A0A077YZD1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YZD1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 943 aa.

						>A0A077YZD1_TRITR|A0A077YZD1
MTFRALKLHCHKERYLRELGQYSSTGKTVFTIRPVHLGKLRLGYEYANCLGIYELVSCFLRHGPEFGLPIAVVVSCERLLLVLLLFLVISGEWQAGMSFDLCIELIGQPSDFTNNMKRMFNSCKPKSTTKLIESMLQLMPDFYNTLPSGLLFIIINYLYDAKDKQLFPFLLPFTRPYLGCMQQQRILDVAEWANAMFCINNPDGMEEAIRDPLLRRRFGNDHVLREIRHFFGTCSPCKLEPLRSRGHQQPENTELHERSLIKTLLRKLATPIARGMFTLRSVHPGCTEHLAIPKLCLCGVVLPKNLLVHAKRMELFPNILYWPRFHNGVAAALSIQPLKKMDKSREDPLDKSFIGSWLSHNLPYTKEEGGTLSPEHGGLMFGLGLNGYLRRLSLPEYHKYLIQCDPMVTSGLLLGIAAGMVGTCDLKIMKVLAPHVPFLTPPTLLDLCIEPTIQTTAVFAVGLLCAQSADLKLCICFLEQIENPSWAARDNVSEREGYALTCGLAFGLVALGRGRKLFSLPGRNFLLDRIVRMIHGGRSTRKEQEMNKEQEESLVKESRFYNTHVTAAPGILALGMSFLRSRDAGIAEWLKLPHRLEDLQCIRPDAAMLRVLSYSLIMWDIIGSDYRWIDALLPIPLRNYGRSIPAKKWDNLDGETLGQIYCYAVSGAAFAMALRFVSTGCARVIKTLSVLSSFTQVTAGSGHPDVLCAARAHLVRYSGRTEGAFGSQLVSHMAIGLALLGAGNYAFKVDDISIACLICALYPRFPMFHRDNRHHAQILRHLYVLAAERRSLEVQDSTTGSPVKATITWEFRDGVFDPSDVSSAISFYVPFQPEILFQGGREDADPVWQRLEHAAATRLEHSQIGARISSPLLKAFGEWRVFEFMSEELGACEGVRNEGKAGHSFLQKPVDRALMVSSLTNKRNITKIDKELSLARSVFVKYF
					

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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	41.2	Very low	58.8	Low	190 Å²	190	95.5 Å²	95.5	94%	0.936	47%	0.474	S	S	*	.				0	-41.4	0	-74.2	-177.5	-177.7	0	0	113
2	T	50.4	Low	59.7	Low	100 Å²	100	92.1 Å²	92.1	61%	0.613	45%	0.454	S	S	*	.			trans	-67.6	-33.6	174.4	26.8	0	0	0	0	115.1	R4 A5 L6	T2-R4 VanDerWaalsContact C-N 3.33Å; T2-R4 PolarHBondContact O-N 2.62Å; T2-A5 WeakPolarHBondContact O-CB 3.29Å; T2-A5 PolarHBondContact O-N 2.75Å; T2-A5 VanDerWaalsContact O-N 3.12Å; T2-L6 PolarHBondContact O-N 3.46Å
3	F	53	Low	60.7	Low	60 Å²	60	91.5 Å²	91.5	26%	0.263	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-31.8	-173.9	-68.6	-77.9	0	0	0	115.6	A5 L6 K7 L8 H11 Y15	F3-A5 VanDerWaalsContact C-N 3.33Å; F3-L6 PolarHBondContact O-N 3.41Å; F3-K7 PolarHBondContact O-N 3.39Å; F3-L8 HydrophobicContact CD1-CB 4.16Å; F3-L8 HydrophobicContact CD1-CD1 3.93Å; F3-L8 HydrophobicContact CE1-CD1 4.32Å; F3-L8 PolarHBondContact O-N 3.31Å; F3-H11 HydrophobicContact CD1-CB 3.81Å; F3-H11 HydrophobicContact CE1-CB 3.98Å; F3-Y15 HydrophobicContact CD2-CD2 4.25Å; F3-Y15 HydrophobicContact CD2-CE2 4.27Å; F3-Y15 AromaticContact CE1-CE2 3.94Å; F3-Y15 HydrophobicContact CE1-CE2 3.94Å; F3-Y15 AromaticContact CE2-CD2 3.93Å; F3-Y15 HydrophobicContact CE2-CD2 3.93Å; F3-Y15 AromaticContact CE2-CE2 3.56Å; F3-Y15 HydrophobicContact CE2-CE2 3.56Å; F3-Y15 HydrophobicContact CZ-CD2 4.16Å; F3-Y15 AromaticContact CZ-CE2 3.37Å; F3-Y15 HydrophobicContact CZ-CE2 3.37Å
4	R	50.6	Low	61.6	Low	158 Å²	158	88.3 Å²	88.3	60%	0.596	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-31.1	178.6	-135.5	178.6	-173.5	168	2.7	111.7	T2 L6	T2-R4 VanDerWaalsContact C-N 3.33Å; T2-R4 PolarHBondContact O-N 2.62Å; R4-L6 VanDerWaalsContact C-N 3.34Å
5	A	55	Low	62.3	Low	22 Å²	22	88.5 Å²	88.5	18%	0.182	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-30.9	174.5	0	0	0	0	0	111.8	T2 F3 F30 I32	T2-A5 WeakPolarHBondContact O-CB 3.29Å; T2-A5 PolarHBondContact O-N 2.75Å; T2-A5 VanDerWaalsContact O-N 3.12Å; F3-A5 VanDerWaalsContact C-N 3.33Å; A5-F30 HydrophobicContact CB-CB 4.38Å; A5-I32 HydrophobicContact CB-CD1 3.9Å; A5-I32 HydrophobicContact CB-CG1 4.08Å; A5-I32 WeakPolarHBondContact O-CD1 3.36Å
6	L	64	Low	63	Low	60 Å²	60	88.5 Å²	88.5	31%	0.314	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	2.5	178.9	-65.9	170.8	0	0	0	114.5	T2 F3 R4 L8 I32 L40	T2-L6 PolarHBondContact O-N 3.46Å; F3-L6 PolarHBondContact O-N 3.41Å; R4-L6 VanDerWaalsContact C-N 3.34Å; L6-L8 HydrophobicContact CB-CD1 3.92Å; L6-L8 HydrophobicContact CB-CG 4.07Å; L6-L8 HydrophobicContact CD1-CD1 4.18Å; L6-L8 PolarHBondContact O-N 2.88Å; L6-L8 VanDerWaalsContact O-N 3.16Å; L6-I32 HydrophobicContact CD2-CD1 4.27Å; L6-L40 HydrophobicContact CD2-CD1 3.92Å
7	K	61.7	Low	63.7	Low	177 Å²	177	93.6 Å²	93.6	77%	0.77	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	23.5	-175.6	-61.3	-175.8	177.3	-179	0	115	F3 H9	F3-K7 PolarHBondContact O-N 3.39Å; K7-H9 PolarHBondContact O-N 3.45Å; K7-H9 VanDerWaalsContact O-N 3.08Å
8	L	67	Low	64.1	Low	35 Å²	35	94.2 Å²	94.2	18%	0.183	44%	0.444	C	S	.	.			trans	-84.2	79.2	179.1	-69.4	169.1	0	0	0	111	F3 L6 H11 K12 Y46	F3-L8 HydrophobicContact CD1-CB 4.16Å; F3-L8 HydrophobicContact CD1-CD1 3.93Å; F3-L8 HydrophobicContact CE1-CD1 4.32Å; F3-L8 PolarHBondContact O-N 3.31Å; L6-L8 HydrophobicContact CB-CD1 3.92Å; L6-L8 HydrophobicContact CB-CG 4.07Å; L6-L8 HydrophobicContact CD1-CD1 4.18Å; L6-L8 PolarHBondContact O-N 2.88Å; L6-L8 VanDerWaalsContact O-N 3.16Å; L8-H11 HydrophobicContact CB-CB 4.28Å; L8-K12 PolarHBondContact O-N 3.22Å; L8-Y46 HydrophobicContact CD2-CD1 4.22Å; L8-Y46 HydrophobicContact CD2-CE1 3.81Å
9	H	66.3	Low	64.5	Low	109 Å²	109	94.6 Å²	94.6	51%	0.505	45%	0.448	S	S	.	.	H	α-helix	trans	-64.9	-44	-174.2	-152.2	-77.1	0	0	0	113	K7 H11 K12 E13	K7-H9 PolarHBondContact O-N 3.45Å; K7-H9 VanDerWaalsContact O-N 3.08Å; H9-H11 PolarHBondContact O-N 3.49Å; H9-K12 WeakPolarHBondContact O-CB 3.3Å; H9-K12 PolarHBondContact O-N 3.27Å; H9-E13 IonicContact CE1-OE1 3.28Å; H9-E13 PolarHBondContact CE1-OE1 3.48Å; H9-E13 IonicContact ND1-OE1 3.75Å; H9-E13 PolarHBondContact ND1-OE1 2.87Å; H9-E13 PolarHBondContact O-N 2.84Å
10	C	68.2	Low	64.4	Low	96 Å²	96	93.3 Å²	93.3	65%	0.649	46%	0.461	S	S	*	.	H	α-helix	trans	-62.7	-44.1	-177.7	-52.6	0	0	0	0	112.3	K12 E13 R14	C10-K12 VanDerWaalsContact C-N 3.33Å; C10-K12 PolarHBondContact O-N 3.43Å; C10-E13 PolarHBondContact O-N 2.89Å; C10-R14 PolarHBondContact O-N 2.96Å
11	H	70	Confident	64.2	Low	43 Å²	43	97.5 Å²	97.5	20%	0.199	48%	0.48	C	S	.	.	H	α-helix	trans	-61.2	-43.6	176	-69	-97.7	0	0	0	111.3	F3 L8 H9 E13 R14 Y15 C49	F3-H11 HydrophobicContact CD1-CB 3.81Å; F3-H11 HydrophobicContact CE1-CB 3.98Å; L8-H11 HydrophobicContact CB-CB 4.28Å; H9-H11 PolarHBondContact O-N 3.49Å; H11-E13 PolarHBondContact O-N 2.89Å; H11-R14 PolarHBondContact O-N 3.23Å; H11-Y15 HydrophobicContact CB-CD2 4.36Å; H11-Y15 HydrophobicContact CB-CE2 4.23Å; H11-Y15 WeakPolarHBondContact O-CD2 3.21Å; H11-Y15 PolarHBondContact O-N 3.09Å; H11-C49 WeakPolarHBondContact CE1-CB 3.37Å; H11-C49 PolarHBondContact CE1-SG 2.98Å; H11-C49 PolarHBondContact ND1-SG 3.04Å
12	K	68.9	Low	64.8	Low	55 Å²	55	97.1 Å²	97.1	24%	0.239	47%	0.469	C	S	.	.	H	α-helix	trans	-59.6	-47.7	178.5	180	-163.7	166.6	-146.3	0	111.1	L8 H9 C10 R14 Y15 L16	L8-K12 PolarHBondContact O-N 3.22Å; H9-K12 WeakPolarHBondContact O-CB 3.3Å; H9-K12 PolarHBondContact O-N 3.27Å; C10-K12 VanDerWaalsContact C-N 3.33Å; C10-K12 PolarHBondContact O-N 3.43Å; K12-R14 VanDerWaalsContact C-N 3.34Å; K12-Y15 PolarHBondContact O-N 3.21Å; K12-L16 HydrophobicContact CG-CD1 4.03Å; K12-L16 WeakPolarHBondContact O-CB 3.5Å; K12-L16 VanDerWaalsContact O-CG 3.26Å; K12-L16 WeakPolarHBondContact O-CG 3.3Å; K12-L16 PolarHBondContact O-N 3.21Å
13	E	72.4	Confident	64.9	Low	85 Å²	85	96.5 Å²	96.5	40%	0.397	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-43.4	178.2	-76.8	-178.2	-166.2	0	0	112.1	H9 C10 H11 L16 R17	H9-E13 IonicContact CE1-OE1 3.28Å; H9-E13 PolarHBondContact CE1-OE1 3.48Å; H9-E13 IonicContact ND1-OE1 3.75Å; H9-E13 PolarHBondContact ND1-OE1 2.87Å; H9-E13 PolarHBondContact O-N 2.84Å; C10-E13 PolarHBondContact O-N 2.89Å; H11-E13 PolarHBondContact O-N 2.89Å; E13-L16 PolarHBondContact O-N 3.11Å; E13-R17 WeakPolarHBondContact O-CG 3.46Å; E13-R17 PolarHBondContact O-N 3.15Å
14	R	73.3	Confident	64.9	Low	46 Å²	46	97.8 Å²	97.8	17%	0.174	49%	0.485	C	S	.	.	H	α-helix	trans	-60.5	-50.2	176.1	-179.8	179.4	155.2	-160.6	-9.5	112.2	C10 H11 K12 L16 R17 E18 C49 L50	C10-R14 PolarHBondContact O-N 2.96Å; H11-R14 PolarHBondContact O-N 3.23Å; K12-R14 VanDerWaalsContact C-N 3.34Å; R14-L16 PolarHBondContact O-N 3.45Å; R14-R17 WeakPolarHBondContact O-CB 3.25Å; R14-R17 PolarHBondContact O-N 2.94Å; R14-R17 VanDerWaalsContact O-N 3.07Å; R14-E18 IonicContact CZ-OE1 3.86Å; R14-E18 IonicContact NE-OE1 3.56Å; R14-E18 PolarHBondContact NE-OE1 3.12Å; R14-E18 IonicContact NH2-OE1 2.99Å; R14-E18 PolarHBondContact NH2-OE1 3.44Å; R14-E18 PolarHBondContact O-N 2.86Å; R14-C49 VanDerWaalsContact CD-O 3.29Å; R14-C49 WeakPolarHBondContact CD-O 3.42Å; R14-C49 PolarHBondContact NH1-O 3.35Å; R14-L50 PolarHBondContact NH1-O 3.47Å
15	Y	71.9	Confident	64.9	Low	92 Å²	92	96.2 Å²	96.2	36%	0.361	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-33.6	177.4	-75	-62.6	0	0	0	112.2	F3 H11 K12 L19	F3-Y15 HydrophobicContact CD2-CD2 4.25Å; F3-Y15 HydrophobicContact CD2-CE2 4.27Å; F3-Y15 AromaticContact CE1-CE2 3.94Å; F3-Y15 HydrophobicContact CE1-CE2 3.94Å; F3-Y15 AromaticContact CE2-CD2 3.93Å; F3-Y15 HydrophobicContact CE2-CD2 3.93Å; F3-Y15 AromaticContact CE2-CE2 3.56Å; F3-Y15 HydrophobicContact CE2-CE2 3.56Å; F3-Y15 HydrophobicContact CZ-CD2 4.16Å; F3-Y15 AromaticContact CZ-CE2 3.37Å; F3-Y15 HydrophobicContact CZ-CE2 3.37Å; H11-Y15 HydrophobicContact CB-CD2 4.36Å; H11-Y15 HydrophobicContact CB-CE2 4.23Å; H11-Y15 WeakPolarHBondContact O-CD2 3.21Å; H11-Y15 PolarHBondContact O-N 3.09Å; K12-Y15 PolarHBondContact O-N 3.21Å; Y15-L19 VanDerWaalsContact O-CB 3.27Å; Y15-L19 WeakPolarHBondContact O-CB 3.47Å; Y15-L19 WeakPolarHBondContact O-CG 3.47Å; Y15-L19 PolarHBondContact O-N 3.28Å
16	L	73.6	Confident	64.8	Low	88 Å²	88	98.1 Å²	98.1	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-68.2	-37.8	174	-74.2	171.3	0	0	0	112.3	K12 E13 R14 G20	K12-L16 HydrophobicContact CG-CD1 4.03Å; K12-L16 WeakPolarHBondContact O-CB 3.5Å; K12-L16 VanDerWaalsContact O-CG 3.26Å; K12-L16 WeakPolarHBondContact O-CG 3.3Å; K12-L16 PolarHBondContact O-N 3.21Å; E13-L16 PolarHBondContact O-N 3.11Å; R14-L16 PolarHBondContact O-N 3.45Å; L16-G20 PolarHBondContact O-N 2.99Å
17	R	74.6	Confident	64.4	Low	175 Å²	175	103.4 Å²	103.4	66%	0.66	54%	0.536	S	S	*	.	H	α-helix	trans	-63.7	-43.8	172.9	-69.8	-178.7	-158.2	169.7	4.2	111.7	E13 R14 E54	E13-R17 WeakPolarHBondContact O-CG 3.46Å; E13-R17 PolarHBondContact O-N 3.15Å; R14-R17 WeakPolarHBondContact O-CB 3.25Å; R14-R17 PolarHBondContact O-N 2.94Å; R14-R17 VanDerWaalsContact O-N 3.07Å; R17-E54 IonicContact NH1-OE1 2.71Å
18	E	71.1	Confident	64.2	Low	105 Å²	105	99.7 Å²	99.7	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-73.6	-36.2	-177.5	-70.4	-176.2	-165.1	0	0	112.9	R14	R14-E18 IonicContact CZ-OE1 3.86Å; R14-E18 IonicContact NE-OE1 3.56Å; R14-E18 PolarHBondContact NE-OE1 3.12Å; R14-E18 IonicContact NH2-OE1 2.99Å; R14-E18 PolarHBondContact NH2-OE1 3.44Å; R14-E18 PolarHBondContact O-N 2.86Å
19	L	71.5	Confident	63.7	Low	101 Å²	101	103.2 Å²	103.2	53%	0.529	55%	0.551	S	S	.	*	H	α-helix	trans	-88.3	-11	-174.7	-71.5	167.5	0	0	0	114.7	Y15 Q21 Y22	Y15-L19 VanDerWaalsContact O-CB 3.27Å; Y15-L19 WeakPolarHBondContact O-CB 3.47Å; Y15-L19 WeakPolarHBondContact O-CG 3.47Å; Y15-L19 PolarHBondContact O-N 3.28Å; L19-Q21 PolarHBondContact O-N 2.96Å; L19-Y22 HydrophobicContact CB-CD2 4.41Å
20	G	62.7	Low	63.5	Low	68 Å²	68	104.7 Å²	104.7	70%	0.701	56%	0.556	S	S	*	*	S	Bend	trans	57.4	-35.8	165.5	0	0	0	0	0	119.5	L16	L16-G20 PolarHBondContact O-N 2.99Å
21	Q	59.9	Low	63.3	Low	182 Å²	182	106.2 Å²	106.2	85%	0.85	56%	0.562	S	S	*	*	S	Bend	trans	-128.9	-3.9	-166.9	-66.5	-175.3	-12.2	0	0	113.7	L19 S23	L19-Q21 PolarHBondContact O-N 2.96Å; Q21-S23 PolarHBondContact O-N 3.3Å
22	Y	55.3	Low	63.2	Low	183 Å²	183	107 Å²	107	72%	0.718	57%	0.567	S	S	*	*			trans	-74.9	74.8	173.4	-98.4	-85.6	0	0	0	111	L19 S24	L19-Y22 HydrophobicContact CB-CD2 4.41Å; Y22-S24 PolarHBondContact O-N 2.89Å
23	S	52.6	Low	63	Low	87 Å²	87	113 Å²	113	61%	0.608	59%	0.589	S	S	*	*			trans	-63	128.1	159.1	69.8	0	0	0	0	107.9	Q21 T25	Q21-S23 PolarHBondContact O-N 3.3Å; S23-T25 VanDerWaalsContact C-N 3.34Å; S23-T25 PolarHBondContact O-N 3.02Å
24	S	53.3	Low	62.7	Low	86 Å²	86	114.3 Å²	114.3	60%	0.601	60%	0.604	S	S	*	*			trans	-69.7	88.3	-176.3	67.3	0	0	0	0	110.8	Y22	Y22-S24 PolarHBondContact O-N 2.89Å
25	T	50.4	Low	62.4	Low	125 Å²	125	117.1 Å²	117.1	77%	0.767	63%	0.626	S	S	*	*			trans	-80.2	115	164.3	44.9	0	0	0	0	108	S23	S23-T25 VanDerWaalsContact C-N 3.34Å; S23-T25 PolarHBondContact O-N 3.02Å
26	G	53	Low	62.3	Low	62 Å²	62	117.4 Å²	117.4	64%	0.639	63%	0.631	S	S	*	*	S	Bend	trans	93.2	81.8	-178	0	0	0	0	0	114.4	T28	G26-T28 PolarHBondContact O-N 3.08Å
27	K	55.3	Low	62	Low	172 Å²	172	116.7 Å²	116.7	75%	0.748	63%	0.627	S	S	*	*			trans	-72.7	88.7	170.2	-71.6	176.5	-178.6	172	0	110
28	T	56.6	Low	61.5	Low	98 Å²	98	112 Å²	112	60%	0.601	63%	0.632	S	S	*	*			trans	-96.9	112.2	159.4	43.9	0	0	0	0	108.8	G26	G26-T28 PolarHBondContact O-N 3.08Å
29	V	56.9	Low	61.4	Low	110 Å²	110	114.7 Å²	114.7	67%	0.667	64%	0.643	S	S	*	*			trans	-92.7	108.6	175.4	179.7	0	0	0	0	107.5
30	F	62.5	Low	61.1	Low	139 Å²	139	113.7 Å²	113.7	61%	0.61	64%	0.638	S	S	*	*			trans	-86	113.3	170.9	-64.1	-82.8	0	0	0	109.2	A5	A5-F30 HydrophobicContact CB-CB 4.38Å
31	T	64	Low	60.9	Low	128 Å²	128	122.2 Å²	122.2	79%	0.785	65%	0.649	S	S	*	*			trans	-88.2	113.5	171.6	33.5	0	0	0	0	109.7	R33	T31-R33 PolarHBondContact O-N 3.2Å
32	I	66.8	Low	60.8	Low	60 Å²	60	119 Å²	119	31%	0.308	64%	0.637	S	S	.	*			trans	-77.4	122	169.9	-57.8	178	0	0	0	107.3	A5 L6 H36 L37	A5-I32 HydrophobicContact CB-CD1 3.9Å; A5-I32 HydrophobicContact CB-CG1 4.08Å; A5-I32 WeakPolarHBondContact O-CD1 3.36Å; L6-I32 HydrophobicContact CD2-CD1 4.27Å; I32-H36 HydrophobicContact CG2-CB 3.87Å; I32-L37 HydrophobicContact CB-CD1 4.14Å; I32-L37 HydrophobicContact CD1-CD1 4.19Å; I32-L37 HydrophobicContact CG2-CB 4.33Å; I32-L37 HydrophobicContact CG2-CD1 3.93Å
33	R	66.4	Low	60.9	Low	182 Å²	182	113.5 Å²	113.5	69%	0.687	64%	0.636	S	S	*	*			trans	-58.1	138.4	173.3	-69.5	-174.9	-175.4	175.1	1.4	109.3	T31 V35 H36 L37	T31-R33 PolarHBondContact O-N 3.2Å; R33-V35 PolarHBondContact O-N 3.04Å; R33-H36 PolarHBondContact O-N 3.22Å; R33-L37 PolarHBondContact O-N 3.29Å
34	P	65	Low	61.1	Low	112 Å²	112	117 Å²	117	73%	0.727	64%	0.636	S	S	*	*	H	α-helix	trans	-51.8	-35	-178	-26.2	32.5	0	0	0	113.7	H36 L37 G38	P34-H36 VanDerWaalsContact C-N 3.26Å; P34-H36 PolarHBondContact O-N 3.17Å; P34-L37 WeakPolarHBondContact O-CB 3.3Å; P34-L37 PolarHBondContact O-N 3.31Å; P34-G38 PolarHBondContact O-N 2.87Å
35	V	67.1	Low	61.1	Low	104 Å²	104	121.9 Å²	121.9	63%	0.63	65%	0.65	S	S	*	*	H	α-helix	trans	-61.4	-32.1	177.6	-169.9	0	0	0	0	112.8	R33	R33-V35 PolarHBondContact O-N 3.04Å
36	H	70.4	Confident	61	Low	98 Å²	98	124.6 Å²	124.6	45%	0.454	65%	0.647	S	S	.	*	H	α-helix	trans	-85.4	-29.4	177.4	-60.5	164.5	0	0	0	111.8	I32 R33 P34 G38 K39	I32-H36 HydrophobicContact CG2-CB 3.87Å; R33-H36 PolarHBondContact O-N 3.22Å; P34-H36 VanDerWaalsContact C-N 3.26Å; P34-H36 PolarHBondContact O-N 3.17Å; H36-G38 VanDerWaalsContact C-N 3.29Å; H36-G38 PolarHBondContact O-N 3.3Å; H36-K39 PolarHBondContact O-N 3.25Å; H36-K39 VanDerWaalsContact O-N 3.11Å
37	L	66.2	Low	61	Low	74 Å²	74	125.4 Å²	125.4	39%	0.387	65%	0.648	S	S	.	*	H	α-helix	trans	-62.2	-40.1	175.8	-151.1	86.9	0	0	0	110.9	I32 R33 P34 K39 L40	I32-L37 HydrophobicContact CB-CD1 4.14Å; I32-L37 HydrophobicContact CD1-CD1 4.19Å; I32-L37 HydrophobicContact CG2-CB 4.33Å; I32-L37 HydrophobicContact CG2-CD1 3.93Å; R33-L37 PolarHBondContact O-N 3.29Å; P34-L37 WeakPolarHBondContact O-CB 3.3Å; P34-L37 PolarHBondContact O-N 3.31Å; L37-K39 PolarHBondContact O-N 3.27Å; L37-L40 HydrophobicContact CD1-CD1 4.36Å; L37-L40 PolarHBondContact O-N 3.08Å
38	G	63.9	Low	61.3	Low	75 Å²	75	124.1 Å²	124.1	77%	0.773	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-13.9	175	0	0	0	0	0	115.3	P34 H36	P34-G38 PolarHBondContact O-N 2.87Å; H36-G38 VanDerWaalsContact C-N 3.29Å; H36-G38 PolarHBondContact O-N 3.3Å
39	K	69.1	Low	61.5	Low	162 Å²	162	122 Å²	122	70%	0.704	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-13	175.4	-69.6	-176.6	179.8	-175.9	0	113.2	H36 L37 R41	H36-K39 PolarHBondContact O-N 3.25Å; H36-K39 VanDerWaalsContact O-N 3.11Å; L37-K39 PolarHBondContact O-N 3.27Å; K39-R41 PolarHBondContact O-N 2.98Å
40	L	65.5	Low	62	Low	81 Å²	81	120.1 Å²	120.1	42%	0.424	62%	0.624	S	S	.	*			trans	-73.8	109.6	177.5	-69.4	167.3	0	0	0	108.7	L6 L37 L42	L6-L40 HydrophobicContact CD2-CD1 3.92Å; L37-L40 HydrophobicContact CD1-CD1 4.36Å; L37-L40 PolarHBondContact O-N 3.08Å; L40-L42 VanDerWaalsContact C-N 3.28Å; L40-L42 PolarHBondContact O-N 2.85Å
41	R	59.5	Low	62.7	Low	247 Å²	247	113.6 Å²	113.6	93%	0.932	60%	0.596	S	S	*	*			trans	-70.1	87.9	166.2	-73.8	-173.6	179.8	-179.6	-0	108.5	K39 G43	K39-R41 PolarHBondContact O-N 2.98Å; R41-G43 PolarHBondContact O-N 3.25Å; R41-G43 VanDerWaalsContact O-N 3.15Å
42	L	57.8	Low	63.4	Low	115 Å²	115	109.8 Å²	109.8	60%	0.602	57%	0.57	S	S	*	*			trans	-76	94.8	167	-72.8	162.4	0	0	0	107.1	L40 Y44	L40-L42 VanDerWaalsContact C-N 3.28Å; L40-L42 PolarHBondContact O-N 2.85Å; L42-Y44 PolarHBondContact O-N 3.42Å
43	G	57.4	Low	64	Low	67 Å²	67	113.1 Å²	113.1	69%	0.691	58%	0.58	S	S	*	*			trans	-75.9	1.2	-174.7	0	0	0	0	0	115.5	R41	R41-G43 PolarHBondContact O-N 3.25Å; R41-G43 VanDerWaalsContact O-N 3.15Å
44	Y	56.1	Low	64.6	Low	160 Å²	160	107.7 Å²	107.7	63%	0.627	56%	0.562	S	S	*	*	S	Bend	trans	-138.2	110.7	178.3	-69.5	-83.2	0	0	0	108.4	L42 Y46 I106	L42-Y44 PolarHBondContact O-N 3.42Å; Y44-Y46 PolarHBondContact O-N 2.69Å; Y44-I106 HydrophobicContact CE1-CD1 4.44Å
45	E	52.6	Low	65.3	Low	189 Å²	189	103.3 Å²	103.3	88%	0.883	53%	0.532	S	S	*	.			trans	-60.9	120.2	171.3	-69.6	-176.1	159.4	0	0	108.7	A47	E45-A47 PolarHBondContact O-N 3.33Å
46	Y	49.4	Very low	65.9	Low	181 Å²	181	98.6 Å²	98.6	71%	0.71	50%	0.504	S	S	*	.			trans	-5.2	76.7	173.8	-59.8	-86.8	0	0	0	117.1	L8 Y44	L8-Y46 HydrophobicContact CD2-CD1 4.22Å; L8-Y46 HydrophobicContact CD2-CE1 3.81Å; Y44-Y46 PolarHBondContact O-N 2.69Å
47	A	53.5	Low	66.2	Low	80 Å²	80	95.7 Å²	95.7	66%	0.661	50%	0.495	S	S	*	.			trans	-82.2	125.5	168.3	0	0	0	0	0	109.4	E45 C49	E45-A47 PolarHBondContact O-N 3.33Å; A47-C49 PolarHBondContact O-N 2.71Å
48	N	60.3	Low	66.8	Low	144 Å²	144	93.4 Å²	93.4	77%	0.77	48%	0.484	S	S	*	.			trans	-44.6	111.1	175.9	-77.1	-27.6	0	0	0	111	L50	N48-L50 VanDerWaalsContact C-N 3.27Å; N48-L50 PolarHBondContact O-N 2.89Å
49	C	60.4	Low	67.4	Low	53 Å²	53	89.8 Å²	89.8	36%	0.358	45%	0.448	S	S	.	.			trans	-83	73.4	-174.1	-156.4	0	0	0	0	110.9	H11 R14 A47	H11-C49 WeakPolarHBondContact CE1-CB 3.37Å; H11-C49 PolarHBondContact CE1-SG 2.98Å; H11-C49 PolarHBondContact ND1-SG 3.04Å; R14-C49 VanDerWaalsContact CD-O 3.29Å; R14-C49 WeakPolarHBondContact CD-O 3.42Å; R14-C49 PolarHBondContact NH1-O 3.35Å; A47-C49 PolarHBondContact O-N 2.71Å
50	L	69.2	Low	67.7	Low	71 Å²	71	85.8 Å²	85.8	37%	0.372	43%	0.433	S	S	.	.			trans	-65.2	137.9	173.9	-79	143.2	0	0	0	110.9	R14 N48 E54	R14-L50 PolarHBondContact NH1-O 3.47Å; N48-L50 VanDerWaalsContact C-N 3.27Å; N48-L50 PolarHBondContact O-N 2.89Å; L50-E54 HydrophobicContact CD2-CB 3.95Å
51	G	75.5	Confident	68.2	Low	2 Å²	2	91.4 Å²	91.4	2%	0.021	45%	0.449	C	S	.	.			trans	-72.9	156	169.9	0	0	0	0	0	112.9	Y53 E54 L55	G51-Y53 PolarHBondContact O-N 3.49Å; G51-E54 PolarHBondContact N-OE2 2.91Å; G51-E54 PolarHBondContact O-N 3.38Å; G51-E54 VanDerWaalsContact O-N 3.09Å; G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 3.07Å
52	I	79.2	Confident	68.5	Low	49 Å²	49	85.7 Å²	85.7	25%	0.251	43%	0.433	S	S	.	.	H	α-helix	trans	-57.7	-38.7	176.8	-168.2	-174.8	0	0	0	111.1	L55 V56 L79 V82	I52-L55 PolarHBondContact O-N 3.08Å; I52-V56 HydrophobicContact CG1-CG2 4.39Å; I52-V56 WeakPolarHBondContact O-CB 3.46Å; I52-V56 VanDerWaalsContact O-CG2 3.28Å; I52-V56 WeakPolarHBondContact O-CG2 3.45Å; I52-V56 PolarHBondContact O-N 3.27Å; I52-L79 HydrophobicContact CB-CD1 4.37Å; I52-L79 HydrophobicContact CD1-CD1 3.31Å; I52-L79 HydrophobicContact CG1-CD1 3.8Å; I52-V82 HydrophobicContact CD1-CB 4.46Å; I52-V82 HydrophobicContact CD1-CG1 3.91Å
53	Y	79.8	Confident	68.7	Low	130 Å²	130	81.2 Å²	81.2	51%	0.51	41%	0.414	S	S	.	.	H	α-helix	trans	-69.3	-36.5	177	-60.4	-66.2	0	0	0	112.5	G51 S57 P147 L150	G51-Y53 PolarHBondContact O-N 3.49Å; Y53-S57 VanDerWaalsContact O-CB 3.29Å; Y53-S57 WeakPolarHBondContact O-CB 3.36Å; Y53-S57 PolarHBondContact O-N 3.47Å; Y53-P147 HydrophobicContact CE1-CB 4.22Å; Y53-P147 HydrophobicContact CE1-CG 4.21Å; Y53-P147 WeakPolarHBondContact OH-CG 3.36Å; Y53-L150 HydrophobicContact CE1-CD1 4.12Å; Y53-L150 HydrophobicContact CE1-CG 4.25Å
54	E	78.8	Confident	68.5	Low	68 Å²	68	84.5 Å²	84.5	32%	0.318	42%	0.423	S	S	.	.	H	α-helix	trans	-67.1	-44.4	173.5	-68.5	175.7	157.7	0	0	110.1	R17 L50 G51 S57 C58	R17-E54 IonicContact NH1-OE1 2.71Å; L50-E54 HydrophobicContact CD2-CB 3.95Å; G51-E54 PolarHBondContact N-OE2 2.91Å; G51-E54 PolarHBondContact O-N 3.38Å; G51-E54 VanDerWaalsContact O-N 3.09Å; E54-S57 CarbonylContact O-C 3.53Å; E54-S57 WeakPolarHBondContact O-CB 3.47Å; E54-S57 PolarHBondContact O-N 2.91Å; E54-C58 PolarHBondContact O-N 3.27Å; E54-C58 PolarHBondContact O-SG 2.92Å
55	L	79.2	Confident	68.8	Low	19 Å²	19	84.8 Å²	84.8	10%	0.099	43%	0.43	C	S	.	.	H	α-helix	trans	-63.5	-44.9	177.8	-172.8	72.6	0	0	0	112.1	G51 I52 S57 C58 F59 I70 L83	G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 3.07Å; I52-L55 PolarHBondContact O-N 3.08Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.35Å; L55-C58 WeakPolarHBondContact O-CB 3.21Å; L55-C58 PolarHBondContact O-N 3.41Å; L55-C58 VanDerWaalsContact O-N 3.1Å; L55-F59 HydrophobicContact CD1-CE2 4.46Å; L55-F59 HydrophobicContact CD1-CZ 4.49Å; L55-F59 HydrophobicContact CD2-CE2 3.99Å; L55-F59 HydrophobicContact CD2-CZ 4.44Å; L55-F59 HydrophobicContact CG-CD2 4.2Å; L55-F59 HydrophobicContact CG-CE2 3.77Å; L55-F59 HydrophobicContact CG-CZ 4.25Å; L55-F59 WeakPolarHBondContact O-CD2 3.46Å; L55-F59 WeakPolarHBondContact O-CG 3.46Å; L55-F59 PolarHBondContact O-N 2.98Å; L55-I70 HydrophobicContact CD1-CD1 4.33Å; L55-I70 HydrophobicContact CD2-CD1 4.13Å; L55-I70 HydrophobicContact CD2-CG2 4.42Å; L55-L83 HydrophobicContact CD2-CD2 3.43Å; L55-L83 VanDerWaalsContact CD2-CD2 3.43Å
56	V	79.2	Confident	69.2	Low	5 Å²	5	77.5 Å²	77.5	3%	0.03	40%	0.396	C	S	.	.	H	α-helix	trans	-63.5	-40	173.2	170.4	0	0	0	0	110.8	I52 C58 F59 L60 F86 L150	I52-V56 HydrophobicContact CG1-CG2 4.39Å; I52-V56 WeakPolarHBondContact O-CB 3.46Å; I52-V56 VanDerWaalsContact O-CG2 3.28Å; I52-V56 WeakPolarHBondContact O-CG2 3.45Å; I52-V56 PolarHBondContact O-N 3.27Å; V56-C58 VanDerWaalsContact C-N 3.27Å; V56-C58 PolarHBondContact O-N 2.91Å; V56-F59 PolarHBondContact O-N 3Å; V56-L60 HydrophobicContact CG1-CD1 3.82Å; V56-L60 HydrophobicContact CG1-CG 4.38Å; V56-L60 WeakPolarHBondContact O-CD1 3.41Å; V56-L60 VanDerWaalsContact O-CG 3.23Å; V56-L60 WeakPolarHBondContact O-CG 3.47Å; V56-L60 PolarHBondContact O-N 3.01Å; V56-F86 HydrophobicContact CG1-CD1 3.64Å; V56-F86 HydrophobicContact CG1-CE1 3.41Å; V56-F86 VanDerWaalsContact CG1-CE1 3.41Å; V56-F86 HydrophobicContact CG1-CE2 4.37Å; V56-F86 HydrophobicContact CG1-CG 4.21Å; V56-F86 HydrophobicContact CG1-CZ 3.83Å; V56-F86 HydrophobicContact CG2-CD1 4.31Å; V56-F86 HydrophobicContact CG2-CD2 4.03Å; V56-F86 HydrophobicContact CG2-CE2 4.33Å; V56-F86 HydrophobicContact CG2-CG 4.04Å; V56-L150 HydrophobicContact CB-CD2 4.1Å; V56-L150 HydrophobicContact CG1-CD2 3.7Å; V56-L150 HydrophobicContact CG2-CD2 3.91Å
57	S	78.3	Confident	70	Confident	38 Å²	38	72 Å²	72	27%	0.266	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-31.5	172.2	-177.3	0	0	0	0	112.6	Y53 E54 L55 R61	Y53-S57 VanDerWaalsContact O-CB 3.29Å; Y53-S57 WeakPolarHBondContact O-CB 3.36Å; Y53-S57 PolarHBondContact O-N 3.47Å; E54-S57 CarbonylContact O-C 3.53Å; E54-S57 WeakPolarHBondContact O-CB 3.47Å; E54-S57 PolarHBondContact O-N 2.91Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.35Å; S57-R61 WeakPolarHBondContact O-CB 3.45Å; S57-R61 WeakPolarHBondContact O-CG 3.28Å; S57-R61 PolarHBondContact O-N 2.95Å; S57-R61 PolarHBondContact OG-NE 3.43Å
58	C	77.4	Confident	70.8	Confident	25 Å²	25	71 Å²	71	17%	0.169	38%	0.377	C	S	.	.	H	α-helix	trans	-71.4	-44.1	174.6	-70.5	0	0	0	0	111.1	E54 L55 V56 L60 R61 H62 G63 F66	E54-C58 PolarHBondContact O-N 3.27Å; E54-C58 PolarHBondContact O-SG 2.92Å; L55-C58 WeakPolarHBondContact O-CB 3.21Å; L55-C58 PolarHBondContact O-N 3.41Å; L55-C58 VanDerWaalsContact O-N 3.1Å; V56-C58 VanDerWaalsContact C-N 3.27Å; V56-C58 PolarHBondContact O-N 2.91Å; C58-L60 VanDerWaalsContact C-N 3.31Å; C58-L60 PolarHBondContact O-N 3.49Å; C58-R61 PolarHBondContact O-N 3.45Å; C58-H62 PolarHBondContact O-N 2.95Å; C58-G63 PolarHBondContact O-N 3.1Å; C58-F66 HydrophobicContact CB-CD1 4.09Å; C58-F66 HydrophobicContact CB-CE1 4.45Å
59	F	77.6	Confident	71.3	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-57.7	-42.7	174.1	-75	-44.7	0	0	0	112	L55 V56 R61 F66 I70 L83 F86 L87 S90 E92	L55-F59 HydrophobicContact CD1-CE2 4.46Å; L55-F59 HydrophobicContact CD1-CZ 4.49Å; L55-F59 HydrophobicContact CD2-CE2 3.99Å; L55-F59 HydrophobicContact CD2-CZ 4.44Å; L55-F59 HydrophobicContact CG-CD2 4.2Å; L55-F59 HydrophobicContact CG-CE2 3.77Å; L55-F59 HydrophobicContact CG-CZ 4.25Å; L55-F59 WeakPolarHBondContact O-CD2 3.46Å; L55-F59 WeakPolarHBondContact O-CG 3.46Å; L55-F59 PolarHBondContact O-N 2.98Å; V56-F59 PolarHBondContact O-N 3Å; F59-R61 VanDerWaalsContact C-N 3.34Å; F59-F66 HydrophobicContact CD1-CE1 4.34Å; F59-F66 AromaticContact CD1-CE2 3.98Å; F59-F66 HydrophobicContact CD1-CE2 3.98Å; F59-F66 AromaticContact CD1-CZ 3.78Å; F59-F66 HydrophobicContact CD1-CZ 3.78Å; F59-F66 HydrophobicContact CE1-CD2 4.22Å; F59-F66 AromaticContact CE1-CE2 3.7Å; F59-F66 HydrophobicContact CE1-CE2 3.7Å; F59-F66 HydrophobicContact CE1-CZ 4.01Å; F59-I70 HydrophobicContact CE1-CD1 4.19Å; F59-I70 HydrophobicContact CE2-CD1 4.3Å; F59-I70 HydrophobicContact CZ-CD1 3.43Å; F59-I70 VanDerWaalsContact CZ-CD1 3.43Å; F59-L83 HydrophobicContact CE2-CD2 4.1Å; F59-F86 HydrophobicContact CD2-CB 4.23Å; F59-L87 HydrophobicContact CD1-CD2 4.46Å; F59-L87 HydrophobicContact CE1-CD2 3.56Å; F59-L87 HydrophobicContact CE1-CG 4.33Å; F59-L87 HydrophobicContact CZ-CD2 3.63Å; F59-L87 HydrophobicContact CZ-CG 3.97Å; F59-S90 WeakPolarHBondContact O-CB 3.35Å; F59-E92 HydrophobicContact CD1-CG 4.16Å
60	L	75.4	Confident	72.1	Confident	77 Å²	77	65.6 Å²	65.6	40%	0.403	35%	0.348	S	S	.	.	H	α-helix	trans	-74.8	-22.4	179.7	-64.4	165.7	0	0	0	113.6	V56 C58 I153	V56-L60 HydrophobicContact CG1-CD1 3.82Å; V56-L60 HydrophobicContact CG1-CG 4.38Å; V56-L60 WeakPolarHBondContact O-CD1 3.41Å; V56-L60 VanDerWaalsContact O-CG 3.23Å; V56-L60 WeakPolarHBondContact O-CG 3.47Å; V56-L60 PolarHBondContact O-N 3.01Å; C58-L60 VanDerWaalsContact C-N 3.31Å; C58-L60 PolarHBondContact O-N 3.49Å; L60-I153 HydrophobicContact CD1-CD1 3.55Å; L60-I153 HydrophobicContact CD2-CG2 4.12Å
61	R	75.1	Confident	72.6	Confident	199 Å²	199	65 Å²	65	75%	0.751	35%	0.353	S	S	*	.	H	α-helix	trans	-91.8	-4.4	179	-74	179.6	-165.7	-171.1	6.5	113.6	S57 C58 F59 G63	S57-R61 WeakPolarHBondContact O-CB 3.45Å; S57-R61 WeakPolarHBondContact O-CG 3.28Å; S57-R61 PolarHBondContact O-N 2.95Å; S57-R61 PolarHBondContact OG-NE 3.43Å; C58-R61 PolarHBondContact O-N 3.45Å; F59-R61 VanDerWaalsContact C-N 3.34Å; R61-G63 PolarHBondContact O-N 3.4Å
62	H	66.9	Low	72.7	Confident	128 Å²	128	65 Å²	65	59%	0.593	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	41	-170.5	-62.9	-70.7	0	0	0	112.8	C58 S90 E92	C58-H62 PolarHBondContact O-N 2.95Å; H62-S90 PolarHBondContact CE1-O 2.82Å; H62-E92 IonicContact CE1-OE1 3.6Å; H62-E92 IonicContact ND1-OE1 3.26Å; H62-E92 PolarHBondContact ND1-OE1 3.27Å
63	G	60.8	Low	72.7	Confident	21 Å²	21	66 Å²	66	22%	0.216	36%	0.361	C	S	.	.			trans	-79.4	138.7	-175.1	0	0	0	0	0	112.3	C58 R61 E65 F66	C58-G63 PolarHBondContact O-N 3.1Å; R61-G63 PolarHBondContact O-N 3.4Å; G63-E65 PolarHBondContact O-N 3Å; G63-F66 WeakPolarHBondContact O-CD1 3.49Å; G63-F66 VanDerWaalsContact O-CE1 3.25Å; G63-F66 WeakPolarHBondContact O-CE1 3.49Å
64	P	54.9	Low	72.6	Confident	136 Å²	136	60.5 Å²	60.5	88%	0.883	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	16.9	-176.4	31.2	-36.6	0	0	0	115
65	E	60.3	Low	72.6	Confident	165 Å²	165	62 Å²	62	77%	0.771	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-2.6	-165.4	-64.4	-171.1	172.8	0	0	114.9	G63	G63-E65 PolarHBondContact O-N 3Å
66	F	63.1	Low	72.7	Confident	37 Å²	37	63.6 Å²	63.6	16%	0.162	37%	0.371	C	S	.	.			trans	-116.1	128.8	179.4	64.1	-87.1	0	0	0	112.1	C58 F59 G63 E92	C58-F66 HydrophobicContact CB-CD1 4.09Å; C58-F66 HydrophobicContact CB-CE1 4.45Å; F59-F66 HydrophobicContact CD1-CE1 4.34Å; F59-F66 AromaticContact CD1-CE2 3.98Å; F59-F66 HydrophobicContact CD1-CE2 3.98Å; F59-F66 AromaticContact CD1-CZ 3.78Å; F59-F66 HydrophobicContact CD1-CZ 3.78Å; F59-F66 HydrophobicContact CE1-CD2 4.22Å; F59-F66 AromaticContact CE1-CE2 3.7Å; F59-F66 HydrophobicContact CE1-CE2 3.7Å; F59-F66 HydrophobicContact CE1-CZ 4.01Å; G63-F66 WeakPolarHBondContact O-CD1 3.49Å; G63-F66 VanDerWaalsContact O-CE1 3.25Å; G63-F66 WeakPolarHBondContact O-CE1 3.49Å; F66-E92 HydrophobicContact CZ-CG 4.13Å
67	G	65	Low	72.8	Confident	66 Å²	66	66.7 Å²	66.7	68%	0.68	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-90.2	127.6	167.9	0	0	0	0	0	110.3
68	L	70.1	Confident	73	Confident	57 Å²	57	69.6 Å²	69.6	30%	0.298	39%	0.39	S	S	.	.	S	Bend	trans	-76.4	144.5	160.7	-65.3	170.2	0	0	0	108.3	I70 L87	L68-I70 HydrophobicContact CD2-CD1 3.89Å; L68-I70 HydrophobicContact CD2-CG1 4.12Å; L68-L87 HydrophobicContact CD2-CD2 4.35Å
69	P	72.2	Confident	73.3	Confident	61 Å²	61	71.2 Å²	71.2	40%	0.396	40%	0.397	S	S	.	.	P	Polyproline II helix	cis	-85.5	148.3	9	33.4	-35	0	0	0	114.2	C102 E104	P69-C102 WeakPolarHBondContact CA-O 3.34Å; P69-E104 HydrophobicContact CB-CB 4.14Å; P69-E104 HydrophobicContact CG-CB 4.23Å
70	I	77.2	Confident	73.7	Confident	24 Å²	24	71.3 Å²	71.3	12%	0.123	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.1	172.7	-65.4	155.4	0	0	0	109	L55 F59 L68 V72 L83 C102 I103 E104	L55-I70 HydrophobicContact CD1-CD1 4.33Å; L55-I70 HydrophobicContact CD2-CD1 4.13Å; L55-I70 HydrophobicContact CD2-CG2 4.42Å; F59-I70 HydrophobicContact CE1-CD1 4.19Å; F59-I70 HydrophobicContact CE2-CD1 4.3Å; F59-I70 HydrophobicContact CZ-CD1 3.43Å; F59-I70 VanDerWaalsContact CZ-CD1 3.43Å; L68-I70 HydrophobicContact CD2-CD1 3.89Å; L68-I70 HydrophobicContact CD2-CG1 4.12Å; I70-V72 HydrophobicContact CG2-CG2 4.1Å; I70-V72 PolarHBondContact O-N 3.29Å; I70-L83 HydrophobicContact CG2-CD1 4.33Å; I70-C102 PolarHBondContact N-O 3.46Å; I70-I103 WeakPolarHBondContact O-CA 3.42Å; I70-E104 PolarHBondContact O-N 3.41Å
71	A	77.6	Confident	74.1	Confident	57 Å²	57	67.6 Å²	67.6	47%	0.471	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	121	177.6	0	0	0	0	0	111.5	E104 I106	A71-E104 CarbonylContact C-O 3.54Å; A71-E104 VanDerWaalsContact CA-O 3.3Å; A71-E104 WeakPolarHBondContact CA-O 3.43Å; A71-I106 HydrophobicContact CB-CD1 3.83Å; A71-I106 HydrophobicContact CB-CG1 4.35Å
72	V	79.3	Confident	74.6	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.018	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.4	-179.8	-177.7	0	0	0	0	109.7	I70 V74 L79 L83 I103 E104 L105 I106	I70-V72 HydrophobicContact CG2-CG2 4.1Å; I70-V72 PolarHBondContact O-N 3.29Å; V72-V74 PolarHBondContact O-N 2.93Å; V72-L79 HydrophobicContact CG1-CD2 4.16Å; V72-L79 HydrophobicContact CG1-CG 4.38Å; V72-L83 HydrophobicContact CG2-CD1 3.42Å; V72-L83 VanDerWaalsContact CG2-CD1 3.42Å; V72-I103 HydrophobicContact CB-CG2 4.08Å; V72-I103 HydrophobicContact CG2-CG2 3.87Å; V72-E104 PolarHBondContact N-O 3.35Å; V72-L105 WeakPolarHBondContact O-CA 3.15Å; V72-I106 PolarHBondContact O-N 3.16Å
73	V	78.7	Confident	75.3	Confident	71 Å²	71	52.4 Å²	52.4	43%	0.43	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.1	174.2	-172.6	0	0	0	0	109.3	S75 C76 I106	V73-S75 VanDerWaalsContact CG1-OG 3.3Å; V73-S75 WeakPolarHBondContact CG1-OG 3.14Å; V73-S75 PolarHBondContact O-N 3.06Å; V73-S75 VanDerWaalsContact O-N 3.07Å; V73-C76 WeakPolarHBondContact O-CB 3.32Å; V73-C76 PolarHBondContact O-N 3.37Å; V73-I106 WeakPolarHBondContact CA-O 3.35Å
74	V	77.3	Confident	76.3	Confident	13 Å²	13	51.4 Å²	51.4	8%	0.079	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.2	-174.3	178.7	0	0	0	0	113	V72 C76 L105 I106 Q108 T113	V72-V74 PolarHBondContact O-N 2.93Å; V74-C76 PolarHBondContact O-N 3.3Å; V74-C76 VanDerWaalsContact O-N 3.08Å; V74-L105 HydrophobicContact CG2-CB 3.88Å; V74-L105 HydrophobicContact CG2-CD2 4.28Å; V74-L105 HydrophobicContact CG2-CG 4.49Å; V74-I106 PolarHBondContact N-O 3.08Å; V74-Q108 WeakPolarHBondContact CG1-O 3.37Å; V74-T113 HydrophobicContact CG1-CG2 3.97Å
75	S	78.3	Confident	77.5	Confident	100 Å²	100	45 Å²	45	70%	0.699	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.1	176.6	58.6	0	0	0	0	114.3	V73 E77	V73-S75 VanDerWaalsContact CG1-OG 3.3Å; V73-S75 WeakPolarHBondContact CG1-OG 3.14Å; V73-S75 PolarHBondContact O-N 3.06Å; V73-S75 VanDerWaalsContact O-N 3.07Å; S75-E77 PolarHBondContact O-N 3.46Å
76	C	81.4	Confident	78.5	Confident	53 Å²	53	37.1 Å²	37.1	36%	0.358	23%	0.228	S	C	.	.			trans	-101.6	60.8	-174.4	-60.7	0	0	0	0	111.9	V73 V74 R78 L79 L80	V73-C76 WeakPolarHBondContact O-CB 3.32Å; V73-C76 PolarHBondContact O-N 3.37Å; V74-C76 PolarHBondContact O-N 3.3Å; V74-C76 VanDerWaalsContact O-N 3.08Å; C76-R78 PolarHBondContact O-N 3.22Å; C76-L79 HydrophobicContact CB-CB 3.79Å; C76-L79 HydrophobicContact CB-CD2 4.2Å; C76-L79 WeakPolarHBondContact O-CB 3.41Å; C76-L79 PolarHBondContact O-N 3.49Å; C76-L80 PolarHBondContact O-N 2.97Å
77	E	82.9	Confident	79.3	Confident	70 Å²	70	35.3 Å²	35.3	33%	0.327	22%	0.22	S	C	.	.	H	α-helix	trans	-55.1	-36.9	-178.7	-65.2	-174.5	162.5	0	0	113.2	S75 L80 L81 S110 F112	S75-E77 PolarHBondContact O-N 3.46Å; E77-L80 WeakPolarHBondContact O-CB 2.88Å; E77-L80 PolarHBondContact O-N 3.38Å; E77-L81 PolarHBondContact O-N 3.04Å; E77-S110 WeakPolarHBondContact OE1-CB 3.25Å; E77-S110 PolarHBondContact OE1-OG 3.22Å; E77-F112 HydrophobicContact CB-CD1 3.75Å; E77-F112 HydrophobicContact CB-CE1 3.83Å; E77-F112 HydrophobicContact CB-CG 4.47Å; E77-F112 HydrophobicContact CG-CB 4.47Å; E77-F112 HydrophobicContact CG-CD1 3.78Å; E77-F112 HydrophobicContact CG-CE1 4.38Å; E77-F112 HydrophobicContact CG-CG 4.32Å; E77-F112 WeakPolarHBondContact OE1-CB 3.41Å
78	R	82.5	Confident	79.9	Confident	98 Å²	98	32.6 Å²	32.6	37%	0.37	19%	0.19	S	C	.	.	H	α-helix	trans	-68.3	-39.9	177.6	-167.2	171.3	177.4	-146.5	-18.3	112.9	C76 L80 L81 V82 M139 F142 T145 L146	C76-R78 PolarHBondContact O-N 3.22Å; R78-L80 VanDerWaalsContact C-N 3.31Å; R78-L81 PolarHBondContact O-N 2.99Å; R78-V82 VanDerWaalsContact O-CG2 3.32Å; R78-V82 WeakPolarHBondContact O-CG2 3.49Å; R78-V82 PolarHBondContact O-N 2.83Å; R78-M139 HydrophobicContact CG-CE 4.48Å; R78-F142 HydrophobicContact CG-CD2 4.28Å; R78-F142 HydrophobicContact CG-CE2 3.96Å; R78-T145 PolarHBondContact NE-OG1 3.19Å; R78-T145 PolarHBondContact NH1-OG1 2.92Å; R78-T145 PolarHBondContact NH2-O 2.72Å; R78-T145 PolarHBondContact NH2-OG1 2.97Å; R78-L146 VanDerWaalsContact NH2-CA 3.26Å; R78-L146 VanDerWaalsContact NH2-N 3.11Å
79	L	83.6	Confident	80.2	Confident	59 Å²	59	31.1 Å²	31.1	31%	0.309	18%	0.182	S	C	.	.	H	α-helix	trans	-63.8	-42.4	173.6	177.1	62.9	0	0	0	109.7	I52 V72 C76 L81 V82 L83	I52-L79 HydrophobicContact CB-CD1 4.37Å; I52-L79 HydrophobicContact CD1-CD1 3.31Å; I52-L79 HydrophobicContact CG1-CD1 3.8Å; V72-L79 HydrophobicContact CG1-CD2 4.16Å; V72-L79 HydrophobicContact CG1-CG 4.38Å; C76-L79 HydrophobicContact CB-CB 3.79Å; C76-L79 HydrophobicContact CB-CD2 4.2Å; C76-L79 WeakPolarHBondContact O-CB 3.41Å; C76-L79 PolarHBondContact O-N 3.49Å; L79-L81 PolarHBondContact O-N 2.93Å; L79-V82 PolarHBondContact O-N 3.48Å; L79-L83 HydrophobicContact CD1-CD1 4.01Å; L79-L83 HydrophobicContact CD1-CG 4.09Å; L79-L83 HydrophobicContact CG-CD1 3.84Å; L79-L83 HydrophobicContact CG-CG 4.33Å; L79-L83 WeakPolarHBondContact O-CB 3.32Å; L79-L83 VanDerWaalsContact O-CG 3.24Å; L79-L83 WeakPolarHBondContact O-CG 3.41Å; L79-L83 PolarHBondContact O-N 3.39Å
80	L	85.5	Confident	80.4	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-46	175.7	-179	66.3	0	0	0	111.8	C76 E77 R78 L83 L84 F99 I103 L105 T113 M116	C76-L80 PolarHBondContact O-N 2.97Å; E77-L80 WeakPolarHBondContact O-CB 2.88Å; E77-L80 PolarHBondContact O-N 3.38Å; R78-L80 VanDerWaalsContact C-N 3.31Å; L80-L83 PolarHBondContact O-N 3.27Å; L80-L84 HydrophobicContact CD1-CD1 4.15Å; L80-L84 HydrophobicContact CD1-CG 4.18Å; L80-L84 HydrophobicContact CG-CD1 4.1Å; L80-L84 HydrophobicContact CG-CG 4.47Å; L80-L84 WeakPolarHBondContact O-CB 3.35Å; L80-L84 WeakPolarHBondContact O-CG 3.31Å; L80-L84 PolarHBondContact O-N 2.92Å; L80-F99 HydrophobicContact CD1-CE2 4.23Å; L80-F99 HydrophobicContact CD1-CZ 3.94Å; L80-F99 HydrophobicContact CD2-CZ 4.48Å; L80-I103 HydrophobicContact CD1-CD1 3.49Å; L80-I103 VanDerWaalsContact CD1-CD1 3.49Å; L80-I103 HydrophobicContact CD1-CG2 4.03Å; L80-L105 HydrophobicContact CD1-CD2 4.41Å; L80-T113 HydrophobicContact CD2-CG2 3.54Å; L80-M116 HydrophobicContact CG-CE 4.28Å
81	L	83.9	Confident	80.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-44.2	177.6	-174.1	65.3	0	0	0	112.3	E77 R78 L79 L85 F112 M116 M135 M139 F142	E77-L81 PolarHBondContact O-N 3.04Å; R78-L81 PolarHBondContact O-N 2.99Å; L79-L81 PolarHBondContact O-N 2.93Å; L81-L85 HydrophobicContact CD1-CD1 4.33Å; L81-L85 HydrophobicContact CD1-CG 4.39Å; L81-L85 HydrophobicContact CG-CD1 4.02Å; L81-L85 HydrophobicContact CG-CG 4.5Å; L81-L85 WeakPolarHBondContact O-CB 3.3Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.48Å; L81-L85 PolarHBondContact O-N 3.38Å; L81-F112 HydrophobicContact CB-CZ 4.45Å; L81-M116 HydrophobicContact CB-CE 3.9Å; L81-M116 HydrophobicContact CD1-CE 3.45Å; L81-M116 VanDerWaalsContact CD1-CE 3.45Å; L81-M116 HydrophobicContact CD1-SD 4.04Å; L81-M116 HydrophobicContact CG-CE 4.29Å; L81-M135 HydrophobicContact CD1-CB 3.96Å; L81-M135 HydrophobicContact CD1-CE 3.83Å; L81-M139 HydrophobicContact CB-CE 4.08Å; L81-M139 HydrophobicContact CD2-CB 4.39Å; L81-M139 HydrophobicContact CD2-CE 3.36Å; L81-M139 HydrophobicContact CG-CE 4.34Å; L81-F142 HydrophobicContact CB-CE2 4.22Å; L81-F142 HydrophobicContact CB-CZ 4.31Å; L81-F142 HydrophobicContact CD2-CD1 3.97Å; L81-F142 HydrophobicContact CD2-CD2 3.68Å; L81-F142 HydrophobicContact CD2-CE1 3.93Å; L81-F142 HydrophobicContact CD2-CE2 3.65Å; L81-F142 HydrophobicContact CD2-CG 3.84Å; L81-F142 HydrophobicContact CD2-CZ 3.76Å; L81-F142 HydrophobicContact CG-CE1 4.25Å; L81-F142 HydrophobicContact CG-CE2 4.07Å; L81-F142 HydrophobicContact CG-CZ 3.87Å
82	V	84.2	Confident	79.9	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.03	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-50.3	175.5	174.3	0	0	0	0	110.4	I52 R78 L79 L84 L85 F86 F142 L146 L150	I52-V82 HydrophobicContact CD1-CB 4.46Å; I52-V82 HydrophobicContact CD1-CG1 3.91Å; R78-V82 VanDerWaalsContact O-CG2 3.32Å; R78-V82 WeakPolarHBondContact O-CG2 3.49Å; R78-V82 PolarHBondContact O-N 2.83Å; L79-V82 PolarHBondContact O-N 3.48Å; V82-L84 PolarHBondContact O-N 3.32Å; V82-L85 PolarHBondContact O-N 2.99Å; V82-F86 HydrophobicContact CG1-CD2 3.6Å; V82-F86 HydrophobicContact CG1-CE2 3.84Å; V82-F86 VanDerWaalsContact O-CD2 3.27Å; V82-F86 WeakPolarHBondContact O-CD2 3.43Å; V82-F86 PolarHBondContact O-N 2.88Å; V82-F142 HydrophobicContact CG2-CE2 3.83Å; V82-F142 HydrophobicContact CG2-CZ 3.57Å; V82-L146 HydrophobicContact CG2-CD2 3.79Å; V82-L150 HydrophobicContact CG1-CD1 4.31Å
83	L	83	Confident	79.7	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-44.5	-178.3	-70	172.7	0	0	0	112.2	L55 F59 I70 V72 L79 L80 F86 L87 I103	L55-L83 HydrophobicContact CD2-CD2 3.43Å; L55-L83 VanDerWaalsContact CD2-CD2 3.43Å; F59-L83 HydrophobicContact CE2-CD2 4.1Å; I70-L83 HydrophobicContact CG2-CD1 4.33Å; V72-L83 HydrophobicContact CG2-CD1 3.42Å; V72-L83 VanDerWaalsContact CG2-CD1 3.42Å; L79-L83 HydrophobicContact CD1-CD1 4.01Å; L79-L83 HydrophobicContact CD1-CG 4.09Å; L79-L83 HydrophobicContact CG-CD1 3.84Å; L79-L83 HydrophobicContact CG-CG 4.33Å; L79-L83 WeakPolarHBondContact O-CB 3.32Å; L79-L83 VanDerWaalsContact O-CG 3.24Å; L79-L83 WeakPolarHBondContact O-CG 3.41Å; L79-L83 PolarHBondContact O-N 3.39Å; L80-L83 PolarHBondContact O-N 3.27Å; L83-F86 PolarHBondContact O-N 2.88Å; L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 VanDerWaalsContact O-CG 3.25Å; L83-L87 WeakPolarHBondContact O-CG 3.44Å; L83-L87 PolarHBondContact O-N 2.93Å; L83-I103 HydrophobicContact CB-CD1 4.46Å
84	L	82.3	Confident	79.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-42.1	176.9	-70.5	178	0	0	0	111.9	L80 V82 L87 V88 F99 I103 M116 F120 M135	L80-L84 HydrophobicContact CD1-CD1 4.15Å; L80-L84 HydrophobicContact CD1-CG 4.18Å; L80-L84 HydrophobicContact CG-CD1 4.1Å; L80-L84 HydrophobicContact CG-CG 4.47Å; L80-L84 WeakPolarHBondContact O-CB 3.35Å; L80-L84 WeakPolarHBondContact O-CG 3.31Å; L80-L84 PolarHBondContact O-N 2.92Å; V82-L84 PolarHBondContact O-N 3.32Å; L84-L87 HydrophobicContact CD2-CD1 4.35Å; L84-L87 PolarHBondContact O-N 2.94Å; L84-V88 WeakPolarHBondContact O-CG2 3.37Å; L84-V88 PolarHBondContact O-N 3.34Å; L84-F99 HydrophobicContact CD1-CD2 4.47Å; L84-F99 HydrophobicContact CD1-CE2 3.8Å; L84-F99 HydrophobicContact CD2-CD2 4.12Å; L84-F99 HydrophobicContact CD2-CE2 3.87Å; L84-F99 HydrophobicContact CG-CE2 4.36Å; L84-I103 HydrophobicContact CD2-CD1 3.43Å; L84-I103 VanDerWaalsContact CD2-CD1 3.43Å; L84-I103 HydrophobicContact CD2-CG1 4.38Å; L84-I103 HydrophobicContact CG-CD1 3.85Å; L84-M116 HydrophobicContact CD1-CB 4.33Å; L84-M116 HydrophobicContact CD1-CE 3.43Å; L84-M116 VanDerWaalsContact CD1-CE 3.43Å; L84-M116 HydrophobicContact CD1-SD 3.97Å; L84-F120 HydrophobicContact CB-CE2 3.81Å; L84-F120 HydrophobicContact CB-CZ 4.07Å; L84-F120 HydrophobicContact CD1-CD2 4.23Å; L84-F120 HydrophobicContact CD1-CE2 4.19Å; L84-F120 HydrophobicContact CD2-CD1 4.33Å; L84-F120 HydrophobicContact CD2-CD2 4.18Å; L84-F120 HydrophobicContact CD2-CE1 3.93Å; L84-F120 HydrophobicContact CD2-CE2 3.8Å; L84-F120 HydrophobicContact CD2-CG 4.44Å; L84-F120 HydrophobicContact CD2-CZ 3.64Å; L84-F120 HydrophobicContact CG-CE2 4.15Å; L84-F120 HydrophobicContact CG-CZ 4.37Å; L84-M135 HydrophobicContact CB-CE 3.4Å; L84-M135 VanDerWaalsContact CB-CE 3.4Å; L84-M135 HydrophobicContact CD1-CE 4.33Å
85	L	80.3	Confident	78.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-45.6	174.7	-76.8	169.8	0	0	0	111	L81 V82 V88 I89 I132 M135 L136 F142 I154	L81-L85 HydrophobicContact CD1-CD1 4.33Å; L81-L85 HydrophobicContact CD1-CG 4.39Å; L81-L85 HydrophobicContact CG-CD1 4.02Å; L81-L85 HydrophobicContact CG-CG 4.5Å; L81-L85 WeakPolarHBondContact O-CB 3.3Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.48Å; L81-L85 PolarHBondContact O-N 3.38Å; V82-L85 PolarHBondContact O-N 2.99Å; L85-V88 PolarHBondContact O-N 3.49Å; L85-I89 HydrophobicContact CB-CD1 4.43Å; L85-I89 WeakPolarHBondContact O-CB 3.19Å; L85-I89 WeakPolarHBondContact O-CD1 3.44Å; L85-I89 WeakPolarHBondContact O-CG1 3.36Å; L85-I89 PolarHBondContact O-N 3.25Å; L85-I132 HydrophobicContact CD2-CG1 4.4Å; L85-I132 HydrophobicContact CD2-CG2 4.17Å; L85-M135 HydrophobicContact CD2-CB 4.48Å; L85-M135 HydrophobicContact CD2-CE 4.04Å; L85-M135 HydrophobicContact CD2-SD 4.42Å; L85-M135 HydrophobicContact CG-CE 3.94Å; L85-L136 HydrophobicContact CD1-CD2 4.19Å; L85-F142 HydrophobicContact CD1-CD1 4.4Å; L85-F142 HydrophobicContact CD1-CE1 3.41Å; L85-F142 VanDerWaalsContact CD1-CE1 3.41Å; L85-F142 HydrophobicContact CD1-CZ 3.9Å; L85-I154 HydrophobicContact CD1-CD1 4.33Å
