 3.33Å; D766-E770 PolarHBondContact O-N 3.46Å
767	T	94.1	Very high	95.2	Very high	69 Å²	69	39.8 Å²	39.8	42%	0.423	21%	0.214	S	C	.	.	H	α-helix	trans	-61.1	-39.6	-178.3	48.1	0	0	0	0	113.4	T765	T765-T767 PolarHBondContact O-N 3.19Å
768	Y	96.3	Very high	95.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-75.1	-42.1	176.2	-63.4	-86.1	0	0	0	111.2	F716 A722 L725 A726 M762 T765 D766 E770 S771 I772	F716-Y768 PolarHBondContact O-OH 2.99Å; A722-Y768 VanDerWaalsContact CA-CE1 3.45Å; A722-Y768 HydrophobicContact CB-CD1 3.74Å; A722-Y768 HydrophobicContact CB-CD2 4.1Å; A722-Y768 HydrophobicContact CB-CE1 3.41Å; A722-Y768 VanDerWaalsContact CB-CE1 3.41Å; A722-Y768 HydrophobicContact CB-CE2 3.81Å; A722-Y768 HydrophobicContact CB-CG 4.08Å; A722-Y768 VanDerWaalsContact CB-CZ 3.45Å; A722-Y768 WeakPolarHBondContact O-CD1 3.46Å; A722-Y768 WeakPolarHBondContact O-CE1 3.48Å; L725-Y768 HydrophobicContact CB-CE1 4.32Å; L725-Y768 HydrophobicContact CD2-CE1 4.1Å; L725-Y768 HydrophobicContact CG-CE1 4.44Å; A726-Y768 HydrophobicContact CB-CD1 4.22Å; M762-Y768 HydrophobicContact CB-CG 4.19Å; M762-Y768 HydrophobicContact CE-CD1 4.04Å; M762-Y768 HydrophobicContact CE-CE1 4.08Å; M762-Y768 HydrophobicContact CG-CD1 3.84Å; M762-Y768 HydrophobicContact CG-CE1 4.45Å; M762-Y768 HydrophobicContact CG-CG 3.94Å; M762-Y768 WeakPolarHBondContact O-CB 3.25Å; M762-Y768 HydrophobicContact SD-CD1 4.14Å; T765-Y768 HydrophobicContact CG2-CD2 3.73Å; T765-Y768 HydrophobicContact CG2-CE2 4.14Å; T765-Y768 PolarHBondContact O-N 3.24Å; D766-Y768 VanDerWaalsContact C-N 3.34Å; D766-Y768 PolarHBondContact O-N 2.9Å; Y768-E770 PolarHBondContact O-N 3.17Å; Y768-S771 WeakPolarHBondContact O-CB 3.45Å; Y768-S771 PolarHBondContact O-N 2.97Å; Y768-I772 WeakPolarHBondContact O-CG1 3.44Å; Y768-I772 PolarHBondContact O-N 2.93Å; Y768-I772 VanDerWaalsContact O-N 3.11Å
769	R	96.4	Very high	95.1	Very high	44 Å²	44	44.6 Å²	44.6	17%	0.166	23%	0.229	C	C	.	.	H	α-helix	trans	-60	-45.3	-179.8	-166.9	-169.8	-40.4	162.1	21.8	112.2	W763 T765 D766 S771 I772 K773 E870	W763-R769 HydrophobicContact CD2-CG 3.94Å; W763-R769 HydrophobicContact CE3-CG 3.86Å; W763-R769 HydrophobicContact CH2-CG 4.25Å; W763-R769 HydrophobicContact CZ2-CG 4.35Å; W763-R769 HydrophobicContact CZ3-CG 4Å; W763-R769 VanDerWaalsContact O-CZ 3.28Å; W763-R769 PolarHBondContact O-NE 3.24Å; W763-R769 PolarHBondContact O-NH2 3.27Å; T765-R769 WeakPolarHBondContact O-CB 3.32Å; T765-R769 PolarHBondContact O-N 3.12Å; D766-R769 PolarHBondContact O-N 3.09Å; D766-R769 IonicContact OD1-CZ 2.65Å; D766-R769 IonicContact OD1-NH2 3.65Å; D766-R769 PolarHBondContact OD1-NH2 2.93Å; R769-S771 VanDerWaalsContact C-N 3.3Å; R769-S771 PolarHBondContact O-N 2.91Å; R769-I772 PolarHBondContact O-N 3.47Å; R769-I772 VanDerWaalsContact O-N 3.16Å; R769-K773 HydrophobicContact CG-CD 4.17Å; R769-K773 WeakPolarHBondContact O-CG 3.5Å; R769-K773 PolarHBondContact O-N 3.14Å; R769-E870 VanDerWaalsContact CD-OE1 3.23Å; R769-E870 WeakPolarHBondContact CD-OE1 3.15Å; R769-E870 IonicContact CZ-OE1 3.37Å; R769-E870 IonicContact NE-OE1 3.3Å; R769-E870 IonicContact NH1-OE1 2.68Å; R769-E870 PolarHBondContact NH1-OE1 3.4Å
770	E	96.3	Very high	94.8	Very high	88 Å²	88	46.2 Å²	46.2	41%	0.411	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-39.5	178.2	-69.8	-55.8	130.3	0	0	111.4	D766 Y768 I772 K773 D774	D766-E770 WeakPolarHBondContact O-CG 3.33Å; D766-E770 PolarHBondContact O-N 3.46Å; Y768-E770 PolarHBondContact O-N 3.17Å; E770-I772 PolarHBondContact O-N 3.41Å; E770-K773 CarbonylContact O-C 3.51Å; E770-K773 WeakPolarHBondContact O-CB 3.38Å; E770-K773 PolarHBondContact O-N 3.16Å; E770-K773 VanDerWaalsContact O-N 3.15Å; E770-K773 IonicContact OE1-NZ 3.03Å; E770-K773 PolarHBondContact OE1-NZ 3.25Å; E770-K773 IonicContact OE2-NZ 3.17Å; E770-D774 PolarHBondContact O-N 3.19Å
771	S	96.1	Very high	94.6	Very high	11 Å²	11	49.3 Å²	49.3	8%	0.077	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-39.7	173.9	179.3	0	0	0	0	113.4	P723 Y768 R769 K773 D774 L775	P723-S771 WeakPolarHBondContact CA-OG 3.36Å; P723-S771 PolarHBondContact O-OG 3.23Å; Y768-S771 WeakPolarHBondContact O-CB 3.45Å; Y768-S771 PolarHBondContact O-N 2.97Å; R769-S771 VanDerWaalsContact C-N 3.3Å; R769-S771 PolarHBondContact O-N 2.91Å; S771-K773 VanDerWaalsContact C-N 3.31Å; S771-D774 PolarHBondContact O-N 3.36Å; S771-L775 WeakPolarHBondContact O-CG 3.42Å; S771-L775 PolarHBondContact O-N 3.39Å; S771-L775 VanDerWaalsContact O-N 3.11Å
772	I	97.4	Very high	94.4	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-38.7	175.4	-62.3	172.8	0	0	0	110.3	A726 I730 M762 W763 Y768 R769 E770 L775 A776 F791 L867 I871	A726-I772 HydrophobicContact CB-CG1 4.13Å; I730-I772 HydrophobicContact CD1-CG1 4.07Å; I730-I772 HydrophobicContact CD1-CG2 4.24Å; M762-I772 HydrophobicContact CB-CD1 4.42Å; W763-I772 HydrophobicContact CE3-CD1 4.25Å; W763-I772 HydrophobicContact CE3-CG2 4.32Å; W763-I772 HydrophobicContact CZ3-CB 4.18Å; W763-I772 HydrophobicContact CZ3-CG2 3.78Å; Y768-I772 WeakPolarHBondContact O-CG1 3.44Å; Y768-I772 PolarHBondContact O-N 2.93Å; Y768-I772 VanDerWaalsContact O-N 3.11Å; R769-I772 PolarHBondContact O-N 3.47Å; R769-I772 VanDerWaalsContact O-N 3.16Å; E770-I772 PolarHBondContact O-N 3.41Å; I772-L775 PolarHBondContact O-N 2.79Å; I772-A776 PolarHBondContact O-N 3.23Å; I772-F791 HydrophobicContact CG2-CD2 4.47Å; I772-F791 HydrophobicContact CG2-CE2 3.61Å; I772-F791 HydrophobicContact CG2-CZ 4.11Å; I772-L867 HydrophobicContact CG2-CD2 4.37Å; I772-I871 HydrophobicContact CG2-CD1 4.34Å
773	K	96.7	Very high	93.9	Very high	44 Å²	44	52.3 Å²	52.3	19%	0.191	27%	0.274	C	S	.	.	H	α-helix	trans	-65.2	-41.7	175.1	-72.1	165.7	62.3	178.6	0	111.8	W763 R769 E770 S771 L775 A776 D777 E870 I871	W763-K773 HydrophobicContact CH2-CG 4.42Å; R769-K773 HydrophobicContact CG-CD 4.17Å; R769-K773 WeakPolarHBondContact O-CG 3.5Å; R769-K773 PolarHBondContact O-N 3.14Å; E770-K773 CarbonylContact O-C 3.51Å; E770-K773 WeakPolarHBondContact O-CB 3.38Å; E770-K773 PolarHBondContact O-N 3.16Å; E770-K773 VanDerWaalsContact O-N 3.15Å; E770-K773 IonicContact OE1-NZ 3.03Å; E770-K773 PolarHBondContact OE1-NZ 3.25Å; E770-K773 IonicContact OE2-NZ 3.17Å; S771-K773 VanDerWaalsContact C-N 3.31Å; K773-L775 VanDerWaalsContact C-N 3.32Å; K773-L775 PolarHBondContact O-N 3.25Å; K773-A776 CarbonylContact O-C 3.49Å; K773-A776 WeakPolarHBondContact O-CA 3.33Å; K773-A776 WeakPolarHBondContact O-CB 3.26Å; K773-A776 PolarHBondContact O-N 3.45Å; K773-A776 VanDerWaalsContact O-N 3.08Å; K773-D777 WeakPolarHBondContact O-CB 3.36Å; K773-D777 PolarHBondContact O-N 3.5Å; K773-E870 IonicContact NZ-OE2 2.65Å; K773-E870 PolarHBondContact NZ-OE2 3.15Å; K773-I871 HydrophobicContact CG-CG1 4.27Å
774	D	96.3	Very high	93.1	Very high	103 Å²	103	55.7 Å²	55.7	55%	0.551	29%	0.29	S	S	*	.	H	α-helix	trans	-59.6	-42.1	175.3	-72.5	-27.4	0	0	0	111.8	E770 S771 A776 D777 Y778	E770-D774 PolarHBondContact O-N 3.19Å; S771-D774 PolarHBondContact O-N 3.36Å; D774-A776 VanDerWaalsContact C-N 3.32Å; D774-A776 PolarHBondContact O-N 2.74Å; D774-D777 PolarHBondContact O-N 3.11Å; D774-Y778 WeakPolarHBondContact O-CB 3.42Å; D774-Y778 PolarHBondContact O-N 2.92Å
775	L	96.4	Very high	92.7	Very high	27 Å²	27	54.6 Å²	54.6	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-38.6	174.6	-69.8	172.4	0	0	0	112	E727 I730 S771 I772 K773 A779 F791	E727-L775 HydrophobicContact CB-CD1 4.18Å; E727-L775 HydrophobicContact CG-CD1 4.19Å; E727-L775 HydrophobicContact CG-CD2 4.23Å; I730-L775 HydrophobicContact CD1-CD1 3.8Å; S771-L775 WeakPolarHBondContact O-CG 3.42Å; S771-L775 PolarHBondContact O-N 3.39Å; S771-L775 VanDerWaalsContact O-N 3.11Å; I772-L775 PolarHBondContact O-N 2.79Å; K773-L775 VanDerWaalsContact C-N 3.32Å; K773-L775 PolarHBondContact O-N 3.25Å; L775-A779 WeakPolarHBondContact O-CB 3.29Å; L775-A779 PolarHBondContact O-N 3.05Å; L775-F791 HydrophobicContact CB-CB 4.11Å; L775-F791 HydrophobicContact CB-CD2 4.24Å; L775-F791 HydrophobicContact CB-CG 4.4Å; L775-F791 WeakPolarHBondContact O-CB 3.23Å
776	A	95.4	Very high	92.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-68.3	-43.8	176	0	0	0	0	0	112.3	I772 K773 D774 A779 S780 F791 I871 L874	I772-A776 PolarHBondContact O-N 3.23Å; K773-A776 CarbonylContact O-C 3.49Å; K773-A776 WeakPolarHBondContact O-CA 3.33Å; K773-A776 WeakPolarHBondContact O-CB 3.26Å; K773-A776 PolarHBondContact O-N 3.45Å; K773-A776 VanDerWaalsContact O-N 3.08Å; D774-A776 VanDerWaalsContact C-N 3.32Å; D774-A776 PolarHBondContact O-N 2.74Å; A776-A779 WeakPolarHBondContact O-CB 3.39Å; A776-A779 PolarHBondContact O-N 3.48Å; A776-A779 VanDerWaalsContact O-N 3.16Å; A776-S780 PolarHBondContact O-N 3.04Å; A776-F791 HydrophobicContact CB-CD1 3.53Å; A776-F791 HydrophobicContact CB-CE1 3.47Å; A776-F791 VanDerWaalsContact CB-CE1 3.47Å; A776-F791 HydrophobicContact CB-CG 4.18Å; A776-F791 HydrophobicContact CB-CZ 4.11Å; A776-I871 HydrophobicContact CB-CD1 3.77Å; A776-I871 HydrophobicContact CB-CG1 4.03Å; A776-I871 HydrophobicContact CB-CG2 3.83Å; A776-L874 HydrophobicContact CB-CD1 3.93Å; A776-L874 WeakPolarHBondContact O-CD1 3.34Å
777	D	95	Very high	91.5	Very high	77 Å²	77	59.2 Å²	59.2	41%	0.412	30%	0.297	S	S	.	.	H	α-helix	trans	-64.9	-41	177.5	-79.1	-9.1	0	0	0	111.5	K773 D774 A779 S780 K781	K773-D777 WeakPolarHBondContact O-CB 3.36Å; K773-D777 PolarHBondContact O-N 3.5Å; D774-D777 PolarHBondContact O-N 3.11Å; D777-A779 VanDerWaalsContact C-N 3.33Å; D777-S780 PolarHBondContact O-N 3.18Å; D777-K781 WeakPolarHBondContact O-CG 3.12Å; D777-K781 PolarHBondContact O-N 2.9Å; D777-K781 VanDerWaalsContact O-N 3.12Å
778	Y	94.6	Very high	91.1	Very high	139 Å²	139	57.4 Å²	57.4	55%	0.545	29%	0.287	S	S	.	.	H	α-helix	trans	-60.1	-44.6	171.7	179.5	-94	0	0	0	111.1	D774 S780 K781 N782 P789	D774-Y778 WeakPolarHBondContact O-CB 3.42Å; D774-Y778 PolarHBondContact O-N 2.92Å; Y778-S780 VanDerWaalsContact C-N 3.35Å; Y778-S780 PolarHBondContact O-N 2.79Å; Y778-K781 PolarHBondContact O-N 3.47Å; Y778-N782 HydrophobicContact CE1-CB 4.41Å; Y778-N782 WeakPolarHBondContact CE2-ND2 3.4Å; Y778-N782 WeakPolarHBondContact O-CB 3.09Å; Y778-N782 PolarHBondContact O-N 2.83Å; Y778-N782 VanDerWaalsContact O-N 3.16Å; Y778-N782 PolarHBondContact O-ND2 3.33Å; Y778-P789 HydrophobicContact CD1-CB 4.11Å; Y778-P789 HydrophobicContact CE1-CB 4.14Å; Y778-P789 HydrophobicContact CE1-CG 4.36Å
779	A	93.3	Very high	90.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-41.2	176.9	0	0	0	0	0	112.4	L775 A776 D777 K781 N782 L783 P789 F791 L792 L874	L775-A779 WeakPolarHBondContact O-CB 3.29Å; L775-A779 PolarHBondContact O-N 3.05Å; A776-A779 WeakPolarHBondContact O-CB 3.39Å; A776-A779 PolarHBondContact O-N 3.48Å; A776-A779 VanDerWaalsContact O-N 3.16Å; D777-A779 VanDerWaalsContact C-N 3.33Å; A779-K781 VanDerWaalsContact C-N 3.28Å; A779-K781 PolarHBondContact O-N 3.16Å; A779-N782 CarbonylContact O-C 3.52Å; A779-N782 PolarHBondContact O-N 3.45Å; A779-L783 WeakPolarHBondContact O-CD2 3.34Å; A779-L783 WeakPolarHBondContact O-CG 3.5Å; A779-L783 PolarHBondContact O-N 3.11Å; A779-P789 HydrophobicContact CB-CB 3.73Å; A779-P789 HydrophobicContact CB-CG 4.32Å; A779-F791 HydrophobicContact CB-CB 4.02Å; A779-L792 HydrophobicContact CB-CB 4.25Å; A779-L874 HydrophobicContact CB-CD1 4.25Å; A779-L874 HydrophobicContact CB-CD2 4.39Å
780	S	90.1	Very high	90.8	Very high	40 Å²	40	57.4 Å²	57.4	28%	0.28	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-32.8	178.3	-171.2	0	0	0	0	112.7	A776 D777 Y778	A776-S780 PolarHBondContact O-N 3.04Å; D777-S780 PolarHBondContact O-N 3.18Å; Y778-S780 VanDerWaalsContact C-N 3.35Å; Y778-S780 PolarHBondContact O-N 2.79Å
781	K	90.9	Very high	90.8	Very high	168 Å²	168	53.3 Å²	53.3	73%	0.73	27%	0.271	S	S	*	.	H	α-helix	trans	-80.1	-20.9	177.5	-68.9	168.3	-174.5	165.4	0	113.1	D777 Y778 A779	D777-K781 WeakPolarHBondContact O-CG 3.12Å; D777-K781 PolarHBondContact O-N 2.9Å; D777-K781 VanDerWaalsContact O-N 3.12Å; Y778-K781 PolarHBondContact O-N 3.47Å; A779-K781 VanDerWaalsContact C-N 3.28Å; A779-K781 PolarHBondContact O-N 3.16Å
782	N	89.9	Confident	90.6	Very high	54 Å²	54	52.8 Å²	52.8	29%	0.289	27%	0.267	S	S	.	.			trans	-124.8	33.3	-170.5	-63.7	-79.8	0	0	0	112.9	Y778 A779 E784 A785 P789	Y778-N782 HydrophobicContact CE1-CB 4.41Å; Y778-N782 WeakPolarHBondContact CE2-ND2 3.4Å; Y778-N782 WeakPolarHBondContact O-CB 3.09Å; Y778-N782 PolarHBondContact O-N 2.83Å; Y778-N782 VanDerWaalsContact O-N 3.16Å; Y778-N782 PolarHBondContact O-ND2 3.33Å; A779-N782 CarbonylContact O-C 3.52Å; A779-N782 PolarHBondContact O-N 3.45Å; N782-E784 PolarHBondContact O-N 3.42Å; N782-A785 HydrophobicContact CB-CB 4.26Å; N782-A785 WeakPolarHBondContact O-CB 3.42Å; N782-A785 PolarHBondContact O-N 2.83Å; N782-A785 VanDerWaalsContact O-N 3.14Å; N782-P789 HydrophobicContact CB-CG 3.81Å; N782-P789 WeakPolarHBondContact O-CD 3.29Å; N782-P789 WeakPolarHBondContact O-CG 3.44Å
783	L	83.2	Confident	90.3	Very high	23 Å²	23	57.7 Å²	57.7	12%	0.12	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.3	-177.7	-71	172.5	0	0	0	113.7	A779 L792 L874 H877 F879	A779-L783 WeakPolarHBondContact O-CD2 3.34Å; A779-L783 WeakPolarHBondContact O-CG 3.5Å; A779-L783 PolarHBondContact O-N 3.11Å; L783-L792 HydrophobicContact CD2-CD1 3.94Å; L783-L792 HydrophobicContact CD2-CD2 3.81Å; L783-L792 HydrophobicContact CD2-CG 4.46Å; L783-L874 HydrophobicContact CD2-CD2 3.77Å; L783-H877 HydrophobicContact CD1-CB 4.48Å; L783-F879 HydrophobicContact CB-CD2 4.18Å; L783-F879 HydrophobicContact CB-CE2 4.04Å
784	E	79.7	Confident	90.2	Very high	89 Å²	89	55.7 Å²	55.7	42%	0.416	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	12.3	-178.6	-56.3	-167.2	151.2	0	0	113.4	N782 F879 R1023 M1045	N782-E784 PolarHBondContact O-N 3.42Å; E784-F879 HydrophobicContact CG-CE2 4.21Å; E784-F879 HydrophobicContact CG-CZ 4.25Å; E784-R1023 WeakPolarHBondContact OE1-CD 3.28Å; E784-R1023 IonicContact OE1-CZ 2.62Å; E784-R1023 IonicContact OE1-NE 3.2Å; E784-R1023 IonicContact OE1-NH1 2.83Å; E784-R1023 PolarHBondContact OE1-NH1 3.3Å; E784-R1023 IonicContact OE2-NH1 3.69Å; E784-R1023 PolarHBondContact OE2-NH1 3.48Å; E784-M1045 HydrophobicContact CB-CG 3.94Å; E784-M1045 HydrophobicContact CG-CE 4.29Å; E784-M1045 HydrophobicContact CG-CG 4.25Å
785	A	83.6	Confident	90.1	Very high	35 Å²	35	50.8 Å²	50.8	29%	0.289	25%	0.251	S	S	.	.			trans	-60.1	145.2	176.9	0	0	0	0	0	111.1	N782 N787	N782-A785 HydrophobicContact CB-CB 4.26Å; N782-A785 WeakPolarHBondContact O-CB 3.42Å; N782-A785 PolarHBondContact O-N 2.83Å; N782-A785 VanDerWaalsContact O-N 3.14Å; A785-N787 WeakPolarHBondContact CB-O 3.44Å; A785-N787 CarbonylContact O-C 3.17Å; A785-N787 PolarHBondContact O-N 3.39Å; A785-N787 VanDerWaalsContact O-N 3.12Å
786	M	79.8	Confident	89.8	Confident	114 Å²	114	50 Å²	50	56%	0.562	25%	0.246	S	C	*	.	S	Bend	trans	-48.9	-42.6	177.6	-179.1	-170.1	178	0	0	111.8
787	N	79.7	Confident	89.6	Confident	116 Å²	116	51 Å²	51	62%	0.62	25%	0.251	S	S	*	.	S	Bend	trans	-105.5	119.3	170.5	-67.6	-41.6	0	0	0	109	A785	A785-N787 WeakPolarHBondContact CB-O 3.44Å; A785-N787 CarbonylContact O-C 3.17Å; A785-N787 PolarHBondContact O-N 3.39Å; A785-N787 VanDerWaalsContact O-N 3.12Å
788	P	85.3	Confident	89.5	Confident	31 Å²	31	47.3 Å²	47.3	20%	0.201	23%	0.232	C	C	.	.			trans	-54.6	131.4	178.4	-29	36	0	0	0	111.6	L792 R793 L1031	P788-L792 HydrophobicContact CB-CD2 4.42Å; P788-R793 HydrophobicContact CB-CG 3.78Å; P788-R793 VanDerWaalsContact O-CD 3.31Å; P788-R793 WeakPolarHBondContact O-CD 3.44Å; P788-L1031 HydrophobicContact CB-CD2 4.15Å; P788-L1031 HydrophobicContact CG-CD2 4.24Å
789	P	93.2	Very high	89.4	Confident	8 Å²	8	40.7 Å²	40.7	5%	0.052	21%	0.206	C	C	.	.			trans	-54.2	150.1	178.4	-28.8	36.3	0	0	0	112.8	Y778 A779 N782 F791 L792 R793	Y778-P789 HydrophobicContact CD1-CB 4.11Å; Y778-P789 HydrophobicContact CE1-CB 4.14Å; Y778-P789 HydrophobicContact CE1-CG 4.36Å; A779-P789 HydrophobicContact CB-CB 3.73Å; A779-P789 HydrophobicContact CB-CG 4.32Å; N782-P789 HydrophobicContact CB-CG 3.81Å; N782-P789 WeakPolarHBondContact O-CD 3.29Å; N782-P789 WeakPolarHBondContact O-CG 3.44Å; P789-F791 VanDerWaalsContact C-N 3.33Å; P789-F791 PolarHBondContact O-N 3.25Å; P789-L792 HydrophobicContact CB-CB 4.4Å; P789-L792 WeakPolarHBondContact O-CB 3.22Å; P789-L792 PolarHBondContact O-N 2.99Å; P789-R793 PolarHBondContact O-N 3.39Å; P789-R793 VanDerWaalsContact O-N 3.07Å
790	L	93.9	Very high	89.2	Confident	36 Å²	36	43.5 Å²	43.5	19%	0.188	22%	0.221	C	C	.	.	H	α-helix	trans	-52.4	-49.4	-174.7	175.2	62.4	0	0	0	112.5	E727 I730 K731 V734 L792 R793 F794	E727-L790 HydrophobicContact CG-CD2 4.05Å; I730-L790 HydrophobicContact CG2-CD1 4.3Å; I730-L790 HydrophobicContact CG2-CD2 4.1Å; I730-L790 HydrophobicContact CG2-CG 3.89Å; K731-L790 HydrophobicContact CB-CD1 4.34Å; K731-L790 HydrophobicContact CB-CD2 4.14Å; V734-L790 HydrophobicContact CB-CD1 4.15Å; V734-L790 HydrophobicContact CG1-CD1 4.45Å; V734-L790 HydrophobicContact CG2-CD1 3.92Å; L790-L792 VanDerWaalsContact C-N 3.32Å; L790-L792 PolarHBondContact O-N 2.94Å; L790-R793 WeakPolarHBondContact O-CB 3.41Å; L790-R793 PolarHBondContact O-N 2.77Å; L790-F794 PolarHBondContact O-N 2.87Å
791	F	95.6	Very high	89.3	Confident	1 Å²	1	41.6 Å²	41.6	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-66.5	-33.8	-178.2	-162.2	-103.1	0	0	0	112.9	I730 I772 L775 A776 A779 P789 F794 L795 L867 I871 L874	I730-F791 HydrophobicContact CD1-CD2 4.09Å; I730-F791 HydrophobicContact CD1-CE2 4.18Å; I772-F791 HydrophobicContact CG2-CD2 4.47Å; I772-F791 HydrophobicContact CG2-CE2 3.61Å; I772-F791 HydrophobicContact CG2-CZ 4.11Å; L775-F791 HydrophobicContact CB-CB 4.11Å; L775-F791 HydrophobicContact CB-CD2 4.24Å; L775-F791 HydrophobicContact CB-CG 4.4Å; L775-F791 WeakPolarHBondContact O-CB 3.23Å; A776-F791 HydrophobicContact CB-CD1 3.53Å; A776-F791 HydrophobicContact CB-CE1 3.47Å; A776-F791 VanDerWaalsContact CB-CE1 3.47Å; A776-F791 HydrophobicContact CB-CG 4.18Å; A776-F791 HydrophobicContact CB-CZ 4.11Å; A779-F791 HydrophobicContact CB-CB 4.02Å; P789-F791 VanDerWaalsContact C-N 3.33Å; P789-F791 PolarHBondContact O-N 3.25Å; F791-F794 HydrophobicContact CD2-CD1 4.04Å; F791-F794 AromaticContact CE2-CD1 3.81Å; F791-F794 HydrophobicContact CE2-CD1 3.81Å; F791-F794 HydrophobicContact CE2-CE1 4.1Å; F791-F794 HydrophobicContact CZ-CD1 4.35Å; F791-F794 WeakPolarHBondContact O-CB 3.28Å; F791-F794 PolarHBondContact O-N 3.4Å; F791-L795 HydrophobicContact CD1-CD1 3.9Å; F791-L795 HydrophobicContact CD1-CG 4.02Å; F791-L795 HydrophobicContact CE1-CD1 3.64Å; F791-L795 HydrophobicContact CE1-CD2 4Å; F791-L795 HydrophobicContact CE1-CG 3.75Å; F791-L795 HydrophobicContact CZ-CD2 4.14Å; F791-L795 HydrophobicContact CZ-CG 4.3Å; F791-L795 WeakPolarHBondContact O-CG 3.36Å; F791-L795 PolarHBondContact O-N 2.95Å; F791-L867 HydrophobicContact CZ-CD2 4.44Å; F791-I871 HydrophobicContact CE1-CD1 4.04Å; F791-I871 HydrophobicContact CE1-CG2 4.42Å; F791-I871 HydrophobicContact CZ-CD1 3.72Å; F791-L874 HydrophobicContact CD1-CD1 3.64Å; F791-L874 HydrophobicContact CE1-CD1 3.92Å
792	L	91.9	Very high	89.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-42.9	175.2	-175.6	60.9	0	0	0	111.1	A779 L783 P788 P789 L790 L795 N796 L880 L1031	A779-L792 HydrophobicContact CB-CB 4.25Å; L783-L792 HydrophobicContact CD2-CD1 3.94Å; L783-L792 HydrophobicContact CD2-CD2 3.81Å; L783-L792 HydrophobicContact CD2-CG 4.46Å; P788-L792 HydrophobicContact CB-CD2 4.42Å; P789-L792 HydrophobicContact CB-CB 4.4Å; P789-L792 WeakPolarHBondContact O-CB 3.22Å; P789-L792 PolarHBondContact O-N 2.99Å; L790-L792 VanDerWaalsContact C-N 3.32Å; L790-L792 PolarHBondContact O-N 2.94Å; L792-L795 PolarHBondContact O-N 3.26Å; L792-N796 WeakPolarHBondContact O-CB 3.49Å; L792-N796 PolarHBondContact O-N 3.48Å; L792-L880 HydrophobicContact CD1-CD1 3.74Å; L792-L880 HydrophobicContact CD1-CD2 4.02Å; L792-L880 HydrophobicContact CD1-CG 4.19Å; L792-L1031 HydrophobicContact CD2-CD2 3.78Å; L792-L1031 HydrophobicContact CG-CD2 3.97Å
793	R	91.7	Very high	89.5	Confident	107 Å²	107	33.7 Å²	33.7	40%	0.404	17%	0.173	S	C	.	.	H	α-helix	trans	-62.7	-43.3	173.9	-65.4	174.2	62.3	-157.2	-2.4	111.5	V734 P788 P789 L790 N796 L797	V734-R793 HydrophobicContact CG1-CB 4Å; V734-R793 HydrophobicContact CG2-CB 4.25Å; P788-R793 HydrophobicContact CB-CG 3.78Å; P788-R793 VanDerWaalsContact O-CD 3.31Å; P788-R793 WeakPolarHBondContact O-CD 3.44Å; P789-R793 PolarHBondContact O-N 3.39Å; P789-R793 VanDerWaalsContact O-N 3.07Å; L790-R793 WeakPolarHBondContact O-CB 3.41Å; L790-R793 PolarHBondContact O-N 2.77Å; R793-N796 WeakPolarHBondContact O-CB 3.36Å; R793-N796 PolarHBondContact O-N 3.15Å; R793-L797 WeakPolarHBondContact O-CG 3.46Å; R793-L797 PolarHBondContact O-N 2.59Å
794	F	95.1	Very high	89.9	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.009	18%	0.179	C	C	.	.	H	α-helix	trans	-57.5	-52.3	175.8	168	-105.3	0	0	0	112	I730 F733 V734 L759 L790 F791 N796 L797 L798 L867	I730-F794 HydrophobicContact CG2-CB 3.71Å; I730-F794 HydrophobicContact CG2-CD1 4.43Å; I730-F794 HydrophobicContact CG2-CD2 4.11Å; I730-F794 HydrophobicContact CG2-CG 3.82Å; F733-F794 HydrophobicContact CB-CD2 4.13Å; F733-F794 HydrophobicContact CB-CE2 4.29Å; F733-F794 AromaticContact CD1-CD2 3.38Å; F733-F794 HydrophobicContact CD1-CD2 3.38Å; F733-F794 AromaticContact CD1-CE2 3.63Å; F733-F794 HydrophobicContact CD1-CE2 3.63Å; F733-F794 HydrophobicContact CD2-CD2 4.38Å; F733-F794 AromaticContact CD2-CE2 3.85Å; F733-F794 HydrophobicContact CD2-CE2 3.85Å; F733-F794 AromaticContact CE1-CD2 3.79Å; F733-F794 HydrophobicContact CE1-CD2 3.79Å; F733-F794 AromaticContact CE1-CE2 3.81Å; F733-F794 HydrophobicContact CE1-CE2 3.81Å; F733-F794 HydrophobicContact CE2-CE2 4.02Å; F733-F794 AromaticContact CG-CD2 3.72Å; F733-F794 HydrophobicContact CG-CD2 3.72Å; F733-F794 AromaticContact CG-CE2 3.66Å; F733-F794 HydrophobicContact CG-CE2 3.66Å; F733-F794 HydrophobicContact CZ-CD2 4.45Å; F733-F794 HydrophobicContact CZ-CE2 4Å; V734-F794 HydrophobicContact CG2-CB 3.8Å; L759-F794 HydrophobicContact CD1-CE2 4.32Å; L759-F794 HydrophobicContact CD1-CZ 4.02Å; L790-F794 PolarHBondContact O-N 2.87Å; F791-F794 HydrophobicContact CD2-CD1 4.04Å; F791-F794 AromaticContact CE2-CD1 3.81Å; F791-F794 HydrophobicContact CE2-CD1 3.81Å; F791-F794 HydrophobicContact CE2-CE1 4.1Å; F791-F794 HydrophobicContact CZ-CD1 4.35Å; F791-F794 WeakPolarHBondContact O-CB 3.28Å; F791-F794 PolarHBondContact O-N 3.4Å; F794-N796 VanDerWaalsContact C-N 3.31Å; F794-N796 PolarHBondContact O-N 3.27Å; F794-L797 PolarHBondContact O-N 3.12Å; F794-L798 HydrophobicContact CE1-CD2 4.27Å; F794-L798 HydrophobicContact CZ-CD2 4.17Å; F794-L798 WeakPolarHBondContact O-CB 3.48Å; F794-L798 PolarHBondContact O-N 3.25Å; F794-L867 HydrophobicContact CE1-CD1 4Å
795	L	93.9	Very high	90.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-40.9	177.9	-71.4	-177.4	0	0	0	112.2	F791 L792 L797 L798 M799 L867 L874 F875 L880	F791-L795 HydrophobicContact CD1-CD1 3.9Å; F791-L795 HydrophobicContact CD1-CG 4.02Å; F791-L795 HydrophobicContact CE1-CD1 3.64Å; F791-L795 HydrophobicContact CE1-CD2 4Å; F791-L795 HydrophobicContact CE1-CG 3.75Å; F791-L795 HydrophobicContact CZ-CD2 4.14Å; F791-L795 HydrophobicContact CZ-CG 4.3Å; F791-L795 WeakPolarHBondContact O-CG 3.36Å; F791-L795 PolarHBondContact O-N 2.95Å; L792-L795 PolarHBondContact O-N 3.26Å; L795-L797 PolarHBondContact O-N 3.14Å; L795-L798 PolarHBondContact O-N 3.49Å; L795-M799 WeakPolarHBondContact O-CG 3.41Å; L795-M799 PolarHBondContact O-N 3.22Å; L795-L867 HydrophobicContact CD2-CD1 4.16Å; L795-L874 HydrophobicContact CD1-CB 4.3Å; L795-L874 HydrophobicContact CD1-CD1 3.93Å; L795-F875 HydrophobicContact CD1-CE1 4.3Å; L795-F875 HydrophobicContact CD1-CE2 4.47Å; L795-F875 HydrophobicContact CD1-CZ 4.08Å; L795-F875 HydrophobicContact CD2-CE1 4.04Å; L795-F875 HydrophobicContact CD2-CZ 3.63Å; L795-L880 HydrophobicContact CD1-CD1 4.25Å
796	N	89.8	Confident	90.9	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.053	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-46	177	-176.8	64.9	0	0	0	112.2	L792 R793 F794 N800 R883 L1031	L792-N796 WeakPolarHBondContact O-CB 3.49Å; L792-N796 PolarHBondContact O-N 3.48Å; R793-N796 WeakPolarHBondContact O-CB 3.36Å; R793-N796 PolarHBondContact O-N 3.15Å; F794-N796 VanDerWaalsContact C-N 3.31Å; F794-N796 PolarHBondContact O-N 3.27Å; N796-N800 PolarHBondContact O-N 3.48Å; N796-N800 VanDerWaalsContact O-N 3.09Å; N796-R883 PolarHBondContact O-NH2 3.2Å; N796-R883 PolarHBondContact OD1-NH1 3.38Å; N796-R883 PolarHBondContact OD1-NH2 3.18Å; N796-R883 VanDerWaalsContact OD1-NH2 3.07Å; N796-L1031 PolarHBondContact ND2-O 3.22Å
797	L	91.5	Very high	91.6	Very high	20 Å²	20	26 Å²	26	11%	0.105	13%	0.129	C	C	.	.	H	α-helix	trans	-70	-39.3	177.8	-68	175.7	0	0	0	112.2	F733 V734 E737 R793 F794 L795 M799 N800 D801	F733-L797 HydrophobicContact CE1-CB 4.13Å; V734-L797 HydrophobicContact CB-CD1 4.3Å; V734-L797 HydrophobicContact CG1-CD1 4.18Å; V734-L797 HydrophobicContact CG2-CD1 4.27Å; E737-L797 HydrophobicContact CB-CD1 4.37Å; E737-L797 HydrophobicContact CG-CD2 3.92Å; R793-L797 WeakPolarHBondContact O-CG 3.46Å; R793-L797 PolarHBondContact O-N 2.59Å; F794-L797 PolarHBondContact O-N 3.12Å; L795-L797 PolarHBondContact O-N 3.14Å; L797-M799 VanDerWaalsContact C-N 3.31Å; L797-M799 PolarHBondContact O-N 3.01Å; L797-N800 WeakPolarHBondContact O-CB 3.44Å; L797-N800 PolarHBondContact O-N 3.43Å; L797-D801 PolarHBondContact O-N 3.05Å
798	L	93.5	Very high	92.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.5	-41.2	176.2	-174.1	69.1	0	0	0	111.6	F733 Y756 F794 L795 D801 A802 T860 T863 L864 L867	F733-L798 HydrophobicContact CZ-CD1 3.99Å; Y756-L798 HydrophobicContact CE1-CD1 3.76Å; F794-L798 HydrophobicContact CE1-CD2 4.27Å; F794-L798 HydrophobicContact CZ-CD2 4.17Å; F794-L798 WeakPolarHBondContact O-CB 3.48Å; F794-L798 PolarHBondContact O-N 3.25Å; L795-L798 PolarHBondContact O-N 3.49Å; L798-D801 PolarHBondContact O-N 3.37Å; L798-A802 WeakPolarHBondContact O-CB 3.45Å; L798-A802 PolarHBondContact O-N 3.24Å; L798-T860 HydrophobicContact CD1-CG2 3.66Å; L798-T860 HydrophobicContact CG-CG2 4.13Å; L798-T860 WeakPolarHBondContact O-CG2 3.38Å; L798-T863 HydrophobicContact CD1-CG2 4.41Å; L798-T863 HydrophobicContact CD2-CG2 3.94Å; L798-L864 HydrophobicContact CD2-CD2 3.61Å; L798-L864 HydrophobicContact CD2-CG 3.96Å; L798-L864 HydrophobicContact CG-CD2 4.22Å; L798-L864 HydrophobicContact CG-CG 4.37Å; L798-L867 HydrophobicContact CD2-CD1 4.05Å
799	M	91.4	Very high	92.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-68.1	-39.5	174.2	-70.1	-174.6	-66	0	0	112.4	L795 L797 D801 A802 I803 L880 R883 I884	L795-M799 WeakPolarHBondContact O-CG 3.41Å; L795-M799 PolarHBondContact O-N 3.22Å; L797-M799 VanDerWaalsContact C-N 3.31Å; L797-M799 PolarHBondContact O-N 3.01Å; M799-D801 VanDerWaalsContact C-N 3.33Å; M799-D801 PolarHBondContact O-N 3.39Å; M799-A802 PolarHBondContact O-N 3.11Å; M799-I803 VanDerWaalsContact O-CG1 3.26Å; M799-I803 WeakPolarHBondContact O-CG1 3.21Å; M799-I803 PolarHBondContact O-N 3.45Å; M799-L880 HydrophobicContact CE-CD2 3.94Å; M799-R883 HydrophobicContact SD-CG 4.49Å; M799-I884 HydrophobicContact SD-CB 4.03Å
800	N	90.1	Very high	92.5	Very high	59 Å²	59	21.1 Å²	21.1	32%	0.316	10%	0.1	S	C	.	.	H	α-helix	trans	-59.1	-45.5	174	-83.2	-19.6	0	0	0	112	N796 L797 I803 F804 R883	N796-N800 PolarHBondContact O-N 3.48Å; N796-N800 VanDerWaalsContact O-N 3.09Å; L797-N800 WeakPolarHBondContact O-CB 3.44Å; L797-N800 PolarHBondContact O-N 3.43Å; N800-I803 PolarHBondContact O-N 3.31Å; N800-F804 WeakPolarHBondContact O-CB 3.4Å; N800-F804 PolarHBondContact O-N 3.43Å; N800-R883 PolarHBondContact ND2-NH2 3.22Å; N800-R883 PolarHBondContact OD1-NH2 2.68Å