86	F	80.6	Confident	77.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-31.7	178.8	-85.2	-80.7	0	0	0	113.2	V56 F59 V82 L83 V88 I89 S90 L150 I153 I154	V56-F86 HydrophobicContact CG1-CD1 3.64Å; V56-F86 HydrophobicContact CG1-CE1 3.41Å; V56-F86 VanDerWaalsContact CG1-CE1 3.41Å; V56-F86 HydrophobicContact CG1-CE2 4.37Å; V56-F86 HydrophobicContact CG1-CG 4.21Å; V56-F86 HydrophobicContact CG1-CZ 3.83Å; V56-F86 HydrophobicContact CG2-CD1 4.31Å; V56-F86 HydrophobicContact CG2-CD2 4.03Å; V56-F86 HydrophobicContact CG2-CE2 4.33Å; V56-F86 HydrophobicContact CG2-CG 4.04Å; F59-F86 HydrophobicContact CD2-CB 4.23Å; V82-F86 HydrophobicContact CG1-CD2 3.6Å; V82-F86 HydrophobicContact CG1-CE2 3.84Å; V82-F86 VanDerWaalsContact O-CD2 3.27Å; V82-F86 WeakPolarHBondContact O-CD2 3.43Å; V82-F86 PolarHBondContact O-N 2.88Å; L83-F86 PolarHBondContact O-N 2.88Å; F86-V88 VanDerWaalsContact C-N 3.33Å; F86-I89 PolarHBondContact O-N 3.35Å; F86-S90 WeakPolarHBondContact O-CB 3.24Å; F86-S90 PolarHBondContact O-N 2.87Å; F86-S90 PolarHBondContact O-OG 2.82Å; F86-L150 HydrophobicContact CE2-CB 4.21Å; F86-L150 HydrophobicContact CE2-CD2 3.77Å; F86-L150 HydrophobicContact CE2-CG 4.49Å; F86-L150 HydrophobicContact CZ-CB 4.2Å; F86-L150 HydrophobicContact CZ-CD2 3.67Å; F86-I153 HydrophobicContact CE1-CB 4.05Å; F86-I153 HydrophobicContact CE1-CD1 3.93Å; F86-I153 HydrophobicContact CE1-CG2 3.71Å; F86-I153 HydrophobicContact CZ-CB 4.16Å; F86-I153 HydrophobicContact CZ-CD1 4.12Å; F86-I153 HydrophobicContact CZ-CG2 4.27Å; F86-I154 HydrophobicContact CE2-CD1 4.36Å; F86-I154 HydrophobicContact CE2-CG1 4.4Å; F86-I154 HydrophobicContact CZ-CG1 4.43Å
87	L	78.7	Confident	77.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-37.5	170.7	-78.7	165.7	0	0	0	111.9	F59 L68 L83 L84 S90 G91 E92 W93 C102 I103	F59-L87 HydrophobicContact CD1-CD2 4.46Å; F59-L87 HydrophobicContact CE1-CD2 3.56Å; F59-L87 HydrophobicContact CE1-CG 4.33Å; F59-L87 HydrophobicContact CZ-CD2 3.63Å; F59-L87 HydrophobicContact CZ-CG 3.97Å; L68-L87 HydrophobicContact CD2-CD2 4.35Å; L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 VanDerWaalsContact O-CG 3.25Å; L83-L87 WeakPolarHBondContact O-CG 3.44Å; L83-L87 PolarHBondContact O-N 2.93Å; L84-L87 HydrophobicContact CD2-CD1 4.35Å; L84-L87 PolarHBondContact O-N 2.94Å; L87-S90 PolarHBondContact O-OG 3.23Å; L87-G91 PolarHBondContact O-N 3.28Å; L87-E92 HydrophobicContact CD2-CB 4.12Å; L87-E92 PolarHBondContact O-N 3.37Å; L87-W93 HydrophobicContact CB-CB 4.35Å; L87-W93 PolarHBondContact O-N 3.24Å; L87-W93 VanDerWaalsContact O-N 3.1Å; L87-C102 HydrophobicContact CD1-CB 4.16Å; L87-I103 HydrophobicContact CD1-CD1 4.21Å; L87-I103 HydrophobicContact CD1-CG1 4.27Å
88	V	78	Confident	77.2	Confident	9 Å²	9	32.3 Å²	32.3	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-73.7	-43.7	174.6	179.1	0	0	0	0	111.3	L84 L85 F86 G91 W93 F120 L131 I132	L84-V88 WeakPolarHBondContact O-CG2 3.37Å; L84-V88 PolarHBondContact O-N 3.34Å; L85-V88 PolarHBondContact O-N 3.49Å; F86-V88 VanDerWaalsContact C-N 3.33Å; V88-G91 PolarHBondContact O-N 3.07Å; V88-W93 HydrophobicContact CG2-CE3 4.39Å; V88-F120 HydrophobicContact CG2-CE2 4Å; V88-F120 HydrophobicContact CG2-CZ 3.54Å; V88-L131 HydrophobicContact CG2-CD2 4.27Å; V88-I132 HydrophobicContact CG1-CD1 3.92Å; V88-I132 HydrophobicContact CG1-CG1 4.08Å
89	I	77.2	Confident	77.2	Confident	25 Å²	25	27.6 Å²	27.6	13%	0.128	18%	0.177	C	C	.	.	H	α-helix	trans	-67.6	-40.4	-178.4	-69.4	165.2	0	0	0	111.4	L85 F86 G91 I153 I154 Y157	L85-I89 HydrophobicContact CB-CD1 4.43Å; L85-I89 WeakPolarHBondContact O-CB 3.19Å; L85-I89 WeakPolarHBondContact O-CD1 3.44Å; L85-I89 WeakPolarHBondContact O-CG1 3.36Å; L85-I89 PolarHBondContact O-N 3.25Å; F86-I89 PolarHBondContact O-N 3.35Å; I89-G91 VanDerWaalsContact C-N 3.26Å; I89-G91 PolarHBondContact O-N 3.45Å; I89-I153 HydrophobicContact CG2-CG2 4.26Å; I89-I154 HydrophobicContact CD1-CB 4.49Å; I89-I154 HydrophobicContact CD1-CG1 3.92Å; I89-Y157 HydrophobicContact CB-CD2 4.31Å; I89-Y157 HydrophobicContact CB-CG 4.47Å; I89-Y157 HydrophobicContact CG1-CD1 4.02Å; I89-Y157 HydrophobicContact CG1-CD2 4.21Å; I89-Y157 HydrophobicContact CG1-CE1 4.42Å; I89-Y157 HydrophobicContact CG1-CG 3.9Å; I89-Y157 HydrophobicContact CG2-CD2 3.8Å; I89-Y157 HydrophobicContact CG2-CE2 4.43Å; I89-Y157 HydrophobicContact CG2-CG 4.09Å
90	S	75.3	Confident	76.9	Confident	11 Å²	11	28.9 Å²	28.9	8%	0.077	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.7	177.1	58.6	0	0	0	0	113.4	F59 H62 F86 L87 E92	F59-S90 WeakPolarHBondContact O-CB 3.35Å; H62-S90 PolarHBondContact CE1-O 2.82Å; F86-S90 WeakPolarHBondContact O-CB 3.24Å; F86-S90 PolarHBondContact O-N 2.87Å; F86-S90 PolarHBondContact O-OG 2.82Å; L87-S90 PolarHBondContact O-OG 3.23Å; S90-E92 PolarHBondContact O-N 3.34Å; S90-E92 WeakPolarHBondContact OG-CG 3.36Å
91	G	73.4	Confident	76.6	Confident	44 Å²	44	33.5 Å²	33.5	45%	0.454	21%	0.208	S	C	.	.	S	Bend	trans	73.4	5	-178	0	0	0	0	0	114.9	L87 V88 I89 W93	L87-G91 PolarHBondContact O-N 3.28Å; V88-G91 PolarHBondContact O-N 3.07Å; I89-G91 VanDerWaalsContact C-N 3.26Å; I89-G91 PolarHBondContact O-N 3.45Å; G91-W93 PolarHBondContact O-N 3.32Å
92	E	71.8	Confident	76.3	Confident	54 Å²	54	33.5 Å²	33.5	25%	0.252	21%	0.208	S	C	.	.			trans	-67.7	-24	174.2	-63.5	-63	154.9	0	0	111.8	F59 H62 F66 L87 S90	F59-E92 HydrophobicContact CD1-CG 4.16Å; H62-E92 IonicContact CE1-OE1 3.6Å; H62-E92 IonicContact ND1-OE1 3.26Å; H62-E92 PolarHBondContact ND1-OE1 3.27Å; F66-E92 HydrophobicContact CZ-CG 4.13Å; L87-E92 HydrophobicContact CD2-CB 4.12Å; L87-E92 PolarHBondContact O-N 3.37Å; S90-E92 PolarHBondContact O-N 3.34Å; S90-E92 WeakPolarHBondContact OG-CG 3.36Å
93	W	74	Confident	76.2	Confident	15 Å²	15	33.3 Å²	33.3	6%	0.057	21%	0.207	C	C	.	.	S	Bend	trans	-83.7	113.7	165.9	-179.8	76.7	0	0	0	111	L87 V88 G91 A95 M97 F120 C123 T128 L131	L87-W93 HydrophobicContact CB-CB 4.35Å; L87-W93 PolarHBondContact O-N 3.24Å; L87-W93 VanDerWaalsContact O-N 3.1Å; V88-W93 HydrophobicContact CG2-CE3 4.39Å; G91-W93 PolarHBondContact O-N 3.32Å; W93-A95 HydrophobicContact CH2-CB 4.16Å; W93-A95 HydrophobicContact CZ3-CB 4.38Å; W93-M97 PolarHBondContact NE1-O 3.28Å; W93-F120 HydrophobicContact CB-CE1 4.39Å; W93-F120 AromaticContact CD1-CD1 3.89Å; W93-F120 AromaticContact CD1-CE1 3.39Å; W93-F120 HydrophobicContact CD2-CD1 4.48Å; W93-F120 AromaticContact CD2-CE1 3.9Å; W93-F120 HydrophobicContact CD2-CE1 3.9Å; W93-F120 AromaticContact CE2-CD1 3.89Å; W93-F120 AromaticContact CE2-CE1 3.78Å; W93-F120 HydrophobicContact CG-CD1 4.44Å; W93-F120 AromaticContact CG-CE1 3.63Å; W93-F120 HydrophobicContact CG-CE1 3.63Å; W93-F120 HydrophobicContact CG-CZ 4.36Å; W93-F120 HydrophobicContact CZ2-CD1 4.41Å; W93-F120 AromaticContact NE1-CD1 3.5Å; W93-F120 AromaticContact NE1-CE1 3.46Å; W93-C123 HydrophobicContact CH2-CB 4.12Å; W93-T128 HydrophobicContact CZ3-CG2 4.35Å; W93-L131 HydrophobicContact CH2-CD2 4.37Å; W93-L131 HydrophobicContact CZ3-CD2 4.46Å
94	Q	67.1	Low	76.1	Confident	139 Å²	139	38.1 Å²	38.1	65%	0.65	23%	0.23	S	C	*	.			trans	-93.5	138.7	169.3	-63.4	-175.5	-11.3	0	0	110.5	G96 M97	Q94-G96 PolarHBondContact O-N 3.24Å; Q94-G96 VanDerWaalsContact O-N 3.08Å; Q94-M97 HydrophobicContact CB-CG 4.29Å; Q94-M97 HydrophobicContact CB-SD 4.29Å; Q94-M97 WeakPolarHBondContact O-CB 3.25Å; Q94-M97 WeakPolarHBondContact O-CG 3.47Å; Q94-M97 PolarHBondContact O-N 3.12Å
95	A	62.9	Low	76	Confident	46 Å²	46	40.2 Å²	40.2	38%	0.38	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	116.9	179.1	0	0	0	0	0	111.1	W93 P125	W93-A95 HydrophobicContact CH2-CB 4.16Å; W93-A95 HydrophobicContact CZ3-CB 4.38Å; A95-P125 HydrophobicContact CB-CB 3.53Å; A95-P125 HydrophobicContact CB-CG 4.06Å
96	G	65.7	Low	75.8	Confident	72 Å²	72	42.8 Å²	42.8	74%	0.742	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.4	-15.7	-173.9	0	0	0	0	0	114	Q94 S98	Q94-G96 PolarHBondContact O-N 3.24Å; Q94-G96 VanDerWaalsContact O-N 3.08Å; G96-S98 PolarHBondContact O-N 3.49Å
97	M	73.7	Confident	75.7	Confident	53 Å²	53	45.5 Å²	45.5	26%	0.261	28%	0.282	S	S	.	.			trans	-68.8	120.5	169	-65.2	-170.4	85.8	0	0	109.5	W93 Q94 L101	W93-M97 PolarHBondContact NE1-O 3.28Å; Q94-M97 HydrophobicContact CB-CG 4.29Å; Q94-M97 HydrophobicContact CB-SD 4.29Å; Q94-M97 WeakPolarHBondContact O-CB 3.25Å; Q94-M97 WeakPolarHBondContact O-CG 3.47Å; Q94-M97 PolarHBondContact O-N 3.12Å; M97-L101 HydrophobicContact CE-CB 4.45Å
98	S	77.3	Confident	75.6	Confident	43 Å²	43	54.3 Å²	54.3	30%	0.301	32%	0.323	S	S	.	.			trans	-65.6	145.3	175	63.2	0	0	0	0	110.2	G96 D100 L101 N121	G96-S98 PolarHBondContact O-N 3.49Å; S98-D100 PolarHBondContact O-N 2.61Å; S98-L101 WeakPolarHBondContact O-CB 3.17Å; S98-L101 PolarHBondContact O-N 3.49Å; S98-L101 WeakPolarHBondContact OG-CD1 3.38Å; S98-N121 WeakPolarHBondContact CA-OD1 3.32Å
99	F	81.7	Confident	75.5	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-46.2	-38.7	174.8	179.6	-86.6	0	0	0	113.1	L80 L84 L101 C102 I103 L105 K117 F120 N121	L80-F99 HydrophobicContact CD1-CE2 4.23Å; L80-F99 HydrophobicContact CD1-CZ 3.94Å; L80-F99 HydrophobicContact CD2-CZ 4.48Å; L84-F99 HydrophobicContact CD1-CD2 4.47Å; L84-F99 HydrophobicContact CD1-CE2 3.8Å; L84-F99 HydrophobicContact CD2-CD2 4.12Å; L84-F99 HydrophobicContact CD2-CE2 3.87Å; L84-F99 HydrophobicContact CG-CE2 4.36Å; F99-L101 VanDerWaalsContact C-N 3.26Å; F99-L101 PolarHBondContact O-N 2.83Å; F99-C102 PolarHBondContact O-N 2.91Å; F99-C102 VanDerWaalsContact O-N 3.08Å; F99-I103 HydrophobicContact CE1-CB 4.27Å; F99-I103 HydrophobicContact CE1-CG2 4.46Å; F99-I103 HydrophobicContact CE2-CD1 4.49Å; F99-I103 HydrophobicContact CZ-CB 4.19Å; F99-I103 HydrophobicContact CZ-CG2 4.27Å; F99-I103 PolarHBondContact O-N 3.3Å; F99-L105 HydrophobicContact CE1-CD1 3.76Å; F99-L105 HydrophobicContact CE1-CD2 4.47Å; F99-L105 HydrophobicContact CE1-CG 3.98Å; F99-L105 HydrophobicContact CZ-CD1 4.19Å; F99-L105 HydrophobicContact CZ-CD2 4.38Å; F99-L105 HydrophobicContact CZ-CG 4.37Å; F99-K117 HydrophobicContact CB-CG 4Å; F99-K117 HydrophobicContact CD1-CB 4.23Å; F99-K117 HydrophobicContact CD1-CD 3.91Å; F99-K117 HydrophobicContact CD1-CG 3.91Å; F99-K117 HydrophobicContact CD2-CB 4.42Å; F99-K117 HydrophobicContact CE1-CD 4.43Å; F99-K117 HydrophobicContact CG-CB 4.17Å; F99-K117 HydrophobicContact CG-CD 4.45Å; F99-K117 HydrophobicContact CG-CG 3.95Å; F99-F120 HydrophobicContact CD2-CB 4.25Å; F99-F120 HydrophobicContact CD2-CG 4.49Å; F99-N121 PolarHBondContact N-OD1 2.95Å
100	D	79	Confident	75.6	Confident	86 Å²	86	57.7 Å²	57.7	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-69.8	-16.9	-178.4	-62.1	-33.8	0	0	0	114.2	S98 K117	S98-D100 PolarHBondContact O-N 2.61Å; D100-K117 VanDerWaalsContact OD1-CE 3.29Å; D100-K117 WeakPolarHBondContact OD1-CE 3.36Å; D100-K117 IonicContact OD1-NZ 2.62Å; D100-K117 PolarHBondContact OD1-NZ 3.19Å; D100-K117 VanDerWaalsContact OD2-CE 3.3Å; D100-K117 WeakPolarHBondContact OD2-CE 3.44Å; D100-K117 IonicContact OD2-NZ 2.75Å; D100-K117 PolarHBondContact OD2-NZ 3.01Å
101	L	78.7	Confident	75.8	Confident	98 Å²	98	63.4 Å²	63.4	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-79.5	-27.6	171.7	-89.2	151.7	0	0	0	111.7	M97 S98 F99	M97-L101 HydrophobicContact CE-CB 4.45Å; S98-L101 WeakPolarHBondContact O-CB 3.17Å; S98-L101 PolarHBondContact O-N 3.49Å; S98-L101 WeakPolarHBondContact OG-CD1 3.38Å; F99-L101 VanDerWaalsContact C-N 3.26Å; F99-L101 PolarHBondContact O-N 2.83Å
102	C	77.3	Confident	76.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-95.2	-39.7	-175.6	-60.9	0	0	0	0	112.4	P69 I70 L87 F99	P69-C102 WeakPolarHBondContact CA-O 3.34Å; I70-C102 PolarHBondContact N-O 3.46Å; L87-C102 HydrophobicContact CD1-CB 4.16Å; F99-C102 PolarHBondContact O-N 2.91Å; F99-C102 VanDerWaalsContact O-N 3.08Å
103	I	82.2	Confident	76.6	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	125.3	-171.8	-59.7	-172.3	0	0	0	110.6	I70 V72 L80 L83 L84 L87 F99 L105	I70-I103 WeakPolarHBondContact O-CA 3.42Å; V72-I103 HydrophobicContact CB-CG2 4.08Å; V72-I103 HydrophobicContact CG2-CG2 3.87Å; L80-I103 HydrophobicContact CD1-CD1 3.49Å; L80-I103 VanDerWaalsContact CD1-CD1 3.49Å; L80-I103 HydrophobicContact CD1-CG2 4.03Å; L83-I103 HydrophobicContact CB-CD1 4.46Å; L84-I103 HydrophobicContact CD2-CD1 3.43Å; L84-I103 VanDerWaalsContact CD2-CD1 3.43Å; L84-I103 HydrophobicContact CD2-CG1 4.38Å; L84-I103 HydrophobicContact CG-CD1 3.85Å; L87-I103 HydrophobicContact CD1-CD1 4.21Å; L87-I103 HydrophobicContact CD1-CG1 4.27Å; F99-I103 HydrophobicContact CE1-CB 4.27Å; F99-I103 HydrophobicContact CE1-CG2 4.46Å; F99-I103 HydrophobicContact CE2-CD1 4.49Å; F99-I103 HydrophobicContact CZ-CB 4.19Å; F99-I103 HydrophobicContact CZ-CG2 4.27Å; F99-I103 PolarHBondContact O-N 3.3Å; I103-L105 HydrophobicContact CG2-CD2 4.08Å; I103-L105 HydrophobicContact CG2-CG 4.49Å
104	E	80.9	Confident	77	Confident	104 Å²	104	62 Å²	62	49%	0.486	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	116.3	170.7	-171.3	-178.3	169.3	0	0	109.1	P69 I70 A71 V72	P69-E104 HydrophobicContact CB-CB 4.14Å; P69-E104 HydrophobicContact CG-CB 4.23Å; I70-E104 PolarHBondContact O-N 3.41Å; A71-E104 CarbonylContact C-O 3.54Å; A71-E104 VanDerWaalsContact CA-O 3.3Å; A71-E104 WeakPolarHBondContact CA-O 3.43Å; V72-E104 PolarHBondContact N-O 3.35Å
105	L	80	Confident	77.7	Confident	44 Å²	44	58.8 Å²	58.8	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	118.9	-178.2	-69.7	175.5	0	0	0	111.2	V72 V74 L80 F99 I103	V72-L105 WeakPolarHBondContact O-CA 3.15Å; V74-L105 HydrophobicContact CG2-CB 3.88Å; V74-L105 HydrophobicContact CG2-CD2 4.28Å; V74-L105 HydrophobicContact CG2-CG 4.49Å; L80-L105 HydrophobicContact CD1-CD2 4.41Å; F99-L105 HydrophobicContact CE1-CD1 3.76Å; F99-L105 HydrophobicContact CE1-CD2 4.47Å; F99-L105 HydrophobicContact CE1-CG 3.98Å; F99-L105 HydrophobicContact CZ-CD1 4.19Å; F99-L105 HydrophobicContact CZ-CD2 4.38Å; F99-L105 HydrophobicContact CZ-CG 4.37Å; I103-L105 HydrophobicContact CG2-CD2 4.08Å; I103-L105 HydrophobicContact CG2-CG 4.49Å
106	I	77.1	Confident	78.5	Confident	53 Å²	53	56.6 Å²	56.6	27%	0.272	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	106.2	174.5	-56.6	175.5	0	0	0	109.2	Y44 A71 V72 V73 V74	Y44-I106 HydrophobicContact CE1-CD1 4.44Å; A71-I106 HydrophobicContact CB-CD1 3.83Å; A71-I106 HydrophobicContact CB-CG1 4.35Å; V72-I106 PolarHBondContact O-N 3.16Å; V73-I106 WeakPolarHBondContact CA-O 3.35Å; V74-I106 PolarHBondContact N-O 3.08Å
107	G	78	Confident	79.2	Confident	57 Å²	57	56 Å²	56	59%	0.588	31%	0.307	S	S	*	.	S	Bend	trans	128.7	-172.8	177.3	0	0	0	0	0	113.7
108	Q	77.1	Confident	79.5	Confident	185 Å²	185	61.7 Å²	61.7	86%	0.864	33%	0.326	S	S	*	.	S	Bend	trans	-81.6	125.8	173.3	-70.3	-173.5	-18.7	0	0	110.2	V74	V74-Q108 WeakPolarHBondContact CG1-O 3.37Å
109	P	75.7	Confident	79.4	Confident	73 Å²	73	61.6 Å²	61.6	47%	0.474	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-64.2	131.9	-176.1	25.4	-33.2	0	0	0	112.8	T113	P109-T113 WeakPolarHBondContact CA-OG1 3.45Å; P109-T113 WeakPolarHBondContact CB-OG1 3.2Å
110	S	78.6	Confident	79.2	Confident	32 Å²	32	61.7 Å²	61.7	22%	0.224	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-80.3	162.1	170.8	73.5	0	0	0	0	112.2	E77 F112 T113 N114	E77-S110 WeakPolarHBondContact OE1-CB 3.25Å; E77-S110 PolarHBondContact OE1-OG 3.22Å; S110-F112 PolarHBondContact O-N 2.71Å; S110-T113 PolarHBondContact N-OG1 2.9Å; S110-T113 PolarHBondContact O-N 2.99Å; S110-T113 PolarHBondContact O-OG1 3.12Å; S110-T113 PolarHBondContact OG-N 3.19Å; S110-N114 PolarHBondContact O-N 3.43Å; S110-N114 PolarHBondContact O-ND2 3.29Å
111	D	80.1	Confident	79.1	Confident	132 Å²	132	61.6 Å²	61.6	71%	0.706	32%	0.321	S	S	*	.	H	α-helix	trans	-56.3	-36.2	175.2	-73.6	-27.4	0	0	0	112.5	N114 N115	D111-N114 PolarHBondContact O-N 3.18Å; D111-N115 WeakPolarHBondContact O-CB 3.5Å; D111-N115 PolarHBondContact O-N 3.26Å; D111-N115 PolarHBondContact O-ND2 2.95Å
112	F	82	Confident	79	Confident	28 Å²	28	61.1 Å²	61.1	12%	0.123	33%	0.326	C	S	.	.	H	α-helix	trans	-60.3	-49.3	173.1	179.6	-92.6	0	0	0	111.4	E77 L81 S110 N114 N115 M116 L138 M139	E77-F112 HydrophobicContact CB-CD1 3.75Å; E77-F112 HydrophobicContact CB-CE1 3.83Å; E77-F112 HydrophobicContact CB-CG 4.47Å; E77-F112 HydrophobicContact CG-CB 4.47Å; E77-F112 HydrophobicContact CG-CD1 3.78Å; E77-F112 HydrophobicContact CG-CE1 4.38Å; E77-F112 HydrophobicContact CG-CG 4.32Å; E77-F112 WeakPolarHBondContact OE1-CB 3.41Å; L81-F112 HydrophobicContact CB-CZ 4.45Å; S110-F112 PolarHBondContact O-N 2.71Å; F112-N114 VanDerWaalsContact C-N 3.32Å; F112-N114 PolarHBondContact O-N 3.24Å; F112-N115 PolarHBondContact O-N 2.89Å; F112-M116 HydrophobicContact CD1-CG 4.21Å; F112-M116 HydrophobicContact CE1-CE 3.71Å; F112-M116 HydrophobicContact CE1-CG 3.88Å; F112-M116 HydrophobicContact CE1-SD 4.48Å; F112-M116 HydrophobicContact CZ-CE 3.8Å; F112-M116 HydrophobicContact CZ-CG 4.08Å; F112-M116 HydrophobicContact CZ-SD 4.32Å; F112-M116 WeakPolarHBondContact O-CB 3.07Å; F112-M116 WeakPolarHBondContact O-CG 3.27Å; F112-M116 PolarHBondContact O-N 3.05Å; F112-L138 HydrophobicContact CE2-CB 3.89Å; F112-L138 HydrophobicContact CE2-CD1 4.23Å; F112-M139 HydrophobicContact CE2-CG 4.43Å; F112-M139 HydrophobicContact CZ-CE 4.32Å
113	T	80.1	Confident	78.4	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-36.7	177.9	58.8	0	0	0	0	112.7	V74 L80 P109 S110 M116 K117	V74-T113 HydrophobicContact CG1-CG2 3.97Å; L80-T113 HydrophobicContact CD2-CG2 3.54Å; P109-T113 WeakPolarHBondContact CA-OG1 3.45Å; P109-T113 WeakPolarHBondContact CB-OG1 3.2Å; S110-T113 PolarHBondContact N-OG1 2.9Å; S110-T113 PolarHBondContact O-N 2.99Å; S110-T113 PolarHBondContact O-OG1 3.12Å; S110-T113 PolarHBondContact OG-N 3.19Å; T113-M116 PolarHBondContact O-N 3.05Å; T113-K117 VanDerWaalsContact O-CB 3.28Å; T113-K117 WeakPolarHBondContact O-CB 3.39Å; T113-K117 PolarHBondContact O-N 3.25Å
114	N	81.8	Confident	77.6	Confident	55 Å²	55	69.9 Å²	69.9	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-67.5	-41.2	175.5	-74.2	-38.1	0	0	0	112.2	S110 D111 F112 K117 R118	S110-N114 PolarHBondContact O-N 3.43Å; S110-N114 PolarHBondContact O-ND2 3.29Å; D111-N114 PolarHBondContact O-N 3.18Å; F112-N114 VanDerWaalsContact C-N 3.32Å; F112-N114 PolarHBondContact O-N 3.24Å; N114-K117 PolarHBondContact O-N 2.94Å; N114-R118 VanDerWaalsContact O-CG 3.3Å; N114-R118 WeakPolarHBondContact O-CG 3.49Å; N114-R118 PolarHBondContact O-N 3Å
115	N	81.4	Confident	76.5	Confident	70 Å²	70	69.5 Å²	69.5	37%	0.374	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-45.2	175	-76.7	-21	0	0	0	111.3	D111 F112 K117 R118 M119	D111-N115 WeakPolarHBondContact O-CB 3.5Å; D111-N115 PolarHBondContact O-N 3.26Å; D111-N115 PolarHBondContact O-ND2 2.95Å; F112-N115 PolarHBondContact O-N 2.89Å; N115-K117 PolarHBondContact O-N 3.21Å; N115-R118 PolarHBondContact O-N 2.99Å; N115-M119 WeakPolarHBondContact O-CB 3.22Å; N115-M119 WeakPolarHBondContact O-CG 3.44Å; N115-M119 PolarHBondContact O-N 3.03Å
116	M	80	Confident	75.4	Confident	1 Å²	1	77 Å²	77	1%	0.005	40%	0.404	C	S	.	.	H	α-helix	trans	-59.7	-46.4	174.8	-75.8	-92	-98.9	0	0	111.9	L80 L81 L84 F112 T113 R118 M119 F120 M135 L138	L80-M116 HydrophobicContact CG-CE 4.28Å; L81-M116 HydrophobicContact CB-CE 3.9Å; L81-M116 HydrophobicContact CD1-CE 3.45Å; L81-M116 VanDerWaalsContact CD1-CE 3.45Å; L81-M116 HydrophobicContact CD1-SD 4.04Å; L81-M116 HydrophobicContact CG-CE 4.29Å; L84-M116 HydrophobicContact CD1-CB 4.33Å; L84-M116 HydrophobicContact CD1-CE 3.43Å; L84-M116 VanDerWaalsContact CD1-CE 3.43Å; L84-M116 HydrophobicContact CD1-SD 3.97Å; F112-M116 HydrophobicContact CD1-CG 4.21Å; F112-M116 HydrophobicContact CE1-CE 3.71Å; F112-M116 HydrophobicContact CE1-CG 3.88Å; F112-M116 HydrophobicContact CE1-SD 4.48Å; F112-M116 HydrophobicContact CZ-CE 3.8Å; F112-M116 HydrophobicContact CZ-CG 4.08Å; F112-M116 HydrophobicContact CZ-SD 4.32Å; F112-M116 WeakPolarHBondContact O-CB 3.07Å; F112-M116 WeakPolarHBondContact O-CG 3.27Å; F112-M116 PolarHBondContact O-N 3.05Å; T113-M116 PolarHBondContact O-N 3.05Å; M116-R118 VanDerWaalsContact C-N 3.35Å; M116-R118 PolarHBondContact O-N 3.12Å; M116-M119 PolarHBondContact O-N 3.4Å; M116-F120 WeakPolarHBondContact O-CB 3.47Å; M116-F120 PolarHBondContact O-N 3.34Å; M116-M135 HydrophobicContact CE-CE 4.42Å; M116-M135 HydrophobicContact SD-CE 4.33Å; M116-M135 HydrophobicContact SD-CG 4.21Å; M116-L138 HydrophobicContact CG-CD1 4.09Å; M116-L138 HydrophobicContact SD-CD1 3.98Å
117	K	81	Confident	75	Confident	59 Å²	59	75.8 Å²	75.8	26%	0.257	40%	0.4	S	S	.	.	H	α-helix	trans	-60.6	-41.2	176.7	-177.9	166.7	178.2	167.2	0	112.2	F99 D100 T113 N114 N115 N121	F99-K117 HydrophobicContact CB-CG 4Å; F99-K117 HydrophobicContact CD1-CB 4.23Å; F99-K117 HydrophobicContact CD1-CD 3.91Å; F99-K117 HydrophobicContact CD1-CG 3.91Å; F99-K117 HydrophobicContact CD2-CB 4.42Å; F99-K117 HydrophobicContact CE1-CD 4.43Å; F99-K117 HydrophobicContact CG-CB 4.17Å; F99-K117 HydrophobicContact CG-CD 4.45Å; F99-K117 HydrophobicContact CG-CG 3.95Å; D100-K117 VanDerWaalsContact OD1-CE 3.29Å; D100-K117 WeakPolarHBondContact OD1-CE 3.36Å; D100-K117 IonicContact OD1-NZ 2.62Å; D100-K117 PolarHBondContact OD1-NZ 3.19Å; D100-K117 VanDerWaalsContact OD2-CE 3.3Å; D100-K117 WeakPolarHBondContact OD2-CE 3.44Å; D100-K117 IonicContact OD2-NZ 2.75Å; D100-K117 PolarHBondContact OD2-NZ 3.01Å; T113-K117 VanDerWaalsContact O-CB 3.28Å; T113-K117 WeakPolarHBondContact O-CB 3.39Å; T113-K117 PolarHBondContact O-N 3.25Å; N114-K117 PolarHBondContact O-N 2.94Å; N115-K117 PolarHBondContact O-N 3.21Å; K117-N121 WeakPolarHBondContact O-CB 3.43Å; K117-N121 VanDerWaalsContact O-CG 3.29Å; K117-N121 PolarHBondContact O-N 3.24Å; K117-N121 VanDerWaalsContact O-N 3.12Å; K117-N121 PolarHBondContact O-ND2 3.42Å
118	R	79.5	Confident	74.5	Confident	173 Å²	173	75.2 Å²	75.2	65%	0.653	39%	0.385	S	S	*	.	H	α-helix	trans	-64.3	-45.2	174.3	-73.7	174.2	-172.6	169.8	3.1	111.8	N114 N115 M116 S122	N114-R118 VanDerWaalsContact O-CG 3.3Å; N114-R118 WeakPolarHBondContact O-CG 3.49Å; N114-R118 PolarHBondContact O-N 3Å; N115-R118 PolarHBondContact O-N 2.99Å; M116-R118 VanDerWaalsContact C-N 3.35Å; M116-R118 PolarHBondContact O-N 3.12Å; R118-S122 VanDerWaalsContact O-CB 3.25Å; R118-S122 WeakPolarHBondContact O-CB 3.15Å; R118-S122 PolarHBondContact O-N 2.73Å; R118-S122 VanDerWaalsContact O-N 3.09Å; R118-S122 PolarHBondContact O-OG 3.18Å
119	M	75.3	Confident	73.9	Confident	40 Å²	40	67.6 Å²	67.6	20%	0.197	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-49.8	-180	-72.1	169.9	60.3	0	0	111.3	N115 M116 N121 S122 C123 L131 M135 L138	N115-M119 WeakPolarHBondContact O-CB 3.22Å; N115-M119 WeakPolarHBondContact O-CG 3.44Å; N115-M119 PolarHBondContact O-N 3.03Å; M116-M119 PolarHBondContact O-N 3.4Å; M119-N121 PolarHBondContact O-N 3.27Å; M119-S122 PolarHBondContact O-N 2.73Å; M119-S122 PolarHBondContact O-OG 2.91Å; M119-C123 PolarHBondContact O-N 3.01Å; M119-L131 HydrophobicContact CB-CD1 4.22Å; M119-M135 HydrophobicContact CE-CG 4.25Å; M119-L138 HydrophobicContact CE-CD1 4.22Å; M119-L138 HydrophobicContact SD-CD1 3.85Å
120	F	76.8	Confident	73.6	Confident	3 Å²	3	69.8 Å²	69.8	1%	0.013	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-45.2	179.5	-120.6	-106.1	0	0	0	112.6	L84 V88 W93 F99 M116 S122 L131 M135	L84-F120 HydrophobicContact CB-CE2 3.81Å; L84-F120 HydrophobicContact CB-CZ 4.07Å; L84-F120 HydrophobicContact CD1-CD2 4.23Å; L84-F120 HydrophobicContact CD1-CE2 4.19Å; L84-F120 HydrophobicContact CD2-CD1 4.33Å; L84-F120 HydrophobicContact CD2-CD2 4.18Å; L84-F120 HydrophobicContact CD2-CE1 3.93Å; L84-F120 HydrophobicContact CD2-CE2 3.8Å; L84-F120 HydrophobicContact CD2-CG 4.44Å; L84-F120 HydrophobicContact CD2-CZ 3.64Å; L84-F120 HydrophobicContact CG-CE2 4.15Å; L84-F120 HydrophobicContact CG-CZ 4.37Å; V88-F120 HydrophobicContact CG2-CE2 4Å; V88-F120 HydrophobicContact CG2-CZ 3.54Å; W93-F120 HydrophobicContact CB-CE1 4.39Å; W93-F120 AromaticContact CD1-CD1 3.89Å; W93-F120 AromaticContact CD1-CE1 3.39Å; W93-F120 HydrophobicContact CD2-CD1 4.48Å; W93-F120 AromaticContact CD2-CE1 3.9Å; W93-F120 HydrophobicContact CD2-CE1 3.9Å; W93-F120 AromaticContact CE2-CD1 3.89Å; W93-F120 AromaticContact CE2-CE1 3.78Å; W93-F120 HydrophobicContact CG-CD1 4.44Å; W93-F120 AromaticContact CG-CE1 3.63Å; W93-F120 HydrophobicContact CG-CE1 3.63Å; W93-F120 HydrophobicContact CG-CZ 4.36Å; W93-F120 HydrophobicContact CZ2-CD1 4.41Å; W93-F120 AromaticContact NE1-CD1 3.5Å; W93-F120 AromaticContact NE1-CE1 3.46Å; F99-F120 HydrophobicContact CD2-CB 4.25Å; F99-F120 HydrophobicContact CD2-CG 4.49Å; M116-F120 WeakPolarHBondContact O-CB 3.47Å; M116-F120 PolarHBondContact O-N 3.34Å; F120-S122 VanDerWaalsContact C-N 3.27Å; F120-S122 PolarHBondContact O-N 3.19Å; F120-L131 HydrophobicContact CD2-CD1 4.33Å; F120-L131 HydrophobicContact CD2-CD2 4.12Å; F120-L131 HydrophobicContact CE2-CD2 4.01Å; F120-M135 HydrophobicContact CD2-SD 4.33Å; F120-M135 HydrophobicContact CE2-CE 4.01Å; F120-M135 HydrophobicContact CE2-SD 3.82Å
121	N	78.3	Confident	73.4	Confident	83 Å²	83	68.4 Å²	68.4	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-70.4	-21	179.3	-71.7	-16.3	0	0	0	113.5	S98 F99 K117 M119	S98-N121 WeakPolarHBondContact CA-OD1 3.32Å; F99-N121 PolarHBondContact N-OD1 2.95Å; K117-N121 WeakPolarHBondContact O-CB 3.43Å; K117-N121 VanDerWaalsContact O-CG 3.29Å; K117-N121 PolarHBondContact O-N 3.24Å; K117-N121 VanDerWaalsContact O-N 3.12Å; K117-N121 PolarHBondContact O-ND2 3.42Å; M119-N121 PolarHBondContact O-N 3.27Å
122	S	75.2	Confident	73.1	Confident	89 Å²	89	62.3 Å²	62.3	62%	0.622	31%	0.311	S	S	*	.	H	α-helix	trans	-88.2	-11.8	-178	73.1	0	0	0	0	114.5	R118 M119 F120	R118-S122 VanDerWaalsContact O-CB 3.25Å; R118-S122 WeakPolarHBondContact O-CB 3.15Å; R118-S122 PolarHBondContact O-N 2.73Å; R118-S122 VanDerWaalsContact O-N 3.09Å; R118-S122 PolarHBondContact O-OG 3.18Å; M119-S122 PolarHBondContact O-N 2.73Å; M119-S122 PolarHBondContact O-OG 2.91Å; F120-S122 VanDerWaalsContact C-N 3.27Å; F120-S122 PolarHBondContact O-N 3.19Å
123	C	66	Low	72.4	Confident	26 Å²	26	63 Å²	63	18%	0.176	32%	0.315	C	S	.	.			trans	-80.6	135.2	-167.2	-105.5	0	0	0	0	114	W93 M119 S127 L131	W93-C123 HydrophobicContact CH2-CB 4.12Å; M119-C123 PolarHBondContact O-N 3.01Å; C123-S127 PolarHBondContact SG-OG 3.29Å; C123-S127 VanDerWaalsContact SG-OG 3.35Å; C123-L131 HydrophobicContact CB-CD2 4.2Å
124	K	64.1	Low	72	Confident	160 Å²	160	65.2 Å²	65.2	70%	0.696	33%	0.33	S	S	*	.			trans	-89.4	153	173.5	-69.1	-175.7	-179.8	-179.6	0	110	K126 S127	K124-K126 PolarHBondContact O-N 3.3Å; K124-S127 PolarHBondContact N-OG 2.69Å; K124-S127 PolarHBondContact O-N 3.03Å; K124-S127 PolarHBondContact O-OG 2.93Å
125	P	57.9	Low	71.6	Confident	95 Å²	95	62.6 Å²	62.6	62%	0.617	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-55.5	-27	-176.4	13.3	-26.4	0	0	0	115.4	A95 S127	A95-P125 HydrophobicContact CB-CB 3.53Å; A95-P125 HydrophobicContact CB-CG 4.06Å; P125-S127 VanDerWaalsContact C-N 3.34Å
126	K	58.7	Low	71.2	Confident	203 Å²	203	59.3 Å²	59.3	88%	0.883	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-85.5	2	179.7	-66.1	-173	176.8	-176.2	0	114.5	K124	K124-K126 PolarHBondContact O-N 3.3Å
127	S	67.2	Low	70.8	Confident	26 Å²	26	63.8 Å²	63.8	18%	0.182	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-116.3	25.3	-173.8	72.3	0	0	0	0	113.9	C123 K124 P125 T129 K130 L131	C123-S127 PolarHBondContact SG-OG 3.29Å; C123-S127 VanDerWaalsContact SG-OG 3.35Å; K124-S127 PolarHBondContact N-OG 2.69Å; K124-S127 PolarHBondContact O-N 3.03Å; K124-S127 PolarHBondContact O-OG 2.93Å; P125-S127 VanDerWaalsContact C-N 3.34Å; S127-T129 VanDerWaalsContact C-N 3.31Å; S127-T129 PolarHBondContact O-N 3.34Å; S127-K130 PolarHBondContact O-N 3.4Å; S127-L131 PolarHBondContact O-N 2.79Å
128	T	67.7	Low	70.3	Confident	46 Å²	46	64 Å²	64	28%	0.282	32%	0.323	S	S	.	.	H	α-helix	trans	-58.9	-41.6	179.6	47.9	0	0	0	0	112.1	W93 L131 I132	W93-T128 HydrophobicContact CZ3-CG2 4.35Å; T128-L131 WeakPolarHBondContact O-CB 3.48Å; T128-L131 PolarHBondContact O-N 3.48Å; T128-I132 WeakPolarHBondContact O-CG1 3.32Å; T128-I132 PolarHBondContact O-N 3.25Å
129	T	65.8	Low	69.8	Low	25 Å²	25	58 Å²	58	15%	0.153	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-44.8	176.2	48.3	0	0	0	0	112.3	S127 L131 I132 E133 A161 D163 L166	S127-T129 VanDerWaalsContact C-N 3.31Å; S127-T129 PolarHBondContact O-N 3.34Å; T129-L131 PolarHBondContact O-N 3.05Å; T129-I132 PolarHBondContact O-N 2.88Å; T129-E133 WeakPolarHBondContact O-CB 3.32Å; T129-E133 PolarHBondContact O-N 3.32Å; T129-A161 HydrophobicContact CG2-CB 4.48Å; T129-D163 HydrophobicContact CG2-CB 4.36Å; T129-L166 HydrophobicContact CG2-CD1 3.85Å
130	K	68.7	Low	69.4	Low	118 Å²	118	60.3 Å²	60.3	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-67.1	-33.4	175.4	-71.6	-174.9	177.8	-176.2	0	113.4	S127 S134	S127-K130 PolarHBondContact O-N 3.4Å; K130-S134 WeakPolarHBondContact O-CB 3.26Å; K130-S134 PolarHBondContact O-N 2.93Å; K130-S134 PolarHBondContact O-OG 3.09Å
131	L	74.5	Confident	69	Low	4 Å²	4	65.8 Å²	65.8	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-63.7	-48.5	174.1	-178.8	59.5	0	0	0	109.8	V88 W93 M119 F120 C123 S127 T128 T129 S134 M135	V88-L131 HydrophobicContact CG2-CD2 4.27Å; W93-L131 HydrophobicContact CH2-CD2 4.37Å; W93-L131 HydrophobicContact CZ3-CD2 4.46Å; M119-L131 HydrophobicContact CB-CD1 4.22Å; F120-L131 HydrophobicContact CD2-CD1 4.33Å; F120-L131 HydrophobicContact CD2-CD2 4.12Å; F120-L131 HydrophobicContact CE2-CD2 4.01Å; C123-L131 HydrophobicContact CB-CD2 4.2Å; S127-L131 PolarHBondContact O-N 2.79Å; T128-L131 WeakPolarHBondContact O-CB 3.48Å; T128-L131 PolarHBondContact O-N 3.48Å; T129-L131 PolarHBondContact O-N 3.05Å; L131-S134 PolarHBondContact O-N 3.28Å; L131-M135 HydrophobicContact CD1-CG 4.27Å; L131-M135 HydrophobicContact CD1-SD 4.13Å; L131-M135 HydrophobicContact CD2-SD 4.46Å; L131-M135 HydrophobicContact CG-CG 4.43Å; L131-M135 HydrophobicContact CG-SD 3.83Å; L131-M135 WeakPolarHBondContact O-CB 3.04Å; L131-M135 WeakPolarHBondContact O-CG 3.42Å; L131-M135 PolarHBondContact O-N 2.82Å
132	I	73.5	Confident	68.7	Low	3 Å²	3	62 Å²	62	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-46.6	176.4	-67	167.1	0	0	0	110.3	L85 V88 T128 T129 S134 M135 L136 Y157 L158	L85-I132 HydrophobicContact CD2-CG1 4.4Å; L85-I132 HydrophobicContact CD2-CG2 4.17Å; V88-I132 HydrophobicContact CG1-CD1 3.92Å; V88-I132 HydrophobicContact CG1-CG1 4.08Å; T128-I132 WeakPolarHBondContact O-CG1 3.32Å; T128-I132 PolarHBondContact O-N 3.25Å; T129-I132 PolarHBondContact O-N 2.88Å; I132-S134 VanDerWaalsContact C-N 3.33Å; I132-S134 PolarHBondContact O-N 2.78Å; I132-M135 PolarHBondContact O-N 3.41Å; I132-L136 HydrophobicContact CG2-CD1 3.53Å; I132-L136 HydrophobicContact CG2-CG 4.25Å; I132-L136 WeakPolarHBondContact O-CB 3.19Å; I132-L136 WeakPolarHBondContact O-CD1 3.22Å; I132-L136 WeakPolarHBondContact O-CG 3.27Å; I132-L136 PolarHBondContact O-N 3.04Å; I132-Y157 HydrophobicContact CD1-CD1 4.13Å; I132-Y157 HydrophobicContact CD1-CE1 3.45Å; I132-Y157 VanDerWaalsContact CD1-CE1 3.45Å; I132-L158 HydrophobicContact CG2-CD2 3.94Å
133	E	68.2	Low	68.3	Low	44 Å²	44	58 Å²	58	21%	0.206	30%	0.301	C	S	.	.	H	α-helix	trans	-54.3	-49.7	175.4	-163.7	-172.5	158.4	0	0	111.6	T129 M135 L136 Q137 L166 F169	T129-E133 WeakPolarHBondContact O-CB 3.32Å; T129-E133 PolarHBondContact O-N 3.32Å; E133-M135 VanDerWaalsContact C-N 3.35Å; E133-M135 PolarHBondContact O-N 3.45Å; E133-L136 PolarHBondContact O-N 3.34Å; E133-Q137 WeakPolarHBondContact O-CG 3.28Å; E133-Q137 PolarHBondContact O-N 3.22Å; E133-Q137 PolarHBondContact OE1-NE2 3.43Å; E133-L166 HydrophobicContact CB-CD2 3.63Å; E133-L166 HydrophobicContact CG-CD2 3.94Å; E133-F169 HydrophobicContact CG-CD2 3.71Å; E133-F169 HydrophobicContact CG-CE2 3.39Å; E133-F169 HydrophobicContact CG-CZ 4.19Å; E133-F169 WeakPolarHBondContact OE1-CE2 3.33Å
134	S	71.3	Confident	68.5	Low	46 Å²	46	62 Å²	62	32%	0.322	32%	0.321	S	S	.	.	H	α-helix	trans	-68.1	-36	-178.1	-53.8	0	0	0	0	111.6	K130 L131 I132 L138	K130-S134 WeakPolarHBondContact O-CB 3.26Å; K130-S134 PolarHBondContact O-N 2.93Å; K130-S134 PolarHBondContact O-OG 3.09Å; L131-S134 PolarHBondContact O-N 3.28Å; I132-S134 VanDerWaalsContact C-N 3.33Å; I132-S134 PolarHBondContact O-N 2.78Å; S134-L138 WeakPolarHBondContact O-CG 3.43Å
135	M	73.4	Confident	68.9	Low	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66	-38.9	175.4	-75.3	172.6	72.7	0	0	111.9	L81 L84 L85 M116 M119 F120 L131 I132 E133 L138	L81-M135 HydrophobicContact CD1-CB 3.96Å; L81-M135 HydrophobicContact CD1-CE 3.83Å; L84-M135 HydrophobicContact CB-CE 3.4Å; L84-M135 VanDerWaalsContact CB-CE 3.4Å; L84-M135 HydrophobicContact CD1-CE 4.33Å; L85-M135 HydrophobicContact CD2-CB 4.48Å; L85-M135 HydrophobicContact CD2-CE 4.04Å; L85-M135 HydrophobicContact CD2-SD 4.42Å; L85-M135 HydrophobicContact CG-CE 3.94Å; M116-M135 HydrophobicContact CE-CE 4.42Å; M116-M135 HydrophobicContact SD-CE 4.33Å; M116-M135 HydrophobicContact SD-CG 4.21Å; M119-M135 HydrophobicContact CE-CG 4.25Å; F120-M135 HydrophobicContact CD2-SD 4.33Å; F120-M135 HydrophobicContact CE2-CE 4.01Å; F120-M135 HydrophobicContact CE2-SD 3.82Å; L131-M135 HydrophobicContact CD1-CG 4.27Å; L131-M135 HydrophobicContact CD1-SD 4.13Å; L131-M135 HydrophobicContact CD2-SD 4.46Å; L131-M135 HydrophobicContact CG-CG 4.43Å; L131-M135 HydrophobicContact CG-SD 3.83Å; L131-M135 WeakPolarHBondContact O-CB 3.04Å; L131-M135 WeakPolarHBondContact O-CG 3.42Å; L131-M135 PolarHBondContact O-N 2.82Å; I132-M135 PolarHBondContact O-N 3.41Å; E133-M135 VanDerWaalsContact C-N 3.35Å; E133-M135 PolarHBondContact O-N 3.45Å; M135-L138 WeakPolarHBondContact O-CB 3.39Å; M135-L138 PolarHBondContact O-N 3.47Å
136	L	72.1	Confident	69.8	Low	1 Å²	1	54.4 Å²	54.4	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-74	-32.9	178.7	-67.6	164.4	0	0	0	112.4	L85 I132 E133 L138 M139 F142 Y143 L158	L85-L136 HydrophobicContact CD1-CD2 4.19Å; I132-L136 HydrophobicContact CG2-CD1 3.53Å; I132-L136 HydrophobicContact CG2-CG 4.25Å; I132-L136 WeakPolarHBondContact O-CB 3.19Å; I132-L136 WeakPolarHBondContact O-CD1 3.22Å; I132-L136 WeakPolarHBondContact O-CG 3.27Å; I132-L136 PolarHBondContact O-N 3.04Å; E133-L136 PolarHBondContact O-N 3.34Å; L136-L138 PolarHBondContact O-N 3.04Å; L136-M139 CarbonylContact O-C 3.54Å; L136-M139 PolarHBondContact O-N 3.33Å; L136-F142 HydrophobicContact CD2-CD1 4.14Å; L136-F142 HydrophobicContact CD2-CE1 4.5Å; L136-Y143 WeakPolarHBondContact CD1-OH 3.01Å; L136-Y143 HydrophobicContact CD2-CE1 4.15Å; L136-Y143 HydrophobicContact CD2-CE2 4.17Å; L136-Y143 VanDerWaalsContact CD2-OH 3.26Å; L136-Y143 WeakPolarHBondContact CD2-OH 3.29Å; L136-L158 HydrophobicContact CD1-CD1 4.35Å
137	Q	70.9	Confident	70.8	Confident	96 Å²	96	47 Å²	47	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-28.1	172.4	-77.4	175.5	16.1	0	0	113.1	E133 M139 F169	E133-Q137 WeakPolarHBondContact O-CG 3.28Å; E133-Q137 PolarHBondContact O-N 3.22Å; E133-Q137 PolarHBondContact OE1-NE2 3.43Å; Q137-M139 VanDerWaalsContact C-N 3.28Å; Q137-M139 PolarHBondContact O-N 3.31Å; Q137-F169 HydrophobicContact CB-CE1 4.45Å; Q137-F169 HydrophobicContact CG-CD1 4.44Å; Q137-F169 HydrophobicContact CG-CE1 3.34Å; Q137-F169 HydrophobicContact CG-CE2 4.24Å; Q137-F169 HydrophobicContact CG-CZ 3.23Å
138	L	70.9	Confident	71.2	Confident	63 Å²	63	50.4 Å²	50.4	33%	0.33	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.4	179.7	-66.9	169.2	0	0	0	113.1	F112 M116 M119 S134 M135 L136	F112-L138 HydrophobicContact CE2-CB 3.89Å; F112-L138 HydrophobicContact CE2-CD1 4.23Å; M116-L138 HydrophobicContact CG-CD1 4.09Å; M116-L138 HydrophobicContact SD-CD1 3.98Å; M119-L138 HydrophobicContact CE-CD1 4.22Å; M119-L138 HydrophobicContact SD-CD1 3.85Å; S134-L138 WeakPolarHBondContact O-CG 3.43Å; M135-L138 WeakPolarHBondContact O-CB 3.39Å; M135-L138 PolarHBondContact O-N 3.47Å; L136-L138 PolarHBondContact O-N 3.04Å
139	M	69.9	Low	71.7	Confident	47 Å²	47	50.5 Å²	50.5	23%	0.232	29%	0.292	C	S	.	.			trans	-140.6	89.3	173.3	-77.6	-159.3	-69.7	0	0	110.9	R78 L81 F112 L136 Q137 D141 F142	R78-M139 HydrophobicContact CG-CE 4.48Å; L81-M139 HydrophobicContact CB-CE 4.08Å; L81-M139 HydrophobicContact CD2-CB 4.39Å; L81-M139 HydrophobicContact CD2-CE 3.36Å; L81-M139 HydrophobicContact CG-CE 4.34Å; F112-M139 HydrophobicContact CE2-CG 4.43Å; F112-M139 HydrophobicContact CZ-CE 4.32Å; L136-M139 CarbonylContact O-C 3.54Å; L136-M139 PolarHBondContact O-N 3.33Å; Q137-M139 VanDerWaalsContact C-N 3.28Å; Q137-M139 PolarHBondContact O-N 3.31Å; M139-D141 VanDerWaalsContact C-N 3.27Å; M139-D141 PolarHBondContact O-N 2.85Å; M139-F142 HydrophobicContact CB-CB 3.9Å; M139-F142 HydrophobicContact CE-CD2 3.82Å; M139-F142 HydrophobicContact CE-CE2 4.27Å; M139-F142 WeakPolarHBondContact O-CB 3.21Å; M139-F142 PolarHBondContact O-N 3.1Å; M139-F142 VanDerWaalsContact O-N 3.11Å
140	P	66.1	Low	72.3	Confident	88 Å²	88	49.8 Å²	49.8	57%	0.571	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.3	-179.2	-21.7	31.9	0	0	0	113.7	F142	P140-F142 VanDerWaalsContact C-N 3.27Å; P140-F142 PolarHBondContact O-N 2.79Å
141	D	68.1	Low	72.6	Confident	118 Å²	118	45.3 Å²	45.3	63%	0.631	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	5	-178.9	-62.6	-39.5	0	0	0	113.7	M139 Y143 N144	M139-D141 VanDerWaalsContact C-N 3.27Å; M139-D141 PolarHBondContact O-N 2.85Å; D141-Y143 PolarHBondContact O-N 3.18Å; D141-N144 PolarHBondContact O-N 3.4Å
142	F	72.2	Confident	72.7	Confident	3 Å²	3	51.8 Å²	51.8	1%	0.013	30%	0.297	C	S	.	.	H	α-helix	trans	-56.8	-38.4	-176	179.2	-119.5	0	0	0	112.5	R78 L81 V82 L85 L136 M139 P140 T145 L146 I154	R78-F142 HydrophobicContact CG-CD2 4.28Å; R78-F142 HydrophobicContact CG-CE2 3.96Å; L81-F142 HydrophobicContact CB-CE2 4.22Å; L81-F142 HydrophobicContact CB-CZ 4.31Å; L81-F142 HydrophobicContact CD2-CD1 3.97Å; L81-F142 HydrophobicContact CD2-CD2 3.68Å; L81-F142 HydrophobicContact CD2-CE1 3.93Å; L81-F142 HydrophobicContact CD2-CE2 3.65Å; L81-F142 HydrophobicContact CD2-CG 3.84Å; L81-F142 HydrophobicContact CD2-CZ 3.76Å; L81-F142 HydrophobicContact CG-CE1 4.25Å; L81-F142 HydrophobicContact CG-CE2 4.07Å; L81-F142 HydrophobicContact CG-CZ 3.87Å; V82-F142 HydrophobicContact CG2-CE2 3.83Å; V82-F142 HydrophobicContact CG2-CZ 3.57Å; L85-F142 HydrophobicContact CD1-CD1 4.4Å; L85-F142 HydrophobicContact CD1-CE1 3.41Å; L85-F142 VanDerWaalsContact CD1-CE1 3.41Å; L85-F142 HydrophobicContact CD1-CZ 3.9Å; L136-F142 HydrophobicContact CD2-CD1 4.14Å; L136-F142 HydrophobicContact CD2-CE1 4.5Å; M139-F142 HydrophobicContact CB-CB 3.9Å; M139-F142 HydrophobicContact CE-CD2 3.82Å; M139-F142 HydrophobicContact CE-CE2 4.27Å; M139-F142 WeakPolarHBondContact O-CB 3.21Å; M139-F142 PolarHBondContact O-N 3.1Å; M139-F142 VanDerWaalsContact O-N 3.11Å; P140-F142 VanDerWaalsContact C-N 3.27Å; P140-F142 PolarHBondContact O-N 2.79Å; F142-T145 PolarHBondContact O-OG1 3.21Å; F142-L146 HydrophobicContact CD1-CD1 3.55Å; F142-L146 HydrophobicContact CD2-CD1 4.09Å; F142-L146 HydrophobicContact CE1-CD1 3.4Å; F142-L146 VanDerWaalsContact CE1-CD1 3.4Å; F142-L146 HydrophobicContact CE2-CD1 3.96Å; F142-L146 HydrophobicContact CE2-CD2 4.37Å; F142-L146 HydrophobicContact CE2-CG 4.34Å; F142-L146 HydrophobicContact CG-CD1 3.91Å; F142-L146 HydrophobicContact CZ-CD1 3.63Å; F142-L146 HydrophobicContact CZ-CD2 4.2Å; F142-L146 HydrophobicContact CZ-CG 4.33Å; F142-L146 VanDerWaalsContact O-CD1 3.23Å; F142-L146 WeakPolarHBondContact O-CD1 3.48Å; F142-L146 WeakPolarHBondContact O-CG 3.35Å; F142-I154 HydrophobicContact CE1-CD1 4.29Å
143	Y	67.9	Low	72.7	Confident	5 Å²	5	53.7 Å²	53.7	2%	0.02	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-42.4	-178.1	-63	-73.6	0	0	0	113.7	L136 D141 T145 L146 L151 I154 F173	L136-Y143 WeakPolarHBondContact CD1-OH 3.01Å; L136-Y143 HydrophobicContact CD2-CE1 4.15Å; L136-Y143 HydrophobicContact CD2-CE2 4.17Å; L136-Y143 VanDerWaalsContact CD2-OH 3.26Å; L136-Y143 WeakPolarHBondContact CD2-OH 3.29Å; D141-Y143 PolarHBondContact O-N 3.18Å; Y143-T145 PolarHBondContact O-N 3.5Å; Y143-T145 VanDerWaalsContact O-N 3.14Å; Y143-L146 PolarHBondContact O-N 3.41Å; Y143-L151 HydrophobicContact CD1-CD1 3.59Å; Y143-L151 HydrophobicContact CG-CD1 4.35Å; Y143-I154 HydrophobicContact CE1-CG2 4.28Å; Y143-F173 HydrophobicContact CD1-CE2 4.17Å; Y143-F173 HydrophobicContact CD1-CZ 4.17Å; Y143-F173 HydrophobicContact CG-CE2 4.21Å; Y143-F173 HydrophobicContact CG-CZ 4.19Å
144	N	69.1	Low	73	Confident	112 Å²	112	51.7 Å²	51.7	60%	0.599	30%	0.297	S	S	*	.	H	α-helix	trans	-67	-19	-173.8	-70.6	-25.8	0	0	0	113.4	D141	D141-N144 PolarHBondContact O-N 3.4Å
145	T	72.8	Confident	72.9	Confident	79 Å²	79	51.9 Å²	51.9	49%	0.485	29%	0.294	S	S	.	.	H	α-helix	trans	-105.3	-12.6	-173.6	57.2	0	0	0	0	113	R78 F142 Y143	R78-T145 PolarHBondContact NE-OG1 3.19Å; R78-T145 PolarHBondContact NH1-OG1 2.92Å; R78-T145 PolarHBondContact NH2-O 2.72Å; R78-T145 PolarHBondContact NH2-OG1 2.97Å; F142-T145 PolarHBondContact O-OG1 3.21Å; Y143-T145 PolarHBondContact O-N 3.5Å; Y143-T145 VanDerWaalsContact O-N 3.14Å
146	L	76.9	Confident	72.9	Confident	15 Å²	15	56.2 Å²	56.2	8%	0.079	32%	0.317	C	S	.	.	S	Bend	trans	-75.1	142	-173.8	-86.9	151.1	0	0	0	112.2	R78 V82 F142 Y143 S148 L150 L151 I154	R78-L146 VanDerWaalsContact NH2-CA 3.26Å; R78-L146 VanDerWaalsContact NH2-N 3.11Å; V82-L146 HydrophobicContact CG2-CD2 3.79Å; F142-L146 HydrophobicContact CD1-CD1 3.55Å; F142-L146 HydrophobicContact CD2-CD1 4.09Å; F142-L146 HydrophobicContact CE1-CD1 3.4Å; F142-L146 VanDerWaalsContact CE1-CD1 3.4Å; F142-L146 HydrophobicContact CE2-CD1 3.96Å; F142-L146 HydrophobicContact CE2-CD2 4.37Å; F142-L146 HydrophobicContact CE2-CG 4.34Å; F142-L146 HydrophobicContact CG-CD1 3.91Å; F142-L146 HydrophobicContact CZ-CD1 3.63Å; F142-L146 HydrophobicContact CZ-CD2 4.2Å; F142-L146 HydrophobicContact CZ-CG 4.33Å; F142-L146 VanDerWaalsContact O-CD1 3.23Å; F142-L146 WeakPolarHBondContact O-CD1 3.48Å; F142-L146 WeakPolarHBondContact O-CG 3.35Å; Y143-L146 PolarHBondContact O-N 3.41Å; L146-S148 PolarHBondContact O-N 3Å; L146-L150 HydrophobicContact CD2-CB 4.24Å; L146-L150 HydrophobicContact CD2-CD1 4.26Å; L146-L151 HydrophobicContact CB-CB 4.33Å; L146-L151 HydrophobicContact CB-CD1 4.36Å; L146-L151 HydrophobicContact CD1-CD1 4.31Å; L146-I154 HydrophobicContact CD1-CD1 4.36Å
147	P	80	Confident	72.8	Confident	48 Å²	48	59.5 Å²	59.5	31%	0.312	33%	0.33	S	S	.	.			trans	-53.5	132.9	166.4	-22	31.5	0	0	0	110.4	Y53 G149 L150 L151	Y53-P147 HydrophobicContact CE1-CB 4.22Å; Y53-P147 HydrophobicContact CE1-CG 4.21Å; Y53-P147 WeakPolarHBondContact OH-CG 3.36Å; P147-G149 PolarHBondContact O-N 3.25Å; P147-G149 VanDerWaalsContact O-N 3.07Å; P147-L150 HydrophobicContact CG-CD1 4.27Å; P147-L150 PolarHBondContact O-N 2.95Å; P147-L151 PolarHBondContact O-N 3.26Å; P147-L151 VanDerWaalsContact O-N 3.1Å
148	S	76.1	Confident	72.6	Confident	98 Å²	98	55.5 Å²	55.5	69%	0.685	31%	0.312	S	S	*	.	H	α-helix	trans	-52.8	-34.8	-174.3	53	0	0	0	0	113.7	L146 L151 F152	L146-S148 PolarHBondContact O-N 3Å; S148-L151 PolarHBondContact O-N 3.45Å; S148-F152 WeakPolarHBondContact O-CB 3.23Å; S148-F152 PolarHBondContact O-N 2.99Å