801	D	92	Very high	92.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.2	-43.9	177	-76.8	3.7	0	0	0	111.1	K748 F749 R752 L797 L798 M799 I803 F804 L805	K748-D801 IonicContact NZ-OD1 3.3Å; K748-D801 PolarHBondContact NZ-OD1 3.2Å; K748-D801 VanDerWaalsContact NZ-OD1 3.14Å; F749-D801 HydrophobicContact CE1-CB 3.94Å; F749-D801 VanDerWaalsContact CE1-CG 3.48Å; F749-D801 WeakPolarHBondContact CE1-OD1 3.29Å; R752-D801 WeakPolarHBondContact CD-OD2 3.4Å; R752-D801 IonicContact CZ-OD2 3.54Å; R752-D801 IonicContact NE-OD2 2.67Å; R752-D801 IonicContact NH1-OD1 2.68Å; R752-D801 PolarHBondContact NH1-OD1 3.42Å; R752-D801 IonicContact NH1-OD2 3.06Å; R752-D801 PolarHBondContact NH1-OD2 3.03Å; L797-D801 PolarHBondContact O-N 3.05Å; L798-D801 PolarHBondContact O-N 3.37Å; M799-D801 VanDerWaalsContact C-N 3.33Å; M799-D801 PolarHBondContact O-N 3.39Å; D801-I803 VanDerWaalsContact C-N 3.33Å; D801-I803 PolarHBondContact O-N 2.75Å; D801-F804 PolarHBondContact O-N 3.11Å; D801-L805 HydrophobicContact CB-CD1 4.23Å; D801-L805 WeakPolarHBondContact O-CB 3.42Å; D801-L805 WeakPolarHBondContact O-CD1 3.48Å; D801-L805 WeakPolarHBondContact O-CG 3.35Å; D801-L805 PolarHBondContact O-N 3.44Å
802	A	92.7	Very high	92.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.9	-44.2	176.4	0	0	0	0	0	112.1	L798 M799 L806 T860 I861 L864 M887 F891	L798-A802 WeakPolarHBondContact O-CB 3.45Å; L798-A802 PolarHBondContact O-N 3.24Å; M799-A802 PolarHBondContact O-N 3.11Å; A802-L806 WeakPolarHBondContact O-CB 3.47Å; A802-L806 PolarHBondContact O-N 3.37Å; A802-T860 HydrophobicContact CB-CG2 3.64Å; A802-I861 HydrophobicContact CB-CD1 4.12Å; A802-L864 HydrophobicContact CB-CD1 4.46Å; A802-M887 HydrophobicContact CB-SD 3.65Å; A802-F891 WeakPolarHBondContact O-CZ 3.25Å
803	I	92.1	Very high	92.5	Very high	55 Å²	55	24.5 Å²	24.5	28%	0.282	11%	0.114	S	C	.	.	H	α-helix	trans	-60.1	-56.2	177.9	-68.9	164.2	0	0	0	109.9	M799 N800 D801 D807 M887	M799-I803 VanDerWaalsContact O-CG1 3.26Å; M799-I803 WeakPolarHBondContact O-CG1 3.21Å; M799-I803 PolarHBondContact O-N 3.45Å; N800-I803 PolarHBondContact O-N 3.31Å; D801-I803 VanDerWaalsContact C-N 3.33Å; D801-I803 PolarHBondContact O-N 2.75Å; I803-D807 WeakPolarHBondContact O-CB 3.47Å; I803-D807 PolarHBondContact O-N 2.95Å; I803-M887 HydrophobicContact CD1-CB 4.44Å; I803-M887 HydrophobicContact CD1-CG 4.44Å; I803-M887 HydrophobicContact CG1-CB 4.14Å; I803-M887 HydrophobicContact CG1-CG 3.68Å; I803-M887 HydrophobicContact CG1-SD 3.99Å
804	F	92.5	Very high	92.5	Very high	58 Å²	58	21.3 Å²	21.3	25%	0.254	11%	0.108	S	C	.	.	H	α-helix	trans	-62.6	-50.9	-176.4	177.2	-92.7	0	0	0	112.6	F745 F749 N800 D801 L806 D807 E808 H853	F745-F804 HydrophobicContact CD1-CZ 4.44Å; F745-F804 HydrophobicContact CE1-CD1 4.14Å; F745-F804 HydrophobicContact CE1-CD2 4.1Å; F745-F804 AromaticContact CE1-CE1 3.77Å; F745-F804 HydrophobicContact CE1-CE1 3.77Å; F745-F804 AromaticContact CE1-CE2 3.72Å; F745-F804 HydrophobicContact CE1-CE2 3.72Å; F745-F804 HydrophobicContact CE1-CG 4.31Å; F745-F804 AromaticContact CE1-CZ 3.55Å; F745-F804 HydrophobicContact CE1-CZ 3.55Å; F745-F804 HydrophobicContact CZ-CD1 4.45Å; F745-F804 HydrophobicContact CZ-CD2 4.12Å; F745-F804 HydrophobicContact CZ-CE2 4.17Å; F745-F804 HydrophobicContact CZ-CG 4.27Å; F745-F804 HydrophobicContact CZ-CZ 4.38Å; F749-F804 HydrophobicContact CE1-CD1 4.47Å; F749-F804 AromaticContact CE2-CD1 3.69Å; F749-F804 HydrophobicContact CE2-CD1 3.69Å; F749-F804 AromaticContact CE2-CE1 3.65Å; F749-F804 HydrophobicContact CE2-CE1 3.65Å; F749-F804 AromaticContact CZ-CD1 3.44Å; F749-F804 HydrophobicContact CZ-CD1 3.44Å; F749-F804 VanDerWaalsContact CZ-CD1 3.44Å; F749-F804 AromaticContact CZ-CE1 3.92Å; F749-F804 HydrophobicContact CZ-CE1 3.92Å; F749-F804 HydrophobicContact CZ-CG 4.3Å; N800-F804 WeakPolarHBondContact O-CB 3.4Å; N800-F804 PolarHBondContact O-N 3.43Å; D801-F804 PolarHBondContact O-N 3.11Å; F804-L806 VanDerWaalsContact C-N 3.34Å; F804-L806 PolarHBondContact O-N 3.41Å; F804-D807 PolarHBondContact O-N 3.36Å; F804-E808 HydrophobicContact CD2-CG 4.48Å; F804-E808 HydrophobicContact CE1-CG 3.96Å; F804-E808 HydrophobicContact CE2-CG 3.93Å; F804-E808 HydrophobicContact CZ-CG 3.63Å; F804-E808 PolarHBondContact O-N 3.22Å; F804-H853 AromaticContact CE1-NE2 3.98Å
805	L	92.7	Very high	92.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.6	-41.9	-171.7	-73.2	166.6	0	0	0	112	F749 D801 A809 M856 S857	F749-L805 HydrophobicContact CD1-CD1 3.91Å; F749-L805 HydrophobicContact CD1-CD2 3.79Å; F749-L805 HydrophobicContact CD1-CG 4.05Å; F749-L805 HydrophobicContact CD2-CD2 4.24Å; F749-L805 HydrophobicContact CE1-CD1 3.84Å; F749-L805 HydrophobicContact CE1-CD2 3.8Å; F749-L805 HydrophobicContact CE1-CG 3.7Å; F749-L805 HydrophobicContact CE2-CD2 4.28Å; F749-L805 HydrophobicContact CG-CD2 4.02Å; F749-L805 HydrophobicContact CZ-CD2 4.06Å; F749-L805 HydrophobicContact CZ-CG 4.15Å; D801-L805 HydrophobicContact CB-CD1 4.23Å; D801-L805 WeakPolarHBondContact O-CB 3.42Å; D801-L805 WeakPolarHBondContact O-CD1 3.48Å; D801-L805 WeakPolarHBondContact O-CG 3.35Å; D801-L805 PolarHBondContact O-N 3.44Å; L805-A809 WeakPolarHBondContact O-CB 3.22Å; L805-A809 PolarHBondContact O-N 2.67Å; L805-M856 HydrophobicContact CD1-CB 3.64Å; L805-M856 HydrophobicContact CD2-CB 3.88Å; L805-M856 HydrophobicContact CG-CB 4.31Å; L805-S857 VanDerWaalsContact C-OG 3.28Å; L805-S857 PolarHBondContact O-OG 3.25Å
806	L	91.3	Very high	92.4	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.016	13%	0.125	C	C	.	.	H	α-helix	trans	-78.7	-30.6	-176.5	-174.4	55.6	0	0	0	111.7	A802 F804 A809 I810 S857 F891 L918	A802-L806 WeakPolarHBondContact O-CB 3.47Å; A802-L806 PolarHBondContact O-N 3.37Å; F804-L806 VanDerWaalsContact C-N 3.34Å; F804-L806 PolarHBondContact O-N 3.41Å; L806-A809 HydrophobicContact CD1-CB 4.47Å; L806-I810 HydrophobicContact CG-CD1 4.33Å; L806-I810 WeakPolarHBondContact O-CB 3.15Å; L806-I810 WeakPolarHBondContact O-CD1 3.3Å; L806-I810 VanDerWaalsContact O-CG1 3.26Å; L806-I810 WeakPolarHBondContact O-CG1 3.35Å; L806-I810 PolarHBondContact O-N 2.97Å; L806-S857 WeakPolarHBondContact CA-OG 3.22Å; L806-S857 PolarHBondContact N-OG 3.42Å; L806-F891 HydrophobicContact CB-CD1 4.17Å; L806-F891 HydrophobicContact CB-CE1 3.59Å; L806-F891 HydrophobicContact CB-CE2 4.12Å; L806-F891 HydrophobicContact CB-CZ 3.55Å; L806-F891 HydrophobicContact CD2-CB 3.82Å; L806-F891 HydrophobicContact CD2-CD1 3.38Å; L806-F891 HydrophobicContact CD2-CD2 3.55Å; L806-F891 HydrophobicContact CD2-CE1 3.69Å; L806-F891 HydrophobicContact CD2-CE2 3.82Å; L806-F891 HydrophobicContact CD2-CG 3.31Å; L806-F891 HydrophobicContact CD2-CZ 3.88Å; L806-F891 HydrophobicContact CG-CD1 3.58Å; L806-F891 HydrophobicContact CG-CD2 4.44Å; L806-F891 HydrophobicContact CG-CE1 3.52Å; L806-F891 HydrophobicContact CG-CE2 4.36Å; L806-F891 HydrophobicContact CG-CG 4.07Å; L806-F891 HydrophobicContact CG-CZ 3.92Å; L806-L918 HydrophobicContact CD1-CD2 3.68Å; L806-L918 HydrophobicContact CD2-CD1 4.49Å; L806-L918 HydrophobicContact CD2-CD2 3.97Å
807	D	93.2	Very high	92.5	Very high	39 Å²	39	27.4 Å²	27.4	21%	0.209	13%	0.134	C	C	.	.	H	α-helix	trans	-62.7	-48.9	169.6	-94.1	-27	0	0	0	112.3	I803 F804 A809 I810 Q811 Y890	I803-D807 WeakPolarHBondContact O-CB 3.47Å; I803-D807 PolarHBondContact O-N 2.95Å; F804-D807 PolarHBondContact O-N 3.36Å; D807-A809 VanDerWaalsContact C-N 3.35Å; D807-A809 PolarHBondContact O-N 3.09Å; D807-I810 PolarHBondContact O-N 3.39Å; D807-Q811 VanDerWaalsContact O-CG 3.32Å; D807-Q811 WeakPolarHBondContact O-CG 3.05Å; D807-Q811 PolarHBondContact O-N 2.88Å; D807-Y890 WeakPolarHBondContact OD1-CE1 3.37Å; D807-Y890 PolarHBondContact OD1-OH 2.96Å
808	E	93.6	Very high	92.5	Very high	36 Å²	36	30.7 Å²	30.7	17%	0.168	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-41.4	177	-75	-54.3	123.3	0	0	111.6	F804 I810 Q811 Y812 H853	F804-E808 HydrophobicContact CD2-CG 4.48Å; F804-E808 HydrophobicContact CE1-CG 3.96Å; F804-E808 HydrophobicContact CE2-CG 3.93Å; F804-E808 HydrophobicContact CZ-CG 3.63Å; F804-E808 PolarHBondContact O-N 3.22Å; E808-I810 PolarHBondContact O-N 3.22Å; E808-Q811 PolarHBondContact O-N 2.95Å; E808-Q811 PolarHBondContact OE1-NE2 3.08Å; E808-Y812 HydrophobicContact CB-CD2 4.33Å; E808-Y812 HydrophobicContact CB-CE2 4.04Å; E808-Y812 WeakPolarHBondContact O-CD2 3.39Å; E808-Y812 PolarHBondContact O-N 3.04Å; E808-H853 VanDerWaalsContact CB-CD2 3.46Å; E808-H853 WeakPolarHBondContact CB-CD2 3.49Å
809	A	92.3	Very high	92.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55.8	-47.9	173.6	0	0	0	0	0	112.3	L805 L806 D807 Q811 Y812 L813 H853 N854	L805-A809 WeakPolarHBondContact O-CB 3.22Å; L805-A809 PolarHBondContact O-N 2.67Å; L806-A809 HydrophobicContact CD1-CB 4.47Å; D807-A809 VanDerWaalsContact C-N 3.35Å; D807-A809 PolarHBondContact O-N 3.09Å; A809-Q811 PolarHBondContact O-N 3.39Å; A809-Y812 PolarHBondContact O-N 3.39Å; A809-L813 WeakPolarHBondContact O-CB 3.47Å; A809-L813 VanDerWaalsContact O-CG 3.29Å; A809-L813 WeakPolarHBondContact O-CG 3.31Å; A809-L813 PolarHBondContact O-N 3.15Å; A809-H853 HydrophobicContact CB-CB 3.85Å; A809-N854 WeakPolarHBondContact CB-OD1 3.33Å
810	I	91.1	Very high	92.4	Very high	17 Å²	17	32.5 Å²	32.5	9%	0.087	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-45.1	177.2	-77	167.8	0	0	0	111	L806 D807 E808 S814 F891 H894 L903	L806-I810 HydrophobicContact CG-CD1 4.33Å; L806-I810 WeakPolarHBondContact O-CB 3.15Å; L806-I810 WeakPolarHBondContact O-CD1 3.3Å; L806-I810 VanDerWaalsContact O-CG1 3.26Å; L806-I810 WeakPolarHBondContact O-CG1 3.35Å; L806-I810 PolarHBondContact O-N 2.97Å; D807-I810 PolarHBondContact O-N 3.39Å; E808-I810 PolarHBondContact O-N 3.22Å; I810-S814 WeakPolarHBondContact O-CB 3.32Å; I810-S814 PolarHBondContact O-N 2.66Å; I810-F891 HydrophobicContact CD1-CD1 4.26Å; I810-H894 HydrophobicContact CD1-CB 3.92Å; I810-L903 HydrophobicContact CB-CD2 4.16Å; I810-L903 HydrophobicContact CG1-CD1 4.42Å; I810-L903 HydrophobicContact CG1-CD2 4.02Å; I810-L903 HydrophobicContact CG2-CD2 3.97Å
811	Q	92.9	Very high	92.4	Very high	82 Å²	82	32.8 Å²	32.8	38%	0.383	16%	0.16	S	C	.	.	H	α-helix	trans	-63.4	-47	179.4	-72.8	179.8	56.9	0	0	112	D807 E808 A809 S814 K815	D807-Q811 VanDerWaalsContact O-CG 3.32Å; D807-Q811 WeakPolarHBondContact O-CG 3.05Å; D807-Q811 PolarHBondContact O-N 2.88Å; E808-Q811 PolarHBondContact O-N 2.95Å; E808-Q811 PolarHBondContact OE1-NE2 3.08Å; A809-Q811 PolarHBondContact O-N 3.39Å; Q811-S814 PolarHBondContact O-N 2.87Å; Q811-K815 WeakPolarHBondContact O-CG 3.41Å; Q811-K815 PolarHBondContact O-N 2.91Å
812	Y	94.7	Very high	92.3	Very high	25 Å²	25	34.8 Å²	34.8	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-65.4	-42.5	178.6	-68.9	-56.7	0	0	0	111.9	E808 A809 S814 K815 I816 F846 L849 H853	E808-Y812 HydrophobicContact CB-CD2 4.33Å; E808-Y812 HydrophobicContact CB-CE2 4.04Å; E808-Y812 WeakPolarHBondContact O-CD2 3.39Å; E808-Y812 PolarHBondContact O-N 3.04Å; A809-Y812 PolarHBondContact O-N 3.39Å; Y812-S814 VanDerWaalsContact C-N 3.29Å; Y812-S814 PolarHBondContact O-N 3.17Å; Y812-K815 HydrophobicContact CD1-CD 4.45Å; Y812-K815 PolarHBondContact O-N 3.45Å; Y812-K815 VanDerWaalsContact O-N 3.16Å; Y812-I816 WeakPolarHBondContact O-CB 3.17Å; Y812-I816 VanDerWaalsContact O-CG1 3.24Å; Y812-I816 WeakPolarHBondContact O-CG1 3.19Å; Y812-I816 PolarHBondContact O-N 3.4Å; Y812-F846 AromaticContact CD1-CD1 3.82Å; Y812-F846 HydrophobicContact CD1-CD1 3.82Å; Y812-F846 HydrophobicContact CD1-CE1 4.48Å; Y812-F846 HydrophobicContact CD1-CG 4.46Å; Y812-F846 AromaticContact CE1-CD1 3.98Å; Y812-F846 HydrophobicContact CE1-CD1 3.98Å; Y812-F846 HydrophobicContact CE1-CE1 4.37Å; Y812-L849 HydrophobicContact CD1-CB 4.45Å; Y812-L849 HydrophobicContact CD2-CB 4.05Å; Y812-L849 HydrophobicContact CE1-CB 4.28Å; Y812-L849 HydrophobicContact CE1-CD1 3.89Å; Y812-L849 HydrophobicContact CE2-CB 3.86Å; Y812-L849 HydrophobicContact CG-CB 4.36Å; Y812-H853 AromaticContact CE2-CE1 3.81Å; Y812-H853 AromaticContact CE2-ND1 3.86Å
813	L	93.6	Very high	92.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-40.3	175.2	-73.7	172.2	0	0	0	112	A809 I816 K817 A850 L903 V905 F911 F913	A809-L813 WeakPolarHBondContact O-CB 3.47Å; A809-L813 VanDerWaalsContact O-CG 3.29Å; A809-L813 WeakPolarHBondContact O-CG 3.31Å; A809-L813 PolarHBondContact O-N 3.15Å; L813-I816 PolarHBondContact O-N 2.91Å; L813-K817 WeakPolarHBondContact O-CB 3.4Å; L813-K817 PolarHBondContact O-N 3.4Å; L813-A850 HydrophobicContact CD2-CB 4.49Å; L813-L903 HydrophobicContact CB-CD2 4.3Å; L813-V905 HydrophobicContact CD2-CG1 4.02Å; L813-V905 HydrophobicContact CD2-CG2 4.15Å; L813-F911 HydrophobicContact CD2-CB 4.3Å; L813-F911 HydrophobicContact CD2-CD2 4.38Å; L813-F911 HydrophobicContact CD2-CG 4.47Å; L813-F913 HydrophobicContact CD1-CB 4.39Å; L813-F913 HydrophobicContact CD1-CD1 3.92Å; L813-F913 HydrophobicContact CD1-CD2 3.68Å; L813-F913 HydrophobicContact CD1-CE1 4.06Å; L813-F913 HydrophobicContact CD1-CE2 3.84Å; L813-F913 HydrophobicContact CD1-CG 3.73Å; L813-F913 HydrophobicContact CD1-CZ 4.01Å
814	S	92.3	Very high	92	Very high	41 Å²	41	41.5 Å²	41.5	29%	0.287	20%	0.201	S	C	.	.	H	α-helix	trans	-63.8	-43.8	174.9	-172.4	0	0	0	0	111.9	I810 Q811 Y812 K817 I818	I810-S814 WeakPolarHBondContact O-CB 3.32Å; I810-S814 PolarHBondContact O-N 2.66Å; Q811-S814 PolarHBondContact O-N 2.87Å; Y812-S814 VanDerWaalsContact C-N 3.29Å; Y812-S814 PolarHBondContact O-N 3.17Å; S814-K817 PolarHBondContact O-N 3.47Å; S814-I818 WeakPolarHBondContact O-CG1 3.4Å; S814-I818 PolarHBondContact O-N 3.38Å; S814-I818 VanDerWaalsContact O-N 3.07Å
815	K	93	Very high	91.9	Very high	84 Å²	84	47.2 Å²	47.2	37%	0.365	22%	0.221	S	C	.	.	H	α-helix	trans	-62.5	-45.8	176.3	-72.1	171.2	-176.8	166.7	0	111.8	Q811 Y812 K817 I818 Q819 F846	Q811-K815 WeakPolarHBondContact O-CG 3.41Å; Q811-K815 PolarHBondContact O-N 2.91Å; Y812-K815 HydrophobicContact CD1-CD 4.45Å; Y812-K815 PolarHBondContact O-N 3.45Å; Y812-K815 VanDerWaalsContact O-N 3.16Å; K815-K817 VanDerWaalsContact C-N 3.33Å; K815-K817 PolarHBondContact O-N 2.91Å; K815-I818 PolarHBondContact O-N 2.99Å; K815-Q819 PolarHBondContact O-N 2.58Å; K815-F846 HydrophobicContact CB-CD2 4.36Å; K815-F846 HydrophobicContact CB-CE2 4.48Å; K815-F846 HydrophobicContact CD-CE1 4.47Å; K815-F846 HydrophobicContact CD-CZ 4.38Å
816	I	93.8	Very high	91.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-47.7	175.9	-70.7	163.7	0	0	0	110.1	Y812 L813 I818 Q819 Q820 L843 F846 A850 V905 F911	Y812-I816 WeakPolarHBondContact O-CB 3.17Å; Y812-I816 VanDerWaalsContact O-CG1 3.24Å; Y812-I816 WeakPolarHBondContact O-CG1 3.19Å; Y812-I816 PolarHBondContact O-N 3.4Å; L813-I816 PolarHBondContact O-N 2.91Å; I816-I818 VanDerWaalsContact C-N 3.34Å; I816-I818 PolarHBondContact O-N 3.48Å; I816-Q819 PolarHBondContact O-N 2.9Å; I816-Q820 HydrophobicContact CG2-CG 4.18Å; I816-Q820 WeakPolarHBondContact O-CB 3.41Å; I816-Q820 WeakPolarHBondContact O-CG 3.31Å; I816-Q820 PolarHBondContact O-N 3.27Å; I816-L843 HydrophobicContact CB-CD1 4.43Å; I816-L843 HydrophobicContact CG1-CD1 4.4Å; I816-L843 HydrophobicContact CG2-CD1 4.05Å; I816-F846 HydrophobicContact CD1-CB 4.28Å; I816-F846 HydrophobicContact CG1-CB 3.78Å; I816-A850 HydrophobicContact CD1-CB 3.63Å; I816-V905 HydrophobicContact CB-CG1 4.39Å; I816-V905 HydrophobicContact CG2-CG1 3.95Å; I816-F911 HydrophobicContact CD1-CD1 4.11Å; I816-F911 HydrophobicContact CD1-CE1 4.02Å; I816-F911 HydrophobicContact CD1-CZ 4.38Å; I816-F911 HydrophobicContact CG2-CE1 4.48Å; I816-F911 HydrophobicContact CG2-CE2 4.12Å; I816-F911 HydrophobicContact CG2-CZ 3.85Å
817	K	92.4	Very high	91.5	Very high	55 Å²	55	52.3 Å²	52.3	24%	0.239	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-44.6	179.5	-173.5	-175.9	178.6	-164.4	0	111.9	L813 S814 K815 Q820 I821 G901 A902 K904 V905	L813-K817 WeakPolarHBondContact O-CB 3.4Å; L813-K817 PolarHBondContact O-N 3.4Å; S814-K817 PolarHBondContact O-N 3.47Å; K815-K817 VanDerWaalsContact C-N 3.33Å; K815-K817 PolarHBondContact O-N 2.91Å; K817-Q820 PolarHBondContact O-N 2.65Å; K817-I821 HydrophobicContact CG-CD1 4.1Å; K817-I821 VanDerWaalsContact O-CG1 3.3Å; K817-I821 WeakPolarHBondContact O-CG1 3.45Å; K817-I821 PolarHBondContact O-N 2.97Å; K817-G901 PolarHBondContact NZ-O 2.98Å; K817-A902 WeakPolarHBondContact CD-O 3.38Å; K817-K904 WeakPolarHBondContact CD-O 3.28Å; K817-K904 WeakPolarHBondContact CE-O 3.44Å; K817-V905 HydrophobicContact CB-CG1 4.18Å
818	I	91.9	Very high	91.3	Very high	89 Å²	89	50.7 Å²	50.7	46%	0.456	24%	0.243	S	C	.	.	H	α-helix	trans	-58.9	-49.9	176.9	-68.6	164.9	0	0	0	109.8	S814 K815 I816 Q820 I821 E822	S814-I818 WeakPolarHBondContact O-CG1 3.4Å; S814-I818 PolarHBondContact O-N 3.38Å; S814-I818 VanDerWaalsContact O-N 3.07Å; K815-I818 PolarHBondContact O-N 2.99Å; I816-I818 VanDerWaalsContact C-N 3.34Å; I816-I818 PolarHBondContact O-N 3.48Å; I818-Q820 PolarHBondContact O-N 3.42Å; I818-I821 WeakPolarHBondContact O-CB 3.47Å; I818-I821 PolarHBondContact O-N 3.49Å; I818-I821 VanDerWaalsContact O-N 3.14Å; I818-E822 HydrophobicContact CG2-CG 4.47Å; I818-E822 WeakPolarHBondContact O-CG 3.48Å; I818-E822 PolarHBondContact O-N 3.14Å
819	Q	90.9	Very high	90.9	Very high	22 Å²	22	54.2 Å²	54.2	10%	0.103	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-37.4	179	-73.9	-168.7	-4.5	0	0	113.6	K815 I816 I821 E822 K823 W828 L843	K815-Q819 PolarHBondContact O-N 2.58Å; I816-Q819 PolarHBondContact O-N 2.9Å; Q819-I821 VanDerWaalsContact C-N 3.31Å; Q819-I821 PolarHBondContact O-N 3.5Å; Q819-E822 PolarHBondContact O-N 2.97Å; Q819-K823 WeakPolarHBondContact O-CB 3.41Å; Q819-K823 PolarHBondContact O-N 3.24Å; Q819-W828 HydrophobicContact CB-CZ2 4.08Å; Q819-L843 HydrophobicContact CB-CD1 4.02Å; Q819-L843 VanDerWaalsContact OE1-CB 3.29Å
820	Q	90.6	Very high	90.6	Very high	18 Å²	18	59.1 Å²	59.1	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-39.1	173.9	-75.3	179.5	-12.6	0	0	111.4	I816 K817 I818 D824 L843	I816-Q820 HydrophobicContact CG2-CG 4.18Å; I816-Q820 WeakPolarHBondContact O-CB 3.41Å; I816-Q820 WeakPolarHBondContact O-CG 3.31Å; I816-Q820 PolarHBondContact O-N 3.27Å; K817-Q820 PolarHBondContact O-N 2.65Å; I818-Q820 PolarHBondContact O-N 3.42Å; Q820-D824 WeakPolarHBondContact O-CB 3.34Å; Q820-D824 PolarHBondContact O-N 3.31Å; Q820-L843 HydrophobicContact CG-CD1 4.49Å
821	I	91.1	Very high	90.5	Very high	64 Å²	64	61.5 Å²	61.5	33%	0.328	31%	0.31	S	S	.	.	H	α-helix	trans	-68.1	-45.6	176.1	-69.1	167	0	0	0	111.2	K817 I818 Q819 K823 D824 R825	K817-I821 HydrophobicContact CG-CD1 4.1Å; K817-I821 VanDerWaalsContact O-CG1 3.3Å; K817-I821 WeakPolarHBondContact O-CG1 3.45Å; K817-I821 PolarHBondContact O-N 2.97Å; I818-I821 WeakPolarHBondContact O-CB 3.47Å; I818-I821 PolarHBondContact O-N 3.49Å; I818-I821 VanDerWaalsContact O-N 3.14Å; Q819-I821 VanDerWaalsContact C-N 3.31Å; Q819-I821 PolarHBondContact O-N 3.5Å; I821-K823 VanDerWaalsContact C-N 3.29Å; I821-K823 PolarHBondContact O-N 3.32Å; I821-D824 PolarHBondContact O-N 3.05Å; I821-R825 HydrophobicContact CG2-CG 4.43Å; I821-R825 WeakPolarHBondContact O-CB 3.24Å; I821-R825 VanDerWaalsContact O-CG 3.29Å; I821-R825 WeakPolarHBondContact O-CG 3.41Å; I821-R825 PolarHBondContact O-N 2.95Å
822	E	90.7	Very high	90.4	Very high	43 Å²	43	61.6 Å²	61.6	20%	0.201	32%	0.316	C	S	.	.	H	α-helix	trans	-56.8	-45.4	175.6	-68.9	175.9	-175.1	0	0	110.8	I818 Q819 R825 E827 W828 K839	I818-E822 HydrophobicContact CG2-CG 4.47Å; I818-E822 WeakPolarHBondContact O-CG 3.48Å; I818-E822 PolarHBondContact O-N 3.14Å; Q819-E822 PolarHBondContact O-N 2.97Å; E822-R825 PolarHBondContact O-N 3.48Å; E822-E827 WeakPolarHBondContact O-CB 3.37Å; E822-E827 PolarHBondContact O-N 2.86Å; E822-E827 VanDerWaalsContact O-N 3.14Å; E822-W828 PolarHBondContact OE2-NE1 2.95Å; E822-K839 IonicContact OE1-NZ 2.73Å; E822-K839 IonicContact OE2-NZ 3.52Å; E822-K839 PolarHBondContact OE2-NZ 3.41Å
823	K	88.4	Confident	89.9	Confident	96 Å²	96	64.6 Å²	64.6	42%	0.417	34%	0.338	S	S	.	.	H	α-helix	trans	-61.9	-46.3	177.4	-173.4	177.8	-177.6	174.5	0	111.9	Q819 I821 R825 G826 W828	Q819-K823 WeakPolarHBondContact O-CB 3.41Å; Q819-K823 PolarHBondContact O-N 3.24Å; I821-K823 VanDerWaalsContact C-N 3.29Å; I821-K823 PolarHBondContact O-N 3.32Å; K823-R825 VanDerWaalsContact C-N 3.28Å; K823-R825 PolarHBondContact O-N 3.36Å; K823-G826 PolarHBondContact O-N 3.49Å; K823-G826 VanDerWaalsContact O-N 3.13Å; K823-W828 HydrophobicContact CB-CD2 3.9Å; K823-W828 HydrophobicContact CB-CE3 4.1Å; K823-W828 HydrophobicContact CB-CG 4.41Å; K823-W828 HydrophobicContact CB-CH2 4.35Å; K823-W828 HydrophobicContact CB-CZ2 4.15Å; K823-W828 HydrophobicContact CB-CZ3 4.32Å; K823-W828 HydrophobicContact CD-CE3 4Å; K823-W828 HydrophobicContact CD-CH2 4.25Å; K823-W828 HydrophobicContact CD-CZ3 3.77Å; K823-W828 HydrophobicContact CG-CD2 4.09Å; K823-W828 HydrophobicContact CG-CE3 3.85Å; K823-W828 HydrophobicContact CG-CZ3 4.12Å
824	D	88.4	Confident	89.6	Confident	100 Å²	100	70 Å²	70	54%	0.535	36%	0.364	S	S	.	.	H	α-helix	trans	-67.9	-27.7	-178.8	-73.6	-12.6	0	0	0	113.5	Q820 I821 G826 K906	Q820-D824 WeakPolarHBondContact O-CB 3.34Å; Q820-D824 PolarHBondContact O-N 3.31Å; I821-D824 PolarHBondContact O-N 3.05Å; D824-G826 PolarHBondContact O-N 3.46Å; D824-K906 IonicContact OD1-NZ 2.96Å; D824-K906 PolarHBondContact OD1-NZ 3.34Å; D824-K906 WeakPolarHBondContact OD2-CE 3.16Å; D824-K906 IonicContact OD2-NZ 3.33Å; D824-K906 PolarHBondContact OD2-NZ 3.23Å
825	R	91.3	Very high	89.3	Confident	178 Å²	178	69.4 Å²	69.4	67%	0.672	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-2.6	175.3	-72.9	174.4	179	-178.7	1.8	113.4	I821 E822 K823 E827	I821-R825 HydrophobicContact CG2-CG 4.43Å; I821-R825 WeakPolarHBondContact O-CB 3.24Å; I821-R825 VanDerWaalsContact O-CG 3.29Å; I821-R825 WeakPolarHBondContact O-CG 3.41Å; I821-R825 PolarHBondContact O-N 2.95Å; E822-R825 PolarHBondContact O-N 3.48Å; K823-R825 VanDerWaalsContact C-N 3.28Å; K823-R825 PolarHBondContact O-N 3.36Å; R825-E827 HydrophobicContact CB-CG 3.91Å; R825-E827 WeakPolarHBondContact CD-OE1 3.43Å; R825-E827 IonicContact NH1-OE1 3.71Å; R825-E827 PolarHBondContact O-N 3Å
826	G	87	Confident	89	Confident	26 Å²	26	69.8 Å²	69.8	27%	0.268	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	13.5	-176.5	0	0	0	0	0	113.5	K823 D824 W828 D829	K823-G826 PolarHBondContact O-N 3.49Å; K823-G826 VanDerWaalsContact O-N 3.13Å; D824-G826 PolarHBondContact O-N 3.46Å; G826-W828 PolarHBondContact O-N 2.94Å; G826-D829 PolarHBondContact O-N 3.15Å; G826-D829 VanDerWaalsContact O-N 3.13Å
827	E	88.6	Confident	88.5	Confident	83 Å²	83	77 Å²	77	39%	0.388	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-62.7	-28.7	-179.6	-63	176.5	-157	0	0	110.8	E822 R825 S830	E822-E827 WeakPolarHBondContact O-CB 3.37Å; E822-E827 PolarHBondContact O-N 2.86Å; E822-E827 VanDerWaalsContact O-N 3.14Å; R825-E827 HydrophobicContact CB-CG 3.91Å; R825-E827 WeakPolarHBondContact CD-OE1 3.43Å; R825-E827 IonicContact NH1-OE1 3.71Å; R825-E827 PolarHBondContact O-N 3Å; E827-S830 PolarHBondContact O-N 3.41Å; E827-S830 PolarHBondContact O-OG 3.49Å
828	W	88.4	Confident	88.3	Confident	5 Å²	5	81.4 Å²	81.4	2%	0.019	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-74.5	-22.2	179.3	-67.6	17.5	0	0	0	113.8	Q819 E822 K823 G826 S830 L831 K839 E840 L843	Q819-W828 HydrophobicContact CB-CZ2 4.08Å; E822-W828 PolarHBondContact OE2-NE1 2.95Å; K823-W828 HydrophobicContact CB-CD2 3.9Å; K823-W828 HydrophobicContact CB-CE3 4.1Å; K823-W828 HydrophobicContact CB-CG 4.41Å; K823-W828 HydrophobicContact CB-CH2 4.35Å; K823-W828 HydrophobicContact CB-CZ2 4.15Å; K823-W828 HydrophobicContact CB-CZ3 4.32Å; K823-W828 HydrophobicContact CD-CE3 4Å; K823-W828 HydrophobicContact CD-CH2 4.25Å; K823-W828 HydrophobicContact CD-CZ3 3.77Å; K823-W828 HydrophobicContact CG-CD2 4.09Å; K823-W828 HydrophobicContact CG-CE3 3.85Å; K823-W828 HydrophobicContact CG-CZ3 4.12Å; G826-W828 PolarHBondContact O-N 2.94Å; W828-S830 PolarHBondContact O-N 3.41Å; W828-L831 HydrophobicContact CB-CD1 4.43Å; W828-L831 HydrophobicContact CG-CD1 4.43Å; W828-L831 WeakPolarHBondContact O-CB 3.42Å; W828-L831 PolarHBondContact O-N 2.91Å; W828-K839 HydrophobicContact CD2-CB 4.29Å; W828-K839 HydrophobicContact CE3-CB 4.37Å; W828-K839 HydrophobicContact CH2-CB 4.03Å; W828-K839 HydrophobicContact CZ2-CB 3.93Å; W828-K839 HydrophobicContact CZ2-CD 4.28Å; W828-K839 HydrophobicContact CZ3-CB 4.26Å; W828-E840 HydrophobicContact CE3-CG 4.08Å; W828-E840 HydrophobicContact CZ3-CB 4.45Å; W828-E840 HydrophobicContact CZ3-CG 3.57Å; W828-L843 HydrophobicContact CH2-CB 4.24Å; W828-L843 HydrophobicContact CH2-CD2 4Å
829	D	86.1	Confident	88.1	Confident	111 Å²	111	80.4 Å²	80.4	59%	0.594	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-72.8	-18.4	179.1	-64.1	-39.5	0	0	0	111.9	G826 R836	G826-D829 PolarHBondContact O-N 3.15Å; G826-D829 VanDerWaalsContact O-N 3.13Å; D829-R836 IonicContact OD1-CZ 3.84Å; D829-R836 IonicContact OD1-NH1 3.74Å; D829-R836 PolarHBondContact OD1-NH1 3Å; D829-R836 IonicContact OD1-NH2 3.98Å
830	S	85.2	Confident	87.9	Confident	103 Å²	103	82.4 Å²	82.4	72%	0.72	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-84.5	-7.9	174	73.5	0	0	0	0	114.1	E827 W828	E827-S830 PolarHBondContact O-N 3.41Å; E827-S830 PolarHBondContact O-OG 3.49Å; W828-S830 PolarHBondContact O-N 3.41Å
831	L	88.9	Confident	87.6	Confident	67 Å²	67	84.2 Å²	84.2	35%	0.351	43%	0.429	S	S	.	.	S	Bend	trans	-84.4	157.2	-178	-61.1	177.5	0	0	0	111.9	W828 A835 K839	W828-L831 HydrophobicContact CB-CD1 4.43Å; W828-L831 HydrophobicContact CG-CD1 4.43Å; W828-L831 WeakPolarHBondContact O-CB 3.42Å; W828-L831 PolarHBondContact O-N 2.91Å; L831-A835 HydrophobicContact CB-CB 4.26Å; L831-K839 HydrophobicContact CD1-CG 4.14Å
832	T	90.8	Very high	87.5	Confident	84 Å²	84	82 Å²	82	52%	0.515	42%	0.422	S	S	.	.			trans	-63.1	153.1	170.1	59.8	0	0	0	0	110.8	E834 A835 R836	T832-E834 PolarHBondContact O-N 2.86Å; T832-E834 VanDerWaalsContact O-N 3.14Å; T832-A835 PolarHBondContact O-N 2.85Å; T832-A835 VanDerWaalsContact O-N 3.13Å; T832-A835 WeakPolarHBondContact OG1-CB 3.3Å; T832-A835 PolarHBondContact OG1-N 3.42Å; T832-R836 WeakPolarHBondContact O-CB 3.44Å; T832-R836 PolarHBondContact O-N 2.78Å
833	P	85.3	Confident	87.4	Confident	87 Å²	87	81.2 Å²	81.2	57%	0.565	42%	0.419	S	S	*	.	H	α-helix	trans	-55.3	-31.1	178.2	-26.6	35.3	0	0	0	114.2	R837	P833-R837 WeakPolarHBondContact O-CB 3.32Å; P833-R837 WeakPolarHBondContact O-CG 3.26Å; P833-R837 PolarHBondContact O-N 2.78Å; P833-R837 PolarHBondContact O-NE 2.77Å
834	E	85.9	Confident	87.3	Confident	115 Å²	115	83.1 Å²	83.1	54%	0.537	43%	0.429	S	S	.	.	H	α-helix	trans	-71.7	-49.9	175.4	-66	65.1	-135.9	0	0	111.4	T832 R836 R837 E838	T832-E834 PolarHBondContact O-N 2.86Å; T832-E834 VanDerWaalsContact O-N 3.14Å; E834-R836 VanDerWaalsContact C-N 3.3Å; E834-R836 PolarHBondContact O-N 2.61Å; E834-R837 PolarHBondContact O-N 2.85Å; E834-R837 IonicContact OE1-NH2 3.29Å; E834-R837 PolarHBondContact OE1-NH2 3.23Å; E834-E838 PolarHBondContact O-N 3.45Å
835	A	87.3	Confident	87.3	Confident	28 Å²	28	83.4 Å²	83.4	23%	0.231	43%	0.429	C	S	.	.	H	α-helix	trans	-66	-34	-179.9	0	0	0	0	0	112.1	L831 T832 E838 K839	L831-A835 HydrophobicContact CB-CB 4.26Å; T832-A835 PolarHBondContact O-N 2.85Å; T832-A835 VanDerWaalsContact O-N 3.13Å; T832-A835 WeakPolarHBondContact OG1-CB 3.3Å; T832-A835 PolarHBondContact OG1-N 3.42Å; A835-E838 PolarHBondContact O-N 3.31Å; A835-K839 WeakPolarHBondContact O-CG 3.47Å; A835-K839 PolarHBondContact O-N 3.15Å
836	R	86	Confident	87.3	Confident	91 Å²	91	77 Å²	77	34%	0.343	41%	0.406	S	S	.	.	H	α-helix	trans	-63.7	-46.7	172	-178.8	177.1	175.9	147.3	3.9	111.4	D829 T832 E834 E838 K839 E840	D829-R836 IonicContact OD1-CZ 3.84Å; D829-R836 IonicContact OD1-NH1 3.74Å; D829-R836 PolarHBondContact OD1-NH1 3Å; D829-R836 IonicContact OD1-NH2 3.98Å; T832-R836 WeakPolarHBondContact O-CB 3.44Å; T832-R836 PolarHBondContact O-N 2.78Å; E834-R836 VanDerWaalsContact C-N 3.3Å; E834-R836 PolarHBondContact O-N 2.61Å; R836-E838 VanDerWaalsContact C-N 3.29Å; R836-E838 PolarHBondContact O-N 2.92Å; R836-K839 PolarHBondContact O-N 3.18Å; R836-E840 IonicContact CZ-OE1 3.66Å; R836-E840 IonicContact NE-OE1 2.83Å; R836-E840 PolarHBondContact NE-OE1 3.15Å; R836-E840 VanDerWaalsContact NE-OE1 3.14Å; R836-E840 IonicContact NH2-OE1 3.84Å; R836-E840 WeakPolarHBondContact O-CB 3.4Å; R836-E840 WeakPolarHBondContact O-CG 3.43Å; R836-E840 PolarHBondContact O-N 2.85Å