149	G	76.9	Confident	72.2	Confident	47 Å²	47	60.7 Å²	60.7	49%	0.485	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.8	0	0	0	0	0	114.1	P147 I153	P147-G149 PolarHBondContact O-N 3.25Å; P147-G149 VanDerWaalsContact O-N 3.07Å; G149-I153 WeakPolarHBondContact O-CD1 3.23Å; G149-I153 WeakPolarHBondContact O-CG1 3.44Å
150	L	78.7	Confident	72	Confident	10 Å²	10	64.1 Å²	64.1	5%	0.052	35%	0.347	C	S	.	.	H	α-helix	trans	-72.7	-39.6	176	-64.6	177.6	0	0	0	111	Y53 V56 V82 F86 L146 P147 I153 I154	Y53-L150 HydrophobicContact CE1-CD1 4.12Å; Y53-L150 HydrophobicContact CE1-CG 4.25Å; V56-L150 HydrophobicContact CB-CD2 4.1Å; V56-L150 HydrophobicContact CG1-CD2 3.7Å; V56-L150 HydrophobicContact CG2-CD2 3.91Å; V82-L150 HydrophobicContact CG1-CD1 4.31Å; F86-L150 HydrophobicContact CE2-CB 4.21Å; F86-L150 HydrophobicContact CE2-CD2 3.77Å; F86-L150 HydrophobicContact CE2-CG 4.49Å; F86-L150 HydrophobicContact CZ-CB 4.2Å; F86-L150 HydrophobicContact CZ-CD2 3.67Å; L146-L150 HydrophobicContact CD2-CB 4.24Å; L146-L150 HydrophobicContact CD2-CD1 4.26Å; P147-L150 HydrophobicContact CG-CD1 4.27Å; P147-L150 PolarHBondContact O-N 2.95Å; L150-I153 PolarHBondContact O-N 2.86Å; L150-I154 WeakPolarHBondContact O-CG1 3.43Å; L150-I154 PolarHBondContact O-N 3.13Å
151	L	75.7	Confident	71.6	Confident	24 Å²	24	61.1 Å²	61.1	13%	0.126	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-45.5	178.8	-171.7	63.5	0	0	0	111.9	Y143 L146 P147 S148 I153 I154 I155 F173	Y143-L151 HydrophobicContact CD1-CD1 3.59Å; Y143-L151 HydrophobicContact CG-CD1 4.35Å; L146-L151 HydrophobicContact CB-CB 4.33Å; L146-L151 HydrophobicContact CB-CD1 4.36Å; L146-L151 HydrophobicContact CD1-CD1 4.31Å; P147-L151 PolarHBondContact O-N 3.26Å; P147-L151 VanDerWaalsContact O-N 3.1Å; S148-L151 PolarHBondContact O-N 3.45Å; L151-I153 VanDerWaalsContact C-N 3.27Å; L151-I153 PolarHBondContact O-N 3.28Å; L151-I154 PolarHBondContact O-N 2.97Å; L151-I155 HydrophobicContact CD1-CD1 4.32Å; L151-I155 HydrophobicContact CD2-CD1 4.38Å; L151-I155 HydrophobicContact CG-CD1 3.83Å; L151-I155 HydrophobicContact CG-CG1 4.45Å; L151-I155 WeakPolarHBondContact O-CG1 3.17Å; L151-I155 PolarHBondContact O-N 3.24Å; L151-F173 HydrophobicContact CD1-CZ 4.05Å; L151-F173 HydrophobicContact CD2-CE1 4.01Å; L151-F173 HydrophobicContact CD2-CZ 3.99Å; L151-F173 HydrophobicContact CG-CZ 4.29Å
152	F	75.5	Confident	70.7	Confident	141 Å²	141	64.3 Å²	64.3	62%	0.618	34%	0.338	S	S	*	.	H	α-helix	trans	-57.2	-40.4	179.7	-177.4	-100.1	0	0	0	112.2	S148 I155 N156	S148-F152 WeakPolarHBondContact O-CB 3.23Å; S148-F152 PolarHBondContact O-N 2.99Å; F152-I155 PolarHBondContact O-N 3.08Å; F152-N156 VanDerWaalsContact O-CB 3.27Å; F152-N156 WeakPolarHBondContact O-CB 3.44Å; F152-N156 PolarHBondContact O-N 3.42Å
153	I	74.7	Confident	69.6	Low	42 Å²	42	69 Å²	69	22%	0.215	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-42.3	179.8	-61.5	156.5	0	0	0	111.2	L60 F86 I89 G149 L150 L151 N156 Y157	L60-I153 HydrophobicContact CD1-CD1 3.55Å; L60-I153 HydrophobicContact CD2-CG2 4.12Å; F86-I153 HydrophobicContact CE1-CB 4.05Å; F86-I153 HydrophobicContact CE1-CD1 3.93Å; F86-I153 HydrophobicContact CE1-CG2 3.71Å; F86-I153 HydrophobicContact CZ-CB 4.16Å; F86-I153 HydrophobicContact CZ-CD1 4.12Å; F86-I153 HydrophobicContact CZ-CG2 4.27Å; I89-I153 HydrophobicContact CG2-CG2 4.26Å; G149-I153 WeakPolarHBondContact O-CD1 3.23Å; G149-I153 WeakPolarHBondContact O-CG1 3.44Å; L150-I153 PolarHBondContact O-N 2.86Å; L151-I153 VanDerWaalsContact C-N 3.27Å; L151-I153 PolarHBondContact O-N 3.28Å; I153-N156 PolarHBondContact O-N 3.23Å; I153-Y157 WeakPolarHBondContact O-CB 3.37Å; I153-Y157 PolarHBondContact O-N 3.39Å
154	I	73.1	Confident	68.8	Low	2 Å²	2	74.7 Å²	74.7	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-63.4	-45.9	177.1	-62.8	167.9	0	0	0	110.1	L85 F86 I89 F142 Y143 L146 L150 L151 Y157 L158	L85-I154 HydrophobicContact CD1-CD1 4.33Å; F86-I154 HydrophobicContact CE2-CD1 4.36Å; F86-I154 HydrophobicContact CE2-CG1 4.4Å; F86-I154 HydrophobicContact CZ-CG1 4.43Å; I89-I154 HydrophobicContact CD1-CB 4.49Å; I89-I154 HydrophobicContact CD1-CG1 3.92Å; F142-I154 HydrophobicContact CE1-CD1 4.29Å; Y143-I154 HydrophobicContact CE1-CG2 4.28Å; L146-I154 HydrophobicContact CD1-CD1 4.36Å; L150-I154 WeakPolarHBondContact O-CG1 3.43Å; L150-I154 PolarHBondContact O-N 3.13Å; L151-I154 PolarHBondContact O-N 2.97Å; I154-Y157 PolarHBondContact O-N 3.08Å; I154-L158 HydrophobicContact CG2-CD1 3.99Å; I154-L158 HydrophobicContact CG2-CG 4.47Å; I154-L158 VanDerWaalsContact O-CG 3.3Å; I154-L158 WeakPolarHBondContact O-CG 3.36Å; I154-L158 PolarHBondContact O-N 3.28Å
155	I	69.9	Low	67.9	Low	50 Å²	50	75.7 Å²	75.7	26%	0.256	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-44.6	178.2	-67.5	172.1	0	0	0	110.7	L151 F152 Y157 L158 Y159 L170 F173	L151-I155 HydrophobicContact CD1-CD1 4.32Å; L151-I155 HydrophobicContact CD2-CD1 4.38Å; L151-I155 HydrophobicContact CG-CD1 3.83Å; L151-I155 HydrophobicContact CG-CG1 4.45Å; L151-I155 WeakPolarHBondContact O-CG1 3.17Å; L151-I155 PolarHBondContact O-N 3.24Å; F152-I155 PolarHBondContact O-N 3.08Å; I155-Y157 VanDerWaalsContact C-N 3.33Å; I155-Y157 PolarHBondContact O-N 2.69Å; I155-L158 PolarHBondContact O-N 2.93Å; I155-Y159 WeakPolarHBondContact O-CB 3.5Å; I155-Y159 PolarHBondContact O-N 3.4Å; I155-L170 HydrophobicContact CG1-CD2 4.47Å; I155-L170 HydrophobicContact CG2-CD2 4.26Å; I155-F173 HydrophobicContact CD1-CE1 4.3Å; I155-F173 HydrophobicContact CD1-CE2 3.91Å; I155-F173 HydrophobicContact CD1-CZ 3.69Å; I155-F173 HydrophobicContact CG1-CE2 4.36Å; I155-F173 HydrophobicContact CG1-CZ 4.48Å
156	N	73.3	Confident	66.7	Low	91 Å²	91	72.3 Å²	72.3	49%	0.487	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-38.9	-179.8	-162.1	32	0	0	0	111.6	F152 I153 Y159 D160	F152-N156 VanDerWaalsContact O-CB 3.27Å; F152-N156 WeakPolarHBondContact O-CB 3.44Å; F152-N156 PolarHBondContact O-N 3.42Å; I153-N156 PolarHBondContact O-N 3.23Å; N156-Y159 PolarHBondContact O-N 2.71Å; N156-D160 WeakPolarHBondContact O-CB 3.5Å; N156-D160 PolarHBondContact O-N 3.15Å
157	Y	69.5	Low	65.3	Low	70 Å²	70	76.8 Å²	76.8	28%	0.275	39%	0.387	S	S	.	.	H	α-helix	trans	-64.8	-43.2	173	-175.4	-89.1	0	0	0	112.2	I89 I132 I153 I154 I155 Y159 D160 A161	I89-Y157 HydrophobicContact CB-CD2 4.31Å; I89-Y157 HydrophobicContact CB-CG 4.47Å; I89-Y157 HydrophobicContact CG1-CD1 4.02Å; I89-Y157 HydrophobicContact CG1-CD2 4.21Å; I89-Y157 HydrophobicContact CG1-CE1 4.42Å; I89-Y157 HydrophobicContact CG1-CG 3.9Å; I89-Y157 HydrophobicContact CG2-CD2 3.8Å; I89-Y157 HydrophobicContact CG2-CE2 4.43Å; I89-Y157 HydrophobicContact CG2-CG 4.09Å; I132-Y157 HydrophobicContact CD1-CD1 4.13Å; I132-Y157 HydrophobicContact CD1-CE1 3.45Å; I132-Y157 VanDerWaalsContact CD1-CE1 3.45Å; I153-Y157 WeakPolarHBondContact O-CB 3.37Å; I153-Y157 PolarHBondContact O-N 3.39Å; I154-Y157 PolarHBondContact O-N 3.08Å; I155-Y157 VanDerWaalsContact C-N 3.33Å; I155-Y157 PolarHBondContact O-N 2.69Å; Y157-Y159 VanDerWaalsContact C-N 3.27Å; Y157-Y159 PolarHBondContact O-N 3.08Å; Y157-D160 PolarHBondContact O-N 3.32Å; Y157-A161 HydrophobicContact CE1-CB 4.42Å; Y157-A161 VanDerWaalsContact O-CB 3.22Å; Y157-A161 WeakPolarHBondContact O-CB 3.21Å; Y157-A161 PolarHBondContact O-N 3.41Å
158	L	66.5	Low	63.8	Low	12 Å²	12	78.1 Å²	78.1	6%	0.063	40%	0.396	C	S	.	.	H	α-helix	trans	-64.7	-32.4	176.3	-71.6	171.5	0	0	0	112.3	I132 L136 I154 I155 L166 L170	I132-L158 HydrophobicContact CG2-CD2 3.94Å; L136-L158 HydrophobicContact CD1-CD1 4.35Å; I154-L158 HydrophobicContact CG2-CD1 3.99Å; I154-L158 HydrophobicContact CG2-CG 4.47Å; I154-L158 VanDerWaalsContact O-CG 3.3Å; I154-L158 WeakPolarHBondContact O-CG 3.36Å; I154-L158 PolarHBondContact O-N 3.28Å; I155-L158 PolarHBondContact O-N 2.93Å; L158-L166 HydrophobicContact CD2-CD1 4.1Å; L158-L166 HydrophobicContact CD2-CD2 4.4Å; L158-L170 HydrophobicContact CB-CD1 4.38Å; L158-L170 HydrophobicContact CD1-CD2 4.38Å
159	Y	64.4	Low	62.4	Low	173 Å²	173	75.7 Å²	75.7	68%	0.678	37%	0.373	S	S	*	.	H	α-helix	trans	-72.6	-39.2	176.3	-164.3	-92.8	0	0	0	112.2	I155 N156 Y157	I155-Y159 WeakPolarHBondContact O-CB 3.5Å; I155-Y159 PolarHBondContact O-N 3.4Å; N156-Y159 PolarHBondContact O-N 2.71Å; Y157-Y159 VanDerWaalsContact C-N 3.27Å; Y157-Y159 PolarHBondContact O-N 3.08Å
160	D	64	Low	61.1	Low	119 Å²	119	75.1 Å²	75.1	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-82.7	-23.6	-179.8	-160.5	31.2	0	0	0	113.3	N156 Y157 K162	N156-D160 WeakPolarHBondContact O-CB 3.5Å; N156-D160 PolarHBondContact O-N 3.15Å; Y157-D160 PolarHBondContact O-N 3.32Å; D160-K162 PolarHBondContact O-N 2.94Å
161	A	57.7	Low	59.6	Low	24 Å²	24	77 Å²	77	20%	0.198	37%	0.369	C	S	.	.	S	Bend	trans	-67.6	80.3	167.9	0	0	0	0	0	109.6	T129 Y157 D163	T129-A161 HydrophobicContact CG2-CB 4.48Å; Y157-A161 HydrophobicContact CE1-CB 4.42Å; Y157-A161 VanDerWaalsContact O-CB 3.22Å; Y157-A161 WeakPolarHBondContact O-CB 3.21Å; Y157-A161 PolarHBondContact O-N 3.41Å; A161-D163 PolarHBondContact O-N 3.36Å
162	K	50.3	Low	57.9	Low	185 Å²	185	78.4 Å²	78.4	80%	0.804	38%	0.379	S	S	*	.			trans	-49	8.5	-177.8	-81	173.2	177.4	169.8	0	117.6	D160 K164	D160-K162 PolarHBondContact O-N 2.94Å; K162-K164 PolarHBondContact O-N 3.37Å
163	D	49	Very low	56.3	Low	103 Å²	103	76 Å²	76	55%	0.551	37%	0.368	S	S	*	.			trans	-89.4	102.6	174.5	-87.2	-25.1	0	0	0	111.5	T129 A161 Q165 L166	T129-D163 HydrophobicContact CG2-CB 4.36Å; A161-D163 PolarHBondContact O-N 3.36Å; D163-Q165 PolarHBondContact O-N 3.47Å; D163-L166 PolarHBondContact O-N 3.06Å
164	K	51.5	Low	54.6	Low	123 Å²	123	76.9 Å²	76.9	54%	0.535	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	1.2	179.6	-61.5	169.3	175.3	169.2	0	116.6	K162 E852	K162-K164 PolarHBondContact O-N 3.37Å; K164-E852 IonicContact NZ-OE1 2.99Å; K164-E852 IonicContact NZ-OE2 3.95Å; K164-E852 PolarHBondContact NZ-OE2 3.38Å
165	Q	50	Low	52.8	Low	134 Å²	134	82.2 Å²	82.2	63%	0.626	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-18.4	180	-66.7	-168.6	-8.7	0	0	113.5	D163 P168	D163-Q165 PolarHBondContact O-N 3.47Å; Q165-P168 WeakPolarHBondContact O-CD 3.44Å
166	L	47.9	Very low	50.9	Low	8 Å²	8	86 Å²	86	4%	0.042	42%	0.424	C	S	.	.	S	Bend	trans	-85.5	-5.4	-177	-79.2	160.4	0	0	0	114.6	T129 E133 L158 D163 P168 F169	T129-L166 HydrophobicContact CG2-CD1 3.85Å; E133-L166 HydrophobicContact CB-CD2 3.63Å; E133-L166 HydrophobicContact CG-CD2 3.94Å; L158-L166 HydrophobicContact CD2-CD1 4.1Å; L158-L166 HydrophobicContact CD2-CD2 4.4Å; D163-L166 PolarHBondContact O-N 3.06Å; L166-P168 VanDerWaalsContact C-N 3.32Å; L166-F169 PolarHBondContact O-N 3.41Å; L166-F169 VanDerWaalsContact O-N 3.13Å
167	F	46	Very low	48.9	Very low	108 Å²	108	87.1 Å²	87.1	47%	0.474	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-54.1	-33.4	-176.5	-129.9	-92.2	0	0	0	115.6	F169 L170	F167-F169 PolarHBondContact O-N 2.87Å; F167-F169 VanDerWaalsContact O-N 3.13Å; F167-L170 PolarHBondContact O-N 3.2Å
168	P	49.7	Very low	47.1	Very low	77 Å²	77	92.4 Å²	92.4	50%	0.5	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-61.7	-23.1	178.9	-23.7	34.2	0	0	0	114.4	Q165 L166 L171	Q165-P168 WeakPolarHBondContact O-CD 3.44Å; L166-P168 VanDerWaalsContact C-N 3.32Å; P168-L171 WeakPolarHBondContact O-CB 3.35Å
169	F	46.4	Very low	45.4	Very low	46 Å²	46	93.3 Å²	93.3	20%	0.202	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-92.4	-11	-176	-69.1	-79.7	0	0	0	114.2	E133 Q137 L166 F167 P172	E133-F169 HydrophobicContact CG-CD2 3.71Å; E133-F169 HydrophobicContact CG-CE2 3.39Å; E133-F169 HydrophobicContact CG-CZ 4.19Å; E133-F169 WeakPolarHBondContact OE1-CE2 3.33Å; Q137-F169 HydrophobicContact CB-CE1 4.45Å; Q137-F169 HydrophobicContact CG-CD1 4.44Å; Q137-F169 HydrophobicContact CG-CE1 3.34Å; Q137-F169 HydrophobicContact CG-CE2 4.24Å; Q137-F169 HydrophobicContact CG-CZ 3.23Å; L166-F169 PolarHBondContact O-N 3.41Å; L166-F169 VanDerWaalsContact O-N 3.13Å; F167-F169 PolarHBondContact O-N 2.87Å; F167-F169 VanDerWaalsContact O-N 3.13Å; F169-P172 WeakPolarHBondContact O-CD 3.37Å
170	L	50.4	Low	44	Very low	36 Å²	36	89 Å²	89	19%	0.188	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.2	168.5	-76.7	160.2	0	0	0	112.2	I155 L158 F167 F173	I155-L170 HydrophobicContact CG1-CD2 4.47Å; I155-L170 HydrophobicContact CG2-CD2 4.26Å; L158-L170 HydrophobicContact CB-CD1 4.38Å; L158-L170 HydrophobicContact CD1-CD2 4.38Å; F167-L170 PolarHBondContact O-N 3.2Å; L170-F173 WeakPolarHBondContact O-CD2 3.27Å; L170-F173 PolarHBondContact O-N 3.35Å
171	L	46	Very low	42.6	Very low	49 Å²	49	89.6 Å²	89.6	26%	0.257	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-67.1	-18.7	178.6	-69.7	167.5	0	0	0	117.1	P168 F173 T174	P168-L171 WeakPolarHBondContact O-CB 3.35Å; L171-F173 PolarHBondContact O-N 3.45Å; L171-F173 VanDerWaalsContact O-N 3.08Å; L171-T174 PolarHBondContact O-N 2.98Å; L171-T174 VanDerWaalsContact O-N 3.09Å; L171-T174 PolarHBondContact O-OG1 3.5Å
172	P	41.4	Very low	41.4	Very low	53 Å²	53	95.2 Å²	95.2	34%	0.344	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-59.4	-21.7	175	-22.2	33	0	0	0	113	F169 T174	F169-P172 WeakPolarHBondContact O-CD 3.37Å; P172-T174 PolarHBondContact O-N 3.01Å
173	F	41.2	Very low	40.8	Very low	90 Å²	90	92.8 Å²	92.8	40%	0.395	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-72.6	-4.4	177.7	-68.9	-75.7	0	0	0	114.4	Y143 L151 I155 L170 L171	Y143-F173 HydrophobicContact CD1-CE2 4.17Å; Y143-F173 HydrophobicContact CD1-CZ 4.17Å; Y143-F173 HydrophobicContact CG-CE2 4.21Å; Y143-F173 HydrophobicContact CG-CZ 4.19Å; L151-F173 HydrophobicContact CD1-CZ 4.05Å; L151-F173 HydrophobicContact CD2-CE1 4.01Å; L151-F173 HydrophobicContact CD2-CZ 3.99Å; L151-F173 HydrophobicContact CG-CZ 4.29Å; I155-F173 HydrophobicContact CD1-CE1 4.3Å; I155-F173 HydrophobicContact CD1-CE2 3.91Å; I155-F173 HydrophobicContact CD1-CZ 3.69Å; I155-F173 HydrophobicContact CG1-CE2 4.36Å; I155-F173 HydrophobicContact CG1-CZ 4.48Å; L170-F173 WeakPolarHBondContact O-CD2 3.27Å; L170-F173 PolarHBondContact O-N 3.35Å; L171-F173 PolarHBondContact O-N 3.45Å; L171-F173 VanDerWaalsContact O-N 3.08Å
174	T	38.7	Very low	40.4	Very low	61 Å²	61	93.1 Å²	93.1	37%	0.374	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-132.7	5.8	-174	60.6	0	0	0	0	115	L171 P172 M885	L171-T174 PolarHBondContact O-N 2.98Å; L171-T174 VanDerWaalsContact O-N 3.09Å; L171-T174 PolarHBondContact O-OG1 3.5Å; P172-T174 PolarHBondContact O-N 3.01Å; T174-M885 HydrophobicContact CG2-CE 3.35Å; T174-M885 HydrophobicContact CG2-SD 3.39Å; T174-M885 WeakPolarHBondContact CG2-SD 3.47Å
175	R	35.6	Very low	39.6	Very low	115 Å²	115	96 Å²	96	43%	0.434	48%	0.481	S	S	.	.			trans	-110.8	126.2	-175.6	-66.9	-161.9	158.2	-158.2	-4	113.9	Y177 E883	R175-Y177 HydrophobicContact CB-CD2 3.63Å; R175-Y177 HydrophobicContact CB-CE2 4.45Å; R175-Y177 HydrophobicContact CB-CG 4.4Å; R175-Y177 HydrophobicContact CG-CD2 3.21Å; R175-Y177 HydrophobicContact CG-CE2 3.62Å; R175-Y177 HydrophobicContact CG-CG 4.14Å; R175-Y177 VanDerWaalsContact CZ-CE2 3.45Å; R175-E883 IonicContact CZ-OE1 3.62Å; R175-E883 IonicContact NH2-OE1 2.75Å; R175-E883 PolarHBondContact NH2-OE1 2.89Å; R175-E883 IonicContact NH2-OE2 2.64Å
176	P	28.9	Very low	39	Very low	129 Å²	129	95.2 Å²	95.2	84%	0.838	48%	0.48	S	S	*	.			trans	-106.1	79.4	131.9	32	-23.1	0	0	0	108.3	L178	P176-L178 PolarHBondContact O-N 2.61Å
177	Y	32.2	Very low	38.8	Very low	114 Å²	114	100 Å²	100	45%	0.447	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	101	176.9	-98.9	-104.4	0	0	0	110.9	R175 E883	R175-Y177 HydrophobicContact CB-CD2 3.63Å; R175-Y177 HydrophobicContact CB-CE2 4.45Å; R175-Y177 HydrophobicContact CB-CG 4.4Å; R175-Y177 HydrophobicContact CG-CD2 3.21Å; R175-Y177 HydrophobicContact CG-CE2 3.62Å; R175-Y177 HydrophobicContact CG-CG 4.14Å; R175-Y177 VanDerWaalsContact CZ-CE2 3.45Å; Y177-E883 PolarHBondContact OH-OE1 2.79Å
178	L	31.5	Very low	38.6	Very low	181 Å²	181	99.4 Å²	99.4	95%	0.948	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-165.8	3.4	151	-107	136.5	0	0	0	114.2	P176	P176-L178 PolarHBondContact O-N 2.61Å
179	G	30.2	Very low	38.1	Very low	31 Å²	31	100.2 Å²	100.2	32%	0.32	51%	0.509	S	S	.	.			trans	-107.1	-8.9	-172.5	0	0	0	0	0	118.5	M181 Q182 Q183	G179-M181 VanDerWaalsContact C-N 3.29Å; G179-M181 PolarHBondContact O-N 3Å; G179-Q182 PolarHBondContact O-N 2.98Å; G179-Q183 PolarHBondContact O-N 3.47Å
180	C	35.6	Very low	37.7	Very low	83 Å²	83	100.1 Å²	100.1	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-59	-34.3	-171.9	170.4	0	0	0	0	113.9	Q182 Q183 Q184	C180-Q182 VanDerWaalsContact C-N 3.29Å; C180-Q182 PolarHBondContact O-N 3Å; C180-Q183 PolarHBondContact O-N 2.83Å; C180-Q184 PolarHBondContact O-N 3.22Å
181	M	34.9	Very low	37.2	Very low	132 Å²	132	105 Å²	105	65%	0.65	54%	0.539	S	S	*	.	H	α-helix	trans	-72.2	-17.6	176.1	-77.4	-86.7	-112.8	0	0	114.1	G179	G179-M181 VanDerWaalsContact C-N 3.29Å; G179-M181 PolarHBondContact O-N 3Å
182	Q	33.2	Very low	37	Very low	142 Å²	142	110 Å²	110	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-91.1	-33	173.8	-86.8	177.5	-23.7	0	0	112.2	G179 C180 R185 I186	G179-Q182 PolarHBondContact O-N 2.98Å; C180-Q182 VanDerWaalsContact C-N 3.29Å; C180-Q182 PolarHBondContact O-N 3Å; Q182-R185 PolarHBondContact O-N 2.78Å; Q182-I186 WeakPolarHBondContact O-CG1 3.46Å; Q182-I186 PolarHBondContact O-N 3.29Å; Q182-I186 VanDerWaalsContact O-N 3.12Å
183	Q	37.4	Very low	36.6	Very low	133 Å²	133	109.3 Å²	109.3	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-69.5	-34.2	174.3	-86	174	-34.4	0	0	112.8	G179 C180 R185 I186 L187	G179-Q183 PolarHBondContact O-N 3.47Å; C180-Q183 PolarHBondContact O-N 2.83Å; Q183-R185 VanDerWaalsContact C-N 3.33Å; Q183-R185 PolarHBondContact O-N 3.23Å; Q183-I186 PolarHBondContact O-N 2.95Å; Q183-L187 PolarHBondContact O-N 3.03Å
184	Q	39.3	Very low	36.5	Very low	110 Å²	110	109.8 Å²	109.8	51%	0.514	56%	0.561	S	S	.	*	H	α-helix	trans	-59.9	-41.9	169.6	-100.2	171.4	-19.8	0	0	111.8	C180 I186 L187 D188	C180-Q184 PolarHBondContact O-N 3.22Å; Q184-I186 VanDerWaalsContact C-N 3.33Å; Q184-I186 PolarHBondContact O-N 3.22Å; Q184-L187 PolarHBondContact O-N 3.43Å; Q184-D188 WeakPolarHBondContact O-CB 3.29Å; Q184-D188 PolarHBondContact O-N 2.91Å
185	R	36.1	Very low	36.5	Very low	184 Å²	184	109.8 Å²	109.8	69%	0.694	57%	0.567	S	S	*	*	H	α-helix	trans	-64.6	-34.4	174.3	-70.7	-173.2	-166.8	-177.9	3.2	113.3	Q182 Q183 V189	Q182-R185 PolarHBondContact O-N 2.78Å; Q183-R185 VanDerWaalsContact C-N 3.33Å; Q183-R185 PolarHBondContact O-N 3.23Å; R185-V189 VanDerWaalsContact O-CB 3.29Å; R185-V189 WeakPolarHBondContact O-CB 3.26Å; R185-V189 WeakPolarHBondContact O-CG2 3.43Å; R185-V189 PolarHBondContact O-N 3.08Å
186	I	37.6	Very low	36.4	Very low	118 Å²	118	110.1 Å²	110.1	61%	0.605	58%	0.575	S	S	*	*	H	α-helix	trans	-73.2	-36.9	178.2	-65.6	167.5	0	0	0	110.8	Q182 Q183 Q184 V189 A190	Q182-I186 WeakPolarHBondContact O-CG1 3.46Å; Q182-I186 PolarHBondContact O-N 3.29Å; Q182-I186 VanDerWaalsContact O-N 3.12Å; Q183-I186 PolarHBondContact O-N 2.95Å; Q184-I186 VanDerWaalsContact C-N 3.33Å; Q184-I186 PolarHBondContact O-N 3.22Å; I186-V189 PolarHBondContact O-N 3.06Å; I186-A190 VanDerWaalsContact O-CB 3.3Å; I186-A190 WeakPolarHBondContact O-CB 3.33Å; I186-A190 PolarHBondContact O-N 3.48Å
187	L	42.5	Very low	36.7	Very low	108 Å²	108	112.1 Å²	112.1	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-68.7	-42.7	172.3	-79.4	160.6	0	0	0	111.6	Q183 Q184 V189 A190 E191	Q183-L187 PolarHBondContact O-N 3.03Å; Q184-L187 PolarHBondContact O-N 3.43Å; L187-V189 VanDerWaalsContact C-N 3.28Å; L187-V189 PolarHBondContact O-N 3.26Å; L187-A190 CarbonylContact O-C 3.6Å; L187-A190 PolarHBondContact O-N 3.45Å; L187-A190 VanDerWaalsContact O-N 3.11Å; L187-E191 WeakPolarHBondContact O-CB 3.16Å; L187-E191 WeakPolarHBondContact O-CG 3.44Å; L187-E191 PolarHBondContact O-N 3.33Å
188	D	41.5	Very low	36.8	Very low	95 Å²	95	109.2 Å²	109.2	51%	0.508	57%	0.566	S	S	.	*	H	α-helix	trans	-60.3	-39.3	173.8	-66.1	-20	0	0	0	110.7	Q184 W192	Q184-D188 WeakPolarHBondContact O-CB 3.29Å; Q184-D188 PolarHBondContact O-N 2.91Å; D188-W192 WeakPolarHBondContact O-CB 3.38Å; D188-W192 PolarHBondContact O-N 3.45Å
189	V	39.6	Very low	37.1	Very low	94 Å²	94	107 Å²	107	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-71.7	-33.8	175.1	171.1	0	0	0	0	112	R185 I186 L187 A193	R185-V189 VanDerWaalsContact O-CB 3.29Å; R185-V189 WeakPolarHBondContact O-CB 3.26Å; R185-V189 WeakPolarHBondContact O-CG2 3.43Å; R185-V189 PolarHBondContact O-N 3.08Å; I186-V189 PolarHBondContact O-N 3.06Å; L187-V189 VanDerWaalsContact C-N 3.28Å; L187-V189 PolarHBondContact O-N 3.26Å; V189-A193 WeakPolarHBondContact O-CB 3.25Å; V189-A193 PolarHBondContact O-N 2.69Å
190	A	38.9	Very low	37.7	Very low	45 Å²	45	112.7 Å²	112.7	37%	0.372	58%	0.577	S	S	.	*	H	α-helix	trans	-73.7	-34.7	175.1	0	0	0	0	0	112.4	I186 L187 A193 N194	I186-A190 VanDerWaalsContact O-CB 3.3Å; I186-A190 WeakPolarHBondContact O-CB 3.33Å; I186-A190 PolarHBondContact O-N 3.48Å; L187-A190 CarbonylContact O-C 3.6Å; L187-A190 PolarHBondContact O-N 3.45Å; L187-A190 VanDerWaalsContact O-N 3.11Å; A190-A193 PolarHBondContact O-N 3.1Å; A190-N194 WeakPolarHBondContact O-CB 3.25Å; A190-N194 PolarHBondContact O-N 3.14Å; A190-N194 PolarHBondContact O-ND2 3.02Å
191	E	39.3	Very low	38.4	Very low	137 Å²	137	113 Å²	113	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-68.2	-41.4	170.2	-75.4	-170.8	169.3	0	0	110.9	L187 A193 N194 A195	L187-E191 WeakPolarHBondContact O-CB 3.16Å; L187-E191 WeakPolarHBondContact O-CG 3.44Å; L187-E191 PolarHBondContact O-N 3.33Å; E191-A193 VanDerWaalsContact C-N 3.34Å; E191-A193 PolarHBondContact O-N 3.19Å; E191-N194 CarbonylContact O-C 3.35Å; E191-N194 PolarHBondContact O-N 3.03Å; E191-A195 WeakPolarHBondContact O-CB 3.06Å; E191-A195 PolarHBondContact O-N 3.39Å
192	W	41.6	Very low	39.8	Very low	154 Å²	154	110.3 Å²	110.3	58%	0.583	57%	0.565	S	S	*	*	H	α-helix	trans	-61.2	-42	172.5	-168	78.8	0	0	0	111.7	D188 A195 M196	D188-W192 WeakPolarHBondContact O-CB 3.38Å; D188-W192 PolarHBondContact O-N 3.45Å; W192-A195 PolarHBondContact O-N 3.02Å; W192-M196 HydrophobicContact CH2-CE 3.88Å; W192-M196 HydrophobicContact CH2-SD 4.1Å; W192-M196 HydrophobicContact CZ2-CE 4.34Å; W192-M196 HydrophobicContact CZ3-CE 4.44Å; W192-M196 HydrophobicContact CZ3-SD 4.07Å; W192-M196 PolarHBondContact O-N 3.38Å; W192-M196 VanDerWaalsContact O-N 3.1Å
193	A	33.3	Very low	41.7	Very low	39 Å²	39	104.1 Å²	104.1	32%	0.322	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-41.8	173.5	0	0	0	0	0	112	V189 A190 E191 M196 F197	V189-A193 WeakPolarHBondContact O-CB 3.25Å; V189-A193 PolarHBondContact O-N 2.69Å; A190-A193 PolarHBondContact O-N 3.1Å; E191-A193 VanDerWaalsContact C-N 3.34Å; E191-A193 PolarHBondContact O-N 3.19Å; A193-M196 WeakPolarHBondContact O-CB 3.04Å; A193-M196 PolarHBondContact O-N 2.65Å; A193-F197 WeakPolarHBondContact O-CD2 3.48Å
194	N	38.2	Very low	43.6	Very low	101 Å²	101	99.2 Å²	99.2	54%	0.54	52%	0.522	S	S	.	.	H	α-helix	trans	-71.3	-27.6	176.9	-84.1	-35.5	0	0	0	113.8	A190 E191 C198	A190-N194 WeakPolarHBondContact O-CB 3.25Å; A190-N194 PolarHBondContact O-N 3.14Å; A190-N194 PolarHBondContact O-ND2 3.02Å; E191-N194 CarbonylContact O-C 3.35Å; E191-N194 PolarHBondContact O-N 3.03Å; N194-C198 PolarHBondContact O-SG 3.29Å
195	A	38.2	Very low	45.6	Very low	61 Å²	61	94 Å²	94	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-68.8	-36.2	171.2	0	0	0	0	0	111.1	E191 W192 F197 C198	E191-A195 WeakPolarHBondContact O-CB 3.06Å; E191-A195 PolarHBondContact O-N 3.39Å; W192-A195 PolarHBondContact O-N 3.02Å; A195-F197 PolarHBondContact O-N 3.38Å; A195-C198 PolarHBondContact O-N 2.75Å
196	M	34.2	Very low	47.5	Very low	122 Å²	122	87.7 Å²	87.7	60%	0.601	48%	0.476	S	S	*	.	H	α-helix	trans	-63.9	-22.1	179.6	-140.1	171.7	-160.3	0	0	113.9	W192 A193	W192-M196 HydrophobicContact CH2-CE 3.88Å; W192-M196 HydrophobicContact CH2-SD 4.1Å; W192-M196 HydrophobicContact CZ2-CE 4.34Å; W192-M196 HydrophobicContact CZ3-CE 4.44Å; W192-M196 HydrophobicContact CZ3-SD 4.07Å; W192-M196 PolarHBondContact O-N 3.38Å; W192-M196 VanDerWaalsContact O-N 3.1Å; A193-M196 WeakPolarHBondContact O-CB 3.04Å; A193-M196 PolarHBondContact O-N 2.65Å
197	F	36.2	Very low	49.3	Very low	170 Å²	170	86.3 Å²	86.3	75%	0.746	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	1.6	179.9	-70.2	-70.1	0	0	0	115.1	A193 A195 I199	A193-F197 WeakPolarHBondContact O-CD2 3.48Å; A195-F197 PolarHBondContact O-N 3.38Å; F197-I199 VanDerWaalsContact C-N 3.3Å; F197-I199 PolarHBondContact O-N 3.28Å; F197-I199 VanDerWaalsContact O-N 3.13Å
198	C	33.6	Very low	50.7	Low	54 Å²	54	81.2 Å²	81.2	37%	0.365	44%	0.441	S	S	.	.			trans	-94.4	62.6	-176.7	-61.6	0	0	0	0	111.8	N194 A195 R210	N194-C198 PolarHBondContact O-SG 3.29Å; A195-C198 PolarHBondContact O-N 2.75Å; C198-R210 PolarHBondContact SG-NH2 2.74Å
199	I	37	Very low	52.3	Low	133 Å²	133	77.9 Å²	77.9	68%	0.682	42%	0.423	S	S	*	.			trans	-88.7	124	170.6	-59.3	172.9	0	0	0	107.1	F197	F197-I199 VanDerWaalsContact C-N 3.3Å; F197-I199 PolarHBondContact O-N 3.28Å; F197-I199 VanDerWaalsContact O-N 3.13Å
200	N	44.4	Very low	53.8	Low	151 Å²	151	78.8 Å²	78.8	81%	0.807	42%	0.416	S	S	*	.	S	Bend	trans	105.9	64.5	169.9	-52.1	-41.6	0	0	0	117.7
201	N	49.6	Very low	55.3	Low	91 Å²	91	78.3 Å²	78.3	49%	0.487	41%	0.407	S	S	.	.				161.2	99.3	114	-162.2	2.4	0	0	0	109.2	D203	N201-D203 VanDerWaalsContact C-N 3.34Å; N201-D203 PolarHBondContact O-N 3.27Å
202	P	64.4	Low	56.6	Low	74 Å²	74	74.9 Å²	74.9	48%	0.481	40%	0.397	S	S	.	.			trans	-80.8	80.3	-168.1	34	-33.9	0	0	0	109.8	G204 C234 A291 P293	P202-G204 PolarHBondContact O-N 2.63Å; P202-C234 PolarHBondContact O-SG 3.27Å; P202-A291 HydrophobicContact CB-CB 4.46Å; P202-P293 WeakPolarHBondContact O-CB 3.23Å
203	D	73.9	Confident	57.8	Low	12 Å²	12	68.7 Å²	68.7	6%	0.064	38%	0.375	C	S	.	.			trans	-75.6	-5.2	170.9	66.5	-14.1	0	0	0	113	N201 M205 R228 P293	N201-D203 VanDerWaalsContact C-N 3.34Å; N201-D203 PolarHBondContact O-N 3.27Å; D203-M205 VanDerWaalsContact C-N 3.29Å; D203-M205 HydrophobicContact CB-CE 4.15Å; D203-M205 PolarHBondContact O-N 3.42Å; D203-M205 PolarHBondContact OD1-N 2.98Å; D203-M205 WeakPolarHBondContact OD2-CE 3.47Å; D203-R228 VanDerWaalsContact CG-NH2 3.34Å; D203-R228 IonicContact OD1-CZ 2.67Å; D203-R228 IonicContact OD1-NE 3.99Å; D203-R228 IonicContact OD1-NH2 3.08Å; D203-R228 PolarHBondContact OD1-NH2 3.38Å; D203-R228 VanDerWaalsContact OD2-CG 3.28Å; D203-R228 WeakPolarHBondContact OD2-CG 3.45Å; D203-R228 IonicContact OD2-CZ 2.88Å; D203-R228 IonicContact OD2-NE 3.03Å; D203-R228 PolarHBondContact OD2-NE 2.76Å; D203-R228 IonicContact OD2-NH2 2.86Å; D203-R228 PolarHBondContact OD2-NH2 3.07Å; D203-P293 WeakPolarHBondContact O-CG 3.35Å
204	G	75.6	Confident	59.6	Low	31 Å²	31	66.9 Å²	66.9	32%	0.32	36%	0.36	S	S	.	.	S	Bend	trans	77.4	9.9	177.3	0	0	0	0	0	113.9	P202	P202-G204 PolarHBondContact O-N 2.63Å
205	M	81.3	Confident	61.1	Low	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.357	C	S	.	.			trans	-112.5	2.9	-176.4	-64.8	-174.9	-76.9	0	0	113.6	D203 E207 A208 I209 R228 F231 R274 F277 T278	D203-M205 VanDerWaalsContact C-N 3.29Å; D203-M205 HydrophobicContact CB-CE 4.15Å; D203-M205 PolarHBondContact O-N 3.42Å; D203-M205 PolarHBondContact OD1-N 2.98Å; D203-M205 WeakPolarHBondContact OD2-CE 3.47Å; M205-E207 PolarHBondContact O-N 3.11Å; M205-A208 PolarHBondContact O-N 3.13Å; M205-I209 HydrophobicContact CB-CD1 3.93Å; M205-I209 HydrophobicContact CB-CG1 4.49Å; M205-I209 WeakPolarHBondContact O-CD1 3.5Å; M205-I209 VanDerWaalsContact O-CG1 3.23Å; M205-I209 WeakPolarHBondContact O-CG1 3.12Å; M205-I209 PolarHBondContact O-N 3.43Å; M205-I209 VanDerWaalsContact O-N 3.08Å; M205-R228 HydrophobicContact CE-CB 4.48Å; M205-R228 HydrophobicContact CE-CG 3.86Å; M205-R228 WeakPolarHBondContact CE-O 3.45Å; M205-F231 HydrophobicContact CE-CB 3.98Å; M205-F231 HydrophobicContact SD-CB 3.47Å; M205-F231 WeakPolarHBondContact SD-CB 3.3Å; M205-F231 HydrophobicContact SD-CD2 4.39Å; M205-F231 HydrophobicContact SD-CG 4.48Å; M205-R274 HydrophobicContact CG-CG 3.88Å; M205-R274 HydrophobicContact SD-CG 3.97Å; M205-F277 HydrophobicContact CB-CE1 4.49Å; M205-F277 HydrophobicContact CG-CD1 4.42Å; M205-F277 HydrophobicContact SD-CD1 4.19Å; M205-F277 HydrophobicContact SD-CE1 4.37Å; M205-T278 HydrophobicContact CB-CG2 4.31Å; M205-T278 HydrophobicContact CG-CG2 3.78Å
206	E	77	Confident	62.4	Low	52 Å²	52	69.5 Å²	69.5	24%	0.243	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-46.1	-168.8	-53.9	-149.1	139.2	0	0	113.1	I209 R210 R228	E206-I209 PolarHBondContact O-N 3.4Å; E206-R210 VanDerWaalsContact O-CG 3.3Å; E206-R210 WeakPolarHBondContact O-CG 3.38Å; E206-R210 PolarHBondContact O-N 3.21Å; E206-R228 IonicContact OE1-NH2 3.24Å; E206-R228 PolarHBondContact OE1-NH2 3.23Å; E206-R228 VanDerWaalsContact OE1-NH2 3.07Å
207	E	74.2	Confident	63.9	Low	89 Å²	89	66.4 Å²	66.4	42%	0.416	33%	0.331	S	S	.	.	H	α-helix	trans	-68.1	-41.6	-179.5	-66.1	-172.2	-156	0	0	111.9	M205 I209 R210 D211 V282	M205-E207 PolarHBondContact O-N 3.11Å; E207-I209 VanDerWaalsContact C-N 3.25Å; E207-I209 PolarHBondContact O-N 3.4Å; E207-R210 PolarHBondContact O-N 3.31Å; E207-R210 VanDerWaalsContact O-N 3.14Å; E207-D211 PolarHBondContact O-N 3.13Å; E207-V282 HydrophobicContact CB-CG2 4.27Å; E207-V282 HydrophobicContact CG-CG2 4.44Å; E207-V282 WeakPolarHBondContact OE2-CA 3.35Å; E207-V282 WeakPolarHBondContact OE2-CG2 3.27Å
208	A	72.9	Confident	65.3	Low	1 Å²	1	59.7 Å²	59.7	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-35.1	175.8	0	0	0	0	0	112.3	M205 D211 L214 F277 T278	M205-A208 PolarHBondContact O-N 3.13Å; A208-D211 WeakPolarHBondContact O-CB 3.5Å; A208-L214 WeakPolarHBondContact O-CD2 3.37Å; A208-F277 HydrophobicContact CB-CE1 4.06Å; A208-F277 HydrophobicContact CB-CZ 4.48Å; A208-T278 HydrophobicContact CB-CG2 4.12Å
209	I	74.3	Confident	66.4	Low	25 Å²	25	59.8 Å²	59.8	13%	0.128	31%	0.311	C	S	.	.	H	α-helix	trans	-79.3	-26.1	178.6	-65.8	168.7	0	0	0	112.1	M205 E206 E207 D211 R228 F277	M205-I209 HydrophobicContact CB-CD1 3.93Å; M205-I209 HydrophobicContact CB-CG1 4.49Å; M205-I209 WeakPolarHBondContact O-CD1 3.5Å; M205-I209 VanDerWaalsContact O-CG1 3.23Å; M205-I209 WeakPolarHBondContact O-CG1 3.12Å; M205-I209 PolarHBondContact O-N 3.43Å; M205-I209 VanDerWaalsContact O-N 3.08Å; E206-I209 PolarHBondContact O-N 3.4Å; E207-I209 VanDerWaalsContact C-N 3.25Å; E207-I209 PolarHBondContact O-N 3.4Å; I209-D211 VanDerWaalsContact C-N 3.28Å; I209-R228 HydrophobicContact CD1-CB 3.86Å; I209-R228 HydrophobicContact CD1-CG 3.67Å; I209-F277 HydrophobicContact CG1-CE1 4.19Å; I209-F277 HydrophobicContact CG1-CZ 4.26Å
210	R	72	Confident	67.7	Low	112 Å²	112	58.1 Å²	58.1	42%	0.423	30%	0.304	S	S	.	.	H	α-helix	trans	-74.6	-18.8	175.1	-76.2	176.6	-165.3	-134.9	-2.4	113.1	C198 E206 E207 P212	C198-R210 PolarHBondContact SG-NH2 2.74Å; E206-R210 VanDerWaalsContact O-CG 3.3Å; E206-R210 WeakPolarHBondContact O-CG 3.38Å; E206-R210 PolarHBondContact O-N 3.21Å; E207-R210 PolarHBondContact O-N 3.31Å; E207-R210 VanDerWaalsContact O-N 3.14Å; R210-P212 WeakPolarHBondContact O-CD 3.46Å; R210-P212 VanDerWaalsContact O-N 3.07Å
211	D	70.9	Confident	68.8	Low	36 Å²	36	55.2 Å²	55.2	19%	0.193	29%	0.288	C	S	.	.			trans	-51.2	115.8	178	-171.8	-13.7	0	0	0	110.5	E207 A208 I209 L213 L214 N744	E207-D211 PolarHBondContact O-N 3.13Å; A208-D211 WeakPolarHBondContact O-CB 3.5Å; I209-D211 VanDerWaalsContact C-N 3.28Å; D211-L213 PolarHBondContact O-N 3.1Å; D211-L213 VanDerWaalsContact O-N 3.15Å; D211-L213 VanDerWaalsContact OD1-CB 3.31Å; D211-L213 WeakPolarHBondContact OD1-CB 3.48Å; D211-L213 WeakPolarHBondContact OD1-CG 3.49Å; D211-L213 PolarHBondContact OD1-N 2.74Å; D211-L214 HydrophobicContact CB-CB 4.36Å; D211-L214 PolarHBondContact O-N 2.68Å; D211-L214 VanDerWaalsContact O-N 3.12Å; D211-N744 PolarHBondContact OD2-ND2 2.96Å
212	P	66.2	Low	69.8	Low	64 Å²	64	57.5 Å²	57.5	42%	0.416	30%	0.296	S	S	.	.	H	α-helix	trans	-59	-27.4	-178.8	23.1	-33.9	0	0	0	112.3	R210 R216 P802	R210-P212 WeakPolarHBondContact O-CD 3.46Å; R210-P212 VanDerWaalsContact O-N 3.07Å; P212-R216 WeakPolarHBondContact O-CB 3.26Å; P212-R216 WeakPolarHBondContact O-CG 3.43Å; P212-R216 PolarHBondContact O-N 3.39Å; P212-P802 HydrophobicContact CB-CG 4.27Å
213	L	66.8	Low	70	Confident	24 Å²	24	56 Å²	56	13%	0.126	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-41.3	178.1	-64.5	175.6	0	0	0	111.9	D211 R216 R217 N744 E793	D211-L213 PolarHBondContact O-N 3.1Å; D211-L213 VanDerWaalsContact O-N 3.15Å; D211-L213 VanDerWaalsContact OD1-CB 3.31Å; D211-L213 WeakPolarHBondContact OD1-CB 3.48Å; D211-L213 WeakPolarHBondContact OD1-CG 3.49Å; D211-L213 PolarHBondContact OD1-N 2.74Å; L213-R216 PolarHBondContact O-N 3.35Å; L213-R217 VanDerWaalsContact O-CB 3.3Å; L213-R217 WeakPolarHBondContact O-CB 3.46Å; L213-R217 PolarHBondContact O-N 3.32Å; L213-N744 WeakPolarHBondContact CD1-OD1 3.23Å; L213-E793 HydrophobicContact CD2-CB 4.13Å; L213-E793 HydrophobicContact CD2-CG 3.77Å
214	L	70.6	Confident	70	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-44.2	-177.7	-177.7	68.6	0	0	0	111.3	A208 D211 R216 R217 F218 L224 F277 A742	A208-L214 WeakPolarHBondContact O-CD2 3.37Å; D211-L214 HydrophobicContact CB-CB 4.36Å; D211-L214 PolarHBondContact O-N 2.68Å; D211-L214 VanDerWaalsContact O-N 3.12Å; L214-R216 VanDerWaalsContact C-N 3.32Å; L214-R216 PolarHBondContact O-N 2.93Å; L214-R217 PolarHBondContact O-N 3.46Å; L214-F218 HydrophobicContact CD1-CD2 3.44Å; L214-F218 VanDerWaalsContact CD1-CD2 3.44Å; L214-F218 HydrophobicContact CD1-CE2 3.48Å; L214-F218 VanDerWaalsContact CD1-CE2 3.48Å; L214-F218 HydrophobicContact CG-CD2 4.34Å; L214-F218 PolarHBondContact O-N 3.38Å; L214-F218 VanDerWaalsContact O-N 3.14Å; L214-L224 HydrophobicContact CD1-CD2 3.96Å; L214-L224 HydrophobicContact CD2-CD1 4.29Å; L214-L224 HydrophobicContact CD2-CD2 3.58Å; L214-L224 HydrophobicContact CG-CD1 4.24Å; L214-L224 HydrophobicContact CG-CD2 3.58Å; L214-F277 HydrophobicContact CD1-CE2 4.47Å; L214-F277 HydrophobicContact CD2-CE2 4.12Å; L214-F277 HydrophobicContact CD2-CZ 3.83Å; L214-A742 HydrophobicContact CB-CB 4.39Å; L214-A742 HydrophobicContact CD1-CB 3.95Å; L214-A742 WeakPolarHBondContact CD1-O 3.43Å; L214-A742 HydrophobicContact CD2-CB 4.18Å; L214-A742 HydrophobicContact CG-CB 4.39Å
215	R	70	Confident	70	Confident	131 Å²	131	62.2 Å²	62.2	49%	0.494	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-42.1	177	-67.6	-172.9	-173.1	-179	1.6	111.9	G219 L224	R215-G219 WeakPolarHBondContact O-CA 3.42Å; R215-G219 PolarHBondContact O-N 2.84Å; R215-L224 HydrophobicContact CG-CD1 4.04Å
216	R	65.6	Low	69.7	Low	87 Å²	87	65.4 Å²	65.4	33%	0.328	31%	0.313	S	S	.	.	H	α-helix	trans	-70	-32.6	179.9	-81.6	170.8	170.7	-127.4	14.5	113.5	P212 L213 L214 P802 Y828	P212-R216 WeakPolarHBondContact O-CB 3.26Å; P212-R216 WeakPolarHBondContact O-CG 3.43Å; P212-R216 PolarHBondContact O-N 3.39Å; L213-R216 PolarHBondContact O-N 3.35Å; L214-R216 VanDerWaalsContact C-N 3.32Å; L214-R216 PolarHBondContact O-N 2.93Å; R216-P802 PolarHBondContact NH1-O 3.01Å; R216-P802 PolarHBondContact NH2-O 3.37Å; R216-Y828 HydrophobicContact CB-CE1 4.3Å; R216-Y828 HydrophobicContact CB-CE2 3.71Å; R216-Y828 WeakPolarHBondContact CB-OH 2.84Å; R216-Y828 VanDerWaalsContact CD-OH 3.24Å; R216-Y828 WeakPolarHBondContact CD-OH 3.41Å; R216-Y828 WeakPolarHBondContact CG-OH 3.43Å; R216-Y828 PolarHBondContact NH1-OH 2.94Å; R216-Y828 WeakPolarHBondContact O-CE2 3.08Å
217	R	65	Low	69.7	Low	56 Å²	56	63.5 Å²	63.5	21%	0.211	31%	0.305	C	S	.	.	H	α-helix	trans	-75.6	-49.7	-178.4	-173.9	172.8	-172.7	163.1	-2.2	113.1	L213 L214 G700 S701 G743	L213-R217 VanDerWaalsContact O-CB 3.3Å; L213-R217 WeakPolarHBondContact O-CB 3.46Å; L213-R217 PolarHBondContact O-N 3.32Å; L214-R217 PolarHBondContact O-N 3.46Å; R217-G700 VanDerWaalsContact CZ-O 3.24Å; R217-G700 PolarHBondContact NH1-O 2.98Å; R217-G700 PolarHBondContact NH2-O 3.5Å; R217-S701 VanDerWaalsContact NH2-C 3.34Å; R217-S701 PolarHBondContact NH2-O 3.2Å; R217-G743 VanDerWaalsContact NH1-CA 3.3Å; R217-G743 PolarHBondContact NH1-O 3.38Å
218	F	65.5	Low	70.1	Confident	30 Å²	30	63.3 Å²	63.3	13%	0.132	30%	0.3	C	S	.	.	H	α-helix	trans	-89.8	-10	-177.5	-67.9	-77.4	0	0	0	113.2	L214 N220 L224 L739	L214-F218 HydrophobicContact CD1-CD2 3.44Å; L214-F218 VanDerWaalsContact CD1-CD2 3.44Å; L214-F218 HydrophobicContact CD1-CE2 3.48Å; L214-F218 VanDerWaalsContact CD1-CE2 3.48Å; L214-F218 HydrophobicContact CG-CD2 4.34Å; L214-F218 PolarHBondContact O-N 3.38Å; L214-F218 VanDerWaalsContact O-N 3.14Å; F218-N220 WeakPolarHBondContact O-CB 3.29Å; F218-N220 PolarHBondContact O-N 3.42Å; F218-L224 HydrophobicContact CD2-CD2 4.48Å; F218-L739 HydrophobicContact CE1-CD2 4.05Å; F218-L739 HydrophobicContact CE2-CD2 4Å; F218-L739 HydrophobicContact CZ-CD2 3.4Å; F218-L739 VanDerWaalsContact CZ-CD2 3.4Å
219	G	57.5	Low	70.4	Confident	56 Å²	56	69.3 Å²	69.3	58%	0.577	33%	0.328	S	S	*	.			trans	61	-7.7	168.8	0	0	0	0	0	116.2	R215	R215-G219 WeakPolarHBondContact O-CA 3.42Å; R215-G219 PolarHBondContact O-N 2.84Å
220	N	63.8	Low	70.5	Confident	98 Å²	98	70.9 Å²	70.9	52%	0.524	33%	0.334	S	S	.	.			trans	-136	107	-166.1	-68	-40.5	0	0	0	109.4	F218 H222 V223	F218-N220 WeakPolarHBondContact O-CB 3.29Å; F218-N220 PolarHBondContact O-N 3.42Å; N220-H222 PolarHBondContact O-N 3.43Å; N220-V223 HydrophobicContact CB-CG2 4Å; N220-V223 PolarHBondContact O-N 3.46Å
221	D	67.4	Low	71.1	Confident	89 Å²	89	65.6 Å²	65.6	48%	0.476	31%	0.314	S	S	.	.	H	α-helix	trans	-52.4	-27.6	173.5	-77.2	-13.4	0	0	0	112.7	L224 R225	D221-L224 PolarHBondContact O-N 3.35Å; D221-R225 WeakPolarHBondContact O-CB 3.48Å; D221-R225 VanDerWaalsContact O-CG 3.31Å; D221-R225 WeakPolarHBondContact O-CG 3.42Å; D221-R225 PolarHBondContact O-N 3.21Å
222	H	71	Confident	71.6	Confident	139 Å²	139	64.5 Å²	64.5	64%	0.644	31%	0.311	S	S	*	.	H	α-helix	trans	-61.3	-42.6	176.8	-65.7	-66.9	0	0	0	113.1	N220 L224 R225 E226	N220-H222 PolarHBondContact O-N 3.43Å; H222-L224 VanDerWaalsContact C-N 3.34Å; H222-R225 PolarHBondContact O-N 3.29Å; H222-E226 VanDerWaalsContact O-CB 3.28Å; H222-E226 WeakPolarHBondContact O-CB 3.32Å; H222-E226 PolarHBondContact O-N 3.23Å
223	V	69.2	Low	72.4	Confident	42 Å²	42	61.4 Å²	61.4	26%	0.255	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-41.7	-179.9	178.6	0	0	0	0	109.6	N220 E226 I227	N220-V223 HydrophobicContact CB-CG2 4Å; N220-V223 PolarHBondContact O-N 3.46Å; V223-E226 PolarHBondContact O-N 2.95Å; V223-I227 HydrophobicContact CG1-CD1 3.79Å; V223-I227 HydrophobicContact CG1-CG1 4.43Å; V223-I227 WeakPolarHBondContact O-CD1 3.44Å; V223-I227 VanDerWaalsContact O-CG1 3.24Å; V223-I227 WeakPolarHBondContact O-CG1 3.44Å; V223-I227 PolarHBondContact O-N 3.42Å
224	L	72.7	Confident	73	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-66.7	-41.7	178	-59.2	-176	0	0	0	112.5	L214 R215 F218 D221 H222 E226 I227 R228	L214-L224 HydrophobicContact CD1-CD2 3.96Å; L214-L224 HydrophobicContact CD2-CD1 4.29Å; L214-L224 HydrophobicContact CD2-CD2 3.58Å; L214-L224 HydrophobicContact CG-CD1 4.24Å; L214-L224 HydrophobicContact CG-CD2 3.58Å; R215-L224 HydrophobicContact CG-CD1 4.04Å; F218-L224 HydrophobicContact CD2-CD2 4.48Å; D221-L224 PolarHBondContact O-N 3.35Å; H222-L224 VanDerWaalsContact C-N 3.34Å; L224-E226 VanDerWaalsContact C-N 3.27Å; L224-E226 PolarHBondContact O-N 3.03Å; L224-I227 HydrophobicContact CD2-CD1 4.32Å; L224-I227 PolarHBondContact O-N 2.97Å; L224-R228 WeakPolarHBondContact O-CB 3.39Å; L224-R228 PolarHBondContact O-N 3.35Å
225	R	75.6	Confident	73.4	Confident	166 Å²	166	63.7 Å²	63.7	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-61.8	-39.1	172.9	-74.4	177.2	-170.8	173.8	6.6	111.6	D221 H222 R228 H229	D221-R225 WeakPolarHBondContact O-CB 3.48Å; D221-R225 VanDerWaalsContact O-CG 3.31Å; D221-R225 WeakPolarHBondContact O-CG 3.42Å; D221-R225 PolarHBondContact O-N 3.21Å; H222-R225 PolarHBondContact O-N 3.29Å; R225-R228 PolarHBondContact O-N 2.98Å; R225-H229 WeakPolarHBondContact O-CB 3.46Å; R225-H229 PolarHBondContact O-N 2.92Å
226	E	75.5	Confident	73.8	Confident	67 Å²	67	60.2 Å²	60.2	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-68.3	-43.5	178.2	-172.3	168	-144.5	0	0	111.6	H222 V223 L224 H229 F230 R711	H222-E226 VanDerWaalsContact O-CB 3.28Å; H222-E226 WeakPolarHBondContact O-CB 3.32Å; H222-E226 PolarHBondContact O-N 3.23Å; V223-E226 PolarHBondContact O-N 2.95Å; L224-E226 VanDerWaalsContact C-N 3.27Å; L224-E226 PolarHBondContact O-N 3.03Å; E226-H229 WeakPolarHBondContact O-CB 3.4Å; E226-H229 PolarHBondContact O-N 3.28Å; E226-F230 HydrophobicContact CG-CD2 3.61Å; E226-F230 HydrophobicContact CG-CE2 3.36Å; E226-F230 HydrophobicContact CG-CZ 4.49Å; E226-F230 WeakPolarHBondContact O-CD2 3.48Å; E226-F230 PolarHBondContact O-N 2.73Å; E226-R711 IonicContact OE1-CZ 2.84Å; E226-R711 IonicContact OE1-NE 3.71Å; E226-R711 IonicContact OE1-NH1 2.7Å; E226-R711 PolarHBondContact OE1-NH1 3.03Å; E226-R711 IonicContact OE1-NH2 3.71Å; E226-R711 PolarHBondContact OE1-NH2 2.94Å; E226-R711 IonicContact OE2-CZ 2.85Å; E226-R711 IonicContact OE2-NH1 2.68Å; E226-R711 PolarHBondContact OE2-NH1 3.43Å; E226-R711 VanDerWaalsContact OE2-NH1 3.08Å
227	I	78.1	Confident	74.5	Confident	13 Å²	13	56.8 Å²	56.8	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-47.5	172.7	-68.6	160.8	0	0	0	110.6	V223 L224 H229 F230 F231 F277 L739	V223-I227 HydrophobicContact CG1-CD1 3.79Å; V223-I227 HydrophobicContact CG1-CG1 4.43Å; V223-I227 WeakPolarHBondContact O-CD1 3.44Å; V223-I227 VanDerWaalsContact O-CG1 3.24Å; V223-I227 WeakPolarHBondContact O-CG1 3.44Å; V223-I227 PolarHBondContact O-N 3.42Å; L224-I227 HydrophobicContact CD2-CD1 4.32Å; L224-I227 PolarHBondContact O-N 2.97Å; I227-H229 VanDerWaalsContact C-N 3.25Å; I227-H229 PolarHBondContact O-N 2.98Å; I227-F230 PolarHBondContact O-N 2.86Å; I227-F230 VanDerWaalsContact O-N 3.13Å; I227-F231 HydrophobicContact CG2-CD2 3.47Å; I227-F231 VanDerWaalsContact CG2-CD2 3.47Å; I227-F231 HydrophobicContact CG2-CE2 3.54Å; I227-F231 HydrophobicContact CG2-CG 4.39Å; I227-F231 WeakPolarHBondContact O-CB 3.31Å; I227-F231 PolarHBondContact O-N 3.08Å; I227-F277 HydrophobicContact CG2-CD2 4.36Å; I227-F277 HydrophobicContact CG2-CE1 4.39Å; I227-F277 HydrophobicContact CG2-CE2 4.14Å; I227-F277 HydrophobicContact CG2-CZ 4.16Å; I227-L739 HydrophobicContact CD1-CD1 3.55Å; I227-L739 HydrophobicContact CD1-CD2 4.42Å; I227-L739 HydrophobicContact CG1-CD1 3.86Å; I227-L739 HydrophobicContact CG2-CD1 4.12Å
228	R	81.7	Confident	75.2	Confident	84 Å²	84	61.5 Å²	61.5	32%	0.317	31%	0.314	S	S	.	.	H	α-helix	trans	-58	-39.3	176	-165.5	-178.6	-174.6	164.4	4.5	111.3	D203 M205 E206 I209 L224 R225 G232	D203-R228 VanDerWaalsContact CG-NH2 3.34Å; D203-R228 IonicContact OD1-CZ 2.67Å; D203-R228 IonicContact OD1-NE 3.99Å; D203-R228 IonicContact OD1-NH2 3.08Å; D203-R228 PolarHBondContact OD1-NH2 3.38Å; D203-R228 VanDerWaalsContact OD2-CG 3.28Å; D203-R228 WeakPolarHBondContact OD2-CG 3.45Å; D203-R228 IonicContact OD2-CZ 2.88Å; D203-R228 IonicContact OD2-NE 3.03Å; D203-R228 PolarHBondContact OD2-NE 2.76Å; D203-R228 IonicContact OD2-NH2 2.86Å; D203-R228 PolarHBondContact OD2-NH2 3.07Å; M205-R228 HydrophobicContact CE-CB 4.48Å; M205-R228 HydrophobicContact CE-CG 3.86Å; M205-R228 WeakPolarHBondContact CE-O 3.45Å; E206-R228 IonicContact OE1-NH2 3.24Å; E206-R228 PolarHBondContact OE1-NH2 3.23Å; E206-R228 VanDerWaalsContact OE1-NH2 3.07Å; I209-R228 HydrophobicContact CD1-CB 3.86Å; I209-R228 HydrophobicContact CD1-CG 3.67Å; L224-R228 WeakPolarHBondContact O-CB 3.39Å; L224-R228 PolarHBondContact O-N 3.35Å; R225-R228 PolarHBondContact O-N 2.98Å; R228-G232 WeakPolarHBondContact O-CA 3.39Å; R228-G232 PolarHBondContact O-N 3.27Å
229	H	78.3	Confident	75.8	Confident	127 Å²	127	60.5 Å²	60.5	59%	0.588	31%	0.31	S	S	*	.	H	α-helix	trans	-68.2	-42.5	175.4	-174.3	60	0	0	0	112.5	R225 E226 I227	R225-H229 WeakPolarHBondContact O-CB 3.46Å; R225-H229 PolarHBondContact O-N 2.92Å; E226-H229 WeakPolarHBondContact O-CB 3.4Å; E226-H229 PolarHBondContact O-N 3.28Å; I227-H229 VanDerWaalsContact C-N 3.25Å; I227-H229 PolarHBondContact O-N 2.98Å
230	F	78.3	Confident	76.7	Confident	59 Å²	59	65.9 Å²	65.9	26%	0.259	32%	0.32	S	S	.	.	H	α-helix	trans	-68.3	-34.3	178.8	-84.2	-60.6	0	0	0	113.3	E226 I227 T270 R711	E226-F230 HydrophobicContact CG-CD2 3.61Å; E226-F230 HydrophobicContact CG-CE2 3.36Å; E226-F230 HydrophobicContact CG-CZ 4.49Å; E226-F230 WeakPolarHBondContact O-CD2 3.48Å; E226-F230 PolarHBondContact O-N 2.73Å; I227-F230 PolarHBondContact O-N 2.86Å; I227-F230 VanDerWaalsContact O-N 3.13Å; F230-T270 WeakPolarHBondContact O-CG2 3.37Å; F230-R711 HydrophobicContact CE2-CG 4.5Å; F230-R711 HydrophobicContact CZ-CG 4.04Å
231	F	83.6	Confident	77	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	32%	0.318	C	S	.	.	H	α-helix	trans	-94.2	-2.5	-179.3	-64.2	-20.3	0	0	0	114.1	M205 I227 T233 T270 A273 R274 F277 I735 L739	M205-F231 HydrophobicContact CE-CB 3.98Å; M205-F231 HydrophobicContact SD-CB 3.47Å; M205-F231 WeakPolarHBondContact SD-CB 3.3Å; M205-F231 HydrophobicContact SD-CD2 4.39Å; M205-F231 HydrophobicContact SD-CG 4.48Å; I227-F231 HydrophobicContact CG2-CD2 3.47Å; I227-F231 VanDerWaalsContact CG2-CD2 3.47Å; I227-F231 HydrophobicContact CG2-CE2 3.54Å; I227-F231 HydrophobicContact CG2-CG 4.39Å; I227-F231 WeakPolarHBondContact O-CB 3.31Å; I227-F231 PolarHBondContact O-N 3.08Å; F231-T233 PolarHBondContact O-N 3.3Å; F231-T270 VanDerWaalsContact CA-CG2 3.41Å; F231-T270 HydrophobicContact CB-CG2 4.32Å; F231-T270 HydrophobicContact CD1-CG2 4.22Å; F231-A273 HydrophobicContact CD1-CB 3.87Å; F231-A273 HydrophobicContact CE1-CB 3.38Å; F231-A273 HydrophobicContact CZ-CB 3.83Å; F231-R274 HydrophobicContact CB-CB 4.41Å; F231-F277 HydrophobicContact CD2-CB 3.94Å; F231-F277 HydrophobicContact CD2-CD1 4.11Å; F231-F277 HydrophobicContact CD2-CG 4.01Å; F231-F277 HydrophobicContact CE2-CB 3.69Å; F231-F277 HydrophobicContact CE2-CD1 4.47Å; F231-F277 HydrophobicContact CE2-CD2 4.33Å; F231-F277 AromaticContact CE2-CG 3.92Å; F231-F277 HydrophobicContact CE2-CG 3.92Å; F231-I735 HydrophobicContact CE1-CB 4.41Å; F231-I735 HydrophobicContact CE1-CG2 3.97Å; F231-I735 HydrophobicContact CZ-CB 4.2Å; F231-I735 HydrophobicContact CZ-CG2 3.52Å; F231-L739 HydrophobicContact CE2-CD1 4.28Å
232	G	81.1	Confident	77.1	Confident	12 Å²	12	63.9 Å²	63.9	12%	0.124	31%	0.313	C	S	.	.			trans	-71.4	118.6	-178.5	0	0	0	0	0	113.4	R228	R228-G232 WeakPolarHBondContact O-CA 3.39Å; R228-G232 PolarHBondContact O-N 3.27Å
233	T	82.2	Confident	76.7	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.328	C	S	.	.			trans	-100	-19.5	176.7	56.8	0	0	0	0	113.7	F231 K267 T270 P271 R274 L295 C296	F231-T233 PolarHBondContact O-N 3.3Å; T233-K267 WeakPolarHBondContact O-CE 3.46Å; T233-K267 PolarHBondContact O-NZ 3.31Å; T233-T270 HydrophobicContact CG2-CG2 4.42Å; T233-P271 HydrophobicContact CG2-CG 4.27Å; T233-R274 PolarHBondContact OG1-NH1 3.41Å; T233-R274 VanDerWaalsContact OG1-NH1 3.12Å; T233-L295 HydrophobicContact CG2-CD2 3.89Å; T233-C296 PolarHBondContact O-N 3.04Å; T233-C296 VanDerWaalsContact O-N 3.07Å
234	C	79.9	Confident	76.1	Confident	24 Å²	24	70 Å²	70	16%	0.162	34%	0.335	C	S	.	.	S	Bend	trans	-81.9	-28.9	-173.9	-59.8	0	0	0	0	113.6	P202 P293 K294 C296	P202-C234 PolarHBondContact O-SG 3.27Å; C234-P293 VanDerWaalsContact SG-CB 3.58Å; C234-K294 PolarHBondContact SG-O 3.27Å; C234-C296 WeakPolarHBondContact O-CB 3.42Å
235	S	78.6	Confident	75.1	Confident	49 Å²	49	82.1 Å²	82.1	34%	0.343	38%	0.38	S	S	.	.	S	Bend	trans	-79.9	141.4	-175.9	58.4	0	0	0	0	112.9	K267	S235-K267 PolarHBondContact O-NZ 3.26Å
236	P	79.9	Confident	73.9	Confident	58 Å²	58	76.5 Å²	76.5	38%	0.377	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-62.9	147.7	176.5	27.4	-34.6	0	0	0	112.2	C298 V300	P236-C298 CarbonylContact C-O 3.52Å; P236-C298 VanDerWaalsContact CA-O 3.31Å; P236-C298 WeakPolarHBondContact CA-O 3.44Å; P236-C298 HydrophobicContact CB-CB 4.48Å; P236-C298 WeakPolarHBondContact CB-O 3.38Å; P236-V300 HydrophobicContact CB-CG2 3.86Å; P236-V300 HydrophobicContact CG-CG2 3.9Å
237	C	80.2	Confident	72.6	Confident	15 Å²	15	82.8 Å²	82.8	10%	0.101	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	130.2	178.9	-68.4	0	0	0	0	110.8	L260 T263 K267 C298 G299 V300	C237-L260 HydrophobicContact CB-CD1 4.01Å; C237-T263 HydrophobicContact CB-CG2 3.88Å; C237-K267 VanDerWaalsContact SG-CD 3.54Å; C237-C298 PolarHBondContact N-O 3.37Å; C237-G299 CarbonylContact O-C 3.45Å; C237-G299 WeakPolarHBondContact O-CA 3.36Å; C237-V300 PolarHBondContact O-N 2.82Å
238	K	79.7	Confident	71.4	Confident	155 Å²	155	87.1 Å²	87.1	67%	0.674	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	124.7	172.8	-63	-179.9	-177.4	178.3	0	109.4	L302	K238-L302 HydrophobicContact CB-CD1 4.48Å; K238-L302 HydrophobicContact CD-CD1 4.04Å; K238-L302 HydrophobicContact CG-CD1 4.18Å
239	L	78	Confident	70.3	Confident	9 Å²	9	91.2 Å²	91.2	5%	0.047	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141	178.2	-59.4	174.2	0	0	0	110.6	L260 V300 V301 L302 V308	L239-L260 HydrophobicContact CD1-CB 3.92Å; L239-L260 HydrophobicContact CD1-CD1 4.25Å; L239-L260 HydrophobicContact CD2-CB 4.34Å; L239-L260 HydrophobicContact CD2-CD1 4.27Å; L239-V300 PolarHBondContact N-O 2.71Å; L239-V301 HydrophobicContact CB-CG2 4.06Å; L239-V301 HydrophobicContact CD1-CG2 4.04Å; L239-L302 PolarHBondContact O-N 3.06Å; L239-V308 HydrophobicContact CD1-CB 4.48Å
240	E	76.7	Confident	69.4	Low	168 Å²	168	89.5 Å²	89.5	79%	0.785	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-74	139.8	172.1	-66.1	-172.9	167.4	0	0	110.7	L242	E240-L242 PolarHBondContact O-N 3.3Å
241	P	69.7	Low	68.6	Low	74 Å²	74	92 Å²	92	48%	0.481	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-70.4	126.1	178.3	27.8	-31.8	0	0	0	110.6	R243 V301 L302	P241-R243 PolarHBondContact O-N 2.9Å; P241-V301 HydrophobicContact CB-CG1 4.19Å; P241-L302 WeakPolarHBondContact CD-O 3.14Å; P241-L302 WeakPolarHBondContact CG-O 3.44Å
242	L	69.1	Low	68	Low	71 Å²	71	94 Å²	94	37%	0.372	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-67	125.5	175.4	-66.6	168.4	0	0	0	110.5	E240 S244 L255 H256	E240-L242 PolarHBondContact O-N 3.3Å; L242-S244 VanDerWaalsContact C-N 3.32Å; L242-S244 PolarHBondContact O-N 3.49Å; L242-S244 VanDerWaalsContact O-N 3.12Å; L242-L255 HydrophobicContact CD1-CB 3.24Å; L242-L255 HydrophobicContact CD1-CD1 4.22Å; L242-L255 HydrophobicContact CD1-CG 4.36Å; L242-H256 WeakPolarHBondContact CD1-CD2 3.39Å
243	R	63	Low	67.8	Low	253 Å²	253	97.1 Å²	97.1	96%	0.955	49%	0.485	S	S	*	.			trans	-84.4	71.7	175.3	-66.5	-175.8	179.3	178.2	0	110.3	P241	P241-R243 PolarHBondContact O-N 2.9Å
244	S	56.2	Low	67.7	Low	56 Å²	56	101.7 Å²	101.7	39%	0.392	51%	0.506	S	S	.	.			trans	-91.2	111.8	175.4	-45.2	0	0	0	0	110.4	L242 G246 N252	L242-S244 VanDerWaalsContact C-N 3.32Å; L242-S244 PolarHBondContact O-N 3.49Å; L242-S244 VanDerWaalsContact O-N 3.12Å; S244-G246 PolarHBondContact O-N 2.93Å; S244-G246 VanDerWaalsContact O-N 3.16Å; S244-N252 WeakPolarHBondContact CB-OD1 3.46Å; S244-N252 PolarHBondContact OG-OD1 2.95Å
245	R	51.2	Low	67.7	Low	264 Å²	264	103.9 Å²	103.9	100%	0.996	52%	0.516	S	S	*	.			trans	-78.8	81	168.1	-77.9	-176.4	174.6	-179	-1.7	109
246	G	51	Low	67.9	Low	47 Å²	47	102.5 Å²	102.5	49%	0.485	51%	0.505	S	S	.	.	S	Bend	trans	167.2	126.7	176.8	0	0	0	0	0	112	S244 Q248	S244-G246 PolarHBondContact O-N 2.93Å; S244-G246 VanDerWaalsContact O-N 3.16Å; G246-Q248 PolarHBondContact O-N 2.95Å
247	H	48.1	Very low	68.1	Low	199 Å²	199	100.7 Å²	100.7	92%	0.921	49%	0.491	S	S	*	.			trans	-75	81.1	-176.5	-68.1	-4.9	0	0	0	111.9
248	Q	52.8	Low	68.2	Low	105 Å²	105	106.3 Å²	106.3	49%	0.491	51%	0.51	S	S	.	.			trans	-132.1	93.9	159.2	-62.9	-161.7	14.7	0	0	109.3	G246 E251 N252	G246-Q248 PolarHBondContact O-N 2.95Å; Q248-E251 HydrophobicContact CB-CB 4.24Å; Q248-E251 HydrophobicContact CB-CG 4.04Å; Q248-E251 PolarHBondContact OE1-OE1 2.93Å; Q248-E251 PolarHBondContact OE1-OE2 3.43Å; Q248-N252 PolarHBondContact O-N 3.09Å; Q248-N252 PolarHBondContact O-ND2 2.97Å; Q248-N252 VanDerWaalsContact O-ND2 3.13Å
249	Q	57.9	Low	68.3	Low	169 Å²	169	100.9 Å²	100.9	79%	0.79	49%	0.492	S	S	*	.	H	α-helix	trans	-55.4	-37.2	175.5	-72.1	-174.9	-3.4	0	0	115	T253	Q249-T253 PolarHBondContact O-OG1 2.89Å
250	P	61.1	Low	68.6	Low	91 Å²	91	100.5 Å²	100.5	59%	0.591	49%	0.489	S	S	*	.	H	α-helix	trans	-69.1	-42.3	-179.6	24.8	-32.7	0	0	0	112.6	N252 T253 E254	P250-N252 VanDerWaalsContact C-N 3.26Å; P250-N252 PolarHBondContact O-N 2.88Å; P250-T253 WeakPolarHBondContact O-CB 3.3Å; P250-T253 PolarHBondContact O-N 2.86Å; P250-E254 PolarHBondContact O-N 3.42Å
251	E	61.5	Low	68.8	Low	112 Å²	112	94.5 Å²	94.5	52%	0.523	46%	0.463	S	S	.	.	H	α-helix	trans	-60.9	-35.6	179.1	-65.4	-169.1	149.7	0	0	112.3	Q248 T253 E254 L255	Q248-E251 HydrophobicContact CB-CB 4.24Å; Q248-E251 HydrophobicContact CB-CG 4.04Å; Q248-E251 PolarHBondContact OE1-OE1 2.93Å; Q248-E251 PolarHBondContact OE1-OE2 3.43Å; E251-T253 VanDerWaalsContact C-N 3.27Å; E251-T253 PolarHBondContact O-N 3.44Å; E251-E254 PolarHBondContact O-N 3.07Å; E251-L255 WeakPolarHBondContact O-CG 3.32Å; E251-L255 PolarHBondContact O-N 3.39Å; E251-L255 VanDerWaalsContact O-N 3.15Å
252	N	71.2	Confident	69.2	Low	42 Å²	42	95.4 Å²	95.4	23%	0.225	46%	0.459	C	S	.	.	H	α-helix	trans	-65.5	-29.2	176.6	-71.1	-40.8	0	0	0	112.9	S244 Q248 P250 H256	S244-N252 WeakPolarHBondContact CB-OD1 3.46Å; S244-N252 PolarHBondContact OG-OD1 2.95Å; Q248-N252 PolarHBondContact O-N 3.09Å; Q248-N252 PolarHBondContact O-ND2 2.97Å; Q248-N252 VanDerWaalsContact O-ND2 3.13Å; P250-N252 VanDerWaalsContact C-N 3.26Å; P250-N252 PolarHBondContact O-N 2.88Å; N252-H256 WeakPolarHBondContact O-CB 3.42Å; N252-H256 PolarHBondContact O-N 3.32Å; N252-H256 VanDerWaalsContact O-N 3.07Å; N252-H256 PolarHBondContact O-ND1 3.23Å; N252-H256 VanDerWaalsContact O-ND1 3.09Å
253	T	76.3	Confident	69.7	Low	78 Å²	78	93.3 Å²	93.3	48%	0.479	45%	0.449	S	S	.	.	H	α-helix	trans	-72.7	-43.5	179.5	-54.8	0	0	0	0	111	Q249 P250 E251 H256 E257	Q249-T253 PolarHBondContact O-OG1 2.89Å; P250-T253 WeakPolarHBondContact O-CB 3.3Å; P250-T253 PolarHBondContact O-N 2.86Å; E251-T253 VanDerWaalsContact C-N 3.27Å; E251-T253 PolarHBondContact O-N 3.44Å; T253-H256 PolarHBondContact O-N 3.22Å; T253-E257 PolarHBondContact O-N 3.03Å
254	E	79.3	Confident	70.6	Confident	96 Å²	96	81.3 Å²	81.3	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.2	-66.9	-161.1	-167.1	0	0	112.6	P250 E251 E257 R258 R312	P250-E254 PolarHBondContact O-N 3.42Å; E251-E254 PolarHBondContact O-N 3.07Å; E254-E257 PolarHBondContact O-N 2.7Å; E254-R258 WeakPolarHBondContact O-CG 3.05Å; E254-R258 PolarHBondContact O-N 3.26Å; E254-R312 IonicContact OE2-NH2 3.72Å; E254-R312 PolarHBondContact OE2-NH2 2.99Å
255	L	81	Confident	71.8	Confident	70 Å²	70	80.1 Å²	80.1	37%	0.366	39%	0.393	S	S	.	.	H	α-helix	trans	-66.8	-39.5	177.2	-68.1	171.5	0	0	0	111.6	L242 E251 R258 S259	L242-L255 HydrophobicContact CD1-CB 3.24Å; L242-L255 HydrophobicContact CD1-CD1 4.22Å; L242-L255 HydrophobicContact CD1-CG 4.36Å; E251-L255 WeakPolarHBondContact O-CG 3.32Å; E251-L255 PolarHBondContact O-N 3.39Å; E251-L255 VanDerWaalsContact O-N 3.15Å; L255-R258 PolarHBondContact O-N 3.15Å; L255-S259 PolarHBondContact O-N 2.73Å
256	H	82.4	Confident	73.1	Confident	21 Å²	21	71.8 Å²	71.8	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-63.9	-40.4	171.8	-69.8	148.7	0	0	0	111.7	L242 N252 T253 S259 L260 V301 V308	L242-H256 WeakPolarHBondContact CD1-CD2 3.39Å; N252-H256 WeakPolarHBondContact O-CB 3.42Å; N252-H256 PolarHBondContact O-N 3.32Å; N252-H256 VanDerWaalsContact O-N 3.07Å; N252-H256 PolarHBondContact O-ND1 3.23Å; N252-H256 VanDerWaalsContact O-ND1 3.09Å; T253-H256 PolarHBondContact O-N 3.22Å; H256-S259 PolarHBondContact O-N 3.12Å; H256-L260 WeakPolarHBondContact O-CB 3.45Å; H256-L260 PolarHBondContact O-N 2.92Å; H256-V301 HydrophobicContact CB-CG2 4.42Å; H256-V308 HydrophobicContact CB-CG1 4.35Å; H256-V308 HydrophobicContact CB-CG2 4.05Å
257	E	83	Confident	74.7	Confident	20 Å²	20	70.4 Å²	70.4	9%	0.093	34%	0.342	C	S	.	.	H	α-helix	trans	-61.2	-43.6	174.6	-171.5	-174.9	-162.5	0	0	111.3	T253 E254 S259 L260 I261 V308 K311 R312	T253-E257 PolarHBondContact O-N 3.03Å; E254-E257 PolarHBondContact O-N 2.7Å; E257-S259 PolarHBondContact O-N 3.4Å; E257-L260 WeakPolarHBondContact O-CB 3.44Å; E257-L260 PolarHBondContact O-N 3.47Å; E257-I261 HydrophobicContact CG-CD1 4.21Å; E257-I261 WeakPolarHBondContact O-CG1 3.35Å; E257-I261 PolarHBondContact O-N 3.23Å; E257-V308 HydrophobicContact CB-CG1 4.37Å; E257-K311 PolarHBondContact OE1-N 3.17Å; E257-R312 WeakPolarHBondContact OE1-CB 3.34Å; E257-R312 VanDerWaalsContact OE1-CG 3.26Å; E257-R312 WeakPolarHBondContact OE1-CG 3.37Å; E257-R312 PolarHBondContact OE1-N 3.2Å; E257-R312 IonicContact OE1-NE 3.03Å; E257-R312 IonicContact OE2-CZ 3.79Å; E257-R312 IonicContact OE2-NE 3.92Å; E257-R312 PolarHBondContact OE2-NE 3.38Å; E257-R312 IonicContact OE2-NH2 2.85Å
258	R	82.5	Confident	76.5	Confident	133 Å²	133	61.1 Å²	61.1	50%	0.502	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-42.4	175.5	-74	175.9	178.2	175	2	112.3	E254 L255 L260 I261 K262	E254-R258 WeakPolarHBondContact O-CG 3.05Å; E254-R258 PolarHBondContact O-N 3.26Å; L255-R258 PolarHBondContact O-N 3.15Å; R258-L260 VanDerWaalsContact C-N 3.33Å; R258-I261 PolarHBondContact O-N 3.4Å; R258-K262 WeakPolarHBondContact O-CG 3.46Å; R258-K262 PolarHBondContact O-N 3.41Å
259	S	81.8	Confident	78.1	Confident	41 Å²	41	56.1 Å²	56.1	29%	0.287	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-39.1	175.1	-170.7	0	0	0	0	111.8	L255 H256 E257 K262 T263	L255-S259 PolarHBondContact O-N 2.73Å; H256-S259 PolarHBondContact O-N 3.12Å; E257-S259 PolarHBondContact O-N 3.4Å; S259-K262 PolarHBondContact O-N 3.41Å; S259-T263 PolarHBondContact O-N 3.09Å; S259-T263 VanDerWaalsContact O-N 3.11Å; S259-T263 PolarHBondContact O-OG1 3.22Å
260	L	84.1	Confident	79.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-49.9	174	179.7	56.2	0	0	0	111.3	C237 L239 H256 E257 R258 K262 T263 L264 V308 A310	C237-L260 HydrophobicContact CB-CD1 4.01Å; L239-L260 HydrophobicContact CD1-CB 3.92Å; L239-L260 HydrophobicContact CD1-CD1 4.25Å; L239-L260 HydrophobicContact CD2-CB 4.34Å; L239-L260 HydrophobicContact CD2-CD1 4.27Å; H256-L260 WeakPolarHBondContact O-CB 3.45Å; H256-L260 PolarHBondContact O-N 2.92Å; E257-L260 WeakPolarHBondContact O-CB 3.44Å; E257-L260 PolarHBondContact O-N 3.47Å; R258-L260 VanDerWaalsContact C-N 3.33Å; L260-K262 VanDerWaalsContact C-N 3.29Å; L260-K262 PolarHBondContact O-N 3.42Å; L260-T263 CarbonylContact O-C 3.59Å; L260-T263 WeakPolarHBondContact O-CA 3.44Å; L260-T263 PolarHBondContact O-N 3.09Å; L260-L264 HydrophobicContact CD1-CD1 4.01Å; L260-L264 HydrophobicContact CD1-CD2 4.16Å; L260-L264 HydrophobicContact CD1-CG 3.75Å; L260-L264 HydrophobicContact CD2-CD1 4.3Å; L260-L264 HydrophobicContact CG-CD1 3.72Å; L260-L264 HydrophobicContact CG-CG 3.96Å; L260-L264 WeakPolarHBondContact O-CB 3.3Å; L260-L264 WeakPolarHBondContact O-CG 3.5Å; L260-L264 PolarHBondContact O-N 2.71Å; L260-V308 HydrophobicContact CD2-CB 4.22Å; L260-V308 HydrophobicContact CD2-CG1 3.93Å; L260-V308 WeakPolarHBondContact CD2-O 3.36Å; L260-A310 HydrophobicContact CD2-CB 4.03Å; L260-A310 HydrophobicContact CG-CB 4.46Å
261	I	81.7	Confident	81	Confident	43 Å²	43	44 Å²	44	22%	0.221	21%	0.212	C	C	.	.	H	α-helix	trans	-56.5	-44.2	179.6	-68.6	165.4	0	0	0	110.8	E257 R258 T263 L264 L265 R312 M313	E257-I261 HydrophobicContact CG-CD1 4.21Å; E257-I261 WeakPolarHBondContact O-CG1 3.35Å; E257-I261 PolarHBondContact O-N 3.23Å; R258-I261 PolarHBondContact O-N 3.4Å; I261-T263 VanDerWaalsContact C-N 3.32Å; I261-T263 PolarHBondContact O-N 2.97Å; I261-L264 PolarHBondContact O-N 3.15Å; I261-L265 WeakPolarHBondContact O-CG 3.32Å; I261-L265 PolarHBondContact O-N 2.9Å; I261-R312 HydrophobicContact CD1-CB 4.34Å; I261-M313 HydrophobicContact CG1-CG 4.29Å; I261-M313 HydrophobicContact CG1-SD 4.26Å
262	K	77.9	Confident	82.5	Confident	92 Å²	92	38.7 Å²	38.7	40%	0.4	19%	0.187	S	C	.	.	H	α-helix	trans	-58.9	-43.1	175.8	-66.6	-179.7	-170.4	-167.4	0	112.3	R258 S259 L260 T721	R258-K262 WeakPolarHBondContact O-CG 3.46Å; R258-K262 PolarHBondContact O-N 3.41Å; S259-K262 PolarHBondContact O-N 3.41Å; L260-K262 VanDerWaalsContact C-N 3.29Å; L260-K262 PolarHBondContact O-N 3.42Å; K262-T721 HydrophobicContact CD-CG2 4.04Å; K262-T721 HydrophobicContact CG-CG2 4.18Å
263	T	80.6	Confident	83.3	Confident	28 Å²	28	36.7 Å²	36.7	17%	0.172	18%	0.176	C	C	.	.	H	α-helix	trans	-71	-36.5	178.9	-53.2	0	0	0	0	111.9	C237 S259 L260 I261 R266 K267	C237-T263 HydrophobicContact CB-CG2 3.88Å; S259-T263 PolarHBondContact O-N 3.09Å; S259-T263 VanDerWaalsContact O-N 3.11Å; S259-T263 PolarHBondContact O-OG1 3.22Å; L260-T263 CarbonylContact O-C 3.59Å; L260-T263 WeakPolarHBondContact O-CA 3.44Å; L260-T263 PolarHBondContact O-N 3.09Å; I261-T263 VanDerWaalsContact C-N 3.32Å; I261-T263 PolarHBondContact O-N 2.97Å; T263-R266 PolarHBondContact O-N 3.2Å; T263-K267 PolarHBondContact O-N 2.92Å
264	L	82	Confident	84	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-37.3	177	-74.4	176.8	0	0	0	111.4	L260 I261 R266 K267 L268 L297 A310 M313	L260-L264 HydrophobicContact CD1-CD1 4.01Å; L260-L264 HydrophobicContact CD1-CD2 4.16Å; L260-L264 HydrophobicContact CD1-CG 3.75Å; L260-L264 HydrophobicContact CD2-CD1 4.3Å; L260-L264 HydrophobicContact CG-CD1 3.72Å; L260-L264 HydrophobicContact CG-CG 3.96Å; L260-L264 WeakPolarHBondContact O-CB 3.3Å; L260-L264 WeakPolarHBondContact O-CG 3.5Å; L260-L264 PolarHBondContact O-N 2.71Å; I261-L264 PolarHBondContact O-N 3.15Å; L264-R266 PolarHBondContact O-N 3.14Å; L264-K267 HydrophobicContact CD2-CD 4.36Å; L264-K267 CarbonylContact O-C 3.54Å; L264-K267 WeakPolarHBondContact O-CA 3.46Å; L264-K267 WeakPolarHBondContact O-CB 3.31Å; L264-K267 PolarHBondContact O-N 2.77Å; L264-L268 VanDerWaalsContact O-CG 3.25Å; L264-L268 WeakPolarHBondContact O-CG 3.22Å; L264-L268 PolarHBondContact O-N 3.29Å; L264-L297 HydrophobicContact CD1-CB 4.48Å; L264-A310 HydrophobicContact CD1-CB 3.5Å; L264-A310 VanDerWaalsContact CD1-CB 3.5Å; L264-M313 HydrophobicContact CB-SD 4.35Å; L264-M313 HydrophobicContact CD1-SD 3.8Å
265	L	79.9	Confident	84.6	Confident	30 Å²	30	28.6 Å²	28.6	16%	0.157	13%	0.133	C	C	.	.	H	α-helix	trans	-55	-39.4	176.7	-72.2	173.9	0	0	0	112.6	I261 A269 A724	I261-L265 WeakPolarHBondContact O-CG 3.32Å; I261-L265 PolarHBondContact O-N 2.9Å; L265-A269 PolarHBondContact O-N 3.18Å; L265-A724 HydrophobicContact CD1-CB 4.36Å
266	R	79.8	Confident	85.1	Confident	90 Å²	90	25.2 Å²	25.2	34%	0.34	12%	0.115	S	C	.	.	H	α-helix	trans	-62.6	-48.1	171.8	174.9	176.9	67.3	-167.3	0.1	111.4	T263 L264 L268 A269 T270 Q728 H732	T263-R266 PolarHBondContact O-N 3.2Å; L264-R266 PolarHBondContact O-N 3.14Å; R266-L268 VanDerWaalsContact C-N 3.3Å; R266-L268 PolarHBondContact O-N 3.11Å; R266-A269 PolarHBondContact O-N 3.27Å; R266-A269 VanDerWaalsContact O-N 3.16Å; R266-T270 PolarHBondContact O-N 3.01Å; R266-T270 PolarHBondContact O-OG1 3.29Å; R266-T270 VanDerWaalsContact O-OG1 3.1Å; R266-Q728 HydrophobicContact CB-CG 4.15Å; R266-Q728 HydrophobicContact CG-CG 4.46Å; R266-Q728 VanDerWaalsContact CG-OE1 3.25Å; R266-H732 PolarHBondContact O-NE2 3.34Å
267	K	83.9	Confident	85.4	Confident	18 Å²	18	24.3 Å²	24.3	8%	0.078	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-32.2	-178.9	-168.5	174.1	176.8	-163.9	0	113.4	T233 S235 C237 T263 L264 A269 T270 C296	T233-K267 WeakPolarHBondContact O-CE 3.46Å; T233-K267 PolarHBondContact O-NZ 3.31Å; S235-K267 PolarHBondContact O-NZ 3.26Å; C237-K267 VanDerWaalsContact SG-CD 3.54Å; T263-K267 PolarHBondContact O-N 2.92Å; L264-K267 HydrophobicContact CD2-CD 4.36Å; L264-K267 CarbonylContact O-C 3.54Å; L264-K267 WeakPolarHBondContact O-CA 3.46Å; L264-K267 WeakPolarHBondContact O-CB 3.31Å; L264-K267 PolarHBondContact O-N 2.77Å; K267-A269 VanDerWaalsContact C-N 3.3Å; K267-T270 WeakPolarHBondContact CA-OG1 3.29Å; K267-T270 VanDerWaalsContact O-CB 3.25Å; K267-T270 WeakPolarHBondContact O-CB 3.13Å; K267-T270 PolarHBondContact O-N 3.4Å; K267-T270 PolarHBondContact O-OG1 2.87Å; K267-C296 PolarHBondContact NZ-O 3.21Å
268	L	86.3	Confident	85.7	Confident	3 Å²	3	23.5 Å²	23.5	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-72.6	-22	177.1	-67.1	169.5	0	0	0	112.8	L264 R266 P271 L297 M313 L320 P323 F725	L264-L268 VanDerWaalsContact O-CG 3.25Å; L264-L268 WeakPolarHBondContact O-CG 3.22Å; L264-L268 PolarHBondContact O-N 3.29Å; R266-L268 VanDerWaalsContact C-N 3.3Å; R266-L268 PolarHBondContact O-N 3.11Å; L268-P271 VanDerWaalsContact O-CD 3.26Å; L268-P271 WeakPolarHBondContact O-CD 3.33Å; L268-L297 HydrophobicContact CD2-CD2 4.18Å; L268-M313 HydrophobicContact CD1-CE 3.46Å; L268-M313 VanDerWaalsContact CD1-CE 3.46Å; L268-L320 HydrophobicContact CD1-CD2 4.47Å; L268-L320 HydrophobicContact CD2-CD2 3.92Å; L268-P323 HydrophobicContact CB-CB 3.94Å; L268-P323 HydrophobicContact CB-CG 3.88Å; L268-P323 HydrophobicContact CD1-CG 4.37Å; L268-P323 HydrophobicContact CD2-CB 3.63Å; L268-P323 HydrophobicContact CD2-CG 4.04Å; L268-P323 HydrophobicContact CG-CB 4.28Å; L268-P323 HydrophobicContact CG-CG 4.3Å; L268-F725 HydrophobicContact CB-CE2 4.31Å
269	A	86.5	Confident	86.1	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-85.3	-18.1	174.7	0	0	0	0	0	113	L265 R266 K267 F725 Q728 L729	L265-A269 PolarHBondContact O-N 3.18Å; R266-A269 PolarHBondContact O-N 3.27Å; R266-A269 VanDerWaalsContact O-N 3.16Å; K267-A269 VanDerWaalsContact C-N 3.3Å; A269-F725 HydrophobicContact CB-CD2 4.21Å; A269-F725 HydrophobicContact CB-CE2 3.89Å; A269-Q728 HydrophobicContact CB-CB 4.15Å; A269-L729 HydrophobicContact CB-CB 4.27Å; A269-L729 HydrophobicContact CB-CD1 3.93Å
270	T	88.5	Confident	86.3	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.025	8%	0.077	C	C	.	.	H	α-helix	trans	-59.6	-35.2	-178.9	-51.1	0	0	0	0	116	F230 F231 T233 R266 K267 I272 A273 R274 H732	F230-T270 WeakPolarHBondContact O-CG2 3.37Å; F231-T270 VanDerWaalsContact CA-CG2 3.41Å; F231-T270 HydrophobicContact CB-CG2 4.32Å; F231-T270 HydrophobicContact CD1-CG2 4.22Å; T233-T270 HydrophobicContact CG2-CG2 4.42Å; R266-T270 PolarHBondContact O-N 3.01Å; R266-T270 PolarHBondContact O-OG1 3.29Å; R266-T270 VanDerWaalsContact O-OG1 3.1Å; K267-T270 WeakPolarHBondContact CA-OG1 3.29Å; K267-T270 VanDerWaalsContact O-CB 3.25Å; K267-T270 WeakPolarHBondContact O-CB 3.13Å; K267-T270 PolarHBondContact O-N 3.4Å; K267-T270 PolarHBondContact O-OG1 2.87Å; T270-I272 VanDerWaalsContact C-N 3.25Å; T270-I272 PolarHBondContact O-N 2.94Å; T270-I272 VanDerWaalsContact O-N 3.13Å; T270-A273 PolarHBondContact O-N 3.48Å; T270-R274 PolarHBondContact O-N 3.39Å; T270-R274 VanDerWaalsContact O-N 3.08Å; T270-H732 PolarHBondContact OG1-NE2 3.48Å
271	P	91.8	Very high	86.2	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.006	9%	0.088	C	C	.	.	H	α-helix	trans	-55.1	-34.9	-175.6	-29	35.9	0	0	0	115	T233 L268 A273 R274 G275 L295 H326 N327 A330	T233-P271 HydrophobicContact CG2-CG 4.27Å; L268-P271 VanDerWaalsContact O-CD 3.26Å; L268-P271 WeakPolarHBondContact O-CD 3.33Å; P271-A273 PolarHBondContact O-N 3.43Å; P271-R274 PolarHBondContact O-N 3.16Å; P271-G275 PolarHBondContact O-N 3.34Å; P271-L295 HydrophobicContact CG-CD2 4.03Å; P271-H326 HydrophobicContact CB-CB 4.03Å; P271-N327 HydrophobicContact CB-CB 4.29Å; P271-N327 HydrophobicContact CG-CB 4.34Å; P271-A330 VanDerWaalsContact O-CB 3.23Å; P271-A330 WeakPolarHBondContact O-CB 3.37Å
272	I	91.3	Very high	86.1	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-61.4	-46.7	177.2	-59.6	-164.3	0	0	0	111	T270 R274 G275 M276 H326 L729 R780	T270-I272 VanDerWaalsContact C-N 3.25Å; T270-I272 PolarHBondContact O-N 2.94Å; T270-I272 VanDerWaalsContact O-N 3.13Å; I272-R274 VanDerWaalsContact C-N 3.34Å; I272-R274 PolarHBondContact O-N 3.11Å; I272-G275 PolarHBondContact O-N 3.03Å; I272-M276 HydrophobicContact CG2-CE 3.47Å; I272-M276 VanDerWaalsContact CG2-CE 3.47Å; I272-M276 HydrophobicContact CG2-SD 4.25Å; I272-M276 WeakPolarHBondContact O-CG 3.24Å; I272-M276 PolarHBondContact O-N 2.95Å; I272-H326 HydrophobicContact CG1-CB 3.97Å; I272-L729 HydrophobicContact CB-CD1 4.48Å; I272-L729 HydrophobicContact CD1-CD1 3.49Å; I272-L729 VanDerWaalsContact CD1-CD1 3.49Å; I272-L729 HydrophobicContact CD1-CD2 4.39Å; I272-L729 HydrophobicContact CD1-CG 4.24Å; I272-L729 HydrophobicContact CG1-CD1 4.03Å; I272-R780 HydrophobicContact CD1-CB 4.26Å
273	A	89	Confident	85.9	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.8	-38.3	178.7	0	0	0	0	0	112.2	F231 T270 P271 G275 M276 F277 H732	F231-A273 HydrophobicContact CD1-CB 3.87Å; F231-A273 HydrophobicContact CE1-CB 3.38Å; F231-A273 HydrophobicContact CZ-CB 3.83Å; T270-A273 PolarHBondContact O-N 3.48Å; P271-A273 PolarHBondContact O-N 3.43Å; A273-G275 VanDerWaalsContact C-N 3.33Å; A273-G275 PolarHBondContact O-N 3.34Å; A273-M276 WeakPolarHBondContact O-CB 3.2Å; A273-M276 PolarHBondContact O-N 2.88Å; A273-F277 WeakPolarHBondContact O-CB 3.41Å; A273-F277 PolarHBondContact O-N 2.64Å; A273-H732 HydrophobicContact CB-CB 3.85Å; A273-H732 WeakPolarHBondContact CB-O 3.48Å
274	R	91.6	Very high	85.3	Confident	3 Å²	3	19.7 Å²	19.7	1%	0.011	10%	0.096	C	C	.	.	H	α-helix	trans	-61	-43.5	174	-169	-170.4	68.4	-168	-2	111.1	M205 F231 T233 T270 P271 I272 M276 F277 T278 N327	M205-R274 HydrophobicContact CG-CG 3.88Å; M205-R274 HydrophobicContact SD-CG 3.97Å; F231-R274 HydrophobicContact CB-CB 4.41Å; T233-R274 PolarHBondContact OG1-NH1 3.41Å; T233-R274 VanDerWaalsContact OG1-NH1 3.12Å; T270-R274 PolarHBondContact O-N 3.39Å; T270-R274 VanDerWaalsContact O-N 3.08Å; P271-R274 PolarHBondContact O-N 3.16Å; I272-R274 VanDerWaalsContact C-N 3.34Å; I272-R274 PolarHBondContact O-N 3.11Å; R274-M276 VanDerWaalsContact C-N 3.34Å; R274-M276 PolarHBondContact O-N 3.24Å; R274-F277 PolarHBondContact O-N 3.03Å; R274-T278 HydrophobicContact CG-CG2 4.32Å; R274-T278 WeakPolarHBondContact O-CB 3.43Å; R274-T278 WeakPolarHBondContact O-CG2 3.34Å; R274-T278 PolarHBondContact O-N 3.43Å; R274-T278 PolarHBondContact O-OG1 3.41Å; R274-N327 PolarHBondContact NH1-OD1 2.95Å; R274-N327 PolarHBondContact NH2-O 3.08Å; R274-N327 PolarHBondContact NH2-OD1 3.07Å
275	G	91	Very high	84.6	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.4	-39	175.5	0	0	0	0	0	113	P271 I272 A273 L279	P271-G275 PolarHBondContact O-N 3.34Å; I272-G275 PolarHBondContact O-N 3.03Å; A273-G275 VanDerWaalsContact C-N 3.33Å; A273-G275 PolarHBondContact O-N 3.34Å; G275-L279 PolarHBondContact O-N 3.36Å
276	M	91.2	Very high	83.9	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-43.9	173.6	-69	167.7	-178.6	0	0	111.8	I272 A273 R274 L279 M733 G736 L737 L740 G741 Y783	I272-M276 HydrophobicContact CG2-CE 3.47Å; I272-M276 VanDerWaalsContact CG2-CE 3.47Å; I272-M276 HydrophobicContact CG2-SD 4.25Å; I272-M276 WeakPolarHBondContact O-CG 3.24Å; I272-M276 PolarHBondContact O-N 2.95Å; A273-M276 WeakPolarHBondContact O-CB 3.2Å; A273-M276 PolarHBondContact O-N 2.88Å; R274-M276 VanDerWaalsContact C-N 3.34Å; R274-M276 PolarHBondContact O-N 3.24Å; M276-L279 WeakPolarHBondContact O-CB 2.94Å; M276-M733 HydrophobicContact CE-CB 4.31Å; M276-M733 HydrophobicContact CE-CE 3.54Å; M276-M733 HydrophobicContact CE-CG 3.65Å; M276-M733 HydrophobicContact CE-SD 4.22Å; M276-M733 HydrophobicContact SD-CB 4.5Å; M276-M733 HydrophobicContact SD-CG 4.17Å; M276-G736 WeakPolarHBondContact CB-O 3.38Å; M276-L737 HydrophobicContact CE-CD2 4.21Å; M276-L737 HydrophobicContact CE-CG 4.43Å; M276-L737 HydrophobicContact SD-CD2 4.11Å; M276-L737 HydrophobicContact SD-CG 3.98Å; M276-L740 HydrophobicContact CB-CD1 4.18Å; M276-L740 HydrophobicContact CG-CD1 4.46Å; M276-G741 PolarHBondContact O-N 3.48Å; M276-Y783 HydrophobicContact CB-CE2 4.34Å; M276-Y783 HydrophobicContact CE-CD1 3.5Å; M276-Y783 VanDerWaalsContact CE-CD1 3.5Å; M276-Y783 HydrophobicContact CE-CD2 4.41Å; M276-Y783 HydrophobicContact CE-CE1 3.25Å; M276-Y783 HydrophobicContact CE-CE2 4.22Å; M276-Y783 HydrophobicContact CE-CG 4.1Å; M276-Y783 HydrophobicContact CG-CD2 4.28Å; M276-Y783 HydrophobicContact CG-CE1 3.92Å; M276-Y783 HydrophobicContact CG-CE2 3.49Å; M276-Y783 VanDerWaalsContact CG-CE2 3.49Å; M276-Y783 VanDerWaalsContact CG-OH 3.24Å; M276-Y783 WeakPolarHBondContact CG-OH 3.38Å; M276-Y783 PolarHBondContact N-OH 3.08Å
277	F	89.5	Confident	83.3	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-68.4	-43.3	-178.8	175.3	-111.7	0	0	0	112.9	M205 A208 I209 L214 I227 F231 A273 R274 L279 L739 G741 A742	M205-F277 HydrophobicContact CB-CE1 4.49Å; M205-F277 HydrophobicContact CG-CD1 4.42Å; M205-F277 HydrophobicContact SD-CD1 4.19Å; M205-F277 HydrophobicContact SD-CE1 4.37Å; A208-F277 HydrophobicContact CB-CE1 4.06Å; A208-F277 HydrophobicContact CB-CZ 4.48Å; I209-F277 HydrophobicContact CG1-CE1 4.19Å; I209-F277 HydrophobicContact CG1-CZ 4.26Å; L214-F277 HydrophobicContact CD1-CE2 4.47Å; L214-F277 HydrophobicContact CD2-CE2 4.12Å; L214-F277 HydrophobicContact CD2-CZ 3.83Å; I227-F277 HydrophobicContact CG2-CD2 4.36Å; I227-F277 HydrophobicContact CG2-CE1 4.39Å; I227-F277 HydrophobicContact CG2-CE2 4.14Å; I227-F277 HydrophobicContact CG2-CZ 4.16Å; F231-F277 HydrophobicContact CD2-CB 3.94Å; F231-F277 HydrophobicContact CD2-CD1 4.11Å; F231-F277 HydrophobicContact CD2-CG 4.01Å; F231-F277 HydrophobicContact CE2-CB 3.69Å; F231-F277 HydrophobicContact CE2-CD1 4.47Å; F231-F277 HydrophobicContact CE2-CD2 4.33Å; F231-F277 AromaticContact CE2-CG 3.92Å; F231-F277 HydrophobicContact CE2-CG 3.92Å; A273-F277 WeakPolarHBondContact O-CB 3.41Å; A273-F277 PolarHBondContact O-N 2.64Å; R274-F277 PolarHBondContact O-N 3.03Å; F277-L279 VanDerWaalsContact C-N 3.29Å; F277-L279 PolarHBondContact O-N 3.05Å; F277-L739 HydrophobicContact CD2-CB 3.95Å; F277-L739 HydrophobicContact CD2-CD1 4.44Å; F277-G741 CarbonylContact O-C 3.58Å; F277-G741 WeakPolarHBondContact O-CA 3.04Å; F277-A742 HydrophobicContact CE2-CB 4.25Å; F277-A742 PolarHBondContact O-N 3.14Å
278	T	89.1	Confident	82.5	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.012	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	6.8	-177.3	56.8	0	0	0	0	113.7	M205 A208 R274 R280 S281 S334	M205-T278 HydrophobicContact CB-CG2 4.31Å; M205-T278 HydrophobicContact CG-CG2 3.78Å; A208-T278 HydrophobicContact CB-CG2 4.12Å; R274-T278 HydrophobicContact CG-CG2 4.32Å; R274-T278 WeakPolarHBondContact O-CB 3.43Å; R274-T278 WeakPolarHBondContact O-CG2 3.34Å; R274-T278 PolarHBondContact O-N 3.43Å; R274-T278 PolarHBondContact O-OG1 3.41Å; T278-R280 PolarHBondContact O-N 3.11Å; T278-S281 PolarHBondContact O-N 3.2Å; T278-S281 PolarHBondContact O-OG 2.69Å; T278-S281 VanDerWaalsContact O-OG 3.05Å; T278-S334 VanDerWaalsContact O-CA 3.29Å; T278-S334 WeakPolarHBondContact O-CA 3.29Å
279	L	90.3	Very high	81.7	Confident	2 Å²	2	35 Å²	35	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	117.2	-174.2	-178.1	66.9	0	0	0	111.9	G275 M276 F277 S281 L333 L740 Y745 V784 A787	G275-L279 PolarHBondContact O-N 3.36Å; M276-L279 WeakPolarHBondContact O-CB 2.94Å; F277-L279 VanDerWaalsContact C-N 3.29Å; F277-L279 PolarHBondContact O-N 3.05Å; L279-S281 VanDerWaalsContact C-N 3.25Å; L279-S281 PolarHBondContact O-N 3.28Å; L279-L333 HydrophobicContact CD1-CB 4.15Å; L279-L333 HydrophobicContact CD1-CD2 4.32Å; L279-L740 HydrophobicContact CD2-CD1 4.02Å; L279-L740 HydrophobicContact CD2-CG 4.29Å; L279-Y745 HydrophobicContact CD2-CD1 4.24Å; L279-Y745 HydrophobicContact CD2-CD2 4.42Å; L279-Y745 HydrophobicContact CD2-CG 4.09Å; L279-V784 HydrophobicContact CD1-CG1 4.09Å; L279-V784 HydrophobicContact CD1-CG2 4.16Å; L279-A787 HydrophobicContact CD2-CB 3.81Å
280	R	86.8	Confident	81.2	Confident	38 Å²	38	36.5 Å²	36.5	14%	0.143	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	32	173.5	-60.7	167.5	171.3	168.9	6.8	114.2	T278 L333 S334 Q336 P337 N386 Y745 A787	T278-R280 PolarHBondContact O-N 3.11Å; R280-L333 PolarHBondContact N-O 2.98Å; R280-S334 CarbonylContact C-O 3.08Å; R280-S334 VanDerWaalsContact C-O 3.27Å; R280-S334 VanDerWaalsContact CA-O 3.22Å; R280-S334 WeakPolarHBondContact CA-O 3.36Å; R280-S334 PolarHBondContact N-O 2.97Å; R280-Q336 WeakPolarHBondContact O-CG 3.46Å; R280-P337 HydrophobicContact CG-CG 4.47Å; R280-N386 PolarHBondContact NE-OD1 3.08Å; R280-Y745 HydrophobicContact CB-CE2 4.13Å; R280-Y745 WeakPolarHBondContact CB-OH 2.99Å; R280-Y745 WeakPolarHBondContact CD-OH 3.39Å; R280-A787 PolarHBondContact NH1-O 3.38Å
281	S	82.6	Confident	80.5	Confident	32 Å²	32	39.4 Å²	39.4	22%	0.224	23%	0.225	C	C	.	.			trans	-80.3	-30.2	175.9	62	0	0	0	0	113.5	T278 L279 S334	T278-S281 PolarHBondContact O-N 3.2Å; T278-S281 PolarHBondContact O-OG 2.69Å; T278-S281 VanDerWaalsContact O-OG 3.05Å; L279-S281 VanDerWaalsContact C-N 3.25Å; L279-S281 PolarHBondContact O-N 3.28Å; S281-S334 PolarHBondContact N-O 2.98Å
282	V	78.5	Confident	80	Confident	23 Å²	23	40.8 Å²	40.8	14%	0.139	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-95.2	131	-167.9	-178.5	0	0	0	0	113.1	E207 S334 Q336	E207-V282 HydrophobicContact CB-CG2 4.27Å; E207-V282 HydrophobicContact CG-CG2 4.44Å; E207-V282 WeakPolarHBondContact OE2-CA 3.35Å; E207-V282 WeakPolarHBondContact OE2-CG2 3.27Å; V282-S334 PolarHBondContact N-O 3.2Å; V282-Q336 PolarHBondContact O-N 3.41Å
283	H	73.5	Confident	79.7	Confident	124 Å²	124	40.9 Å²	40.9	57%	0.574	23%	0.233	S	C	*	.			trans	-92.9	111.3	168.2	-60.2	87.9	0	0	0	108.5	G285 Q336	H283-G285 PolarHBondContact O-N 3.28Å; H283-Q336 VanDerWaalsContact CD2-CD 3.42Å; H283-Q336 PolarHBondContact CD2-NE2 3.32Å; H283-Q336 PolarHBondContact CD2-OE1 3.44Å; H283-Q336 VanDerWaalsContact CD2-OE1 3.24Å; H283-Q336 PolarHBondContact CE1-NE2 2.85Å; H283-Q336 VanDerWaalsContact NE2-CD 3.33Å; H283-Q336 PolarHBondContact NE2-NE2 3.25Å; H283-Q336 PolarHBondContact NE2-OE1 3.05Å
284	P	68.2	Low	79.3	Confident	39 Å²	39	49.2 Å²	49.2	25%	0.253	27%	0.269	S	S	.	.			trans	-70.5	121.5	-176.5	29.9	-34.4	0	0	0	110.1	I335	P284-I335 HydrophobicContact CB-CG2 4.29Å; P284-I335 HydrophobicContact CG-CG2 3.73Å
285	G	67.1	Low	78.9	Confident	23 Å²	23	50.3 Å²	50.3	24%	0.237	28%	0.275	C	S	.	.			trans	-64.9	146	165.3	0	0	0	0	0	110.9	H283 T287 E288	H283-G285 PolarHBondContact O-N 3.28Å; G285-T287 PolarHBondContact O-N 3.05Å; G285-E288 PolarHBondContact O-N 2.49Å
286	C	64.5	Low	78.4	Confident	71 Å²	71	51.6 Å²	51.6	48%	0.48	28%	0.283	S	S	.	.	S	Bend	trans	-62.5	-32.3	-178.6	-70.6	0	0	0	0	113	F353	C286-F353 HydrophobicContact CB-CE2 3.72Å; C286-F353 HydrophobicContact CB-CZ 4.18Å; C286-F353 VanDerWaalsContact O-CE2 3.24Å; C286-F353 WeakPolarHBondContact O-CE2 3.31Å; C286-F353 WeakPolarHBondContact O-CZ 3.4Å
287	T	68.2	Low	77.9	Confident	132 Å²	132	52.5 Å²	52.5	81%	0.81	29%	0.288	S	S	*	.	S	Bend	trans	-100.3	-8.8	-175.6	51.1	0	0	0	0	113.6	G285	G285-T287 PolarHBondContact O-N 3.05Å
288	E	67.6	Low	77.6	Confident	105 Å²	105	53.5 Å²	53.5	49%	0.491	30%	0.295	S	S	.	.			trans	-86.2	137.9	-171.7	-68	-176.9	175	0	0	111.4	G285 W357	G285-E288 PolarHBondContact O-N 2.49Å; E288-W357 PolarHBondContact O-NE1 3.05Å
289	H	69	Low	77.1	Confident	132 Å²	132	53.4 Å²	53.4	61%	0.611	30%	0.295	S	S	*	.			trans	-77.9	133.3	169.7	-72.3	-70.8	0	0	0	109.6	A291 H360 N361	H289-A291 PolarHBondContact O-N 2.92Å; H289-H360 PolarHBondContact CE1-O 3.16Å; H289-N361 VanDerWaalsContact CA-OD1 3.23Å; H289-N361 WeakPolarHBondContact CA-OD1 3.32Å; H289-N361 PolarHBondContact ND1-OD1 3.27Å
290	L	75.1	Confident	76.8	Confident	33 Å²	33	54.6 Å²	54.6	17%	0.173	30%	0.302	C	S	.	.			trans	-68.8	107.4	172.5	-174	75.1	0	0	0	109	I292 A331 I335 W357 N361 L379	L290-I292 PolarHBondContact O-N 2.82Å; L290-A331 HydrophobicContact CD2-CB 3.99Å; L290-I335 HydrophobicContact CD1-CD1 4.1Å; L290-I335 HydrophobicContact CD1-CG1 4.03Å; L290-I335 HydrophobicContact CD2-CD1 3.95Å; L290-W357 HydrophobicContact CB-CH2 3.91Å; L290-W357 HydrophobicContact CB-CZ2 3.98Å; L290-W357 HydrophobicContact CD2-CH2 4.49Å; L290-N361 PolarHBondContact N-OD1 2.94Å; L290-L379 HydrophobicContact CD2-CD1 3.37Å
291	A	73.7	Confident	76.4	Confident	64 Å²	64	53 Å²	53	53%	0.529	30%	0.296	S	S	.	.			trans	-71.4	95.3	178.3	0	0	0	0	0	110.6	P202 H289 P293	P202-A291 HydrophobicContact CB-CB 4.46Å; H289-A291 PolarHBondContact O-N 2.92Å; A291-P293 VanDerWaalsContact O-CD 3.26Å; A291-P293 WeakPolarHBondContact O-CD 3.38Å
292	I	82.1	Confident	76	Confident	31 Å²	31	54.8 Å²	54.8	16%	0.159	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-68.8	118.6	170.5	-56.4	178.1	0	0	0	108.1	L290 K294 A331 P363 E375 L379	L290-I292 PolarHBondContact O-N 2.82Å; I292-K294 PolarHBondContact O-N 2.98Å; I292-A331 HydrophobicContact CB-CB 4.37Å; I292-A331 HydrophobicContact CG1-CB 3.93Å; I292-A331 HydrophobicContact CG2-CB 4.3Å; I292-P363 HydrophobicContact CD1-CG 4.42Å; I292-E375 HydrophobicContact CD1-CB 4.46Å; I292-L379 HydrophobicContact CD1-CD1 4.34Å
293	P	84.1	Confident	75.7	Confident	3 Å²	3	59 Å²	59	2%	0.019	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-67.8	130.2	-176.3	-21.8	34.9	0	0	0	111.1	P202 D203 C234 A291 L295 N327	P202-P293 WeakPolarHBondContact O-CB 3.23Å; D203-P293 WeakPolarHBondContact O-CG 3.35Å; C234-P293 VanDerWaalsContact SG-CB 3.58Å; A291-P293 VanDerWaalsContact O-CD 3.26Å; A291-P293 WeakPolarHBondContact O-CD 3.38Å; P293-L295 PolarHBondContact O-N 3.16Å; P293-N327 PolarHBondContact O-ND2 3.31Å; P293-N327 PolarHBondContact O-OD1 3.37Å
294	K	81.1	Confident	75.6	Confident	174 Å²	174	61.6 Å²	61.6	76%	0.757	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-66.5	134.3	-176.8	-64.5	-174.1	179	-174.7	0	111.7	C234 I292 C296	C234-K294 PolarHBondContact SG-O 3.27Å; I292-K294 PolarHBondContact O-N 2.98Å; K294-C296 PolarHBondContact O-N 3.32Å
295	L	82.9	Confident	75.8	Confident	27 Å²	27	65.3 Å²	65.3	14%	0.141	36%	0.358	C	S	.	.			trans	-76.2	102.5	170.5	-68.9	175.9	0	0	0	110	T233 P271 P293 L297 P323 R324 N327	T233-L295 HydrophobicContact CG2-CD2 3.89Å; P271-L295 HydrophobicContact CG-CD2 4.03Å; P293-L295 PolarHBondContact O-N 3.16Å; L295-L297 PolarHBondContact O-N 3.15Å; L295-P323 HydrophobicContact CD1-CB 4.27Å; L295-R324 HydrophobicContact CD1-CG 3.93Å; L295-N327 HydrophobicContact CD1-CB 4.06Å; L295-N327 HydrophobicContact CD2-CB 4.29Å; L295-N327 HydrophobicContact CG-CB 4.18Å
296	C	81.6	Confident	76.3	Confident	26 Å²	26	68 Å²	68	18%	0.176	37%	0.367	C	S	.	.			trans	-78.3	116.8	178.5	170.3	0	0	0	0	111.6	T233 C234 K267 K294 C298	T233-C296 PolarHBondContact O-N 3.04Å; T233-C296 VanDerWaalsContact O-N 3.07Å; C234-C296 WeakPolarHBondContact O-CB 3.42Å; K267-C296 PolarHBondContact NZ-O 3.21Å; K294-C296 PolarHBondContact O-N 3.32Å; C296-C298 VanDerWaalsContact C-N 3.34Å
297	L	81.4	Confident	77	Confident	20 Å²	20	68.9 Å²	68.9	11%	0.105	37%	0.366	C	S	.	.			trans	-94.3	17.6	-179.8	-57	176.3	0	0	0	113.5	L264 L268 L295 A310 L320	L264-L297 HydrophobicContact CD1-CB 4.48Å; L268-L297 HydrophobicContact CD2-CD2 4.18Å; L295-L297 PolarHBondContact O-N 3.15Å; L297-A310 PolarHBondContact O-N 3.3Å; L297-L320 HydrophobicContact CD1-CD1 3.55Å; L297-L320 HydrophobicContact CD1-CD2 4.18Å; L297-L320 HydrophobicContact CD2-CD2 3.88Å
298	C	82.2	Confident	77.5	Confident	23 Å²	23	63 Å²	63	16%	0.155	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.2	-175.9	-50.1	0	0	0	0	111.3	P236 C237 C296 L307 V308 H309	P236-C298 CarbonylContact C-O 3.52Å; P236-C298 VanDerWaalsContact CA-O 3.31Å; P236-C298 WeakPolarHBondContact CA-O 3.44Å; P236-C298 HydrophobicContact CB-CB 4.48Å; P236-C298 WeakPolarHBondContact CB-O 3.38Å; C237-C298 PolarHBondContact N-O 3.37Å; C296-C298 VanDerWaalsContact C-N 3.34Å; C298-L307 HydrophobicContact CB-CD1 3.82Å; C298-L307 HydrophobicContact CB-CG 4.5Å; C298-V308 WeakPolarHBondContact CA-O 3.24Å; C298-H309 PolarHBondContact SG-CE1 3.49Å; C298-H309 PolarHBondContact SG-ND1 3.11Å
299	G	79.3	Confident	78.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	149.3	170.3	0	0	0	0	0	111.8	C237 L307 V308	C237-G299 CarbonylContact O-C 3.45Å; C237-G299 WeakPolarHBondContact O-CA 3.36Å; G299-L307 CarbonylContact O-C 3.56Å; G299-L307 WeakPolarHBondContact O-CA 3.48Å; G299-V308 PolarHBondContact N-O 3.33Å; G299-V308 PolarHBondContact O-N 3.32Å
300	V	82.5	Confident	78.7	Confident	27 Å²	27	55.3 Å²	55.3	16%	0.164	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.3	172.3	176.6	0	0	0	0	108.4	P236 C237 L239 L302 L306 L307	P236-V300 HydrophobicContact CB-CG2 3.86Å; P236-V300 HydrophobicContact CG-CG2 3.9Å; C237-V300 PolarHBondContact O-N 2.82Å; L239-V300 PolarHBondContact N-O 2.71Å; V300-L302 HydrophobicContact CG1-CD2 3.97Å; V300-L302 HydrophobicContact CG1-CG 4.42Å; V300-L306 WeakPolarHBondContact CA-O 3.36Å; V300-L307 HydrophobicContact CG2-CD1 3.88Å
301	V	79.4	Confident	78.6	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.024	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.4	174.3	-174.2	0	0	0	0	108.6	L239 P241 H256 K304 N305 L306 V308	L239-V301 HydrophobicContact CB-CG2 4.06Å; L239-V301 HydrophobicContact CD1-CG2 4.04Å; P241-V301 HydrophobicContact CB-CG1 4.19Å; H256-V301 HydrophobicContact CB-CG2 4.42Å; V301-K304 PolarHBondContact O-N 3.43Å; V301-N305 PolarHBondContact O-N 3.4Å; V301-L306 HydrophobicContact CB-CB 4.31Å; V301-L306 PolarHBondContact N-O 3.42Å; V301-L306 PolarHBondContact O-N 2.97Å; V301-V308 HydrophobicContact CG2-CG2 3.81Å
302	L	74.2	Confident	78.6	Confident	69 Å²	69	61.9 Å²	61.9	36%	0.361	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	144.5	177.3	-64.1	175.1	0	0	0	110.2	K238 L239 P241 V300 N305	K238-L302 HydrophobicContact CB-CD1 4.48Å; K238-L302 HydrophobicContact CD-CD1 4.04Å; K238-L302 HydrophobicContact CG-CD1 4.18Å; L239-L302 PolarHBondContact O-N 3.06Å; P241-L302 WeakPolarHBondContact CD-O 3.14Å; P241-L302 WeakPolarHBondContact CG-O 3.44Å; V300-L302 HydrophobicContact CG1-CD2 3.97Å; V300-L302 HydrophobicContact CG1-CG 4.42Å; L302-N305 WeakPolarHBondContact CD2-OD1 3.43Å
303	P	72.8	Confident	77.9	Confident	112 Å²	112	60.7 Å²	60.7	73%	0.727	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.6	-1.2	4.2	35.4	-36	0	0	0	115	N305	P303-N305 PolarHBondContact O-N 2.72Å; P303-N305 VanDerWaalsContact O-N 3.13Å
304	K	69.9	Low	77	Confident	179 Å²	179	65.3 Å²	65.3	78%	0.778	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-7.9	-173.9	-68.1	-176.2	177.8	-178.8	0	114.6	V301 L306	V301-K304 PolarHBondContact O-N 3.43Å; K304-L306 HydrophobicContact CB-CB 4.42Å; K304-L306 PolarHBondContact O-N 3.18Å
305	N	73.6	Confident	76	Confident	117 Å²	117	63 Å²	63	63%	0.626	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	28.5	-171.7	-68.8	-19.5	0	0	0	113.3	V301 L302 P303 L307	V301-N305 PolarHBondContact O-N 3.4Å; L302-N305 WeakPolarHBondContact CD2-OD1 3.43Å; P303-N305 PolarHBondContact O-N 2.72Å; P303-N305 VanDerWaalsContact O-N 3.13Å; N305-L307 PolarHBondContact O-N 3Å