837	R	83.8	Confident	87.5	Confident	153 Å²	153	76.1 Å²	76.1	58%	0.577	40%	0.397	S	S	*	.	H	α-helix	trans	-60.1	-39.5	175.4	-85.6	-175.4	-80.9	174.2	-4.1	111.9	P833 E834 E840 A841	P833-R837 WeakPolarHBondContact O-CB 3.32Å; P833-R837 WeakPolarHBondContact O-CG 3.26Å; P833-R837 PolarHBondContact O-N 2.78Å; P833-R837 PolarHBondContact O-NE 2.77Å; E834-R837 PolarHBondContact O-N 2.85Å; E834-R837 IonicContact OE1-NH2 3.29Å; E834-R837 PolarHBondContact OE1-NH2 3.23Å; R837-E840 PolarHBondContact O-N 3.42Å; R837-A841 VanDerWaalsContact O-CB 3.31Å; R837-A841 WeakPolarHBondContact O-CB 3.33Å; R837-A841 PolarHBondContact O-N 3.29Å
838	E	87.9	Confident	87.4	Confident	147 Å²	147	78.2 Å²	78.2	69%	0.687	41%	0.406	S	S	*	.	H	α-helix	trans	-64.4	-45.1	176.1	-171.1	-178.8	-176.4	0	0	112.2	E834 A835 R836 A841 G842	E834-E838 PolarHBondContact O-N 3.45Å; A835-E838 PolarHBondContact O-N 3.31Å; R836-E838 VanDerWaalsContact C-N 3.29Å; R836-E838 PolarHBondContact O-N 2.92Å; E838-A841 PolarHBondContact O-N 2.87Å; E838-G842 PolarHBondContact O-N 3.4Å
839	K	88.8	Confident	87.4	Confident	68 Å²	68	79.7 Å²	79.7	30%	0.296	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-41.9	174.1	-79.4	-83	-169	162.8	0	112.3	E822 W828 L831 A835 R836 G842 L843	E822-K839 IonicContact OE1-NZ 2.73Å; E822-K839 IonicContact OE2-NZ 3.52Å; E822-K839 PolarHBondContact OE2-NZ 3.41Å; W828-K839 HydrophobicContact CD2-CB 4.29Å; W828-K839 HydrophobicContact CE3-CB 4.37Å; W828-K839 HydrophobicContact CH2-CB 4.03Å; W828-K839 HydrophobicContact CZ2-CB 3.93Å; W828-K839 HydrophobicContact CZ2-CD 4.28Å; W828-K839 HydrophobicContact CZ3-CB 4.26Å; L831-K839 HydrophobicContact CD1-CG 4.14Å; A835-K839 WeakPolarHBondContact O-CG 3.47Å; A835-K839 PolarHBondContact O-N 3.15Å; R836-K839 PolarHBondContact O-N 3.18Å; K839-G842 PolarHBondContact O-N 3.45Å; K839-L843 PolarHBondContact O-N 3.05Å
840	E	85.8	Confident	87.8	Confident	63 Å²	63	74.4 Å²	74.4	29%	0.294	39%	0.387	S	S	.	.	H	α-helix	trans	-64.4	-45.1	176	-76.6	172.3	-178.5	0	0	111.8	W828 R836 R837 G842 L843 Q844	W828-E840 HydrophobicContact CE3-CG 4.08Å; W828-E840 HydrophobicContact CZ3-CB 4.45Å; W828-E840 HydrophobicContact CZ3-CG 3.57Å; R836-E840 IonicContact CZ-OE1 3.66Å; R836-E840 IonicContact NE-OE1 2.83Å; R836-E840 PolarHBondContact NE-OE1 3.15Å; R836-E840 VanDerWaalsContact NE-OE1 3.14Å; R836-E840 IonicContact NH2-OE1 3.84Å; R836-E840 WeakPolarHBondContact O-CB 3.4Å; R836-E840 WeakPolarHBondContact O-CG 3.43Å; R836-E840 PolarHBondContact O-N 2.85Å; R837-E840 PolarHBondContact O-N 3.42Å; E840-G842 VanDerWaalsContact C-N 3.35Å; E840-L843 PolarHBondContact O-N 3.01Å; E840-Q844 PolarHBondContact O-N 3.26Å; E840-Q844 VanDerWaalsContact O-N 3.13Å
841	A	84.3	Confident	88.1	Confident	57 Å²	57	75.6 Å²	75.6	47%	0.471	38%	0.375	S	S	.	.	H	α-helix	trans	-62.9	-41.4	174.8	0	0	0	0	0	111.8	R837 E838 Q844 M845	R837-A841 VanDerWaalsContact O-CB 3.31Å; R837-A841 WeakPolarHBondContact O-CB 3.33Å; R837-A841 PolarHBondContact O-N 3.29Å; E838-A841 PolarHBondContact O-N 2.87Å; A841-Q844 PolarHBondContact O-N 2.97Å; A841-M845 WeakPolarHBondContact O-CB 3.49Å; A841-M845 PolarHBondContact O-N 3.06Å
842	G	88.9	Confident	88.3	Confident	17 Å²	17	74.8 Å²	74.8	18%	0.175	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-42.7	175.3	0	0	0	0	0	112.8	E838 K839 E840 Q844 M845 F846	E838-G842 PolarHBondContact O-N 3.4Å; K839-G842 PolarHBondContact O-N 3.45Å; E840-G842 VanDerWaalsContact C-N 3.35Å; G842-Q844 PolarHBondContact O-N 3.47Å; G842-M845 PolarHBondContact O-N 2.81Å; G842-F846 VanDerWaalsContact O-CD2 3.25Å; G842-F846 WeakPolarHBondContact O-CD2 3.37Å; G842-F846 VanDerWaalsContact O-CG 3.31Å; G842-F846 WeakPolarHBondContact O-CG 3.33Å; G842-F846 PolarHBondContact O-N 3.33Å
843	L	89.1	Confident	88.4	Confident	27 Å²	27	70.9 Å²	70.9	14%	0.141	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-43.8	176.3	-177.9	61	0	0	0	111.7	I816 Q819 Q820 W828 K839 E840 G847	I816-L843 HydrophobicContact CB-CD1 4.43Å; I816-L843 HydrophobicContact CG1-CD1 4.4Å; I816-L843 HydrophobicContact CG2-CD1 4.05Å; Q819-L843 HydrophobicContact CB-CD1 4.02Å; Q819-L843 VanDerWaalsContact OE1-CB 3.29Å; Q820-L843 HydrophobicContact CG-CD1 4.49Å; W828-L843 HydrophobicContact CH2-CB 4.24Å; W828-L843 HydrophobicContact CH2-CD2 4Å; K839-L843 PolarHBondContact O-N 3.05Å; E840-L843 PolarHBondContact O-N 3.01Å; L843-G847 PolarHBondContact O-N 3.36Å
844	Q	86	Confident	88.8	Confident	135 Å²	135	66.9 Å²	66.9	63%	0.631	32%	0.318	S	S	*	.	H	α-helix	trans	-63.8	-43.9	176.2	-71.5	-177.5	-2.7	0	0	111.9	E840 A841 G842 G847 Q848	E840-Q844 PolarHBondContact O-N 3.26Å; E840-Q844 VanDerWaalsContact O-N 3.13Å; A841-Q844 PolarHBondContact O-N 2.97Å; G842-Q844 PolarHBondContact O-N 3.47Å; Q844-G847 PolarHBondContact O-N 3.18Å; Q844-Q848 WeakPolarHBondContact O-CG 3.49Å; Q844-Q848 PolarHBondContact O-N 3.35Å
845	M	87.9	Confident	89.2	Confident	106 Å²	106	63.6 Å²	63.6	52%	0.522	30%	0.304	S	S	.	.	H	α-helix	trans	-60.2	-49.9	176.6	177.4	-170.7	148.8	0	0	111.3	A841 G842 G847 Q848 L849	A841-M845 WeakPolarHBondContact O-CB 3.49Å; A841-M845 PolarHBondContact O-N 3.06Å; G842-M845 PolarHBondContact O-N 2.81Å; M845-G847 VanDerWaalsContact C-N 3.27Å; M845-G847 PolarHBondContact O-N 2.81Å; M845-Q848 PolarHBondContact O-N 2.9Å; M845-L849 HydrophobicContact CE-CD1 3.71Å; M845-L849 HydrophobicContact CG-CD1 4.12Å; M845-L849 WeakPolarHBondContact O-CG 3.4Å; M845-L849 PolarHBondContact O-N 3.22Å
846	F	92.1	Very high	89.4	Confident	43 Å²	43	62.3 Å²	62.3	19%	0.189	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-37.9	176.6	-65.1	-34.6	0	0	0	111.9	Y812 K815 I816 G842 L849 A850	Y812-F846 AromaticContact CD1-CD1 3.82Å; Y812-F846 HydrophobicContact CD1-CD1 3.82Å; Y812-F846 HydrophobicContact CD1-CE1 4.48Å; Y812-F846 HydrophobicContact CD1-CG 4.46Å; Y812-F846 AromaticContact CE1-CD1 3.98Å; Y812-F846 HydrophobicContact CE1-CD1 3.98Å; Y812-F846 HydrophobicContact CE1-CE1 4.37Å; K815-F846 HydrophobicContact CB-CD2 4.36Å; K815-F846 HydrophobicContact CB-CE2 4.48Å; K815-F846 HydrophobicContact CD-CE1 4.47Å; K815-F846 HydrophobicContact CD-CZ 4.38Å; I816-F846 HydrophobicContact CD1-CB 4.28Å; I816-F846 HydrophobicContact CG1-CB 3.78Å; G842-F846 VanDerWaalsContact O-CD2 3.25Å; G842-F846 WeakPolarHBondContact O-CD2 3.37Å; G842-F846 VanDerWaalsContact O-CG 3.31Å; G842-F846 WeakPolarHBondContact O-CG 3.33Å; G842-F846 PolarHBondContact O-N 3.33Å; F846-L849 PolarHBondContact O-N 3.13Å; F846-A850 VanDerWaalsContact O-CB 3.25Å; F846-A850 WeakPolarHBondContact O-CB 3.31Å; F846-A850 PolarHBondContact O-N 2.93Å
847	G	89.6	Confident	89.8	Confident	8 Å²	8	58 Å²	58	8%	0.082	28%	0.278	C	S	.	.	H	α-helix	trans	-58.8	-46.9	174.7	0	0	0	0	0	113	L843 Q844 M845 A850 R851	L843-G847 PolarHBondContact O-N 3.36Å; Q844-G847 PolarHBondContact O-N 3.18Å; M845-G847 VanDerWaalsContact C-N 3.27Å; M845-G847 PolarHBondContact O-N 2.81Å; G847-A850 PolarHBondContact O-N 3.14Å; G847-R851 WeakPolarHBondContact O-CB 3.48Å; G847-R851 PolarHBondContact O-N 2.89Å
848	Q	87.1	Confident	90.3	Very high	127 Å²	127	51.8 Å²	51.8	59%	0.593	26%	0.256	S	S	*	.	H	α-helix	trans	-63.6	-43.7	177.6	-69.1	175.6	19.6	0	0	112.1	Q844 M845 R851 F852	Q844-Q848 WeakPolarHBondContact O-CG 3.49Å; Q844-Q848 PolarHBondContact O-N 3.35Å; M845-Q848 PolarHBondContact O-N 2.9Å; Q848-R851 PolarHBondContact O-N 3.5Å; Q848-F852 PolarHBondContact O-N 3.01Å; Q848-F852 VanDerWaalsContact O-N 3.11Å
849	L	89.8	Confident	90.6	Very high	37 Å²	37	46.9 Å²	46.9	19%	0.194	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-45.5	177.6	-69.1	170.9	0	0	0	111.8	Y812 M845 F846 R851 F852 H853	Y812-L849 HydrophobicContact CD1-CB 4.45Å; Y812-L849 HydrophobicContact CD2-CB 4.05Å; Y812-L849 HydrophobicContact CE1-CB 4.28Å; Y812-L849 HydrophobicContact CE1-CD1 3.89Å; Y812-L849 HydrophobicContact CE2-CB 3.86Å; Y812-L849 HydrophobicContact CG-CB 4.36Å; M845-L849 HydrophobicContact CE-CD1 3.71Å; M845-L849 HydrophobicContact CG-CD1 4.12Å; M845-L849 WeakPolarHBondContact O-CG 3.4Å; M845-L849 PolarHBondContact O-N 3.22Å; F846-L849 PolarHBondContact O-N 3.13Å; L849-R851 VanDerWaalsContact C-N 3.29Å; L849-R851 PolarHBondContact O-N 3.24Å; L849-F852 PolarHBondContact O-N 3.1Å; L849-H853 PolarHBondContact O-N 3.08Å; L849-H853 PolarHBondContact O-ND1 3.49Å
850	A	93.1	Very high	90.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.8	-44.4	175.9	0	0	0	0	0	111	L813 I816 F846 G847 F852 H853 N854	L813-A850 HydrophobicContact CD2-CB 4.49Å; I816-A850 HydrophobicContact CD1-CB 3.63Å; F846-A850 VanDerWaalsContact O-CB 3.25Å; F846-A850 WeakPolarHBondContact O-CB 3.31Å; F846-A850 PolarHBondContact O-N 2.93Å; G847-A850 PolarHBondContact O-N 3.14Å; A850-F852 PolarHBondContact O-N 3.05Å; A850-H853 PolarHBondContact O-N 2.95Å; A850-N854 VanDerWaalsContact O-CB 3.29Å; A850-N854 WeakPolarHBondContact O-CB 3.32Å; A850-N854 PolarHBondContact O-N 3.47Å; A850-N854 PolarHBondContact O-ND2 3.41Å
851	R	92.7	Very high	91.3	Very high	127 Å²	127	40.7 Å²	40.7	48%	0.479	21%	0.205	S	C	.	.	H	α-helix	trans	-58.4	-49.5	178	-172	-179.4	179.6	176.8	4.3	112.4	G847 Q848 L849 N854 I855 F911 D912	G847-R851 WeakPolarHBondContact O-CB 3.48Å; G847-R851 PolarHBondContact O-N 2.89Å; Q848-R851 PolarHBondContact O-N 3.5Å; L849-R851 VanDerWaalsContact C-N 3.29Å; L849-R851 PolarHBondContact O-N 3.24Å; R851-N854 PolarHBondContact O-N 2.88Å; R851-I855 HydrophobicContact CG-CD1 4.14Å; R851-I855 WeakPolarHBondContact O-CG1 3.29Å; R851-I855 PolarHBondContact O-N 3.43Å; R851-F911 WeakPolarHBondContact CA-O 3.45Å; R851-D912 HydrophobicContact CG-CB 4.05Å; R851-D912 IonicContact CZ-OD2 3.14Å; R851-D912 VanDerWaalsContact CZ-OD2 3.3Å; R851-D912 IonicContact NE-OD2 3.78Å; R851-D912 PolarHBondContact NE-OD2 3.04Å; R851-D912 IonicContact NH2-OD2 2.76Å; R851-D912 PolarHBondContact NH2-OD2 2.71Å
852	F	91.7	Very high	91.9	Very high	51 Å²	51	38.6 Å²	38.6	22%	0.224	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-51.8	177.6	176.9	-97.4	0	0	0	111.8	F749 N750 Q848 L849 A850 N854 I855 M856	F749-F852 HydrophobicContact CB-CE1 3.91Å; F749-F852 HydrophobicContact CB-CZ 3.66Å; N750-F852 WeakPolarHBondContact OD1-CE2 3.37Å; Q848-F852 PolarHBondContact O-N 3.01Å; Q848-F852 VanDerWaalsContact O-N 3.11Å; L849-F852 PolarHBondContact O-N 3.1Å; A850-F852 PolarHBondContact O-N 3.05Å; F852-N854 VanDerWaalsContact C-N 3.33Å; F852-N854 PolarHBondContact O-N 2.73Å; F852-I855 PolarHBondContact O-N 3.26Å; F852-M856 HydrophobicContact CD1-CG 4.41Å; F852-M856 HydrophobicContact CD2-CG 4.47Å; F852-M856 HydrophobicContact CE1-CG 4.06Å; F852-M856 HydrophobicContact CE2-CG 4.13Å; F852-M856 HydrophobicContact CZ-CG 3.92Å; F852-M856 WeakPolarHBondContact O-CG 3.5Å; F852-M856 PolarHBondContact O-N 2.95Å
853	H	93.6	Very high	92.2	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-36.8	-178.5	-72.1	84.9	0	0	0	112.4	F804 E808 A809 Y812 L849 A850 S857	F804-H853 AromaticContact CE1-NE2 3.98Å; E808-H853 VanDerWaalsContact CB-CD2 3.46Å; E808-H853 WeakPolarHBondContact CB-CD2 3.49Å; A809-H853 HydrophobicContact CB-CB 3.85Å; Y812-H853 AromaticContact CE2-CE1 3.81Å; Y812-H853 AromaticContact CE2-ND1 3.86Å; L849-H853 PolarHBondContact O-N 3.08Å; L849-H853 PolarHBondContact O-ND1 3.49Å; A850-H853 PolarHBondContact O-N 2.95Å; H853-S857 VanDerWaalsContact O-CB 3.24Å; H853-S857 WeakPolarHBondContact O-CB 3.37Å; H853-S857 PolarHBondContact O-N 3.36Å; H853-S857 PolarHBondContact O-OG 2.85Å
854	N	93.9	Very high	92.5	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.011	17%	0.174	C	C	.	.	H	α-helix	trans	-64.7	-45.5	175.3	-78.4	-37.8	0	0	0	112.4	A809 A850 R851 F852 S857 N858 F911 F913	A809-N854 WeakPolarHBondContact CB-OD1 3.33Å; A850-N854 VanDerWaalsContact O-CB 3.29Å; A850-N854 WeakPolarHBondContact O-CB 3.32Å; A850-N854 PolarHBondContact O-N 3.47Å; A850-N854 PolarHBondContact O-ND2 3.41Å; R851-N854 PolarHBondContact O-N 2.88Å; F852-N854 VanDerWaalsContact C-N 3.33Å; F852-N854 PolarHBondContact O-N 2.73Å; N854-S857 PolarHBondContact O-N 3.05Å; N854-N858 VanDerWaalsContact O-CG 3.31Å; N854-N858 PolarHBondContact O-N 3.4Å; N854-N858 PolarHBondContact O-ND2 3.06Å; N854-F911 WeakPolarHBondContact CB-O 3.49Å; N854-F911 PolarHBondContact ND2-O 2.8Å; N854-F913 WeakPolarHBondContact OD1-CD2 3.49Å
855	I	92.9	Very high	93	Very high	47 Å²	47	30.5 Å²	30.5	24%	0.241	15%	0.147	C	C	.	.	H	α-helix	trans	-58.2	-52.9	176.6	-69	166.8	0	0	0	109.3	R851 F852 S857 N858 E859 D912	R851-I855 HydrophobicContact CG-CD1 4.14Å; R851-I855 WeakPolarHBondContact O-CG1 3.29Å; R851-I855 PolarHBondContact O-N 3.43Å; F852-I855 PolarHBondContact O-N 3.26Å; I855-S857 VanDerWaalsContact C-N 3.34Å; I855-S857 PolarHBondContact O-N 3.05Å; I855-N858 PolarHBondContact O-N 3.05Å; I855-E859 WeakPolarHBondContact O-CG 3.39Å; I855-E859 PolarHBondContact O-N 3.34Å; I855-D912 HydrophobicContact CD1-CB 4.21Å; I855-D912 HydrophobicContact CG1-CB 3.7Å
856	M	93.4	Very high	93.4	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-63.5	-38.4	-177.7	-64.8	-61.8	-69.2	0	0	112.3	F749 R753 Y756 L805 F852 E859 T860	F749-M856 HydrophobicContact CB-CE 4.03Å; F749-M856 WeakPolarHBondContact O-CE 3.23Å; R753-M856 HydrophobicContact CB-CE 4.1Å; R753-M856 HydrophobicContact CB-SD 3.73Å; R753-M856 HydrophobicContact CG-SD 3.82Å; Y756-M856 HydrophobicContact CD2-CE 4.26Å; Y756-M856 HydrophobicContact CE2-CE 3.58Å; Y756-M856 HydrophobicContact CE2-SD 4.49Å; L805-M856 HydrophobicContact CD1-CB 3.64Å; L805-M856 HydrophobicContact CD2-CB 3.88Å; L805-M856 HydrophobicContact CG-CB 4.31Å; F852-M856 HydrophobicContact CD1-CG 4.41Å; F852-M856 HydrophobicContact CD2-CG 4.47Å; F852-M856 HydrophobicContact CE1-CG 4.06Å; F852-M856 HydrophobicContact CE2-CG 4.13Å; F852-M856 HydrophobicContact CZ-CG 3.92Å; F852-M856 WeakPolarHBondContact O-CG 3.5Å; F852-M856 PolarHBondContact O-N 2.95Å; M856-E859 PolarHBondContact O-N 3.49Å; M856-T860 WeakPolarHBondContact O-CB 3.39Å; M856-T860 PolarHBondContact O-N 3.41Å; M856-T860 PolarHBondContact O-OG1 3.41Å
857	S	94	Very high	93.6	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	12%	0.121	C	C	.	.	H	α-helix	trans	-62.3	-44	176	-62	0	0	0	0	112.2	L805 L806 H853 N854 I855 T860 I861	L805-S857 VanDerWaalsContact C-OG 3.28Å; L805-S857 PolarHBondContact O-OG 3.25Å; L806-S857 WeakPolarHBondContact CA-OG 3.22Å; L806-S857 PolarHBondContact N-OG 3.42Å; H853-S857 VanDerWaalsContact O-CB 3.24Å; H853-S857 WeakPolarHBondContact O-CB 3.37Å; H853-S857 PolarHBondContact O-N 3.36Å; H853-S857 PolarHBondContact O-OG 2.85Å; N854-S857 PolarHBondContact O-N 3.05Å; I855-S857 VanDerWaalsContact C-N 3.34Å; I855-S857 PolarHBondContact O-N 3.05Å; S857-T860 PolarHBondContact O-N 3.49Å; S857-I861 WeakPolarHBondContact O-CB 3.48Å; S857-I861 WeakPolarHBondContact O-CG1 3.44Å; S857-I861 PolarHBondContact O-N 2.9Å
858	N	93.4	Very high	93.9	Very high	22 Å²	22	24.7 Å²	24.7	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-63.2	-44.2	176.8	-70.6	-43.2	0	0	0	111.3	N854 I855 T860 G862	N854-N858 VanDerWaalsContact O-CG 3.31Å; N854-N858 PolarHBondContact O-N 3.4Å; N854-N858 PolarHBondContact O-ND2 3.06Å; I855-N858 PolarHBondContact O-N 3.05Å; N858-T860 VanDerWaalsContact C-N 3.35Å; N858-T860 PolarHBondContact O-N 3.28Å; N858-G862 PolarHBondContact O-N 3.33Å
859	E	94	Very high	94.2	Very high	43 Å²	43	21 Å²	21	20%	0.201	11%	0.105	C	C	.	.	H	α-helix	trans	-62.5	-41.9	177.3	-68.2	-61.4	148.5	0	0	111.9	Y756 R760 I855 M856 T863	Y756-E859 HydrophobicContact CD1-CB 4.37Å; Y756-E859 HydrophobicContact CD2-CB 3.75Å; Y756-E859 HydrophobicContact CE2-CB 4.39Å; Y756-E859 HydrophobicContact CG-CB 3.73Å; R760-E859 IonicContact CZ-OE2 3.3Å; R760-E859 IonicContact NH1-OE1 3.53Å; R760-E859 IonicContact NH1-OE2 2.69Å; R760-E859 PolarHBondContact NH1-OE2 3.17Å; R760-E859 IonicContact NH2-OE1 3.49Å; R760-E859 IonicContact NH2-OE2 3.55Å; R760-E859 PolarHBondContact NH2-OE2 2.86Å; I855-E859 WeakPolarHBondContact O-CG 3.39Å; I855-E859 PolarHBondContact O-N 3.34Å; M856-E859 PolarHBondContact O-N 3.49Å; E859-T863 WeakPolarHBondContact O-CB 3.45Å; E859-T863 PolarHBondContact O-N 3.4Å; E859-T863 PolarHBondContact O-OG1 3.46Å
860	T	94.8	Very high	94.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.3	-49.7	-178.8	-50.9	0	0	0	0	111.7	Y756 L798 A802 M856 S857 N858 T863 L864	Y756-T860 PolarHBondContact OH-OG1 3.42Å; L798-T860 HydrophobicContact CD1-CG2 3.66Å; L798-T860 HydrophobicContact CG-CG2 4.13Å; L798-T860 WeakPolarHBondContact O-CG2 3.38Å; A802-T860 HydrophobicContact CB-CG2 3.64Å; M856-T860 WeakPolarHBondContact O-CB 3.39Å; M856-T860 PolarHBondContact O-N 3.41Å; M856-T860 PolarHBondContact O-OG1 3.41Å; S857-T860 PolarHBondContact O-N 3.49Å; N858-T860 VanDerWaalsContact C-N 3.35Å; N858-T860 PolarHBondContact O-N 3.28Å; T860-T863 WeakPolarHBondContact O-CB 3.45Å; T860-T863 PolarHBondContact O-N 3.03Å; T860-L864 PolarHBondContact O-N 3.47Å; T860-L864 VanDerWaalsContact O-N 3.11Å
861	I	95.6	Very high	94.5	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-66.3	-39.3	177.2	-67.4	-55.2	0	0	0	111.3	A802 S857 T863 L864 A865 M887 L918 D921 I922 I925	A802-I861 HydrophobicContact CB-CD1 4.12Å; S857-I861 WeakPolarHBondContact O-CB 3.48Å; S857-I861 WeakPolarHBondContact O-CG1 3.44Å; S857-I861 PolarHBondContact O-N 2.9Å; I861-T863 PolarHBondContact O-N 3.43Å; I861-L864 HydrophobicContact CD1-CD1 4.09Å; I861-L864 PolarHBondContact O-N 2.96Å; I861-A865 PolarHBondContact O-N 3.45Å; I861-M887 HydrophobicContact CD1-CE 4.34Å; I861-L918 HydrophobicContact CB-CD1 3.86Å; I861-L918 HydrophobicContact CG1-CD1 3.76Å; I861-L918 HydrophobicContact CG2-CD1 3.94Å; I861-D921 HydrophobicContact CG2-CB 3.72Å; I861-I922 HydrophobicContact CG2-CG1 4.05Å; I861-I925 HydrophobicContact CG2-CD1 4.29Å
862	G	95.4	Very high	94.5	Very high	13 Å²	13	19.8 Å²	19.8	13%	0.134	10%	0.103	C	C	.	.	H	α-helix	trans	-60.3	-36.3	173.8	0	0	0	0	0	112.4	N858 A865 F866	N858-G862 PolarHBondContact O-N 3.33Å; G862-A865 PolarHBondContact O-N 2.92Å; G862-F866 WeakPolarHBondContact O-CD1 3.4Å; G862-F866 PolarHBondContact O-N 3.14Å
863	T	96.3	Very high	94.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.9	-46.8	174.2	-59.7	0	0	0	0	112	Y756 L759 L798 E859 T860 I861 A865 F866 L867	Y756-T863 VanDerWaalsContact CD1-OG1 3.31Å; Y756-T863 WeakPolarHBondContact CD1-OG1 3.47Å; L759-T863 HydrophobicContact CD1-CG2 4.32Å; L798-T863 HydrophobicContact CD1-CG2 4.41Å; L798-T863 HydrophobicContact CD2-CG2 3.94Å; E859-T863 WeakPolarHBondContact O-CB 3.45Å; E859-T863 PolarHBondContact O-N 3.4Å; E859-T863 PolarHBondContact O-OG1 3.46Å; T860-T863 WeakPolarHBondContact O-CB 3.45Å; T860-T863 PolarHBondContact O-N 3.03Å; I861-T863 PolarHBondContact O-N 3.43Å; T863-A865 VanDerWaalsContact C-N 3.28Å; T863-A865 PolarHBondContact O-N 3.21Å; T863-F866 VanDerWaalsContact CA-CE1 3.41Å; T863-F866 HydrophobicContact CG2-CE1 4.21Å; T863-F866 HydrophobicContact CG2-CE2 4.3Å; T863-F866 HydrophobicContact CG2-CZ 3.72Å; T863-F866 PolarHBondContact O-N 3.05Å; T863-L867 HydrophobicContact CG2-CD1 3.88Å; T863-L867 HydrophobicContact CG2-CG 4.35Å; T863-L867 WeakPolarHBondContact O-CB 3.38Å; T863-L867 VanDerWaalsContact O-CG 3.25Å; T863-L867 WeakPolarHBondContact O-CG 3.32Å; T863-L867 PolarHBondContact O-N 3.22Å
864	L	96.1	Very high	94.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.4	-38.4	173.8	-69.9	169.6	0	0	0	112.2	L798 A802 T860 I861 L867 T868 F875 M887 I925	L798-L864 HydrophobicContact CD2-CD2 3.61Å; L798-L864 HydrophobicContact CD2-CG 3.96Å; L798-L864 HydrophobicContact CG-CD2 4.22Å; L798-L864 HydrophobicContact CG-CG 4.37Å; A802-L864 HydrophobicContact CB-CD1 4.46Å; T860-L864 PolarHBondContact O-N 3.47Å; T860-L864 VanDerWaalsContact O-N 3.11Å; I861-L864 HydrophobicContact CD1-CD1 4.09Å; I861-L864 PolarHBondContact O-N 2.96Å; L864-L867 PolarHBondContact O-N 2.85Å; L864-T868 WeakPolarHBondContact O-CB 3.13Å; L864-T868 WeakPolarHBondContact O-CG2 3.24Å; L864-T868 PolarHBondContact O-N 3.36Å; L864-T868 PolarHBondContact O-OG1 3.3Å; L864-F875 HydrophobicContact CD2-CE1 4.02Å; L864-F875 HydrophobicContact CD2-CZ 4.41Å; L864-M887 HydrophobicContact CD1-CE 3.78Å; L864-I925 HydrophobicContact CB-CD1 3.78Å
865	A	95.9	Very high	94.1	Very high	9 Å²	9	19.7 Å²	19.7	7%	0.074	11%	0.109	C	C	.	.	H	α-helix	trans	-62.6	-43.1	-179.6	0	0	0	0	0	113.2	I861 G862 T863 T868 D921 I925 N928	I861-A865 PolarHBondContact O-N 3.45Å; G862-A865 PolarHBondContact O-N 2.92Å; T863-A865 VanDerWaalsContact C-N 3.28Å; T863-A865 PolarHBondContact O-N 3.21Å; A865-T868 PolarHBondContact O-OG1 3.27Å; A865-T868 VanDerWaalsContact O-OG1 3.06Å; A865-D921 HydrophobicContact CB-CB 4.2Å; A865-I925 HydrophobicContact CB-CD1 4.36Å; A865-I925 HydrophobicContact CB-CG1 3.95Å; A865-N928 PolarHBondContact O-ND2 2.93Å
866	F	95.4	Very high	94	Very high	32 Å²	32	18.2 Å²	18.2	14%	0.14	10%	0.102	C	C	.	.	H	α-helix	trans	-78.8	-34.2	176.7	69.4	-114.8	0	0	0	112.7	L759 R760 W763 G862 T863 T868 S869	L759-F866 HydrophobicContact CB-CZ 4.16Å; R760-F866 HydrophobicContact CB-CE1 4.15Å; W763-F866 HydrophobicContact CB-CD2 3.79Å; W763-F866 HydrophobicContact CB-CE2 3.7Å; W763-F866 HydrophobicContact CB-CZ 4.35Å; W763-F866 AromaticContact CD1-CD2 3.48Å; W763-F866 VanDerWaalsContact CD1-CD2 3.48Å; W763-F866 AromaticContact CD1-CG 3.9Å; W763-F866 AromaticContact CD2-CD2 3.51Å; W763-F866 HydrophobicContact CD2-CD2 3.51Å; W763-F866 AromaticContact CD2-CE2 3.88Å; W763-F866 HydrophobicContact CD2-CE2 3.88Å; W763-F866 AromaticContact CE2-CD2 3.81Å; W763-F866 HydrophobicContact CE3-CD2 4.19Å; W763-F866 HydrophobicContact CE3-CE2 4.19Å; W763-F866 HydrophobicContact CG-CB 4.49Å; W763-F866 AromaticContact CG-CD2 3.29Å; W763-F866 HydrophobicContact CG-CD2 3.29Å; W763-F866 AromaticContact CG-CE2 3.67Å; W763-F866 HydrophobicContact CG-CE2 3.67Å; W763-F866 HydrophobicContact CG-CG 4.1Å; W763-F866 VanDerWaalsContact CZ2-O 3.31Å; W763-F866 WeakPolarHBondContact CZ2-O 3.44Å; W763-F866 AromaticContact NE1-CD2 3.77Å; W763-F866 PolarHBondContact NE1-O 3Å; G862-F866 WeakPolarHBondContact O-CD1 3.4Å; G862-F866 PolarHBondContact O-N 3.14Å; T863-F866 VanDerWaalsContact CA-CE1 3.41Å; T863-F866 HydrophobicContact CG2-CE1 4.21Å; T863-F866 HydrophobicContact CG2-CE2 4.3Å; T863-F866 HydrophobicContact CG2-CZ 3.72Å; T863-F866 PolarHBondContact O-N 3.05Å; F866-T868 VanDerWaalsContact C-N 3.33Å; F866-T868 PolarHBondContact O-N 3.42Å; F866-S869 WeakPolarHBondContact O-CB 3.4Å; F866-S869 PolarHBondContact O-N 3.39Å; F866-S869 PolarHBondContact O-OG 2.98Å
867	L	96.3	Very high	93.7	Very high	4 Å²	4	21 Å²	21	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-43.2	177.4	-71.8	175.7	0	0	0	111.2	W763 I772 F791 F794 L795 L798 T863 L864 S869 E870 I871 F875	W763-L867 HydrophobicContact CD2-CD2 4.47Å; W763-L867 HydrophobicContact CE3-CD2 3.79Å; W763-L867 HydrophobicContact CH2-CD2 4.02Å; W763-L867 HydrophobicContact CZ3-CD2 3.55Å; I772-L867 HydrophobicContact CG2-CD2 4.37Å; F791-L867 HydrophobicContact CZ-CD2 4.44Å; F794-L867 HydrophobicContact CE1-CD1 4Å; L795-L867 HydrophobicContact CD2-CD1 4.16Å; L798-L867 HydrophobicContact CD2-CD1 4.05Å; T863-L867 HydrophobicContact CG2-CD1 3.88Å; T863-L867 HydrophobicContact CG2-CG 4.35Å; T863-L867 WeakPolarHBondContact O-CB 3.38Å; T863-L867 VanDerWaalsContact O-CG 3.25Å; T863-L867 WeakPolarHBondContact O-CG 3.32Å; T863-L867 PolarHBondContact O-N 3.22Å; L864-L867 PolarHBondContact O-N 2.85Å; L867-S869 PolarHBondContact O-N 2.69Å; L867-E870 PolarHBondContact O-N 2.85Å; L867-I871 HydrophobicContact CD2-CD1 4.25Å; L867-I871 WeakPolarHBondContact O-CB 3.47Å; L867-I871 PolarHBondContact O-N 3.05Å; L867-F875 HydrophobicContact CB-CZ 4.34Å
868	T	95.8	Very high	93	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.6	-14.7	179.5	54.2	0	0	0	0	113.8	L864 A865 F866 E870 F875 I925 N928 L929	L864-T868 WeakPolarHBondContact O-CB 3.13Å; L864-T868 WeakPolarHBondContact O-CG2 3.24Å; L864-T868 PolarHBondContact O-N 3.36Å; L864-T868 PolarHBondContact O-OG1 3.3Å; A865-T868 PolarHBondContact O-OG1 3.27Å; A865-T868 VanDerWaalsContact O-OG1 3.06Å; F866-T868 VanDerWaalsContact C-N 3.33Å; F866-T868 PolarHBondContact O-N 3.42Å; T868-E870 VanDerWaalsContact C-N 3.34Å; T868-E870 PolarHBondContact O-N 3.39Å; T868-F875 HydrophobicContact CG2-CD1 4.09Å; T868-F875 HydrophobicContact CG2-CD2 3.75Å; T868-F875 HydrophobicContact CG2-CE1 4.01Å; T868-F875 HydrophobicContact CG2-CE2 3.66Å; T868-F875 HydrophobicContact CG2-CG 3.93Å; T868-F875 HydrophobicContact CG2-CZ 3.78Å; T868-I925 HydrophobicContact CG2-CG2 4.08Å; T868-N928 WeakPolarHBondContact O-CB 3.24Å; T868-N928 PolarHBondContact OG1-ND2 3.46Å; T868-L929 HydrophobicContact CG2-CD1 4.21Å; T868-L929 HydrophobicContact CG2-CD2 4.27Å; T868-L929 HydrophobicContact CG2-CG 4.38Å
869	S	95.1	Very high	92.2	Very high	49 Å²	49	23.1 Å²	23.1	34%	0.343	13%	0.129	S	C	.	.	H	α-helix	trans	-65.8	-36	179.3	70.7	0	0	0	0	112.9	F866 L867 N928	F866-S869 WeakPolarHBondContact O-CB 3.4Å; F866-S869 PolarHBondContact O-N 3.39Å; F866-S869 PolarHBondContact O-OG 2.98Å; L867-S869 PolarHBondContact O-N 2.69Å; S869-N928 PolarHBondContact N-ND2 3.38Å
870	E	94.4	Very high	91.7	Very high	77 Å²	77	21.1 Å²	21.1	36%	0.36	12%	0.12	S	C	.	.	H	α-helix	trans	-119.1	-32.4	179.6	-62.9	-170.1	-140.2	0	0	113	W763 R769 K773 L867 T868 K872	W763-E870 HydrophobicContact CH2-CB 4.41Å; W763-E870 HydrophobicContact CZ2-CB 4Å; W763-E870 HydrophobicContact CZ2-CG 4.32Å; R769-E870 VanDerWaalsContact CD-OE1 3.23Å; R769-E870 WeakPolarHBondContact CD-OE1 3.15Å; R769-E870 IonicContact CZ-OE1 3.37Å; R769-E870 IonicContact NE-OE1 3.3Å; R769-E870 IonicContact NH1-OE1 2.68Å; R769-E870 PolarHBondContact NH1-OE1 3.4Å; K773-E870 IonicContact NZ-OE2 2.65Å; K773-E870 PolarHBondContact NZ-OE2 3.15Å; L867-E870 PolarHBondContact O-N 2.85Å; T868-E870 VanDerWaalsContact C-N 3.34Å; T868-E870 PolarHBondContact O-N 3.39Å; E870-K872 PolarHBondContact O-N 3.39Å
871	I	94.4	Very high	91.4	Very high	8 Å²	8	21.1 Å²	21.1	4%	0.041	12%	0.12	C	C	.	.			trans	-92.5	97.2	177.3	-59.5	162.3	0	0	0	107.8	W763 I772 K773 A776 F791 L867 L874 F875	W763-I871 HydrophobicContact CH2-CD1 3.61Å; W763-I871 HydrophobicContact CH2-CG1 3.96Å; W763-I871 HydrophobicContact CZ3-CD1 3.89Å; I772-I871 HydrophobicContact CG2-CD1 4.34Å; K773-I871 HydrophobicContact CG-CG1 4.27Å; A776-I871 HydrophobicContact CB-CD1 3.77Å; A776-I871 HydrophobicContact CB-CG1 4.03Å; A776-I871 HydrophobicContact CB-CG2 3.83Å; F791-I871 HydrophobicContact CE1-CD1 4.04Å; F791-I871 HydrophobicContact CE1-CG2 4.42Å; F791-I871 HydrophobicContact CZ-CD1 3.72Å; L867-I871 HydrophobicContact CD2-CD1 4.25Å; L867-I871 WeakPolarHBondContact O-CB 3.47Å; L867-I871 PolarHBondContact O-N 3.05Å; I871-L874 HydrophobicContact CG2-CB 4.43Å; I871-L874 HydrophobicContact CG2-CD1 4.2Å; I871-F875 HydrophobicContact CB-CE2 4.35Å; I871-F875 HydrophobicContact CG2-CD2 4.42Å; I871-F875 HydrophobicContact CG2-CE2 4.13Å; I871-F875 WeakPolarHBondContact O-CD2 3.48Å; I871-F875 WeakPolarHBondContact O-CE2 3.24Å
872	K	92.3	Very high	90.8	Very high	54 Å²	54	23.5 Å²	23.5	24%	0.235	13%	0.131	C	C	.	.			trans	-102.6	-44.3	-179.1	-59.5	-171.6	-177.4	-161.7	0	113.5	E870 L874 F875 V876 N928 L929 D931	E870-K872 PolarHBondContact O-N 3.39Å; K872-L874 VanDerWaalsContact C-N 3.33Å; K872-L874 PolarHBondContact O-N 3.09Å; K872-F875 PolarHBondContact O-N 2.87Å; K872-V876 PolarHBondContact O-N 2.93Å; K872-N928 WeakPolarHBondContact CE-O 3.32Å; K872-N928 PolarHBondContact NZ-O 3.11Å; K872-L929 HydrophobicContact CB-CD2 4.37Å; K872-L929 HydrophobicContact CG-CD2 4.43Å; K872-D931 IonicContact NZ-OD2 3.88Å; K872-D931 PolarHBondContact NZ-OD2 3.3Å; K872-D931 VanDerWaalsContact NZ-OD2 3.15Å
873	S	90.2	Very high	90.4	Very high	53 Å²	53	24.4 Å²	24.4	37%	0.371	13%	0.13	S	C	.	.	H	α-helix	trans	-51.3	-44.7	-170.9	54.1	0	0	0	0	114.1	V876 H877	S873-V876 WeakPolarHBondContact O-CG2 3.28Å; S873-H877 PolarHBondContact O-N 3.5Å
874	L	90	Very high	90.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.8	-43.6	178.7	-76.6	175.8	0	0	0	112.8	A776 A779 L783 F791 L795 I871 K872 V876 H877 L880	A776-L874 HydrophobicContact CB-CD1 3.93Å; A776-L874 WeakPolarHBondContact O-CD1 3.34Å; A779-L874 HydrophobicContact CB-CD1 4.25Å; A779-L874 HydrophobicContact CB-CD2 4.39Å; L783-L874 HydrophobicContact CD2-CD2 3.77Å; F791-L874 HydrophobicContact CD1-CD1 3.64Å; F791-L874 HydrophobicContact CE1-CD1 3.92Å; L795-L874 HydrophobicContact CD1-CB 4.3Å; L795-L874 HydrophobicContact CD1-CD1 3.93Å; I871-L874 HydrophobicContact CG2-CB 4.43Å; I871-L874 HydrophobicContact CG2-CD1 4.2Å; K872-L874 VanDerWaalsContact C-N 3.33Å; K872-L874 PolarHBondContact O-N 3.09Å; L874-V876 VanDerWaalsContact C-N 3.3Å; L874-V876 PolarHBondContact O-N 3.15Å; L874-H877 WeakPolarHBondContact O-CB 3.23Å; L874-H877 PolarHBondContact O-N 3.31Å; L874-L880 HydrophobicContact CB-CD1 4.41Å
875	F	91.2	Very high	89.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-73.7	-23.2	-175.5	-66.2	-80.9	0	0	0	113.1	L795 L864 L867 T868 I871 K872 A881 I884 L929	L795-F875 HydrophobicContact CD1-CE1 4.3Å; L795-F875 HydrophobicContact CD1-CE2 4.47Å; L795-F875 HydrophobicContact CD1-CZ 4.08Å; L795-F875 HydrophobicContact CD2-CE1 4.04Å; L795-F875 HydrophobicContact CD2-CZ 3.63Å; L864-F875 HydrophobicContact CD2-CE1 4.02Å; L864-F875 HydrophobicContact CD2-CZ 4.41Å; L867-F875 HydrophobicContact CB-CZ 4.34Å; T868-F875 HydrophobicContact CG2-CD1 4.09Å; T868-F875 HydrophobicContact CG2-CD2 3.75Å; T868-F875 HydrophobicContact CG2-CE1 4.01Å; T868-F875 HydrophobicContact CG2-CE2 3.66Å; T868-F875 HydrophobicContact CG2-CG 3.93Å; T868-F875 HydrophobicContact CG2-CZ 3.78Å; I871-F875 HydrophobicContact CB-CE2 4.35Å; I871-F875 HydrophobicContact CG2-CD2 4.42Å; I871-F875 HydrophobicContact CG2-CE2 4.13Å; I871-F875 WeakPolarHBondContact O-CD2 3.48Å; I871-F875 WeakPolarHBondContact O-CE2 3.24Å; K872-F875 PolarHBondContact O-N 2.87Å; F875-A881 VanDerWaalsContact O-CA 3.24Å; F875-A881 WeakPolarHBondContact O-CA 3.4Å; F875-A881 WeakPolarHBondContact O-CB 3.4Å; F875-I884 HydrophobicContact CD1-CD1 3.41Å; F875-I884 VanDerWaalsContact CD1-CD1 3.41Å; F875-I884 HydrophobicContact CE1-CD1 3.84Å; F875-I884 HydrophobicContact CG-CD1 4.36Å; F875-L929 HydrophobicContact CB-CD1 3.83Å; F875-L929 HydrophobicContact CB-CD2 3.83Å
876	V	90.6	Very high	89.7	Confident	16 Å²	16	26.2 Å²	26.2	10%	0.097	14%	0.142	C	C	.	.	H	α-helix	trans	-95.6	-4.1	177.1	-53.6	0	0	0	0	113.1	K872 S873 L874 L929 E932 N934 F935	K872-V876 PolarHBondContact O-N 2.93Å; S873-V876 WeakPolarHBondContact O-CG2 3.28Å; L874-V876 VanDerWaalsContact C-N 3.3Å; L874-V876 PolarHBondContact O-N 3.15Å; V876-L929 HydrophobicContact CG1-CB 4.37Å; V876-L929 HydrophobicContact CG1-CD2 4.12Å; V876-E932 HydrophobicContact CB-CB 4.27Å; V876-E932 HydrophobicContact CB-CG 4.38Å; V876-E932 HydrophobicContact CG1-CB 3.86Å; V876-E932 HydrophobicContact CG1-CG 3.84Å; V876-E932 HydrophobicContact CG2-CB 4.48Å; V876-E932 HydrophobicContact CG2-CG 4.19Å; V876-N934 PolarHBondContact O-ND2 2.9Å; V876-F935 HydrophobicContact CB-CB 4.29Å; V876-F935 HydrophobicContact CG1-CB 3.81Å; V876-F935 HydrophobicContact CG1-CD2 4.22Å; V876-F935 HydrophobicContact CG1-CG 4.27Å
877	H	87.4	Confident	89.6	Confident	59 Å²	59	25 Å²	25	27%	0.273	14%	0.137	S	C	.	.	S	Bend	trans	-69.8	137.8	174.3	-167.7	-91	0	0	0	110.5	L783 S873 L874 F879 L880 A881	L783-H877 HydrophobicContact CD1-CB 4.48Å; S873-H877 PolarHBondContact O-N 3.5Å; L874-H877 WeakPolarHBondContact O-CB 3.23Å; L874-H877 PolarHBondContact O-N 3.31Å; H877-F879 AromaticContact CE1-CD1 3.64Å; H877-F879 AromaticContact CE1-CD2 3.92Å; H877-F879 AromaticContact CE1-CE1 3.91Å; H877-F879 AromaticContact CE1-CG 3.64Å; H877-F879 AromaticContact ND1-CD1 3.78Å; H877-F879 AromaticContact ND1-CD2 3.97Å; H877-F879 AromaticContact ND1-CG 3.47Å; H877-F879 WeakPolarHBondContact ND1-CG 3.22Å; H877-F879 PolarHBondContact ND1-N 3.45Å; H877-F879 PolarHBondContact O-N 3.45Å; H877-L880 PolarHBondContact O-N 3.03Å; H877-A881 VanDerWaalsContact O-CB 3.31Å; H877-A881 WeakPolarHBondContact O-CB 3.32Å; H877-A881 PolarHBondContact O-N 3.28Å
878	P	79	Confident	89.5	Confident	56 Å²	56	24.8 Å²	24.8	36%	0.364	14%	0.136	S	C	.	.	H	α-helix	trans	-51.1	-29.3	-177.3	-30.5	35.8	0	0	0	115.5	L880	P878-L880 VanDerWaalsContact C-N 3.33Å; P878-L880 PolarHBondContact O-N 2.99Å
879	F	77	Confident	89.4	Confident	12 Å²	12	24.8 Å²	24.8	5%	0.053	14%	0.136	C	C	.	.	H	α-helix	trans	-62.6	-36.2	178	-70.1	6.5	0	0	0	113.2	L783 E784 H877 R1023 A1027 M1045	L783-F879 HydrophobicContact CB-CD2 4.18Å; L783-F879 HydrophobicContact CB-CE2 4.04Å; E784-F879 HydrophobicContact CG-CE2 4.21Å; E784-F879 HydrophobicContact CG-CZ 4.25Å; H877-F879 AromaticContact CE1-CD1 3.64Å; H877-F879 AromaticContact CE1-CD2 3.92Å; H877-F879 AromaticContact CE1-CE1 3.91Å; H877-F879 AromaticContact CE1-CG 3.64Å; H877-F879 AromaticContact ND1-CD1 3.78Å; H877-F879 AromaticContact ND1-CD2 3.97Å; H877-F879 AromaticContact ND1-CG 3.47Å; H877-F879 WeakPolarHBondContact ND1-CG 3.22Å; H877-F879 PolarHBondContact ND1-N 3.45Å; H877-F879 PolarHBondContact O-N 3.45Å; F879-R1023 HydrophobicContact CE1-CG 4.4Å; F879-R1023 HydrophobicContact CZ-CG 4.49Å; F879-A1027 HydrophobicContact CD1-CB 3.82Å; F879-A1027 HydrophobicContact CD2-CB 3.92Å; F879-A1027 HydrophobicContact CE1-CB 3.58Å; F879-A1027 HydrophobicContact CE2-CB 3.68Å; F879-A1027 HydrophobicContact CG-CB 4Å; F879-A1027 HydrophobicContact CZ-CB 3.51Å; F879-M1045 HydrophobicContact CZ-CE 4.09Å
880	L	83.3	Confident	89.2	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-111.6	-29.6	-176	-58.9	-177.3	0	0	0	113.1	L792 L795 M799 L874 H877 P878 E882 R883 I884 L1031	L792-L880 HydrophobicContact CD1-CD1 3.74Å; L792-L880 HydrophobicContact CD1-CD2 4.02Å; L792-L880 HydrophobicContact CD1-CG 4.19Å; L795-L880 HydrophobicContact CD1-CD1 4.25Å; M799-L880 HydrophobicContact CE-CD2 3.94Å; L874-L880 HydrophobicContact CB-CD1 4.41Å; H877-L880 PolarHBondContact O-N 3.03Å; P878-L880 VanDerWaalsContact C-N 3.33Å; P878-L880 PolarHBondContact O-N 2.99Å; L880-E882 PolarHBondContact O-N 3.48Å; L880-R883 PolarHBondContact O-N 3.34Å; L880-R883 VanDerWaalsContact O-N 3.09Å; L880-I884 PolarHBondContact O-N 2.89Å; L880-L1031 HydrophobicContact CD2-CD1 4.15Å
881	A	87.3	Confident	89.1	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-54.3	-52.5	-171.8	0	0	0	0	0	113.1	F875 H877 R883 I884 I885	F875-A881 VanDerWaalsContact O-CA 3.24Å; F875-A881 WeakPolarHBondContact O-CA 3.4Å; F875-A881 WeakPolarHBondContact O-CB 3.4Å; H877-A881 VanDerWaalsContact O-CB 3.31Å; H877-A881 WeakPolarHBondContact O-CB 3.32Å; H877-A881 PolarHBondContact O-N 3.28Å; A881-R883 VanDerWaalsContact C-N 3.25Å; A881-R883 PolarHBondContact O-N 2.9Å; A881-I884 VanDerWaalsContact O-CG2 3.24Å; A881-I884 WeakPolarHBondContact O-CG2 3.35Å; A881-I884 PolarHBondContact O-N 3.18Å; A881-I885 VanDerWaalsContact O-CB 3.24Å; A881-I885 WeakPolarHBondContact O-CB 3.34Å; A881-I885 WeakPolarHBondContact O-CD1 3.2Å; A881-I885 WeakPolarHBondContact O-CG1 3.34Å; A881-I885 PolarHBondContact O-N 3.3Å
882	E	84.4	Confident	89	Confident	50 Å²	50	21.6 Å²	21.6	23%	0.234	11%	0.113	C	C	.	.	H	α-helix	trans	-58.6	-38.7	179.3	-73.8	-177.6	-171.4	0	0	112.4	L880 I885 S886 T938 R1028	L880-E882 PolarHBondContact O-N 3.48Å; E882-I885 PolarHBondContact O-N 3.02Å; E882-S886 WeakPolarHBondContact O-CB 3.44Å; E882-S886 PolarHBondContact O-N 3.03Å; E882-S886 PolarHBondContact O-OG 3.36Å; E882-T938 HydrophobicContact CB-CG2 4.46Å; E882-T938 HydrophobicContact CG-CG2 3.55Å; E882-R1028 IonicContact OE2-CZ 3.98Å; E882-R1028 VanDerWaalsContact OE2-CZ 3.29Å; E882-R1028 IonicContact OE2-NH1 3.91Å; E882-R1028 PolarHBondContact OE2-NH1 2.79Å; E882-R1028 VanDerWaalsContact OE2-NH1 3.14Å; E882-R1028 IonicContact OE2-NH2 2.78Å; E882-R1028 PolarHBondContact OE2-NH2 3.01Å
883	R	86	Confident	89	Confident	32 Å²	32	21.4 Å²	21.4	12%	0.121	11%	0.113	C	C	.	.	H	α-helix	trans	-71.7	-46	-176.7	-174.4	175.3	178.2	178	-12.7	112.4	N796 M799 N800 L880 A881 I885 M887	N796-R883 PolarHBondContact O-NH2 3.2Å; N796-R883 PolarHBondContact OD1-NH1 3.38Å; N796-R883 PolarHBondContact OD1-NH2 3.18Å; N796-R883 VanDerWaalsContact OD1-NH2 3.07Å; M799-R883 HydrophobicContact SD-CG 4.49Å; N800-R883 PolarHBondContact ND2-NH2 3.22Å; N800-R883 PolarHBondContact OD1-NH2 2.68Å; L880-R883 PolarHBondContact O-N 3.34Å; L880-R883 VanDerWaalsContact O-N 3.09Å; A881-R883 VanDerWaalsContact C-N 3.25Å; A881-R883 PolarHBondContact O-N 2.9Å; R883-I885 VanDerWaalsContact C-N 3.28Å; R883-I885 PolarHBondContact O-N 2.76Å; R883-M887 WeakPolarHBondContact O-CB 3.38Å; R883-M887 PolarHBondContact O-N 3.32Å
884	I	90.6	Very high	89.1	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.2	-39.7	176	-169.7	166.8	0	0	0	110	M799 F875 L880 A881 M887 L888 I925 F935	M799-I884 HydrophobicContact SD-CB 4.03Å; F875-I884 HydrophobicContact CD1-CD1 3.41Å; F875-I884 VanDerWaalsContact CD1-CD1 3.41Å; F875-I884 HydrophobicContact CE1-CD1 3.84Å; F875-I884 HydrophobicContact CG-CD1 4.36Å; L880-I884 PolarHBondContact O-N 2.89Å; A881-I884 VanDerWaalsContact O-CG2 3.24Å; A881-I884 WeakPolarHBondContact O-CG2 3.35Å; A881-I884 PolarHBondContact O-N 3.18Å; I884-M887 HydrophobicContact CG1-CE 4.05Å; I884-M887 PolarHBondContact O-N 3.19Å; I884-L888 HydrophobicContact CD1-CD1 4.47Å; I884-L888 HydrophobicContact CG1-CD1 3.85Å; I884-L888 HydrophobicContact CG1-CG 4.1Å; I884-L888 WeakPolarHBondContact O-CB 3.41Å; I884-L888 WeakPolarHBondContact O-CG 3.45Å; I884-L888 PolarHBondContact O-N 2.89Å; I884-I925 HydrophobicContact CD1-CG2 4.36Å; I884-F935 HydrophobicContact CG2-CE2 4.42Å
885	I	92.4	Very high	89.1	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-53.2	176.6	-74.5	167.2	0	0	0	111.3	A881 E882 R883 M887 L888 N889 F935 T938 V939 D942	A881-I885 VanDerWaalsContact O-CB 3.24Å; A881-I885 WeakPolarHBondContact O-CB 3.34Å; A881-I885 WeakPolarHBondContact O-CD1 3.2Å; A881-I885 WeakPolarHBondContact O-CG1 3.34Å; A881-I885 PolarHBondContact O-N 3.3Å; E882-I885 PolarHBondContact O-N 3.02Å; R883-I885 VanDerWaalsContact C-N 3.28Å; R883-I885 PolarHBondContact O-N 2.76Å; I885-M887 VanDerWaalsContact C-N 3.27Å; I885-M887 PolarHBondContact O-N 3.17Å; I885-L888 PolarHBondContact O-N 3.24Å; I885-L888 VanDerWaalsContact O-N 3.16Å; I885-N889 WeakPolarHBondContact O-CB 3.18Å; I885-N889 PolarHBondContact O-N 2.79Å; I885-F935 HydrophobicContact CD1-CD2 3.83Å; I885-F935 HydrophobicContact CD1-CE2 3.76Å; I885-F935 HydrophobicContact CD1-CZ 4.4Å; I885-F935 HydrophobicContact CG1-CD2 4.1Å; I885-F935 HydrophobicContact CG1-CE2 3.48Å; I885-F935 VanDerWaalsContact CG1-CE2 3.48Å; I885-F935 HydrophobicContact CG1-CZ 3.93Å; I885-T938 HydrophobicContact CD1-CG2 3.57Å; I885-V939 HydrophobicContact CD1-CG2 3.88Å; I885-V939 HydrophobicContact CG1-CG2 3.99Å; I885-V939 HydrophobicContact CG2-CB 4.39Å; I885-V939 HydrophobicContact CG2-CG2 4.25Å; I885-D942 HydrophobicContact CG2-CB 4.26Å
886	S	90.7	Very high	89.1	Confident	46 Å²	46	20.8 Å²	20.8	32%	0.322	11%	0.105	S	C	.	.	H	α-helix	trans	-57.8	-42.3	179.4	-73.1	0	0	0	0	111.4	E882 Y890 D942	E882-S886 WeakPolarHBondContact O-CB 3.44Å; E882-S886 PolarHBondContact O-N 3.03Å; E882-S886 PolarHBondContact O-OG 3.36Å; S886-Y890 WeakPolarHBondContact O-CB 3.32Å; S886-Y890 PolarHBondContact O-N 3.2Å; S886-D942 PolarHBondContact OG-OD1 2.94Å
887	M	93.1	Very high	88.8	Confident	7 Å²	7	20.1 Å²	20.1	3%	0.034	10%	0.102	C	C	.	.	H	α-helix	trans	-60.7	-51.3	174.7	178.9	-165.4	75.3	0	0	111.8	A802 I803 I861 L864 R883 I884 I885 Y890 F891	A802-M887 HydrophobicContact CB-SD 3.65Å; I803-M887 HydrophobicContact CD1-CB 4.44Å; I803-M887 HydrophobicContact CD1-CG 4.44Å; I803-M887 HydrophobicContact CG1-CB 4.14Å; I803-M887 HydrophobicContact CG1-CG 3.68Å; I803-M887 HydrophobicContact CG1-SD 3.99Å; I861-M887 HydrophobicContact CD1-CE 4.34Å; L864-M887 HydrophobicContact CD1-CE 3.78Å; R883-M887 WeakPolarHBondContact O-CB 3.38Å; R883-M887 PolarHBondContact O-N 3.32Å; I884-M887 HydrophobicContact CG1-CE 4.05Å; I884-M887 PolarHBondContact O-N 3.19Å; I885-M887 VanDerWaalsContact C-N 3.27Å; I885-M887 PolarHBondContact O-N 3.17Å; M887-Y890 PolarHBondContact O-N 3.38Å; M887-F891 HydrophobicContact CG-CD2 3.64Å; M887-F891 HydrophobicContact CG-CE2 3.37Å; M887-F891 HydrophobicContact CG-CZ 4.5Å; M887-F891 WeakPolarHBondContact O-CD2 3.47Å; M887-F891 WeakPolarHBondContact O-CG 3.39Å; M887-F891 PolarHBondContact O-N 3.11Å; M887-F891 HydrophobicContact SD-CE2 4.3Å
888	L	94.4	Very high	88.5	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-43.5	-178.2	-67.6	171.9	0	0	0	111.9	I884 I885 L892 I922 I925 Y926	I884-L888 HydrophobicContact CD1-CD1 4.47Å; I884-L888 HydrophobicContact CG1-CD1 3.85Å; I884-L888 HydrophobicContact CG1-CG 4.1Å; I884-L888 WeakPolarHBondContact O-CB 3.41Å; I884-L888 WeakPolarHBondContact O-CG 3.45Å; I884-L888 PolarHBondContact O-N 2.89Å; I885-L888 PolarHBondContact O-N 3.24Å; I885-L888 VanDerWaalsContact O-N 3.16Å; L888-L892 WeakPolarHBondContact O-CB 3.42Å; L888-L892 PolarHBondContact O-N 2.81Å; L888-I922 HydrophobicContact CB-CG2 4.48Å; L888-I922 HydrophobicContact CD2-CG1 4.29Å; L888-I922 HydrophobicContact CD2-CG2 4.08Å; L888-I925 HydrophobicContact CD1-CB 4.34Å; L888-I925 HydrophobicContact CD1-CG2 3.58Å; L888-I925 HydrophobicContact CD2-CB 4.43Å; L888-I925 HydrophobicContact CD2-CD1 3.87Å; L888-I925 HydrophobicContact CD2-CG2 4.3Å; L888-Y926 HydrophobicContact CB-CE2 3.72Å; L888-Y926 VanDerWaalsContact CB-OH 3.26Å; L888-Y926 WeakPolarHBondContact CB-OH 3.38Å; L888-Y926 HydrophobicContact CD1-CE2 4.27Å
889	N	93.8	Very high	88.6	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.6	-49.4	176.5	-83.3	-23.2	0	0	0	111	I885 F891 L892 Q893 Y926 V939 D942	I885-N889 WeakPolarHBondContact O-CB 3.18Å; I885-N889 PolarHBondContact O-N 2.79Å; N889-F891 PolarHBondContact O-N 2.89Å; N889-L892 PolarHBondContact O-N 2.73Å; N889-Q893 VanDerWaalsContact O-CB 3.31Å; N889-Q893 WeakPolarHBondContact O-CB 3.46Å; N889-Q893 PolarHBondContact O-N 2.91Å; N889-Y926 PolarHBondContact N-OH 3.49Å; N889-Y926 VanDerWaalsContact N-OH 3.17Å; N889-Y926 PolarHBondContact OD1-OH 3.02Å; N889-V939 PolarHBondContact ND2-O 3.34Å; N889-D942 WeakPolarHBondContact CB-OD2 3.43Å; N889-D942 WeakPolarHBondContact ND2-CB 3.49Å; N889-D942 PolarHBondContact ND2-OD2 3.01Å
890	Y	91.8	Very high	89	Confident	66 Å²	66	29.6 Å²	29.6	26%	0.259	15%	0.151	S	C	.	.	H	α-helix	trans	-57	-50.5	180	171.2	-107.2	0	0	0	111.7	D807 S886 M887 Q893 H894 S945	D807-Y890 WeakPolarHBondContact OD1-CE1 3.37Å; D807-Y890 PolarHBondContact OD1-OH 2.96Å; S886-Y890 WeakPolarHBondContact O-CB 3.32Å; S886-Y890 PolarHBondContact O-N 3.2Å; M887-Y890 PolarHBondContact O-N 3.38Å; Y890-Q893 WeakPolarHBondContact O-CB 3.36Å; Y890-Q893 PolarHBondContact O-N 3.31Å; Y890-H894 AromaticContact CE2-CD2 3.73Å; Y890-H894 AromaticContact CE2-NE2 3.45Å; Y890-H894 WeakPolarHBondContact CE2-NE2 3.45Å; Y890-H894 AromaticContact CZ-NE2 3.85Å; Y890-H894 PolarHBondContact O-CD2 3.4Å; Y890-H894 PolarHBondContact O-N 2.99Å; Y890-S945 WeakPolarHBondContact CA-OG 3.25Å
891	F	91.6	Very high	88.9	Confident	1 Å²	1	31.2 Å²	31.2	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-69.2	-39.6	179.5	-66.9	-45.2	0	0	0	113.3	A802 L806 I810 M887 N889 Q893 H894 L895 I922	A802-F891 WeakPolarHBondContact O-CZ 3.25Å; L806-F891 HydrophobicContact CB-CD1 4.17Å; L806-F891 HydrophobicContact CB-CE1 3.59Å; L806-F891 HydrophobicContact CB-CE2 4.12Å; L806-F891 HydrophobicContact CB-CZ 3.55Å; L806-F891 HydrophobicContact CD2-CB 3.82Å; L806-F891 HydrophobicContact CD2-CD1 3.38Å; L806-F891 HydrophobicContact CD2-CD2 3.55Å; L806-F891 HydrophobicContact CD2-CE1 3.69Å; L806-F891 HydrophobicContact CD2-CE2 3.82Å; L806-F891 HydrophobicContact CD2-CG 3.31Å; L806-F891 HydrophobicContact CD2-CZ 3.88Å; L806-F891 HydrophobicContact CG-CD1 3.58Å; L806-F891 HydrophobicContact CG-CD2 4.44Å; L806-F891 HydrophobicContact CG-CE1 3.52Å; L806-F891 HydrophobicContact CG-CE2 4.36Å; L806-F891 HydrophobicContact CG-CG 4.07Å; L806-F891 HydrophobicContact CG-CZ 3.92Å; I810-F891 HydrophobicContact CD1-CD1 4.26Å; M887-F891 HydrophobicContact CG-CD2 3.64Å; M887-F891 HydrophobicContact CG-CE2 3.37Å; M887-F891 HydrophobicContact CG-CZ 4.5Å; M887-F891 WeakPolarHBondContact O-CD2 3.47Å; M887-F891 WeakPolarHBondContact O-CG 3.39Å; M887-F891 PolarHBondContact O-N 3.11Å; M887-F891 HydrophobicContact SD-CE2 4.3Å; N889-F891 PolarHBondContact O-N 2.89Å; F891-Q893 VanDerWaalsContact C-N 3.29Å; F891-Q893 PolarHBondContact O-N 3.12Å; F891-H894 PolarHBondContact O-N 3.36Å; F891-L895 VanDerWaalsContact O-CG 3.3Å; F891-L895 WeakPolarHBondContact O-CG 3.48Å; F891-L895 PolarHBondContact O-N 3.15Å; F891-I922 HydrophobicContact CB-CD1 4.06Å
892	L	92.9	Very high	88.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-42.7	175.7	-167.4	62.1	0	0	0	110.6	L888 N889 H894 L895 V896 I922 Y926 L950 F951 T954	L888-L892 WeakPolarHBondContact O-CB 3.42Å; L888-L892 PolarHBondContact O-N 2.81Å; N889-L892 PolarHBondContact O-N 2.73Å; L892-H894 VanDerWaalsContact C-N 3.29Å; L892-H894 PolarHBondContact O-N 2.79Å; L892-L895 PolarHBondContact O-N 2.85Å; L892-L895 VanDerWaalsContact O-N 3.1Å; L892-V896 HydrophobicContact CD1-CG1 3.87Å; L892-V896 HydrophobicContact CD1-CG2 4.49Å; L892-V896 HydrophobicContact CG-CG2 4.24Å; L892-V896 WeakPolarHBondContact O-CG2 3.39Å; L892-V896 PolarHBondContact O-N 3.39Å; L892-I922 HydrophobicContact CB-CG2 4.25Å; L892-I922 HydrophobicContact CD1-CG2 4.06Å; L892-I922 HydrophobicContact CD2-CG2 4.49Å; L892-Y926 HydrophobicContact CD2-CE2 4.02Å; L892-L950 HydrophobicContact CD2-CG 4.43Å; L892-L950 HydrophobicContact CG-CD1 4.35Å; L892-F951 HydrophobicContact CD2-CD1 4Å; L892-F951 HydrophobicContact CD2-CE1 3.81Å; L892-T954 HydrophobicContact CD1-CG2 4.06Å; L892-T954 HydrophobicContact CD2-CG2 4.3Å; L892-T954 WeakPolarHBondContact CD2-OG1 3.05Å
893	Q	92.4	Very high	88.8	Confident	50 Å²	50	31.1 Å²	31.1	23%	0.234	18%	0.175	C	C	.	.	H	α-helix	trans	-58.6	-39	176.1	-171.7	-170.5	46.6	0	0	112.3	N889 Y890 F891 G897 L950	N889-Q893 VanDerWaalsContact O-CB 3.31Å; N889-Q893 WeakPolarHBondContact O-CB 3.46Å; N889-Q893 PolarHBondContact O-N 2.91Å; Y890-Q893 WeakPolarHBondContact O-CB 3.36Å; Y890-Q893 PolarHBondContact O-N 3.31Å; F891-Q893 VanDerWaalsContact C-N 3.29Å; F891-Q893 PolarHBondContact O-N 3.12Å; Q893-G897 WeakPolarHBondContact O-CA 3.34Å; Q893-G897 PolarHBondContact O-N 2.97Å; Q893-L950 HydrophobicContact CB-CD1 4.07Å
894	H	90.6	Very high	88.9	Confident	18 Å²	18	36.6 Å²	36.6	8%	0.083	20%	0.199	C	C	.	.	H	α-helix	trans	-71	-32	176.1	-85.8	-110.4	0	0	0	113.2	I810 Y890 F891 L892 K899 M900	I810-H894 HydrophobicContact CD1-CB 3.92Å; Y890-H894 AromaticContact CE2-CD2 3.73Å; Y890-H894 AromaticContact CE2-NE2 3.45Å; Y890-H894 WeakPolarHBondContact CE2-NE2 3.45Å; Y890-H894 AromaticContact CZ-NE2 3.85Å; Y890-H894 PolarHBondContact O-CD2 3.4Å; Y890-H894 PolarHBondContact O-N 2.99Å; F891-H894 PolarHBondContact O-N 3.36Å; L892-H894 VanDerWaalsContact C-N 3.29Å; L892-H894 PolarHBondContact O-N 2.79Å; H894-K899 PolarHBondContact NE2-NZ 3.04Å; H894-M900 VanDerWaalsContact O-CA 3.3Å; H894-M900 WeakPolarHBondContact O-CA 3.26Å; H894-M900 PolarHBondContact O-N 2.87Å
895	L	90.7	Very high	88.8	Confident	16 Å²	16	37 Å²	37	8%	0.084	20%	0.202	C	C	.	.	H	α-helix	trans	-85.6	-34.5	-177	-67.1	167	0	0	0	114.2	F891 L892 M900 L903 F913 P915 L918 V919 I922	F891-L895 VanDerWaalsContact O-CG 3.3Å; F891-L895 WeakPolarHBondContact O-CG 3.48Å; F891-L895 PolarHBondContact O-N 3.15Å; L892-L895 PolarHBondContact O-N 2.85Å; L892-L895 VanDerWaalsContact O-N 3.1Å; L895-M900 VanDerWaalsContact O-CB 3.31Å; L895-M900 WeakPolarHBondContact O-CB 3.28Å; L895-L903 HydrophobicContact CD2-CD1 4.32Å; L895-F913 HydrophobicContact CD2-CZ 4.23Å; L895-P915 HydrophobicContact CD2-CB 4.4Å; L895-L918 HydrophobicContact CD1-CB 4.35Å; L895-L918 HydrophobicContact CD1-CD2 3.63Å; L895-L918 HydrophobicContact CD1-CG 3.81Å; L895-L918 HydrophobicContact CD2-CD2 4.03Å; L895-L918 HydrophobicContact CG-CD2 4.42Å; L895-V919 HydrophobicContact CB-CG2 3.73Å; L895-V919 HydrophobicContact CD1-CG2 3.97Å; L895-V919 HydrophobicContact CG-CG2 4.37Å; L895-I922 HydrophobicContact CD1-CD1 3.75Å
896	V	90.6	Very high	88.5	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.03	23%	0.229	C	C	.	.	H	α-helix	trans	-115.8	-15.7	-175.4	-46.1	0	0	0	0	113.8	L892 V919 L950 Q953 V957	L892-V896 HydrophobicContact CD1-CG1 3.87Å; L892-V896 HydrophobicContact CD1-CG2 4.49Å; L892-V896 HydrophobicContact CG-CG2 4.24Å; L892-V896 WeakPolarHBondContact O-CG2 3.39Å; L892-V896 PolarHBondContact O-N 3.39Å; V896-V919 HydrophobicContact CG1-CG1 4.29Å; V896-V919 HydrophobicContact CG1-CG2 4.09Å; V896-L950 HydrophobicContact CG2-CD1 3.65Å; V896-Q953 HydrophobicContact CG2-CB 4.13Å; V896-V957 HydrophobicContact CB-CG2 3.89Å; V896-V957 HydrophobicContact CG1-CB 4.16Å; V896-V957 HydrophobicContact CG1-CG1 4.26Å; V896-V957 HydrophobicContact CG1-CG2 4.03Å
897	G	85.2	Confident	88.3	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.031	23%	0.232	C	C	.	.	S	Bend	trans	-85.7	-168.6	-176.6	0	0	0	0	0	114.1	Q893 K899 M900	Q893-G897 WeakPolarHBondContact O-CA 3.34Å; Q893-G897 PolarHBondContact O-N 2.97Å; G897-K899 PolarHBondContact O-N 3.42Å; G897-K899 VanDerWaalsContact O-N 3.15Å; G897-M900 WeakPolarHBondContact O-CB 3.28Å; G897-M900 VanDerWaalsContact O-CG 3.23Å; G897-M900 WeakPolarHBondContact O-CG 3.39Å; G897-M900 PolarHBondContact O-N 3.45Å; G897-M900 VanDerWaalsContact O-N 3.09Å
898	P	80.9	Confident	88.2	Confident	119 Å²	119	48 Å²	48	77%	0.773	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-63.2	-25.9	-173.8	25.3	-34.2	0	0	0	113.3	M900	P898-M900 VanDerWaalsContact C-N 3.3Å; P898-M900 PolarHBondContact O-N 3.48Å
899	K	81.1	Confident	87.9	Confident	110 Å²	110	52.1 Å²	52.1	48%	0.478	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-75.5	-12.1	179	-67.2	177.9	176.8	170.5	0	113.6	H894 G897 G901 A902	H894-K899 PolarHBondContact NE2-NZ 3.04Å; G897-K899 PolarHBondContact O-N 3.42Å; G897-K899 VanDerWaalsContact O-N 3.15Å; K899-G901 PolarHBondContact O-N 3Å; K899-A902 WeakPolarHBondContact O-CB 3.19Å; K899-A902 PolarHBondContact O-N 3.35Å
900	M	84.4	Confident	87.6	Confident	96 Å²	96	57.4 Å²	57.4	47%	0.473	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-56.9	-29.2	-176.9	74.8	175.5	175.3	0	0	113	H894 L895 G897 P898 A902 L903	H894-M900 VanDerWaalsContact O-CA 3.3Å; H894-M900 WeakPolarHBondContact O-CA 3.26Å; H894-M900 PolarHBondContact O-N 2.87Å; L895-M900 VanDerWaalsContact O-CB 3.31Å; L895-M900 WeakPolarHBondContact O-CB 3.28Å; G897-M900 WeakPolarHBondContact O-CB 3.28Å; G897-M900 VanDerWaalsContact O-CG 3.23Å; G897-M900 WeakPolarHBondContact O-CG 3.39Å; G897-M900 PolarHBondContact O-N 3.45Å; G897-M900 VanDerWaalsContact O-N 3.09Å; P898-M900 VanDerWaalsContact C-N 3.3Å; P898-M900 PolarHBondContact O-N 3.48Å; M900-A902 PolarHBondContact O-N 3.07Å; M900-L903 PolarHBondContact O-N 3.37Å
901	G	81.8	Confident	87.6	Confident	36 Å²	36	54.4 Å²	54.4	37%	0.371	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-60.9	-33.1	177.1	0	0	0	0	0	112.8	K817 K899 L903 K904	K817-G901 PolarHBondContact NZ-O 2.98Å; K899-G901 PolarHBondContact O-N 3Å; G901-L903 PolarHBondContact O-N 2.45Å; G901-K904 WeakPolarHBondContact O-CB 3.46Å; G901-K904 PolarHBondContact O-N 3.35Å
902	A	83.1	Confident	87.6	Confident	39 Å²	39	56 Å²	56	32%	0.322	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-66	-22.3	179.5	0	0	0	0	0	113.1	K817 K899 M900	K817-A902 WeakPolarHBondContact CD-O 3.38Å; K899-A902 WeakPolarHBondContact O-CB 3.19Å; K899-A902 PolarHBondContact O-N 3.35Å; M900-A902 PolarHBondContact O-N 3.07Å
903	L	86.9	Confident	87.6	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.042	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-87.7	-4.9	-179.9	-56.1	177.6	0	0	0	113.3	I810 L813 L895 M900 G901 V905 F913	I810-L903 HydrophobicContact CB-CD2 4.16Å; I810-L903 HydrophobicContact CG1-CD1 4.42Å; I810-L903 HydrophobicContact CG1-CD2 4.02Å; I810-L903 HydrophobicContact CG2-CD2 3.97Å; L813-L903 HydrophobicContact CB-CD2 4.3Å; L895-L903 HydrophobicContact CD2-CD1 4.32Å; M900-L903 PolarHBondContact O-N 3.37Å; G901-L903 PolarHBondContact O-N 2.45Å; L903-V905 PolarHBondContact O-N 2.99Å; L903-F913 HydrophobicContact CB-CE1 4.23Å; L903-F913 HydrophobicContact CB-CZ 4.33Å; L903-F913 HydrophobicContact CD1-CZ 4.33Å
904	K	88.3	Confident	87.6	Confident	148 Å²	148	59.7 Å²	59.7	64%	0.643	31%	0.313	S	S	*	.			trans	-79.8	90.4	-177.6	-167.4	179.6	-179.4	-174.7	0	111.4	K817 G901 F908	K817-K904 WeakPolarHBondContact CD-O 3.28Å; K817-K904 WeakPolarHBondContact CE-O 3.44Å; G901-K904 WeakPolarHBondContact O-CB 3.46Å; G901-K904 PolarHBondContact O-N 3.35Å; K904-F908 HydrophobicContact CG-CZ 4.42Å
905	V	88.9	Confident	87.6	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.055	32%	0.317	C	S	.	.			trans	-85.3	166.9	167.3	-62.9	0	0	0	0	111.3	L813 I816 K817 L903 F908 F911	L813-V905 HydrophobicContact CD2-CG1 4.02Å; L813-V905 HydrophobicContact CD2-CG2 4.15Å; I816-V905 HydrophobicContact CB-CG1 4.39Å; I816-V905 HydrophobicContact CG2-CG1 3.95Å; K817-V905 HydrophobicContact CB-CG1 4.18Å; L903-V905 PolarHBondContact O-N 2.99Å; V905-F908 HydrophobicContact CG2-CD1 3.6Å; V905-F908 HydrophobicContact CG2-CE1 3.91Å; V905-F911 HydrophobicContact CB-CD2 4.43Å; V905-F911 HydrophobicContact CB-CE2 4.16Å; V905-F911 HydrophobicContact CG2-CD2 3.76Å; V905-F911 HydrophobicContact CG2-CE2 3.94Å
906	K	85.8	Confident	87.7	Confident	133 Å²	133	65 Å²	65	58%	0.578	34%	0.339	S	S	*	.	S	Bend	trans	-61.9	-48.3	-176.8	-71.8	-178.4	178.5	-176.5	0	113.6	D824	D824-K906 IonicContact OD1-NZ 2.96Å; D824-K906 PolarHBondContact OD1-NZ 3.34Å; D824-K906 WeakPolarHBondContact OD2-CE 3.16Å; D824-K906 IonicContact OD2-NZ 3.33Å; D824-K906 PolarHBondContact OD2-NZ 3.23Å
907	D	87	Confident	87.8	Confident	71 Å²	71	68.7 Å²	68.7	38%	0.38	36%	0.356	S	S	.	.			trans	-127	115.1	-179.1	-171.1	-12.4	0	0	0	109.6	S909 E910 F911	D907-S909 VanDerWaalsContact C-N 3.34Å; D907-S909 VanDerWaalsContact CG-OG 3.29Å; D907-S909 WeakPolarHBondContact OD1-CA 3.47Å; D907-S909 WeakPolarHBondContact OD1-CB 3.28Å; D907-S909 PolarHBondContact OD1-N 3.39Å; D907-S909 PolarHBondContact OD1-OG 3.34Å; D907-S909 PolarHBondContact OD2-OG 3.08Å; D907-E910 HydrophobicContact CB-CB 4.09Å; D907-E910 PolarHBondContact OD1-N 2.79Å; D907-F911 WeakPolarHBondContact O-CD2 3.38Å; D907-F911 WeakPolarHBondContact O-CE2 3.48Å
908	F	89.8	Confident	88.2	Confident	81 Å²	81	68.7 Å²	68.7	36%	0.355	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-28.4	176.8	-69.2	-20.7	0	0	0	112.7	K904 V905 F911 D912 F913 P915	K904-F908 HydrophobicContact CG-CZ 4.42Å; V905-F908 HydrophobicContact CG2-CD1 3.6Å; V905-F908 HydrophobicContact CG2-CE1 3.91Å; F908-F911 PolarHBondContact O-N 3.17Å; F908-D912 PolarHBondContact O-N 2.92Å; F908-F913 WeakPolarHBondContact CB-O 3.28Å; F908-F913 AromaticContact CD1-CD1 3.82Å; F908-F913 HydrophobicContact CD1-CD1 3.82Å; F908-F913 HydrophobicContact CE1-CD1 4Å; F908-F913 HydrophobicContact CE1-CE1 4.32Å; F908-F913 HydrophobicContact CG-CD1 4.24Å; F908-F913 PolarHBondContact O-N 3.27Å; F908-P915 HydrophobicContact CD2-CG 4.3Å; F908-P915 HydrophobicContact CE2-CG 4.13Å
909	S	89.2	Confident	88.8	Confident	85 Å²	85	63.1 Å²	63.1	59%	0.594	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-35	-177.1	72	0	0	0	0	112.2	D907 F911 D912	D907-S909 VanDerWaalsContact C-N 3.34Å; D907-S909 VanDerWaalsContact CG-OG 3.29Å; D907-S909 WeakPolarHBondContact OD1-CA 3.47Å; D907-S909 WeakPolarHBondContact OD1-CB 3.28Å; D907-S909 PolarHBondContact OD1-N 3.39Å; D907-S909 PolarHBondContact OD1-OG 3.34Å; D907-S909 PolarHBondContact OD2-OG 3.08Å; S909-F911 PolarHBondContact O-N 3.32Å; S909-D912 PolarHBondContact O-N 3.34Å; S909-D912 VanDerWaalsContact O-N 3.13Å