306	L	77.3	Confident	75.3	Confident	80 Å²	80	67.8 Å²	67.8	42%	0.419	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	119	178.9	179.5	69.8	0	0	0	108.4	V300 V301 K304 V308	V300-L306 WeakPolarHBondContact CA-O 3.36Å; V301-L306 HydrophobicContact CB-CB 4.31Å; V301-L306 PolarHBondContact N-O 3.42Å; V301-L306 PolarHBondContact O-N 2.97Å; K304-L306 HydrophobicContact CB-CB 4.42Å; K304-L306 PolarHBondContact O-N 3.18Å; L306-V308 HydrophobicContact CD2-CG2 4.38Å; L306-V308 HydrophobicContact CG-CG2 4.37Å
307	L	79.7	Confident	74.7	Confident	88 Å²	88	68.9 Å²	68.9	46%	0.461	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.3	174.7	-167.6	68.7	0	0	0	109.2	C298 G299 V300 N305 H309	C298-L307 HydrophobicContact CB-CD1 3.82Å; C298-L307 HydrophobicContact CB-CG 4.5Å; G299-L307 CarbonylContact O-C 3.56Å; G299-L307 WeakPolarHBondContact O-CA 3.48Å; V300-L307 HydrophobicContact CG2-CD1 3.88Å; N305-L307 PolarHBondContact O-N 3Å; L307-H309 WeakPolarHBondContact CD2-NE2 3.43Å
308	V	78.7	Confident	74.3	Confident	8 Å²	8	71 Å²	71	5%	0.048	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.5	176.4	-178.5	0	0	0	0	107.1	L239 H256 E257 L260 C298 G299 V301 L306	L239-V308 HydrophobicContact CD1-CB 4.48Å; H256-V308 HydrophobicContact CB-CG1 4.35Å; H256-V308 HydrophobicContact CB-CG2 4.05Å; E257-V308 HydrophobicContact CB-CG1 4.37Å; L260-V308 HydrophobicContact CD2-CB 4.22Å; L260-V308 HydrophobicContact CD2-CG1 3.93Å; L260-V308 WeakPolarHBondContact CD2-O 3.36Å; C298-V308 WeakPolarHBondContact CA-O 3.24Å; G299-V308 PolarHBondContact N-O 3.33Å; G299-V308 PolarHBondContact O-N 3.32Å; V301-V308 HydrophobicContact CG2-CG2 3.81Å; L306-V308 HydrophobicContact CD2-CG2 4.38Å; L306-V308 HydrophobicContact CG-CG2 4.37Å
309	H	81.2	Confident	74.2	Confident	77 Å²	77	71.3 Å²	71.3	36%	0.356	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.3	174.1	-70.4	-93.8	0	0	0	109.6	C298 L307 K311	C298-H309 PolarHBondContact SG-CE1 3.49Å; C298-H309 PolarHBondContact SG-ND1 3.11Å; L307-H309 WeakPolarHBondContact CD2-NE2 3.43Å; H309-K311 HydrophobicContact CB-CG 4.28Å; H309-K311 PolarHBondContact O-N 3.15Å
310	A	79.3	Confident	74.4	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.356	C	S	.	.			trans	-78.8	66.1	173.8	0	0	0	0	0	110.9	L260 L264 L297 R312 M313 E314	L260-A310 HydrophobicContact CD2-CB 4.03Å; L260-A310 HydrophobicContact CG-CB 4.46Å; L264-A310 HydrophobicContact CD1-CB 3.5Å; L264-A310 VanDerWaalsContact CD1-CB 3.5Å; L297-A310 PolarHBondContact O-N 3.3Å; A310-R312 PolarHBondContact O-N 3.46Å; A310-M313 HydrophobicContact CB-CB 4.19Å; A310-M313 HydrophobicContact CB-CG 4.17Å; A310-M313 HydrophobicContact CB-SD 4.16Å; A310-M313 WeakPolarHBondContact O-CB 3.27Å; A310-M313 PolarHBondContact O-N 3.44Å; A310-E314 PolarHBondContact O-N 3.13Å
311	K	74.2	Confident	74.6	Confident	141 Å²	141	74.4 Å²	74.4	61%	0.613	37%	0.365	S	S	*	.	H	α-helix	trans	-55.2	-37.5	-178.2	-66.2	-175.8	178.7	-176.3	0	111.9	E257 H309 M313 E314 L315	E257-K311 PolarHBondContact OE1-N 3.17Å; H309-K311 HydrophobicContact CB-CG 4.28Å; H309-K311 PolarHBondContact O-N 3.15Å; K311-M313 PolarHBondContact O-N 3.14Å; K311-E314 WeakPolarHBondContact O-CB 3.47Å; K311-E314 PolarHBondContact O-N 3.06Å; K311-E314 VanDerWaalsContact O-N 3.15Å; K311-L315 WeakPolarHBondContact O-CG 3.47Å; K311-L315 PolarHBondContact O-N 3.49Å
312	R	72.1	Confident	75.1	Confident	94 Å²	94	74.6 Å²	74.6	36%	0.355	37%	0.365	S	S	.	.	H	α-helix	trans	-60.1	-30.5	175.3	-70.6	176.6	-155.8	-140.6	-1.4	113.7	E254 E257 I261 A310 F316	E254-R312 IonicContact OE2-NH2 3.72Å; E254-R312 PolarHBondContact OE2-NH2 2.99Å; E257-R312 WeakPolarHBondContact OE1-CB 3.34Å; E257-R312 VanDerWaalsContact OE1-CG 3.26Å; E257-R312 WeakPolarHBondContact OE1-CG 3.37Å; E257-R312 PolarHBondContact OE1-N 3.2Å; E257-R312 IonicContact OE1-NE 3.03Å; E257-R312 IonicContact OE2-CZ 3.79Å; E257-R312 IonicContact OE2-NE 3.92Å; E257-R312 PolarHBondContact OE2-NE 3.38Å; E257-R312 IonicContact OE2-NH2 2.85Å; I261-R312 HydrophobicContact CD1-CB 4.34Å; A310-R312 PolarHBondContact O-N 3.46Å; R312-F316 WeakPolarHBondContact O-CD2 3.48Å
313	M	67.7	Low	75.8	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.025	35%	0.348	C	S	.	.	H	α-helix	trans	-78.8	-34.6	176.2	-69.1	-173.2	68.5	0	0	111.9	I261 L264 L268 A310 K311 L315 F316 I319 L320	I261-M313 HydrophobicContact CG1-CG 4.29Å; I261-M313 HydrophobicContact CG1-SD 4.26Å; L264-M313 HydrophobicContact CB-SD 4.35Å; L264-M313 HydrophobicContact CD1-SD 3.8Å; L268-M313 HydrophobicContact CD1-CE 3.46Å; L268-M313 VanDerWaalsContact CD1-CE 3.46Å; A310-M313 HydrophobicContact CB-CB 4.19Å; A310-M313 HydrophobicContact CB-CG 4.17Å; A310-M313 HydrophobicContact CB-SD 4.16Å; A310-M313 WeakPolarHBondContact O-CB 3.27Å; A310-M313 PolarHBondContact O-N 3.44Å; K311-M313 PolarHBondContact O-N 3.14Å; M313-L315 VanDerWaalsContact C-N 3.3Å; M313-F316 CarbonylContact O-C 3.59Å; M313-F316 PolarHBondContact O-N 3.08Å; M313-I319 HydrophobicContact CE-CG2 3.48Å; M313-I319 VanDerWaalsContact CE-CG2 3.48Å; M313-L320 HydrophobicContact CE-CD2 3.79Å
314	E	65.5	Low	76.6	Confident	101 Å²	101	68.8 Å²	68.8	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-35	174.1	-65.6	170.4	179.5	0	0	111.4	A310 K311 F316	A310-E314 PolarHBondContact O-N 3.13Å; K311-E314 WeakPolarHBondContact O-CB 3.47Å; K311-E314 PolarHBondContact O-N 3.06Å; K311-E314 VanDerWaalsContact O-N 3.15Å; E314-F316 PolarHBondContact O-N 3.14Å
315	L	60.1	Low	77.7	Confident	124 Å²	124	60.3 Å²	60.3	65%	0.649	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.1	174.8	-75.6	164.3	0	0	0	113.7	K311 M313	K311-L315 WeakPolarHBondContact O-CG 3.47Å; K311-L315 PolarHBondContact O-N 3.49Å; M313-L315 VanDerWaalsContact C-N 3.3Å
316	F	68.7	Low	78.6	Confident	128 Å²	128	54.8 Å²	54.8	56%	0.561	26%	0.257	S	S	*	.	S	Bend	trans	-125.4	72.8	179	-62.2	-69.7	0	0	0	110.1	R312 M313 E314 N318 I319	R312-F316 WeakPolarHBondContact O-CD2 3.48Å; M313-F316 CarbonylContact O-C 3.59Å; M313-F316 PolarHBondContact O-N 3.08Å; E314-F316 PolarHBondContact O-N 3.14Å; F316-N318 PolarHBondContact O-N 3.29Å; F316-I319 HydrophobicContact CB-CD1 3.79Å; F316-I319 HydrophobicContact CB-CG1 3.92Å; F316-I319 VanDerWaalsContact O-CB 3.26Å; F316-I319 WeakPolarHBondContact O-CB 3.12Å; F316-I319 VanDerWaalsContact O-CG1 3.26Å; F316-I319 WeakPolarHBondContact O-CG1 3.31Å; F316-I319 PolarHBondContact O-N 3.39Å
317	P	68.4	Low	79.3	Confident	49 Å²	49	51 Å²	51	32%	0.318	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-57.7	-27.2	-171.2	23.1	-34.1	0	0	0	113.1	I319 L320	P317-I319 PolarHBondContact O-N 3.18Å; P317-L320 WeakPolarHBondContact O-CB 3.43Å; P317-L320 PolarHBondContact O-N 3.09Å
318	N	74.4	Confident	79.8	Confident	66 Å²	66	46.8 Å²	46.8	35%	0.353	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-62.7	-13.5	177.2	-33.4	-8.3	0	0	0	112.2	F316 L320 Y321 R770	F316-N318 PolarHBondContact O-N 3.29Å; N318-L320 PolarHBondContact O-N 3.45Å; N318-Y321 VanDerWaalsContact CA-CD2 3.41Å; N318-Y321 HydrophobicContact CB-CD2 3.47Å; N318-Y321 VanDerWaalsContact CB-CD2 3.47Å; N318-Y321 HydrophobicContact CB-CE2 3.16Å; N318-Y321 HydrophobicContact CB-CG 4.29Å; N318-Y321 WeakPolarHBondContact OD1-CE2 3.4Å; N318-Y321 VanDerWaalsContact OD1-CZ 3.28Å; N318-Y321 PolarHBondContact OD1-OH 2.54Å; N318-R770 VanDerWaalsContact C-CZ 3.46Å; N318-R770 VanDerWaalsContact CB-NH2 3.3Å; N318-R770 WeakPolarHBondContact O-CG 3.2Å; N318-R770 PolarHBondContact O-NE 3.35Å
319	I	78.9	Confident	80.5	Confident	29 Å²	29	46.4 Å²	46.4	15%	0.149	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-63.9	-31.2	172.3	-67.6	-176.7	0	0	0	110.5	M313 F316 P317 H769 R770	M313-I319 HydrophobicContact CE-CG2 3.48Å; M313-I319 VanDerWaalsContact CE-CG2 3.48Å; F316-I319 HydrophobicContact CB-CD1 3.79Å; F316-I319 HydrophobicContact CB-CG1 3.92Å; F316-I319 VanDerWaalsContact O-CB 3.26Å; F316-I319 WeakPolarHBondContact O-CB 3.12Å; F316-I319 VanDerWaalsContact O-CG1 3.26Å; F316-I319 WeakPolarHBondContact O-CG1 3.31Å; F316-I319 PolarHBondContact O-N 3.39Å; P317-I319 PolarHBondContact O-N 3.18Å; I319-H769 WeakPolarHBondContact CA-CD2 3.47Å; I319-H769 VanDerWaalsContact CA-NE2 3.31Å; I319-H769 WeakPolarHBondContact CA-NE2 3.46Å; I319-H769 WeakPolarHBondContact CB-NE2 3.49Å; I319-H769 WeakPolarHBondContact CG1-NE2 3.48Å; I319-H769 WeakPolarHBondContact CG2-NE2 3.25Å; I319-H769 PolarHBondContact O-CD2 2.67Å; I319-R770 VanDerWaalsContact CG1-NH2 3.31Å
320	L	83.8	Confident	81	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	20%	0.197	C	C	.	.	S	Bend	trans	-94.5	-5.3	-172.6	-60	172.9	0	0	0	113.1	L268 L297 M313 P317 N318 P323 R324	L268-L320 HydrophobicContact CD1-CD2 4.47Å; L268-L320 HydrophobicContact CD2-CD2 3.92Å; L297-L320 HydrophobicContact CD1-CD1 3.55Å; L297-L320 HydrophobicContact CD1-CD2 4.18Å; L297-L320 HydrophobicContact CD2-CD2 3.88Å; M313-L320 HydrophobicContact CE-CD2 3.79Å; P317-L320 WeakPolarHBondContact O-CB 3.43Å; P317-L320 PolarHBondContact O-N 3.09Å; N318-L320 PolarHBondContact O-N 3.45Å; L320-P323 WeakPolarHBondContact O-CD 3.37Å; L320-R324 HydrophobicContact CB-CG 4.22Å; L320-R324 WeakPolarHBondContact O-CB 3.5Å; L320-R324 VanDerWaalsContact O-CG 3.25Å; L320-R324 WeakPolarHBondContact O-CG 3.48Å; L320-R324 PolarHBondContact O-N 3.31Å
321	Y	87.1	Confident	81.5	Confident	88 Å²	88	43.1 Å²	43.1	35%	0.345	20%	0.199	S	C	.	.	H	α-helix	trans	-55.4	-57	-176.2	-69.3	-23.1	0	0	0	113.1	N318 R324 F325 P374	N318-Y321 VanDerWaalsContact CA-CD2 3.41Å; N318-Y321 HydrophobicContact CB-CD2 3.47Å; N318-Y321 VanDerWaalsContact CB-CD2 3.47Å; N318-Y321 HydrophobicContact CB-CE2 3.16Å; N318-Y321 HydrophobicContact CB-CG 4.29Å; N318-Y321 WeakPolarHBondContact OD1-CE2 3.4Å; N318-Y321 VanDerWaalsContact OD1-CZ 3.28Å; N318-Y321 PolarHBondContact OD1-OH 2.54Å; Y321-R324 PolarHBondContact O-N 3.47Å; Y321-F325 VanDerWaalsContact O-CB 3.29Å; Y321-F325 WeakPolarHBondContact O-CB 3.39Å; Y321-F325 PolarHBondContact O-N 2.88Å; Y321-P374 HydrophobicContact CD1-CB 4.41Å; Y321-P374 HydrophobicContact CD1-CG 4.05Å
322	W	90	Very high	82.2	Confident	9 Å²	9	36.4 Å²	36.4	3%	0.034	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-46.9	178.1	-75.7	106.6	0	0	0	113.6	R324 F325 H326 M407 T452 H769 N772 Q777 I778	W322-R324 VanDerWaalsContact C-N 3.32Å; W322-R324 PolarHBondContact O-N 3.31Å; W322-F325 HydrophobicContact CE3-CD1 4.11Å; W322-F325 HydrophobicContact CE3-CG 4.44Å; W322-F325 AromaticContact CZ3-CD1 4Å; W322-F325 HydrophobicContact CZ3-CD1 4Å; W322-F325 HydrophobicContact CZ3-CE1 4.24Å; W322-F325 HydrophobicContact CZ3-CG 4.47Å; W322-F325 WeakPolarHBondContact O-CB 3.06Å; W322-F325 PolarHBondContact O-N 2.93Å; W322-F325 VanDerWaalsContact O-N 3.14Å; W322-H326 AromaticContact CE3-NE2 3.95Å; W322-H326 PolarHBondContact O-CD2 2.98Å; W322-H326 PolarHBondContact O-N 3.07Å; W322-M407 HydrophobicContact CD2-CE 4.18Å; W322-M407 HydrophobicContact CD2-SD 4.49Å; W322-M407 HydrophobicContact CG-CE 4.45Å; W322-M407 HydrophobicContact CZ2-CE 3.98Å; W322-M407 HydrophobicContact CZ2-SD 4.41Å; W322-T452 HydrophobicContact CZ2-CG2 4.15Å; W322-H769 WeakPolarHBondContact CB-O 3.44Å; W322-H769 VanDerWaalsContact CD1-O 3.25Å; W322-N772 VanDerWaalsContact CE2-ND2 3.31Å; W322-N772 WeakPolarHBondContact CZ2-ND2 3.43Å; W322-N772 PolarHBondContact NE1-ND2 2.9Å; W322-N772 VanDerWaalsContact NE1-ND2 3.11Å; W322-Q777 HydrophobicContact CD2-CB 3.84Å; W322-Q777 HydrophobicContact CE3-CB 3.62Å; W322-Q777 HydrophobicContact CH2-CB 4.19Å; W322-Q777 HydrophobicContact CZ2-CB 4.37Å; W322-Q777 HydrophobicContact CZ3-CB 3.82Å; W322-I778 HydrophobicContact CH2-CB 3.81Å; W322-I778 HydrophobicContact CH2-CG2 4.44Å; W322-I778 HydrophobicContact CZ3-CB 3.78Å; W322-I778 VanDerWaalsContact CZ3-N 3.3Å
323	P	89.2	Confident	83.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.2	-42.7	175	-29	35.6	0	0	0	113.9	L268 L295 L320 H326 N327 H769	L268-P323 HydrophobicContact CB-CB 3.94Å; L268-P323 HydrophobicContact CB-CG 3.88Å; L268-P323 HydrophobicContact CD1-CG 4.37Å; L268-P323 HydrophobicContact CD2-CB 3.63Å; L268-P323 HydrophobicContact CD2-CG 4.04Å; L268-P323 HydrophobicContact CG-CB 4.28Å; L268-P323 HydrophobicContact CG-CG 4.3Å; L295-P323 HydrophobicContact CD1-CB 4.27Å; L320-P323 WeakPolarHBondContact O-CD 3.37Å; P323-H326 PolarHBondContact O-N 3.14Å; P323-N327 WeakPolarHBondContact O-CB 3.35Å; P323-N327 PolarHBondContact O-N 3.18Å; P323-H769 HydrophobicContact CG-CB 4.42Å
324	R	89.5	Confident	84	Confident	59 Å²	59	32.1 Å²	32.1	22%	0.223	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-43.6	174.2	-77.6	179.5	177.6	-179.3	-0.6	111.1	L295 L320 Y321 W322 H326 N327 G328 P374 E375	L295-R324 HydrophobicContact CD1-CG 3.93Å; L320-R324 HydrophobicContact CB-CG 4.22Å; L320-R324 WeakPolarHBondContact O-CB 3.5Å; L320-R324 VanDerWaalsContact O-CG 3.25Å; L320-R324 WeakPolarHBondContact O-CG 3.48Å; L320-R324 PolarHBondContact O-N 3.31Å; Y321-R324 PolarHBondContact O-N 3.47Å; W322-R324 VanDerWaalsContact C-N 3.32Å; W322-R324 PolarHBondContact O-N 3.31Å; R324-H326 PolarHBondContact O-N 2.65Å; R324-N327 VanDerWaalsContact O-CB 3.29Å; R324-N327 WeakPolarHBondContact O-CB 3.27Å; R324-N327 PolarHBondContact O-N 2.97Å; R324-N327 VanDerWaalsContact O-N 3.15Å; R324-G328 PolarHBondContact O-N 3Å; R324-P374 HydrophobicContact CB-CB 4.31Å; R324-P374 HydrophobicContact CB-CG 3.73Å; R324-P374 HydrophobicContact CG-CG 4.43Å; R324-E375 HydrophobicContact CB-CG 3.61Å; R324-E375 HydrophobicContact CG-CG 4.06Å; R324-E375 WeakPolarHBondContact O-CG 3.12Å
325	F	92.1	Very high	84.9	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-57.2	-51.4	173.9	-177.3	-85.6	0	0	0	111.5	Y321 W322 N327 G328 V329 P374 G377 G378 F381 M407 I778	Y321-F325 VanDerWaalsContact O-CB 3.29Å; Y321-F325 WeakPolarHBondContact O-CB 3.39Å; Y321-F325 PolarHBondContact O-N 2.88Å; W322-F325 HydrophobicContact CE3-CD1 4.11Å; W322-F325 HydrophobicContact CE3-CG 4.44Å; W322-F325 AromaticContact CZ3-CD1 4Å; W322-F325 HydrophobicContact CZ3-CD1 4Å; W322-F325 HydrophobicContact CZ3-CE1 4.24Å; W322-F325 HydrophobicContact CZ3-CG 4.47Å; W322-F325 WeakPolarHBondContact O-CB 3.06Å; W322-F325 PolarHBondContact O-N 2.93Å; W322-F325 VanDerWaalsContact O-N 3.14Å; F325-N327 PolarHBondContact O-N 3.15Å; F325-G328 PolarHBondContact O-N 3.32Å; F325-G328 VanDerWaalsContact O-N 3.14Å; F325-V329 HydrophobicContact CD1-CG2 3.93Å; F325-V329 HydrophobicContact CE1-CG2 3.57Å; F325-V329 HydrophobicContact CZ-CG2 4.16Å; F325-V329 WeakPolarHBondContact O-CG2 3.2Å; F325-V329 PolarHBondContact O-N 3.21Å; F325-P374 WeakPolarHBondContact CA-O 3.39Å; F325-G377 WeakPolarHBondContact CE2-O 3.39Å; F325-G378 VanDerWaalsContact CD2-N 3.26Å; F325-G378 VanDerWaalsContact CE2-N 3.3Å; F325-G378 WeakPolarHBondContact O-CA 3.49Å; F325-F381 HydrophobicContact CE1-CD1 4.03Å; F325-F381 HydrophobicContact CZ-CB 4.02Å; F325-F381 AromaticContact CZ-CD1 3.95Å; F325-F381 HydrophobicContact CZ-CD1 3.95Å; F325-F381 HydrophobicContact CZ-CG 4.35Å; F325-M407 HydrophobicContact CB-SD 4.36Å; F325-M407 HydrophobicContact CD2-CB 4.18Å; F325-M407 HydrophobicContact CD2-SD 4.09Å; F325-M407 HydrophobicContact CG-SD 4.38Å; F325-I778 HydrophobicContact CE1-CB 4.46Å; F325-I778 HydrophobicContact CE1-CD1 4.23Å; F325-I778 HydrophobicContact CE1-CG1 3.82Å; F325-I778 HydrophobicContact CE2-CD1 4.46Å; F325-I778 HydrophobicContact CZ-CD1 3.63Å; F325-I778 HydrophobicContact CZ-CG1 3.74Å
326	H	93.4	Very high	86	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-32.9	176.6	-62.9	-62.2	0	0	0	112.7	P271 I272 W322 P323 R324 V329 A330 Q777 H781	P271-H326 HydrophobicContact CB-CB 4.03Å; I272-H326 HydrophobicContact CG1-CB 3.97Å; W322-H326 AromaticContact CE3-NE2 3.95Å; W322-H326 PolarHBondContact O-CD2 2.98Å; W322-H326 PolarHBondContact O-N 3.07Å; P323-H326 PolarHBondContact O-N 3.14Å; R324-H326 PolarHBondContact O-N 2.65Å; H326-V329 PolarHBondContact O-N 2.76Å; H326-A330 WeakPolarHBondContact O-CB 3.34Å; H326-A330 PolarHBondContact O-N 3.33Å; H326-Q777 PolarHBondContact NE2-OE1 3.32Å; H326-H781 AromaticContact CE1-NE2 3.91Å; H326-H781 AromaticContact CG-NE2 3.83Å; H326-H781 AromaticContact ND1-CD2 3.75Å; H326-H781 AromaticContact ND1-CE1 3.62Å; H326-H781 AromaticContact ND1-NE2 2.92Å; H326-H781 PolarHBondContact ND1-NE2 2.92Å
327	N	91.5	Very high	86.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.3	-45.2	173.9	-169.3	45.6	0	0	0	112.1	P271 R274 P293 L295 P323 R324 F325 A330 A331 E375	P271-N327 HydrophobicContact CB-CB 4.29Å; P271-N327 HydrophobicContact CG-CB 4.34Å; R274-N327 PolarHBondContact NH1-OD1 2.95Å; R274-N327 PolarHBondContact NH2-O 3.08Å; R274-N327 PolarHBondContact NH2-OD1 3.07Å; P293-N327 PolarHBondContact O-ND2 3.31Å; P293-N327 PolarHBondContact O-OD1 3.37Å; L295-N327 HydrophobicContact CD1-CB 4.06Å; L295-N327 HydrophobicContact CD2-CB 4.29Å; L295-N327 HydrophobicContact CG-CB 4.18Å; P323-N327 WeakPolarHBondContact O-CB 3.35Å; P323-N327 PolarHBondContact O-N 3.18Å; R324-N327 VanDerWaalsContact O-CB 3.29Å; R324-N327 WeakPolarHBondContact O-CB 3.27Å; R324-N327 PolarHBondContact O-N 2.97Å; R324-N327 VanDerWaalsContact O-N 3.15Å; F325-N327 PolarHBondContact O-N 3.15Å; N327-A330 PolarHBondContact O-N 3.12Å; N327-A331 PolarHBondContact O-N 3.12Å; N327-A331 VanDerWaalsContact O-N 3.12Å; N327-E375 PolarHBondContact ND2-OE1 3.14Å
328	G	89.9	Confident	86.6	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63	-43.8	173.7	0	0	0	0	0	113.1	R324 F325 A330 A331 A332 E375	R324-G328 PolarHBondContact O-N 3Å; F325-G328 PolarHBondContact O-N 3.32Å; F325-G328 VanDerWaalsContact O-N 3.14Å; G328-A330 PolarHBondContact O-N 2.75Å; G328-A331 PolarHBondContact O-N 2.99Å; G328-A332 PolarHBondContact O-N 3.03Å; G328-E375 WeakPolarHBondContact CA-O 3.42Å
329	V	93.5	Very high	86.2	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.7	-47.6	175.3	-179.7	0	0	0	0	110.4	F325 H326 A331 A332 L333 G378 F381 H781	F325-V329 HydrophobicContact CD1-CG2 3.93Å; F325-V329 HydrophobicContact CE1-CG2 3.57Å; F325-V329 HydrophobicContact CZ-CG2 4.16Å; F325-V329 WeakPolarHBondContact O-CG2 3.2Å; F325-V329 PolarHBondContact O-N 3.21Å; H326-V329 PolarHBondContact O-N 2.76Å; V329-A331 VanDerWaalsContact C-N 3.29Å; V329-A331 PolarHBondContact O-N 3.1Å; V329-A332 PolarHBondContact O-N 2.9Å; V329-A332 VanDerWaalsContact O-N 3.16Å; V329-L333 HydrophobicContact CG1-CD1 3.71Å; V329-L333 HydrophobicContact CG1-CG 3.87Å; V329-L333 WeakPolarHBondContact O-CB 3.34Å; V329-L333 VanDerWaalsContact O-CG 3.27Å; V329-L333 WeakPolarHBondContact O-CG 3.32Å; V329-L333 PolarHBondContact O-N 3.12Å; V329-G378 VanDerWaalsContact CA-O 3.28Å; V329-G378 WeakPolarHBondContact CA-O 3.25Å; V329-G378 VanDerWaalsContact CG2-CA 3.44Å; V329-G378 WeakPolarHBondContact CG2-O 3.25Å; V329-G378 PolarHBondContact N-O 2.85Å; V329-F381 HydrophobicContact CG1-CD1 4.5Å; V329-F381 HydrophobicContact CG2-CB 4.4Å; V329-F381 HydrophobicContact CG2-CD1 3.89Å; V329-H781 HydrophobicContact CG1-CB 4.15Å
330	A	92.3	Very high	84.9	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-38.1	-179.5	0	0	0	0	0	112.8	P271 H326 N327 G328 S334	P271-A330 VanDerWaalsContact O-CB 3.23Å; P271-A330 WeakPolarHBondContact O-CB 3.37Å; H326-A330 WeakPolarHBondContact O-CB 3.34Å; H326-A330 PolarHBondContact O-N 3.33Å; N327-A330 PolarHBondContact O-N 3.12Å; G328-A330 PolarHBondContact O-N 2.75Å; A330-S334 PolarHBondContact O-N 2.65Å
331	A	88.5	Confident	82.8	Confident	6 Å²	6	36.2 Å²	36.2	5%	0.05	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-47.2	174.1	0	0	0	0	0	111.5	L290 I292 N327 G328 V329 L333 S334	L290-A331 HydrophobicContact CD2-CB 3.99Å; I292-A331 HydrophobicContact CB-CB 4.37Å; I292-A331 HydrophobicContact CG1-CB 3.93Å; I292-A331 HydrophobicContact CG2-CB 4.3Å; N327-A331 PolarHBondContact O-N 3.12Å; N327-A331 VanDerWaalsContact O-N 3.12Å; G328-A331 PolarHBondContact O-N 2.99Å; V329-A331 VanDerWaalsContact C-N 3.29Å; V329-A331 PolarHBondContact O-N 3.1Å; A331-L333 VanDerWaalsContact C-N 3.35Å; A331-L333 PolarHBondContact O-N 3.18Å; A331-S334 WeakPolarHBondContact O-CB 3.49Å; A331-S334 PolarHBondContact O-N 3.19Å; A331-S334 PolarHBondContact O-OG 2.65Å
332	A	88.6	Confident	80.3	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-36.3	178.3	0	0	0	0	0	113.5	G328 V329 S334 I335 L379 L383 N386	G328-A332 PolarHBondContact O-N 3.03Å; V329-A332 PolarHBondContact O-N 2.9Å; V329-A332 VanDerWaalsContact O-N 3.16Å; A332-S334 PolarHBondContact O-N 2.93Å; A332-I335 WeakPolarHBondContact O-CB 3.29Å; A332-I335 PolarHBondContact O-N 3.28Å; A332-L379 HydrophobicContact CB-CD1 3.79Å; A332-L379 HydrophobicContact CB-CG 4.37Å; A332-L379 VanDerWaalsContact CB-O 3.28Å; A332-L379 WeakPolarHBondContact CB-O 3.24Å; A332-L383 HydrophobicContact CB-CG 4.13Å; A332-N386 PolarHBondContact O-ND2 3.19Å
333	L	91.2	Very high	78.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.4	-21.8	178.1	-72.5	-178.2	0	0	0	113.2	L279 R280 V329 A331 I335 L385 Y783 V784	L279-L333 HydrophobicContact CD1-CB 4.15Å; L279-L333 HydrophobicContact CD1-CD2 4.32Å; R280-L333 PolarHBondContact N-O 2.98Å; V329-L333 HydrophobicContact CG1-CD1 3.71Å; V329-L333 HydrophobicContact CG1-CG 3.87Å; V329-L333 WeakPolarHBondContact O-CB 3.34Å; V329-L333 VanDerWaalsContact O-CG 3.27Å; V329-L333 WeakPolarHBondContact O-CG 3.32Å; V329-L333 PolarHBondContact O-N 3.12Å; A331-L333 VanDerWaalsContact C-N 3.35Å; A331-L333 PolarHBondContact O-N 3.18Å; L333-I335 PolarHBondContact O-N 3.47Å; L333-L385 HydrophobicContact CD2-CB 4.1Å; L333-L385 HydrophobicContact CD2-CD1 4.01Å; L333-Y783 WeakPolarHBondContact CD1-OH 3.18Å; L333-V784 HydrophobicContact CD1-CG2 3.64Å; L333-V784 HydrophobicContact CD2-CB 4.29Å; L333-V784 HydrophobicContact CD2-CG1 3.88Å; L333-V784 HydrophobicContact CD2-CG2 3.66Å; L333-V784 HydrophobicContact CG-CG2 4.29Å
334	S	87.6	Confident	75.7	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-25.9	174.8	75.9	0	0	0	0	112.7	T278 R280 S281 V282 A330 A331 A332	T278-S334 VanDerWaalsContact O-CA 3.29Å; T278-S334 WeakPolarHBondContact O-CA 3.29Å; R280-S334 CarbonylContact C-O 3.08Å; R280-S334 VanDerWaalsContact C-O 3.27Å; R280-S334 VanDerWaalsContact CA-O 3.22Å; R280-S334 WeakPolarHBondContact CA-O 3.36Å; R280-S334 PolarHBondContact N-O 2.97Å; S281-S334 PolarHBondContact N-O 2.98Å; V282-S334 PolarHBondContact N-O 3.2Å; A330-S334 PolarHBondContact O-N 2.65Å; A331-S334 WeakPolarHBondContact O-CB 3.49Å; A331-S334 PolarHBondContact O-N 3.19Å; A331-S334 PolarHBondContact O-OG 2.65Å; A332-S334 PolarHBondContact O-N 2.93Å
335	I	85.2	Confident	73.4	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-69.2	138.3	179.5	-56.7	173	0	0	0	110	P284 L290 A332 L333 W357 L383 N386 Y388	P284-I335 HydrophobicContact CB-CG2 4.29Å; P284-I335 HydrophobicContact CG-CG2 3.73Å; L290-I335 HydrophobicContact CD1-CD1 4.1Å; L290-I335 HydrophobicContact CD1-CG1 4.03Å; L290-I335 HydrophobicContact CD2-CD1 3.95Å; A332-I335 WeakPolarHBondContact O-CB 3.29Å; A332-I335 PolarHBondContact O-N 3.28Å; L333-I335 PolarHBondContact O-N 3.47Å; I335-W357 HydrophobicContact CD1-CH2 3.91Å; I335-L383 HydrophobicContact CD1-CD2 3.8Å; I335-N386 PolarHBondContact O-ND2 2.89Å; I335-Y388 HydrophobicContact CG2-CE2 3.81Å
336	Q	82.4	Confident	70.8	Confident	46 Å²	46	66 Å²	66	22%	0.215	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-60.4	149.3	173.4	-78.4	-169.3	7.9	0	0	113.4	R280 V282 H283 Y388	R280-Q336 WeakPolarHBondContact O-CG 3.46Å; V282-Q336 PolarHBondContact O-N 3.41Å; H283-Q336 VanDerWaalsContact CD2-CD 3.42Å; H283-Q336 PolarHBondContact CD2-NE2 3.32Å; H283-Q336 PolarHBondContact CD2-OE1 3.44Å; H283-Q336 VanDerWaalsContact CD2-OE1 3.24Å; H283-Q336 PolarHBondContact CE1-NE2 2.85Å; H283-Q336 VanDerWaalsContact NE2-CD 3.33Å; H283-Q336 PolarHBondContact NE2-NE2 3.25Å; H283-Q336 PolarHBondContact NE2-OE1 3.05Å; Q336-Y388 VanDerWaalsContact O-CE2 3.22Å; Q336-Y388 WeakPolarHBondContact O-CE2 3.24Å; Q336-Y388 PolarHBondContact O-OH 2.85Å
337	P	80.4	Confident	68.6	Low	45 Å²	45	69.2 Å²	69.2	29%	0.292	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-72.5	150.5	-179.1	32.1	-31.8	0	0	0	110.2	R280 K339	R280-P337 HydrophobicContact CG-CG 4.47Å; P337-K339 PolarHBondContact O-N 3.46Å
338	L	69.7	Low	66.4	Low	43 Å²	43	74.6 Å²	74.6	23%	0.225	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-64.4	118.5	176.3	-173.8	73.8	0	0	0	110.3	K340 N386 Y388 R391	L338-K340 PolarHBondContact O-N 3.31Å; L338-N386 PolarHBondContact N-O 2.99Å; L338-Y388 HydrophobicContact CB-CE1 4.28Å; L338-Y388 HydrophobicContact CD1-CD1 4.31Å; L338-Y388 HydrophobicContact CD1-CE1 3.94Å; L338-R391 HydrophobicContact CD2-CG 4.36Å
339	K	65	Low	64.5	Low	141 Å²	141	76.5 Å²	76.5	61%	0.613	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-60.9	134.9	176.3	-70.6	-177.6	-178	175.8	0	110	P337 M341	P337-K339 PolarHBondContact O-N 3.46Å; K339-M341 PolarHBondContact O-N 3.41Å
340	K	52.3	Low	62.5	Low	180 Å²	180	81.7 Å²	81.7	78%	0.783	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-65	119.7	164.3	-73.2	-177.4	178.5	179.6	0	106	L338 D342	L338-K340 PolarHBondContact O-N 3.31Å; K340-D342 PolarHBondContact O-N 2.64Å; K340-D342 VanDerWaalsContact O-N 3.07Å
341	M	39.6	Very low	60.6	Low	129 Å²	129	89.1 Å²	89.1	64%	0.635	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-50.7	116.6	-177	-67.7	-169.2	-161.5	0	0	110.7	K339	K339-M341 PolarHBondContact O-N 3.41Å
342	D	35.4	Very low	58.9	Low	106 Å²	106	93.2 Å²	93.2	57%	0.567	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-70.6	127.5	149.2	-92.5	-34.6	0	0	0	106.8	K340 S344 R345	K340-D342 PolarHBondContact O-N 2.64Å; K340-D342 VanDerWaalsContact O-N 3.07Å; D342-S344 PolarHBondContact O-N 2.99Å; D342-R345 PolarHBondContact O-N 2.69Å
343	K	42.7	Very low	57.6	Low	220 Å²	220	95.1 Å²	95.1	96%	0.957	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	0.2	-171.4	-66.1	177.6	176.6	176.7	0	115
344	S	39.4	Very low	56.4	Low	109 Å²	109	95.4 Å²	95.4	76%	0.762	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-3.6	-170.9	51.8	0	0	0	0	114.9	D342	D342-S344 PolarHBondContact O-N 2.99Å
345	R	41.5	Very low	55.2	Low	153 Å²	153	95.4 Å²	95.4	58%	0.577	48%	0.479	S	S	*	.			trans	-132.6	109.8	172.8	-91.9	176.1	161.1	161.4	-9.6	109.3	D342 D347 E878	D342-R345 PolarHBondContact O-N 2.69Å; R345-D347 VanDerWaalsContact C-N 3.29Å; R345-D347 PolarHBondContact O-N 2.93Å; R345-E878 IonicContact NH1-OE2 2.99Å; R345-E878 PolarHBondContact NH1-OE2 2.89Å
346	E	37.9	Very low	54.2	Low	195 Å²	195	98 Å²	98	91%	0.911	50%	0.498	S	S	*	.			trans	-61.8	96.5	162.4	-67.7	-179.3	168.4	0	0	107.1	P348	E346-P348 WeakPolarHBondContact O-CD 3.5Å
347	D	45.4	Very low	53.6	Low	69 Å²	69	96.9 Å²	96.9	37%	0.369	49%	0.492	S	S	.	.			trans	-61.2	126.1	167.4	-89.2	-25	0	0	0	107	R345 L349	R345-D347 VanDerWaalsContact C-N 3.29Å; R345-D347 PolarHBondContact O-N 2.93Å; D347-L349 PolarHBondContact O-N 2.93Å
348	P	45.6	Very low	53.1	Low	112 Å²	112	94.8 Å²	94.8	73%	0.727	48%	0.478	S	S	*	.	S	Bend	trans	-64.9	-4.4	-175.8	23.9	-32.8	0	0	0	114	E346 D350	E346-P348 WeakPolarHBondContact O-CD 3.5Å; P348-D350 PolarHBondContact O-N 3.16Å
349	L	51.3	Low	52.9	Low	41 Å²	41	95.1 Å²	95.1	22%	0.215	48%	0.484	C	S	.	.			trans	-79.5	72	168.4	-76.8	108.4	0	0	0	110	D347 F353 R391	D347-L349 PolarHBondContact O-N 2.93Å; L349-F353 HydrophobicContact CD2-CD1 3.45Å; L349-F353 VanDerWaalsContact CD2-CD1 3.45Å; L349-F353 HydrophobicContact CD2-CE1 3.63Å; L349-F353 HydrophobicContact CD2-CG 4.21Å; L349-F353 HydrophobicContact CG-CD1 4.24Å; L349-R391 PolarHBondContact O-NH1 2.65Å
350	D	50.7	Low	52.7	Low	109 Å²	109	94.3 Å²	94.3	58%	0.583	48%	0.482	S	S	*	.			trans	-68.4	161.3	176	-146.4	-11.6	0	0	0	111.1	P348 S352 F353	P348-D350 PolarHBondContact O-N 3.16Å; D350-S352 PolarHBondContact O-N 2.88Å; D350-F353 WeakPolarHBondContact O-CB 3.49Å; D350-F353 PolarHBondContact O-N 3.05Å
351	K	52.7	Low	53	Low	156 Å²	156	86.5 Å²	86.5	68%	0.678	45%	0.449	S	S	*	.	H	α-helix	trans	-52.2	-24.3	-172.6	-70.5	173.1	-177.8	168.4	0	114.5
352	S	53	Low	54	Low	93 Å²	93	81.6 Å²	81.6	65%	0.65	43%	0.425	S	S	*	.	H	α-helix	trans	-74.5	-24.7	179	56.8	0	0	0	0	114.1	D350 I354 S356	D350-S352 PolarHBondContact O-N 2.88Å; S352-I354 PolarHBondContact O-N 3.18Å; S352-S356 PolarHBondContact O-N 3.41Å
353	F	61.8	Low	54.8	Low	40 Å²	40	78.3 Å²	78.3	18%	0.175	41%	0.41	C	S	.	.	H	α-helix	trans	-65.9	-43.3	-171.4	179.6	-96.5	0	0	0	112.3	C286 L349 D350 S356 W357	C286-F353 HydrophobicContact CB-CE2 3.72Å; C286-F353 HydrophobicContact CB-CZ 4.18Å; C286-F353 VanDerWaalsContact O-CE2 3.24Å; C286-F353 WeakPolarHBondContact O-CE2 3.31Å; C286-F353 WeakPolarHBondContact O-CZ 3.4Å; L349-F353 HydrophobicContact CD2-CD1 3.45Å; L349-F353 VanDerWaalsContact CD2-CD1 3.45Å; L349-F353 HydrophobicContact CD2-CE1 3.63Å; L349-F353 HydrophobicContact CD2-CG 4.21Å; L349-F353 HydrophobicContact CG-CD1 4.24Å; D350-F353 WeakPolarHBondContact O-CB 3.49Å; D350-F353 PolarHBondContact O-N 3.05Å; F353-S356 PolarHBondContact O-N 3.44Å; F353-W357 HydrophobicContact CD1-CB 4.11Å; F353-W357 HydrophobicContact CE1-CB 3.74Å; F353-W357 AromaticContact CE1-CD1 3.76Å; F353-W357 HydrophobicContact CE1-CD2 4.38Å; F353-W357 AromaticContact CE1-CG 3.68Å; F353-W357 HydrophobicContact CE1-CG 3.68Å; F353-W357 HydrophobicContact CE2-CB 4.36Å; F353-W357 HydrophobicContact CZ-CB 3.87Å; F353-W357 AromaticContact CZ-CD1 3.3Å; F353-W357 AromaticContact CZ-CG 3.68Å; F353-W357 HydrophobicContact CZ-CG 3.68Å; F353-W357 WeakPolarHBondContact O-CB 3.49Å; F353-W357 PolarHBondContact O-N 3.31Å
354	I	64.2	Low	55.3	Low	6 Å²	6	73.1 Å²	73.1	3%	0.031	39%	0.385	C	S	.	.	H	α-helix	trans	-70.9	-41.7	-169.5	-64.9	160.7	0	0	0	111.7	S352 W357 L358 Y388 R391 L392	S352-I354 PolarHBondContact O-N 3.18Å; I354-W357 PolarHBondContact O-N 3.37Å; I354-L358 HydrophobicContact CG2-CD1 3.72Å; I354-L358 HydrophobicContact CG2-CG 4.23Å; I354-L358 WeakPolarHBondContact O-CB 3.08Å; I354-L358 VanDerWaalsContact O-CG 3.25Å; I354-L358 WeakPolarHBondContact O-CG 3.44Å; I354-L358 PolarHBondContact O-N 3.22Å; I354-Y388 HydrophobicContact CD1-CD1 3.75Å; I354-Y388 HydrophobicContact CG1-CD1 4.11Å; I354-R391 HydrophobicContact CD1-CB 3.82Å; I354-R391 VanDerWaalsContact CD1-CD 3.45Å; I354-R391 HydrophobicContact CD1-CG 4.16Å; I354-L392 HydrophobicContact CG2-CD2 4.31Å
355	G	63.2	Low	55.8	Low	9 Å²	9	69.5 Å²	69.5	9%	0.093	36%	0.358	C	S	.	.	H	α-helix	trans	-62.1	-47.1	177.2	0	0	0	0	0	111.8	S359 E396	G355-S359 WeakPolarHBondContact O-CB 3.45Å; G355-S359 PolarHBondContact O-N 3.37Å; G355-S359 PolarHBondContact O-OG 3.43Å; G355-E396 VanDerWaalsContact CA-OE1 3.25Å; G355-E396 WeakPolarHBondContact CA-OE1 3.44Å
356	S	64.7	Low	56	Low	57 Å²	57	72.2 Å²	72.2	40%	0.399	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-49.3	175.5	179.6	0	0	0	0	111.4	S352 F353 L358 S359 H360	S352-S356 PolarHBondContact O-N 3.41Å; F353-S356 PolarHBondContact O-N 3.44Å; S356-L358 VanDerWaalsContact C-N 3.35Å; S356-L358 PolarHBondContact O-N 3.09Å; S356-S359 CarbonylContact O-C 3.21Å; S356-S359 WeakPolarHBondContact O-CA 3.49Å; S356-S359 PolarHBondContact O-N 2.99Å; S356-S359 VanDerWaalsContact O-N 3.08Å; S356-S359 PolarHBondContact O-OG 2.87Å; S356-H360 PolarHBondContact O-CD2 3.48Å; S356-H360 PolarHBondContact O-N 3.47Å; S356-H360 PolarHBondContact OG-CD2 2.83Å; S356-H360 VanDerWaalsContact OG-CD2 3.26Å; S356-H360 PolarHBondContact OG-NE2 3.08Å
357	W	70.1	Confident	56.5	Low	21 Å²	21	71.9 Å²	71.9	8%	0.08	37%	0.373	C	S	.	.	H	α-helix	trans	-62	-39.8	180	-172.5	87.4	0	0	0	112.2	E288 L290 I335 F353 I354 S359 H360 N361 L383	E288-W357 PolarHBondContact O-NE1 3.05Å; L290-W357 HydrophobicContact CB-CH2 3.91Å; L290-W357 HydrophobicContact CB-CZ2 3.98Å; L290-W357 HydrophobicContact CD2-CH2 4.49Å; I335-W357 HydrophobicContact CD1-CH2 3.91Å; F353-W357 HydrophobicContact CD1-CB 4.11Å; F353-W357 HydrophobicContact CE1-CB 3.74Å; F353-W357 AromaticContact CE1-CD1 3.76Å; F353-W357 HydrophobicContact CE1-CD2 4.38Å; F353-W357 AromaticContact CE1-CG 3.68Å; F353-W357 HydrophobicContact CE1-CG 3.68Å; F353-W357 HydrophobicContact CE2-CB 4.36Å; F353-W357 HydrophobicContact CZ-CB 3.87Å; F353-W357 AromaticContact CZ-CD1 3.3Å; F353-W357 AromaticContact CZ-CG 3.68Å; F353-W357 HydrophobicContact CZ-CG 3.68Å; F353-W357 WeakPolarHBondContact O-CB 3.49Å; F353-W357 PolarHBondContact O-N 3.31Å; I354-W357 PolarHBondContact O-N 3.37Å; W357-S359 VanDerWaalsContact C-N 3.35Å; W357-H360 PolarHBondContact O-N 3.36Å; W357-N361 PolarHBondContact NE1-ND2 3.3Å; W357-N361 VanDerWaalsContact NE1-ND2 3.16Å; W357-N361 VanDerWaalsContact O-CB 3.29Å; W357-N361 WeakPolarHBondContact O-CB 3.4Å; W357-N361 PolarHBondContact O-N 2.89Å; W357-N361 PolarHBondContact O-ND2 2.88Å; W357-L383 HydrophobicContact CZ3-CD1 4.23Å; W357-L383 HydrophobicContact CZ3-CD2 4.45Å
358	L	68.6	Low	56.7	Low	2 Å²	2	72.6 Å²	72.6	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-65	-38.9	173.6	-80.9	172.7	0	0	0	112.2	I354 S356 H360 N361 L362 M380 L383 L389 L392	I354-L358 HydrophobicContact CG2-CD1 3.72Å; I354-L358 HydrophobicContact CG2-CG 4.23Å; I354-L358 WeakPolarHBondContact O-CB 3.08Å; I354-L358 VanDerWaalsContact O-CG 3.25Å; I354-L358 WeakPolarHBondContact O-CG 3.44Å; I354-L358 PolarHBondContact O-N 3.22Å; S356-L358 VanDerWaalsContact C-N 3.35Å; S356-L358 PolarHBondContact O-N 3.09Å; L358-H360 VanDerWaalsContact C-N 3.34Å; L358-N361 CarbonylContact O-C 3.58Å; L358-N361 PolarHBondContact O-N 3.4Å; L358-L362 PolarHBondContact O-N 3.46Å; L358-M380 HydrophobicContact CB-CE 4.28Å; L358-M380 HydrophobicContact CD1-CE 4.09Å; L358-M380 HydrophobicContact CD1-SD 4.23Å; L358-M380 HydrophobicContact CD2-CE 3.46Å; L358-M380 VanDerWaalsContact CD2-CE 3.46Å; L358-M380 HydrophobicContact CD2-SD 4.01Å; L358-M380 HydrophobicContact CG-CE 4.15Å; L358-L383 HydrophobicContact CD2-CD1 3.25Å; L358-L383 HydrophobicContact CG-CD1 4.32Å; L358-L389 HydrophobicContact CD1-CD2 4.32Å; L358-L392 HydrophobicContact CD1-CD1 3.89Å; L358-L392 HydrophobicContact CD1-CD2 3.97Å; L358-L392 HydrophobicContact CD1-CG 4.33Å
359	S	65.3	Low	56.6	Low	50 Å²	50	71.4 Å²	71.4	35%	0.35	38%	0.381	S	S	.	.	H	α-helix	trans	-68.3	-34.3	174.6	76.1	0	0	0	0	112.4	G355 S356 W357 L362	G355-S359 WeakPolarHBondContact O-CB 3.45Å; G355-S359 PolarHBondContact O-N 3.37Å; G355-S359 PolarHBondContact O-OG 3.43Å; S356-S359 CarbonylContact O-C 3.21Å; S356-S359 WeakPolarHBondContact O-CA 3.49Å; S356-S359 PolarHBondContact O-N 2.99Å; S356-S359 VanDerWaalsContact O-N 3.08Å; S356-S359 PolarHBondContact O-OG 2.87Å; W357-S359 VanDerWaalsContact C-N 3.35Å; S359-L362 WeakPolarHBondContact O-CD1 3.17Å
360	H	60.8	Low	56.7	Low	124 Å²	124	71.5 Å²	71.5	57%	0.574	39%	0.392	S	S	*	.	H	α-helix	trans	-74.7	-30	174.9	-78.6	-69.1	0	0	0	112.7	H289 S356 W357 L358 L362	H289-H360 PolarHBondContact CE1-O 3.16Å; S356-H360 PolarHBondContact O-CD2 3.48Å; S356-H360 PolarHBondContact O-N 3.47Å; S356-H360 PolarHBondContact OG-CD2 2.83Å; S356-H360 VanDerWaalsContact OG-CD2 3.26Å; S356-H360 PolarHBondContact OG-NE2 3.08Å; W357-H360 PolarHBondContact O-N 3.36Å; L358-H360 VanDerWaalsContact C-N 3.34Å; H360-L362 VanDerWaalsContact C-N 3.34Å
361	N	59.9	Low	57.2	Low	16 Å²	16	69.8 Å²	69.8	9%	0.086	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	18.3	178	-74.6	-78.6	0	0	0	113.4	H289 L290 W357 L358 P363	H289-N361 VanDerWaalsContact CA-OD1 3.23Å; H289-N361 WeakPolarHBondContact CA-OD1 3.32Å; H289-N361 PolarHBondContact ND1-OD1 3.27Å; L290-N361 PolarHBondContact N-OD1 2.94Å; W357-N361 PolarHBondContact NE1-ND2 3.3Å; W357-N361 VanDerWaalsContact NE1-ND2 3.16Å; W357-N361 VanDerWaalsContact O-CB 3.29Å; W357-N361 WeakPolarHBondContact O-CB 3.4Å; W357-N361 PolarHBondContact O-N 2.89Å; W357-N361 PolarHBondContact O-ND2 2.88Å; L358-N361 CarbonylContact O-C 3.58Å; L358-N361 PolarHBondContact O-N 3.4Å; N361-P363 WeakPolarHBondContact O-CD 3.37Å; N361-P363 VanDerWaalsContact O-N 3.11Å
362	L	59.5	Low	58	Low	25 Å²	25	63 Å²	63	13%	0.131	36%	0.357	C	S	.	.			trans	-62	109.1	168.4	-86.6	157.9	0	0	0	108.6	L358 S359 H360 Y364 L372 Y400	L358-L362 PolarHBondContact O-N 3.46Å; S359-L362 WeakPolarHBondContact O-CD1 3.17Å; H360-L362 VanDerWaalsContact C-N 3.34Å; L362-Y364 HydrophobicContact CB-CD2 3.87Å; L362-Y364 HydrophobicContact CB-CE2 3.73Å; L362-Y364 HydrophobicContact CD1-CE2 3.83Å; L362-Y364 HydrophobicContact CG-CE2 4.23Å; L362-Y364 PolarHBondContact O-N 2.85Å; L362-L372 HydrophobicContact CD2-CD2 3.9Å; L362-Y400 HydrophobicContact CD2-CE1 4.3Å
363	P	53.4	Low	59.3	Low	38 Å²	38	58.8 Å²	58.8	25%	0.247	33%	0.328	C	S	.	.			trans	-78.5	78.7	166.9	27.5	-13.3	0	0	0	105.5	I292 N361 T365 S373 H376	I292-P363 HydrophobicContact CD1-CG 4.42Å; N361-P363 WeakPolarHBondContact O-CD 3.37Å; N361-P363 VanDerWaalsContact O-N 3.11Å; P363-T365 PolarHBondContact O-N 3.36Å; P363-T365 VanDerWaalsContact O-N 3.16Å; P363-S373 PolarHBondContact O-OG 3.3Å; P363-H376 WeakPolarHBondContact CD-ND1 3.38Å; P363-H376 HydrophobicContact CG-CB 4.05Å
364	Y	51.9	Low	60.5	Low	111 Å²	111	57.2 Å²	57.2	44%	0.435	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-58.6	119	158	-73.3	-72.2	0	0	0	105.7	L362 K366	L362-Y364 HydrophobicContact CB-CD2 3.87Å; L362-Y364 HydrophobicContact CB-CE2 3.73Å; L362-Y364 HydrophobicContact CD1-CE2 3.83Å; L362-Y364 HydrophobicContact CG-CE2 4.23Å; L362-Y364 PolarHBondContact O-N 2.85Å; Y364-K366 PolarHBondContact O-N 2.98Å
365	T	50.8	Low	61.6	Low	33 Å²	33	58.7 Å²	58.7	20%	0.202	33%	0.328	C	S	.	.			trans	-60.4	98.5	162.5	30.5	0	0	0	0	105.6	P363 E367 E368 T371	P363-T365 PolarHBondContact O-N 3.36Å; P363-T365 VanDerWaalsContact O-N 3.16Å; T365-E367 PolarHBondContact O-N 3.07Å; T365-E368 PolarHBondContact O-N 3.04Å; T365-T371 PolarHBondContact OG1-O 2.89Å
366	K	45.8	Very low	62.7	Low	209 Å²	209	58.3 Å²	58.3	91%	0.909	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-19.2	173.8	-70.7	-173.7	177.4	-177.4	0	111.6	Y364	Y364-K366 PolarHBondContact O-N 2.98Å
367	E	47.8	Very low	63.9	Low	189 Å²	189	55.6 Å²	55.6	88%	0.883	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-15.2	-177.7	-62.1	177.3	-178.5	0	0	114.2	T365	T365-E367 PolarHBondContact O-N 3.07Å
368	E	49.6	Very low	64.9	Low	84 Å²	84	54.6 Å²	54.6	39%	0.393	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	46.8	-174	-63.5	179.7	179.6	0	0	112.8	T365 G370 T371	T365-E368 PolarHBondContact O-N 3.04Å; E368-G370 PolarHBondContact O-N 3.45Å; E368-T371 WeakPolarHBondContact CB-OG1 3.42Å; E368-T371 PolarHBondContact O-N 2.88Å; E368-T371 VanDerWaalsContact O-N 3.09Å; E368-T371 PolarHBondContact O-OG1 3.2Å
369	G	43.8	Very low	65.9	Low	86 Å²	86	54.6 Å²	54.6	89%	0.887	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	21.3	161.9	0	0	0	0	0	116.8
370	G	53.3	Low	67	Low	43 Å²	43	52.2 Å²	52.2	44%	0.443	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	10.5	179.9	0	0	0	0	0	115.3	E368	E368-G370 PolarHBondContact O-N 3.45Å
371	T	60.7	Low	68.5	Low	74 Å²	74	46.3 Å²	46.3	45%	0.454	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-67.6	148.8	168.3	59.6	0	0	0	0	110.6	T365 E368	T365-T371 PolarHBondContact OG1-O 2.89Å; E368-T371 WeakPolarHBondContact CB-OG1 3.42Å; E368-T371 PolarHBondContact O-N 2.88Å; E368-T371 VanDerWaalsContact O-N 3.09Å; E368-T371 PolarHBondContact O-OG1 3.2Å
372	L	71	Confident	70	Confident	14 Å²	14	45.5 Å²	45.5	7%	0.073	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-77.7	136.7	174.2	-64.7	99.8	0	0	0	109.5	L362 H376 Y400 Q403 V408	L362-L372 HydrophobicContact CD2-CD2 3.9Å; L372-H376 VanDerWaalsContact CD2-CD2 3.41Å; L372-H376 WeakPolarHBondContact CD2-CD2 3.34Å; L372-Y400 HydrophobicContact CD2-CD1 4.45Å; L372-Q403 HydrophobicContact CD1-CB 3.75Å; L372-Q403 HydrophobicContact CD1-CG 3.89Å; L372-Q403 VanDerWaalsContact CD2-OE1 3.31Å; L372-V408 HydrophobicContact CB-CG2 3.75Å; L372-V408 HydrophobicContact CD2-CG1 4.4Å; L372-V408 HydrophobicContact CD2-CG2 4.26Å
373	S	79.8	Confident	71.4	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.028	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-70.9	146.5	174	59.9	0	0	0	0	111.2	P363 E375 H376	P363-S373 PolarHBondContact O-OG 3.3Å; S373-E375 PolarHBondContact O-N 3.09Å; S373-E375 VanDerWaalsContact O-N 3.13Å; S373-H376 WeakPolarHBondContact O-CB 3.41Å; S373-H376 PolarHBondContact O-N 3.28Å; S373-H376 PolarHBondContact OG-N 3.49Å
374	P	85.8	Confident	73.2	Confident	7 Å²	7	42.7 Å²	42.7	5%	0.045	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-23.4	169.9	25	-36.7	0	0	0	112.6	Y321 R324 F325 H376 G377 G378 M407	Y321-P374 HydrophobicContact CD1-CB 4.41Å; Y321-P374 HydrophobicContact CD1-CG 4.05Å; R324-P374 HydrophobicContact CB-CB 4.31Å; R324-P374 HydrophobicContact CB-CG 3.73Å; R324-P374 HydrophobicContact CG-CG 4.43Å; F325-P374 WeakPolarHBondContact CA-O 3.39Å; P374-H376 VanDerWaalsContact C-N 3.27Å; P374-H376 PolarHBondContact O-N 3.15Å; P374-G377 PolarHBondContact O-N 3.49Å; P374-G378 PolarHBondContact O-N 3.49Å; P374-G378 VanDerWaalsContact O-N 3.16Å; P374-M407 HydrophobicContact CB-CB 4.13Å; P374-M407 HydrophobicContact CB-CG 4.12Å
375	E	87.9	Confident	75.1	Confident	36 Å²	36	37.9 Å²	37.9	17%	0.168	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-36.8	171.4	-56.8	-166.8	142	0	0	111.5	I292 R324 N327 G328 S373 G378 L379	I292-E375 HydrophobicContact CD1-CB 4.46Å; R324-E375 HydrophobicContact CB-CG 3.61Å; R324-E375 HydrophobicContact CG-CG 4.06Å; R324-E375 WeakPolarHBondContact O-CG 3.12Å; N327-E375 PolarHBondContact ND2-OE1 3.14Å; G328-E375 WeakPolarHBondContact CA-O 3.42Å; S373-E375 PolarHBondContact O-N 3.09Å; S373-E375 VanDerWaalsContact O-N 3.13Å; E375-G378 PolarHBondContact O-N 3.24Å; E375-L379 WeakPolarHBondContact O-CB 3.24Å; E375-L379 PolarHBondContact O-N 3.45Å
376	H	86.8	Confident	76.9	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-39.5	175.8	-169.1	71.4	0	0	0	112.3	P363 L372 S373 P374 G378 L379 M380 Y400	P363-H376 WeakPolarHBondContact CD-ND1 3.38Å; P363-H376 HydrophobicContact CG-CB 4.05Å; L372-H376 VanDerWaalsContact CD2-CD2 3.41Å; L372-H376 WeakPolarHBondContact CD2-CD2 3.34Å; S373-H376 WeakPolarHBondContact O-CB 3.41Å; S373-H376 PolarHBondContact O-N 3.28Å; S373-H376 PolarHBondContact OG-N 3.49Å; P374-H376 VanDerWaalsContact C-N 3.27Å; P374-H376 PolarHBondContact O-N 3.15Å; H376-G378 VanDerWaalsContact C-N 3.29Å; H376-G378 PolarHBondContact O-N 2.76Å; H376-L379 WeakPolarHBondContact O-CB 3.27Å; H376-L379 PolarHBondContact O-N 2.9Å; H376-M380 WeakPolarHBondContact CE1-CE 3.41Å; H376-M380 WeakPolarHBondContact NE2-CE 3.5Å; H376-M380 WeakPolarHBondContact O-CG 3.34Å; H376-M380 PolarHBondContact O-N 3.17Å; H376-Y400 AromaticContact NE2-CE1 3.37Å; H376-Y400 WeakPolarHBondContact NE2-CE1 2.88Å
377	G	88.6	Confident	78.7	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.2	-39.7	174.1	0	0	0	0	0	112.4	F325 P374 M380 F381	F325-G377 WeakPolarHBondContact CE2-O 3.39Å; P374-G377 PolarHBondContact O-N 3.49Å; G377-M380 PolarHBondContact O-N 2.99Å; G377-F381 PolarHBondContact O-N 3.16Å; G377-F381 VanDerWaalsContact O-N 3.11Å
378	G	91.2	Very high	80.4	Confident	0 Å²	0	19 Å²	19	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.8	-43.6	172.7	0	0	0	0	0	112.8	F325 V329 P374 E375 H376 M380 F381 G382	F325-G378 VanDerWaalsContact CD2-N 3.26Å; F325-G378 VanDerWaalsContact CE2-N 3.3Å; F325-G378 WeakPolarHBondContact O-CA 3.49Å; V329-G378 VanDerWaalsContact CA-O 3.28Å; V329-G378 WeakPolarHBondContact CA-O 3.25Å; V329-G378 VanDerWaalsContact CG2-CA 3.44Å; V329-G378 WeakPolarHBondContact CG2-O 3.25Å; V329-G378 PolarHBondContact N-O 2.85Å; P374-G378 PolarHBondContact O-N 3.49Å; P374-G378 VanDerWaalsContact O-N 3.16Å; E375-G378 PolarHBondContact O-N 3.24Å; H376-G378 VanDerWaalsContact C-N 3.29Å; H376-G378 PolarHBondContact O-N 2.76Å; G378-M380 VanDerWaalsContact C-N 3.34Å; G378-M380 PolarHBondContact O-N 3.34Å; G378-F381 PolarHBondContact O-N 3.4Å; G378-G382 PolarHBondContact O-N 2.88Å