910	E	86.7	Confident	89.4	Confident	111 Å²	111	58.4 Å²	58.4	52%	0.519	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-37.2	175	-172.6	-176.8	172.8	0	0	112.1	D907	D907-E910 HydrophobicContact CB-CB 4.09Å; D907-E910 PolarHBondContact OD1-N 2.79Å
911	F	91.2	Very high	90	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.018	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	14.1	-176.5	-46.2	-65.8	0	0	0	113.5	L813 I816 R851 N854 V905 D907 F908 S909 F913	L813-F911 HydrophobicContact CD2-CB 4.3Å; L813-F911 HydrophobicContact CD2-CD2 4.38Å; L813-F911 HydrophobicContact CD2-CG 4.47Å; I816-F911 HydrophobicContact CD1-CD1 4.11Å; I816-F911 HydrophobicContact CD1-CE1 4.02Å; I816-F911 HydrophobicContact CD1-CZ 4.38Å; I816-F911 HydrophobicContact CG2-CE1 4.48Å; I816-F911 HydrophobicContact CG2-CE2 4.12Å; I816-F911 HydrophobicContact CG2-CZ 3.85Å; R851-F911 WeakPolarHBondContact CA-O 3.45Å; N854-F911 WeakPolarHBondContact CB-O 3.49Å; N854-F911 PolarHBondContact ND2-O 2.8Å; V905-F911 HydrophobicContact CB-CD2 4.43Å; V905-F911 HydrophobicContact CB-CE2 4.16Å; V905-F911 HydrophobicContact CG2-CD2 3.76Å; V905-F911 HydrophobicContact CG2-CE2 3.94Å; D907-F911 WeakPolarHBondContact O-CD2 3.38Å; D907-F911 WeakPolarHBondContact O-CE2 3.48Å; F908-F911 PolarHBondContact O-N 3.17Å; S909-F911 PolarHBondContact O-N 3.32Å; F911-F913 PolarHBondContact O-N 3.16Å
912	D	91.3	Very high	90.6	Very high	33 Å²	33	53.1 Å²	53.1	18%	0.176	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	28.9	-175.5	-84	-64.8	0	0	0	114	R851 I855 F908 S909 K914	R851-D912 HydrophobicContact CG-CB 4.05Å; R851-D912 IonicContact CZ-OD2 3.14Å; R851-D912 VanDerWaalsContact CZ-OD2 3.3Å; R851-D912 IonicContact NE-OD2 3.78Å; R851-D912 PolarHBondContact NE-OD2 3.04Å; R851-D912 IonicContact NH2-OD2 2.76Å; R851-D912 PolarHBondContact NH2-OD2 2.71Å; I855-D912 HydrophobicContact CD1-CB 4.21Å; I855-D912 HydrophobicContact CG1-CB 3.7Å; F908-D912 PolarHBondContact O-N 2.92Å; S909-D912 PolarHBondContact O-N 3.34Å; S909-D912 VanDerWaalsContact O-N 3.13Å; D912-K914 PolarHBondContact O-N 2.98Å
913	F	94.1	Very high	91.3	Very high	11 Å²	11	51.3 Å²	51.3	5%	0.048	25%	0.25	C	S	.	.			trans	-82.4	110.5	-179.3	-176.5	-130.8	0	0	0	110	L813 N854 L895 L903 F908 F911 P915	L813-F913 HydrophobicContact CD1-CB 4.39Å; L813-F913 HydrophobicContact CD1-CD1 3.92Å; L813-F913 HydrophobicContact CD1-CD2 3.68Å; L813-F913 HydrophobicContact CD1-CE1 4.06Å; L813-F913 HydrophobicContact CD1-CE2 3.84Å; L813-F913 HydrophobicContact CD1-CG 3.73Å; L813-F913 HydrophobicContact CD1-CZ 4.01Å; N854-F913 WeakPolarHBondContact OD1-CD2 3.49Å; L895-F913 HydrophobicContact CD2-CZ 4.23Å; L903-F913 HydrophobicContact CB-CE1 4.23Å; L903-F913 HydrophobicContact CB-CZ 4.33Å; L903-F913 HydrophobicContact CD1-CZ 4.33Å; F908-F913 WeakPolarHBondContact CB-O 3.28Å; F908-F913 AromaticContact CD1-CD1 3.82Å; F908-F913 HydrophobicContact CD1-CD1 3.82Å; F908-F913 HydrophobicContact CE1-CD1 4Å; F908-F913 HydrophobicContact CE1-CE1 4.32Å; F908-F913 HydrophobicContact CG-CD1 4.24Å; F908-F913 PolarHBondContact O-N 3.27Å; F911-F913 PolarHBondContact O-N 3.16Å; F913-P915 HydrophobicContact CD1-CB 4.5Å; F913-P915 HydrophobicContact CD1-CG 4.02Å; F913-P915 HydrophobicContact CE1-CB 3.81Å; F913-P915 HydrophobicContact CE1-CG 3.7Å; F913-P915 HydrophobicContact CE2-CB 4.23Å; F913-P915 HydrophobicContact CZ-CB 3.66Å; F913-P915 HydrophobicContact CZ-CG 4.08Å; F913-P915 WeakPolarHBondContact O-CD 3.3Å
914	K	92.9	Very high	91.7	Very high	117 Å²	117	52.9 Å²	52.9	51%	0.509	26%	0.26	S	S	.	.			trans	-114	65.6	-176.5	-62.9	177.5	-174.3	172.3	0	111.3	D912 Q916 Q917 L918	D912-K914 PolarHBondContact O-N 2.98Å; K914-Q916 PolarHBondContact O-N 3.13Å; K914-Q916 VanDerWaalsContact O-N 3.13Å; K914-Q917 HydrophobicContact CB-CB 4.11Å; K914-Q917 PolarHBondContact O-N 2.99Å; K914-L918 PolarHBondContact O-N 3.11Å
915	P	90.9	Very high	92.1	Very high	27 Å²	27	45.9 Å²	45.9	18%	0.175	23%	0.23	C	C	.	.	H	α-helix	trans	-60.5	-31.3	-172.3	23.1	-33.3	0	0	0	113.2	L895 F908 F913 L918 V919	L895-P915 HydrophobicContact CD2-CB 4.4Å; F908-P915 HydrophobicContact CD2-CG 4.3Å; F908-P915 HydrophobicContact CE2-CG 4.13Å; F913-P915 HydrophobicContact CD1-CB 4.5Å; F913-P915 HydrophobicContact CD1-CG 4.02Å; F913-P915 HydrophobicContact CE1-CB 3.81Å; F913-P915 HydrophobicContact CE1-CG 3.7Å; F913-P915 HydrophobicContact CE2-CB 4.23Å; F913-P915 HydrophobicContact CZ-CB 3.66Å; F913-P915 HydrophobicContact CZ-CG 4.08Å; F913-P915 WeakPolarHBondContact O-CD 3.3Å; P915-L918 PolarHBondContact O-N 3.14Å; P915-V919 WeakPolarHBondContact O-CB 3.49Å; P915-V919 VanDerWaalsContact O-CG2 3.27Å; P915-V919 WeakPolarHBondContact O-CG2 3.45Å; P915-V919 PolarHBondContact O-N 2.99Å
916	Q	91.4	Very high	92.4	Very high	118 Å²	118	45.4 Å²	45.4	55%	0.551	23%	0.227	S	C	*	.	H	α-helix	trans	-66	-38.8	178.3	-53.6	-176.4	-0	0	0	112.2	K914 S920 I961	K914-Q916 PolarHBondContact O-N 3.13Å; K914-Q916 VanDerWaalsContact O-N 3.13Å; Q916-S920 WeakPolarHBondContact O-CB 3.28Å; Q916-S920 PolarHBondContact O-N 3.49Å; Q916-I961 HydrophobicContact CB-CB 4.33Å; Q916-I961 HydrophobicContact CB-CD1 4.19Å; Q916-I961 HydrophobicContact CB-CG2 4.16Å; Q916-I961 HydrophobicContact CG-CB 4.25Å; Q916-I961 HydrophobicContact CG-CG2 3.71Å; Q916-I961 WeakPolarHBondContact O-CD1 3.33Å
917	Q	92.3	Very high	92.9	Very high	84 Å²	84	41 Å²	41	39%	0.393	21%	0.21	S	C	.	.	H	α-helix	trans	-71.4	-46.7	176.7	-175.8	56.8	33.9	0	0	109.9	K914 V919 S920 D921	K914-Q917 HydrophobicContact CB-CB 4.11Å; K914-Q917 PolarHBondContact O-N 2.99Å; Q917-V919 PolarHBondContact O-N 2.87Å; Q917-S920 CarbonylContact O-C 3.57Å; Q917-S920 WeakPolarHBondContact O-CA 3.39Å; Q917-S920 WeakPolarHBondContact O-CB 3.26Å; Q917-S920 PolarHBondContact O-N 3.48Å; Q917-D921 WeakPolarHBondContact CG-OD2 3.12Å; Q917-D921 PolarHBondContact NE2-OD1 3.18Å; Q917-D921 PolarHBondContact NE2-OD2 3.35Å; Q917-D921 PolarHBondContact O-N 3.05Å
918	L	93.3	Very high	93.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-58.2	-45.2	179	-168	64.5	0	0	0	112.7	L806 I861 L895 K914 P915 S920 D921 I922	L806-L918 HydrophobicContact CD1-CD2 3.68Å; L806-L918 HydrophobicContact CD2-CD1 4.49Å; L806-L918 HydrophobicContact CD2-CD2 3.97Å; I861-L918 HydrophobicContact CB-CD1 3.86Å; I861-L918 HydrophobicContact CG1-CD1 3.76Å; I861-L918 HydrophobicContact CG2-CD1 3.94Å; L895-L918 HydrophobicContact CD1-CB 4.35Å; L895-L918 HydrophobicContact CD1-CD2 3.63Å; L895-L918 HydrophobicContact CD1-CG 3.81Å; L895-L918 HydrophobicContact CD2-CD2 4.03Å; L895-L918 HydrophobicContact CG-CD2 4.42Å; K914-L918 PolarHBondContact O-N 3.11Å; P915-L918 PolarHBondContact O-N 3.14Å; L918-S920 VanDerWaalsContact C-N 3.31Å; L918-S920 PolarHBondContact O-N 3.29Å; L918-D921 PolarHBondContact O-N 2.8Å; L918-I922 HydrophobicContact CG-CD1 4.21Å; L918-I922 WeakPolarHBondContact O-CB 3.14Å; L918-I922 VanDerWaalsContact O-CG1 3.3Å; L918-I922 WeakPolarHBondContact O-CG1 3.37Å; L918-I922 PolarHBondContact O-N 2.93Å
919	V	94.4	Very high	93.6	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.018	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-41.5	173.5	171.1	0	0	0	0	111	L895 V896 P915 Q917 C923 V957 L958	L895-V919 HydrophobicContact CB-CG2 3.73Å; L895-V919 HydrophobicContact CD1-CG2 3.97Å; L895-V919 HydrophobicContact CG-CG2 4.37Å; V896-V919 HydrophobicContact CG1-CG1 4.29Å; V896-V919 HydrophobicContact CG1-CG2 4.09Å; P915-V919 WeakPolarHBondContact O-CB 3.49Å; P915-V919 VanDerWaalsContact O-CG2 3.27Å; P915-V919 WeakPolarHBondContact O-CG2 3.45Å; P915-V919 PolarHBondContact O-N 2.99Å; Q917-V919 PolarHBondContact O-N 2.87Å; V919-C923 WeakPolarHBondContact O-CB 3.29Å; V919-C923 PolarHBondContact O-N 3Å; V919-C923 PolarHBondContact O-SG 3.48Å; V919-V957 HydrophobicContact CG1-CG1 4.31Å; V919-L958 HydrophobicContact CG1-CD2 4.2Å
920	S	94.6	Very high	93.7	Very high	10 Å²	10	31.4 Å²	31.4	7%	0.07	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-46	177.1	-164.6	0	0	0	0	112.1	Q916 Q917 L918 C923 T924 K963 M967	Q916-S920 WeakPolarHBondContact O-CB 3.28Å; Q916-S920 PolarHBondContact O-N 3.49Å; Q917-S920 CarbonylContact O-C 3.57Å; Q917-S920 WeakPolarHBondContact O-CA 3.39Å; Q917-S920 WeakPolarHBondContact O-CB 3.26Å; Q917-S920 PolarHBondContact O-N 3.48Å; L918-S920 VanDerWaalsContact C-N 3.31Å; L918-S920 PolarHBondContact O-N 3.29Å; S920-C923 PolarHBondContact O-N 3.45Å; S920-T924 WeakPolarHBondContact O-CB 3.46Å; S920-T924 PolarHBondContact O-N 3.45Å; S920-T924 PolarHBondContact O-OG1 3.42Å; S920-K963 VanDerWaalsContact OG-CE 3.28Å; S920-K963 WeakPolarHBondContact OG-CE 3.33Å; S920-K963 PolarHBondContact OG-NZ 2.98Å; S920-M967 WeakPolarHBondContact O-CE 3.37Å
921	D	95.6	Very high	93.7	Very high	22 Å²	22	31.3 Å²	31.3	12%	0.118	16%	0.159	C	C	.	.	H	α-helix	trans	-70.6	-42.5	-176.2	-66	-25.3	0	0	0	110.9	I861 A865 Q917 L918 C923 T924 I925	I861-D921 HydrophobicContact CG2-CB 3.72Å; A865-D921 HydrophobicContact CB-CB 4.2Å; Q917-D921 WeakPolarHBondContact CG-OD2 3.12Å; Q917-D921 PolarHBondContact NE2-OD1 3.18Å; Q917-D921 PolarHBondContact NE2-OD2 3.35Å; Q917-D921 PolarHBondContact O-N 3.05Å; L918-D921 PolarHBondContact O-N 2.8Å; D921-C923 VanDerWaalsContact C-N 3.34Å; D921-C923 PolarHBondContact O-N 3.01Å; D921-T924 WeakPolarHBondContact O-CB 3.36Å; D921-T924 PolarHBondContact O-N 2.97Å; D921-T924 VanDerWaalsContact O-N 3.11Å; D921-I925 WeakPolarHBondContact O-CG1 3.42Å; D921-I925 PolarHBondContact O-N 3.4Å
922	I	96.1	Very high	93.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.7	-46.9	172.1	-69.2	169.7	0	0	0	110.8	I861 L888 F891 L892 L895 L918 T924 I925 Y926	I861-I922 HydrophobicContact CG2-CG1 4.05Å; L888-I922 HydrophobicContact CB-CG2 4.48Å; L888-I922 HydrophobicContact CD2-CG1 4.29Å; L888-I922 HydrophobicContact CD2-CG2 4.08Å; F891-I922 HydrophobicContact CB-CD1 4.06Å; L892-I922 HydrophobicContact CB-CG2 4.25Å; L892-I922 HydrophobicContact CD1-CG2 4.06Å; L892-I922 HydrophobicContact CD2-CG2 4.49Å; L895-I922 HydrophobicContact CD1-CD1 3.75Å; L918-I922 HydrophobicContact CG-CD1 4.21Å; L918-I922 WeakPolarHBondContact O-CB 3.14Å; L918-I922 VanDerWaalsContact O-CG1 3.3Å; L918-I922 WeakPolarHBondContact O-CG1 3.37Å; L918-I922 PolarHBondContact O-N 2.93Å; I922-T924 VanDerWaalsContact C-N 3.28Å; I922-T924 PolarHBondContact O-N 3Å; I922-I925 PolarHBondContact O-N 2.99Å; I922-Y926 HydrophobicContact CG2-CD2 3.99Å; I922-Y926 HydrophobicContact CG2-CE2 3.78Å; I922-Y926 VanDerWaalsContact O-CD2 3.28Å; I922-Y926 WeakPolarHBondContact O-CD2 3.37Å; I922-Y926 PolarHBondContact O-N 3.38Å; I922-Y926 VanDerWaalsContact O-N 3.15Å
923	C	95.9	Very high	93.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-34.7	177.6	-66.7	0	0	0	0	112.1	V919 S920 D921 Y926 L927 T954 M967 F971	V919-C923 WeakPolarHBondContact O-CB 3.29Å; V919-C923 PolarHBondContact O-N 3Å; V919-C923 PolarHBondContact O-SG 3.48Å; S920-C923 PolarHBondContact O-N 3.45Å; D921-C923 VanDerWaalsContact C-N 3.34Å; D921-C923 PolarHBondContact O-N 3.01Å; C923-Y926 PolarHBondContact O-N 3.07Å; C923-L927 VanDerWaalsContact O-CG 3.28Å; C923-L927 WeakPolarHBondContact O-CG 3.34Å; C923-L927 PolarHBondContact O-N 3.47Å; C923-T954 WeakPolarHBondContact SG-CG2 3.32Å; C923-M967 HydrophobicContact CB-CE 3.54Å; C923-F971 HydrophobicContact CB-CD2 3.92Å; C923-F971 HydrophobicContact CB-CE2 3.88Å
924	T	96	Very high	93	Very high	42 Å²	42	42.6 Å²	42.6	26%	0.258	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-41.6	176.1	-57.1	0	0	0	0	110.8	S920 D921 I922 Y926 L927 N928	S920-T924 WeakPolarHBondContact O-CB 3.46Å; S920-T924 PolarHBondContact O-N 3.45Å; S920-T924 PolarHBondContact O-OG1 3.42Å; D921-T924 WeakPolarHBondContact O-CB 3.36Å; D921-T924 PolarHBondContact O-N 2.97Å; D921-T924 VanDerWaalsContact O-N 3.11Å; I922-T924 VanDerWaalsContact C-N 3.28Å; I922-T924 PolarHBondContact O-N 3Å; T924-Y926 PolarHBondContact O-N 3.05Å; T924-L927 PolarHBondContact O-N 2.87Å; T924-N928 WeakPolarHBondContact O-CB 2.92Å; T924-N928 PolarHBondContact O-N 2.84Å; T924-N928 PolarHBondContact O-ND2 3.31Å; T924-N928 PolarHBondContact O-OD1 2.98Å
925	I	96.7	Very high	92.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-47.3	174.5	-64.4	163	0	0	0	110.9	I861 L864 A865 T868 I884 L888 D921 I922 L927 N928 L929	I861-I925 HydrophobicContact CG2-CD1 4.29Å; L864-I925 HydrophobicContact CB-CD1 3.78Å; A865-I925 HydrophobicContact CB-CD1 4.36Å; A865-I925 HydrophobicContact CB-CG1 3.95Å; T868-I925 HydrophobicContact CG2-CG2 4.08Å; I884-I925 HydrophobicContact CD1-CG2 4.36Å; L888-I925 HydrophobicContact CD1-CB 4.34Å; L888-I925 HydrophobicContact CD1-CG2 3.58Å; L888-I925 HydrophobicContact CD2-CB 4.43Å; L888-I925 HydrophobicContact CD2-CD1 3.87Å; L888-I925 HydrophobicContact CD2-CG2 4.3Å; D921-I925 WeakPolarHBondContact O-CG1 3.42Å; D921-I925 PolarHBondContact O-N 3.4Å; I922-I925 PolarHBondContact O-N 2.99Å; I925-L927 VanDerWaalsContact C-N 3.3Å; I925-L927 PolarHBondContact O-N 3.34Å; I925-N928 PolarHBondContact O-N 3.41Å; I925-L929 HydrophobicContact CG2-CD1 4.01Å; I925-L929 WeakPolarHBondContact O-CG 3.47Å; I925-L929 PolarHBondContact O-N 3.29Å; I925-L929 VanDerWaalsContact O-N 3.15Å
926	Y	96.1	Very high	92.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.6	-42.5	175.2	-84.5	-69.3	0	0	0	112.5	L888 N889 L892 I922 C923 T924 G930 F935 V939 F951 F971 L974	L888-Y926 HydrophobicContact CB-CE2 3.72Å; L888-Y926 VanDerWaalsContact CB-OH 3.26Å; L888-Y926 WeakPolarHBondContact CB-OH 3.38Å; L888-Y926 HydrophobicContact CD1-CE2 4.27Å; N889-Y926 PolarHBondContact N-OH 3.49Å; N889-Y926 VanDerWaalsContact N-OH 3.17Å; N889-Y926 PolarHBondContact OD1-OH 3.02Å; L892-Y926 HydrophobicContact CD2-CE2 4.02Å; I922-Y926 HydrophobicContact CG2-CD2 3.99Å; I922-Y926 HydrophobicContact CG2-CE2 3.78Å; I922-Y926 VanDerWaalsContact O-CD2 3.28Å; I922-Y926 WeakPolarHBondContact O-CD2 3.37Å; I922-Y926 PolarHBondContact O-N 3.38Å; I922-Y926 VanDerWaalsContact O-N 3.15Å; C923-Y926 PolarHBondContact O-N 3.07Å; T924-Y926 PolarHBondContact O-N 3.05Å; Y926-G930 VanDerWaalsContact O-CA 3.26Å; Y926-G930 WeakPolarHBondContact O-CA 3.19Å; Y926-G930 PolarHBondContact O-N 3.07Å; Y926-F935 AromaticContact CD1-CE1 3.95Å; Y926-F935 HydrophobicContact CD1-CE1 3.95Å; Y926-F935 HydrophobicContact CD1-CZ 4.07Å; Y926-F935 HydrophobicContact CE1-CE1 4.42Å; Y926-F935 HydrophobicContact CE1-CZ 4.25Å; Y926-V939 HydrophobicContact CE1-CG1 4.45Å; Y926-V939 HydrophobicContact CE1-CG2 4.11Å; Y926-F951 HydrophobicContact CD1-CZ 4.34Å; Y926-F951 HydrophobicContact CE1-CE1 4.49Å; Y926-F951 AromaticContact CE1-CZ 3.95Å; Y926-F951 HydrophobicContact CE1-CZ 3.95Å; Y926-F951 HydrophobicContact CE2-CE1 4.48Å; Y926-F971 HydrophobicContact CD2-CE2 4.28Å; Y926-F971 HydrophobicContact CG-CE2 4.25Å; Y926-L974 VanDerWaalsContact O-CD2 3.28Å; Y926-L974 WeakPolarHBondContact O-CD2 3.47Å
927	L	95.8	Very high	92.6	Very high	40 Å²	40	31.4 Å²	31.4	21%	0.209	17%	0.166	C	C	.	.	H	α-helix	trans	-67.5	-41	178.9	-70.7	172.7	0	0	0	112.2	C923 T924 I925 L929 G930 M967 A970 F971 L974	C923-L927 VanDerWaalsContact O-CG 3.28Å; C923-L927 WeakPolarHBondContact O-CG 3.34Å; C923-L927 PolarHBondContact O-N 3.47Å; T924-L927 PolarHBondContact O-N 2.87Å; I925-L927 VanDerWaalsContact C-N 3.3Å; I925-L927 PolarHBondContact O-N 3.34Å; L927-L929 VanDerWaalsContact C-N 3.31Å; L927-L929 PolarHBondContact O-N 3.01Å; L927-G930 PolarHBondContact O-N 2.56Å; L927-M967 HydrophobicContact CD1-CE 4.22Å; L927-M967 HydrophobicContact CD1-CG 3.76Å; L927-A970 HydrophobicContact CD2-CB 3.77Å; L927-F971 HydrophobicContact CD2-CB 4.21Å; L927-F971 HydrophobicContact CD2-CD2 4.28Å; L927-F971 HydrophobicContact CG-CD2 4.21Å; L927-L974 HydrophobicContact CD2-CD2 4.22Å
928	N	95.5	Very high	92.4	Very high	31 Å²	31	27.7 Å²	27.7	17%	0.166	15%	0.149	C	C	.	.	H	α-helix	trans	-61.4	-40.6	179.3	-70.4	-15.2	0	0	0	112.2	A865 T868 S869 K872 T924 I925	A865-N928 PolarHBondContact O-ND2 2.93Å; T868-N928 WeakPolarHBondContact O-CB 3.24Å; T868-N928 PolarHBondContact OG1-ND2 3.46Å; S869-N928 PolarHBondContact N-ND2 3.38Å; K872-N928 WeakPolarHBondContact CE-O 3.32Å; K872-N928 PolarHBondContact NZ-O 3.11Å; T924-N928 WeakPolarHBondContact O-CB 2.92Å; T924-N928 PolarHBondContact O-N 2.84Å; T924-N928 PolarHBondContact O-ND2 3.31Å; T924-N928 PolarHBondContact O-OD1 2.98Å; I925-N928 PolarHBondContact O-N 3.41Å
929	L	94.9	Very high	92.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-92.2	-13.7	-177.6	-57.1	178.7	0	0	0	113.4	T868 K872 F875 V876 I925 L927 D931 E932 F935	T868-L929 HydrophobicContact CG2-CD1 4.21Å; T868-L929 HydrophobicContact CG2-CD2 4.27Å; T868-L929 HydrophobicContact CG2-CG 4.38Å; K872-L929 HydrophobicContact CB-CD2 4.37Å; K872-L929 HydrophobicContact CG-CD2 4.43Å; F875-L929 HydrophobicContact CB-CD1 3.83Å; F875-L929 HydrophobicContact CB-CD2 3.83Å; V876-L929 HydrophobicContact CG1-CB 4.37Å; V876-L929 HydrophobicContact CG1-CD2 4.12Å; I925-L929 HydrophobicContact CG2-CD1 4.01Å; I925-L929 WeakPolarHBondContact O-CG 3.47Å; I925-L929 PolarHBondContact O-N 3.29Å; I925-L929 VanDerWaalsContact O-N 3.15Å; L927-L929 VanDerWaalsContact C-N 3.31Å; L927-L929 PolarHBondContact O-N 3.01Å; L929-D931 PolarHBondContact O-N 3.4Å; L929-E932 PolarHBondContact O-N 2.88Å; L929-E932 VanDerWaalsContact O-N 3.15Å; L929-F935 HydrophobicContact CB-CD1 3.78Å; L929-F935 HydrophobicContact CB-CD2 4.02Å; L929-F935 HydrophobicContact CB-CE1 3.75Å; L929-F935 HydrophobicContact CB-CE2 4Å; L929-F935 HydrophobicContact CB-CG 3.93Å; L929-F935 HydrophobicContact CB-CZ 3.87Å; L929-F935 HydrophobicContact CD1-CD2 4.11Å; L929-F935 HydrophobicContact CD1-CE2 3.58Å; L929-F935 HydrophobicContact CD1-CZ 3.87Å; L929-F935 HydrophobicContact CG-CE2 4.45Å
930	G	91.3	Very high	92	Very high	5 Å²	5	28.3 Å²	28.3	5%	0.052	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6	-171	0	0	0	0	0	115.8	Y926 L927 E932 C936 R977	Y926-G930 VanDerWaalsContact O-CA 3.26Å; Y926-G930 WeakPolarHBondContact O-CA 3.19Å; Y926-G930 PolarHBondContact O-N 3.07Å; L927-G930 PolarHBondContact O-N 2.56Å; G930-E932 VanDerWaalsContact C-N 3.34Å; G930-C936 PolarHBondContact O-SG 3.28Å; G930-R977 PolarHBondContact O-NH1 2.69Å
931	D	88.6	Confident	91.5	Very high	108 Å²	108	33 Å²	33	58%	0.578	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-33.2	170.3	-64.1	-36.9	0	0	0	111	K872 L929 E933 R977	K872-D931 IonicContact NZ-OD2 3.88Å; K872-D931 PolarHBondContact NZ-OD2 3.3Å; K872-D931 VanDerWaalsContact NZ-OD2 3.15Å; L929-D931 PolarHBondContact O-N 3.4Å; D931-E933 PolarHBondContact O-N 2.83Å; D931-R977 PolarHBondContact O-NH1 3.48Å; D931-R977 PolarHBondContact O-NH2 2.95Å
932	E	89.1	Confident	90.9	Very high	83 Å²	83	32.7 Å²	32.7	39%	0.388	17%	0.171	S	C	.	.			trans	-77.6	118.3	-174.4	-61.9	-64.1	159	0	0	111.6	V876 L929 G930 N934 F935 C936	V876-E932 HydrophobicContact CB-CB 4.27Å; V876-E932 HydrophobicContact CB-CG 4.38Å; V876-E932 HydrophobicContact CG1-CB 3.86Å; V876-E932 HydrophobicContact CG1-CG 3.84Å; V876-E932 HydrophobicContact CG2-CB 4.48Å; V876-E932 HydrophobicContact CG2-CG 4.19Å; L929-E932 PolarHBondContact O-N 2.88Å; L929-E932 VanDerWaalsContact O-N 3.15Å; G930-E932 VanDerWaalsContact C-N 3.34Å; E932-N934 VanDerWaalsContact C-N 3.33Å; E932-N934 PolarHBondContact O-N 3.25Å; E932-F935 HydrophobicContact CB-CB 4.13Å; E932-F935 WeakPolarHBondContact O-CB 3.4Å; E932-F935 PolarHBondContact O-N 3.37Å; E932-F935 VanDerWaalsContact O-N 3.14Å; E932-C936 PolarHBondContact O-N 3.22Å; E932-C936 VanDerWaalsContact O-N 3.13Å
933	E	86.3	Confident	90	Very high	126 Å²	126	36 Å²	36	59%	0.589	20%	0.204	S	C	*	.	H	α-helix	trans	-62.2	-39.4	-175	-170.8	170	-160.7	0	0	112.6	D931 F935 C936 A937	D931-E933 PolarHBondContact O-N 2.83Å; E933-F935 VanDerWaalsContact C-N 3.29Å; E933-F935 PolarHBondContact O-N 3.27Å; E933-C936 PolarHBondContact O-N 3.4Å; E933-A937 WeakPolarHBondContact O-CB 3.1Å; E933-A937 PolarHBondContact O-N 3.05Å
934	N	84.7	Confident	89.4	Confident	76 Å²	76	46.8 Å²	46.8	41%	0.406	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-38.6	176.7	-173	39.8	0	0	0	112.3	V876 E932 T938	V876-N934 PolarHBondContact O-ND2 2.9Å; E932-N934 VanDerWaalsContact C-N 3.33Å; E932-N934 PolarHBondContact O-N 3.25Å; N934-T938 WeakPolarHBondContact O-CB 3.11Å; N934-T938 PolarHBondContact O-N 3.02Å; N934-T938 VanDerWaalsContact O-N 3.08Å; N934-T938 PolarHBondContact O-OG1 2.92Å
935	F	90.6	Very high	89	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-49.8	175.8	-180	-96.9	0	0	0	110.2	V876 I884 I885 Y926 L929 E932 E933 A937 T938 V939	V876-F935 HydrophobicContact CB-CB 4.29Å; V876-F935 HydrophobicContact CG1-CB 3.81Å; V876-F935 HydrophobicContact CG1-CD2 4.22Å; V876-F935 HydrophobicContact CG1-CG 4.27Å; I884-F935 HydrophobicContact CG2-CE2 4.42Å; I885-F935 HydrophobicContact CD1-CD2 3.83Å; I885-F935 HydrophobicContact CD1-CE2 3.76Å; I885-F935 HydrophobicContact CD1-CZ 4.4Å; I885-F935 HydrophobicContact CG1-CD2 4.1Å; I885-F935 HydrophobicContact CG1-CE2 3.48Å; I885-F935 VanDerWaalsContact CG1-CE2 3.48Å; I885-F935 HydrophobicContact CG1-CZ 3.93Å; Y926-F935 AromaticContact CD1-CE1 3.95Å; Y926-F935 HydrophobicContact CD1-CE1 3.95Å; Y926-F935 HydrophobicContact CD1-CZ 4.07Å; Y926-F935 HydrophobicContact CE1-CE1 4.42Å; Y926-F935 HydrophobicContact CE1-CZ 4.25Å; L929-F935 HydrophobicContact CB-CD1 3.78Å; L929-F935 HydrophobicContact CB-CD2 4.02Å; L929-F935 HydrophobicContact CB-CE1 3.75Å; L929-F935 HydrophobicContact CB-CE2 4Å; L929-F935 HydrophobicContact CB-CG 3.93Å; L929-F935 HydrophobicContact CB-CZ 3.87Å; L929-F935 HydrophobicContact CD1-CD2 4.11Å; L929-F935 HydrophobicContact CD1-CE2 3.58Å; L929-F935 HydrophobicContact CD1-CZ 3.87Å; L929-F935 HydrophobicContact CG-CE2 4.45Å; E932-F935 HydrophobicContact CB-CB 4.13Å; E932-F935 WeakPolarHBondContact O-CB 3.4Å; E932-F935 PolarHBondContact O-N 3.37Å; E932-F935 VanDerWaalsContact O-N 3.14Å; E933-F935 VanDerWaalsContact C-N 3.29Å; E933-F935 PolarHBondContact O-N 3.27Å; F935-A937 VanDerWaalsContact C-N 3.3Å; F935-A937 PolarHBondContact O-N 3.03Å; F935-T938 PolarHBondContact O-N 3.16Å; F935-V939 HydrophobicContact CD1-CG2 4.3Å; F935-V939 HydrophobicContact CE1-CG2 3.97Å; F935-V939 HydrophobicContact CZ-CG2 4.24Å; F935-V939 WeakPolarHBondContact O-CG2 3.45Å; F935-V939 PolarHBondContact O-N 3.3Å; F935-V939 VanDerWaalsContact O-N 3.12Å
936	C	90.9	Very high	88.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.7	-38.6	178.2	-64.5	0	0	0	0	113.4	G930 E932 E933 T938 P940 I978 L981	G930-C936 PolarHBondContact O-SG 3.28Å; E932-C936 PolarHBondContact O-N 3.22Å; E932-C936 VanDerWaalsContact O-N 3.13Å; E933-C936 PolarHBondContact O-N 3.4Å; C936-T938 VanDerWaalsContact C-N 3.32Å; C936-P940 VanDerWaalsContact O-CD 3.28Å; C936-P940 WeakPolarHBondContact O-CD 3.26Å; C936-I978 HydrophobicContact CB-CG1 3.89Å; C936-L981 HydrophobicContact CB-CD1 3.53Å
937	A	86.9	Confident	88.2	Confident	27 Å²	27	48.1 Å²	48.1	22%	0.223	25%	0.252	C	S	.	.	H	α-helix	trans	-73.2	-22.6	177.1	0	0	0	0	0	113	E933 F935 L981 Q985	E933-A937 WeakPolarHBondContact O-CB 3.1Å; E933-A937 PolarHBondContact O-N 3.05Å; F935-A937 VanDerWaalsContact C-N 3.3Å; F935-A937 PolarHBondContact O-N 3.03Å; A937-L981 HydrophobicContact CB-CD1 4.4Å; A937-Q985 PolarHBondContact O-OE1 3.29Å
938	T	88.1	Confident	87.4	Confident	7 Å²	7	50 Å²	50	4%	0.043	27%	0.267	C	S	.	.	H	α-helix	trans	-84.7	-27.5	178.3	-56.9	0	0	0	0	112	E882 I885 N934 F935 C936 K941	E882-T938 HydrophobicContact CB-CG2 4.46Å; E882-T938 HydrophobicContact CG-CG2 3.55Å; I885-T938 HydrophobicContact CD1-CG2 3.57Å; N934-T938 WeakPolarHBondContact O-CB 3.11Å; N934-T938 PolarHBondContact O-N 3.02Å; N934-T938 VanDerWaalsContact O-N 3.08Å; N934-T938 PolarHBondContact O-OG1 2.92Å; F935-T938 PolarHBondContact O-N 3.16Å; C936-T938 VanDerWaalsContact C-N 3.32Å; T938-K941 HydrophobicContact CG2-CD 4.36Å; T938-K941 VanDerWaalsContact O-CB 3.28Å; T938-K941 WeakPolarHBondContact O-CB 3.43Å; T938-K941 PolarHBondContact O-N 2.67Å; T938-K941 VanDerWaalsContact O-N 3.08Å
939	V	91	Very high	87	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-53.1	-45.4	-178.5	171.2	0	0	0	0	114	I885 N889 Y926 F935 K941 Y946 F951 I978	I885-V939 HydrophobicContact CD1-CG2 3.88Å; I885-V939 HydrophobicContact CG1-CG2 3.99Å; I885-V939 HydrophobicContact CG2-CB 4.39Å; I885-V939 HydrophobicContact CG2-CG2 4.25Å; N889-V939 PolarHBondContact ND2-O 3.34Å; Y926-V939 HydrophobicContact CE1-CG1 4.45Å; Y926-V939 HydrophobicContact CE1-CG2 4.11Å; F935-V939 HydrophobicContact CD1-CG2 4.3Å; F935-V939 HydrophobicContact CE1-CG2 3.97Å; F935-V939 HydrophobicContact CZ-CG2 4.24Å; F935-V939 WeakPolarHBondContact O-CG2 3.45Å; F935-V939 PolarHBondContact O-N 3.3Å; F935-V939 VanDerWaalsContact O-N 3.12Å; V939-K941 VanDerWaalsContact C-N 3.28Å; V939-K941 PolarHBondContact O-N 2.92Å; V939-Y946 HydrophobicContact CG1-CD2 3.81Å; V939-Y946 HydrophobicContact CG1-CE2 4Å; V939-F951 HydrophobicContact CG1-CE2 4.09Å; V939-F951 HydrophobicContact CG1-CZ 3.84Å; V939-I978 HydrophobicContact CB-CD1 4.27Å; V939-I978 HydrophobicContact CB-CG2 4.02Å; V939-I978 HydrophobicContact CG1-CD1 4.26Å; V939-I978 HydrophobicContact CG1-CG2 3.88Å; V939-I978 HydrophobicContact CG2-CD1 4.18Å
940	P	88.1	Confident	86.8	Confident	18 Å²	18	52.6 Å²	52.6	12%	0.117	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-70.7	-20	-179.5	-20.2	34.4	0	0	0	114.4	C936 D942 Y946 I978 A982	C936-P940 VanDerWaalsContact O-CD 3.28Å; C936-P940 WeakPolarHBondContact O-CD 3.26Å; P940-D942 PolarHBondContact O-N 3.38Å; P940-Y946 HydrophobicContact CB-CD1 4.1Å; P940-Y946 HydrophobicContact CB-CE1 3.93Å; P940-Y946 HydrophobicContact CG-CE1 4.39Å; P940-I978 HydrophobicContact CG-CG2 3.8Å; P940-A982 HydrophobicContact CB-CB 3.59Å; P940-A982 HydrophobicContact CG-CB 3.54Å
941	K	82.9	Confident	86.9	Confident	108 Å²	108	52.5 Å²	52.5	47%	0.47	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-62.5	-24	-178.7	-61.1	-170.7	179.5	179.9	0	112.9	T938 V939 G943	T938-K941 HydrophobicContact CG2-CD 4.36Å; T938-K941 VanDerWaalsContact O-CB 3.28Å; T938-K941 WeakPolarHBondContact O-CB 3.43Å; T938-K941 PolarHBondContact O-N 2.67Å; T938-K941 VanDerWaalsContact O-N 3.08Å; V939-K941 VanDerWaalsContact C-N 3.28Å; V939-K941 PolarHBondContact O-N 2.92Å; K941-G943 PolarHBondContact O-N 3.2Å
942	D	84.6	Confident	87	Confident	16 Å²	16	49.7 Å²	49.7	9%	0.086	27%	0.274	C	S	.	.			trans	-77.6	72.1	174.9	178.3	52.7	0	0	0	111.6	I885 S886 N889 P940 R944 S945 Y946	I885-D942 HydrophobicContact CG2-CB 4.26Å; S886-D942 PolarHBondContact OG-OD1 2.94Å; N889-D942 WeakPolarHBondContact CB-OD2 3.43Å; N889-D942 WeakPolarHBondContact ND2-CB 3.49Å; N889-D942 PolarHBondContact ND2-OD2 3.01Å; P940-D942 PolarHBondContact O-N 3.38Å; D942-R944 PolarHBondContact O-N 2.98Å; D942-S945 PolarHBondContact O-N 3.36Å; D942-S945 WeakPolarHBondContact OD2-CB 3.36Å; D942-Y946 VanDerWaalsContact O-CB 3.28Å; D942-Y946 WeakPolarHBondContact O-CB 3.23Å; D942-Y946 PolarHBondContact O-N 3.44Å
943	G	75.9	Confident	87.1	Confident	69 Å²	69	48.4 Å²	48.4	71%	0.711	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-7	-178.7	0	0	0	0	0	115.3	K941	K941-G943 PolarHBondContact O-N 3.2Å
944	R	83.3	Confident	87.4	Confident	227 Å²	227	42.4 Å²	42.4	86%	0.857	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-39	177.7	-65.9	-178.5	-178.9	178.8	2.6	112.5	D942	D942-R944 PolarHBondContact O-N 2.98Å
945	S	88	Confident	87.8	Confident	8 Å²	8	39.5 Å²	39.5	6%	0.056	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-30.5	-172.1	-67.4	0	0	0	0	113.6	Y890 D942	Y890-S945 WeakPolarHBondContact CA-OG 3.25Å; D942-S945 PolarHBondContact O-N 3.36Å; D942-S945 WeakPolarHBondContact OD2-CB 3.36Å