379	L	89.5	Confident	82	Confident	2 Å²	2	15 Å²	15	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-57.3	-47.9	176.3	-174.5	79.8	0	0	0	111.2	L290 I292 A332 E375 H376 F381 G382 L383	L290-L379 HydrophobicContact CD2-CD1 3.37Å; I292-L379 HydrophobicContact CD1-CD1 4.34Å; A332-L379 HydrophobicContact CB-CD1 3.79Å; A332-L379 HydrophobicContact CB-CG 4.37Å; A332-L379 VanDerWaalsContact CB-O 3.28Å; A332-L379 WeakPolarHBondContact CB-O 3.24Å; E375-L379 WeakPolarHBondContact O-CB 3.24Å; E375-L379 PolarHBondContact O-N 3.45Å; H376-L379 WeakPolarHBondContact O-CB 3.27Å; H376-L379 PolarHBondContact O-N 2.9Å; L379-F381 PolarHBondContact O-N 3.26Å; L379-G382 PolarHBondContact O-N 3.13Å; L379-L383 HydrophobicContact CG-CD1 4.13Å; L379-L383 WeakPolarHBondContact O-CG 3.36Å; L379-L383 PolarHBondContact O-N 3.45Å
380	M	89.2	Confident	83.8	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.3	-47.2	177.6	-73.7	-62.9	165.9	0	0	111.6	L358 H376 G377 G378 G382 L383 G384 L389 Y400	L358-M380 HydrophobicContact CB-CE 4.28Å; L358-M380 HydrophobicContact CD1-CE 4.09Å; L358-M380 HydrophobicContact CD1-SD 4.23Å; L358-M380 HydrophobicContact CD2-CE 3.46Å; L358-M380 VanDerWaalsContact CD2-CE 3.46Å; L358-M380 HydrophobicContact CD2-SD 4.01Å; L358-M380 HydrophobicContact CG-CE 4.15Å; H376-M380 WeakPolarHBondContact CE1-CE 3.41Å; H376-M380 WeakPolarHBondContact NE2-CE 3.5Å; H376-M380 WeakPolarHBondContact O-CG 3.34Å; H376-M380 PolarHBondContact O-N 3.17Å; G377-M380 PolarHBondContact O-N 2.99Å; G378-M380 VanDerWaalsContact C-N 3.34Å; G378-M380 PolarHBondContact O-N 3.34Å; M380-G382 PolarHBondContact O-N 3.33Å; M380-L383 PolarHBondContact O-N 3.13Å; M380-G384 PolarHBondContact O-N 2.88Å; M380-L389 VanDerWaalsContact O-CD1 3.25Å; M380-L389 WeakPolarHBondContact O-CD1 3.48Å; M380-L389 HydrophobicContact SD-CD2 3.87Å; M380-Y400 HydrophobicContact CE-CE1 3.94Å; M380-Y400 HydrophobicContact CE-CE2 4.13Å; M380-Y400 WeakPolarHBondContact CE-OH 2.91Å
381	F	93.2	Very high	85	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.5	-45.7	178.5	-179.3	-142.6	0	0	0	112.4	F325 V329 G377 G378 L379 L383 G384 L385 G411 L414 I778 H781 L782	F325-F381 HydrophobicContact CE1-CD1 4.03Å; F325-F381 HydrophobicContact CZ-CB 4.02Å; F325-F381 AromaticContact CZ-CD1 3.95Å; F325-F381 HydrophobicContact CZ-CD1 3.95Å; F325-F381 HydrophobicContact CZ-CG 4.35Å; V329-F381 HydrophobicContact CG1-CD1 4.5Å; V329-F381 HydrophobicContact CG2-CB 4.4Å; V329-F381 HydrophobicContact CG2-CD1 3.89Å; G377-F381 PolarHBondContact O-N 3.16Å; G377-F381 VanDerWaalsContact O-N 3.11Å; G378-F381 PolarHBondContact O-N 3.4Å; L379-F381 PolarHBondContact O-N 3.26Å; F381-L383 PolarHBondContact O-N 2.93Å; F381-G384 WeakPolarHBondContact O-CA 3.41Å; F381-G384 PolarHBondContact O-N 3.26Å; F381-G384 VanDerWaalsContact O-N 3.13Å; F381-L385 HydrophobicContact CD1-CD1 4.44Å; F381-L385 HydrophobicContact CD2-CD1 4.37Å; F381-L385 HydrophobicContact CD2-CG 4.29Å; F381-L385 HydrophobicContact CE1-CD1 4.1Å; F381-L385 HydrophobicContact CE2-CD1 3.96Å; F381-L385 HydrophobicContact CE2-CD2 4.07Å; F381-L385 HydrophobicContact CE2-CG 3.87Å; F381-L385 HydrophobicContact CZ-CD1 3.82Å; F381-L385 HydrophobicContact CZ-CD2 4.29Å; F381-L385 HydrophobicContact CZ-CG 4.21Å; F381-L385 PolarHBondContact O-N 2.91Å; F381-G411 WeakPolarHBondContact CA-O 3.24Å; F381-L414 HydrophobicContact CD2-CB 4.24Å; F381-L414 HydrophobicContact CD2-CD2 4.25Å; F381-L414 HydrophobicContact CD2-CG 4.15Å; F381-L414 HydrophobicContact CE1-CD2 4.27Å; F381-L414 HydrophobicContact CE2-CB 4.14Å; F381-L414 HydrophobicContact CE2-CD2 3.52Å; F381-L414 HydrophobicContact CE2-CG 3.54Å; F381-L414 HydrophobicContact CZ-CD2 3.53Å; F381-L414 HydrophobicContact CZ-CG 4.08Å; F381-I778 HydrophobicContact CD1-CD1 4.26Å; F381-I778 HydrophobicContact CD1-CG1 3.8Å; F381-I778 HydrophobicContact CE1-CD1 4.43Å; F381-I778 HydrophobicContact CE1-CG1 3.63Å; F381-I778 VanDerWaalsContact CE1-O 3.3Å; F381-I778 WeakPolarHBondContact CE1-O 2.98Å; F381-I778 HydrophobicContact CG-CD1 4.47Å; F381-I778 HydrophobicContact CG-CG1 4.46Å; F381-I778 HydrophobicContact CZ-CG1 4.24Å; F381-H781 HydrophobicContact CE1-CB 3.72Å; F381-H781 HydrophobicContact CZ-CB 4.31Å; F381-L782 HydrophobicContact CZ-CD2 4.35Å
382	G	91.2	Very high	85.9	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.2	-38.3	177.8	0	0	0	0	0	113.3	G378 L379 M380 G384 L385 N386	G378-G382 PolarHBondContact O-N 2.88Å; L379-G382 PolarHBondContact O-N 3.13Å; M380-G382 PolarHBondContact O-N 3.33Å; G382-G384 VanDerWaalsContact C-N 3.3Å; G382-G384 PolarHBondContact O-N 2.83Å; G382-L385 PolarHBondContact O-N 2.85Å; G382-N386 PolarHBondContact O-N 3.34Å
383	L	89	Confident	86.4	Confident	4 Å²	4	16.7 Å²	16.7	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-66.2	-33.7	173.5	-72	171.9	0	0	0	112.1	A332 I335 W357 L358 L379 M380 F381 N386 G387 Y388 L389	A332-L383 HydrophobicContact CB-CG 4.13Å; I335-L383 HydrophobicContact CD1-CD2 3.8Å; W357-L383 HydrophobicContact CZ3-CD1 4.23Å; W357-L383 HydrophobicContact CZ3-CD2 4.45Å; L358-L383 HydrophobicContact CD2-CD1 3.25Å; L358-L383 HydrophobicContact CG-CD1 4.32Å; L379-L383 HydrophobicContact CG-CD1 4.13Å; L379-L383 WeakPolarHBondContact O-CG 3.36Å; L379-L383 PolarHBondContact O-N 3.45Å; M380-L383 PolarHBondContact O-N 3.13Å; F381-L383 PolarHBondContact O-N 2.93Å; L383-N386 CarbonylContact O-C 3.32Å; L383-N386 PolarHBondContact O-N 2.8Å; L383-G387 PolarHBondContact O-N 3.48Å; L383-G387 VanDerWaalsContact O-N 3.09Å; L383-Y388 HydrophobicContact CD2-CD2 3.93Å; L383-Y388 HydrophobicContact CD2-CG 4.32Å; L383-Y388 PolarHBondContact O-N 3.45Å; L383-L389 HydrophobicContact CB-CD2 4.41Å; L383-L389 HydrophobicContact CB-CG 4.4Å
384	G	90.1	Very high	86.6	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-46.6	171.6	0	0	0	0	0	112.7	M380 F381 G382 N386 G387 G415	M380-G384 PolarHBondContact O-N 2.88Å; F381-G384 WeakPolarHBondContact O-CA 3.41Å; F381-G384 PolarHBondContact O-N 3.26Å; F381-G384 VanDerWaalsContact O-N 3.13Å; G382-G384 VanDerWaalsContact C-N 3.3Å; G382-G384 PolarHBondContact O-N 2.83Å; G384-N386 VanDerWaalsContact C-N 3.26Å; G384-N386 PolarHBondContact O-N 3.16Å; G384-G387 WeakPolarHBondContact O-CA 3.44Å; G384-G387 PolarHBondContact O-N 3.08Å; G384-G415 CarbonylContact C-O 3.43Å; G384-G415 WeakPolarHBondContact CA-O 3.35Å
385	L	91.9	Very high	86.5	Confident	9 Å²	9	24.8 Å²	24.8	5%	0.047	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-33.5	175.1	-69.3	168.2	0	0	0	112.6	L333 F381 G382 G387 A418 H781 V784 L785	L333-L385 HydrophobicContact CD2-CB 4.1Å; L333-L385 HydrophobicContact CD2-CD1 4.01Å; F381-L385 HydrophobicContact CD1-CD1 4.44Å; F381-L385 HydrophobicContact CD2-CD1 4.37Å; F381-L385 HydrophobicContact CD2-CG 4.29Å; F381-L385 HydrophobicContact CE1-CD1 4.1Å; F381-L385 HydrophobicContact CE2-CD1 3.96Å; F381-L385 HydrophobicContact CE2-CD2 4.07Å; F381-L385 HydrophobicContact CE2-CG 3.87Å; F381-L385 HydrophobicContact CZ-CD1 3.82Å; F381-L385 HydrophobicContact CZ-CD2 4.29Å; F381-L385 HydrophobicContact CZ-CG 4.21Å; F381-L385 PolarHBondContact O-N 2.91Å; G382-L385 PolarHBondContact O-N 2.85Å; L385-G387 VanDerWaalsContact C-N 3.3Å; L385-A418 HydrophobicContact CD2-CB 3.82Å; L385-A418 HydrophobicContact CG-CB 4.49Å; L385-H781 HydrophobicContact CD1-CB 4.12Å; L385-V784 HydrophobicContact CB-CB 4.46Å; L385-V784 HydrophobicContact CB-CG1 4.05Å; L385-V784 HydrophobicContact CD1-CB 4.29Å; L385-V784 HydrophobicContact CD1-CG2 4.33Å; L385-V784 HydrophobicContact CD2-CB 4.47Å; L385-L785 HydrophobicContact CD2-CD1 4.35Å; L385-L785 HydrophobicContact CD2-CD2 3.98Å; L385-L785 HydrophobicContact CD2-CG 3.85Å
386	N	88.3	Confident	86.2	Confident	5 Å²	5	25.7 Å²	25.7	3%	0.027	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.9	173.9	-80.8	-24.1	0	0	0	114.2	R280 A332 I335 L338 G382 L383 G384 Y388	R280-N386 PolarHBondContact NE-OD1 3.08Å; A332-N386 PolarHBondContact O-ND2 3.19Å; I335-N386 PolarHBondContact O-ND2 2.89Å; L338-N386 PolarHBondContact N-O 2.99Å; G382-N386 PolarHBondContact O-N 3.34Å; L383-N386 CarbonylContact O-C 3.32Å; L383-N386 PolarHBondContact O-N 2.8Å; G384-N386 VanDerWaalsContact C-N 3.26Å; G384-N386 PolarHBondContact O-N 3.16Å; N386-Y388 HydrophobicContact CB-CD2 3.69Å; N386-Y388 HydrophobicContact CB-CE2 3.79Å
387	G	84.4	Confident	86.2	Confident	8 Å²	8	26 Å²	26	8%	0.082	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	4.5	174	0	0	0	0	0	115.8	L383 G384 L385 R390	L383-G387 PolarHBondContact O-N 3.48Å; L383-G387 VanDerWaalsContact O-N 3.09Å; G384-G387 WeakPolarHBondContact O-CA 3.44Å; G384-G387 PolarHBondContact O-N 3.08Å; L385-G387 VanDerWaalsContact C-N 3.3Å; G387-R390 WeakPolarHBondContact O-CG 3.42Å
388	Y	83.5	Confident	86	Confident	21 Å²	21	30.4 Å²	30.4	8%	0.082	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-70.3	-37.7	-178.7	-71.4	-81.1	0	0	0	112.9	I335 Q336 L338 I354 L383 N386 R390 R391	I335-Y388 HydrophobicContact CG2-CE2 3.81Å; Q336-Y388 VanDerWaalsContact O-CE2 3.22Å; Q336-Y388 WeakPolarHBondContact O-CE2 3.24Å; Q336-Y388 PolarHBondContact O-OH 2.85Å; L338-Y388 HydrophobicContact CB-CE1 4.28Å; L338-Y388 HydrophobicContact CD1-CD1 4.31Å; L338-Y388 HydrophobicContact CD1-CE1 3.94Å; I354-Y388 HydrophobicContact CD1-CD1 3.75Å; I354-Y388 HydrophobicContact CG1-CD1 4.11Å; L383-Y388 HydrophobicContact CD2-CD2 3.93Å; L383-Y388 HydrophobicContact CD2-CG 4.32Å; L383-Y388 PolarHBondContact O-N 3.45Å; N386-Y388 HydrophobicContact CB-CD2 3.69Å; N386-Y388 HydrophobicContact CB-CE2 3.79Å; Y388-R390 PolarHBondContact O-N 2.76Å; Y388-R391 PolarHBondContact O-N 3.14Å; Y388-R391 VanDerWaalsContact O-N 3.12Å
389	L	83.9	Confident	85.7	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-62	-18.8	-178	-66.1	-174.1	0	0	0	113.6	L358 M380 L383 R391 L392 Y397 L412 I416	L358-L389 HydrophobicContact CD1-CD2 4.32Å; M380-L389 VanDerWaalsContact O-CD1 3.25Å; M380-L389 WeakPolarHBondContact O-CD1 3.48Å; M380-L389 HydrophobicContact SD-CD2 3.87Å; L383-L389 HydrophobicContact CB-CD2 4.41Å; L383-L389 HydrophobicContact CB-CG 4.4Å; L389-R391 PolarHBondContact O-N 3.36Å; L389-L392 HydrophobicContact CB-CD1 4.49Å; L389-L392 HydrophobicContact CD2-CD1 3.45Å; L389-L392 VanDerWaalsContact CD2-CD1 3.45Å; L389-L392 PolarHBondContact O-N 3.45Å; L389-Y397 PolarHBondContact O-OH 3.19Å; L389-L412 HydrophobicContact CD1-CD1 4.2Å; L389-I416 HydrophobicContact CB-CG1 4.44Å; L389-I416 HydrophobicContact CD1-CG1 4.28Å
390	R	80.3	Confident	85.3	Confident	128 Å²	128	36.2 Å²	36.2	48%	0.483	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-62	-21.1	176.6	-56	177.4	-164.9	-134.3	-16	113.2	G387 Y388 G419 M420	G387-R390 WeakPolarHBondContact O-CG 3.42Å; Y388-R390 PolarHBondContact O-N 2.76Å; R390-G419 WeakPolarHBondContact CD-O 3.32Å; R390-G419 WeakPolarHBondContact CG-O 3.44Å; R390-G419 VanDerWaalsContact CZ-C 3.43Å; R390-G419 PolarHBondContact NE-O 2.79Å; R390-G419 PolarHBondContact NH1-O 3.3Å; R390-G419 VanDerWaalsContact NH1-O 3.16Å; R390-G419 VanDerWaalsContact NH2-C 3.33Å; R390-G419 PolarHBondContact NH2-O 3.25Å; R390-M420 HydrophobicContact CB-CE 4.26Å; R390-M420 HydrophobicContact CG-CE 4.47Å; R390-M420 HydrophobicContact CG-CG 4.46Å
391	R	78.1	Confident	85.1	Confident	55 Å²	55	37.3 Å²	37.3	21%	0.208	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-93.4	-8.8	-176.6	-70.4	-176	170.7	-173.7	4.6	113.8	L338 L349 I354 Y388 L389	L338-R391 HydrophobicContact CD2-CG 4.36Å; L349-R391 PolarHBondContact O-NH1 2.65Å; I354-R391 HydrophobicContact CD1-CB 3.82Å; I354-R391 VanDerWaalsContact CD1-CD 3.45Å; I354-R391 HydrophobicContact CD1-CG 4.16Å; Y388-R391 PolarHBondContact O-N 3.14Å; Y388-R391 VanDerWaalsContact O-N 3.12Å; L389-R391 PolarHBondContact O-N 3.36Å
392	L	80	Confident	84.7	Confident	14 Å²	14	43.7 Å²	43.7	7%	0.073	22%	0.216	C	C	.	.			trans	-68.9	146.5	177.9	-72.8	172.6	0	0	0	111.5	I354 L358 L389 E396 Y397	I354-L392 HydrophobicContact CG2-CD2 4.31Å; L358-L392 HydrophobicContact CD1-CD1 3.89Å; L358-L392 HydrophobicContact CD1-CD2 3.97Å; L358-L392 HydrophobicContact CD1-CG 4.33Å; L389-L392 HydrophobicContact CB-CD1 4.49Å; L389-L392 HydrophobicContact CD2-CD1 3.45Å; L389-L392 VanDerWaalsContact CD2-CD1 3.45Å; L389-L392 PolarHBondContact O-N 3.45Å; L392-E396 HydrophobicContact CD2-CB 4.33Å; L392-E396 VanDerWaalsContact CD2-OE2 3.32Å; L392-E396 WeakPolarHBondContact CD2-OE2 3.44Å; L392-Y397 HydrophobicContact CB-CD1 4.13Å; L392-Y397 HydrophobicContact CB-CE1 3.42Å; L392-Y397 VanDerWaalsContact CB-CE1 3.42Å; L392-Y397 HydrophobicContact CD1-CD1 4.27Å; L392-Y397 HydrophobicContact CD1-CE1 3.79Å; L392-Y397 HydrophobicContact CG-CE1 4.26Å
393	S	81.9	Confident	84.2	Confident	55 Å²	55	46.9 Å²	46.9	39%	0.385	23%	0.231	S	C	.	.			trans	-80.8	153.3	175.5	67.2	0	0	0	0	111.1	P395 E396 Y397	S393-P395 VanDerWaalsContact C-CD 3.45Å; S393-E396 WeakPolarHBondContact CB-OE2 3.42Å; S393-E396 PolarHBondContact N-OE2 3.43Å; S393-E396 WeakPolarHBondContact O-CB 3.27Å; S393-E396 PolarHBondContact O-N 3.29Å; S393-E396 VanDerWaalsContact O-N 3.07Å; S393-E396 VanDerWaalsContact OG-CG 3.31Å; S393-E396 WeakPolarHBondContact OG-CG 3.44Å; S393-E396 PolarHBondContact OG-OE2 3.07Å; S393-Y397 PolarHBondContact O-N 3.39Å
394	L	82.9	Confident	83.5	Confident	90 Å²	90	51.3 Å²	51.3	47%	0.471	26%	0.261	S	S	.	.	H	α-helix	trans	-55.2	-41.5	179.8	-174.4	64.6	0	0	0	113.6	E396 Y397 H398 V431	L394-E396 VanDerWaalsContact C-N 3.26Å; L394-E396 PolarHBondContact O-N 3.26Å; L394-Y397 HydrophobicContact CD1-CD2 4.19Å; L394-Y397 WeakPolarHBondContact O-CB 3.46Å; L394-Y397 PolarHBondContact O-N 3.02Å; L394-H398 PolarHBondContact O-CD2 2.57Å; L394-H398 PolarHBondContact O-N 3.4Å; L394-H398 VanDerWaalsContact O-N 3.15Å; L394-V431 HydrophobicContact CD1-CG2 3.55Å
395	P	84.1	Confident	83.4	Confident	91 Å²	91	53.3 Å²	53.3	59%	0.591	27%	0.272	S	S	*	.	H	α-helix	trans	-61.3	-32.5	176.4	-23.8	35.3	0	0	0	113.8	S393 H398 K399	S393-P395 VanDerWaalsContact C-CD 3.45Å; P395-H398 PolarHBondContact O-N 3.34Å; P395-K399 PolarHBondContact O-N 3.25Å
396	E	83.1	Confident	83.2	Confident	56 Å²	56	54 Å²	54	26%	0.262	28%	0.277	S	S	.	.	H	α-helix	trans	-67.9	-40.6	177.4	-69.1	166.3	139.2	0	0	110.8	G355 L392 S393 L394 H398 K399 Y400	G355-E396 VanDerWaalsContact CA-OE1 3.25Å; G355-E396 WeakPolarHBondContact CA-OE1 3.44Å; L392-E396 HydrophobicContact CD2-CB 4.33Å; L392-E396 VanDerWaalsContact CD2-OE2 3.32Å; L392-E396 WeakPolarHBondContact CD2-OE2 3.44Å; S393-E396 WeakPolarHBondContact CB-OE2 3.42Å; S393-E396 PolarHBondContact N-OE2 3.43Å; S393-E396 WeakPolarHBondContact O-CB 3.27Å; S393-E396 PolarHBondContact O-N 3.29Å; S393-E396 VanDerWaalsContact O-N 3.07Å; S393-E396 VanDerWaalsContact OG-CG 3.31Å; S393-E396 WeakPolarHBondContact OG-CG 3.44Å; S393-E396 PolarHBondContact OG-OE2 3.07Å; L394-E396 VanDerWaalsContact C-N 3.26Å; L394-E396 PolarHBondContact O-N 3.26Å; E396-H398 VanDerWaalsContact C-N 3.33Å; E396-H398 PolarHBondContact O-N 3.14Å; E396-K399 WeakPolarHBondContact O-CB 3.41Å; E396-K399 PolarHBondContact O-N 3.27Å; E396-Y400 WeakPolarHBondContact O-CD2 3.36Å; E396-Y400 PolarHBondContact O-N 2.87Å
397	Y	85.5	Confident	83.2	Confident	8 Å²	8	54.3 Å²	54.3	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-58	-47.5	171.8	-59.5	-37.3	0	0	0	111.2	L389 L392 S393 L394 K399 Y400 L401 L412 I416 I428	L389-Y397 PolarHBondContact O-OH 3.19Å; L392-Y397 HydrophobicContact CB-CD1 4.13Å; L392-Y397 HydrophobicContact CB-CE1 3.42Å; L392-Y397 VanDerWaalsContact CB-CE1 3.42Å; L392-Y397 HydrophobicContact CD1-CD1 4.27Å; L392-Y397 HydrophobicContact CD1-CE1 3.79Å; L392-Y397 HydrophobicContact CG-CE1 4.26Å; S393-Y397 PolarHBondContact O-N 3.39Å; L394-Y397 HydrophobicContact CD1-CD2 4.19Å; L394-Y397 WeakPolarHBondContact O-CB 3.46Å; L394-Y397 PolarHBondContact O-N 3.02Å; Y397-K399 VanDerWaalsContact C-N 3.3Å; Y397-K399 PolarHBondContact O-N 3.25Å; Y397-Y400 PolarHBondContact O-N 3.5Å; Y397-L401 VanDerWaalsContact O-CG 3.3Å; Y397-L401 WeakPolarHBondContact O-CG 3.38Å; Y397-L401 PolarHBondContact O-N 2.69Å; Y397-L412 HydrophobicContact CD1-CD1 4.12Å; Y397-L412 HydrophobicContact CE1-CD1 4.47Å; Y397-I416 HydrophobicContact CD1-CD1 3.64Å; Y397-I416 HydrophobicContact CD1-CG1 4.36Å; Y397-I416 HydrophobicContact CD2-CD1 4.35Å; Y397-I416 HydrophobicContact CE1-CD1 3.56Å; Y397-I416 HydrophobicContact CE1-CG1 3.8Å; Y397-I416 HydrophobicContact CE2-CD1 4.31Å; Y397-I416 HydrophobicContact CG-CD1 4.04Å; Y397-I428 HydrophobicContact CE2-CD1 4.07Å
398	H	84.4	Confident	83.5	Confident	91 Å²	91	53.9 Å²	53.9	42%	0.421	27%	0.274	S	S	.	.	H	α-helix	trans	-60.2	-38.5	178.6	-74.9	-69.6	0	0	0	112.6	L394 P395 E396 Y400 L401 I402	L394-H398 PolarHBondContact O-CD2 2.57Å; L394-H398 PolarHBondContact O-N 3.4Å; L394-H398 VanDerWaalsContact O-N 3.15Å; P395-H398 PolarHBondContact O-N 3.34Å; E396-H398 VanDerWaalsContact C-N 3.33Å; E396-H398 PolarHBondContact O-N 3.14Å; H398-Y400 VanDerWaalsContact C-N 3.29Å; H398-Y400 PolarHBondContact O-N 2.76Å; H398-L401 PolarHBondContact O-N 3.28Å; H398-I402 WeakPolarHBondContact O-CD1 3.44Å; H398-I402 WeakPolarHBondContact O-CG1 3.27Å; H398-I402 PolarHBondContact O-N 3.03Å
399	K	84.3	Confident	83.9	Confident	112 Å²	112	53 Å²	53	49%	0.487	27%	0.271	S	S	.	.	H	α-helix	trans	-57	-42.5	177	-175.9	-178.9	177	-177.6	0	112.2	P395 E396 Y397	P395-K399 PolarHBondContact O-N 3.25Å; E396-K399 WeakPolarHBondContact O-CB 3.41Å; E396-K399 PolarHBondContact O-N 3.27Å; Y397-K399 VanDerWaalsContact C-N 3.3Å; Y397-K399 PolarHBondContact O-N 3.25Å
400	Y	82	Confident	84.3	Confident	12 Å²	12	53 Å²	53	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-75.6	-38.5	178	-70	-68.2	0	0	0	112.5	L362 L372 H376 M380 E396 Y397 H398 I402 Q403 V408 L412	L362-Y400 HydrophobicContact CD2-CE1 4.3Å; L372-Y400 HydrophobicContact CD2-CD1 4.45Å; H376-Y400 AromaticContact NE2-CE1 3.37Å; H376-Y400 WeakPolarHBondContact NE2-CE1 2.88Å; M380-Y400 HydrophobicContact CE-CE1 3.94Å; M380-Y400 HydrophobicContact CE-CE2 4.13Å; M380-Y400 WeakPolarHBondContact CE-OH 2.91Å; E396-Y400 WeakPolarHBondContact O-CD2 3.36Å; E396-Y400 PolarHBondContact O-N 2.87Å; Y397-Y400 PolarHBondContact O-N 3.5Å; H398-Y400 VanDerWaalsContact C-N 3.29Å; H398-Y400 PolarHBondContact O-N 2.76Å; Y400-I402 VanDerWaalsContact C-N 3.33Å; Y400-I402 PolarHBondContact O-N 2.68Å; Y400-Q403 WeakPolarHBondContact O-CB 3.39Å; Y400-Q403 PolarHBondContact O-N 3.04Å; Y400-V408 HydrophobicContact CD1-CG1 4.46Å; Y400-L412 HydrophobicContact CG-CD2 4.5Å
401	L	85.6	Confident	84.9	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.126	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-32.1	179.9	-66.8	173.7	0	0	0	112.9	Y397 H398 Q403 C404 T409 L412 L413 V431	Y397-L401 VanDerWaalsContact O-CG 3.3Å; Y397-L401 WeakPolarHBondContact O-CG 3.38Å; Y397-L401 PolarHBondContact O-N 2.69Å; H398-L401 PolarHBondContact O-N 3.28Å; L401-Q403 PolarHBondContact O-N 3.41Å; L401-C404 PolarHBondContact O-N 3.04Å; L401-T409 HydrophobicContact CD2-CG2 3.8Å; L401-L412 HydrophobicContact CD2-CD2 4.04Å; L401-L412 HydrophobicContact CG-CD2 4.11Å; L401-L413 HydrophobicContact CD2-CD2 4.01Å; L401-L413 HydrophobicContact CD2-CG 4.41Å; L401-V431 HydrophobicContact CD1-CG1 3.74Å
402	I	84.6	Confident	85.6	Confident	133 Å²	133	44.3 Å²	44.3	68%	0.682	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.8	177	-71.6	162.8	0	0	0	112.1	H398 Y400 C404	H398-I402 WeakPolarHBondContact O-CD1 3.44Å; H398-I402 WeakPolarHBondContact O-CG1 3.27Å; H398-I402 PolarHBondContact O-N 3.03Å; Y400-I402 VanDerWaalsContact C-N 3.33Å; Y400-I402 PolarHBondContact O-N 2.68Å; I402-C404 PolarHBondContact O-N 3.26Å
403	Q	79.2	Confident	86.2	Confident	68 Å²	68	43.7 Å²	43.7	32%	0.318	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-16	-177.9	-64.7	171.4	-35.3	0	0	112.5	L372 Y400 L401 D405	L372-Q403 HydrophobicContact CD1-CB 3.75Å; L372-Q403 HydrophobicContact CD1-CG 3.89Å; L372-Q403 VanDerWaalsContact CD2-OE1 3.31Å; Y400-Q403 WeakPolarHBondContact O-CB 3.39Å; Y400-Q403 PolarHBondContact O-N 3.04Å; L401-Q403 PolarHBondContact O-N 3.41Å; Q403-D405 PolarHBondContact O-N 3.35Å
404	C	76.1	Confident	86.8	Confident	96 Å²	96	41 Å²	41	65%	0.649	22%	0.216	S	C	*	.			trans	53.9	18.6	174.1	-64.4	0	0	0	0	115.9	L401 I402	L401-C404 PolarHBondContact O-N 3.04Å; I402-C404 PolarHBondContact O-N 3.26Å
405	D	86.6	Confident	87.3	Confident	43 Å²	43	36.8 Å²	36.8	23%	0.23	19%	0.194	C	C	.	.			trans	-71.9	127.4	171.1	179.1	-87.5	0	0	0	109.5	Q403 M407 V408 T409	Q403-D405 PolarHBondContact O-N 3.35Å; D405-M407 VanDerWaalsContact C-N 3.34Å; D405-M407 PolarHBondContact O-N 3.4Å; D405-M407 WeakPolarHBondContact OD1-CA 3.43Å; D405-M407 WeakPolarHBondContact OD1-CB 3.36Å; D405-M407 PolarHBondContact OD1-N 3.38Å; D405-V408 HydrophobicContact CB-CB 4.13Å; D405-V408 HydrophobicContact CB-CG2 4.14Å; D405-V408 PolarHBondContact O-N 3.06Å; D405-V408 WeakPolarHBondContact OD1-CG2 3.32Å; D405-V408 PolarHBondContact OD1-N 2.84Å; D405-T409 WeakPolarHBondContact O-CB 3.25Å; D405-T409 PolarHBondContact O-N 2.9Å; D405-T409 PolarHBondContact O-OG1 3.12Å
406	P	87.7	Confident	87.7	Confident	23 Å²	23	32.5 Å²	32.5	15%	0.149	17%	0.166	C	C	.	.	H	α-helix	trans	-66.4	-33.9	-173.2	25.8	-36.3	0	0	0	113.7	S410 E450 I453	P406-S410 WeakPolarHBondContact O-CB 3.13Å; P406-S410 PolarHBondContact O-N 2.96Å; P406-S410 PolarHBondContact O-OG 2.8Å; P406-E450 VanDerWaalsContact CB-CD 3.44Å; P406-E450 HydrophobicContact CB-CG 4.48Å; P406-E450 WeakPolarHBondContact CB-OE2 3.45Å; P406-E450 WeakPolarHBondContact CG-OE2 3.37Å; P406-I453 HydrophobicContact CB-CD1 4.14Å; P406-I453 HydrophobicContact CB-CG1 4.05Å
407	M	89.9	Confident	88.2	Confident	11 Å²	11	29.9 Å²	29.9	5%	0.054	15%	0.154	C	C	.	.	H	α-helix	trans	-76.2	-42.5	-178.5	-68.2	-75.4	163.4	0	0	110.6	W322 F325 P374 D405 G411	W322-M407 HydrophobicContact CD2-CE 4.18Å; W322-M407 HydrophobicContact CD2-SD 4.49Å; W322-M407 HydrophobicContact CG-CE 4.45Å; W322-M407 HydrophobicContact CZ2-CE 3.98Å; W322-M407 HydrophobicContact CZ2-SD 4.41Å; F325-M407 HydrophobicContact CB-SD 4.36Å; F325-M407 HydrophobicContact CD2-CB 4.18Å; F325-M407 HydrophobicContact CD2-SD 4.09Å; F325-M407 HydrophobicContact CG-SD 4.38Å; P374-M407 HydrophobicContact CB-CB 4.13Å; P374-M407 HydrophobicContact CB-CG 4.12Å; D405-M407 VanDerWaalsContact C-N 3.34Å; D405-M407 PolarHBondContact O-N 3.4Å; D405-M407 WeakPolarHBondContact OD1-CA 3.43Å; D405-M407 WeakPolarHBondContact OD1-CB 3.36Å; D405-M407 PolarHBondContact OD1-N 3.38Å; M407-G411 PolarHBondContact O-N 3.26Å
408	V	89.7	Confident	88.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.9	-47.8	175.1	179.1	0	0	0	0	111.2	L372 Y400 D405 G411 L412	L372-V408 HydrophobicContact CB-CG2 3.75Å; L372-V408 HydrophobicContact CD2-CG1 4.4Å; L372-V408 HydrophobicContact CD2-CG2 4.26Å; Y400-V408 HydrophobicContact CD1-CG1 4.46Å; D405-V408 HydrophobicContact CB-CB 4.13Å; D405-V408 HydrophobicContact CB-CG2 4.14Å; D405-V408 PolarHBondContact O-N 3.06Å; D405-V408 WeakPolarHBondContact OD1-CG2 3.32Å; D405-V408 PolarHBondContact OD1-N 2.84Å; V408-G411 PolarHBondContact O-N 3.45Å; V408-L412 WeakPolarHBondContact O-CB 3.35Å; V408-L412 PolarHBondContact O-N 3.32Å
409	T	91.6	Very high	88.6	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.012	13%	0.133	C	C	.	.	H	α-helix	trans	-61.8	-48.4	179.4	-57.5	0	0	0	0	110.8	L401 D405 G411 L412 L413 I453	L401-T409 HydrophobicContact CD2-CG2 3.8Å; D405-T409 WeakPolarHBondContact O-CB 3.25Å; D405-T409 PolarHBondContact O-N 2.9Å; D405-T409 PolarHBondContact O-OG1 3.12Å; T409-G411 PolarHBondContact O-N 3.34Å; T409-L412 PolarHBondContact O-N 3.45Å; T409-L413 HydrophobicContact CG2-CD1 3.81Å; T409-L413 HydrophobicContact CG2-CG 4.24Å; T409-L413 VanDerWaalsContact O-CG 3.24Å; T409-L413 WeakPolarHBondContact O-CG 3.48Å; T409-L413 PolarHBondContact O-N 2.94Å; T409-I453 HydrophobicContact CG2-CD1 4.21Å; T409-I453 HydrophobicContact CG2-CG1 4.33Å; T409-I453 HydrophobicContact CG2-CG2 3.77Å
410	S	92.8	Very high	88.8	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.007	12%	0.116	C	C	.	.	H	α-helix	trans	-60.5	-44.7	177.4	-60.8	0	0	0	0	111.9	P406 L412 L414 I453 T456	P406-S410 WeakPolarHBondContact O-CB 3.13Å; P406-S410 PolarHBondContact O-N 2.96Å; P406-S410 PolarHBondContact O-OG 2.8Å; S410-L412 PolarHBondContact O-N 3.07Å; S410-L414 WeakPolarHBondContact O-CB 3.3Å; S410-L414 PolarHBondContact O-N 3.4Å; S410-L414 VanDerWaalsContact O-N 3.16Å; S410-I453 WeakPolarHBondContact OG-CA 3.44Å; S410-T456 VanDerWaalsContact O-CG2 3.29Å; S410-T456 WeakPolarHBondContact O-CG2 3.24Å
411	G	92.8	Very high	89.3	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.6	-39.3	178.6	0	0	0	0	0	113.4	F381 M407 V408 T409 G415	F381-G411 WeakPolarHBondContact CA-O 3.24Å; M407-G411 PolarHBondContact O-N 3.26Å; V408-G411 PolarHBondContact O-N 3.45Å; T409-G411 PolarHBondContact O-N 3.34Å; G411-G415 WeakPolarHBondContact O-CA 3.25Å; G411-G415 PolarHBondContact O-N 3.27Å
412	L	92.1	Very high	89.5	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-67.8	-53.1	176.6	-179	65	0	0	0	111.9	L389 Y397 Y400 L401 V408 T409 S410 L414 G415 I416	L389-L412 HydrophobicContact CD1-CD1 4.2Å; Y397-L412 HydrophobicContact CD1-CD1 4.12Å; Y397-L412 HydrophobicContact CE1-CD1 4.47Å; Y400-L412 HydrophobicContact CG-CD2 4.5Å; L401-L412 HydrophobicContact CD2-CD2 4.04Å; L401-L412 HydrophobicContact CG-CD2 4.11Å; V408-L412 WeakPolarHBondContact O-CB 3.35Å; V408-L412 PolarHBondContact O-N 3.32Å; T409-L412 PolarHBondContact O-N 3.45Å; S410-L412 PolarHBondContact O-N 3.07Å; L412-L414 PolarHBondContact O-N 2.99Å; L412-G415 PolarHBondContact O-N 3.26Å; L412-I416 HydrophobicContact CD1-CD1 3.8Å; L412-I416 HydrophobicContact CD1-CG1 4.1Å; L412-I416 HydrophobicContact CG-CD1 3.8Å; L412-I416 HydrophobicContact CG-CG1 4.46Å; L412-I416 VanDerWaalsContact O-CG1 3.24Å; L412-I416 WeakPolarHBondContact O-CG1 3.46Å; L412-I416 PolarHBondContact O-N 3.34Å
413	L	93.8	Very high	89.8	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.9	-47.2	-176.2	-65.9	172.9	0	0	0	111.4	L401 T409 A417 L432 H435 I453 A457	L401-L413 HydrophobicContact CD2-CD2 4.01Å; L401-L413 HydrophobicContact CD2-CG 4.41Å; T409-L413 HydrophobicContact CG2-CD1 3.81Å; T409-L413 HydrophobicContact CG2-CG 4.24Å; T409-L413 VanDerWaalsContact O-CG 3.24Å; T409-L413 WeakPolarHBondContact O-CG 3.48Å; T409-L413 PolarHBondContact O-N 2.94Å; L413-A417 PolarHBondContact O-N 3.31Å; L413-L432 HydrophobicContact CB-CD2 3.88Å; L413-L432 HydrophobicContact CD2-CD2 3.57Å; L413-L432 HydrophobicContact CG-CD2 4.24Å; L413-H435 HydrophobicContact CD1-CB 4.24Å; L413-I453 HydrophobicContact CD1-CG2 3.94Å; L413-A457 HydrophobicContact CD1-CB 4.19Å
414	L	94.7	Very high	90.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71.9	-36.8	178	-172.5	60	0	0	0	112.3	F381 S410 L412 A417 A418 T456 F459 A460 L463 I778 L779	F381-L414 HydrophobicContact CD2-CB 4.24Å; F381-L414 HydrophobicContact CD2-CD2 4.25Å; F381-L414 HydrophobicContact CD2-CG 4.15Å; F381-L414 HydrophobicContact CE1-CD2 4.27Å; F381-L414 HydrophobicContact CE2-CB 4.14Å; F381-L414 HydrophobicContact CE2-CD2 3.52Å; F381-L414 HydrophobicContact CE2-CG 3.54Å; F381-L414 HydrophobicContact CZ-CD2 3.53Å; F381-L414 HydrophobicContact CZ-CG 4.08Å; S410-L414 WeakPolarHBondContact O-CB 3.3Å; S410-L414 PolarHBondContact O-N 3.4Å; S410-L414 VanDerWaalsContact O-N 3.16Å; L412-L414 PolarHBondContact O-N 2.99Å; L414-A417 PolarHBondContact O-N 2.85Å; L414-A418 WeakPolarHBondContact O-CB 3.32Å; L414-A418 PolarHBondContact O-N 2.9Å; L414-T456 HydrophobicContact CB-CG2 3.63Å; L414-T456 HydrophobicContact CD2-CG2 4.3Å; L414-T456 HydrophobicContact CG-CG2 4.44Å; L414-F459 HydrophobicContact CD1-CD1 3.56Å; L414-F459 HydrophobicContact CD1-CE1 4.12Å; L414-A460 HydrophobicContact CD1-CB 4.32Å; L414-L463 HydrophobicContact CD1-CD2 4.22Å; L414-I778 HydrophobicContact CB-CD1 4.33Å; L414-I778 HydrophobicContact CD2-CD1 3.79Å; L414-I778 HydrophobicContact CD2-CG1 3.78Å; L414-I778 HydrophobicContact CD2-CG2 4.15Å; L414-L779 HydrophobicContact CD2-CD2 4.08Å
415	G	92.6	Very high	91	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62	-41.6	177.2	0	0	0	0	0	112.7	G384 G411 L412 A418 G419	G384-G415 CarbonylContact C-O 3.43Å; G384-G415 WeakPolarHBondContact CA-O 3.35Å; G411-G415 WeakPolarHBondContact O-CA 3.25Å; G411-G415 PolarHBondContact O-N 3.27Å; L412-G415 PolarHBondContact O-N 3.26Å; G415-A418 PolarHBondContact O-N 3.21Å; G415-G419 PolarHBondContact O-N 3.16Å
416	I	92	Very high	91.1	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-46.3	175.1	-62.8	163.3	0	0	0	110.1	L389 Y397 L412 A418 G419 M420 I428	L389-I416 HydrophobicContact CB-CG1 4.44Å; L389-I416 HydrophobicContact CD1-CG1 4.28Å; Y397-I416 HydrophobicContact CD1-CD1 3.64Å; Y397-I416 HydrophobicContact CD1-CG1 4.36Å; Y397-I416 HydrophobicContact CD2-CD1 4.35Å; Y397-I416 HydrophobicContact CE1-CD1 3.56Å; Y397-I416 HydrophobicContact CE1-CG1 3.8Å; Y397-I416 HydrophobicContact CE2-CD1 4.31Å; Y397-I416 HydrophobicContact CG-CD1 4.04Å; L412-I416 HydrophobicContact CD1-CD1 3.8Å; L412-I416 HydrophobicContact CD1-CG1 4.1Å; L412-I416 HydrophobicContact CG-CD1 3.8Å; L412-I416 HydrophobicContact CG-CG1 4.46Å; L412-I416 VanDerWaalsContact O-CG1 3.24Å; L412-I416 WeakPolarHBondContact O-CG1 3.46Å; L412-I416 PolarHBondContact O-N 3.34Å; I416-A418 PolarHBondContact O-N 3.41Å; I416-G419 CarbonylContact O-C 3.27Å; I416-G419 WeakPolarHBondContact O-CA 3.21Å; I416-G419 PolarHBondContact O-N 3.26Å; I416-G419 VanDerWaalsContact O-N 3.09Å; I416-M420 PolarHBondContact O-N 3.05Å; I416-I428 HydrophobicContact CG2-CB 4.37Å; I416-I428 HydrophobicContact CG2-CD1 3.71Å; I416-I428 HydrophobicContact CG2-CG1 3.88Å; I416-I428 HydrophobicContact CG2-CG2 3.55Å
417	A	93.3	Very high	91.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.3	-37.7	178.6	0	0	0	0	0	113	L413 L414 G419 M420 V421 A460 L463	L413-A417 PolarHBondContact O-N 3.31Å; L414-A417 PolarHBondContact O-N 2.85Å; A417-G419 VanDerWaalsContact C-N 3.26Å; A417-G419 PolarHBondContact O-N 2.95Å; A417-M420 CarbonylContact O-C 3.58Å; A417-M420 VanDerWaalsContact O-C 3.32Å; A417-M420 PolarHBondContact O-N 3.42Å; A417-V421 PolarHBondContact O-N 3.47Å; A417-V421 VanDerWaalsContact O-N 3.08Å; A417-A460 HydrophobicContact CB-CB 3.68Å; A417-A460 WeakPolarHBondContact CB-O 3.45Å; A417-L463 HydrophobicContact CB-CD2 4.48Å
418	A	92.2	Very high	91.3	Very high	1 Å²	1	27 Å²	27	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-30.4	172.6	0	0	0	0	0	112.2	L385 L414 G415 I416 M420 V421 L463 L785	L385-A418 HydrophobicContact CD2-CB 3.82Å; L385-A418 HydrophobicContact CG-CB 4.49Å; L414-A418 WeakPolarHBondContact O-CB 3.32Å; L414-A418 PolarHBondContact O-N 2.9Å; G415-A418 PolarHBondContact O-N 3.21Å; I416-A418 PolarHBondContact O-N 3.41Å; A418-M420 PolarHBondContact O-N 2.88Å; A418-V421 VanDerWaalsContact O-CG2 3.31Å; A418-V421 WeakPolarHBondContact O-CG2 3.46Å; A418-L463 HydrophobicContact CB-CD2 4.05Å; A418-L785 HydrophobicContact CB-CD1 4.37Å; A418-L785 HydrophobicContact CB-CD2 4.42Å
419	G	87	Confident	91.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.3	165.8	0	0	0	0	0	113.8	R390 G415 I416 A417	R390-G419 WeakPolarHBondContact CD-O 3.32Å; R390-G419 WeakPolarHBondContact CG-O 3.44Å; R390-G419 VanDerWaalsContact CZ-C 3.43Å; R390-G419 PolarHBondContact NE-O 2.79Å; R390-G419 PolarHBondContact NH1-O 3.3Å; R390-G419 VanDerWaalsContact NH1-O 3.16Å; R390-G419 VanDerWaalsContact NH2-C 3.33Å; R390-G419 PolarHBondContact NH2-O 3.25Å; G415-G419 PolarHBondContact O-N 3.16Å; I416-G419 CarbonylContact O-C 3.27Å; I416-G419 WeakPolarHBondContact O-CA 3.21Å; I416-G419 PolarHBondContact O-N 3.26Å; I416-G419 VanDerWaalsContact O-N 3.09Å; A417-G419 VanDerWaalsContact C-N 3.26Å; A417-G419 PolarHBondContact O-N 2.95Å
420	M	88.9	Confident	91.3	Very high	26 Å²	26	36.8 Å²	36.8	13%	0.128	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141	29.6	-174.3	-66.6	-162.4	-169.9	0	0	112.3	R390 I416 A417 A418 G422 T423 D425 I428 L464	R390-M420 HydrophobicContact CB-CE 4.26Å; R390-M420 HydrophobicContact CG-CE 4.47Å; R390-M420 HydrophobicContact CG-CG 4.46Å; I416-M420 PolarHBondContact O-N 3.05Å; A417-M420 CarbonylContact O-C 3.58Å; A417-M420 VanDerWaalsContact O-C 3.32Å; A417-M420 PolarHBondContact O-N 3.42Å; A418-M420 PolarHBondContact O-N 2.88Å; M420-G422 PolarHBondContact O-N 3.11Å; M420-T423 HydrophobicContact CB-CG2 4.38Å; M420-T423 WeakPolarHBondContact CB-OG1 3.37Å; M420-T423 WeakPolarHBondContact O-CB 3.34Å; M420-T423 WeakPolarHBondContact O-CG2 3.28Å; M420-T423 PolarHBondContact O-N 2.63Å; M420-T423 VanDerWaalsContact O-N 3.08Å; M420-T423 PolarHBondContact O-OG1 2.96Å; M420-D425 HydrophobicContact SD-CB 4.28Å; M420-I428 HydrophobicContact CE-CD1 4.28Å; M420-I428 HydrophobicContact CE-CG1 4.04Å; M420-I428 HydrophobicContact SD-CD1 4.34Å; M420-I428 HydrophobicContact SD-CG1 3.46Å; M420-I428 WeakPolarHBondContact SD-CG1 3.16Å; M420-L464 HydrophobicContact CB-CD1 3.74Å; M420-L464 WeakPolarHBondContact O-CD1 3.35Å
421	V	91.5	Very high	91.2	Very high	36 Å²	36	37.2 Å²	37.2	22%	0.218	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	124.9	-177.5	-170.7	0	0	0	0	111.2	A417 A418 T423 L463 A466 I752 L785	A417-V421 PolarHBondContact O-N 3.47Å; A417-V421 VanDerWaalsContact O-N 3.08Å; A418-V421 VanDerWaalsContact O-CG2 3.31Å; A418-V421 WeakPolarHBondContact O-CG2 3.46Å; V421-T423 VanDerWaalsContact C-N 3.26Å; V421-T423 PolarHBondContact O-N 2.64Å; V421-L463 WeakPolarHBondContact CA-O 3.29Å; V421-L463 HydrophobicContact CG1-CD1 3.89Å; V421-L463 HydrophobicContact CG1-CG 4.26Å; V421-L463 HydrophobicContact CG2-CD1 4.08Å; V421-L463 HydrophobicContact CG2-CD2 4.26Å; V421-L463 HydrophobicContact CG2-CG 3.93Å; V421-A466 HydrophobicContact CG1-CB 4.03Å; V421-I752 HydrophobicContact CG1-CG2 4.11Å; V421-L785 HydrophobicContact CG2-CD1 4.19Å
422	G	89.9	Confident	91.1	Very high	36 Å²	36	37.2 Å²	37.2	37%	0.371	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	10	176.4	0	0	0	0	0	116.3	M420 L463 L464	M420-G422 PolarHBondContact O-N 3.11Å; G422-L463 PolarHBondContact N-O 3.49Å; G422-L464 CarbonylContact C-O 3.45Å; G422-L464 VanDerWaalsContact CA-O 3.3Å; G422-L464 WeakPolarHBondContact CA-O 3.41Å; G422-L464 PolarHBondContact N-O 3.45Å; G422-L464 VanDerWaalsContact N-O 3.15Å
423	T	90.7	Very high	91	Very high	78 Å²	78	38.2 Å²	38.2	48%	0.479	21%	0.206	S	C	.	.			trans	-84.8	-22.9	179.4	61.9	0	0	0	0	113.9	M420 V421 D425 L464	M420-T423 HydrophobicContact CB-CG2 4.38Å; M420-T423 WeakPolarHBondContact CB-OG1 3.37Å; M420-T423 WeakPolarHBondContact O-CB 3.34Å; M420-T423 WeakPolarHBondContact O-CG2 3.28Å; M420-T423 PolarHBondContact O-N 2.63Å; M420-T423 VanDerWaalsContact O-N 3.08Å; M420-T423 PolarHBondContact O-OG1 2.96Å; V421-T423 VanDerWaalsContact C-N 3.26Å; V421-T423 PolarHBondContact O-N 2.64Å; T423-D425 PolarHBondContact O-N 3.47Å; T423-L464 PolarHBondContact N-O 3.11Å
424	C	89.1	Confident	90.7	Very high	46 Å²	46	41.1 Å²	41.1	31%	0.311	23%	0.225	S	C	.	.			trans	51.4	35.3	-172.5	-58.7	0	0	0	0	114.3	L426 L464	C424-L426 PolarHBondContact O-N 3.09Å; C424-L426 VanDerWaalsContact O-N 3.13Å; C424-L464 PolarHBondContact N-O 2.94Å; C424-L464 VanDerWaalsContact N-O 3.08Å
425	D	91.4	Very high	90.4	Very high	52 Å²	52	42.6 Å²	42.6	28%	0.278	23%	0.232	S	C	.	.			trans	-62.1	117.2	-179	-171.7	-9.3	0	0	0	111.6	M420 T423 K427 I428 M429	M420-D425 HydrophobicContact SD-CB 4.28Å; T423-D425 PolarHBondContact O-N 3.47Å; D425-K427 PolarHBondContact O-N 3.36Å; D425-K427 WeakPolarHBondContact OD1-CB 3.33Å; D425-K427 PolarHBondContact OD1-N 2.95Å; D425-I428 HydrophobicContact CB-CG1 4.4Å; D425-I428 PolarHBondContact O-N 3.42Å; D425-M429 WeakPolarHBondContact O-CB 3.22Å; D425-M429 PolarHBondContact O-N 3.13Å
426	L	90.3	Very high	90.1	Very high	122 Å²	122	42.6 Å²	42.6	64%	0.639	23%	0.232	S	C	*	.	H	α-helix	trans	-60.6	-28.8	178.6	-64.9	175.3	0	0	0	112.7	C424 K430	C424-L426 PolarHBondContact O-N 3.09Å; C424-L426 VanDerWaalsContact O-N 3.13Å; L426-K430 VanDerWaalsContact O-CG 3.32Å; L426-K430 WeakPolarHBondContact O-CG 3.41Å; L426-K430 PolarHBondContact O-N 3.36Å
427	K	90.1	Very high	89.7	Confident	156 Å²	156	44.6 Å²	44.6	68%	0.678	25%	0.245	S	C	*	.	H	α-helix	trans	-66.2	-48.8	178	-65.9	177.9	-177.9	176.3	0	110.8	D425 K430 V431	D425-K427 PolarHBondContact O-N 3.36Å; D425-K427 WeakPolarHBondContact OD1-CB 3.33Å; D425-K427 PolarHBondContact OD1-N 2.95Å; K427-K430 WeakPolarHBondContact O-CB 3.45Å; K427-K430 PolarHBondContact O-N 2.7Å; K427-V431 PolarHBondContact O-N 3.04Å
428	I	91.1	Very high	89.3	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-69.8	-38	178.2	-59.6	-44.2	0	0	0	110.6	Y397 I416 M420 D425 K430 V431 L432 L464	Y397-I428 HydrophobicContact CE2-CD1 4.07Å; I416-I428 HydrophobicContact CG2-CB 4.37Å; I416-I428 HydrophobicContact CG2-CD1 3.71Å; I416-I428 HydrophobicContact CG2-CG1 3.88Å; I416-I428 HydrophobicContact CG2-CG2 3.55Å; M420-I428 HydrophobicContact CE-CD1 4.28Å; M420-I428 HydrophobicContact CE-CG1 4.04Å; M420-I428 HydrophobicContact SD-CD1 4.34Å; M420-I428 HydrophobicContact SD-CG1 3.46Å; M420-I428 WeakPolarHBondContact SD-CG1 3.16Å; D425-I428 HydrophobicContact CB-CG1 4.4Å; D425-I428 PolarHBondContact O-N 3.42Å; I428-K430 PolarHBondContact O-N 3.37Å; I428-V431 WeakPolarHBondContact O-CA 3.18Å; I428-V431 WeakPolarHBondContact O-CB 3.31Å; I428-V431 PolarHBondContact O-N 3.4Å; I428-L432 HydrophobicContact CG2-CD1 4.3Å; I428-L432 HydrophobicContact CG2-CG 4.28Å; I428-L432 WeakPolarHBondContact O-CG 3.03Å; I428-L432 PolarHBondContact O-N 3.04Å; I428-L464 HydrophobicContact CB-CD2 4.32Å; I428-L464 HydrophobicContact CG2-CD2 4.19Å
429	M	90.8	Very high	88.9	Confident	42 Å²	42	49 Å²	49	21%	0.207	27%	0.266	C	S	.	.	H	α-helix	trans	-56.9	-38.5	174.2	-170.3	174.1	-73.1	0	0	112.1	D425 V431 L432 A433 L464 C465	D425-M429 WeakPolarHBondContact O-CB 3.22Å; D425-M429 PolarHBondContact O-N 3.13Å; M429-V431 VanDerWaalsContact C-N 3.34Å; M429-V431 PolarHBondContact O-N 3.46Å; M429-L432 PolarHBondContact O-N 3.15Å; M429-A433 WeakPolarHBondContact O-CB 3.5Å; M429-A433 PolarHBondContact O-N 3.02Å; M429-L464 HydrophobicContact CB-CD2 4.19Å; M429-L464 HydrophobicContact CE-CD2 4.49Å; M429-C465 WeakPolarHBondContact CE-SG 3.4Å
430	K	90.1	Very high	88.6	Confident	165 Å²	165	50.9 Å²	50.9	72%	0.717	28%	0.278	S	S	*	.	H	α-helix	trans	-65.9	-31.9	173	-74	175.4	-179.3	-173.5	0	113.6	L426 K427 I428 P434	L426-K430 VanDerWaalsContact O-CG 3.32Å; L426-K430 WeakPolarHBondContact O-CG 3.41Å; L426-K430 PolarHBondContact O-N 3.36Å; K427-K430 WeakPolarHBondContact O-CB 3.45Å; K427-K430 PolarHBondContact O-N 2.7Å; I428-K430 PolarHBondContact O-N 3.37Å; K430-P434 WeakPolarHBondContact O-CD 3.38Å
431	V	90.4	Very high	87.9	Confident	11 Å²	11	54 Å²	54	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-71.2	-37.1	174.2	178	0	0	0	0	110.9	L394 L401 K427 I428 M429 P434	L394-V431 HydrophobicContact CD1-CG2 3.55Å; L401-V431 HydrophobicContact CD1-CG1 3.74Å; K427-V431 PolarHBondContact O-N 3.04Å; I428-V431 WeakPolarHBondContact O-CA 3.18Å; I428-V431 WeakPolarHBondContact O-CB 3.31Å; I428-V431 PolarHBondContact O-N 3.4Å; M429-V431 VanDerWaalsContact C-N 3.34Å; M429-V431 PolarHBondContact O-N 3.46Å; V431-P434 WeakPolarHBondContact O-CD 3.42Å
432	L	90.7	Very high	86.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-76	-31.5	178.1	-62.2	179.6	0	0	0	113	L413 I428 M429 P434 H435 A460 V461 L464	L413-L432 HydrophobicContact CB-CD2 3.88Å; L413-L432 HydrophobicContact CD2-CD2 3.57Å; L413-L432 HydrophobicContact CG-CD2 4.24Å; I428-L432 HydrophobicContact CG2-CD1 4.3Å; I428-L432 HydrophobicContact CG2-CG 4.28Å; I428-L432 WeakPolarHBondContact O-CG 3.03Å; I428-L432 PolarHBondContact O-N 3.04Å; M429-L432 PolarHBondContact O-N 3.15Å; L432-P434 VanDerWaalsContact C-CD 3.45Å; L432-H435 PolarHBondContact O-N 3.27Å; L432-A460 HydrophobicContact CD1-CB 4.04Å; L432-A460 HydrophobicContact CD2-CB 4.11Å; L432-V461 HydrophobicContact CB-CG2 4.15Å; L432-V461 HydrophobicContact CD1-CG2 3.86Å; L432-L464 HydrophobicContact CD1-CD2 4.24Å
433	A	89.4	Confident	85.4	Confident	22 Å²	22	61.5 Å²	61.5	18%	0.182	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-51.9	-43.7	-170	0	0	0	0	0	115.2	M429 H435 V436 L439 T440	M429-A433 WeakPolarHBondContact O-CB 3.5Å; M429-A433 PolarHBondContact O-N 3.02Å; A433-H435 PolarHBondContact O-N 2.97Å; A433-H435 VanDerWaalsContact O-N 3.12Å; A433-V436 PolarHBondContact O-N 3.36Å; A433-V436 VanDerWaalsContact O-N 3.12Å; A433-L439 HydrophobicContact CB-CB 4.04Å; A433-T440 PolarHBondContact O-OG1 2.96Å; A433-T440 VanDerWaalsContact O-OG1 3.08Å
434	P	87.8	Confident	83.8	Confident	60 Å²	60	66.4 Å²	66.4	39%	0.39	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-60.9	-23.9	179.2	-23.2	34.6	0	0	0	113.8	K430 V431 L432 T440 I449	K430-P434 WeakPolarHBondContact O-CD 3.38Å; V431-P434 WeakPolarHBondContact O-CD 3.42Å; L432-P434 VanDerWaalsContact C-CD 3.45Å; P434-T440 PolarHBondContact O-OG1 2.64Å; P434-I449 WeakPolarHBondContact O-CD1 3.39Å
435	H	88.4	Confident	82.5	Confident	32 Å²	32	70.5 Å²	70.5	15%	0.148	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-93	-1.2	-177.8	-56	-70.8	0	0	0	113.7	L413 L432 A433 I453 A457	L413-H435 HydrophobicContact CD1-CB 4.24Å; L432-H435 PolarHBondContact O-N 3.27Å; A433-H435 PolarHBondContact O-N 2.97Å; A433-H435 VanDerWaalsContact O-N 3.12Å; H435-I453 HydrophobicContact CB-CG2 4.34Å; H435-A457 HydrophobicContact CB-CB 3.57Å
436	V	87.9	Confident	81.2	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	40%	0.403	C	S	.	.	S	Bend	trans	-119.1	116.5	-174.9	177.7	0	0	0	0	109.8	A433 F438 L439 T440 A457 V458 V461	A433-V436 PolarHBondContact O-N 3.36Å; A433-V436 VanDerWaalsContact O-N 3.12Å; V436-F438 VanDerWaalsContact C-N 3.3Å; V436-F438 HydrophobicContact CG1-CD1 3.75Å; V436-F438 HydrophobicContact CG1-CD2 4.1Å; V436-F438 HydrophobicContact CG1-CE1 3.36Å; V436-F438 HydrophobicContact CG1-CE2 3.74Å; V436-F438 HydrophobicContact CG1-CG 4.11Å; V436-F438 HydrophobicContact CG1-CZ 3.36Å; V436-F438 PolarHBondContact O-N 3.06Å; V436-F438 VanDerWaalsContact O-N 3.1Å; V436-L439 HydrophobicContact CB-CB 4.16Å; V436-L439 HydrophobicContact CB-CD1 4.02Å; V436-L439 HydrophobicContact CB-CG 4.17Å; V436-L439 HydrophobicContact CG1-CB 4.23Å; V436-L439 HydrophobicContact CG1-CD1 3.91Å; V436-L439 HydrophobicContact CG1-CG 3.82Å; V436-L439 HydrophobicContact CG2-CD1 4.46Å; V436-L439 PolarHBondContact O-N 3.3Å; V436-T440 PolarHBondContact O-N 3.05Å; V436-T440 VanDerWaalsContact O-N 3.08Å; V436-T440 PolarHBondContact O-OG1 3.3Å; V436-A457 HydrophobicContact CG2-CB 3.74Å; V436-V458 HydrophobicContact CG1-CG2 4.17Å; V436-V458 HydrophobicContact CG2-CG2 4.48Å; V436-V461 HydrophobicContact CG2-CG2 3.91Å
437	P	82.3	Confident	80.3	Confident	43 Å²	43	73.5 Å²	73.5	28%	0.279	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-42	-169.7	-34.8	39.8	0	0	0	116.2	L439 Q454	P437-L439 VanDerWaalsContact C-N 3.33Å; P437-Q454 HydrophobicContact CG-CG 4.17Å