946	Y	89.6	Confident	87.9	Confident	27 Å²	27	48.2 Å²	48.2	11%	0.106	26%	0.257	C	S	.	.			trans	-66.1	141.3	173.9	-179.3	-100.7	0	0	0	111.7	V939 P940 D942 F951 I978 A982	V939-Y946 HydrophobicContact CG1-CD2 3.81Å; V939-Y946 HydrophobicContact CG1-CE2 4Å; P940-Y946 HydrophobicContact CB-CD1 4.1Å; P940-Y946 HydrophobicContact CB-CE1 3.93Å; P940-Y946 HydrophobicContact CG-CE1 4.39Å; D942-Y946 VanDerWaalsContact O-CB 3.28Å; D942-Y946 WeakPolarHBondContact O-CB 3.23Å; D942-Y946 PolarHBondContact O-N 3.44Å; Y946-F951 HydrophobicContact CD2-CZ 4.42Å; Y946-F951 HydrophobicContact CE2-CD2 4.22Å; Y946-F951 AromaticContact CE2-CE2 3.9Å; Y946-F951 HydrophobicContact CE2-CE2 3.9Å; Y946-F951 HydrophobicContact CE2-CZ 4.23Å; Y946-I978 HydrophobicContact CE2-CG2 4.03Å; Y946-A982 HydrophobicContact CE1-CB 4.43Å
947	S	86.8	Confident	87.9	Confident	34 Å²	34	49.5 Å²	49.5	24%	0.238	27%	0.266	C	S	.	.			trans	-150.7	153.9	161.5	69.6	0	0	0	0	109.6	T949 L950	S947-T949 PolarHBondContact O-N 3.44Å; S947-T949 PolarHBondContact OG-OG1 2.93Å; S947-L950 VanDerWaalsContact O-CB 3.28Å; S947-L950 WeakPolarHBondContact O-CB 3.4Å; S947-L950 PolarHBondContact O-N 3.21Å; S947-L950 PolarHBondContact OG-N 3.43Å
948	P	77.6	Confident	88.2	Confident	80 Å²	80	48.2 Å²	48.2	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-56.4	-25.4	175.5	-26.8	35.1	0	0	0	113.3
949	T	87.5	Confident	88.4	Confident	83 Å²	83	54 Å²	54	51%	0.509	28%	0.28	S	S	.	.	H	α-helix	trans	-81.1	-21.5	177.7	65.9	0	0	0	0	114.2	S947 A952 Q953	S947-T949 PolarHBondContact O-N 3.44Å; S947-T949 PolarHBondContact OG-OG1 2.93Å; T949-A952 PolarHBondContact O-N 2.68Å; T949-Q953 VanDerWaalsContact O-CG 3.3Å; T949-Q953 WeakPolarHBondContact O-CG 3.34Å; T949-Q953 PolarHBondContact O-N 3Å
950	L	91.3	Very high	88.4	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-53.5	-175.6	177.1	61	0	0	0	110.6	L892 Q893 V896 S947 A952 Q953 T954	L892-L950 HydrophobicContact CD2-CG 4.43Å; L892-L950 HydrophobicContact CG-CD1 4.35Å; Q893-L950 HydrophobicContact CB-CD1 4.07Å; V896-L950 HydrophobicContact CG2-CD1 3.65Å; S947-L950 VanDerWaalsContact O-CB 3.28Å; S947-L950 WeakPolarHBondContact O-CB 3.4Å; S947-L950 PolarHBondContact O-N 3.21Å; S947-L950 PolarHBondContact OG-N 3.43Å; L950-A952 PolarHBondContact O-N 3.31Å; L950-Q953 WeakPolarHBondContact O-CB 3.43Å; L950-Q953 PolarHBondContact O-N 3.47Å; L950-Q953 VanDerWaalsContact O-N 3.15Å; L950-T954 PolarHBondContact O-N 2.89Å; L950-T954 PolarHBondContact O-OG1 2.93Å
951	F	92.8	Very high	88.5	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-70.4	-31.1	-179	-67.6	-12.1	0	0	0	113.2	L892 Y926 V939 Y946 Q953 T954 V955 F971 A975 I978	L892-F951 HydrophobicContact CD2-CD1 4Å; L892-F951 HydrophobicContact CD2-CE1 3.81Å; Y926-F951 HydrophobicContact CD1-CZ 4.34Å; Y926-F951 HydrophobicContact CE1-CE1 4.49Å; Y926-F951 AromaticContact CE1-CZ 3.95Å; Y926-F951 HydrophobicContact CE1-CZ 3.95Å; Y926-F951 HydrophobicContact CE2-CE1 4.48Å; V939-F951 HydrophobicContact CG1-CE2 4.09Å; V939-F951 HydrophobicContact CG1-CZ 3.84Å; Y946-F951 HydrophobicContact CD2-CZ 4.42Å; Y946-F951 HydrophobicContact CE2-CD2 4.22Å; Y946-F951 AromaticContact CE2-CE2 3.9Å; Y946-F951 HydrophobicContact CE2-CE2 3.9Å; Y946-F951 HydrophobicContact CE2-CZ 4.23Å; F951-Q953 VanDerWaalsContact C-N 3.3Å; F951-Q953 PolarHBondContact O-N 3.28Å; F951-T954 WeakPolarHBondContact O-CB 3.43Å; F951-T954 PolarHBondContact O-N 3.04Å; F951-V955 WeakPolarHBondContact O-CG2 3.45Å; F951-V955 PolarHBondContact O-N 3.45Å; F951-F971 HydrophobicContact CB-CE1 4.04Å; F951-F971 HydrophobicContact CD1-CE1 4.14Å; F951-F971 AromaticContact CD1-CZ 4Å; F951-F971 HydrophobicContact CD1-CZ 4Å; F951-F971 HydrophobicContact CE1-CZ 4.28Å; F951-F971 HydrophobicContact CG-CE1 4.06Å; F951-F971 HydrophobicContact CG-CZ 4.27Å; F951-A975 HydrophobicContact CB-CB 3.63Å; F951-A975 HydrophobicContact CD2-CB 3.9Å; F951-A975 HydrophobicContact CG-CB 4.21Å; F951-I978 HydrophobicContact CE2-CB 4.37Å; F951-I978 HydrophobicContact CE2-CD1 3.67Å; F951-I978 HydrophobicContact CE2-CG2 4.14Å; F951-I978 HydrophobicContact CZ-CD1 4.41Å
952	A	90.1	Very high	88.9	Confident	49 Å²	49	65.1 Å²	65.1	41%	0.405	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-38.6	170.9	0	0	0	0	0	111.6	T949 L950 R956	T949-A952 PolarHBondContact O-N 2.68Å; L950-A952 PolarHBondContact O-N 3.31Å; A952-R956 WeakPolarHBondContact O-CG 3.45Å; A952-R956 PolarHBondContact O-N 3.35Å
953	Q	91.9	Very high	89.2	Confident	56 Å²	56	66.4 Å²	66.4	26%	0.262	34%	0.339	S	S	.	.	H	α-helix	trans	-67.2	-42.3	172.1	-69.6	168.4	-4.9	0	0	111.3	V896 T949 L950 F951 V955 R956 V957	V896-Q953 HydrophobicContact CG2-CB 4.13Å; T949-Q953 VanDerWaalsContact O-CG 3.3Å; T949-Q953 WeakPolarHBondContact O-CG 3.34Å; T949-Q953 PolarHBondContact O-N 3Å; L950-Q953 WeakPolarHBondContact O-CB 3.43Å; L950-Q953 PolarHBondContact O-N 3.47Å; L950-Q953 VanDerWaalsContact O-N 3.15Å; F951-Q953 VanDerWaalsContact C-N 3.3Å; F951-Q953 PolarHBondContact O-N 3.28Å; Q953-V955 PolarHBondContact O-N 3.49Å; Q953-R956 WeakPolarHBondContact O-CB 3.46Å; Q953-R956 PolarHBondContact O-N 3.14Å; Q953-R956 VanDerWaalsContact O-N 3.09Å; Q953-V957 WeakPolarHBondContact O-CG2 3.04Å; Q953-V957 PolarHBondContact O-N 3.25Å
954	T	93.9	Very high	89.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-55.2	-48.7	174.8	-53.6	0	0	0	0	111.8	L892 C923 L950 F951 R956 V957 L958 F971	L892-T954 HydrophobicContact CD1-CG2 4.06Å; L892-T954 HydrophobicContact CD2-CG2 4.3Å; L892-T954 WeakPolarHBondContact CD2-OG1 3.05Å; C923-T954 WeakPolarHBondContact SG-CG2 3.32Å; L950-T954 PolarHBondContact O-N 2.89Å; L950-T954 PolarHBondContact O-OG1 2.93Å; F951-T954 WeakPolarHBondContact O-CB 3.43Å; F951-T954 PolarHBondContact O-N 3.04Å; T954-R956 VanDerWaalsContact C-N 3.28Å; T954-R956 PolarHBondContact O-N 3.33Å; T954-V957 PolarHBondContact O-N 3.48Å; T954-L958 HydrophobicContact CG2-CD1 4.24Å; T954-L958 HydrophobicContact CG2-CG 4.33Å; T954-L958 WeakPolarHBondContact O-CG 3.42Å; T954-L958 PolarHBondContact O-N 3.49Å; T954-F971 HydrophobicContact CG2-CD1 4.28Å; T954-F971 HydrophobicContact CG2-CE1 3.65Å; T954-F971 HydrophobicContact CG2-CZ 3.82Å
955	V	92.8	Very high	90	Very high	15 Å²	15	58.3 Å²	58.3	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-39.3	177.1	171.7	0	0	0	0	111.6	F951 Q953 K959 I968 F971 S972	F951-V955 WeakPolarHBondContact O-CG2 3.45Å; F951-V955 PolarHBondContact O-N 3.45Å; Q953-V955 PolarHBondContact O-N 3.49Å; V955-K959 WeakPolarHBondContact O-CG 3.39Å; V955-K959 PolarHBondContact O-N 3.41Å; V955-K959 VanDerWaalsContact O-N 3.13Å; V955-I968 HydrophobicContact CG1-CG2 4.16Å; V955-F971 HydrophobicContact CG2-CD1 3.92Å; V955-S972 WeakPolarHBondContact CG2-OG 3.08Å
956	R	91.7	Very high	90.1	Very high	182 Å²	182	63.9 Å²	63.9	69%	0.687	34%	0.341	S	S	*	.	H	α-helix	trans	-64.9	-41.9	174.8	-68.5	173.1	-174.4	177.7	2.2	111.6	A952 Q953 T954 K959 K960	A952-R956 WeakPolarHBondContact O-CG 3.45Å; A952-R956 PolarHBondContact O-N 3.35Å; Q953-R956 WeakPolarHBondContact O-CB 3.46Å; Q953-R956 PolarHBondContact O-N 3.14Å; Q953-R956 VanDerWaalsContact O-N 3.09Å; T954-R956 VanDerWaalsContact C-N 3.28Å; T954-R956 PolarHBondContact O-N 3.33Å; R956-K959 PolarHBondContact O-N 3.19Å; R956-K960 PolarHBondContact O-N 2.98Å
957	V	92.1	Very high	90.3	Very high	28 Å²	28	63.8 Å²	63.8	17%	0.17	34%	0.342	C	S	.	.	H	α-helix	trans	-65.6	-46.2	177.1	173.4	0	0	0	0	110.7	V896 V919 Q953 T954 K959 K960 I961	V896-V957 HydrophobicContact CB-CG2 3.89Å; V896-V957 HydrophobicContact CG1-CB 4.16Å; V896-V957 HydrophobicContact CG1-CG1 4.26Å; V896-V957 HydrophobicContact CG1-CG2 4.03Å; V919-V957 HydrophobicContact CG1-CG1 4.31Å; Q953-V957 WeakPolarHBondContact O-CG2 3.04Å; Q953-V957 PolarHBondContact O-N 3.25Å; T954-V957 PolarHBondContact O-N 3.48Å; V957-K959 VanDerWaalsContact C-N 3.28Å; V957-K959 PolarHBondContact O-N 3.39Å; V957-K960 CarbonylContact O-C 3.47Å; V957-K960 WeakPolarHBondContact O-CA 3.43Å; V957-K960 WeakPolarHBondContact O-CB 2.98Å; V957-K960 PolarHBondContact O-N 3.13Å; V957-I961 HydrophobicContact CG1-CG2 4.31Å; V957-I961 WeakPolarHBondContact O-CG1 3.31Å; V957-I961 PolarHBondContact O-N 3.4Å
958	L	92.9	Very high	90.5	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-55.5	-41.5	176.7	-70.8	175.4	0	0	0	112.3	V919 T954 I961 N962 K963 I968 F971	V919-L958 HydrophobicContact CG1-CD2 4.2Å; T954-L958 HydrophobicContact CG2-CD1 4.24Å; T954-L958 HydrophobicContact CG2-CG 4.33Å; T954-L958 WeakPolarHBondContact O-CG 3.42Å; T954-L958 PolarHBondContact O-N 3.49Å; L958-I961 HydrophobicContact CD2-CD1 4.3Å; L958-I961 WeakPolarHBondContact O-CG1 3.39Å; L958-N962 PolarHBondContact O-N 2.89Å; L958-K963 HydrophobicContact CD2-CB 4.47Å; L958-K963 HydrophobicContact CD2-CG 4.14Å; L958-K963 PolarHBondContact O-N 2.95Å; L958-I968 HydrophobicContact CB-CG1 4.08Å; L958-F971 HydrophobicContact CD1-CB 4.21Å; L958-F971 HydrophobicContact CD1-CD1 4.38Å; L958-F971 HydrophobicContact CD1-CG 4.19Å
959	K	92.3	Very high	91.3	Very high	129 Å²	129	63.3 Å²	63.3	56%	0.561	34%	0.335	S	S	*	.	H	α-helix	trans	-62.4	-43.4	172	-72.9	174.1	-178.7	-178.4	0	111.9	V955 R956 V957 N962 I968	V955-K959 WeakPolarHBondContact O-CG 3.39Å; V955-K959 PolarHBondContact O-N 3.41Å; V955-K959 VanDerWaalsContact O-N 3.13Å; R956-K959 PolarHBondContact O-N 3.19Å; V957-K959 VanDerWaalsContact C-N 3.28Å; V957-K959 PolarHBondContact O-N 3.39Å; K959-N962 PolarHBondContact O-N 3.07Å; K959-I968 HydrophobicContact CG-CD1 3.9Å; K959-I968 HydrophobicContact CG-CG2 4.08Å
960	K	90.2	Very high	91.6	Very high	182 Å²	182	61.2 Å²	61.2	79%	0.791	33%	0.326	S	S	*	.	H	α-helix	trans	-67.1	-34.8	-179	-171.9	177.9	179.9	-179.6	0	113.2	R956 V957 N962	R956-K960 PolarHBondContact O-N 2.98Å; V957-K960 CarbonylContact O-C 3.47Å; V957-K960 WeakPolarHBondContact O-CA 3.43Å; V957-K960 WeakPolarHBondContact O-CB 2.98Å; V957-K960 PolarHBondContact O-N 3.13Å; K960-N962 PolarHBondContact O-N 3.2Å
961	I	90.9	Very high	91.8	Very high	29 Å²	29	61.2 Å²	61.2	15%	0.149	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	10.2	176.5	65.2	161.4	0	0	0	112.8	Q916 V957 L958 K963	Q916-I961 HydrophobicContact CB-CB 4.33Å; Q916-I961 HydrophobicContact CB-CD1 4.19Å; Q916-I961 HydrophobicContact CB-CG2 4.16Å; Q916-I961 HydrophobicContact CG-CB 4.25Å; Q916-I961 HydrophobicContact CG-CG2 3.71Å; Q916-I961 WeakPolarHBondContact O-CD1 3.33Å; V957-I961 HydrophobicContact CG1-CG2 4.31Å; V957-I961 WeakPolarHBondContact O-CG1 3.31Å; V957-I961 PolarHBondContact O-N 3.4Å; L958-I961 HydrophobicContact CD2-CD1 4.3Å; L958-I961 WeakPolarHBondContact O-CG1 3.39Å; I961-K963 HydrophobicContact CD1-CD 4.32Å; I961-K963 HydrophobicContact CD1-CG 3.62Å; I961-K963 HydrophobicContact CG1-CG 3.79Å; I961-K963 PolarHBondContact O-N 3.03Å
962	N	90	Very high	91.9	Very high	147 Å²	147	62.6 Å²	62.6	79%	0.786	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	42.5	174.5	-160	34.8	0	0	0	114.6	L958 K959 K960	L958-N962 PolarHBondContact O-N 2.89Å; K959-N962 PolarHBondContact O-N 3.07Å; K960-N962 PolarHBondContact O-N 3.2Å
963	K	90.8	Very high	92.1	Very high	44 Å²	44	64.8 Å²	64.8	19%	0.191	34%	0.341	C	S	.	.			trans	-72.8	155.1	174.3	-71.8	-74.2	170.1	170.2	0	111.5	S920 L958 I961 G965 M967 I968	S920-K963 VanDerWaalsContact OG-CE 3.28Å; S920-K963 WeakPolarHBondContact OG-CE 3.33Å; S920-K963 PolarHBondContact OG-NZ 2.98Å; L958-K963 HydrophobicContact CD2-CB 4.47Å; L958-K963 HydrophobicContact CD2-CG 4.14Å; L958-K963 PolarHBondContact O-N 2.95Å; I961-K963 HydrophobicContact CD1-CD 4.32Å; I961-K963 HydrophobicContact CD1-CG 3.62Å; I961-K963 HydrophobicContact CG1-CG 3.79Å; I961-K963 PolarHBondContact O-N 3.03Å; K963-G965 PolarHBondContact O-N 3.13Å; K963-M967 HydrophobicContact CB-SD 4.33Å; K963-M967 HydrophobicContact CD-SD 4.48Å; K963-I968 WeakPolarHBondContact O-CD1 3.27Å
964	P	89.8	Confident	92.2	Very high	78 Å²	78	62.7 Å²	62.7	51%	0.506	33%	0.331	S	S	.	.			trans	-51.8	136.8	-179.8	-30.5	38.4	0	0	0	113.5	N966 M967 I968	P964-N966 WeakPolarHBondContact CB-OD1 3.37Å; P964-N966 PolarHBondContact O-N 3.12Å; P964-M967 WeakPolarHBondContact O-CB 3.49Å; P964-M967 PolarHBondContact O-N 3.17Å; P964-I968 PolarHBondContact O-N 2.96Å
965	G	87.4	Confident	92.1	Very high	48 Å²	48	63.4 Å²	63.4	50%	0.495	34%	0.338	S	S	.	.	H	α-helix	trans	-59.7	-31.8	-174.5	0	0	0	0	0	114.1	K963 I968 V969	K963-G965 PolarHBondContact O-N 3.13Å; G965-I968 PolarHBondContact O-N 3.27Å; G965-V969 WeakPolarHBondContact O-CG2 3.46Å; G965-V969 PolarHBondContact O-N 2.63Å
966	N	90.8	Very high	92	Very high	125 Å²	125	69.2 Å²	69.2	67%	0.668	36%	0.364	S	S	*	.	H	α-helix	trans	-61.2	-42.7	173.9	61.1	-30.9	0	0	0	112.3	P964 I968 V969 A970	P964-N966 WeakPolarHBondContact CB-OD1 3.37Å; P964-N966 PolarHBondContact O-N 3.12Å; N966-I968 VanDerWaalsContact C-N 3.34Å; N966-V969 PolarHBondContact O-N 3.35Å; N966-A970 VanDerWaalsContact O-CB 3.31Å; N966-A970 WeakPolarHBondContact O-CB 3.35Å; N966-A970 PolarHBondContact O-N 3.34Å
967	M	91.9	Very high	92	Very high	24 Å²	24	64.6 Å²	64.6	12%	0.118	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.5	-173.4	-173.3	-173.4	0	0	111.2	S920 C923 L927 K963 P964 A970 F971	S920-M967 WeakPolarHBondContact O-CE 3.37Å; C923-M967 HydrophobicContact CB-CE 3.54Å; L927-M967 HydrophobicContact CD1-CE 4.22Å; L927-M967 HydrophobicContact CD1-CG 3.76Å; K963-M967 HydrophobicContact CB-SD 4.33Å; K963-M967 HydrophobicContact CD-SD 4.48Å; P964-M967 WeakPolarHBondContact O-CB 3.49Å; P964-M967 PolarHBondContact O-N 3.17Å; M967-A970 PolarHBondContact O-N 2.86Å; M967-F971 WeakPolarHBondContact O-CB 3.42Å; M967-F971 PolarHBondContact O-N 3.38Å
968	I	92.7	Very high	92	Very high	20 Å²	20	63.2 Å²	63.2	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-46.7	179.3	-62.6	171.7	0	0	0	110.3	V955 L958 K959 K963 P964 G965 N966 F971 S972	V955-I968 HydrophobicContact CG1-CG2 4.16Å; L958-I968 HydrophobicContact CB-CG1 4.08Å; K959-I968 HydrophobicContact CG-CD1 3.9Å; K959-I968 HydrophobicContact CG-CG2 4.08Å; K963-I968 WeakPolarHBondContact O-CD1 3.27Å; P964-I968 PolarHBondContact O-N 2.96Å; G965-I968 PolarHBondContact O-N 3.27Å; N966-I968 VanDerWaalsContact C-N 3.34Å; I968-F971 PolarHBondContact O-N 2.87Å; I968-S972 WeakPolarHBondContact O-CB 3.49Å; I968-S972 PolarHBondContact O-N 3Å; I968-S972 PolarHBondContact O-OG 3Å
969	V	94	Very high	91.8	Very high	84 Å²	84	68.1 Å²	68.1	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-47.1	178	172.5	0	0	0	0	110.9	G965 N966 F971 S972 N973	G965-V969 WeakPolarHBondContact O-CG2 3.46Å; G965-V969 PolarHBondContact O-N 2.63Å; N966-V969 PolarHBondContact O-N 3.35Å; V969-F971 VanDerWaalsContact C-N 3.3Å; V969-F971 PolarHBondContact O-N 3.35Å; V969-S972 PolarHBondContact O-N 3.05Å; V969-N973 VanDerWaalsContact O-CG 3.28Å; V969-N973 PolarHBondContact O-N 2.87Å; V969-N973 PolarHBondContact O-OD1 3.31Å
970	A	94.4	Very high	91.6	Very high	40 Å²	40	65.1 Å²	65.1	33%	0.331	36%	0.355	S	S	.	.	H	α-helix	trans	-58	-43.5	178.4	0	0	0	0	0	111.7	L927 N966 M967 N973 L974	L927-A970 HydrophobicContact CD2-CB 3.77Å; N966-A970 VanDerWaalsContact O-CB 3.31Å; N966-A970 WeakPolarHBondContact O-CB 3.35Å; N966-A970 PolarHBondContact O-N 3.34Å; M967-A970 PolarHBondContact O-N 2.86Å; A970-N973 PolarHBondContact O-N 3.41Å; A970-L974 PolarHBondContact O-N 3.45Å
971	F	95.1	Very high	91.4	Very high	2 Å²	2	58 Å²	58	1%	0.009	33%	0.325	C	S	.	.	H	α-helix	trans	-71.1	-35.6	179.4	-163.1	-85.3	0	0	0	112.2	C923 Y926 L927 F951 T954 V955 L958 M967 I968 V969 L974 A975	C923-F971 HydrophobicContact CB-CD2 3.92Å; C923-F971 HydrophobicContact CB-CE2 3.88Å; Y926-F971 HydrophobicContact CD2-CE2 4.28Å; Y926-F971 HydrophobicContact CG-CE2 4.25Å; L927-F971 HydrophobicContact CD2-CB 4.21Å; L927-F971 HydrophobicContact CD2-CD2 4.28Å; L927-F971 HydrophobicContact CG-CD2 4.21Å; F951-F971 HydrophobicContact CB-CE1 4.04Å; F951-F971 HydrophobicContact CD1-CE1 4.14Å; F951-F971 AromaticContact CD1-CZ 4Å; F951-F971 HydrophobicContact CD1-CZ 4Å; F951-F971 HydrophobicContact CE1-CZ 4.28Å; F951-F971 HydrophobicContact CG-CE1 4.06Å; F951-F971 HydrophobicContact CG-CZ 4.27Å; T954-F971 HydrophobicContact CG2-CD1 4.28Å; T954-F971 HydrophobicContact CG2-CE1 3.65Å; T954-F971 HydrophobicContact CG2-CZ 3.82Å; V955-F971 HydrophobicContact CG2-CD1 3.92Å; L958-F971 HydrophobicContact CD1-CB 4.21Å; L958-F971 HydrophobicContact CD1-CD1 4.38Å; L958-F971 HydrophobicContact CD1-CG 4.19Å; M967-F971 WeakPolarHBondContact O-CB 3.42Å; M967-F971 PolarHBondContact O-N 3.38Å; I968-F971 PolarHBondContact O-N 2.87Å; V969-F971 VanDerWaalsContact C-N 3.3Å; V969-F971 PolarHBondContact O-N 3.35Å; F971-L974 PolarHBondContact O-N 3.34Å; F971-A975 WeakPolarHBondContact O-CB 3.28Å; F971-A975 PolarHBondContact O-N 3.18Å
972	S	94.1	Very high	91.2	Very high	32 Å²	32	57.3 Å²	57.3	22%	0.224	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-45.5	172.1	-71.1	0	0	0	0	111.8	V955 I968 V969 L974 A975 E976	V955-S972 WeakPolarHBondContact CG2-OG 3.08Å; I968-S972 WeakPolarHBondContact O-CB 3.49Å; I968-S972 PolarHBondContact O-N 3Å; I968-S972 PolarHBondContact O-OG 3Å; V969-S972 PolarHBondContact O-N 3.05Å; S972-L974 PolarHBondContact O-N 3.1Å; S972-A975 PolarHBondContact O-N 2.95Å; S972-E976 PolarHBondContact O-N 3.17Å
973	N	93.7	Very high	90.9	Very high	95 Å²	95	53.6 Å²	53.6	51%	0.508	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-43	177.5	-64.4	-11.1	0	0	0	111.5	V969 A970 A975 E976 R977	V969-N973 VanDerWaalsContact O-CG 3.28Å; V969-N973 PolarHBondContact O-N 2.87Å; V969-N973 PolarHBondContact O-OD1 3.31Å; A970-N973 PolarHBondContact O-N 3.41Å; N973-A975 VanDerWaalsContact C-N 3.33Å; N973-A975 PolarHBondContact O-N 3.45Å; N973-E976 PolarHBondContact O-N 2.89Å; N973-R977 PolarHBondContact O-N 3.16Å
974	L	93.8	Very high	90.4	Very high	12 Å²	12	55.9 Å²	55.9	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-42.7	175.4	179	60.7	0	0	0	111.7	Y926 L927 A970 F971 S972 E976 R977 I978	Y926-L974 VanDerWaalsContact O-CD2 3.28Å; Y926-L974 WeakPolarHBondContact O-CD2 3.47Å; L927-L974 HydrophobicContact CD2-CD2 4.22Å; A970-L974 PolarHBondContact O-N 3.45Å; F971-L974 PolarHBondContact O-N 3.34Å; S972-L974 PolarHBondContact O-N 3.1Å; L974-E976 PolarHBondContact O-N 3.37Å; L974-R977 PolarHBondContact O-N 3.46Å; L974-I978 HydrophobicContact CD1-CD1 3.83Å; L974-I978 HydrophobicContact CD1-CG1 4.17Å; L974-I978 HydrophobicContact CG-CD1 3.86Å; L974-I978 WeakPolarHBondContact O-CG1 3.49Å; L974-I978 PolarHBondContact O-N 3.04Å
975	A	92.5	Very high	89.7	Confident	16 Å²	16	53.5 Å²	53.5	13%	0.132	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-40.1	178.4	0	0	0	0	0	112.4	F951 F971 S972 N973 K979	F951-A975 HydrophobicContact CB-CB 3.63Å; F951-A975 HydrophobicContact CD2-CB 3.9Å; F951-A975 HydrophobicContact CG-CB 4.21Å; F971-A975 WeakPolarHBondContact O-CB 3.28Å; F971-A975 PolarHBondContact O-N 3.18Å; S972-A975 PolarHBondContact O-N 2.95Å; N973-A975 VanDerWaalsContact C-N 3.33Å; N973-A975 PolarHBondContact O-N 3.45Å; A975-K979 WeakPolarHBondContact O-CB 3.39Å; A975-K979 PolarHBondContact O-N 3.38Å
976	E	91.1	Very high	89.1	Confident	136 Å²	136	56.3 Å²	56.3	64%	0.636	30%	0.3	S	S	*	.	H	α-helix	trans	-65.1	-43.4	174.5	-73.7	179.5	-177.2	0	0	111.8	S972 N973 L974 K979 S980	S972-E976 PolarHBondContact O-N 3.17Å; N973-E976 PolarHBondContact O-N 2.89Å; L974-E976 PolarHBondContact O-N 3.37Å; E976-K979 PolarHBondContact O-N 2.81Å; E976-S980 PolarHBondContact O-N 3.5Å
977	R	91.2	Very high	88.2	Confident	85 Å²	85	56 Å²	56	32%	0.321	30%	0.295	S	S	.	.	H	α-helix	trans	-58.5	-51.7	175.2	-176.3	-177.2	178.4	-171.6	4	111.4	G930 D931 N973 L974 K979 S980 L981	G930-R977 PolarHBondContact O-NH1 2.69Å; D931-R977 PolarHBondContact O-NH1 3.48Å; D931-R977 PolarHBondContact O-NH2 2.95Å; N973-R977 PolarHBondContact O-N 3.16Å; L974-R977 PolarHBondContact O-N 3.46Å; R977-K979 VanDerWaalsContact C-N 3.29Å; R977-K979 PolarHBondContact O-N 3.29Å; R977-S980 PolarHBondContact O-N 3.44Å; R977-S980 PolarHBondContact O-OG 3.42Å; R977-L981 PolarHBondContact O-N 3.11Å; R977-L981 VanDerWaalsContact O-N 3.13Å
978	I	92	Very high	87.1	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-39.6	179.7	-68.9	170.3	0	0	0	110.9	C936 V939 P940 Y946 F951 L974 S980 L981 A982	C936-I978 HydrophobicContact CB-CG1 3.89Å; V939-I978 HydrophobicContact CB-CD1 4.27Å; V939-I978 HydrophobicContact CB-CG2 4.02Å; V939-I978 HydrophobicContact CG1-CD1 4.26Å; V939-I978 HydrophobicContact CG1-CG2 3.88Å; V939-I978 HydrophobicContact CG2-CD1 4.18Å; P940-I978 HydrophobicContact CG-CG2 3.8Å; Y946-I978 HydrophobicContact CE2-CG2 4.03Å; F951-I978 HydrophobicContact CE2-CB 4.37Å; F951-I978 HydrophobicContact CE2-CD1 3.67Å; F951-I978 HydrophobicContact CE2-CG2 4.14Å; F951-I978 HydrophobicContact CZ-CD1 4.41Å; L974-I978 HydrophobicContact CD1-CD1 3.83Å; L974-I978 HydrophobicContact CD1-CG1 4.17Å; L974-I978 HydrophobicContact CG-CD1 3.86Å; L974-I978 WeakPolarHBondContact O-CG1 3.49Å; L974-I978 PolarHBondContact O-N 3.04Å; I978-S980 PolarHBondContact O-N 2.8Å; I978-L981 PolarHBondContact O-N 3.44Å; I978-A982 WeakPolarHBondContact O-CB 3.33Å; I978-A982 PolarHBondContact O-N 2.94Å
979	K	89.2	Confident	85.9	Confident	102 Å²	102	63.4 Å²	63.4	44%	0.443	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-44.9	175.5	-174.6	-173.2	173	-166.7	0	111.8	A975 E976 R977 L981 A982 D983	A975-K979 WeakPolarHBondContact O-CB 3.39Å; A975-K979 PolarHBondContact O-N 3.38Å; E976-K979 PolarHBondContact O-N 2.81Å; R977-K979 VanDerWaalsContact C-N 3.29Å; R977-K979 PolarHBondContact O-N 3.29Å; K979-L981 VanDerWaalsContact C-N 3.3Å; K979-L981 PolarHBondContact O-N 2.99Å; K979-A982 WeakPolarHBondContact O-CB 3.33Å; K979-A982 PolarHBondContact O-N 3.41Å; K979-D983 VanDerWaalsContact O-CG 3.29Å; K979-D983 PolarHBondContact O-N 2.99Å
980	S	88.3	Confident	84.7	Confident	66 Å²	66	65.7 Å²	65.7	46%	0.462	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-37.8	178.6	69	0	0	0	0	113	E976 R977 I978 L984	E976-S980 PolarHBondContact O-N 3.5Å; R977-S980 PolarHBondContact O-N 3.44Å; R977-S980 PolarHBondContact O-OG 3.42Å; I978-S980 PolarHBondContact O-N 2.8Å; S980-L984 PolarHBondContact O-N 3.21Å; S980-L984 VanDerWaalsContact O-N 3.14Å
981	L	86.4	Confident	83.2	Confident	32 Å²	32	65.6 Å²	65.6	17%	0.168	33%	0.329	C	S	.	.	H	α-helix	trans	-70.1	-37.9	174.7	-68.8	171.2	0	0	0	111.8	C936 A937 R977 I978 K979 L984 Q985	C936-L981 HydrophobicContact CB-CD1 3.53Å; A937-L981 HydrophobicContact CB-CD1 4.4Å; R977-L981 PolarHBondContact O-N 3.11Å; R977-L981 VanDerWaalsContact O-N 3.13Å; I978-L981 PolarHBondContact O-N 3.44Å; K979-L981 VanDerWaalsContact C-N 3.3Å; K979-L981 PolarHBondContact O-N 2.99Å; L981-L984 PolarHBondContact O-N 3.37Å; L981-Q985 WeakPolarHBondContact O-CB 3.39Å; L981-Q985 PolarHBondContact O-N 3.4Å
982	A	85.2	Confident	81.9	Confident	15 Å²	15	68 Å²	68	12%	0.124	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-45.4	174.2	0	0	0	0	0	111.7	P940 Y946 I978 K979 L984 Q985 Q986	P940-A982 HydrophobicContact CB-CB 3.59Å; P940-A982 HydrophobicContact CG-CB 3.54Å; Y946-A982 HydrophobicContact CE1-CB 4.43Å; I978-A982 WeakPolarHBondContact O-CB 3.33Å; I978-A982 PolarHBondContact O-N 2.94Å; K979-A982 WeakPolarHBondContact O-CB 3.33Å; K979-A982 PolarHBondContact O-N 3.41Å; A982-L984 VanDerWaalsContact C-N 3.31Å; A982-L984 PolarHBondContact O-N 3.17Å; A982-Q985 PolarHBondContact O-N 2.95Å; A982-Q986 WeakPolarHBondContact O-CB 3.3Å; A982-Q986 PolarHBondContact O-N 2.98Å
983	D	83.9	Confident	80.4	Confident	70 Å²	70	70.8 Å²	70.8	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-63	-39.2	178.8	-66.6	-22.3	0	0	0	110.8	K979 Q987	K979-D983 VanDerWaalsContact O-CG 3.29Å; K979-D983 PolarHBondContact O-N 2.99Å; D983-Q987 VanDerWaalsContact O-CG 3.3Å; D983-Q987 WeakPolarHBondContact O-CG 3.42Å; D983-Q987 PolarHBondContact O-N 3.3Å
984	L	80.4	Confident	79.3	Confident	91 Å²	91	70.2 Å²	70.2	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-69.1	-43.3	176.2	-169.6	139.8	0	0	0	112	S980 L981 A982 Q987 E988	S980-L984 PolarHBondContact O-N 3.21Å; S980-L984 VanDerWaalsContact O-N 3.14Å; L981-L984 PolarHBondContact O-N 3.37Å; A982-L984 VanDerWaalsContact C-N 3.31Å; A982-L984 PolarHBondContact O-N 3.17Å; L984-Q987 WeakPolarHBondContact O-CB 3.08Å; L984-Q987 PolarHBondContact O-N 3.47Å; L984-E988 HydrophobicContact CD2-CG 4.46Å; L984-E988 WeakPolarHBondContact O-CG 3.17Å; L984-E988 PolarHBondContact O-N 3.01Å
985	Q	75.9	Confident	78.5	Confident	28 Å²	28	70.4 Å²	70.4	13%	0.131	36%	0.364	C	S	.	.	H	α-helix	trans	-66.9	-38.5	178.1	-170.1	-177.5	-11.3	0	0	112	A937 L981 A982 Q987 E988 E989	A937-Q985 PolarHBondContact O-OE1 3.29Å; L981-Q985 WeakPolarHBondContact O-CB 3.39Å; L981-Q985 PolarHBondContact O-N 3.4Å; A982-Q985 PolarHBondContact O-N 2.95Å; Q985-Q987 VanDerWaalsContact C-N 3.31Å; Q985-Q987 PolarHBondContact O-N 3Å; Q985-E988 CarbonylContact O-C 3.58Å; Q985-E988 WeakPolarHBondContact O-CB 3.42Å; Q985-E988 PolarHBondContact O-N 3.48Å; Q985-E988 VanDerWaalsContact O-N 3.11Å; Q985-E989 HydrophobicContact CG-CG 4.39Å; Q985-E989 PolarHBondContact NE2-OE1 3.14Å; Q985-E989 PolarHBondContact O-N 3.37Å
986	Q	74.2	Confident	77.9	Confident	107 Å²	107	72.9 Å²	72.9	50%	0.5	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-41.7	175.1	-173.8	-177.7	-16.7	0	0	111	A982 E988 E989 E990	A982-Q986 WeakPolarHBondContact O-CB 3.3Å; A982-Q986 PolarHBondContact O-N 2.98Å; Q986-E988 VanDerWaalsContact C-N 3.28Å; Q986-E988 PolarHBondContact O-N 3.37Å; Q986-E989 PolarHBondContact O-N 3.1Å; Q986-E990 WeakPolarHBondContact CG-OE1 3.38Å; Q986-E990 PolarHBondContact NE2-OE1 3.03Å; Q986-E990 WeakPolarHBondContact O-CB 3.48Å; Q986-E990 VanDerWaalsContact O-CG 3.26Å; Q986-E990 WeakPolarHBondContact O-CG 3.49Å; Q986-E990 PolarHBondContact O-N 3.33Å
987	Q	71.7	Confident	77.3	Confident	120 Å²	120	73.1 Å²	73.1	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-63.2	-34.6	174	-70.3	170.9	10.6	0	0	112.4	D983 L984 Q985 T991	D983-Q987 VanDerWaalsContact O-CG 3.3Å; D983-Q987 WeakPolarHBondContact O-CG 3.42Å; D983-Q987 PolarHBondContact O-N 3.3Å; L984-Q987 WeakPolarHBondContact O-CB 3.08Å; L984-Q987 PolarHBondContact O-N 3.47Å; Q985-Q987 VanDerWaalsContact C-N 3.31Å; Q985-Q987 PolarHBondContact O-N 3Å; Q987-T991 PolarHBondContact O-N 3.37Å; Q987-T991 PolarHBondContact O-OG1 3.16Å
988	E	69.1	Low	77	Confident	86 Å²	86	74.6 Å²	74.6	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-71.3	-47.6	174.6	-74.9	-175.4	165.4	0	0	112.3	L984 Q985 Q986 E990 T991 Y992	L984-E988 HydrophobicContact CD2-CG 4.46Å; L984-E988 WeakPolarHBondContact O-CG 3.17Å; L984-E988 PolarHBondContact O-N 3.01Å; Q985-E988 CarbonylContact O-C 3.58Å; Q985-E988 WeakPolarHBondContact O-CB 3.42Å; Q985-E988 PolarHBondContact O-N 3.48Å; Q985-E988 VanDerWaalsContact O-N 3.11Å; Q986-E988 VanDerWaalsContact C-N 3.28Å; Q986-E988 PolarHBondContact O-N 3.37Å; E988-E990 VanDerWaalsContact C-N 3.34Å; E988-E990 PolarHBondContact O-N 3.49Å; E988-T991 WeakPolarHBondContact O-CA 3.45Å; E988-T991 WeakPolarHBondContact O-CB 3.26Å; E988-T991 PolarHBondContact O-N 3.33Å; E988-Y992 HydrophobicContact CB-CD2 4.44Å; E988-Y992 HydrophobicContact CB-CE2 3.89Å; E988-Y992 HydrophobicContact CG-CE2 4.45Å; E988-Y992 WeakPolarHBondContact O-CD2 3.28Å; E988-Y992 WeakPolarHBondContact O-CE2 3.38Å; E988-Y992 PolarHBondContact O-N 2.72Å
989	E	68.3	Low	76.7	Confident	113 Å²	113	75.2 Å²	75.2	53%	0.528	40%	0.398	S	S	.	.	H	α-helix	trans	-62.2	-39.2	178.2	-74.7	177.2	-173.9	0	0	112.3	Q985 Q986 T991 Y992 A993	Q985-E989 HydrophobicContact CG-CG 4.39Å; Q985-E989 PolarHBondContact NE2-OE1 3.14Å; Q985-E989 PolarHBondContact O-N 3.37Å; Q986-E989 PolarHBondContact O-N 3.1Å; E989-T991 PolarHBondContact O-N 2.98Å; E989-Y992 PolarHBondContact O-N 2.84Å; E989-Y992 VanDerWaalsContact O-N 3.14Å; E989-A993 PolarHBondContact O-N 2.94Å; E989-A993 VanDerWaalsContact O-N 3.1Å
990	E	68.1	Low	76.6	Confident	131 Å²	131	72.6 Å²	72.6	61%	0.612	39%	0.388	S	S	*	.	H	α-helix	trans	-62.3	-26.8	171.7	-73.5	173.7	-168.5	0	0	112.4	Q986 E988	Q986-E990 WeakPolarHBondContact CG-OE1 3.38Å; Q986-E990 PolarHBondContact NE2-OE1 3.03Å; Q986-E990 WeakPolarHBondContact O-CB 3.48Å; Q986-E990 VanDerWaalsContact O-CG 3.26Å; Q986-E990 WeakPolarHBondContact O-CG 3.49Å; Q986-E990 PolarHBondContact O-N 3.33Å; E988-E990 VanDerWaalsContact C-N 3.34Å; E988-E990 PolarHBondContact O-N 3.49Å
991	T	63.9	Low	76.5	Confident	38 Å²	38	69.5 Å²	69.5	23%	0.233	37%	0.367	C	S	.	.	H	α-helix	trans	-76.3	-27.5	176.2	-54.3	0	0	0	0	112.2	Q987 E988 E989 K1069	Q987-T991 PolarHBondContact O-N 3.37Å; Q987-T991 PolarHBondContact O-OG1 3.16Å; E988-T991 WeakPolarHBondContact O-CA 3.45Å; E988-T991 WeakPolarHBondContact O-CB 3.26Å; E988-T991 PolarHBondContact O-N 3.33Å; E989-T991 PolarHBondContact O-N 2.98Å; T991-K1069 HydrophobicContact CG2-CD 3.84Å; T991-K1069 PolarHBondContact OG1-NZ 3.39Å
992	Y	67.1	Low	76.4	Confident	53 Å²	53	71 Å²	71	21%	0.208	38%	0.379	C	S	.	.	H	α-helix	trans	-112.8	9.1	-171.7	-51.1	-51.1	0	0	0	114.2	E988 E989 D994 A995 W1061 L1062 R1065	E988-Y992 HydrophobicContact CB-CD2 4.44Å; E988-Y992 HydrophobicContact CB-CE2 3.89Å; E988-Y992 HydrophobicContact CG-CE2 4.45Å; E988-Y992 WeakPolarHBondContact O-CD2 3.28Å; E988-Y992 WeakPolarHBondContact O-CE2 3.38Å; E988-Y992 PolarHBondContact O-N 2.72Å; E989-Y992 PolarHBondContact O-N 2.84Å; E989-Y992 VanDerWaalsContact O-N 3.14Å; Y992-D994 PolarHBondContact O-N 3.46Å; Y992-A995 WeakPolarHBondContact O-CB 3.38Å; Y992-A995 PolarHBondContact O-N 3Å; Y992-W1061 HydrophobicContact CD1-CH2 4.15Å; Y992-W1061 HydrophobicContact CD1-CZ3 4.2Å; Y992-W1061 HydrophobicContact CG-CH2 4.42Å; Y992-W1061 HydrophobicContact CG-CZ3 4.48Å; Y992-L1062 HydrophobicContact CD1-CD2 4.33Å; Y992-L1062 HydrophobicContact CE1-CD2 4.2Å; Y992-R1065 HydrophobicContact CD1-CB 4.45Å; Y992-R1065 HydrophobicContact CE1-CB 4.18Å
993	A	63.2	Low	76.3	Confident	91 Å²	91	74 Å²	74	75%	0.752	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.8	-177.5	0	0	0	0	0	114.6	E989	E989-A993 PolarHBondContact O-N 2.94Å; E989-A993 VanDerWaalsContact O-N 3.1Å
994	D	70.8	Confident	76.1	Confident	83 Å²	83	74.4 Å²	74.4	44%	0.444	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	18.7	176.7	69.7	-18.7	0	0	0	114	Y992 R1065	Y992-D994 PolarHBondContact O-N 3.46Å; D994-R1065 IonicContact OD1-CZ 2.82Å; D994-R1065 IonicContact OD1-NH1 2.82Å; D994-R1065 PolarHBondContact OD1-NH1 3.43Å; D994-R1065 IonicContact OD1-NH2 2.63Å; D994-R1065 IonicContact OD2-CZ 2.91Å; D994-R1065 IonicContact OD2-NH1 3.82Å; D994-R1065 PolarHBondContact OD2-NH1 2.83Å; D994-R1065 IonicContact OD2-NH2 3.2Å; D994-R1065 PolarHBondContact OD2-NH2 3.21Å
995	A	75.1	Confident	76.2	Confident	16 Å²	16	74.5 Å²	74.5	13%	0.132	40%	0.4	C	S	.	.			trans	-56.2	136.3	172	0	0	0	0	0	111.5	Y992 L1000 L1007 W1061	Y992-A995 WeakPolarHBondContact O-CB 3.38Å; Y992-A995 PolarHBondContact O-N 3Å; A995-L1000 HydrophobicContact CB-CD2 4.21Å; A995-L1007 HydrophobicContact CB-CD1 4.21Å; A995-W1061 HydrophobicContact CB-CH2 3.61Å; A995-W1061 HydrophobicContact CB-CZ2 3.99Å; A995-W1061 HydrophobicContact CB-CZ3 4.2Å
996	C	80.6	Confident	76.4	Confident	67 Å²	67	76.9 Å²	76.9	45%	0.453	42%	0.417	S	S	.	.			trans	-64.2	144.1	174.6	-74.8	0	0	0	0	111.2	E998 F999	C996-E998 HydrophobicContact CB-CG 3.94Å; C996-E998 PolarHBondContact O-N 3.5Å; C996-F999 HydrophobicContact CB-CD2 4.32Å; C996-F999 HydrophobicContact CB-CE2 4.4Å; C996-F999 WeakPolarHBondContact O-CB 3.47Å; C996-F999 PolarHBondContact O-N 3.34Å
997	D	79.2	Confident	76.9	Confident	141 Å²	141	74.1 Å²	74.1	75%	0.754	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-53.4	-29.2	179.7	-67.1	-20.1	0	0	0	113.3	F999 L1000	D997-F999 PolarHBondContact O-N 3.13Å; D997-L1000 PolarHBondContact O-N 3.1Å
998	E	84	Confident	77.6	Confident	117 Å²	117	68.6 Å²	68.6	55%	0.547	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-67.7	-17.2	176.9	61.7	171.1	-169.8	0	0	114.5	C996 M1008	C996-E998 HydrophobicContact CB-CG 3.94Å; C996-E998 PolarHBondContact O-N 3.5Å; E998-M1008 WeakPolarHBondContact O-CE 3.45Å
999	F	87.1	Confident	78.3	Confident	13 Å²	13	69.5 Å²	69.5	6%	0.057	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-93.1	-8.9	176	-58.1	-22.4	0	0	0	112.6	C996 D997 L1007 M1008 L1054 K1057 I1058 W1061	C996-F999 HydrophobicContact CB-CD2 4.32Å; C996-F999 HydrophobicContact CB-CE2 4.4Å; C996-F999 WeakPolarHBondContact O-CB 3.47Å; C996-F999 PolarHBondContact O-N 3.34Å; D997-F999 PolarHBondContact O-N 3.13Å; F999-L1007 HydrophobicContact CB-CD1 3.65Å; F999-M1008 PolarHBondContact O-N 2.88Å; F999-L1054 HydrophobicContact CD1-CD1 3.93Å; F999-L1054 HydrophobicContact CE1-CD1 4.09Å; F999-K1057 HydrophobicContact CE1-CB 4.15Å; F999-I1058 HydrophobicContact CB-CD1 4.23Å; F999-I1058 HydrophobicContact CB-CG1 3.92Å; F999-I1058 HydrophobicContact CD1-CD1 4.34Å; F999-I1058 HydrophobicContact CD1-CG1 3.56Å; F999-I1058 HydrophobicContact CE1-CG1 4.24Å; F999-I1058 HydrophobicContact CG-CG1 3.77Å; F999-W1061 HydrophobicContact CD2-CD2 4.17Å; F999-W1061 HydrophobicContact CD2-CE3 4.43Å; F999-W1061 HydrophobicContact CD2-CG 4.25Å; F999-W1061 HydrophobicContact CE2-CB 3.9Å; F999-W1061 AromaticContact CE2-CD1 3.83Å; F999-W1061 HydrophobicContact CE2-CD2 4.03Å; F999-W1061 AromaticContact CE2-CG 3.64Å; F999-W1061 HydrophobicContact CE2-CG 3.64Å; F999-W1061 HydrophobicContact CZ-CB 4.45Å
1000	L	85.9	Confident	79.2	Confident	46 Å²	46	65.9 Å²	65.9	24%	0.241	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-92.6	139.5	-177.4	-56.5	-178.9	0	0	0	111.2	A995 D997 T1006	A995-L1000 HydrophobicContact CB-CD2 4.21Å; D997-L1000 PolarHBondContact O-N 3.1Å; L1000-T1006 CarbonylContact C-O 3.59Å; L1000-T1006 WeakPolarHBondContact CA-O 3.34Å
1001	D	86.4	Confident	80.3	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	35%	0.35	C	S	.	.			trans	-63.7	127.5	171.2	-178	-67.7	0	0	0	108.9	I1003 M1004 S1005 T1006 M1008 D1022 T1025	D1001-I1003 PolarHBondContact O-N 3.4Å; D1001-I1003 WeakPolarHBondContact OD1-CA 3.29Å; D1001-I1003 WeakPolarHBondContact OD1-CB 3.43Å; D1001-I1003 PolarHBondContact OD1-N 2.95Å; D1001-M1004 HydrophobicContact CB-CB 4.21Å; D1001-M1004 PolarHBondContact OD1-N 3.35Å; D1001-S1005 WeakPolarHBondContact O-CA 3.31Å; D1001-S1005 PolarHBondContact O-N 3.34Å; D1001-T1006 PolarHBondContact N-O 2.83Å; D1001-M1008 HydrophobicContact CB-CG 3.86Å; D1001-D1022 WeakPolarHBondContact OD2-CB 3.44Å; D1001-D1022 PolarHBondContact OD2-N 3.22Å; D1001-T1025 VanDerWaalsContact OD2-CB 3.29Å; D1001-T1025 WeakPolarHBondContact OD2-CB 3.41Å; D1001-T1025 PolarHBondContact OD2-OG1 3.19Å
1002	P	84.9	Confident	81.7	Confident	65 Å²	65	57.9 Å²	57.9	42%	0.422	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-10.3	-174.5	27.9	-35	0	0	0	114.5	V1019 T1020 V1021 F1038	P1002-V1019 HydrophobicContact CB-CG1 4.43Å; P1002-V1019 HydrophobicContact CG-CG1 3.64Å; P1002-T1020 VanDerWaalsContact CD-O 3.22Å; P1002-T1020 WeakPolarHBondContact CD-O 3.5Å; P1002-T1020 WeakPolarHBondContact CG-O 3.34Å; P1002-V1021 HydrophobicContact CG-CG1 3.7Å; P1002-F1038 HydrophobicContact CB-CE1 4.48Å; P1002-F1038 HydrophobicContact CB-CZ 4.3Å; P1002-F1038 HydrophobicContact CG-CE1 4.47Å; P1002-F1038 HydrophobicContact CG-CZ 3.83Å
1003	I	82.8	Confident	82.9	Confident	77 Å²	77	57.3 Å²	57.3	40%	0.395	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-46.5	175.8	-61.8	170.4	0	0	0	110	D1001 V1021 T1025 P1037 F1038	D1001-I1003 PolarHBondContact O-N 3.4Å; D1001-I1003 WeakPolarHBondContact OD1-CA 3.29Å; D1001-I1003 WeakPolarHBondContact OD1-CB 3.43Å; D1001-I1003 PolarHBondContact OD1-N 2.95Å; I1003-V1021 HydrophobicContact CD1-CG1 4.43Å; I1003-T1025 HydrophobicContact CB-CG2 3.92Å; I1003-T1025 HydrophobicContact CD1-CG2 3.88Å; I1003-T1025 HydrophobicContact CG1-CG2 4.44Å; I1003-T1025 HydrophobicContact CG2-CG2 4.13Å; I1003-P1037 HydrophobicContact CD1-CB 4.2Å; I1003-P1037 HydrophobicContact CD1-CG 3.83Å; I1003-F1038 HydrophobicContact CD1-CE2 4.3Å; I1003-F1038 HydrophobicContact CD1-CZ 3.93Å; I1003-F1038 HydrophobicContact CG1-CE1 4.31Å; I1003-F1038 HydrophobicContact CG1-CZ 3.76Å
1004	M	79.8	Confident	84.2	Confident	79 Å²	79	53 Å²	53	39%	0.389	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-12.2	-173.4	-61.7	-60.5	-64.4	0	0	113.4	D1001 T1006 T1025	D1001-M1004 HydrophobicContact CB-CB 4.21Å; D1001-M1004 PolarHBondContact OD1-N 3.35Å; M1004-T1006 WeakPolarHBondContact CB-OG1 3.34Å; M1004-T1006 PolarHBondContact O-N 3.41Å; M1004-T1025 HydrophobicContact CG-CG2 3.82Å
1005	S	81.3	Confident	85	Confident	92 Å²	92	51.7 Å²	51.7	64%	0.643	30%	0.301	S	S	*	.			trans	51.7	31.9	-175	-62	0	0	0	0	113.8	D1001	D1001-S1005 WeakPolarHBondContact O-CA 3.31Å; D1001-S1005 PolarHBondContact O-N 3.34Å
1006	T	81.5	Confident	85.6	Confident	78 Å²	78	53.5 Å²	53.5	48%	0.479	31%	0.312	S	S	.	.	S	Bend	trans	-120.1	157.2	-179.6	47	0	0	0	0	110.4	L1000 D1001 M1004 M1008	L1000-T1006 CarbonylContact C-O 3.59Å; L1000-T1006 WeakPolarHBondContact CA-O 3.34Å; D1001-T1006 PolarHBondContact N-O 2.83Å; M1004-T1006 WeakPolarHBondContact CB-OG1 3.34Å; M1004-T1006 PolarHBondContact O-N 3.41Å; T1006-M1008 PolarHBondContact O-N 3.39Å
1007	L	83.9	Confident	85.9	Confident	50 Å²	50	51.8 Å²	51.8	26%	0.262	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-58.4	126.4	179.6	-168.4	76	0	0	0	111.1	A995 F999 C1009 I1058 W1061 L1062	A995-L1007 HydrophobicContact CB-CD1 4.21Å; F999-L1007 HydrophobicContact CB-CD1 3.65Å; L1007-C1009 PolarHBondContact O-N 3.41Å; L1007-I1058 HydrophobicContact CD1-CG2 4.25Å; L1007-I1058 HydrophobicContact CD2-CG2 4.24Å; L1007-I1058 HydrophobicContact CG-CG2 4.22Å; L1007-W1061 HydrophobicContact CD1-CZ3 4.28Å; L1007-W1061 HydrophobicContact CD2-CZ3 4.44Å; L1007-L1062 HydrophobicContact CD2-CD1 4.06Å; L1007-L1062 HydrophobicContact CD2-CD2 3.77Å; L1007-L1062 HydrophobicContact CD2-CG 4.18Å
1008	M	87.1	Confident	86.3	Confident	4 Å²	4	55 Å²	55	2%	0.02	30%	0.303	C	S	.	.			trans	-70.1	124.8	178	-68.5	-177.6	-80.6	0	0	110.7	E998 F999 D1001 T1006 P1011 T1020 D1022 L1054 I1058	E998-M1008 WeakPolarHBondContact O-CE 3.45Å; F999-M1008 PolarHBondContact O-N 2.88Å; D1001-M1008 HydrophobicContact CB-CG 3.86Å; T1006-M1008 PolarHBondContact O-N 3.39Å; M1008-P1011 HydrophobicContact CB-CB 4.17Å; M1008-P1011 HydrophobicContact CE-CB 4.49Å; M1008-P1011 HydrophobicContact SD-CB 3.94Å; M1008-T1020 HydrophobicContact CE-CG2 4.36Å; M1008-T1020 HydrophobicContact SD-CG2 3.98Å; M1008-D1022 HydrophobicContact CB-CB 4.47Å; M1008-D1022 HydrophobicContact CG-CB 4.18Å; M1008-L1054 HydrophobicContact CE-CD2 3.59Å; M1008-I1058 HydrophobicContact CB-CD1 4Å; M1008-I1058 WeakPolarHBondContact O-CD1 3.46Å
1009	C	84	Confident	86.7	Confident	104 Å²	104	51.5 Å²	51.5	70%	0.703	29%	0.29	S	S	*	.	S	Bend	trans	-88.1	-38.4	176.4	-72.7	0	0	0	0	111.3	L1007 D1022	L1007-C1009 PolarHBondContact O-N 3.41Å; C1009-D1022 PolarHBondContact N-OD1 2.97Å
1010	D	87.4	Confident	86.9	Confident	38 Å²	38	52.3 Å²	52.3	20%	0.203	30%	0.296	C	S	.	.	S	Bend	trans	-135.1	81.1	177.3	-166.3	38.7	0	0	0	110.6	V1012 D1022 R1023 K1055	D1010-V1012 PolarHBondContact O-N 2.94Å; D1010-D1022 PolarHBondContact N-OD1 3.32Å; D1010-R1023 HydrophobicContact CB-CB 4.13Å; D1010-R1023 PolarHBondContact O-N 3.42Å; D1010-R1023 VanDerWaalsContact OD2-CD 3.23Å; D1010-R1023 WeakPolarHBondContact OD2-CD 3.49Å; D1010-R1023 IonicContact OD2-CZ 2.69Å; D1010-R1023 IonicContact OD2-NE 3.22Å; D1010-R1023 PolarHBondContact OD2-NE 3.13Å; D1010-R1023 IonicContact OD2-NH2 3.81Å; D1010-K1055 IonicContact OD1-NZ 3.86Å; D1010-K1055 PolarHBondContact OD1-NZ 3.29Å
1011	P	91.1	Very high	87.1	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	131.9	-175.7	27.4	-34.6	0	0	0	111.4	M1008 T1020 N1051 L1054 K1055 I1058	M1008-P1011 HydrophobicContact CB-CB 4.17Å; M1008-P1011 HydrophobicContact CE-CB 4.49Å; M1008-P1011 HydrophobicContact SD-CB 3.94Å; P1011-T1020 HydrophobicContact CB-CG2 3.61Å; P1011-N1051 HydrophobicContact CB-CB 4.22Å; P1011-N1051 HydrophobicContact CG-CB 4.47Å; P1011-N1051 WeakPolarHBondContact O-CB 3.47Å; P1011-N1051 PolarHBondContact O-N 3.45Å; P1011-L1054 HydrophobicContact CB-CB 4.4Å; P1011-L1054 HydrophobicContact CB-CD2 3.93Å; P1011-L1054 HydrophobicContact CB-CG 4.35Å; P1011-L1054 HydrophobicContact CG-CB 4.17Å; P1011-L1054 HydrophobicContact CG-CD2 4.45Å; P1011-L1054 HydrophobicContact CG-CG 4.33Å; P1011-K1055 HydrophobicContact CG-CB 3.71Å; P1011-K1055 HydrophobicContact CG-CG 4.41Å; P1011-I1058 HydrophobicContact CG-CD1 4.29Å
1012	V	91.8	Very high	87.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.7	179.8	-63.3	0	0	0	0	111.4	D1010 T1020 V1021 R1023 I1026 I1048 R1049	D1010-V1012 PolarHBondContact O-N 2.94Å; V1012-T1020 CarbonylContact O-C 3.57Å; V1012-T1020 VanDerWaalsContact O-CA 3.25Å; V1012-T1020 WeakPolarHBondContact O-CA 3.5Å; V1012-T1020 WeakPolarHBondContact O-CG2 3.35Å; V1012-V1021 HydrophobicContact CG2-CG2 3.97Å; V1012-V1021 VanDerWaalsContact CG2-O 3.28Å; V1012-V1021 WeakPolarHBondContact CG2-O 3.24Å; V1012-V1021 PolarHBondContact N-O 3.3Å; V1012-V1021 PolarHBondContact O-N 3.49Å; V1012-R1023 HydrophobicContact CG1-CB 3.87Å; V1012-R1023 HydrophobicContact CG1-CG 4.34Å; V1012-R1023 HydrophobicContact CG2-CB 4.32Å; V1012-I1026 HydrophobicContact CG2-CG2 3.83Å; V1012-I1048 HydrophobicContact CB-CG2 3.4Å; V1012-I1048 VanDerWaalsContact CB-CG2 3.4Å; V1012-I1048 HydrophobicContact CG1-CG2 4.03Å; V1012-I1048 HydrophobicContact CG2-CG2 3.51Å; V1012-R1049 CarbonylContact C-O 3.56Å; V1012-R1049 WeakPolarHBondContact CA-O 3.37Å
1013	V	92.4	Very high	87.5	Confident	41 Å²	41	49.5 Å²	49.5	25%	0.248	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.6	-177.9	175.9	0	0	0	0	109.9	T1020 R1049 N1051	V1013-T1020 WeakPolarHBondContact CG2-OG1 3.41Å; V1013-R1049 PolarHBondContact N-O 3.49Å; V1013-R1049 PolarHBondContact O-N 2.94Å; V1013-N1051 HydrophobicContact CG2-CB 3.81Å
1014	L	92.2	Very high	87.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.262	C	S	.	.			trans	-78.3	129.2	173.1	-53.3	-174.2	0	0	0	110	S1016 S1017 R1018 V1019 V1021 I1026 D1036 P1037 F1038 L1043 I1048	L1014-S1016 PolarHBondContact O-N 3.31Å; L1014-S1017 WeakPolarHBondContact CB-OG 3.41Å; L1014-R1018 WeakPolarHBondContact O-CA 3.31Å; L1014-R1018 PolarHBondContact O-N 2.99Å; L1014-V1019 PolarHBondContact N-O 3.3Å; L1014-V1021 HydrophobicContact CD1-CG1 4.32Å; L1014-V1021 HydrophobicContact CD1-CG2 4.19Å; L1014-V1021 HydrophobicContact CD2-CG2 3.74Å; L1014-V1021 HydrophobicContact CG-CG2 3.97Å; L1014-I1026 HydrophobicContact CD1-CD1 4.13Å; L1014-I1026 HydrophobicContact CD2-CB 4.3Å; L1014-I1026 HydrophobicContact CD2-CD1 3.83Å; L1014-I1026 HydrophobicContact CD2-CG1 3.66Å; L1014-D1036 WeakPolarHBondContact CB-OD2 3.39Å; L1014-P1037 HydrophobicContact CD1-CG 4.36Å; L1014-F1038 HydrophobicContact CD1-CD2 3.82Å; L1014-F1038 HydrophobicContact CD1-CE2 3.78Å; L1014-L1043 HydrophobicContact CD2-CD2 3.96Å; L1014-I1048 HydrophobicContact CD2-CD1 4.5Å; L1014-I1048 HydrophobicContact CD2-CG1 4.41Å
1015	P	87.1	Confident	87.9	Confident	56 Å²	56	43.6 Å²	43.6	36%	0.364	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.9	-171	25.1	-34.7	0	0	0	113.9	L1043 Q1047	P1015-L1043 HydrophobicContact CG-CD1 3.59Å; P1015-Q1047 HydrophobicContact CG-CB 4.13Å
1016	S	86.9	Confident	88.2	Confident	53 Å²	53	39.2 Å²	39.2	37%	0.371	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-52.1	-175.1	60.6	0	0	0	0	112.4	L1014 D1036 N1039 S1041	L1014-S1016 PolarHBondContact O-N 3.31Å; S1016-D1036 WeakPolarHBondContact OG-CB 3.31Å; S1016-D1036 PolarHBondContact OG-OD2 2.92Å; S1016-N1039 WeakPolarHBondContact CB-ND2 3.19Å; S1016-N1039 PolarHBondContact OG-ND2 3.47Å; S1016-S1041 WeakPolarHBondContact CB-OG 3.25Å; S1016-S1041 PolarHBondContact OG-OG 3.16Å
1017	S	87.3	Confident	88.2	Confident	31 Å²	31	35.7 Å²	35.7	22%	0.217	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-20.5	177.9	60.8	0	0	0	0	113.5	L1014 V1019 D1036 N1039	L1014-S1017 WeakPolarHBondContact CB-OG 3.41Å; S1017-V1019 PolarHBondContact O-N 3.18Å; S1017-V1019 VanDerWaalsContact O-N 3.16Å; S1017-V1019 PolarHBondContact OG-N 3.36Å; S1017-D1036 WeakPolarHBondContact CB-OD2 3.41Å; S1017-D1036 PolarHBondContact N-OD2 3.03Å; S1017-D1036 PolarHBondContact OG-OD1 2.95Å; S1017-D1036 PolarHBondContact OG-OD2 3.19Å; S1017-N1039 PolarHBondContact N-ND2 3.05Å; S1017-N1039 VanDerWaalsContact N-ND2 3.18Å
1018	R	88.6	Confident	87.9	Confident	208 Å²	208	35.4 Å²	35.4	79%	0.785	19%	0.191	S	C	*	.			trans	59	14.1	-171.4	-55	-175.4	-179.4	-173.4	0.8	114	L1014	L1014-R1018 WeakPolarHBondContact O-CA 3.31Å; L1014-R1018 PolarHBondContact O-N 2.99Å
1019	V	90.9	Very high	87.7	Confident	45 Å²	45	37.6 Å²	37.6	27%	0.273	20%	0.201	S	C	.	.			trans	-77	140.3	175	179.3	0	0	0	0	108.6	P1002 L1014 S1017 V1021 F1038	P1002-V1019 HydrophobicContact CB-CG1 4.43Å; P1002-V1019 HydrophobicContact CG-CG1 3.64Å; L1014-V1019 PolarHBondContact N-O 3.3Å; S1017-V1019 PolarHBondContact O-N 3.18Å; S1017-V1019 VanDerWaalsContact O-N 3.16Å; S1017-V1019 PolarHBondContact OG-N 3.36Å; V1019-V1021 HydrophobicContact CG1-CG1 4.19Å; V1019-F1038 HydrophobicContact CB-CD2 3.99Å; V1019-F1038 HydrophobicContact CB-CE2 3.91Å; V1019-F1038 HydrophobicContact CB-CZ 4.42Å; V1019-F1038 HydrophobicContact CG1-CD2 4.19Å; V1019-F1038 HydrophobicContact CG1-CE1 4.31Å; V1019-F1038 HydrophobicContact CG1-CE2 3.65Å; V1019-F1038 HydrophobicContact CG1-CZ 3.73Å; V1019-F1038 HydrophobicContact CG2-CD2 4.12Å; V1019-F1038 HydrophobicContact CG2-CE2 4.41Å; V1019-F1038 HydrophobicContact CG2-CG 4.21Å
1020	T	91	Very high	87.7	Confident	30 Å²	30	33.4 Å²	33.4	18%	0.184	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.5	171.4	-56.4	0	0	0	0	108.9	P1002 M1008 P1011 V1012 V1013 N1051 L1054	P1002-T1020 VanDerWaalsContact CD-O 3.22Å; P1002-T1020 WeakPolarHBondContact CD-O 3.5Å; P1002-T1020 WeakPolarHBondContact CG-O 3.34Å; M1008-T1020 HydrophobicContact CE-CG2 4.36Å; M1008-T1020 HydrophobicContact SD-CG2 3.98Å; P1011-T1020 HydrophobicContact CB-CG2 3.61Å; V1012-T1020 CarbonylContact O-C 3.57Å; V1012-T1020 VanDerWaalsContact O-CA 3.25Å; V1012-T1020 WeakPolarHBondContact O-CA 3.5Å; V1012-T1020 WeakPolarHBondContact O-CG2 3.35Å; V1013-T1020 WeakPolarHBondContact CG2-OG1 3.41Å; T1020-N1051 HydrophobicContact CG2-CB 4.09Å; T1020-N1051 PolarHBondContact OG1-ND2 3.27Å; T1020-L1054 HydrophobicContact CG2-CD2 3.75Å
1021	V	91.6	Very high	87.1	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	164.2	178.3	-65.1	0	0	0	0	108.8	P1002 I1003 V1012 L1014 V1019 I1026 F1038	P1002-V1021 HydrophobicContact CG-CG1 3.7Å; I1003-V1021 HydrophobicContact CD1-CG1 4.43Å; V1012-V1021 HydrophobicContact CG2-CG2 3.97Å; V1012-V1021 VanDerWaalsContact CG2-O 3.28Å; V1012-V1021 WeakPolarHBondContact CG2-O 3.24Å; V1012-V1021 PolarHBondContact N-O 3.3Å; V1012-V1021 PolarHBondContact O-N 3.49Å; L1014-V1021 HydrophobicContact CD1-CG1 4.32Å; L1014-V1021 HydrophobicContact CD1-CG2 4.19Å; L1014-V1021 HydrophobicContact CD2-CG2 3.74Å; L1014-V1021 HydrophobicContact CG-CG2 3.97Å; V1019-V1021 HydrophobicContact CG1-CG1 4.19Å; V1021-I1026 HydrophobicContact CG2-CB 3.76Å; V1021-I1026 HydrophobicContact CG2-CG1 4.48Å; V1021-I1026 HydrophobicContact CG2-CG2 3.99Å; V1021-F1038 HydrophobicContact CG1-CE2 3.71Å; V1021-F1038 HydrophobicContact CG1-CZ 3.93Å
1022	D	90.4	Very high	86.3	Confident	15 Å²	15	36.4 Å²	36.4	8%	0.08	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.9	169.3	-170.8	84.3	0	0	0	110.4	D1001 M1008 C1009 D1010 S1024 T1025 I1026	D1001-D1022 WeakPolarHBondContact OD2-CB 3.44Å; D1001-D1022 PolarHBondContact OD2-N 3.22Å; M1008-D1022 HydrophobicContact CB-CB 4.47Å; M1008-D1022 HydrophobicContact CG-CB 4.18Å; C1009-D1022 PolarHBondContact N-OD1 2.97Å; D1010-D1022 PolarHBondContact N-OD1 3.32Å; D1022-S1024 PolarHBondContact O-N 2.82Å; D1022-S1024 VanDerWaalsContact OD2-CB 3.32Å; D1022-S1024 WeakPolarHBondContact OD2-CB 3.47Å; D1022-S1024 PolarHBondContact OD2-N 2.93Å; D1022-S1024 PolarHBondContact OD2-OG 2.89Å; D1022-T1025 WeakPolarHBondContact O-CB 3.38Å; D1022-T1025 PolarHBondContact O-N 3.34Å; D1022-T1025 VanDerWaalsContact O-N 3.12Å; D1022-I1026 PolarHBondContact O-N 2.92Å
1023	R	88.8	Confident	85.8	Confident	37 Å²	37	40.2 Å²	40.2	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-53.9	-40.7	179.4	-176.8	-179.4	-73.3	-85.5	-11.6	112.6	E784 F879 D1010 V1012 I1026 A1027 M1045	E784-R1023 WeakPolarHBondContact OE1-CD 3.28Å; E784-R1023 IonicContact OE1-CZ 2.62Å; E784-R1023 IonicContact OE1-NE 3.2Å; E784-R1023 IonicContact OE1-NH1 2.83Å; E784-R1023 PolarHBondContact OE1-NH1 3.3Å; E784-R1023 IonicContact OE2-NH1 3.69Å; E784-R1023 PolarHBondContact OE2-NH1 3.48Å; F879-R1023 HydrophobicContact CE1-CG 4.4Å; F879-R1023 HydrophobicContact CZ-CG 4.49Å; D1010-R1023 HydrophobicContact CB-CB 4.13Å; D1010-R1023 PolarHBondContact O-N 3.42Å; D1010-R1023 VanDerWaalsContact OD2-CD 3.23Å; D1010-R1023 WeakPolarHBondContact OD2-CD 3.49Å; D1010-R1023 IonicContact OD2-CZ 2.69Å; D1010-R1023 IonicContact OD2-NE 3.22Å; D1010-R1023 PolarHBondContact OD2-NE 3.13Å; D1010-R1023 IonicContact OD2-NH2 3.81Å; V1012-R1023 HydrophobicContact CG1-CB 3.87Å; V1012-R1023 HydrophobicContact CG1-CG 4.34Å; V1012-R1023 HydrophobicContact CG2-CB 4.32Å; R1023-I1026 WeakPolarHBondContact O-CG2 3.4Å; R1023-A1027 WeakPolarHBondContact O-CB 3.39Å; R1023-A1027 PolarHBondContact O-N 3.02Å; R1023-M1045 HydrophobicContact CG-CE 3.51Å
1024	S	84.6	Confident	85.4	Confident	19 Å²	19	42.7 Å²	42.7	13%	0.133	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-36.4	-178.8	67.9	0	0	0	0	112.2	D1022 R1028	D1022-S1024 PolarHBondContact O-N 2.82Å; D1022-S1024 VanDerWaalsContact OD2-CB 3.32Å; D1022-S1024 WeakPolarHBondContact OD2-CB 3.47Å; D1022-S1024 PolarHBondContact OD2-N 2.93Å; D1022-S1024 PolarHBondContact OD2-OG 2.89Å; S1024-R1028 WeakPolarHBondContact O-CB 3.37Å; S1024-R1028 PolarHBondContact O-N 2.93Å
1025	T	86.3	Confident	85.1	Confident	12 Å²	12	43.9 Å²	43.9	7%	0.074	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-51.6	175.7	-54.5	0	0	0	0	111.3	D1001 I1003 M1004 D1022 R1028 H1029	D1001-T1025 VanDerWaalsContact OD2-CB 3.29Å; D1001-T1025 WeakPolarHBondContact OD2-CB 3.41Å; D1001-T1025 PolarHBondContact OD2-OG1 3.19Å; I1003-T1025 HydrophobicContact CB-CG2 3.92Å; I1003-T1025 HydrophobicContact CD1-CG2 3.88Å; I1003-T1025 HydrophobicContact CG1-CG2 4.44Å; I1003-T1025 HydrophobicContact CG2-CG2 4.13Å; M1004-T1025 HydrophobicContact CG-CG2 3.82Å; D1022-T1025 WeakPolarHBondContact O-CB 3.38Å; D1022-T1025 PolarHBondContact O-N 3.34Å; D1022-T1025 VanDerWaalsContact O-N 3.12Å; T1025-R1028 WeakPolarHBondContact O-CB 3.37Å; T1025-R1028 PolarHBondContact O-N 3.22Å; T1025-H1029 PolarHBondContact O-N 3.07Å
1026	I	88	Confident	85.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-72.8	-38.1	-178.1	-171.4	67.2	0	0	0	112.6	V1012 L1014 V1021 D1022 R1023 R1028 H1029 L1030 P1037 L1043 I1048	V1012-I1026 HydrophobicContact CG2-CG2 3.83Å; L1014-I1026 HydrophobicContact CD1-CD1 4.13Å; L1014-I1026 HydrophobicContact CD2-CB 4.3Å; L1014-I1026 HydrophobicContact CD2-CD1 3.83Å; L1014-I1026 HydrophobicContact CD2-CG1 3.66Å; V1021-I1026 HydrophobicContact CG2-CB 3.76Å; V1021-I1026 HydrophobicContact CG2-CG1 4.48Å; V1021-I1026 HydrophobicContact CG2-CG2 3.99Å; D1022-I1026 PolarHBondContact O-N 2.92Å; R1023-I1026 WeakPolarHBondContact O-CG2 3.4Å; I1026-R1028 PolarHBondContact O-N 3.41Å; I1026-H1029 HydrophobicContact CD1-CB 4.35Å; I1026-H1029 WeakPolarHBondContact O-CB 3.41Å; I1026-H1029 PolarHBondContact O-N 2.88Å; I1026-H1029 VanDerWaalsContact O-N 3.09Å; I1026-L1030 HydrophobicContact CD1-CG 4.48Å; I1026-L1030 HydrophobicContact CG1-CD1 4.23Å; I1026-L1030 HydrophobicContact CG1-CG 4.27Å; I1026-L1030 WeakPolarHBondContact O-CG 3.33Å; I1026-L1030 PolarHBondContact O-N 3.34Å; I1026-P1037 HydrophobicContact CD1-CG 4.01Å; I1026-L1043 HydrophobicContact CD1-CD2 3.91Å; I1026-L1043 HydrophobicContact CG1-CD2 4.19Å; I1026-I1048 HydrophobicContact CB-CD1 4.34Å; I1026-I1048 HydrophobicContact CG1-CD1 3.7Å; I1026-I1048 HydrophobicContact CG2-CD1 3.67Å
1027	A	81.8	Confident	85.2	Confident	5 Å²	5	40.7 Å²	40.7	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-56.8	-40.4	175.8	0	0	0	0	0	111.3	F879 R1023 L1030 L1031 M1045	F879-A1027 HydrophobicContact CD1-CB 3.82Å; F879-A1027 HydrophobicContact CD2-CB 3.92Å; F879-A1027 HydrophobicContact CE1-CB 3.58Å; F879-A1027 HydrophobicContact CE2-CB 3.68Å; F879-A1027 HydrophobicContact CG-CB 4Å; F879-A1027 HydrophobicContact CZ-CB 3.51Å; R1023-A1027 WeakPolarHBondContact O-CB 3.39Å; R1023-A1027 PolarHBondContact O-N 3.02Å; A1027-L1030 PolarHBondContact O-N 3.45Å; A1027-L1031 WeakPolarHBondContact O-CG 3.39Å; A1027-L1031 PolarHBondContact O-N 3.45Å; A1027-L1031 VanDerWaalsContact O-N 3.16Å; A1027-M1045 HydrophobicContact CB-CE 4.01Å; A1027-M1045 HydrophobicContact CB-SD 3.95Å
1028	R	77.1	Confident	85.3	Confident	44 Å²	44	43.4 Å²	43.4	17%	0.166	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-43.8	175.1	-178.4	-174	-55.3	147.9	8.1	112.9	E882 S1024 T1025 I1026 L1030 L1031	E882-R1028 IonicContact OE2-CZ 3.98Å; E882-R1028 VanDerWaalsContact OE2-CZ 3.29Å; E882-R1028 IonicContact OE2-NH1 3.91Å; E882-R1028 PolarHBondContact OE2-NH1 2.79Å; E882-R1028 VanDerWaalsContact OE2-NH1 3.14Å; E882-R1028 IonicContact OE2-NH2 2.78Å; E882-R1028 PolarHBondContact OE2-NH2 3.01Å; S1024-R1028 WeakPolarHBondContact O-CB 3.37Å; S1024-R1028 PolarHBondContact O-N 2.93Å; T1025-R1028 WeakPolarHBondContact O-CB 3.37Å; T1025-R1028 PolarHBondContact O-N 3.22Å; I1026-R1028 PolarHBondContact O-N 3.41Å; R1028-L1030 VanDerWaalsContact C-N 3.34Å; R1028-L1031 PolarHBondContact O-N 3.01Å
1029	H	82.9	Confident	85.2	Confident	50 Å²	50	36.8 Å²	36.8	23%	0.231	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-48.6	176.2	178.9	73.8	0	0	0	110.2	T1025 I1026 L1031 S1032 D1033 T1035	T1025-H1029 PolarHBondContact O-N 3.07Å; I1026-H1029 HydrophobicContact CD1-CB 4.35Å; I1026-H1029 WeakPolarHBondContact O-CB 3.41Å; I1026-H1029 PolarHBondContact O-N 2.88Å; I1026-H1029 VanDerWaalsContact O-N 3.09Å; H1029-L1031 VanDerWaalsContact C-N 3.28Å; H1029-L1031 PolarHBondContact O-N 2.92Å; H1029-S1032 CarbonylContact O-C 3.48Å; H1029-S1032 WeakPolarHBondContact O-CA 3.49Å; H1029-S1032 PolarHBondContact O-N 2.95Å; H1029-D1033 CarbonylContact C-O 3.57Å; H1029-D1033 PolarHBondContact CD2-O 3.19Å; H1029-D1033 PolarHBondContact NE2-O 3.32Å; H1029-D1033 PolarHBondContact O-N 2.97Å; H1029-D1033 VanDerWaalsContact O-O 3.14Å; H1029-T1035 PolarHBondContact CD2-O 2.9Å; H1029-T1035 PolarHBondContact NE2-O 3.14Å; H1029-T1035 PolarHBondContact NE2-OG1 3.26Å
1030	L	83.4	Confident	84.9	Confident	15 Å²	15	44.6 Å²	44.6	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-21.7	-178.4	-64.6	-177.9	0	0	0	115.2	I1026 A1027 R1028 S1032 D1033 L1043 M1045 I1048	I1026-L1030 HydrophobicContact CD1-CG 4.48Å; I1026-L1030 HydrophobicContact CG1-CD1 4.23Å; I1026-L1030 HydrophobicContact CG1-CG 4.27Å; I1026-L1030 WeakPolarHBondContact O-CG 3.33Å; I1026-L1030 PolarHBondContact O-N 3.34Å; A1027-L1030 PolarHBondContact O-N 3.45Å; R1028-L1030 VanDerWaalsContact C-N 3.34Å; L1030-S1032 VanDerWaalsContact C-N 3.26Å; L1030-D1033 WeakPolarHBondContact CA-O 3.48Å; L1030-L1043 HydrophobicContact CD1-CG 4.39Å; L1030-L1043 HydrophobicContact CD2-CB 4.12Å; L1030-L1043 HydrophobicContact CD2-CD2 4.25Å; L1030-L1043 HydrophobicContact CD2-CG 4.18Å; L1030-L1043 VanDerWaalsContact CD2-O 3.27Å; L1030-L1043 WeakPolarHBondContact CD2-O 3.13Å; L1030-M1045 HydrophobicContact CD1-CB 4.41Å; L1030-M1045 HydrophobicContact CD1-SD 4.36Å; L1030-I1048 HydrophobicContact CD1-CD1 3.89Å
1031	L	75.8	Confident	84.7	Confident	26 Å²	26	44.8 Å²	44.8	14%	0.136	22%	0.223	C	C	.	.	H	α-helix	trans	-73.1	-19.6	170.5	-72.6	173	0	0	0	113	P788 L792 N796 L880 A1027 R1028 H1029	P788-L1031 HydrophobicContact CB-CD2 4.15Å; P788-L1031 HydrophobicContact CG-CD2 4.24Å; L792-L1031 HydrophobicContact CD2-CD2 3.78Å; L792-L1031 HydrophobicContact CG-CD2 3.97Å; N796-L1031 PolarHBondContact ND2-O 3.22Å; L880-L1031 HydrophobicContact CD2-CD1 4.15Å; A1027-L1031 WeakPolarHBondContact O-CG 3.39Å; A1027-L1031 PolarHBondContact O-N 3.45Å; A1027-L1031 VanDerWaalsContact O-N 3.16Å; R1028-L1031 PolarHBondContact O-N 3.01Å; H1029-L1031 VanDerWaalsContact C-N 3.28Å; H1029-L1031 PolarHBondContact O-N 2.92Å