438	F	84.5	Confident	79.4	Confident	43 Å²	43	72.4 Å²	72.4	19%	0.189	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-6.8	-174.2	59.1	-99	0	0	0	112.8	V436 V458 L473 C476 F477 Q480	V436-F438 VanDerWaalsContact C-N 3.3Å; V436-F438 HydrophobicContact CG1-CD1 3.75Å; V436-F438 HydrophobicContact CG1-CD2 4.1Å; V436-F438 HydrophobicContact CG1-CE1 3.36Å; V436-F438 HydrophobicContact CG1-CE2 3.74Å; V436-F438 HydrophobicContact CG1-CG 4.11Å; V436-F438 HydrophobicContact CG1-CZ 3.36Å; V436-F438 PolarHBondContact O-N 3.06Å; V436-F438 VanDerWaalsContact O-N 3.1Å; F438-V458 HydrophobicContact CE1-CG2 4.36Å; F438-L473 HydrophobicContact CE2-CD2 4.12Å; F438-C476 HydrophobicContact CB-CB 4.2Å; F438-C476 HydrophobicContact CD1-CB 4.24Å; F438-C476 HydrophobicContact CD2-CB 3.51Å; F438-C476 HydrophobicContact CE2-CB 3.85Å; F438-C476 HydrophobicContact CG-CB 3.73Å; F438-C476 HydrophobicContact CZ-CB 4.34Å; F438-F477 HydrophobicContact CE1-CD1 4.07Å; F438-F477 HydrophobicContact CE1-CE1 4.05Å; F438-F477 AromaticContact CZ-CD1 3.95Å; F438-F477 HydrophobicContact CZ-CD1 3.95Å; F438-F477 AromaticContact CZ-CE1 3.61Å; F438-F477 HydrophobicContact CZ-CE1 3.61Å; F438-F477 HydrophobicContact CZ-CZ 4.17Å; F438-Q480 HydrophobicContact CD1-CG 3.74Å; F438-Q480 HydrophobicContact CE1-CG 4.18Å
439	L	85.3	Confident	78.9	Confident	51 Å²	51	74 Å²	74	27%	0.267	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-22.8	173.8	-62.6	-178.7	0	0	0	112	A433 V436 P437 V461 L473	A433-L439 HydrophobicContact CB-CB 4.04Å; V436-L439 HydrophobicContact CB-CB 4.16Å; V436-L439 HydrophobicContact CB-CD1 4.02Å; V436-L439 HydrophobicContact CB-CG 4.17Å; V436-L439 HydrophobicContact CG1-CB 4.23Å; V436-L439 HydrophobicContact CG1-CD1 3.91Å; V436-L439 HydrophobicContact CG1-CG 3.82Å; V436-L439 HydrophobicContact CG2-CD1 4.46Å; V436-L439 PolarHBondContact O-N 3.3Å; P437-L439 VanDerWaalsContact C-N 3.33Å; L439-V461 HydrophobicContact CD1-CG2 4.1Å; L439-L473 HydrophobicContact CD2-CD2 4.46Å
440	T	79.7	Confident	78.6	Confident	40 Å²	40	76 Å²	76	25%	0.245	43%	0.425	C	S	.	.	S	Bend	trans	-68.6	126.5	174.2	-54.3	0	0	0	0	109.8	A433 P434 V436 L447	A433-T440 PolarHBondContact O-OG1 2.96Å; A433-T440 VanDerWaalsContact O-OG1 3.08Å; P434-T440 PolarHBondContact O-OG1 2.64Å; V436-T440 PolarHBondContact O-N 3.05Å; V436-T440 VanDerWaalsContact O-N 3.08Å; V436-T440 PolarHBondContact O-OG1 3.3Å; T440-L447 HydrophobicContact CG2-CD1 4.26Å
441	P	73.9	Confident	78.3	Confident	90 Å²	90	68.8 Å²	68.8	58%	0.584	40%	0.396	S	S	*	.			trans	-57.2	141.5	173	-21.5	31.8	0	0	0	110.2	T443	P441-T443 VanDerWaalsContact C-N 3.27Å; P441-T443 PolarHBondContact O-N 3.15Å; P441-T443 PolarHBondContact O-OG1 3.22Å
442	P	68.1	Low	78.2	Confident	144 Å²	144	68.8 Å²	68.8	94%	0.935	40%	0.396	S	S	*	.			trans	-63.6	91.5	175.7	28	-34.3	0	0	0	108.9
443	T	61.9	Low	78.2	Confident	86 Å²	86	69.4 Å²	69.4	53%	0.528	40%	0.399	S	S	.	.			trans	-111.5	144.4	-179.2	-46.9	0	0	0	0	106.8	P441 L445	P441-T443 VanDerWaalsContact C-N 3.27Å; P441-T443 PolarHBondContact O-N 3.15Å; P441-T443 PolarHBondContact O-OG1 3.22Å; T443-L445 HydrophobicContact CG2-CB 4.48Å; T443-L445 HydrophobicContact CG2-CD1 4.31Å; T443-L445 HydrophobicContact CG2-CG 4.49Å; T443-L445 PolarHBondContact O-N 3.13Å
444	L	56.3	Low	78.1	Confident	182 Å²	182	69 Å²	69	95%	0.953	39%	0.393	S	S	*	.	S	Bend	trans	-61.7	-3.3	179.4	-71.5	162.6	0	0	0	114.6	D446	L444-D446 PolarHBondContact O-N 3.19Å
445	L	63.1	Low	78.3	Confident	131 Å²	131	66.5 Å²	66.5	69%	0.686	38%	0.377	S	S	*	.			trans	-87.6	104.1	176.9	-70	163.7	0	0	0	108.4	T443 L447	T443-L445 HydrophobicContact CG2-CB 4.48Å; T443-L445 HydrophobicContact CG2-CD1 4.31Å; T443-L445 HydrophobicContact CG2-CG 4.49Å; T443-L445 PolarHBondContact O-N 3.13Å; L445-L447 VanDerWaalsContact C-N 3.3Å; L445-L447 PolarHBondContact O-N 3.26Å
446	D	63.1	Low	78.5	Confident	137 Å²	137	65.1 Å²	65.1	73%	0.733	37%	0.37	S	S	*	.			trans	-65.6	93.2	165.9	-78.9	-28.3	0	0	0	108.5	L444 C448	L444-D446 PolarHBondContact O-N 3.19Å; D446-C448 PolarHBondContact O-N 3.24Å; D446-C448 VanDerWaalsContact O-N 3.12Å
447	L	71.4	Confident	78.7	Confident	101 Å²	101	65.1 Å²	65.1	53%	0.529	37%	0.37	S	S	.	.			trans	-69	106.9	172.5	-66	174.3	0	0	0	108.1	T440 L445 I449	T440-L447 HydrophobicContact CG2-CD1 4.26Å; L445-L447 VanDerWaalsContact C-N 3.3Å; L445-L447 PolarHBondContact O-N 3.26Å; L447-I449 VanDerWaalsContact C-N 3.32Å; L447-I449 HydrophobicContact CB-CD1 4.16Å; L447-I449 HydrophobicContact CB-CG1 3.96Å; L447-I449 PolarHBondContact O-N 3.41Å
448	C	72	Confident	79.3	Confident	133 Å²	133	63 Å²	63	90%	0.899	36%	0.357	S	S	*	.			trans	-72.4	85.7	172	-60.1	0	0	0	0	109.9	D446	D446-C448 PolarHBondContact O-N 3.24Å; D446-C448 VanDerWaalsContact O-N 3.12Å
449	I	80.6	Confident	79.8	Confident	40 Å²	40	61 Å²	61	21%	0.205	35%	0.348	C	S	.	.			trans	-94.7	132.3	178.2	-53.1	-176.3	0	0	0	109.1	P434 L447 I453 Q454	P434-I449 WeakPolarHBondContact O-CD1 3.39Å; L447-I449 VanDerWaalsContact C-N 3.32Å; L447-I449 HydrophobicContact CB-CD1 4.16Å; L447-I449 HydrophobicContact CB-CG1 3.96Å; L447-I449 PolarHBondContact O-N 3.41Å; I449-I453 HydrophobicContact CG2-CB 3.99Å; I449-I453 HydrophobicContact CG2-CG2 3.97Å; I449-Q454 HydrophobicContact CG2-CB 4.22Å
450	E	83.4	Confident	80.2	Confident	85 Å²	85	58.6 Å²	58.6	40%	0.397	34%	0.335	S	S	.	.			trans	-64	136.1	177.3	-169.6	174.2	146.5	0	0	111	P406 T452 I453 Q454	P406-E450 VanDerWaalsContact CB-CD 3.44Å; P406-E450 HydrophobicContact CB-CG 4.48Å; P406-E450 WeakPolarHBondContact CB-OE2 3.45Å; P406-E450 WeakPolarHBondContact CG-OE2 3.37Å; E450-T452 PolarHBondContact O-N 3.35Å; E450-I453 HydrophobicContact CB-CD1 4.04Å; E450-I453 HydrophobicContact CB-CG1 4.23Å; E450-I453 WeakPolarHBondContact O-CB 3.48Å; E450-I453 PolarHBondContact O-N 3.08Å; E450-Q454 PolarHBondContact O-N 3.18Å
451	P	84.8	Confident	81	Confident	14 Å²	14	56.7 Å²	56.7	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-57.8	-29.5	-175.3	-24.7	31.2	0	0	0	114.8	Q454 T455 W486 N491 E494	P451-Q454 PolarHBondContact O-N 3.42Å; P451-T455 VanDerWaalsContact O-CB 3.29Å; P451-T455 WeakPolarHBondContact O-CB 3.4Å; P451-T455 PolarHBondContact O-N 3.09Å; P451-T455 PolarHBondContact O-OG1 3.11Å; P451-W486 HydrophobicContact CB-CH2 3.89Å; P451-W486 HydrophobicContact CB-CZ3 3.74Å; P451-W486 HydrophobicContact CG-CZ3 3.97Å; P451-N491 HydrophobicContact CG-CB 3.89Å; P451-N491 WeakPolarHBondContact CG-ND2 3.42Å; P451-E494 WeakPolarHBondContact CB-OE2 3.18Å
452	T	87.4	Confident	82	Confident	11 Å²	11	52.4 Å²	52.4	7%	0.067	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-42.4	175.8	-68.2	0	0	0	0	111.8	W322 E450 Q454 T456	W322-T452 HydrophobicContact CZ2-CG2 4.15Å; E450-T452 PolarHBondContact O-N 3.35Å; T452-Q454 VanDerWaalsContact C-N 3.33Å; T452-Q454 PolarHBondContact O-N 3.26Å; T452-T456 VanDerWaalsContact O-CB 3.32Å; T452-T456 WeakPolarHBondContact O-CB 3.24Å; T452-T456 PolarHBondContact O-N 2.86Å; T452-T456 PolarHBondContact O-OG1 3.42Å
453	I	90	Very high	83.2	Confident	13 Å²	13	45.6 Å²	45.6	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-45.7	176.9	-62	172.1	0	0	0	109.4	P406 T409 S410 L413 H435 I449 E450 T456 A457	P406-I453 HydrophobicContact CB-CD1 4.14Å; P406-I453 HydrophobicContact CB-CG1 4.05Å; T409-I453 HydrophobicContact CG2-CD1 4.21Å; T409-I453 HydrophobicContact CG2-CG1 4.33Å; T409-I453 HydrophobicContact CG2-CG2 3.77Å; S410-I453 WeakPolarHBondContact OG-CA 3.44Å; L413-I453 HydrophobicContact CD1-CG2 3.94Å; H435-I453 HydrophobicContact CB-CG2 4.34Å; I449-I453 HydrophobicContact CG2-CB 3.99Å; I449-I453 HydrophobicContact CG2-CG2 3.97Å; E450-I453 HydrophobicContact CB-CD1 4.04Å; E450-I453 HydrophobicContact CB-CG1 4.23Å; E450-I453 WeakPolarHBondContact O-CB 3.48Å; E450-I453 PolarHBondContact O-N 3.08Å; I453-T456 CarbonylContact O-C 3.27Å; I453-T456 WeakPolarHBondContact O-CB 3.31Å; I453-T456 PolarHBondContact O-N 3.3Å; I453-A457 WeakPolarHBondContact O-CB 3.45Å; I453-A457 PolarHBondContact O-N 3.14Å
454	Q	88.7	Confident	84.8	Confident	14 Å²	14	41.5 Å²	41.5	7%	0.065	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-43.3	-175.4	-169.7	164.6	-9.2	0	0	112.8	P437 I449 E450 P451 T452 T456 A457 V458 W486 Y498	P437-Q454 HydrophobicContact CG-CG 4.17Å; I449-Q454 HydrophobicContact CG2-CB 4.22Å; E450-Q454 PolarHBondContact O-N 3.18Å; P451-Q454 PolarHBondContact O-N 3.42Å; T452-Q454 VanDerWaalsContact C-N 3.33Å; T452-Q454 PolarHBondContact O-N 3.26Å; Q454-T456 VanDerWaalsContact C-N 3.27Å; Q454-T456 PolarHBondContact O-N 3.36Å; Q454-A457 PolarHBondContact O-N 2.94Å; Q454-V458 WeakPolarHBondContact O-CB 3.49Å; Q454-V458 WeakPolarHBondContact O-CG2 3.36Å; Q454-V458 PolarHBondContact O-N 3.18Å; Q454-W486 HydrophobicContact CB-CH2 3.69Å; Q454-W486 HydrophobicContact CB-CZ2 4.09Å; Q454-W486 HydrophobicContact CB-CZ3 4.32Å; Q454-W486 HydrophobicContact CG-CH2 3.57Å; Q454-W486 HydrophobicContact CG-CZ2 3.47Å; Q454-W486 VanDerWaalsContact CG-CZ2 3.47Å; Q454-W486 HydrophobicContact CG-CZ3 4.24Å; Q454-W486 VanDerWaalsContact NE2-NE1 3.15Å; Q454-W486 VanDerWaalsContact OE1-CE3 3.23Å; Q454-W486 VanDerWaalsContact OE1-CH2 3.23Å; Q454-Y498 HydrophobicContact CG-CE2 4.42Å
455	T	90.8	Very high	86.6	Confident	7 Å²	7	33 Å²	33	4%	0.043	18%	0.182	C	C	.	.	H	α-helix	trans	-57.2	-45.1	170.9	-59.4	0	0	0	0	110.5	P451 F459 T501 A776	P451-T455 VanDerWaalsContact O-CB 3.29Å; P451-T455 WeakPolarHBondContact O-CB 3.4Å; P451-T455 PolarHBondContact O-N 3.09Å; P451-T455 PolarHBondContact O-OG1 3.11Å; T455-F459 PolarHBondContact O-N 3.06Å; T455-F459 VanDerWaalsContact O-N 3.16Å; T455-T501 HydrophobicContact CG2-CG2 3.8Å; T455-T501 VanDerWaalsContact CG2-OG1 3.29Å; T455-T501 WeakPolarHBondContact CG2-OG1 3.25Å; T455-T501 WeakPolarHBondContact O-CG2 3.39Å; T455-A776 HydrophobicContact CG2-CB 4.21Å
456	T	92.9	Very high	88	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-66.1	-41.5	179	-57.2	0	0	0	0	112.3	S410 L414 T452 I453 Q454 F459 A460 I778	S410-T456 VanDerWaalsContact O-CG2 3.29Å; S410-T456 WeakPolarHBondContact O-CG2 3.24Å; L414-T456 HydrophobicContact CB-CG2 3.63Å; L414-T456 HydrophobicContact CD2-CG2 4.3Å; L414-T456 HydrophobicContact CG-CG2 4.44Å; T452-T456 VanDerWaalsContact O-CB 3.32Å; T452-T456 WeakPolarHBondContact O-CB 3.24Å; T452-T456 PolarHBondContact O-N 2.86Å; T452-T456 PolarHBondContact O-OG1 3.42Å; I453-T456 CarbonylContact O-C 3.27Å; I453-T456 WeakPolarHBondContact O-CB 3.31Å; I453-T456 PolarHBondContact O-N 3.3Å; Q454-T456 VanDerWaalsContact C-N 3.27Å; Q454-T456 PolarHBondContact O-N 3.36Å; T456-F459 PolarHBondContact O-N 2.81Å; T456-A460 WeakPolarHBondContact O-CB 3.43Å; T456-A460 PolarHBondContact O-N 2.9Å; T456-I778 HydrophobicContact CG2-CD1 4.11Å
457	A	93	Very high	89.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.5	-42.3	179	0	0	0	0	0	112.2	L413 H435 V436 I453 Q454 F459 A460 V461	L413-A457 HydrophobicContact CD1-CB 4.19Å; H435-A457 HydrophobicContact CB-CB 3.57Å; V436-A457 HydrophobicContact CG2-CB 3.74Å; I453-A457 WeakPolarHBondContact O-CB 3.45Å; I453-A457 PolarHBondContact O-N 3.14Å; Q454-A457 PolarHBondContact O-N 2.94Å; A457-F459 VanDerWaalsContact C-N 3.34Å; A457-F459 PolarHBondContact O-N 3.37Å; A457-A460 WeakPolarHBondContact O-CB 3.44Å; A457-A460 PolarHBondContact O-N 2.79Å; A457-V461 WeakPolarHBondContact O-CG2 3.5Å; A457-V461 PolarHBondContact O-N 3.5Å
458	V	93.6	Very high	90.4	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.9	-44.9	174.6	164.6	0	0	0	0	111.1	V436 F438 Q454 V461 G462 F477 Y498	V436-V458 HydrophobicContact CG1-CG2 4.17Å; V436-V458 HydrophobicContact CG2-CG2 4.48Å; F438-V458 HydrophobicContact CE1-CG2 4.36Å; Q454-V458 WeakPolarHBondContact O-CB 3.49Å; Q454-V458 WeakPolarHBondContact O-CG2 3.36Å; Q454-V458 PolarHBondContact O-N 3.18Å; V458-V461 PolarHBondContact O-N 3.42Å; V458-G462 PolarHBondContact O-N 3.5Å; V458-F477 HydrophobicContact CG1-CD1 3.99Å; V458-F477 HydrophobicContact CG1-CE1 3.71Å; V458-Y498 HydrophobicContact CB-CE2 4.21Å; V458-Y498 HydrophobicContact CG1-CE2 4.42Å; V458-Y498 HydrophobicContact CG2-CE2 3.71Å
459	F	95.1	Very high	91.2	Very high	1 Å²	1	14.8 Å²	14.8	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-63.9	-42.4	174.5	-167.2	-92	0	0	0	112.3	L414 T455 T456 A457 V461 G462 L463 T501 L504 L508 C759 L779 L782	L414-F459 HydrophobicContact CD1-CD1 3.56Å; L414-F459 HydrophobicContact CD1-CE1 4.12Å; T455-F459 PolarHBondContact O-N 3.06Å; T455-F459 VanDerWaalsContact O-N 3.16Å; T456-F459 PolarHBondContact O-N 2.81Å; A457-F459 VanDerWaalsContact C-N 3.34Å; A457-F459 PolarHBondContact O-N 3.37Å; F459-V461 VanDerWaalsContact C-N 3.29Å; F459-V461 PolarHBondContact O-N 3.31Å; F459-G462 WeakPolarHBondContact O-CA 3.46Å; F459-G462 PolarHBondContact O-N 3.33Å; F459-L463 HydrophobicContact CE1-CB 4.35Å; F459-L463 HydrophobicContact CE1-CD2 4.39Å; F459-L463 PolarHBondContact O-N 3.09Å; F459-T501 HydrophobicContact CB-CG2 3.53Å; F459-T501 HydrophobicContact CD2-CG2 3.86Å; F459-T501 HydrophobicContact CG-CG2 4.14Å; F459-L504 HydrophobicContact CD2-CB 4.35Å; F459-L504 HydrophobicContact CE2-CB 3.99Å; F459-L504 HydrophobicContact CE2-CD1 4.46Å; F459-L508 HydrophobicContact CE1-CD1 4.22Å; F459-L508 HydrophobicContact CE2-CD1 3.79Å; F459-L508 HydrophobicContact CZ-CD1 3.6Å; F459-C759 HydrophobicContact CE2-CB 4.42Å; F459-C759 HydrophobicContact CZ-CB 4.18Å; F459-L779 HydrophobicContact CB-CD2 4.29Å; F459-L779 HydrophobicContact CD1-CD2 3.49Å; F459-L779 VanDerWaalsContact CD1-CD2 3.49Å; F459-L779 HydrophobicContact CD2-CD1 4.05Å; F459-L779 HydrophobicContact CD2-CD2 3.95Å; F459-L779 HydrophobicContact CE1-CD2 3.69Å; F459-L779 HydrophobicContact CE2-CD1 4.17Å; F459-L779 HydrophobicContact CE2-CD2 4.11Å; F459-L779 HydrophobicContact CG-CD1 4.45Å; F459-L779 HydrophobicContact CG-CD2 3.62Å; F459-L779 HydrophobicContact CZ-CD2 3.99Å; F459-L782 HydrophobicContact CD1-CD1 4.49Å; F459-L782 HydrophobicContact CE1-CD1 3.38Å; F459-L782 HydrophobicContact CE1-CD2 4.35Å; F459-L782 HydrophobicContact CE1-CG 4.5Å; F459-L782 HydrophobicContact CE2-CD1 4.45Å; F459-L782 HydrophobicContact CZ-CD1 3.35Å
460	A	95.2	Very high	91.7	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58.8	-39.7	178.9	0	0	0	0	0	111.8	L414 A417 L432 T456 A457 L463 L464	L414-A460 HydrophobicContact CD1-CB 4.32Å; A417-A460 HydrophobicContact CB-CB 3.68Å; A417-A460 WeakPolarHBondContact CB-O 3.45Å; L432-A460 HydrophobicContact CD1-CB 4.04Å; L432-A460 HydrophobicContact CD2-CB 4.11Å; T456-A460 WeakPolarHBondContact O-CB 3.43Å; T456-A460 PolarHBondContact O-N 2.9Å; A457-A460 WeakPolarHBondContact O-CB 3.44Å; A457-A460 PolarHBondContact O-N 2.79Å; A460-L463 PolarHBondContact O-N 3.4Å; A460-L464 WeakPolarHBondContact O-CB 3.4Å; A460-L464 PolarHBondContact O-N 3.22Å
461	V	95.2	Very high	92.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.6	-44.5	172.2	173.7	0	0	0	0	111.3	L432 V436 L439 A457 V458 F459 L463 L464 C465 L473 F477	L432-V461 HydrophobicContact CB-CG2 4.15Å; L432-V461 HydrophobicContact CD1-CG2 3.86Å; V436-V461 HydrophobicContact CG2-CG2 3.91Å; L439-V461 HydrophobicContact CD1-CG2 4.1Å; A457-V461 WeakPolarHBondContact O-CG2 3.5Å; A457-V461 PolarHBondContact O-N 3.5Å; V458-V461 PolarHBondContact O-N 3.42Å; F459-V461 VanDerWaalsContact C-N 3.29Å; F459-V461 PolarHBondContact O-N 3.31Å; V461-L463 VanDerWaalsContact C-N 3.31Å; V461-L463 PolarHBondContact O-N 3.08Å; V461-L464 PolarHBondContact O-N 3.02Å; V461-C465 WeakPolarHBondContact O-CB 3.32Å; V461-C465 PolarHBondContact O-N 3.16Å; V461-C465 PolarHBondContact O-SG 3.2Å; V461-C465 VanDerWaalsContact O-SG 3.41Å; V461-L473 HydrophobicContact CG1-CD1 4.48Å; V461-L473 HydrophobicContact CG1-CD2 4.24Å; V461-F477 HydrophobicContact CB-CZ 4.41Å; V461-F477 HydrophobicContact CG1-CZ 4.04Å
462	G	94.9	Very high	92.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.5	-39.1	176.6	0	0	0	0	0	113.2	V458 F459 C465 A466	V458-G462 PolarHBondContact O-N 3.5Å; F459-G462 WeakPolarHBondContact O-CA 3.46Å; F459-G462 PolarHBondContact O-N 3.33Å; G462-C465 CarbonylContact O-C 3.56Å; G462-A466 PolarHBondContact O-N 3.17Å; G462-A466 VanDerWaalsContact O-N 3.11Å
463	L	94.7	Very high	92.6	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-72.6	-42.7	178	-169.2	66.4	0	0	0	112.3	L414 A417 A418 V421 G422 F459 A460 V461 C465 A466 L508 L782 L785	L414-L463 HydrophobicContact CD1-CD2 4.22Å; A417-L463 HydrophobicContact CB-CD2 4.48Å; A418-L463 HydrophobicContact CB-CD2 4.05Å; V421-L463 WeakPolarHBondContact CA-O 3.29Å; V421-L463 HydrophobicContact CG1-CD1 3.89Å; V421-L463 HydrophobicContact CG1-CG 4.26Å; V421-L463 HydrophobicContact CG2-CD1 4.08Å; V421-L463 HydrophobicContact CG2-CD2 4.26Å; V421-L463 HydrophobicContact CG2-CG 3.93Å; G422-L463 PolarHBondContact N-O 3.49Å; F459-L463 HydrophobicContact CE1-CB 4.35Å; F459-L463 HydrophobicContact CE1-CD2 4.39Å; F459-L463 PolarHBondContact O-N 3.09Å; A460-L463 PolarHBondContact O-N 3.4Å; V461-L463 VanDerWaalsContact C-N 3.31Å; V461-L463 PolarHBondContact O-N 3.08Å; L463-C465 VanDerWaalsContact C-N 3.27Å; L463-C465 PolarHBondContact O-N 3.45Å; L463-A466 VanDerWaalsContact O-CB 3.31Å; L463-A466 WeakPolarHBondContact O-CB 3.22Å; L463-A466 PolarHBondContact O-N 3.26Å; L463-L508 HydrophobicContact CD1-CD1 4.28Å; L463-L782 HydrophobicContact CD2-CD2 4.45Å; L463-L785 HydrophobicContact CD1-CD1 4.32Å; L463-L785 HydrophobicContact CD2-CD1 4.25Å
464	L	94.8	Very high	92.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-39.2	175.1	-179.2	66.7	0	0	0	111.5	M420 G422 T423 C424 I428 M429 L432 A460 V461	M420-L464 HydrophobicContact CB-CD1 3.74Å; M420-L464 WeakPolarHBondContact O-CD1 3.35Å; G422-L464 CarbonylContact C-O 3.45Å; G422-L464 VanDerWaalsContact CA-O 3.3Å; G422-L464 WeakPolarHBondContact CA-O 3.41Å; G422-L464 PolarHBondContact N-O 3.45Å; G422-L464 VanDerWaalsContact N-O 3.15Å; T423-L464 PolarHBondContact N-O 3.11Å; C424-L464 PolarHBondContact N-O 2.94Å; C424-L464 VanDerWaalsContact N-O 3.08Å; I428-L464 HydrophobicContact CB-CD2 4.32Å; I428-L464 HydrophobicContact CG2-CD2 4.19Å; M429-L464 HydrophobicContact CB-CD2 4.19Å; M429-L464 HydrophobicContact CE-CD2 4.49Å; L432-L464 HydrophobicContact CD1-CD2 4.24Å; A460-L464 WeakPolarHBondContact O-CB 3.4Å; A460-L464 PolarHBondContact O-N 3.22Å; V461-L464 PolarHBondContact O-N 3.02Å
465	C	94	Very high	92.8	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.014	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	19.7	-178.7	-55	0	0	0	0	113.5	M429 V461 G462 L463 Q467 S468 L473 V509	M429-C465 WeakPolarHBondContact CE-SG 3.4Å; V461-C465 WeakPolarHBondContact O-CB 3.32Å; V461-C465 PolarHBondContact O-N 3.16Å; V461-C465 PolarHBondContact O-SG 3.2Å; V461-C465 VanDerWaalsContact O-SG 3.41Å; G462-C465 CarbonylContact O-C 3.56Å; L463-C465 VanDerWaalsContact C-N 3.27Å; L463-C465 PolarHBondContact O-N 3.45Å; C465-Q467 PolarHBondContact O-N 3.17Å; C465-S468 VanDerWaalsContact O-CB 3.23Å; C465-S468 WeakPolarHBondContact O-CB 3.41Å; C465-S468 PolarHBondContact O-N 3.45Å; C465-S468 PolarHBondContact O-OG 2.83Å; C465-L473 HydrophobicContact CB-CD1 3.97Å; C465-V509 HydrophobicContact CB-CG2 3.98Å
466	A	92.9	Very high	92.8	Very high	3 Å²	3	22.6 Å²	22.6	3%	0.025	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	135.7	-179.2	0	0	0	0	0	111.3	V421 G462 L463 S468 L508	V421-A466 HydrophobicContact CG1-CB 4.03Å; G462-A466 PolarHBondContact O-N 3.17Å; G462-A466 VanDerWaalsContact O-N 3.11Å; L463-A466 VanDerWaalsContact O-CB 3.31Å; L463-A466 WeakPolarHBondContact O-CB 3.22Å; L463-A466 PolarHBondContact O-N 3.26Å; A466-S468 PolarHBondContact O-N 3.33Å; A466-S468 VanDerWaalsContact O-N 3.08Å; A466-L508 CarbonylContact C-O 3.41Å; A466-L508 WeakPolarHBondContact CA-O 3.48Å
467	Q	92.8	Very high	92.8	Very high	54 Å²	54	22.5 Å²	22.5	25%	0.252	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	7.8	-175.9	-57.2	-179.6	-31.5	0	0	115.9	C465 A469 L508 V509 L511 R513 I752	C465-Q467 PolarHBondContact O-N 3.17Å; Q467-A469 VanDerWaalsContact C-N 3.27Å; Q467-A469 PolarHBondContact O-N 3.44Å; Q467-L508 PolarHBondContact N-O 3.19Å; Q467-V509 CarbonylContact C-O 3.32Å; Q467-V509 WeakPolarHBondContact CA-O 3.48Å; Q467-V509 PolarHBondContact N-O 3.08Å; Q467-L511 HydrophobicContact CG-CB 4.03Å; Q467-L511 HydrophobicContact CG-CD2 4.06Å; Q467-L511 HydrophobicContact CG-CG 4.38Å; Q467-R513 WeakPolarHBondContact O-CD 3.46Å; Q467-R513 PolarHBondContact O-NE 3.18Å; Q467-R513 PolarHBondContact O-NH1 3.21Å; Q467-I752 HydrophobicContact CG-CG1 4.39Å
468	S	92.1	Very high	92.7	Very high	41 Å²	41	22.6 Å²	22.6	29%	0.287	12%	0.12	S	C	.	.			trans	-67.2	-28.2	178.6	63.1	0	0	0	0	113.2	C465 A466 D470 V509	C465-S468 VanDerWaalsContact O-CB 3.23Å; C465-S468 WeakPolarHBondContact O-CB 3.41Å; C465-S468 PolarHBondContact O-N 3.45Å; C465-S468 PolarHBondContact O-OG 2.83Å; A466-S468 PolarHBondContact O-N 3.33Å; A466-S468 VanDerWaalsContact O-N 3.08Å; S468-D470 PolarHBondContact O-N 3.24Å; S468-V509 PolarHBondContact N-O 3.48Å
469	A	89.4	Confident	92.5	Very high	23 Å²	23	25.4 Å²	25.4	19%	0.19	13%	0.133	C	C	.	.			trans	54.8	34.5	-172.2	0	0	0	0	0	113.8	Q467 L471 V509 R513	Q467-A469 VanDerWaalsContact C-N 3.27Å; Q467-A469 PolarHBondContact O-N 3.44Å; A469-L471 PolarHBondContact O-N 3.05Å; A469-V509 WeakPolarHBondContact CA-O 3.29Å; A469-V509 PolarHBondContact N-O 3.47Å; A469-R513 HydrophobicContact CB-CB 4.14Å
470	D	91	Very high	92.1	Very high	64 Å²	64	26.5 Å²	26.5	34%	0.342	14%	0.138	S	C	.	.			trans	-69.4	114.8	174.6	-175.5	2.9	0	0	0	111.3	S468 K472 L473 C474	S468-D470 PolarHBondContact O-N 3.24Å; D470-K472 VanDerWaalsContact C-N 3.31Å; D470-K472 PolarHBondContact O-N 2.86Å; D470-K472 PolarHBondContact OD1-N 3.29Å; D470-L473 HydrophobicContact CB-CB 4.38Å; D470-L473 HydrophobicContact CB-CD1 4.17Å; D470-L473 HydrophobicContact CB-CG 4.36Å; D470-C474 PolarHBondContact O-N 3.01Å; D470-C474 VanDerWaalsContact O-N 3.15Å; D470-C474 PolarHBondContact O-SG 3.46Å; D470-C474 VanDerWaalsContact O-SG 3.42Å
471	L	90.1	Very high	91.8	Very high	42 Å²	42	26.7 Å²	26.7	22%	0.22	14%	0.139	C	C	.	.	H	α-helix	trans	-58.8	-40.4	178.8	176.1	67.5	0	0	0	112.3	A469 C474 I475 L517 L526	A469-L471 PolarHBondContact O-N 3.05Å; L471-C474 WeakPolarHBondContact O-CB 3.3Å; L471-C474 PolarHBondContact O-N 3.08Å; L471-I475 HydrophobicContact CD1-CD1 3.92Å; L471-I475 HydrophobicContact CD1-CG1 4.14Å; L471-I475 HydrophobicContact CD2-CD1 4.24Å; L471-I475 HydrophobicContact CG-CD1 3.77Å; L471-I475 HydrophobicContact CG-CG1 4.36Å; L471-I475 WeakPolarHBondContact O-CG1 3.12Å; L471-I475 PolarHBondContact O-N 3.44Å; L471-L517 HydrophobicContact CB-CD1 4.44Å; L471-L517 HydrophobicContact CD1-CD1 4.03Å; L471-L526 HydrophobicContact CD1-CD1 3.58Å
472	K	90.9	Very high	91.3	Very high	159 Å²	159	26.9 Å²	26.9	69%	0.691	14%	0.14	S	C	*	.	H	α-helix	trans	-65.1	-48.6	-173.5	-68.8	-178.9	-179.3	179.1	0	110.4	D470 C474 I475 C476	D470-K472 VanDerWaalsContact C-N 3.31Å; D470-K472 PolarHBondContact O-N 2.86Å; D470-K472 PolarHBondContact OD1-N 3.29Å; K472-C474 VanDerWaalsContact C-N 3.34Å; K472-C474 PolarHBondContact O-N 3.11Å; K472-I475 PolarHBondContact O-N 3.34Å; K472-C476 PolarHBondContact O-N 2.92Å; K472-C476 PolarHBondContact O-SG 3.27Å
473	L	92.3	Very high	90.3	Very high	11 Å²	11	28 Å²	28	6%	0.058	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-44.6	175.1	-68.6	177	0	0	0	111.5	F438 L439 V461 C465 D470 I475 C476 F477	F438-L473 HydrophobicContact CE2-CD2 4.12Å; L439-L473 HydrophobicContact CD2-CD2 4.46Å; V461-L473 HydrophobicContact CG1-CD1 4.48Å; V461-L473 HydrophobicContact CG1-CD2 4.24Å; C465-L473 HydrophobicContact CB-CD1 3.97Å; D470-L473 HydrophobicContact CB-CB 4.38Å; D470-L473 HydrophobicContact CB-CD1 4.17Å; D470-L473 HydrophobicContact CB-CG 4.36Å; L473-I475 VanDerWaalsContact C-N 3.34Å; L473-I475 PolarHBondContact O-N 2.96Å; L473-C476 PolarHBondContact O-N 2.97Å; L473-F477 HydrophobicContact CB-CD2 4.44Å; L473-F477 HydrophobicContact CB-CE2 4.06Å; L473-F477 WeakPolarHBondContact O-CD2 3.45Å; L473-F477 WeakPolarHBondContact O-CG 3.18Å; L473-F477 PolarHBondContact O-N 3.34Å
474	C	91.7	Very high	89	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-42.3	176.1	-77.8	0	0	0	0	113	D470 L471 K472 L478 F506 L517	D470-C474 PolarHBondContact O-N 3.01Å; D470-C474 VanDerWaalsContact O-N 3.15Å; D470-C474 PolarHBondContact O-SG 3.46Å; D470-C474 VanDerWaalsContact O-SG 3.42Å; L471-C474 WeakPolarHBondContact O-CB 3.3Å; L471-C474 PolarHBondContact O-N 3.08Å; K472-C474 VanDerWaalsContact C-N 3.34Å; K472-C474 PolarHBondContact O-N 3.11Å; C474-L478 WeakPolarHBondContact O-CB 3.23Å; C474-L478 PolarHBondContact O-N 2.98Å; C474-L478 VanDerWaalsContact O-N 3.09Å; C474-F506 HydrophobicContact CB-CD2 3.85Å; C474-F506 HydrophobicContact CB-CE2 3.48Å; C474-F506 VanDerWaalsContact CB-CE2 3.48Å; C474-F506 HydrophobicContact CB-CZ 4.24Å; C474-F506 WeakPolarHBondContact O-CD2 3.07Å; C474-F506 WeakPolarHBondContact O-CE2 3.42Å; C474-L517 HydrophobicContact CB-CD2 4.37Å
475	I	91.2	Very high	87.1	Confident	41 Å²	41	31 Å²	31	21%	0.21	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-48.4	175.4	-69.3	166.8	0	0	0	110.2	L471 K472 L473 F477 L478 E479 F525 L526	L471-I475 HydrophobicContact CD1-CD1 3.92Å; L471-I475 HydrophobicContact CD1-CG1 4.14Å; L471-I475 HydrophobicContact CD2-CD1 4.24Å; L471-I475 HydrophobicContact CG-CD1 3.77Å; L471-I475 HydrophobicContact CG-CG1 4.36Å; L471-I475 WeakPolarHBondContact O-CG1 3.12Å; L471-I475 PolarHBondContact O-N 3.44Å; K472-I475 PolarHBondContact O-N 3.34Å; L473-I475 VanDerWaalsContact C-N 3.34Å; L473-I475 PolarHBondContact O-N 2.96Å; I475-F477 PolarHBondContact O-N 3.38Å; I475-L478 PolarHBondContact O-N 3.22Å; I475-L478 VanDerWaalsContact O-N 3.12Å; I475-E479 HydrophobicContact CG2-CG 4.37Å; I475-E479 WeakPolarHBondContact O-CG 3.07Å; I475-E479 PolarHBondContact O-N 3.18Å; I475-F525 HydrophobicContact CD1-CZ 4.35Å; I475-L526 HydrophobicContact CG1-CD2 3.96Å
476	C	91.6	Very high	85.3	Confident	30 Å²	30	33.4 Å²	33.4	20%	0.203	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-45.6	179.9	-66	0	0	0	0	112.1	F438 K472 L473 L478 E479 Q480	F438-C476 HydrophobicContact CB-CB 4.2Å; F438-C476 HydrophobicContact CD1-CB 4.24Å; F438-C476 HydrophobicContact CD2-CB 3.51Å; F438-C476 HydrophobicContact CE2-CB 3.85Å; F438-C476 HydrophobicContact CG-CB 3.73Å; F438-C476 HydrophobicContact CZ-CB 4.34Å; K472-C476 PolarHBondContact O-N 2.92Å; K472-C476 PolarHBondContact O-SG 3.27Å; L473-C476 PolarHBondContact O-N 2.97Å; C476-L478 VanDerWaalsContact C-N 3.29Å; C476-L478 PolarHBondContact O-N 3.43Å; C476-E479 PolarHBondContact O-N 3.02Å; C476-Q480 VanDerWaalsContact O-CG 3.31Å; C476-Q480 WeakPolarHBondContact O-CG 3.48Å; C476-Q480 PolarHBondContact O-N 3.3Å
477	F	93.1	Very high	83.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-41.4	175.2	-69.3	-53.3	0	0	0	111.7	F438 V458 V461 L473 I475 Q480 I481 A505 F506 V509	F438-F477 HydrophobicContact CE1-CD1 4.07Å; F438-F477 HydrophobicContact CE1-CE1 4.05Å; F438-F477 AromaticContact CZ-CD1 3.95Å; F438-F477 HydrophobicContact CZ-CD1 3.95Å; F438-F477 AromaticContact CZ-CE1 3.61Å; F438-F477 HydrophobicContact CZ-CE1 3.61Å; F438-F477 HydrophobicContact CZ-CZ 4.17Å; V458-F477 HydrophobicContact CG1-CD1 3.99Å; V458-F477 HydrophobicContact CG1-CE1 3.71Å; V461-F477 HydrophobicContact CB-CZ 4.41Å; V461-F477 HydrophobicContact CG1-CZ 4.04Å; L473-F477 HydrophobicContact CB-CD2 4.44Å; L473-F477 HydrophobicContact CB-CE2 4.06Å; L473-F477 WeakPolarHBondContact O-CD2 3.45Å; L473-F477 WeakPolarHBondContact O-CG 3.18Å; L473-F477 PolarHBondContact O-N 3.34Å; I475-F477 PolarHBondContact O-N 3.38Å; F477-Q480 PolarHBondContact O-N 2.88Å; F477-I481 VanDerWaalsContact O-CG1 3.29Å; F477-I481 WeakPolarHBondContact O-CG1 3.5Å; F477-I481 PolarHBondContact O-N 3.1Å; F477-I481 VanDerWaalsContact O-N 3.07Å; F477-A505 HydrophobicContact CD1-CB 4.17Å; F477-A505 HydrophobicContact CE1-CB 3.8Å; F477-A505 HydrophobicContact CE2-CB 4.24Å; F477-A505 HydrophobicContact CZ-CB 3.84Å; F477-F506 HydrophobicContact CB-CB 4.19Å; F477-F506 HydrophobicContact CB-CD2 4.39Å; F477-F506 HydrophobicContact CD2-CB 4.45Å; F477-V509 HydrophobicContact CE2-CG2 3.98Å
478	L	91.3	Very high	81.3	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-40.4	-180	-168.2	147.6	0	0	0	111.7	C474 I475 C476 Q480 I481 E482 R529 I530 M533	C474-L478 WeakPolarHBondContact O-CB 3.23Å; C474-L478 PolarHBondContact O-N 2.98Å; C474-L478 VanDerWaalsContact O-N 3.09Å; I475-L478 PolarHBondContact O-N 3.22Å; I475-L478 VanDerWaalsContact O-N 3.12Å; C476-L478 VanDerWaalsContact C-N 3.29Å; C476-L478 PolarHBondContact O-N 3.43Å; L478-Q480 VanDerWaalsContact C-N 3.32Å; L478-Q480 PolarHBondContact O-N 3.35Å; L478-I481 PolarHBondContact O-N 2.87Å; L478-E482 HydrophobicContact CD2-CG 4.31Å; L478-E482 VanDerWaalsContact CD2-OE1 3.3Å; L478-E482 WeakPolarHBondContact CD2-OE1 3.48Å; L478-E482 WeakPolarHBondContact O-CG 3.44Å; L478-E482 PolarHBondContact O-N 3.47Å; L478-E482 VanDerWaalsContact O-N 3.09Å; L478-R529 HydrophobicContact CD1-CB 4.37Å; L478-R529 HydrophobicContact CD2-CB 4.06Å; L478-R529 VanDerWaalsContact CD2-NH2 3.26Å; L478-I530 HydrophobicContact CD1-CD1 4.13Å; L478-I530 HydrophobicContact CD1-CG1 3.59Å; L478-M533 HydrophobicContact CG-SD 4.25Å
479	E	88	Confident	79.6	Confident	60 Å²	60	36.7 Å²	36.7	28%	0.28	18%	0.182	S	C	.	.	H	α-helix	trans	-60.7	-39.6	172.8	-68.3	-177.7	139.9	0	0	112.6	I475 C476 I481 E482 N483 R541	I475-E479 HydrophobicContact CG2-CG 4.37Å; I475-E479 WeakPolarHBondContact O-CG 3.07Å; I475-E479 PolarHBondContact O-N 3.18Å; C476-E479 PolarHBondContact O-N 3.02Å; E479-I481 VanDerWaalsContact C-N 3.32Å; E479-I481 PolarHBondContact O-N 2.91Å; E479-E482 PolarHBondContact O-N 3.43Å; E479-N483 PolarHBondContact O-N 3.03Å; E479-R541 IonicContact OE1-NH1 2.91Å; E479-R541 PolarHBondContact OE1-NH1 3.21Å
480	Q	87.3	Confident	78.2	Confident	24 Å²	24	42.1 Å²	42.1	11%	0.112	21%	0.208	C	C	.	.	H	α-helix	trans	-67.2	-29.8	176.2	-66.4	-63.2	-59.2	0	0	113.1	F438 C476 F477 L478 N483 Y498	F438-Q480 HydrophobicContact CD1-CG 3.74Å; F438-Q480 HydrophobicContact CE1-CG 4.18Å; C476-Q480 VanDerWaalsContact O-CG 3.31Å; C476-Q480 WeakPolarHBondContact O-CG 3.48Å; C476-Q480 PolarHBondContact O-N 3.3Å; F477-Q480 PolarHBondContact O-N 2.88Å; L478-Q480 VanDerWaalsContact C-N 3.32Å; L478-Q480 PolarHBondContact O-N 3.35Å; Q480-N483 CarbonylContact O-C 3.56Å; Q480-Y498 HydrophobicContact CB-CE1 4.12Å; Q480-Y498 PolarHBondContact OE1-OH 3.22Å
481	I	89	Confident	76.8	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-73.5	-38.8	174.6	-57.7	160.1	0	0	0	110.5	F477 L478 E479 A499 C502 M533 T566 P569	F477-I481 VanDerWaalsContact O-CG1 3.29Å; F477-I481 WeakPolarHBondContact O-CG1 3.5Å; F477-I481 PolarHBondContact O-N 3.1Å; F477-I481 VanDerWaalsContact O-N 3.07Å; L478-I481 PolarHBondContact O-N 2.87Å; E479-I481 VanDerWaalsContact C-N 3.32Å; E479-I481 PolarHBondContact O-N 2.91Å; I481-A499 HydrophobicContact CG2-CB 4.38Å; I481-C502 HydrophobicContact CD1-CB 4.1Å; I481-C502 HydrophobicContact CG1-CB 3.47Å; I481-C502 VanDerWaalsContact CG1-CB 3.47Å; I481-M533 HydrophobicContact CB-CE 3.56Å; I481-M533 HydrophobicContact CD1-CE 4.27Å; I481-M533 HydrophobicContact CG2-CE 3.09Å; I481-T566 HydrophobicContact CG2-CG2 4.29Å; I481-P569 HydrophobicContact CD1-CB 4.21Å; I481-P569 HydrophobicContact CG1-CB 4.46Å; I481-P569 HydrophobicContact CG2-CB 4.07Å; I481-P569 HydrophobicContact CG2-CG 3.64Å
482	E	83.5	Confident	75.8	Confident	3 Å²	3	43 Å²	43	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-66.6	-45.7	180	-69.5	-175.7	176.3	0	0	112.3	L478 E479 R529 M533 K542 Y561	L478-E482 HydrophobicContact CD2-CG 4.31Å; L478-E482 VanDerWaalsContact CD2-OE1 3.3Å; L478-E482 WeakPolarHBondContact CD2-OE1 3.48Å; L478-E482 WeakPolarHBondContact O-CG 3.44Å; L478-E482 PolarHBondContact O-N 3.47Å; L478-E482 VanDerWaalsContact O-N 3.09Å; E479-E482 PolarHBondContact O-N 3.43Å; E482-R529 IonicContact OE1-CZ 3.17Å; E482-R529 VanDerWaalsContact OE1-CZ 3.26Å; E482-R529 IonicContact OE1-NE 2.98Å; E482-R529 PolarHBondContact OE1-NE 3.45Å; E482-R529 IonicContact OE1-NH2 2.61Å; E482-R529 PolarHBondContact OE1-NH2 3.45Å; E482-R529 IonicContact OE2-CZ 3.16Å; E482-R529 IonicContact OE2-NE 3.55Å; E482-R529 IonicContact OE2-NH2 3.98Å; E482-R529 PolarHBondContact OE2-NH2 3.29Å; E482-M533 HydrophobicContact CG-CE 4.49Å; E482-M533 HydrophobicContact CG-SD 4.27Å; E482-K542 WeakPolarHBondContact O-CE 3.37Å; E482-K542 PolarHBondContact O-NZ 3.13Å; E482-Y561 HydrophobicContact CB-CE1 4.27Å; E482-Y561 HydrophobicContact CG-CE1 3.71Å; E482-Y561 PolarHBondContact OE1-OH 2.96Å
483	N	75	Confident	75	Confident	23 Å²	23	38.4 Å²	38.4	12%	0.123	20%	0.203	C	C	.	.			trans	-130	92.1	178.4	-70.6	-22.3	0	0	0	109.7	E479 Q480 S485 K542 E545	E479-N483 PolarHBondContact O-N 3.03Å; Q480-N483 CarbonylContact O-C 3.56Å; N483-S485 PolarHBondContact O-N 3.45Å; N483-S485 PolarHBondContact O-OG 2.84Å; N483-K542 VanDerWaalsContact OD1-CE 3.27Å; N483-K542 WeakPolarHBondContact OD1-CE 3.44Å; N483-E545 PolarHBondContact ND2-OE1 3.49Å; N483-E545 PolarHBondContact ND2-OE2 2.95Å
484	P	66.3	Low	74.3	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.013	21%	0.208	C	C	.	.			trans	-76.4	60.9	167.6	32.7	-34.1	0	0	0	109.1	W486 A487 A488 R495 Y498	P484-W486 VanDerWaalsContact C-N 3.31Å; P484-W486 PolarHBondContact O-N 3.35Å; P484-A487 HydrophobicContact CB-CB 4.33Å; P484-A487 PolarHBondContact O-N 2.78Å; P484-A488 PolarHBondContact O-N 2.76Å; P484-R495 HydrophobicContact CB-CG 4.07Å; P484-R495 HydrophobicContact CG-CG 3.51Å; P484-R495 VanDerWaalsContact CG-NE 3.25Å; P484-Y498 HydrophobicContact CB-CD1 4.14Å
485	S	55.1	Low	73.9	Confident	62 Å²	62	40.1 Å²	40.1	43%	0.434	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.1	-163.1	15.6	0	0	0	0	114.5	N483	N483-S485 PolarHBondContact O-N 3.45Å; N483-S485 PolarHBondContact O-OG 2.84Å
486	W	56.3	Low	73.7	Confident	54 Å²	54	40.7 Å²	40.7	21%	0.205	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-29.6	175.4	65.8	-91	0	0	0	112.6	P451 Q454 P484 A488 R489 Y498	P451-W486 HydrophobicContact CB-CH2 3.89Å; P451-W486 HydrophobicContact CB-CZ3 3.74Å; P451-W486 HydrophobicContact CG-CZ3 3.97Å; Q454-W486 HydrophobicContact CB-CH2 3.69Å; Q454-W486 HydrophobicContact CB-CZ2 4.09Å; Q454-W486 HydrophobicContact CB-CZ3 4.32Å; Q454-W486 HydrophobicContact CG-CH2 3.57Å; Q454-W486 HydrophobicContact CG-CZ2 3.47Å; Q454-W486 VanDerWaalsContact CG-CZ2 3.47Å; Q454-W486 HydrophobicContact CG-CZ3 4.24Å; Q454-W486 VanDerWaalsContact NE2-NE1 3.15Å; Q454-W486 VanDerWaalsContact OE1-CE3 3.23Å; Q454-W486 VanDerWaalsContact OE1-CH2 3.23Å; P484-W486 VanDerWaalsContact C-N 3.31Å; P484-W486 PolarHBondContact O-N 3.35Å; W486-A488 PolarHBondContact O-N 3.2Å; W486-R489 PolarHBondContact O-N 3.06Å; W486-Y498 AromaticContact CE2-CE1 3.99Å; W486-Y498 AromaticContact CE2-CZ 3.85Å; W486-Y498 HydrophobicContact CH2-CD2 4.22Å; W486-Y498 HydrophobicContact CH2-CE2 4.4Å; W486-Y498 HydrophobicContact CZ2-CD1 4.03Å; W486-Y498 AromaticContact CZ2-CD2 3.52Å; W486-Y498 HydrophobicContact CZ2-CD2 3.52Å; W486-Y498 AromaticContact CZ2-CE1 3.91Å; W486-Y498 HydrophobicContact CZ2-CE1 3.91Å; W486-Y498 AromaticContact CZ2-CE2 3.41Å; W486-Y498 HydrophobicContact CZ2-CE2 3.41Å; W486-Y498 VanDerWaalsContact CZ2-CE2 3.41Å; W486-Y498 AromaticContact CZ2-CG 3.81Å; W486-Y498 HydrophobicContact CZ2-CG 3.81Å; W486-Y498 AromaticContact CZ2-CZ 3.59Å; W486-Y498 AromaticContact NE1-CE1 3.55Å; W486-Y498 AromaticContact NE1-CZ 3.5Å; W486-Y498 PolarHBondContact NE1-OH 3.47Å
487	A	54.2	Low	73.6	Confident	2 Å²	2	39.4 Å²	39.4	2%	0.017	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.6	175.8	0	0	0	0	0	111.9	P484 N491 V492	P484-A487 HydrophobicContact CB-CB 4.33Å; P484-A487 PolarHBondContact O-N 2.78Å; A487-N491 CarbonylContact O-C 3.43Å; A487-N491 VanDerWaalsContact O-O 3.05Å; A487-V492 PolarHBondContact O-N 2.8Å
488	A	48.4	Very low	73.5	Confident	14 Å²	14	39.5 Å²	39.5	12%	0.116	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-16.1	179.2	0	0	0	0	0	114.9	P484 W486	P484-A488 PolarHBondContact O-N 2.76Å; W486-A488 PolarHBondContact O-N 3.2Å
489	R	56.9	Low	73.5	Confident	151 Å²	151	39.4 Å²	39.4	57%	0.57	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-53	-177.1	-72.7	-172.9	174.2	179.6	-3.6	111.8	W486	W486-R489 PolarHBondContact O-N 3.06Å
490	D	58.6	Low	73.8	Confident	137 Å²	137	36.7 Å²	36.7	73%	0.733	19%	0.19	S	C	*	.	S	Bend	trans	-119.3	-27	-173.7	-58.3	-40	0	0	0	114.4
491	N	63.2	Low	74.1	Confident	74 Å²	74	35.5 Å²	35.5	40%	0.396	19%	0.185	S	C	.	.			trans	-134.8	63	-168.2	-78.3	-41.5	0	0	0	113.7	P451 A487 S493 E494	P451-N491 HydrophobicContact CG-CB 3.89Å; P451-N491 WeakPolarHBondContact CG-ND2 3.42Å; A487-N491 CarbonylContact O-C 3.43Å; A487-N491 VanDerWaalsContact O-O 3.05Å; N491-S493 PolarHBondContact O-N 3.15Å; N491-E494 PolarHBondContact O-N 3.28Å
492	V	68.5	Low	74.3	Confident	49 Å²	49	35.3 Å²	35.3	30%	0.297	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-50.9	-30.8	-179.9	177.6	0	0	0	0	113.5	A487 E494 R495 L554 V555	A487-V492 PolarHBondContact O-N 2.8Å; V492-E494 VanDerWaalsContact C-N 3.3Å; V492-E494 PolarHBondContact O-N 3.5Å; V492-R495 VanDerWaalsContact O-CB 3.3Å; V492-R495 WeakPolarHBondContact O-CB 3.5Å; V492-R495 PolarHBondContact O-N 3.3Å; V492-L554 HydrophobicContact CG2-CB 3.5Å; V492-L554 VanDerWaalsContact CG2-CB 3.5Å; V492-L554 HydrophobicContact CG2-CD1 3.66Å; V492-L554 HydrophobicContact CG2-CG 4.23Å; V492-V555 HydrophobicContact CB-CG2 4.31Å; V492-V555 HydrophobicContact CG1-CG2 3.28Å; V492-V555 HydrophobicContact CG2-CG2 4.04Å
493	S	73.3	Confident	74.9	Confident	64 Å²	64	35.2 Å²	35.2	45%	0.448	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-65.1	-29	-173.7	54.5	0	0	0	0	114.3	N491 R773	N491-S493 PolarHBondContact O-N 3.15Å; S493-R773 WeakPolarHBondContact O-CA 3.44Å; S493-R773 WeakPolarHBondContact O-CB 3.42Å; S493-R773 WeakPolarHBondContact O-CG 3.26Å
494	E	77.9	Confident	75.9	Confident	37 Å²	37	34.1 Å²	34.1	17%	0.173	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-96.1	5.5	-174.9	-59.5	-164.6	164.3	0	0	113.5	P451 N491 V492 E496 G497 Y498	P451-E494 WeakPolarHBondContact CB-OE2 3.18Å; N491-E494 PolarHBondContact O-N 3.28Å; V492-E494 VanDerWaalsContact C-N 3.3Å; V492-E494 PolarHBondContact O-N 3.5Å; E494-E496 PolarHBondContact O-N 3.07Å; E494-G497 PolarHBondContact O-N 3.07Å; E494-Y498 PolarHBondContact O-N 3.25Å
495	R	84	Confident	77.2	Confident	9 Å²	9	34 Å²	34	3%	0.034	18%	0.177	C	C	.	.	H	α-helix	trans	-56.7	-44.7	-177.6	-177.5	-174.2	164.8	160.7	7.2	113.5	P484 V492 A499 E557 V565	P484-R495 HydrophobicContact CB-CG 4.07Å; P484-R495 HydrophobicContact CG-CG 3.51Å; P484-R495 VanDerWaalsContact CG-NE 3.25Å; V492-R495 VanDerWaalsContact O-CB 3.3Å; V492-R495 WeakPolarHBondContact O-CB 3.5Å; V492-R495 PolarHBondContact O-N 3.3Å; R495-A499 WeakPolarHBondContact O-CB 3.18Å; R495-A499 PolarHBondContact O-N 3.35Å; R495-E557 IonicContact CZ-OE1 3.2Å; R495-E557 IonicContact NH1-OE1 3.01Å; R495-E557 PolarHBondContact NH1-OE1 3.42Å; R495-E557 IonicContact NH2-OE1 3.47Å; R495-E557 PolarHBondContact NH2-OE1 3.09Å; R495-E557 IonicContact NH2-OE2 2.7Å; R495-E557 PolarHBondContact NH2-OE2 3.1Å; R495-E557 VanDerWaalsContact NH2-OE2 3.11Å; R495-V565 HydrophobicContact CG-CG1 4.39Å
496	E	87	Confident	79.2	Confident	54 Å²	54	31.1 Å²	31.1	25%	0.252	16%	0.157	S	C	.	.	H	α-helix	trans	-67.1	-40.6	179.8	-72	-175.3	-164.5	0	0	111.6	E494 A499 L500 V565 R603 R773 H774	E494-E496 PolarHBondContact O-N 3.07Å; E496-A499 PolarHBondContact O-N 3Å; E496-L500 VanDerWaalsContact O-CB 3.31Å; E496-L500 WeakPolarHBondContact O-CB 3.37Å; E496-L500 PolarHBondContact O-N 2.81Å; E496-V565 HydrophobicContact CG-CG1 4.45Å; E496-V565 HydrophobicContact CG-CG2 4.03Å; E496-R603 IonicContact OE1-NH1 2.74Å; E496-R603 IonicContact OE2-NH1 2.63Å; E496-R773 CarbonylContact C-O 3.4Å; E496-R773 WeakPolarHBondContact CB-O 3.49Å; E496-H774 IonicContact OE2-CE1 3.11Å; E496-H774 PolarHBondContact OE2-CE1 2.78Å; E496-H774 IonicContact OE2-ND1 3.25Å; E496-H774 PolarHBondContact OE2-ND1 3.02Å
497	G	89.1	Confident	81	Confident	2 Å²	2	28.6 Å²	28.6	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-64.6	-41.2	177.9	0	0	0	0	0	112.4	E494 T501 R773	E494-G497 PolarHBondContact O-N 3.07Å; G497-T501 WeakPolarHBondContact O-CB 3.46Å; G497-T501 PolarHBondContact O-N 3.18Å; G497-T501 PolarHBondContact O-OG1 2.85Å; G497-R773 WeakPolarHBondContact CA-O 3.25Å; G497-R773 PolarHBondContact N-O 3.13Å
498	Y	90.5	Very high	83	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-47.6	173.5	-179.7	-106.7	0	0	0	112.1	Q454 V458 Q480 P484 W486 E494 L500 T501 C502	Q454-Y498 HydrophobicContact CG-CE2 4.42Å; V458-Y498 HydrophobicContact CB-CE2 4.21Å; V458-Y498 HydrophobicContact CG1-CE2 4.42Å; V458-Y498 HydrophobicContact CG2-CE2 3.71Å; Q480-Y498 HydrophobicContact CB-CE1 4.12Å; Q480-Y498 PolarHBondContact OE1-OH 3.22Å; P484-Y498 HydrophobicContact CB-CD1 4.14Å; W486-Y498 AromaticContact CE2-CE1 3.99Å; W486-Y498 AromaticContact CE2-CZ 3.85Å; W486-Y498 HydrophobicContact CH2-CD2 4.22Å; W486-Y498 HydrophobicContact CH2-CE2 4.4Å; W486-Y498 HydrophobicContact CZ2-CD1 4.03Å; W486-Y498 AromaticContact CZ2-CD2 3.52Å; W486-Y498 HydrophobicContact CZ2-CD2 3.52Å; W486-Y498 AromaticContact CZ2-CE1 3.91Å; W486-Y498 HydrophobicContact CZ2-CE1 3.91Å; W486-Y498 AromaticContact CZ2-CE2 3.41Å; W486-Y498 HydrophobicContact CZ2-CE2 3.41Å; W486-Y498 VanDerWaalsContact CZ2-CE2 3.41Å; W486-Y498 AromaticContact CZ2-CG 3.81Å; W486-Y498 HydrophobicContact CZ2-CG 3.81Å; W486-Y498 AromaticContact CZ2-CZ 3.59Å; W486-Y498 AromaticContact NE1-CE1 3.55Å; W486-Y498 AromaticContact NE1-CZ 3.5Å; W486-Y498 PolarHBondContact NE1-OH 3.47Å; E494-Y498 PolarHBondContact O-N 3.25Å; Y498-L500 PolarHBondContact O-N 2.74Å; Y498-T501 WeakPolarHBondContact O-CB 3.09Å; Y498-T501 PolarHBondContact O-N 3.17Å; Y498-T501 VanDerWaalsContact O-N 3.15Å; Y498-C502 PolarHBondContact O-N 3.3Å; Y498-C502 PolarHBondContact O-SG 3.29Å
499	A	91.8	Very high	85.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.7	-44.5	178.3	0	0	0	0	0	111.7	I481 R495 E496 T501 C502 G503 V565 P569	I481-A499 HydrophobicContact CG2-CB 4.38Å; R495-A499 WeakPolarHBondContact O-CB 3.18Å; R495-A499 PolarHBondContact O-N 3.35Å; E496-A499 PolarHBondContact O-N 3Å; A499-T501 VanDerWaalsContact C-N 3.31Å; A499-T501 PolarHBondContact O-N 3.09Å; A499-C502 WeakPolarHBondContact O-CB 3.19Å; A499-C502 PolarHBondContact O-N 2.76Å; A499-G503 PolarHBondContact O-N 3.18Å; A499-V565 HydrophobicContact CB-CG1 3.72Å; A499-P569 HydrophobicContact CB-CG 4.42Å; A499-P569 VanDerWaalsContact O-CB 3.28Å; A499-P569 WeakPolarHBondContact O-CB 3.45Å
500	L	93.4	Very high	86.9	Confident	3 Å²	3	20.7 Å²	20.7	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-56.7	-46.5	173.6	178.9	67.1	0	0	0	111.1	E496 Y498 C502 G503 L504 A568 L572 Y762 H774 H775	E496-L500 VanDerWaalsContact O-CB 3.31Å; E496-L500 WeakPolarHBondContact O-CB 3.37Å; E496-L500 PolarHBondContact O-N 2.81Å; Y498-L500 PolarHBondContact O-N 2.74Å; L500-C502 VanDerWaalsContact C-N 3.34Å; L500-C502 PolarHBondContact O-N 3.35Å; L500-G503 WeakPolarHBondContact O-CA 3.32Å; L500-G503 PolarHBondContact O-N 3.32Å; L500-G503 VanDerWaalsContact O-N 3.09Å; L500-L504 HydrophobicContact CG-CD1 4.19Å; L500-L504 HydrophobicContact CG-CG 4.46Å; L500-L504 WeakPolarHBondContact O-CG 3.43Å; L500-L504 PolarHBondContact O-N 3.43Å; L500-A568 HydrophobicContact CD1-CB 4.47Å; L500-L572 HydrophobicContact CD1-CD1 3.68Å; L500-Y762 HydrophobicContact CD1-CE2 3.84Å; L500-Y762 HydrophobicContact CD2-CD1 3.78Å; L500-Y762 HydrophobicContact CD2-CD2 4.2Å; L500-Y762 HydrophobicContact CD2-CE1 3.37Å; L500-Y762 HydrophobicContact CD2-CE2 3.89Å; L500-Y762 HydrophobicContact CD2-CG 4.16Å; L500-Y762 VanDerWaalsContact CD2-CZ 3.46Å; L500-H774 WeakPolarHBondContact CD2-O 3.34Å; L500-H775 HydrophobicContact CD2-CB 4.11Å