1032	S	74.5	Confident	84.5	Confident	77 Å²	77	50 Å²	50	54%	0.538	26%	0.257	S	S	.	.	H	α-helix	trans	-104.2	-43.3	177.6	-55.5	0	0	0	0	111.9	H1029 L1030	H1029-S1032 CarbonylContact O-C 3.48Å; H1029-S1032 WeakPolarHBondContact O-CA 3.49Å; H1029-S1032 PolarHBondContact O-N 2.95Å; L1030-S1032 VanDerWaalsContact C-N 3.26Å
1033	D	79.2	Confident	84.4	Confident	79 Å²	79	49.4 Å²	49.4	42%	0.422	25%	0.254	S	S	.	.			trans	-145.2	119.1	-175.5	-174.8	-6.2	0	0	0	110.1	H1029 L1030 T1035	H1029-D1033 CarbonylContact C-O 3.57Å; H1029-D1033 PolarHBondContact CD2-O 3.19Å; H1029-D1033 PolarHBondContact NE2-O 3.32Å; H1029-D1033 PolarHBondContact O-N 2.97Å; H1029-D1033 VanDerWaalsContact O-O 3.14Å; L1030-D1033 WeakPolarHBondContact CA-O 3.48Å; D1033-T1035 PolarHBondContact O-N 3.29Å; D1033-T1035 VanDerWaalsContact OD1-CG2 3.3Å; D1033-T1035 WeakPolarHBondContact OD1-CG2 3.3Å; D1033-T1035 PolarHBondContact OD1-OG1 3.48Å; D1033-T1035 PolarHBondContact OD2-OG1 2.97Å; D1033-T1035 VanDerWaalsContact OD2-OG1 3.13Å
1034	Q	84.6	Confident	84.2	Confident	94 Å²	94	48.5 Å²	48.5	44%	0.439	25%	0.253	S	S	.	.	S	Bend	trans	-80.2	52.4	-177.2	-66.4	-170.1	-2.8	0	0	112.7	P1042 L1043	Q1034-P1042 WeakPolarHBondContact O-CA 3.49Å; Q1034-L1043 CarbonylContact C-O 3.54Å; Q1034-L1043 PolarHBondContact O-N 3.35Å
1035	T	86.4	Confident	84.2	Confident	24 Å²	24	48.6 Å²	48.6	15%	0.147	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-134.1	161	-179	58.2	0	0	0	0	111.9	H1029 D1033 S1041	H1029-T1035 PolarHBondContact CD2-O 2.9Å; H1029-T1035 PolarHBondContact NE2-O 3.14Å; H1029-T1035 PolarHBondContact NE2-OG1 3.26Å; D1033-T1035 PolarHBondContact O-N 3.29Å; D1033-T1035 VanDerWaalsContact OD1-CG2 3.3Å; D1033-T1035 WeakPolarHBondContact OD1-CG2 3.3Å; D1033-T1035 PolarHBondContact OD1-OG1 3.48Å; D1033-T1035 PolarHBondContact OD2-OG1 2.97Å; D1033-T1035 VanDerWaalsContact OD2-OG1 3.13Å; T1035-S1041 CarbonylContact C-O 3.56Å; T1035-S1041 WeakPolarHBondContact CA-O 3.39Å
1036	D	88.1	Confident	84.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.			trans	-74	124.8	168.2	176.3	-50.1	0	0	0	109	L1014 S1016 S1017 F1038 N1039 R1040 S1041 L1043	L1014-D1036 WeakPolarHBondContact CB-OD2 3.39Å; S1016-D1036 WeakPolarHBondContact OG-CB 3.31Å; S1016-D1036 PolarHBondContact OG-OD2 2.92Å; S1017-D1036 WeakPolarHBondContact CB-OD2 3.41Å; S1017-D1036 PolarHBondContact N-OD2 3.03Å; S1017-D1036 PolarHBondContact OG-OD1 2.95Å; S1017-D1036 PolarHBondContact OG-OD2 3.19Å; D1036-F1038 PolarHBondContact O-N 3.29Å; D1036-F1038 VanDerWaalsContact O-N 3.11Å; D1036-F1038 WeakPolarHBondContact OD1-CB 3.31Å; D1036-F1038 PolarHBondContact OD1-N 3.32Å; D1036-N1039 VanDerWaalsContact CB-OD1 3.31Å; D1036-N1039 WeakPolarHBondContact CB-OD1 3.37Å; D1036-N1039 PolarHBondContact O-N 3.41Å; D1036-N1039 PolarHBondContact OD1-N 3.09Å; D1036-R1040 WeakPolarHBondContact O-CA 3.28Å; D1036-R1040 PolarHBondContact O-N 3.44Å; D1036-S1041 PolarHBondContact N-O 3.19Å; D1036-L1043 HydrophobicContact CB-CB 4.36Å; D1036-L1043 HydrophobicContact CB-CD2 4.12Å
1037	P	88.9	Confident	83.9	Confident	42 Å²	42	56.5 Å²	56.5	27%	0.273	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.6	-173	24.3	-33.1	0	0	0	114.3	I1003 L1014 I1026	I1003-P1037 HydrophobicContact CD1-CB 4.2Å; I1003-P1037 HydrophobicContact CD1-CG 3.83Å; L1014-P1037 HydrophobicContact CD1-CG 4.36Å; I1026-P1037 HydrophobicContact CD1-CG 4.01Å
1038	F	88.1	Confident	84.3	Confident	88 Å²	88	56.9 Å²	56.9	39%	0.386	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-26.9	-176.6	-57.3	-79.8	0	0	0	113.4	P1002 I1003 L1014 V1019 V1021 D1036	P1002-F1038 HydrophobicContact CB-CE1 4.48Å; P1002-F1038 HydrophobicContact CB-CZ 4.3Å; P1002-F1038 HydrophobicContact CG-CE1 4.47Å; P1002-F1038 HydrophobicContact CG-CZ 3.83Å; I1003-F1038 HydrophobicContact CD1-CE2 4.3Å; I1003-F1038 HydrophobicContact CD1-CZ 3.93Å; I1003-F1038 HydrophobicContact CG1-CE1 4.31Å; I1003-F1038 HydrophobicContact CG1-CZ 3.76Å; L1014-F1038 HydrophobicContact CD1-CD2 3.82Å; L1014-F1038 HydrophobicContact CD1-CE2 3.78Å; V1019-F1038 HydrophobicContact CB-CD2 3.99Å; V1019-F1038 HydrophobicContact CB-CE2 3.91Å; V1019-F1038 HydrophobicContact CB-CZ 4.42Å; V1019-F1038 HydrophobicContact CG1-CD2 4.19Å; V1019-F1038 HydrophobicContact CG1-CE1 4.31Å; V1019-F1038 HydrophobicContact CG1-CE2 3.65Å; V1019-F1038 HydrophobicContact CG1-CZ 3.73Å; V1019-F1038 HydrophobicContact CG2-CD2 4.12Å; V1019-F1038 HydrophobicContact CG2-CE2 4.41Å; V1019-F1038 HydrophobicContact CG2-CG 4.21Å; V1021-F1038 HydrophobicContact CG1-CE2 3.71Å; V1021-F1038 HydrophobicContact CG1-CZ 3.93Å; D1036-F1038 PolarHBondContact O-N 3.29Å; D1036-F1038 VanDerWaalsContact O-N 3.11Å; D1036-F1038 WeakPolarHBondContact OD1-CB 3.31Å; D1036-F1038 PolarHBondContact OD1-N 3.32Å
1039	N	86.6	Confident	84.9	Confident	70 Å²	70	63.5 Å²	63.5	37%	0.374	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-2	-176.3	68.4	28.3	0	0	0	114.8	S1016 S1017 D1036 S1041	S1016-N1039 WeakPolarHBondContact CB-ND2 3.19Å; S1016-N1039 PolarHBondContact OG-ND2 3.47Å; S1017-N1039 PolarHBondContact N-ND2 3.05Å; S1017-N1039 VanDerWaalsContact N-ND2 3.18Å; D1036-N1039 VanDerWaalsContact CB-OD1 3.31Å; D1036-N1039 WeakPolarHBondContact CB-OD1 3.37Å; D1036-N1039 PolarHBondContact O-N 3.41Å; D1036-N1039 PolarHBondContact OD1-N 3.09Å; N1039-S1041 PolarHBondContact O-N 3.24Å; N1039-S1041 VanDerWaalsContact OD1-CB 3.26Å; N1039-S1041 WeakPolarHBondContact OD1-CB 3.35Å; N1039-S1041 PolarHBondContact OD1-N 3.3Å; N1039-S1041 PolarHBondContact OD1-OG 2.93Å
1040	R	85.5	Confident	85.2	Confident	209 Å²	209	64.9 Å²	64.9	79%	0.789	33%	0.33	S	S	*	.			trans	59.4	17.4	-179.6	-55.8	-177.1	178.5	-177.7	-2.1	115.5	D1036	D1036-R1040 WeakPolarHBondContact O-CA 3.28Å; D1036-R1040 PolarHBondContact O-N 3.44Å
1041	S	85.6	Confident	85.6	Confident	33 Å²	33	65.8 Å²	65.8	23%	0.231	34%	0.335	C	S	.	.			trans	-71.3	147.1	172.2	60.3	0	0	0	0	110.9	S1016 T1035 D1036 N1039 L1043	S1016-S1041 WeakPolarHBondContact CB-OG 3.25Å; S1016-S1041 PolarHBondContact OG-OG 3.16Å; T1035-S1041 CarbonylContact C-O 3.56Å; T1035-S1041 WeakPolarHBondContact CA-O 3.39Å; D1036-S1041 PolarHBondContact N-O 3.19Å; N1039-S1041 PolarHBondContact O-N 3.24Å; N1039-S1041 VanDerWaalsContact OD1-CB 3.26Å; N1039-S1041 WeakPolarHBondContact OD1-CB 3.35Å; N1039-S1041 PolarHBondContact OD1-N 3.3Å; N1039-S1041 PolarHBondContact OD1-OG 2.93Å; S1041-L1043 PolarHBondContact O-N 2.92Å
1042	P	87.8	Confident	86.3	Confident	111 Å²	111	68.9 Å²	68.9	72%	0.721	36%	0.355	S	S	*	.	B	Isolated β-bridge	trans	-56.3	132.3	177.7	-25.1	34.5	0	0	0	111.9	Q1034	Q1034-P1042 WeakPolarHBondContact O-CA 3.49Å
1043	L	87.5	Confident	87	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.01	36%	0.356	C	S	.	.			trans	-142.8	138.6	-177	-179	67.3	0	0	0	110.4	L1014 P1015 I1026 L1030 Q1034 D1036 S1041 Q1047 I1048	L1014-L1043 HydrophobicContact CD2-CD2 3.96Å; P1015-L1043 HydrophobicContact CG-CD1 3.59Å; I1026-L1043 HydrophobicContact CD1-CD2 3.91Å; I1026-L1043 HydrophobicContact CG1-CD2 4.19Å; L1030-L1043 HydrophobicContact CD1-CG 4.39Å; L1030-L1043 HydrophobicContact CD2-CB 4.12Å; L1030-L1043 HydrophobicContact CD2-CD2 4.25Å; L1030-L1043 HydrophobicContact CD2-CG 4.18Å; L1030-L1043 VanDerWaalsContact CD2-O 3.27Å; L1030-L1043 WeakPolarHBondContact CD2-O 3.13Å; Q1034-L1043 CarbonylContact C-O 3.54Å; Q1034-L1043 PolarHBondContact O-N 3.35Å; D1036-L1043 HydrophobicContact CB-CB 4.36Å; D1036-L1043 HydrophobicContact CB-CD2 4.12Å; S1041-L1043 PolarHBondContact O-N 2.92Å; L1043-Q1047 HydrophobicContact CD1-CB 4.13Å; L1043-I1048 HydrophobicContact CD1-CG1 4.38Å
1044	T	85.3	Confident	87.5	Confident	19 Å²	19	68 Å²	68	12%	0.117	34%	0.34	C	S	.	.			trans	-126.6	158.6	174.2	56.4	0	0	0	0	111	D1046 Q1047	T1044-D1046 VanDerWaalsContact C-N 3.25Å; T1044-D1046 WeakPolarHBondContact CB-OD1 3.33Å; T1044-D1046 PolarHBondContact O-N 3.07Å; T1044-D1046 PolarHBondContact OG1-OD1 3.27Å; T1044-Q1047 WeakPolarHBondContact O-CB 3.5Å; T1044-Q1047 PolarHBondContact O-N 3.41Å; T1044-Q1047 VanDerWaalsContact O-N 3.08Å; T1044-Q1047 VanDerWaalsContact OG1-CD 3.31Å; T1044-Q1047 WeakPolarHBondContact OG1-CG 3.17Å; T1044-Q1047 PolarHBondContact OG1-NE2 3.39Å
1045	M	84.5	Confident	87.7	Confident	21 Å²	21	66.7 Å²	66.7	10%	0.103	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-61.2	-33.1	-172.3	-165.9	68.5	-170.7	0	0	112.9	E784 F879 R1023 A1027 L1030 Q1047 I1048	E784-M1045 HydrophobicContact CB-CG 3.94Å; E784-M1045 HydrophobicContact CG-CE 4.29Å; E784-M1045 HydrophobicContact CG-CG 4.25Å; F879-M1045 HydrophobicContact CZ-CE 4.09Å; R1023-M1045 HydrophobicContact CG-CE 3.51Å; A1027-M1045 HydrophobicContact CB-CE 4.01Å; A1027-M1045 HydrophobicContact CB-SD 3.95Å; L1030-M1045 HydrophobicContact CD1-CB 4.41Å; L1030-M1045 HydrophobicContact CD1-SD 4.36Å; M1045-Q1047 VanDerWaalsContact C-N 3.27Å; M1045-Q1047 PolarHBondContact O-N 3.2Å; M1045-I1048 HydrophobicContact CE-CD1 4.47Å; M1045-I1048 WeakPolarHBondContact O-CB 3.3Å; M1045-I1048 PolarHBondContact O-N 3.22Å; M1045-I1048 HydrophobicContact SD-CD1 3.67Å
1046	D	84.4	Confident	87.9	Confident	92 Å²	92	70 Å²	70	49%	0.492	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-69.3	-20.9	178.5	61.6	-64.9	0	0	0	113.9	T1044 I1048	T1044-D1046 VanDerWaalsContact C-N 3.25Å; T1044-D1046 WeakPolarHBondContact CB-OD1 3.33Å; T1044-D1046 PolarHBondContact O-N 3.07Å; T1044-D1046 PolarHBondContact OG1-OD1 3.27Å; D1046-I1048 VanDerWaalsContact C-N 3.31Å
1047	Q	84.6	Confident	87.9	Confident	86 Å²	86	74 Å²	74	40%	0.402	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-82.4	-12.9	179.4	-62.3	175.6	-2.8	0	0	112.8	P1015 L1043 T1044 M1045	P1015-Q1047 HydrophobicContact CG-CB 4.13Å; L1043-Q1047 HydrophobicContact CD1-CB 4.13Å; T1044-Q1047 WeakPolarHBondContact O-CB 3.5Å; T1044-Q1047 PolarHBondContact O-N 3.41Å; T1044-Q1047 VanDerWaalsContact O-N 3.08Å; T1044-Q1047 VanDerWaalsContact OG1-CD 3.31Å; T1044-Q1047 WeakPolarHBondContact OG1-CG 3.17Å; T1044-Q1047 PolarHBondContact OG1-NE2 3.39Å; M1045-Q1047 VanDerWaalsContact C-N 3.27Å; M1045-Q1047 PolarHBondContact O-N 3.2Å
1048	I	88.8	Confident	87.8	Confident	13 Å²	13	72.2 Å²	72.2	7%	0.067	35%	0.352	C	S	.	.			trans	-78.8	133.8	-175.4	-61	176.4	0	0	0	110	V1012 L1014 I1026 L1030 L1043 M1045 D1046	V1012-I1048 HydrophobicContact CB-CG2 3.4Å; V1012-I1048 VanDerWaalsContact CB-CG2 3.4Å; V1012-I1048 HydrophobicContact CG1-CG2 4.03Å; V1012-I1048 HydrophobicContact CG2-CG2 3.51Å; L1014-I1048 HydrophobicContact CD2-CD1 4.5Å; L1014-I1048 HydrophobicContact CD2-CG1 4.41Å; I1026-I1048 HydrophobicContact CB-CD1 4.34Å; I1026-I1048 HydrophobicContact CG1-CD1 3.7Å; I1026-I1048 HydrophobicContact CG2-CD1 3.67Å; L1030-I1048 HydrophobicContact CD1-CD1 3.89Å; L1043-I1048 HydrophobicContact CD1-CG1 4.38Å; M1045-I1048 HydrophobicContact CE-CD1 4.47Å; M1045-I1048 WeakPolarHBondContact O-CB 3.3Å; M1045-I1048 PolarHBondContact O-N 3.22Å; M1045-I1048 HydrophobicContact SD-CD1 3.67Å; D1046-I1048 VanDerWaalsContact C-N 3.31Å
1049	R	89.4	Confident	87.6	Confident	182 Å²	182	73 Å²	73	69%	0.687	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.2	-176	-63.6	-176	-178.2	-172.7	-0.2	111.4	V1012 V1013 N1051	V1012-R1049 CarbonylContact C-O 3.56Å; V1012-R1049 WeakPolarHBondContact CA-O 3.37Å; V1013-R1049 PolarHBondContact N-O 3.49Å; V1013-R1049 PolarHBondContact O-N 2.94Å; R1049-N1051 PolarHBondContact O-N 2.82Å
1050	P	90.8	Very high	87.6	Confident	80 Å²	80	76.4 Å²	76.4	52%	0.519	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	133.8	173.1	-20.8	30.8	0	0	0	112	T1052	P1050-T1052 HydrophobicContact CB-CG2 4.29Å; P1050-T1052 PolarHBondContact O-N 3.08Å
1051	N	91.5	Very high	87.6	Confident	34 Å²	34	67.9 Å²	67.9	18%	0.182	33%	0.333	C	S	.	.			trans	-95.5	73.1	171.8	-166	-19	0	0	0	109.7	P1011 V1013 T1020 R1049 E1053 L1054 K1055	P1011-N1051 HydrophobicContact CB-CB 4.22Å; P1011-N1051 HydrophobicContact CG-CB 4.47Å; P1011-N1051 WeakPolarHBondContact O-CB 3.47Å; P1011-N1051 PolarHBondContact O-N 3.45Å; V1013-N1051 HydrophobicContact CG2-CB 3.81Å; T1020-N1051 HydrophobicContact CG2-CB 4.09Å; T1020-N1051 PolarHBondContact OG1-ND2 3.27Å; R1049-N1051 PolarHBondContact O-N 2.82Å; N1051-E1053 PolarHBondContact O-N 3.02Å; N1051-L1054 HydrophobicContact CB-CB 4.24Å; N1051-L1054 VanDerWaalsContact CG-CB 3.46Å; N1051-L1054 PolarHBondContact O-N 3.23Å; N1051-L1054 WeakPolarHBondContact OD1-CB 3.33Å; N1051-L1054 PolarHBondContact OD1-N 2.91Å; N1051-L1054 VanDerWaalsContact OD1-N 3.11Å; N1051-K1055 PolarHBondContact O-N 3.43Å
1052	T	90.6	Very high	87.4	Confident	91 Å²	91	68.8 Å²	68.8	56%	0.558	34%	0.335	S	S	*	.	H	α-helix	trans	-60.6	-34.1	-176.5	51.9	0	0	0	0	112.6	P1050 K1055 E1056	P1050-T1052 HydrophobicContact CB-CG2 4.29Å; P1050-T1052 PolarHBondContact O-N 3.08Å; T1052-K1055 PolarHBondContact O-N 2.76Å; T1052-E1056 WeakPolarHBondContact O-CG 3.48Å; T1052-E1056 PolarHBondContact O-N 2.97Å
1053	E	89.2	Confident	87.1	Confident	119 Å²	119	66 Å²	66	56%	0.556	32%	0.321	S	S	*	.	H	α-helix	trans	-63.8	-47.9	177.8	-169.1	-168.1	152.4	0	0	111.5	N1051 K1055 E1056 K1057	N1051-E1053 PolarHBondContact O-N 3.02Å; E1053-K1055 VanDerWaalsContact C-N 3.34Å; E1053-E1056 PolarHBondContact O-N 3.19Å; E1053-K1057 WeakPolarHBondContact O-CG 3.32Å; E1053-K1057 PolarHBondContact O-N 3.14Å; E1053-K1057 VanDerWaalsContact O-N 3.08Å; E1053-K1057 VanDerWaalsContact OE1-CE 3.29Å; E1053-K1057 WeakPolarHBondContact OE1-CE 3.46Å; E1053-K1057 IonicContact OE1-NZ 3.27Å; E1053-K1057 PolarHBondContact OE1-NZ 3.13Å
1054	L	89.3	Confident	86.8	Confident	17 Å²	17	71.4 Å²	71.4	9%	0.089	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-38.6	177.5	-171.5	62.2	0	0	0	111.3	F999 M1008 P1011 T1020 N1051 E1056 K1057 I1058	F999-L1054 HydrophobicContact CD1-CD1 3.93Å; F999-L1054 HydrophobicContact CE1-CD1 4.09Å; M1008-L1054 HydrophobicContact CE-CD2 3.59Å; P1011-L1054 HydrophobicContact CB-CB 4.4Å; P1011-L1054 HydrophobicContact CB-CD2 3.93Å; P1011-L1054 HydrophobicContact CB-CG 4.35Å; P1011-L1054 HydrophobicContact CG-CB 4.17Å; P1011-L1054 HydrophobicContact CG-CD2 4.45Å; P1011-L1054 HydrophobicContact CG-CG 4.33Å; T1020-L1054 HydrophobicContact CG2-CD2 3.75Å; N1051-L1054 HydrophobicContact CB-CB 4.24Å; N1051-L1054 VanDerWaalsContact CG-CB 3.46Å; N1051-L1054 PolarHBondContact O-N 3.23Å; N1051-L1054 WeakPolarHBondContact OD1-CB 3.33Å; N1051-L1054 PolarHBondContact OD1-N 2.91Å; N1051-L1054 VanDerWaalsContact OD1-N 3.11Å; L1054-E1056 VanDerWaalsContact C-N 3.33Å; L1054-E1056 PolarHBondContact O-N 3.21Å; L1054-K1057 WeakPolarHBondContact O-CB 3.45Å; L1054-K1057 PolarHBondContact O-N 2.89Å; L1054-K1057 VanDerWaalsContact O-N 3.15Å; L1054-I1058 HydrophobicContact CG-CD1 4.03Å; L1054-I1058 HydrophobicContact CG-CG1 4.43Å; L1054-I1058 VanDerWaalsContact O-CG1 3.32Å; L1054-I1058 WeakPolarHBondContact O-CG1 3.41Å; L1054-I1058 PolarHBondContact O-N 3.14Å
1055	K	89.9	Confident	86.4	Confident	67 Å²	67	73.9 Å²	73.9	29%	0.291	35%	0.354	S	S	.	.	H	α-helix	trans	-57.7	-45.8	175.4	-168.7	172.5	-172.9	167.3	0	111.8	D1010 P1011 N1051 T1052 E1053 I1058 Q1059	D1010-K1055 IonicContact OD1-NZ 3.86Å; D1010-K1055 PolarHBondContact OD1-NZ 3.29Å; P1011-K1055 HydrophobicContact CG-CB 3.71Å; P1011-K1055 HydrophobicContact CG-CG 4.41Å; N1051-K1055 PolarHBondContact O-N 3.43Å; T1052-K1055 PolarHBondContact O-N 2.76Å; E1053-K1055 VanDerWaalsContact C-N 3.34Å; K1055-I1058 PolarHBondContact O-N 3.28Å; K1055-Q1059 WeakPolarHBondContact O-CB 3.35Å; K1055-Q1059 VanDerWaalsContact O-CG 3.3Å; K1055-Q1059 WeakPolarHBondContact O-CG 3.4Å; K1055-Q1059 PolarHBondContact O-N 3.31Å
1056	E	89	Confident	85.9	Confident	95 Å²	95	78.6 Å²	78.6	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-64.5	-38.3	176	-75.5	-178.5	-161.4	0	0	112.6	T1052 E1053 L1054 Q1059 R1060	T1052-E1056 WeakPolarHBondContact O-CG 3.48Å; T1052-E1056 PolarHBondContact O-N 2.97Å; E1053-E1056 PolarHBondContact O-N 3.19Å; L1054-E1056 VanDerWaalsContact C-N 3.33Å; L1054-E1056 PolarHBondContact O-N 3.21Å; E1056-Q1059 PolarHBondContact O-N 3.41Å; E1056-R1060 WeakPolarHBondContact O-CB 3.3Å; E1056-R1060 VanDerWaalsContact O-CG 3.31Å; E1056-R1060 WeakPolarHBondContact O-CG 3.47Å; E1056-R1060 PolarHBondContact O-N 3.15Å; E1056-R1060 IonicContact OE2-CZ 3.74Å; E1056-R1060 IonicContact OE2-NH2 3.1Å; E1056-R1060 PolarHBondContact OE2-NH2 2.67Å
1057	K	88.3	Confident	85.3	Confident	82 Å²	82	79.9 Å²	79.9	36%	0.357	38%	0.377	S	S	.	.	H	α-helix	trans	-62.4	-46.6	175.4	-72.8	175.7	-173.4	168.1	0	111.5	F999 E1053 L1054 Q1059 R1060 W1061	F999-K1057 HydrophobicContact CE1-CB 4.15Å; E1053-K1057 WeakPolarHBondContact O-CG 3.32Å; E1053-K1057 PolarHBondContact O-N 3.14Å; E1053-K1057 VanDerWaalsContact O-N 3.08Å; E1053-K1057 VanDerWaalsContact OE1-CE 3.29Å; E1053-K1057 WeakPolarHBondContact OE1-CE 3.46Å; E1053-K1057 IonicContact OE1-NZ 3.27Å; E1053-K1057 PolarHBondContact OE1-NZ 3.13Å; L1054-K1057 WeakPolarHBondContact O-CB 3.45Å; L1054-K1057 PolarHBondContact O-N 2.89Å; L1054-K1057 VanDerWaalsContact O-N 3.15Å; K1057-Q1059 VanDerWaalsContact C-N 3.35Å; K1057-Q1059 PolarHBondContact O-N 3.09Å; K1057-R1060 PolarHBondContact O-N 3.04Å; K1057-W1061 WeakPolarHBondContact O-CB 3.49Å; K1057-W1061 PolarHBondContact O-N 3.35Å
1058	I	86.3	Confident	84.7	Confident	5 Å²	5	80.3 Å²	80.3	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176.5	-66.1	170.6	0	0	0	110.3	F999 L1007 M1008 P1011 L1054 K1055 W1061 L1062	F999-I1058 HydrophobicContact CB-CD1 4.23Å; F999-I1058 HydrophobicContact CB-CG1 3.92Å; F999-I1058 HydrophobicContact CD1-CD1 4.34Å; F999-I1058 HydrophobicContact CD1-CG1 3.56Å; F999-I1058 HydrophobicContact CE1-CG1 4.24Å; F999-I1058 HydrophobicContact CG-CG1 3.77Å; L1007-I1058 HydrophobicContact CD1-CG2 4.25Å; L1007-I1058 HydrophobicContact CD2-CG2 4.24Å; L1007-I1058 HydrophobicContact CG-CG2 4.22Å; M1008-I1058 HydrophobicContact CB-CD1 4Å; M1008-I1058 WeakPolarHBondContact O-CD1 3.46Å; P1011-I1058 HydrophobicContact CG-CD1 4.29Å; L1054-I1058 HydrophobicContact CG-CD1 4.03Å; L1054-I1058 HydrophobicContact CG-CG1 4.43Å; L1054-I1058 VanDerWaalsContact O-CG1 3.32Å; L1054-I1058 WeakPolarHBondContact O-CG1 3.41Å; L1054-I1058 PolarHBondContact O-N 3.14Å; K1055-I1058 PolarHBondContact O-N 3.28Å; I1058-W1061 PolarHBondContact O-N 2.78Å; I1058-L1062 HydrophobicContact CG2-CD1 3.99Å; I1058-L1062 HydrophobicContact CG2-CG 4.41Å; I1058-L1062 WeakPolarHBondContact O-CB 3.35Å; I1058-L1062 WeakPolarHBondContact O-CG 2.86Å; I1058-L1062 PolarHBondContact O-N 2.63Å
1059	Q	85.8	Confident	83.6	Confident	106 Å²	106	82.6 Å²	82.6	50%	0.495	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-41	179	-74.9	-179.9	-9.9	0	0	113.2	K1055 E1056 K1057 L1062 A1063	K1055-Q1059 WeakPolarHBondContact O-CB 3.35Å; K1055-Q1059 VanDerWaalsContact O-CG 3.3Å; K1055-Q1059 WeakPolarHBondContact O-CG 3.4Å; K1055-Q1059 PolarHBondContact O-N 3.31Å; E1056-Q1059 PolarHBondContact O-N 3.41Å; K1057-Q1059 VanDerWaalsContact C-N 3.35Å; K1057-Q1059 PolarHBondContact O-N 3.09Å; Q1059-L1062 PolarHBondContact O-N 3.07Å; Q1059-A1063 WeakPolarHBondContact O-CB 3.39Å; Q1059-A1063 PolarHBondContact O-N 2.93Å
1060	R	85.6	Confident	82.4	Confident	140 Å²	140	79.8 Å²	79.8	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-45	174.7	-73.2	178.9	-138.4	157.2	4.2	111.2	E1056 K1057 L1062 A1063 E1064	E1056-R1060 WeakPolarHBondContact O-CB 3.3Å; E1056-R1060 VanDerWaalsContact O-CG 3.31Å; E1056-R1060 WeakPolarHBondContact O-CG 3.47Å; E1056-R1060 PolarHBondContact O-N 3.15Å; E1056-R1060 IonicContact OE2-CZ 3.74Å; E1056-R1060 IonicContact OE2-NH2 3.1Å; E1056-R1060 PolarHBondContact OE2-NH2 2.67Å; K1057-R1060 PolarHBondContact O-N 3.04Å; R1060-L1062 PolarHBondContact O-N 3.15Å; R1060-A1063 PolarHBondContact O-N 3.48Å; R1060-E1064 WeakPolarHBondContact O-CG 3.23Å; R1060-E1064 PolarHBondContact O-N 2.94Å
1061	W	85.5	Confident	80.8	Confident	31 Å²	31	83.5 Å²	83.5	12%	0.117	39%	0.393	C	S	.	.	H	α-helix	trans	-59.9	-45	177	179.9	85	0	0	0	111.9	Y992 A995 F999 L1007 K1057 I1058 A1063 E1064 R1065	Y992-W1061 HydrophobicContact CD1-CH2 4.15Å; Y992-W1061 HydrophobicContact CD1-CZ3 4.2Å; Y992-W1061 HydrophobicContact CG-CH2 4.42Å; Y992-W1061 HydrophobicContact CG-CZ3 4.48Å; A995-W1061 HydrophobicContact CB-CH2 3.61Å; A995-W1061 HydrophobicContact CB-CZ2 3.99Å; A995-W1061 HydrophobicContact CB-CZ3 4.2Å; F999-W1061 HydrophobicContact CD2-CD2 4.17Å; F999-W1061 HydrophobicContact CD2-CE3 4.43Å; F999-W1061 HydrophobicContact CD2-CG 4.25Å; F999-W1061 HydrophobicContact CE2-CB 3.9Å; F999-W1061 AromaticContact CE2-CD1 3.83Å; F999-W1061 HydrophobicContact CE2-CD2 4.03Å; F999-W1061 AromaticContact CE2-CG 3.64Å; F999-W1061 HydrophobicContact CE2-CG 3.64Å; F999-W1061 HydrophobicContact CZ-CB 4.45Å; L1007-W1061 HydrophobicContact CD1-CZ3 4.28Å; L1007-W1061 HydrophobicContact CD2-CZ3 4.44Å; K1057-W1061 WeakPolarHBondContact O-CB 3.49Å; K1057-W1061 PolarHBondContact O-N 3.35Å; I1058-W1061 PolarHBondContact O-N 2.78Å; W1061-A1063 PolarHBondContact O-N 3.37Å; W1061-E1064 PolarHBondContact O-N 3.42Å; W1061-R1065 HydrophobicContact CD2-CG 4.37Å; W1061-R1065 HydrophobicContact CZ2-CG 4.17Å; W1061-R1065 WeakPolarHBondContact O-CG 3.35Å; W1061-R1065 PolarHBondContact O-N 3.46Å
1062	L	81.3	Confident	79.1	Confident	52 Å²	52	89.2 Å²	89.2	27%	0.272	42%	0.423	S	S	.	.	H	α-helix	trans	-60.2	-43.1	174.6	-76.4	171.5	0	0	0	112.2	Y992 L1007 I1058 Q1059 R1060 R1065 K1066	Y992-L1062 HydrophobicContact CD1-CD2 4.33Å; Y992-L1062 HydrophobicContact CE1-CD2 4.2Å; L1007-L1062 HydrophobicContact CD2-CD1 4.06Å; L1007-L1062 HydrophobicContact CD2-CD2 3.77Å; L1007-L1062 HydrophobicContact CD2-CG 4.18Å; I1058-L1062 HydrophobicContact CG2-CD1 3.99Å; I1058-L1062 HydrophobicContact CG2-CG 4.41Å; I1058-L1062 WeakPolarHBondContact O-CB 3.35Å; I1058-L1062 WeakPolarHBondContact O-CG 2.86Å; I1058-L1062 PolarHBondContact O-N 2.63Å; Q1059-L1062 PolarHBondContact O-N 3.07Å; R1060-L1062 PolarHBondContact O-N 3.15Å; L1062-R1065 PolarHBondContact O-N 3.01Å; L1062-K1066 WeakPolarHBondContact O-CB 3.3Å; L1062-K1066 PolarHBondContact O-N 3.14Å
1063	A	81.3	Confident	77	Confident	53 Å²	53	93.9 Å²	93.9	44%	0.438	44%	0.439	S	S	.	.	H	α-helix	trans	-66.4	-42	179.3	0	0	0	0	0	112.5	Q1059 R1060 W1061 K1066 Q1067	Q1059-A1063 WeakPolarHBondContact O-CB 3.39Å; Q1059-A1063 PolarHBondContact O-N 2.93Å; R1060-A1063 PolarHBondContact O-N 3.48Å; W1061-A1063 PolarHBondContact O-N 3.37Å; A1063-K1066 PolarHBondContact O-N 3.42Å; A1063-Q1067 WeakPolarHBondContact O-CG 3.39Å; A1063-Q1067 PolarHBondContact O-N 2.97Å
1064	E	81.9	Confident	76.4	Confident	115 Å²	115	92.7 Å²	92.7	54%	0.537	43%	0.433	S	S	.	.	H	α-helix	trans	-61.9	-42.2	175.9	-74.2	174.2	-173.9	0	0	111.6	R1060 W1061 Q1067 Q1068	R1060-E1064 WeakPolarHBondContact O-CG 3.23Å; R1060-E1064 PolarHBondContact O-N 2.94Å; W1061-E1064 PolarHBondContact O-N 3.42Å; E1064-Q1067 PolarHBondContact O-N 3.41Å; E1064-Q1068 WeakPolarHBondContact O-CG 3.44Å; E1064-Q1068 PolarHBondContact O-N 3.01Å
1065	R	76.3	Confident	75.7	Confident	70 Å²	70	96.6 Å²	96.6	26%	0.264	45%	0.451	S	S	.	.	H	α-helix	trans	-68.3	-40.6	177.4	-71.6	-67.4	179.2	145.6	3.7	112.9	Y992 D994 W1061 L1062 Q1067 Q1068 K1069	Y992-R1065 HydrophobicContact CD1-CB 4.45Å; Y992-R1065 HydrophobicContact CE1-CB 4.18Å; D994-R1065 IonicContact OD1-CZ 2.82Å; D994-R1065 IonicContact OD1-NH1 2.82Å; D994-R1065 PolarHBondContact OD1-NH1 3.43Å; D994-R1065 IonicContact OD1-NH2 2.63Å; D994-R1065 IonicContact OD2-CZ 2.91Å; D994-R1065 IonicContact OD2-NH1 3.82Å; D994-R1065 PolarHBondContact OD2-NH1 2.83Å; D994-R1065 IonicContact OD2-NH2 3.2Å; D994-R1065 PolarHBondContact OD2-NH2 3.21Å; W1061-R1065 HydrophobicContact CD2-CG 4.37Å; W1061-R1065 HydrophobicContact CZ2-CG 4.17Å; W1061-R1065 WeakPolarHBondContact O-CG 3.35Å; W1061-R1065 PolarHBondContact O-N 3.46Å; L1062-R1065 PolarHBondContact O-N 3.01Å; R1065-Q1067 VanDerWaalsContact C-N 3.34Å; R1065-Q1067 PolarHBondContact O-N 3.29Å; R1065-Q1068 PolarHBondContact O-N 3.14Å; R1065-K1069 PolarHBondContact O-N 2.94Å
1066	K	73.5	Confident	74.9	Confident	121 Å²	121	98.3 Å²	98.3	53%	0.526	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-42.2	175.4	-168.9	173.6	179.6	174.6	0	111.6	L1062 A1063 K1069 E1070	L1062-K1066 WeakPolarHBondContact O-CB 3.3Å; L1062-K1066 PolarHBondContact O-N 3.14Å; A1063-K1066 PolarHBondContact O-N 3.42Å; K1066-K1069 PolarHBondContact O-N 3.37Å; K1066-E1070 WeakPolarHBondContact CE-OE1 3.29Å; K1066-E1070 WeakPolarHBondContact O-CG 3.49Å; K1066-E1070 PolarHBondContact O-N 3.22Å
1067	Q	73.2	Confident	74.1	Confident	118 Å²	118	98.5 Å²	98.5	55%	0.551	46%	0.461	S	S	*	.	H	α-helix	trans	-65.9	-38.8	174.6	-76.7	-176.8	-1	0	0	113.3	A1063 E1064 R1065 K1069 Q1071	A1063-Q1067 WeakPolarHBondContact O-CG 3.39Å; A1063-Q1067 PolarHBondContact O-N 2.97Å; E1064-Q1067 PolarHBondContact O-N 3.41Å; R1065-Q1067 VanDerWaalsContact C-N 3.34Å; R1065-Q1067 PolarHBondContact O-N 3.29Å; Q1067-K1069 VanDerWaalsContact C-N 3.32Å; Q1067-Q1071 WeakPolarHBondContact O-CB 3.46Å; Q1067-Q1071 VanDerWaalsContact O-CG 3.28Å; Q1067-Q1071 WeakPolarHBondContact O-CG 3.39Å; Q1067-Q1071 PolarHBondContact O-N 3.4Å; Q1067-Q1071 VanDerWaalsContact O-N 3.12Å
1068	Q	70.8	Confident	73.2	Confident	96 Å²	96	99.5 Å²	99.5	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-39.1	174.9	-77.1	175.9	2.8	0	0	111.7	E1064 R1065 Q1071 L1072	E1064-Q1068 WeakPolarHBondContact O-CG 3.44Å; E1064-Q1068 PolarHBondContact O-N 3.01Å; R1065-Q1068 PolarHBondContact O-N 3.14Å; Q1068-Q1071 PolarHBondContact O-N 2.74Å; Q1068-L1072 WeakPolarHBondContact O-CB 3.43Å; Q1068-L1072 WeakPolarHBondContact O-CD1 3.33Å; Q1068-L1072 PolarHBondContact O-N 3.13Å; Q1068-L1072 VanDerWaalsContact O-N 3.14Å
1069	K	65.3	Low	72.3	Confident	60 Å²	60	105.8 Å²	105.8	26%	0.261	50%	0.496	S	S	.	.	H	α-helix	trans	-66.7	-46.6	176.1	-173.5	173.1	179.3	172.6	0	112.3	T991 R1065 K1066 Q1067 Q1071 L1072 E1073	T991-K1069 HydrophobicContact CG2-CD 3.84Å; T991-K1069 PolarHBondContact OG1-NZ 3.39Å; R1065-K1069 PolarHBondContact O-N 2.94Å; K1066-K1069 PolarHBondContact O-N 3.37Å; Q1067-K1069 VanDerWaalsContact C-N 3.32Å; K1069-Q1071 PolarHBondContact O-N 3.47Å; K1069-Q1071 VanDerWaalsContact O-N 3.17Å; K1069-L1072 PolarHBondContact O-N 3.41Å; K1069-E1073 WeakPolarHBondContact CE-OE1 3.16Å; K1069-E1073 PolarHBondContact O-N 3.13Å
1070	E	64.8	Low	71.3	Confident	123 Å²	123	105.8 Å²	105.8	58%	0.575	50%	0.497	S	S	*	.	H	α-helix	trans	-63.7	-17.1	175.5	-73.2	174	-175	0	0	113.5	K1066	K1066-E1070 WeakPolarHBondContact CE-OE1 3.29Å; K1066-E1070 WeakPolarHBondContact O-CG 3.49Å; K1066-E1070 PolarHBondContact O-N 3.22Å
1071	Q	58.3	Low	70.2	Confident	159 Å²	159	103.2 Å²	103.2	74%	0.743	49%	0.494	S	S	*	.	H	α-helix	trans	-93.6	-15.9	172.6	-72.7	175.5	15.2	0	0	113.8	Q1067 Q1068 K1069	Q1067-Q1071 WeakPolarHBondContact O-CB 3.46Å; Q1067-Q1071 VanDerWaalsContact O-CG 3.28Å; Q1067-Q1071 WeakPolarHBondContact O-CG 3.39Å; Q1067-Q1071 PolarHBondContact O-N 3.4Å; Q1067-Q1071 VanDerWaalsContact O-N 3.12Å; Q1068-Q1071 PolarHBondContact O-N 2.74Å; K1069-Q1071 PolarHBondContact O-N 3.47Å; K1069-Q1071 VanDerWaalsContact O-N 3.17Å
1072	L	55.8	Low	69	Low	153 Å²	153	109.2 Å²	109.2	80%	0.801	53%	0.525	S	S	*	.	H	α-helix	trans	-99.2	-25	-179	-88.6	157.7	0	0	0	112.9	Q1068 K1069	Q1068-L1072 WeakPolarHBondContact O-CB 3.43Å; Q1068-L1072 WeakPolarHBondContact O-CD1 3.33Å; Q1068-L1072 PolarHBondContact O-N 3.13Å; Q1068-L1072 VanDerWaalsContact O-N 3.14Å; K1069-L1072 PolarHBondContact O-N 3.41Å
1073	E	45.2	Very low	67.8	Low	190 Å²	190	114.4 Å²	114.4	89%	0.888	55%	0.548	S	S	*	.			trans	-82.1	0	165.6	-70.8	178.1	-178.2	0	0	111.5	K1069	K1069-E1073 WeakPolarHBondContact CE-OE1 3.16Å; K1069-E1073 PolarHBondContact O-N 3.13Å

Retrieved 1,073 of 1,073 residues in 6194.7 ms (Link to these results)

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