501	T	94.1	Very high	88.6	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.8	-39	-178.6	-59.3	0	0	0	0	111.9	T455 F459 G497 Y498 A499 G503 L504 A505	T455-T501 HydrophobicContact CG2-CG2 3.8Å; T455-T501 VanDerWaalsContact CG2-OG1 3.29Å; T455-T501 WeakPolarHBondContact CG2-OG1 3.25Å; T455-T501 WeakPolarHBondContact O-CG2 3.39Å; F459-T501 HydrophobicContact CB-CG2 3.53Å; F459-T501 HydrophobicContact CD2-CG2 3.86Å; F459-T501 HydrophobicContact CG-CG2 4.14Å; G497-T501 WeakPolarHBondContact O-CB 3.46Å; G497-T501 PolarHBondContact O-N 3.18Å; G497-T501 PolarHBondContact O-OG1 2.85Å; Y498-T501 WeakPolarHBondContact O-CB 3.09Å; Y498-T501 PolarHBondContact O-N 3.17Å; Y498-T501 VanDerWaalsContact O-N 3.15Å; A499-T501 VanDerWaalsContact C-N 3.31Å; A499-T501 PolarHBondContact O-N 3.09Å; T501-G503 VanDerWaalsContact C-N 3.34Å; T501-L504 PolarHBondContact O-N 2.71Å; T501-A505 VanDerWaalsContact O-CB 3.32Å; T501-A505 WeakPolarHBondContact O-CB 3.34Å; T501-A505 PolarHBondContact O-N 2.93Å
502	C	94.1	Very high	89.9	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.4	-41.5	171.2	-65	0	0	0	0	111.8	I481 Y498 A499 L500 A505 F506	I481-C502 HydrophobicContact CD1-CB 4.1Å; I481-C502 HydrophobicContact CG1-CB 3.47Å; I481-C502 VanDerWaalsContact CG1-CB 3.47Å; Y498-C502 PolarHBondContact O-N 3.3Å; Y498-C502 PolarHBondContact O-SG 3.29Å; A499-C502 WeakPolarHBondContact O-CB 3.19Å; A499-C502 PolarHBondContact O-N 2.76Å; L500-C502 VanDerWaalsContact C-N 3.34Å; L500-C502 PolarHBondContact O-N 3.35Å; C502-A505 PolarHBondContact O-N 3.2Å; C502-F506 WeakPolarHBondContact O-CB 3.16Å; C502-F506 PolarHBondContact O-N 3.25Å
503	G	94.6	Very high	91	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.8	-40.2	175.8	0	0	0	0	0	113.4	A499 L500 T501 G507	A499-G503 PolarHBondContact O-N 3.18Å; L500-G503 WeakPolarHBondContact O-CA 3.32Å; L500-G503 PolarHBondContact O-N 3.32Å; L500-G503 VanDerWaalsContact O-N 3.09Å; T501-G503 VanDerWaalsContact C-N 3.34Å; G503-G507 PolarHBondContact O-N 3Å
504	L	95.7	Very high	91.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-66.3	-43.7	173.5	-68.9	173	0	0	0	111.7	F459 L500 T501 G507 L508 L572 M576 L779	F459-L504 HydrophobicContact CD2-CB 4.35Å; F459-L504 HydrophobicContact CE2-CB 3.99Å; F459-L504 HydrophobicContact CE2-CD1 4.46Å; L500-L504 HydrophobicContact CG-CD1 4.19Å; L500-L504 HydrophobicContact CG-CG 4.46Å; L500-L504 WeakPolarHBondContact O-CG 3.43Å; L500-L504 PolarHBondContact O-N 3.43Å; T501-L504 PolarHBondContact O-N 2.71Å; L504-G507 CarbonylContact O-C 3.02Å; L504-G507 PolarHBondContact O-N 3.28Å; L504-G507 VanDerWaalsContact O-N 3.16Å; L504-L508 WeakPolarHBondContact O-CG 3.13Å; L504-L508 PolarHBondContact O-N 3.26Å; L504-L572 HydrophobicContact CD2-CB 4.48Å; L504-L572 HydrophobicContact CD2-CD1 3.92Å; L504-M576 HydrophobicContact CD2-CE 3.58Å; L504-M576 HydrophobicContact CD2-SD 4.36Å; L504-L779 HydrophobicContact CD1-CD1 4.45Å
505	A	95.6	Very high	91.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.7	-43.7	176.3	0	0	0	0	0	111.7	F477 T501 C502 G507 L508 V509	F477-A505 HydrophobicContact CD1-CB 4.17Å; F477-A505 HydrophobicContact CE1-CB 3.8Å; F477-A505 HydrophobicContact CE2-CB 4.24Å; F477-A505 HydrophobicContact CZ-CB 3.84Å; T501-A505 VanDerWaalsContact O-CB 3.32Å; T501-A505 WeakPolarHBondContact O-CB 3.34Å; T501-A505 PolarHBondContact O-N 2.93Å; C502-A505 PolarHBondContact O-N 3.2Å; A505-G507 VanDerWaalsContact C-N 3.33Å; A505-G507 PolarHBondContact O-N 3.47Å; A505-L508 PolarHBondContact O-N 2.66Å; A505-V509 WeakPolarHBondContact O-CG2 3.41Å; A505-V509 PolarHBondContact O-N 2.82Å
506	F	95.5	Very high	91.9	Very high	2 Å²	2	23 Å²	23	1%	0.009	11%	0.105	C	C	.	.	H	α-helix	trans	-56.8	-48.5	171	-179.6	-75	0	0	0	111	C474 F477 C502 L508 V509 A510 L517 F518 I530 A573	C474-F506 HydrophobicContact CB-CD2 3.85Å; C474-F506 HydrophobicContact CB-CE2 3.48Å; C474-F506 VanDerWaalsContact CB-CE2 3.48Å; C474-F506 HydrophobicContact CB-CZ 4.24Å; C474-F506 WeakPolarHBondContact O-CD2 3.07Å; C474-F506 WeakPolarHBondContact O-CE2 3.42Å; F477-F506 HydrophobicContact CB-CB 4.19Å; F477-F506 HydrophobicContact CB-CD2 4.39Å; F477-F506 HydrophobicContact CD2-CB 4.45Å; C502-F506 WeakPolarHBondContact O-CB 3.16Å; C502-F506 PolarHBondContact O-N 3.25Å; F506-L508 VanDerWaalsContact C-N 3.31Å; F506-L508 PolarHBondContact O-N 3.44Å; F506-V509 PolarHBondContact O-N 3.38Å; F506-A510 HydrophobicContact CE1-CB 4.26Å; F506-A510 WeakPolarHBondContact O-CB 3.3Å; F506-A510 PolarHBondContact O-N 3.02Å; F506-L517 HydrophobicContact CE1-CD2 4.4Å; F506-L517 HydrophobicContact CZ-CD2 3.92Å; F506-F518 HydrophobicContact CE1-CZ 4.42Å; F506-F518 HydrophobicContact CZ-CZ 4.2Å; F506-I530 HydrophobicContact CE1-CD1 4.13Å; F506-I530 HydrophobicContact CZ-CD1 3.88Å; F506-A573 HydrophobicContact CB-CB 4.42Å; F506-A573 HydrophobicContact CD1-CB 3.52Å; F506-A573 HydrophobicContact CE1-CB 4.09Å; F506-A573 HydrophobicContact CG-CB 4.18Å
507	G	94.8	Very high	91.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-38.9	178.4	0	0	0	0	0	113.1	G503 L504 A505 L511	G503-G507 PolarHBondContact O-N 3Å; L504-G507 CarbonylContact O-C 3.02Å; L504-G507 PolarHBondContact O-N 3.28Å; L504-G507 VanDerWaalsContact O-N 3.16Å; A505-G507 VanDerWaalsContact C-N 3.33Å; A505-G507 PolarHBondContact O-N 3.47Å; G507-L511 WeakPolarHBondContact O-CA 3.24Å; G507-L511 WeakPolarHBondContact O-CB 3.34Å; G507-L511 PolarHBondContact O-N 2.89Å
508	L	95.3	Very high	91.5	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-67.8	-44.1	175.5	-73.3	169.7	0	0	0	112.3	F459 L463 A466 Q467 L504 A505 F506 A510 L511 A755	F459-L508 HydrophobicContact CE1-CD1 4.22Å; F459-L508 HydrophobicContact CE2-CD1 3.79Å; F459-L508 HydrophobicContact CZ-CD1 3.6Å; L463-L508 HydrophobicContact CD1-CD1 4.28Å; A466-L508 CarbonylContact C-O 3.41Å; A466-L508 WeakPolarHBondContact CA-O 3.48Å; Q467-L508 PolarHBondContact N-O 3.19Å; L504-L508 WeakPolarHBondContact O-CG 3.13Å; L504-L508 PolarHBondContact O-N 3.26Å; A505-L508 PolarHBondContact O-N 2.66Å; F506-L508 VanDerWaalsContact C-N 3.31Å; F506-L508 PolarHBondContact O-N 3.44Å; L508-A510 PolarHBondContact O-N 2.73Å; L508-L511 VanDerWaalsContact O-CB 3.22Å; L508-L511 WeakPolarHBondContact O-CB 3.29Å; L508-L511 PolarHBondContact O-N 3.08Å; L508-A755 HydrophobicContact CD2-CB 3.55Å
509	V	95.3	Very high	90.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-42.2	177.9	170.6	0	0	0	0	111.5	C465 Q467 S468 A469 F477 A505 F506	C465-V509 HydrophobicContact CB-CG2 3.98Å; Q467-V509 CarbonylContact C-O 3.32Å; Q467-V509 WeakPolarHBondContact CA-O 3.48Å; Q467-V509 PolarHBondContact N-O 3.08Å; S468-V509 PolarHBondContact N-O 3.48Å; A469-V509 WeakPolarHBondContact CA-O 3.29Å; A469-V509 PolarHBondContact N-O 3.47Å; F477-V509 HydrophobicContact CE2-CG2 3.98Å; A505-V509 WeakPolarHBondContact O-CG2 3.41Å; A505-V509 PolarHBondContact O-N 2.82Å; F506-V509 PolarHBondContact O-N 3.38Å
510	A	93.5	Very high	89.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	5.6	-178.4	0	0	0	0	0	114.3	F506 L508 G512 R513 L517 S577	F506-A510 HydrophobicContact CE1-CB 4.26Å; F506-A510 WeakPolarHBondContact O-CB 3.3Å; F506-A510 PolarHBondContact O-N 3.02Å; L508-A510 PolarHBondContact O-N 2.73Å; A510-G512 PolarHBondContact O-N 3.2Å; A510-R513 PolarHBondContact O-N 3.22Å; A510-L517 HydrophobicContact CB-CD2 3.81Å; A510-S577 WeakPolarHBondContact CB-OG 3.44Å; A510-S577 WeakPolarHBondContact O-CA 3.38Å
511	L	94.1	Very high	88.6	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	118.9	-168.5	-175.7	66.2	0	0	0	113.3	Q467 G507 L508 R513 M576 L579 D751 I752 A755	Q467-L511 HydrophobicContact CG-CB 4.03Å; Q467-L511 HydrophobicContact CG-CD2 4.06Å; Q467-L511 HydrophobicContact CG-CG 4.38Å; G507-L511 WeakPolarHBondContact O-CA 3.24Å; G507-L511 WeakPolarHBondContact O-CB 3.34Å; G507-L511 PolarHBondContact O-N 2.89Å; L508-L511 VanDerWaalsContact O-CB 3.22Å; L508-L511 WeakPolarHBondContact O-CB 3.29Å; L508-L511 PolarHBondContact O-N 3.08Å; L511-R513 PolarHBondContact O-N 3.07Å; L511-M576 HydrophobicContact CD1-CB 4.17Å; L511-L579 HydrophobicContact CD1-CD2 3.88Å; L511-D751 HydrophobicContact CD2-CB 4.13Å; L511-D751 HydrophobicContact CG-CB 4.16Å; L511-I752 HydrophobicContact CD2-CB 4.45Å; L511-I752 HydrophobicContact CD2-CG1 3.92Å; L511-A755 HydrophobicContact CD1-CB 3.81Å; L511-A755 HydrophobicContact CD2-CB 3.98Å
512	G	90.2	Very high	87.2	Confident	33 Å²	33	38.2 Å²	38.2	34%	0.34	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	3.2	-178.8	0	0	0	0	0	115.2	A510 M576 S577	A510-G512 PolarHBondContact O-N 3.2Å; G512-M576 PolarHBondContact N-O 2.97Å; G512-M576 VanDerWaalsContact N-O 3.08Å; G512-S577 CarbonylContact C-O 3.49Å; G512-S577 PolarHBondContact N-O 2.89Å
513	R	90.4	Very high	86.2	Confident	97 Å²	97	40.9 Å²	40.9	37%	0.366	23%	0.225	S	C	.	.			trans	-115.4	16.4	-174.9	-67	-175.3	179.9	-168.1	3.4	112.9	Q467 A469 A510 L511 R515 K516 L517 S577	Q467-R513 WeakPolarHBondContact O-CD 3.46Å; Q467-R513 PolarHBondContact O-NE 3.18Å; Q467-R513 PolarHBondContact O-NH1 3.21Å; A469-R513 HydrophobicContact CB-CB 4.14Å; A510-R513 PolarHBondContact O-N 3.22Å; L511-R513 PolarHBondContact O-N 3.07Å; R513-R515 VanDerWaalsContact C-N 3.27Å; R513-R515 PolarHBondContact O-N 3.29Å; R513-K516 WeakPolarHBondContact O-CB 3.36Å; R513-K516 PolarHBondContact O-N 3.47Å; R513-L517 PolarHBondContact O-N 3.23Å; R513-S577 PolarHBondContact N-O 2.7Å
514	G	84.5	Confident	85.2	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-50.5	-43.5	179.8	0	0	0	0	0	113	K516 L517 F518 S577	G514-K516 VanDerWaalsContact C-N 3.27Å; G514-K516 PolarHBondContact O-N 3.27Å; G514-L517 PolarHBondContact O-N 3.35Å; G514-F518 WeakPolarHBondContact O-CD2 3.28Å; G514-F518 PolarHBondContact O-N 2.76Å; G514-S577 VanDerWaalsContact CA-O 3.29Å; G514-S577 WeakPolarHBondContact CA-O 3.39Å; G514-S577 PolarHBondContact N-O 3.38Å
515	R	86	Confident	84.6	Confident	146 Å²	146	50.3 Å²	50.3	55%	0.551	27%	0.272	S	S	*	.	H	α-helix	trans	-54.9	-41.5	176.4	-65.5	-174.3	-177.9	-170.5	3.1	112.6	R513 S519 F578 S581	R513-R515 VanDerWaalsContact C-N 3.27Å; R513-R515 PolarHBondContact O-N 3.29Å; R515-S519 WeakPolarHBondContact O-CB 3.47Å; R515-S519 PolarHBondContact O-N 3.48Å; R515-F578 HydrophobicContact CG-CE1 4.22Å; R515-S581 PolarHBondContact NH2-O 3.48Å
516	K	84.9	Confident	84.1	Confident	141 Å²	141	50.3 Å²	50.3	61%	0.613	27%	0.272	S	S	*	.	H	α-helix	trans	-68.9	-35.9	177.6	-64.9	-175.4	178	-177.6	0	112.3	R513 G514	R513-K516 WeakPolarHBondContact O-CB 3.36Å; R513-K516 PolarHBondContact O-N 3.47Å; G514-K516 VanDerWaalsContact C-N 3.27Å; G514-K516 PolarHBondContact O-N 3.27Å
517	L	84.1	Confident	83.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-73.7	-44.9	-177.6	-173.4	64.7	0	0	0	111.9	L471 C474 F506 A510 R513 G514 R523	L471-L517 HydrophobicContact CB-CD1 4.44Å; L471-L517 HydrophobicContact CD1-CD1 4.03Å; C474-L517 HydrophobicContact CB-CD2 4.37Å; F506-L517 HydrophobicContact CE1-CD2 4.4Å; F506-L517 HydrophobicContact CZ-CD2 3.92Å; A510-L517 HydrophobicContact CB-CD2 3.81Å; R513-L517 PolarHBondContact O-N 3.23Å; G514-L517 PolarHBondContact O-N 3.35Å; L517-R523 WeakPolarHBondContact O-CD 3.3Å; L517-R523 PolarHBondContact O-NH1 3.43Å
518	F	83.3	Confident	83.4	Confident	14 Å²	14	55.1 Å²	55.1	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-94.2	-24.8	-171.9	-63.1	-74.9	0	0	0	114.5	F506 G514 L520 L526 L527 I530 F578	F506-F518 HydrophobicContact CE1-CZ 4.42Å; F506-F518 HydrophobicContact CZ-CZ 4.2Å; G514-F518 WeakPolarHBondContact O-CD2 3.28Å; G514-F518 PolarHBondContact O-N 2.76Å; F518-L520 VanDerWaalsContact C-N 3.29Å; F518-L520 PolarHBondContact O-N 2.83Å; F518-L526 HydrophobicContact CD1-CB 4.07Å; F518-L526 HydrophobicContact CE1-CB 3.79Å; F518-L527 HydrophobicContact CD1-CB 3.88Å; F518-L527 HydrophobicContact CE1-CB 4.15Å; F518-I530 HydrophobicContact CE1-CD1 4.09Å; F518-I530 HydrophobicContact CZ-CD1 3.89Å; F518-F578 HydrophobicContact CB-CZ 4.31Å; F518-F578 HydrophobicContact CD2-CD2 4.48Å; F518-F578 AromaticContact CD2-CE2 3.32Å; F518-F578 HydrophobicContact CD2-CE2 3.32Å; F518-F578 AromaticContact CD2-CZ 3.35Å; F518-F578 HydrophobicContact CD2-CZ 3.35Å; F518-F578 HydrophobicContact CE2-CD2 4.32Å; F518-F578 AromaticContact CE2-CE2 3.42Å; F518-F578 HydrophobicContact CE2-CE2 3.42Å; F518-F578 VanDerWaalsContact CE2-CE2 3.42Å; F518-F578 AromaticContact CE2-CZ 3.97Å; F518-F578 HydrophobicContact CE2-CZ 3.97Å; F518-F578 HydrophobicContact CG-CE2 4.29Å; F518-F578 HydrophobicContact CG-CZ 4.1Å; F518-F578 HydrophobicContact CZ-CE2 4.42Å
519	S	73.9	Confident	83.1	Confident	98 Å²	98	56.8 Å²	56.8	69%	0.685	30%	0.304	S	S	*	.	S	Bend	trans	-74.8	-11.4	-173.5	-174.9	0	0	0	0	114.9	R515	R515-S519 WeakPolarHBondContact O-CB 3.47Å; R515-S519 PolarHBondContact O-N 3.48Å
520	L	74.3	Confident	82.8	Confident	81 Å²	81	56.9 Å²	56.9	42%	0.424	30%	0.304	S	S	.	.	S	Bend	trans	-75.2	131.6	-178.4	-74.4	163.4	0	0	0	110.6	F518 G522 R523	F518-L520 VanDerWaalsContact C-N 3.29Å; F518-L520 PolarHBondContact O-N 2.83Å; L520-G522 PolarHBondContact O-N 2.9Å; L520-R523 HydrophobicContact CB-CG 4.19Å; L520-R523 WeakPolarHBondContact O-CB 3.44Å; L520-R523 PolarHBondContact O-N 3.47Å
521	P	66.7	Low	82.7	Confident	125 Å²	125	57.9 Å²	57.9	81%	0.812	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	134.7	-179.9	22.5	-31.7	0	0	0	110.3
522	G	64.6	Low	82.5	Confident	61 Å²	61	61.8 Å²	61.8	63%	0.629	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-3.1	-175.1	0	0	0	0	0	115.4	L520 F525	L520-G522 PolarHBondContact O-N 2.9Å; G522-F525 WeakPolarHBondContact O-CD1 3.42Å; G522-F525 WeakPolarHBondContact O-CE1 3.31Å
523	R	73.5	Confident	82.4	Confident	56 Å²	56	60.3 Å²	60.3	21%	0.211	31%	0.309	C	S	.	.			trans	-99.3	3.5	175.7	-60.5	-170.1	-174	-175.8	-2.3	115	L517 L520 F525 L526	L517-R523 WeakPolarHBondContact O-CD 3.3Å; L517-R523 PolarHBondContact O-NH1 3.43Å; L520-R523 HydrophobicContact CB-CG 4.19Å; L520-R523 WeakPolarHBondContact O-CB 3.44Å; L520-R523 PolarHBondContact O-N 3.47Å; R523-F525 PolarHBondContact O-N 3.31Å; R523-L526 HydrophobicContact CB-CD1 4.42Å; R523-L526 WeakPolarHBondContact O-CB 3.38Å; R523-L526 PolarHBondContact O-N 3.34Å
524	N	73.7	Confident	82.4	Confident	116 Å²	116	55.8 Å²	55.8	62%	0.62	29%	0.292	S	S	*	.	H	α-helix	trans	-55.7	-26.7	177.8	-66.8	-11.2	0	0	0	112.6	L526 L527 D528	N524-L526 PolarHBondContact O-N 2.96Å; N524-L527 PolarHBondContact O-N 2.97Å; N524-D528 VanDerWaalsContact O-CB 3.27Å; N524-D528 WeakPolarHBondContact O-CB 3.04Å; N524-D528 PolarHBondContact O-N 2.64Å
525	F	82.7	Confident	82.6	Confident	82 Å²	82	60 Å²	60	36%	0.36	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-29.9	175.5	75.6	-92	0	0	0	113.2	I475 G522 R523 R529	I475-F525 HydrophobicContact CD1-CZ 4.35Å; G522-F525 WeakPolarHBondContact O-CD1 3.42Å; G522-F525 WeakPolarHBondContact O-CE1 3.31Å; R523-F525 PolarHBondContact O-N 3.31Å; F525-R529 WeakPolarHBondContact O-CB 3.38Å; F525-R529 WeakPolarHBondContact O-CG 3.24Å; F525-R529 PolarHBondContact O-N 2.95Å
526	L	86	Confident	82.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.9	-49.9	179.1	-69.1	174.2	0	0	0	111.3	L471 I475 F518 R523 N524 D528 R529 I530	L471-L526 HydrophobicContact CD1-CD1 3.58Å; I475-L526 HydrophobicContact CG1-CD2 3.96Å; F518-L526 HydrophobicContact CD1-CB 4.07Å; F518-L526 HydrophobicContact CE1-CB 3.79Å; R523-L526 HydrophobicContact CB-CD1 4.42Å; R523-L526 WeakPolarHBondContact O-CB 3.38Å; R523-L526 PolarHBondContact O-N 3.34Å; N524-L526 PolarHBondContact O-N 2.96Å; L526-D528 VanDerWaalsContact C-N 3.33Å; L526-R529 PolarHBondContact O-N 2.74Å; L526-I530 WeakPolarHBondContact O-CG1 3.37Å; L526-I530 PolarHBondContact O-N 3.5Å
527	L	87.1	Confident	82.4	Confident	38 Å²	38	48.5 Å²	48.5	20%	0.199	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-45.7	179.1	179.2	62.6	0	0	0	110.1	F518 N524 R529 I530 V531 L574 I586	F518-L527 HydrophobicContact CD1-CB 3.88Å; F518-L527 HydrophobicContact CE1-CB 4.15Å; N524-L527 PolarHBondContact O-N 2.97Å; L527-R529 PolarHBondContact O-N 3.46Å; L527-I530 PolarHBondContact O-N 3.46Å; L527-V531 HydrophobicContact CD1-CG2 4.17Å; L527-V531 HydrophobicContact CG-CG2 4.32Å; L527-V531 WeakPolarHBondContact O-CB 3.34Å; L527-V531 VanDerWaalsContact O-CG2 3.27Å; L527-V531 WeakPolarHBondContact O-CG2 3.22Å; L527-V531 PolarHBondContact O-N 2.77Å; L527-L574 HydrophobicContact CD1-CD1 3.69Å; L527-I586 HydrophobicContact CD1-CD1 3.84Å; L527-I586 HydrophobicContact CD2-CD1 3.64Å; L527-I586 HydrophobicContact CG-CD1 4.42Å
528	D	86.8	Confident	82.2	Confident	66 Å²	66	55.8 Å²	55.8	35%	0.353	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-41.3	177.3	169.8	57.4	0	0	0	112.5	N524 L526 V531 R532	N524-D528 VanDerWaalsContact O-CB 3.27Å; N524-D528 WeakPolarHBondContact O-CB 3.04Å; N524-D528 PolarHBondContact O-N 2.64Å; L526-D528 VanDerWaalsContact C-N 3.33Å; D528-V531 PolarHBondContact O-N 3.39Å; D528-R532 WeakPolarHBondContact O-CG 3.19Å; D528-R532 PolarHBondContact O-N 3.3Å; D528-R532 IonicContact OD1-CZ 3.57Å; D528-R532 IonicContact OD1-NE 2.95Å; D528-R532 IonicContact OD1-NH1 3.25Å; D528-R532 IonicContact OD1-NH2 3Å; D528-R532 PolarHBondContact OD1-NH2 3.23Å; D528-R532 IonicContact OD2-CZ 2.69Å; D528-R532 IonicContact OD2-NE 2.82Å; D528-R532 IonicContact OD2-NH1 2.93Å; D528-R532 PolarHBondContact OD2-NH1 2.99Å; D528-R532 IonicContact OD2-NH2 3.52Å; D528-R532 PolarHBondContact OD2-NH2 3.29Å
529	R	88.6	Confident	81.8	Confident	35 Å²	35	55.2 Å²	55.2	13%	0.132	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-49.7	171.4	-75.5	170.3	80.9	-176	0.6	111.9	L478 E482 F525 L526 L527 V531 R532 M533	L478-R529 HydrophobicContact CD1-CB 4.37Å; L478-R529 HydrophobicContact CD2-CB 4.06Å; L478-R529 VanDerWaalsContact CD2-NH2 3.26Å; E482-R529 IonicContact OE1-CZ 3.17Å; E482-R529 VanDerWaalsContact OE1-CZ 3.26Å; E482-R529 IonicContact OE1-NE 2.98Å; E482-R529 PolarHBondContact OE1-NE 3.45Å; E482-R529 IonicContact OE1-NH2 2.61Å; E482-R529 PolarHBondContact OE1-NH2 3.45Å; E482-R529 IonicContact OE2-CZ 3.16Å; E482-R529 IonicContact OE2-NE 3.55Å; E482-R529 IonicContact OE2-NH2 3.98Å; E482-R529 PolarHBondContact OE2-NH2 3.29Å; F525-R529 WeakPolarHBondContact O-CB 3.38Å; F525-R529 WeakPolarHBondContact O-CG 3.24Å; F525-R529 PolarHBondContact O-N 2.95Å; L526-R529 PolarHBondContact O-N 2.74Å; L527-R529 PolarHBondContact O-N 3.46Å; R529-V531 VanDerWaalsContact C-N 3.34Å; R529-V531 PolarHBondContact O-N 3.43Å; R529-R532 PolarHBondContact O-N 3.11Å; R529-M533 VanDerWaalsContact O-CG 3.24Å; R529-M533 WeakPolarHBondContact O-CG 3.4Å; R529-M533 PolarHBondContact O-N 2.85Å
530	I	90.8	Very high	81.6	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-44.5	178.3	-65.8	170.8	0	0	0	110.9	L478 F506 F518 L526 L527 R532 M533 I534 L574	L478-I530 HydrophobicContact CD1-CD1 4.13Å; L478-I530 HydrophobicContact CD1-CG1 3.59Å; F506-I530 HydrophobicContact CE1-CD1 4.13Å; F506-I530 HydrophobicContact CZ-CD1 3.88Å; F518-I530 HydrophobicContact CE1-CD1 4.09Å; F518-I530 HydrophobicContact CZ-CD1 3.89Å; L526-I530 WeakPolarHBondContact O-CG1 3.37Å; L526-I530 PolarHBondContact O-N 3.5Å; L527-I530 PolarHBondContact O-N 3.46Å; I530-R532 VanDerWaalsContact C-N 3.35Å; I530-R532 PolarHBondContact O-N 3.28Å; I530-M533 WeakPolarHBondContact O-CB 3.22Å; I530-M533 PolarHBondContact O-N 3.36Å; I530-M533 VanDerWaalsContact O-N 3.11Å; I530-I534 HydrophobicContact CG2-CD1 3.9Å; I530-I534 HydrophobicContact CG2-CG1 4.43Å; I530-I534 VanDerWaalsContact O-CG1 3.29Å; I530-I534 WeakPolarHBondContact O-CG1 3.03Å; I530-I534 PolarHBondContact O-N 3.44Å; I530-L574 HydrophobicContact CG2-CB 4.3Å
531	V	91.1	Very high	81.2	Confident	20 Å²	20	56.3 Å²	56.3	12%	0.121	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-41.3	179.2	171.2	0	0	0	0	111.2	L527 D528 R529 M533 I534 H535 W589	L527-V531 HydrophobicContact CD1-CG2 4.17Å; L527-V531 HydrophobicContact CG-CG2 4.32Å; L527-V531 WeakPolarHBondContact O-CB 3.34Å; L527-V531 VanDerWaalsContact O-CG2 3.27Å; L527-V531 WeakPolarHBondContact O-CG2 3.22Å; L527-V531 PolarHBondContact O-N 2.77Å; D528-V531 PolarHBondContact O-N 3.39Å; R529-V531 VanDerWaalsContact C-N 3.34Å; R529-V531 PolarHBondContact O-N 3.43Å; V531-M533 VanDerWaalsContact C-N 3.32Å; V531-M533 PolarHBondContact O-N 2.97Å; V531-I534 PolarHBondContact O-N 2.99Å; V531-H535 PolarHBondContact O-N 3Å; V531-H535 PolarHBondContact O-ND1 2.85Å; V531-H535 VanDerWaalsContact O-ND1 3.11Å; V531-W589 HydrophobicContact CG1-CD2 4.28Å; V531-W589 HydrophobicContact CG1-CE3 3.83Å; V531-W589 HydrophobicContact CG1-CZ3 4.08Å; V531-W589 HydrophobicContact CG2-CD2 4.28Å; V531-W589 HydrophobicContact CG2-CG 4.28Å
532	R	89	Confident	81.1	Confident	84 Å²	84	50.8 Å²	50.8	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-32.3	173.1	-71.9	-172	-160.8	111	-0.5	113.1	D528 R529 I530 I534 G536 Y561	D528-R532 WeakPolarHBondContact O-CG 3.19Å; D528-R532 PolarHBondContact O-N 3.3Å; D528-R532 IonicContact OD1-CZ 3.57Å; D528-R532 IonicContact OD1-NE 2.95Å; D528-R532 IonicContact OD1-NH1 3.25Å; D528-R532 IonicContact OD1-NH2 3Å; D528-R532 PolarHBondContact OD1-NH2 3.23Å; D528-R532 IonicContact OD2-CZ 2.69Å; D528-R532 IonicContact OD2-NE 2.82Å; D528-R532 IonicContact OD2-NH1 2.93Å; D528-R532 PolarHBondContact OD2-NH1 2.99Å; D528-R532 IonicContact OD2-NH2 3.52Å; D528-R532 PolarHBondContact OD2-NH2 3.29Å; R529-R532 PolarHBondContact O-N 3.11Å; I530-R532 VanDerWaalsContact C-N 3.35Å; I530-R532 PolarHBondContact O-N 3.28Å; R532-I534 VanDerWaalsContact C-N 3.32Å; R532-G536 CarbonylContact O-C 3.46Å; R532-G536 WeakPolarHBondContact O-CA 3.38Å; R532-G536 PolarHBondContact O-N 2.76Å; R532-Y561 HydrophobicContact CB-CD2 3.81Å; R532-Y561 HydrophobicContact CB-CE2 3.74Å
533	M	88.4	Confident	80.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-33.6	173.5	-67.4	162.7	73.7	0	0	111.8	L478 I481 E482 R529 I530 V531 Y561 T566	L478-M533 HydrophobicContact CG-SD 4.25Å; I481-M533 HydrophobicContact CB-CE 3.56Å; I481-M533 HydrophobicContact CD1-CE 4.27Å; I481-M533 HydrophobicContact CG2-CE 3.09Å; E482-M533 HydrophobicContact CG-CE 4.49Å; E482-M533 HydrophobicContact CG-SD 4.27Å; R529-M533 VanDerWaalsContact O-CG 3.24Å; R529-M533 WeakPolarHBondContact O-CG 3.4Å; R529-M533 PolarHBondContact O-N 2.85Å; I530-M533 WeakPolarHBondContact O-CB 3.22Å; I530-M533 PolarHBondContact O-N 3.36Å; I530-M533 VanDerWaalsContact O-N 3.11Å; V531-M533 VanDerWaalsContact C-N 3.32Å; V531-M533 PolarHBondContact O-N 2.97Å; M533-Y561 HydrophobicContact CG-CD1 4.15Å; M533-Y561 HydrophobicContact CG-CE1 4.29Å; M533-Y561 HydrophobicContact CG-CG 4.45Å; M533-T566 HydrophobicContact CE-CG2 4.47Å; M533-T566 PolarHBondContact O-OG1 2.94Å
534	I	90.8	Very high	80.1	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-78.4	-43.6	-179.2	-64.2	172.6	0	0	0	112.7	I530 V531 R532 I571 L574 L590 R610	I530-I534 HydrophobicContact CG2-CD1 3.9Å; I530-I534 HydrophobicContact CG2-CG1 4.43Å; I530-I534 VanDerWaalsContact O-CG1 3.29Å; I530-I534 WeakPolarHBondContact O-CG1 3.03Å; I530-I534 PolarHBondContact O-N 3.44Å; V531-I534 PolarHBondContact O-N 2.99Å; R532-I534 VanDerWaalsContact C-N 3.32Å; I534-I571 HydrophobicContact CD1-CG1 4.08Å; I534-I571 HydrophobicContact CG1-CG1 3.96Å; I534-I571 HydrophobicContact CG2-CD1 4.4Å; I534-I571 HydrophobicContact CG2-CG1 3.88Å; I534-L574 HydrophobicContact CD1-CD2 4.27Å; I534-L590 HydrophobicContact CD1-CD2 4.2Å; I534-R610 PolarHBondContact O-NH2 2.86Å; I534-R610 VanDerWaalsContact O-NH2 3.13Å
535	H	88.1	Confident	79.5	Confident	88 Å²	88	52.9 Å²	52.9	41%	0.407	26%	0.255	S	S	.	.	H	α-helix	trans	-98.3	-12.9	-174.2	-63.6	87	0	0	0	113.3	V531 W589	V531-H535 PolarHBondContact O-N 3Å; V531-H535 PolarHBondContact O-ND1 2.85Å; V531-H535 VanDerWaalsContact O-ND1 3.11Å; H535-W589 PolarHBondContact CE1-O 3.33Å; H535-W589 PolarHBondContact NE2-O 2.97Å
536	G	83.9	Confident	78.1	Confident	26 Å²	26	52.5 Å²	52.5	27%	0.268	26%	0.255	S	S	.	.			trans	86.8	160.1	-164	0	0	0	0	0	111.4	R532	R532-G536 CarbonylContact O-C 3.46Å; R532-G536 WeakPolarHBondContact O-CA 3.38Å; R532-G536 PolarHBondContact O-N 2.76Å
537	G	83.6	Confident	76.5	Confident	21 Å²	21	59.3 Å²	59.3	22%	0.216	29%	0.292	C	S	.	.			trans	164.7	166	-177.5	0	0	0	0	0	111.3	F560 Y561	G537-F560 VanDerWaalsContact O-CA 3.29Å; G537-F560 WeakPolarHBondContact O-CA 3.45Å; G537-Y561 WeakPolarHBondContact O-CD2 3.46Å; G537-Y561 PolarHBondContact O-N 2.78Å
538	R	79.6	Confident	75	Confident	154 Å²	154	66.3 Å²	66.3	58%	0.581	32%	0.321	S	S	*	.	B	Isolated β-bridge	trans	-73.4	137.8	174.3	-65.7	-174.9	-174.1	177.8	3.9	109.8	F560	R538-F560 HydrophobicContact CG-CD1 3.77Å; R538-F560 HydrophobicContact CG-CE1 3.42Å; R538-F560 VanDerWaalsContact CG-CE1 3.42Å; R538-F560 HydrophobicContact CG-CZ 4.25Å
539	S	75.3	Confident	73.5	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.007	33%	0.33	C	S	.	.			trans	-102.9	117.1	170.5	-179.7	0	0	0	0	109	R541 K542 E543 R559 Y561	S539-R541 PolarHBondContact O-N 3.21Å; S539-K542 PolarHBondContact O-N 3.1Å; S539-K542 PolarHBondContact OG-N 3.31Å; S539-E543 PolarHBondContact O-N 3.05Å; S539-R559 PolarHBondContact N-O 3.43Å; S539-R559 VanDerWaalsContact N-O 3.14Å; S539-Y561 VanDerWaalsContact CB-CZ 3.45Å; S539-Y561 WeakPolarHBondContact CB-OH 3.24Å; S539-Y561 PolarHBondContact OG-OH 3.34Å
540	T	69.2	Low	71.7	Confident	112 Å²	112	72.3 Å²	72.3	69%	0.687	35%	0.348	S	S	*	.	H	α-helix	trans	-61.2	-28.1	176.5	50.1	0	0	0	0	112.3
541	R	65.6	Low	69.8	Low	90 Å²	90	81.5 Å²	81.5	34%	0.34	39%	0.391	S	S	.	.	H	α-helix	trans	-77.4	-43.1	179.9	-171	176.3	178.8	156.8	2.9	112.3	E479 S539 E543 Q544 E545	E479-R541 IonicContact OE1-NH1 2.91Å; E479-R541 PolarHBondContact OE1-NH1 3.21Å; S539-R541 PolarHBondContact O-N 3.21Å; R541-E543 PolarHBondContact O-N 3.38Å; R541-Q544 WeakPolarHBondContact O-CB 3.32Å; R541-Q544 PolarHBondContact O-N 3.41Å; R541-E545 WeakPolarHBondContact CG-OE1 3.33Å; R541-E545 IonicContact CZ-OE1 3.62Å; R541-E545 IonicContact NE-OE1 2.64Å; R541-E545 PolarHBondContact NE-OE1 3.37Å; R541-E545 IonicContact NH2-OE1 2.71Å; R541-E545 PolarHBondContact O-N 3.14Å; R541-E545 VanDerWaalsContact O-N 3.09Å
542	K	63.9	Low	68.1	Low	10 Å²	10	88.2 Å²	88.2	4%	0.043	42%	0.421	C	S	.	.	H	α-helix	trans	-61.7	-29.6	176.6	-70.3	-172.1	171.4	-178	0	112.5	E482 N483 S539 Q544 M546 E557	E482-K542 WeakPolarHBondContact O-CE 3.37Å; E482-K542 PolarHBondContact O-NZ 3.13Å; N483-K542 VanDerWaalsContact OD1-CE 3.27Å; N483-K542 WeakPolarHBondContact OD1-CE 3.44Å; S539-K542 PolarHBondContact O-N 3.1Å; S539-K542 PolarHBondContact OG-N 3.31Å; K542-Q544 VanDerWaalsContact C-N 3.28Å; K542-Q544 PolarHBondContact O-N 3.37Å; K542-M546 WeakPolarHBondContact O-CB 2.94Å; K542-M546 WeakPolarHBondContact O-CG 2.97Å; K542-M546 PolarHBondContact O-N 3.36Å; K542-E557 IonicContact NZ-OE2 3.7Å; K542-E557 PolarHBondContact NZ-OE2 3.18Å
543	E	59.2	Low	66.8	Low	85 Å²	85	86.9 Å²	86.9	40%	0.397	43%	0.425	S	S	.	.	H	α-helix	trans	-64.3	-31.7	172.8	-70.7	179.2	170.1	0	0	112.7	S539 R541 R559	S539-E543 PolarHBondContact O-N 3.05Å; R541-E543 PolarHBondContact O-N 3.38Å; E543-R559 HydrophobicContact CG-CB 4.28Å
544	Q	59.2	Low	65.9	Low	148 Å²	148	93 Å²	93	69%	0.692	46%	0.457	S	S	*	.	H	α-helix	trans	-81.3	-37.2	178	-64.4	179.7	-16.4	0	0	112.5	R541 K542	R541-Q544 WeakPolarHBondContact O-CB 3.32Å; R541-Q544 PolarHBondContact O-N 3.41Å; K542-Q544 VanDerWaalsContact C-N 3.28Å; K542-Q544 PolarHBondContact O-N 3.37Å
545	E	59.6	Low	65.1	Low	43 Å²	43	94.6 Å²	94.6	20%	0.201	47%	0.467	C	S	.	.	H	α-helix	trans	-80.5	-24.8	-176.6	-70	165.3	171.5	0	0	113.1	N483 R541 N547 K548 E549	N483-E545 PolarHBondContact ND2-OE1 3.49Å; N483-E545 PolarHBondContact ND2-OE2 2.95Å; R541-E545 WeakPolarHBondContact CG-OE1 3.33Å; R541-E545 IonicContact CZ-OE1 3.62Å; R541-E545 IonicContact NE-OE1 2.64Å; R541-E545 PolarHBondContact NE-OE1 3.37Å; R541-E545 IonicContact NH2-OE1 2.71Å; R541-E545 PolarHBondContact O-N 3.14Å; R541-E545 VanDerWaalsContact O-N 3.09Å; E545-N547 PolarHBondContact O-N 3.04Å; E545-K548 PolarHBondContact O-N 3.48Å; E545-E549 PolarHBondContact O-N 2.7Å
546	M	54.9	Low	64.5	Low	74 Å²	74	99.7 Å²	99.7	37%	0.365	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-24.3	174.6	-88	-178.5	68.7	0	0	113.5	K542 R559	K542-M546 WeakPolarHBondContact O-CB 2.94Å; K542-M546 WeakPolarHBondContact O-CG 2.97Å; K542-M546 PolarHBondContact O-N 3.36Å; M546-R559 HydrophobicContact SD-CB 4.02Å
547	N	52.1	Low	64	Low	144 Å²	144	101 Å²	101	77%	0.77	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-5.6	179.6	-67	-17.2	0	0	0	114	E545	E545-N547 PolarHBondContact O-N 3.04Å
548	K	55.9	Low	63.7	Low	185 Å²	185	103 Å²	103	80%	0.804	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	-24.8	-172.4	-72	-174.6	177.5	-178.3	0	116	E545	E545-K548 PolarHBondContact O-N 3.48Å
549	E	54.6	Low	63.7	Low	116 Å²	116	101.8 Å²	101.8	54%	0.542	49%	0.492	S	S	.	.	S	Bend	trans	-122.4	6.4	-163.4	-64.5	-176.5	170.3	0	0	115.3	E545 E551	E545-E549 PolarHBondContact O-N 2.7Å; E549-E551 VanDerWaalsContact C-N 3.32Å; E549-E551 PolarHBondContact O-N 2.76Å
550	Q	50.7	Low	64.1	Low	110 Å²	110	105.7 Å²	105.7	51%	0.514	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-12.1	-173	-75.7	-172.1	-6.1	0	0	115.7
551	E	50.4	Low	64.8	Low	196 Å²	196	101 Å²	101	92%	0.916	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-15	-172.9	-65.9	-169.9	160.1	0	0	114.4	E549	E549-E551 VanDerWaalsContact C-N 3.32Å; E549-E551 PolarHBondContact O-N 2.76Å
552	E	55.4	Low	65.8	Low	162 Å²	162	98.9 Å²	98.9	76%	0.757	48%	0.475	S	S	*	.	S	Bend	trans	-123.7	-0.9	-171.4	-64	-178.1	170.3	0	0	115
553	S	62.9	Low	67	Low	56 Å²	56	100.8 Å²	100.8	39%	0.392	49%	0.488	S	S	.	.			trans	-92.9	128.5	-177.3	70.9	0	0	0	0	112.9	V555	S553-V555 PolarHBondContact O-N 3.07Å; S553-V555 PolarHBondContact OG-O 2.96Å
554	L	69.9	Low	68.3	Low	129 Å²	129	102 Å²	102	68%	0.675	49%	0.493	S	S	*	.	S	Bend	trans	-67.5	-13.8	174.2	-71.3	169.2	0	0	0	114	V492	V492-L554 HydrophobicContact CG2-CB 3.5Å; V492-L554 VanDerWaalsContact CG2-CB 3.5Å; V492-L554 HydrophobicContact CG2-CD1 3.66Å; V492-L554 HydrophobicContact CG2-CG 4.23Å
555	V	73.8	Confident	69.7	Low	37 Å²	37	95.4 Å²	95.4	22%	0.224	46%	0.463	C	S	.	.	S	Bend	trans	-117.7	117.6	-179.5	-177	0	0	0	0	110.7	V492 S553 E557	V492-V555 HydrophobicContact CB-CG2 4.31Å; V492-V555 HydrophobicContact CG1-CG2 3.28Å; V492-V555 HydrophobicContact CG2-CG2 4.04Å; S553-V555 PolarHBondContact O-N 3.07Å; S553-V555 PolarHBondContact OG-O 2.96Å; V555-E557 HydrophobicContact CG1-CG 4.17Å; V555-E557 PolarHBondContact O-N 2.82Å
556	K	75.2	Confident	71.2	Confident	195 Å²	195	93.3 Å²	93.3	85%	0.848	45%	0.453	S	S	*	.			trans	-83	102.7	174.7	-171	174.4	-176.1	172.4	0	111.1
557	E	74.1	Confident	73	Confident	53 Å²	53	90.1 Å²	90.1	25%	0.248	44%	0.438	C	S	.	.			trans	-89.8	154.4	174.2	-71.8	-175.2	-124.7	0	0	113.2	R495 K542 V555	R495-E557 IonicContact CZ-OE1 3.2Å; R495-E557 IonicContact NH1-OE1 3.01Å; R495-E557 PolarHBondContact NH1-OE1 3.42Å; R495-E557 IonicContact NH2-OE1 3.47Å; R495-E557 PolarHBondContact NH2-OE1 3.09Å; R495-E557 IonicContact NH2-OE2 2.7Å; R495-E557 PolarHBondContact NH2-OE2 3.1Å; R495-E557 VanDerWaalsContact NH2-OE2 3.11Å; K542-E557 IonicContact NZ-OE2 3.7Å; K542-E557 PolarHBondContact NZ-OE2 3.18Å; V555-E557 HydrophobicContact CG1-CG 4.17Å; V555-E557 PolarHBondContact O-N 2.82Å
558	S	77	Confident	74.9	Confident	62 Å²	62	84 Å²	84	43%	0.434	41%	0.408	S	S	.	.			trans	-91	169	171.6	83.2	0	0	0	0	111.2	F560	S558-F560 PolarHBondContact O-N 2.83Å; S558-F560 VanDerWaalsContact O-N 3.11Å; S558-F560 WeakPolarHBondContact OG-CB 3.44Å; S558-F560 PolarHBondContact OG-N 2.78Å; S558-F560 PolarHBondContact OG-O 3.47Å
559	R	79.3	Confident	76.8	Confident	129 Å²	129	75.3 Å²	75.3	49%	0.487	37%	0.37	S	S	.	.	S	Bend	trans	-59.8	-11	167.1	51.7	-178.9	169.3	178.9	-4.6	114.7	S539 E543 M546	S539-R559 PolarHBondContact N-O 3.43Å; S539-R559 VanDerWaalsContact N-O 3.14Å; E543-R559 HydrophobicContact CG-CB 4.28Å; M546-R559 HydrophobicContact SD-CB 4.02Å
560	F	83.3	Confident	78.6	Confident	84 Å²	84	69.9 Å²	69.9	37%	0.368	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-95.2	151.2	174.9	-57.9	-84.8	0	0	0	111.3	G537 R538 S558 N562	G537-F560 VanDerWaalsContact O-CA 3.29Å; G537-F560 WeakPolarHBondContact O-CA 3.45Å; R538-F560 HydrophobicContact CG-CD1 3.77Å; R538-F560 HydrophobicContact CG-CE1 3.42Å; R538-F560 VanDerWaalsContact CG-CE1 3.42Å; R538-F560 HydrophobicContact CG-CZ 4.25Å; S558-F560 PolarHBondContact O-N 2.83Å; S558-F560 VanDerWaalsContact O-N 3.11Å; S558-F560 WeakPolarHBondContact OG-CB 3.44Å; S558-F560 PolarHBondContact OG-N 2.78Å; S558-F560 PolarHBondContact OG-O 3.47Å; F560-N562 PolarHBondContact O-N 3.01Å
561	Y	84.3	Confident	80.8	Confident	12 Å²	12	64.6 Å²	64.6	5%	0.047	32%	0.321	C	S	.	.			trans	-58.2	131.4	170.5	-71.1	-69.6	0	0	0	110.9	E482 R532 M533 G537 S539 T563	E482-Y561 HydrophobicContact CB-CE1 4.27Å; E482-Y561 HydrophobicContact CG-CE1 3.71Å; E482-Y561 PolarHBondContact OE1-OH 2.96Å; R532-Y561 HydrophobicContact CB-CD2 3.81Å; R532-Y561 HydrophobicContact CB-CE2 3.74Å; M533-Y561 HydrophobicContact CG-CD1 4.15Å; M533-Y561 HydrophobicContact CG-CE1 4.29Å; M533-Y561 HydrophobicContact CG-CG 4.45Å; G537-Y561 WeakPolarHBondContact O-CD2 3.46Å; G537-Y561 PolarHBondContact O-N 2.78Å; S539-Y561 VanDerWaalsContact CB-CZ 3.45Å; S539-Y561 WeakPolarHBondContact CB-OH 3.24Å; S539-Y561 PolarHBondContact OG-OH 3.34Å; Y561-T563 PolarHBondContact O-N 3.11Å; Y561-T563 VanDerWaalsContact O-N 3.13Å
562	N	86.9	Confident	82.9	Confident	47 Å²	47	55.3 Å²	55.3	25%	0.251	28%	0.277	S	S	.	.			trans	-77.8	97.3	173.4	-174.8	-6.2	0	0	0	109	F560 H564 V565 T566	F560-N562 PolarHBondContact O-N 3.01Å; N562-H564 PolarHBondContact O-N 3.25Å; N562-H564 WeakPolarHBondContact OD1-CB 3.4Å; N562-H564 PolarHBondContact OD1-CD2 3.13Å; N562-H564 PolarHBondContact OD1-N 3.12Å; N562-V565 PolarHBondContact O-N 3.28Å; N562-V565 VanDerWaalsContact O-N 3.15Å; N562-T566 PolarHBondContact O-N 3.18Å; N562-T566 PolarHBondContact O-OG1 3.47Å
563	T	88.3	Confident	84.8	Confident	50 Å²	50	47.7 Å²	47.7	31%	0.307	24%	0.242	S	C	.	.	H	α-helix	trans	-61.1	-26	-178.3	51.4	0	0	0	0	112.5	Y561 V565 A567	Y561-T563 PolarHBondContact O-N 3.11Å; Y561-T563 VanDerWaalsContact O-N 3.13Å; T563-V565 PolarHBondContact O-N 3.38Å; T563-A567 WeakPolarHBondContact O-CB 3.18Å; T563-A567 PolarHBondContact O-N 2.78Å
564	H	87.5	Confident	86.3	Confident	110 Å²	110	45 Å²	45	51%	0.509	22%	0.223	S	C	.	.	H	α-helix	trans	-62.5	-31.8	176.8	-64.7	-88.1	0	0	0	113.1	N562 R603	N562-H564 PolarHBondContact O-N 3.25Å; N562-H564 WeakPolarHBondContact OD1-CB 3.4Å; N562-H564 PolarHBondContact OD1-CD2 3.13Å; N562-H564 PolarHBondContact OD1-N 3.12Å; H564-R603 PolarHBondContact O-NH1 3.36Å
565	V	87.9	Confident	87.4	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.055	19%	0.191	C	C	.	.	H	α-helix	trans	-98.1	-40.5	179.5	-177.9	0	0	0	0	111.3	R495 E496 A499 N562 T563 P569	R495-V565 HydrophobicContact CG-CG1 4.39Å; E496-V565 HydrophobicContact CG-CG1 4.45Å; E496-V565 HydrophobicContact CG-CG2 4.03Å; A499-V565 HydrophobicContact CB-CG1 3.72Å; N562-V565 PolarHBondContact O-N 3.28Å; N562-V565 VanDerWaalsContact O-N 3.15Å; T563-V565 PolarHBondContact O-N 3.38Å; V565-P569 WeakPolarHBondContact O-CD 3.26Å; V565-P569 VanDerWaalsContact O-CG 3.31Å; V565-P569 WeakPolarHBondContact O-CG 3.41Å
566	T	90.7	Very high	88.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-94	-19.7	-166.9	59.5	0	0	0	0	114.4	I481 M533 N562 P569 G570	I481-T566 HydrophobicContact CG2-CG2 4.29Å; M533-T566 HydrophobicContact CE-CG2 4.47Å; M533-T566 PolarHBondContact O-OG1 2.94Å; N562-T566 PolarHBondContact O-N 3.18Å; N562-T566 PolarHBondContact O-OG1 3.47Å; T566-P569 WeakPolarHBondContact O-CD 3.45Å; T566-P569 WeakPolarHBondContact O-CG 3.17Å; T566-G570 PolarHBondContact O-N 3.03Å; T566-G570 VanDerWaalsContact O-N 3.14Å
567	A	92.3	Very high	89.3	Confident	6 Å²	6	28 Å²	28	5%	0.05	14%	0.141	C	C	.	.	H	α-helix	trans	-69.8	-49.1	-175.7	0	0	0	0	0	112.6	T563 G570 I571	T563-A567 WeakPolarHBondContact O-CB 3.18Å; T563-A567 PolarHBondContact O-N 2.78Å; A567-G570 PolarHBondContact O-N 3.23Å; A567-I571 HydrophobicContact CB-CD1 4.42Å; A567-I571 WeakPolarHBondContact O-CB 3.39Å; A567-I571 VanDerWaalsContact O-CD1 3.32Å; A567-I571 WeakPolarHBondContact O-CD1 3.37Å; A567-I571 WeakPolarHBondContact O-CG1 3.42Å; A567-I571 PolarHBondContact O-N 3.02Å
568	A	93.6	Very high	90.2	Very high	17 Å²	17	25.7 Å²	25.7	14%	0.14	13%	0.13	C	C	.	.	H	α-helix	trans	-57.1	-51	179.4	0	0	0	0	0	113.7	L500 G570 I571 L572 L609	L500-A568 HydrophobicContact CD1-CB 4.47Å; A568-G570 PolarHBondContact O-N 3.25Å; A568-I571 PolarHBondContact O-N 3.2Å; A568-L572 PolarHBondContact O-N 3.36Å; A568-L572 VanDerWaalsContact O-N 3.16Å; A568-L609 HydrophobicContact CB-CD1 3.6Å
569	P	94.2	Very high	90.9	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.013	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-39.4	175.5	19.4	-28.7	0	0	0	112.9	I481 A499 V565 T566 L572 A573	I481-P569 HydrophobicContact CD1-CB 4.21Å; I481-P569 HydrophobicContact CG1-CB 4.46Å; I481-P569 HydrophobicContact CG2-CB 4.07Å; I481-P569 HydrophobicContact CG2-CG 3.64Å; A499-P569 HydrophobicContact CB-CG 4.42Å; A499-P569 VanDerWaalsContact O-CB 3.28Å; A499-P569 WeakPolarHBondContact O-CB 3.45Å; V565-P569 WeakPolarHBondContact O-CD 3.26Å; V565-P569 VanDerWaalsContact O-CG 3.31Å; V565-P569 WeakPolarHBondContact O-CG 3.41Å; T566-P569 WeakPolarHBondContact O-CD 3.45Å; T566-P569 WeakPolarHBondContact O-CG 3.17Å; P569-L572 PolarHBondContact O-N 3.32Å; P569-A573 WeakPolarHBondContact O-CB 3.38Å; P569-A573 PolarHBondContact O-N 2.83Å
570	G	93.8	Very high	91.5	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-62.4	-44.4	177.6	0	0	0	0	0	112.8	T566 A567 A568 L574	T566-G570 PolarHBondContact O-N 3.03Å; T566-G570 VanDerWaalsContact O-N 3.14Å; A567-G570 PolarHBondContact O-N 3.23Å; A568-G570 PolarHBondContact O-N 3.25Å; G570-L574 WeakPolarHBondContact O-CB 3.44Å; G570-L574 PolarHBondContact O-N 2.93Å
571	I	95.6	Very high	91.9	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.6	-49.5	178.1	-70.7	158.7	0	0	0	110.8	I534 A567 A568 L574 G575 L590 A606 L609 R610 S613	I534-I571 HydrophobicContact CD1-CG1 4.08Å; I534-I571 HydrophobicContact CG1-CG1 3.96Å; I534-I571 HydrophobicContact CG2-CD1 4.4Å; I534-I571 HydrophobicContact CG2-CG1 3.88Å; A567-I571 HydrophobicContact CB-CD1 4.42Å; A567-I571 WeakPolarHBondContact O-CB 3.39Å; A567-I571 VanDerWaalsContact O-CD1 3.32Å; A567-I571 WeakPolarHBondContact O-CD1 3.37Å; A567-I571 WeakPolarHBondContact O-CG1 3.42Å; A567-I571 PolarHBondContact O-N 3.02Å; A568-I571 PolarHBondContact O-N 3.2Å; I571-L574 PolarHBondContact O-N 3.09Å; I571-G575 PolarHBondContact O-N 3.37Å; I571-L590 HydrophobicContact CB-CD2 4.42Å; I571-L590 HydrophobicContact CG1-CD2 4.23Å; I571-L590 HydrophobicContact CG2-CD2 4.07Å; I571-A606 HydrophobicContact CD1-CB 4.09Å; I571-L609 HydrophobicContact CB-CB 4.48Å; I571-L609 HydrophobicContact CD1-CB 4.41Å; I571-L609 VanDerWaalsContact CG2-C 3.45Å; I571-L609 HydrophobicContact CG2-CB 3.8Å; I571-L609 VanDerWaalsContact CG2-O 3.24Å; I571-L609 WeakPolarHBondContact CG2-O 3.42Å; I571-R610 HydrophobicContact CD1-CG 3.65Å; I571-R610 HydrophobicContact CG1-CG 4Å; I571-R610 HydrophobicContact CG2-CG 4.46Å; I571-S613 VanDerWaalsContact CG2-OG 3.25Å; I571-S613 WeakPolarHBondContact CG2-OG 3.36Å; I571-S613 PolarHBondContact O-OG 2.84Å
572	L	94.9	Very high	92.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.3	-40.1	-178.4	-75.3	171.7	0	0	0	112.6	L500 L504 A568 P569 L574 G575 M576 L609 I758 Y762	L500-L572 HydrophobicContact CD1-CD1 3.68Å; L504-L572 HydrophobicContact CD2-CB 4.48Å; L504-L572 HydrophobicContact CD2-CD1 3.92Å; A568-L572 PolarHBondContact O-N 3.36Å; A568-L572 VanDerWaalsContact O-N 3.16Å; P569-L572 PolarHBondContact O-N 3.32Å; L572-L574 VanDerWaalsContact C-N 3.31Å; L572-L574 PolarHBondContact O-N 2.88Å; L572-G575 PolarHBondContact O-N 3.43Å; L572-M576 WeakPolarHBondContact O-CB 3.23Å; L572-M576 WeakPolarHBondContact O-CG 3.09Å; L572-M576 PolarHBondContact O-N 3.36Å; L572-L609 HydrophobicContact CD1-CD1 4.36Å; L572-L609 HydrophobicContact CD1-CD2 4.38Å; L572-L609 HydrophobicContact CD2-CD2 4.21Å; L572-L609 HydrophobicContact CG-CD1 4.5Å; L572-L609 HydrophobicContact CG-CD2 4.39Å; L572-I758 HydrophobicContact CD2-CG2 3.98Å; L572-Y762 HydrophobicContact CD1-CD2 4.17Å; L572-Y762 HydrophobicContact CD1-CE2 3.8Å
573	A	94.8	Very high	92.4	Very high	3 Å²	3	23.8 Å²	23.8	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-56.2	-46.8	173.9	0	0	0	0	0	111	F506 P569 S577	F506-A573 HydrophobicContact CB-CB 4.42Å; F506-A573 HydrophobicContact CD1-CB 3.52Å; F506-A573 HydrophobicContact CE1-CB 4.09Å; F506-A573 HydrophobicContact CG-CB 4.18Å; P569-A573 WeakPolarHBondContact O-CB 3.38Å; P569-A573 PolarHBondContact O-N 2.83Å; A573-S577 VanDerWaalsContact O-CB 3.26Å; A573-S577 WeakPolarHBondContact O-CB 3.43Å; A573-S577 PolarHBondContact O-N 3.49Å; A573-S577 PolarHBondContact O-OG 2.87Å
574	L	94	Very high	92.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.9	-46.5	177.9	-165.9	67.6	0	0	0	111.8	L527 I530 I534 G570 I571 L572 M576 S577 F578 I586 L590	L527-L574 HydrophobicContact CD1-CD1 3.69Å; I530-L574 HydrophobicContact CG2-CB 4.3Å; I534-L574 HydrophobicContact CD1-CD2 4.27Å; G570-L574 WeakPolarHBondContact O-CB 3.44Å; G570-L574 PolarHBondContact O-N 2.93Å; I571-L574 PolarHBondContact O-N 3.09Å; L572-L574 VanDerWaalsContact C-N 3.31Å; L572-L574 PolarHBondContact O-N 2.88Å; L574-M576 PolarHBondContact O-N 3.26Å; L574-S577 PolarHBondContact O-N 3.21Å; L574-F578 HydrophobicContact CD1-CD2 3.94Å; L574-F578 HydrophobicContact CD1-CE2 3.85Å; L574-F578 HydrophobicContact CG-CD2 4.47Å; L574-F578 PolarHBondContact O-N 3.17Å; L574-F578 VanDerWaalsContact O-N 3.14Å; L574-I586 HydrophobicContact CD1-CG2 3.68Å; L574-I586 HydrophobicContact CD2-CG2 3.79Å; L574-I586 HydrophobicContact CG-CG2 3.64Å; L574-L590 HydrophobicContact CD2-CD1 4.12Å; L574-L590 HydrophobicContact CD2-CD2 4.1Å; L574-L590 HydrophobicContact CD2-CG 4.02Å
575	G	93.8	Very high	92.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.5	-44.5	179.1	0	0	0	0	0	113.6	I571 L572 L579	I571-G575 PolarHBondContact O-N 3.37Å; L572-G575 PolarHBondContact O-N 3.43Å; G575-L579 PolarHBondContact O-N 3.45Å; G575-L579 VanDerWaalsContact O-N 3.16Å
576	M	94.5	Very high	92.8	Very high	3 Å²	3	21.5 Å²	21.5	2%	0.015	12%	0.122	C	C	.	.	H	α-helix	trans	-72.3	-37.4	177.5	-69.5	-173.4	178.4	0	0	112.5	L504 L511 G512 L572 L574 F578 L579 A755 I758	L504-M576 HydrophobicContact CD2-CE 3.58Å; L504-M576 HydrophobicContact CD2-SD 4.36Å; L511-M576 HydrophobicContact CD1-CB 4.17Å; G512-M576 PolarHBondContact N-O 2.97Å; G512-M576 VanDerWaalsContact N-O 3.08Å; L572-M576 WeakPolarHBondContact O-CB 3.23Å; L572-M576 WeakPolarHBondContact O-CG 3.09Å; L572-M576 PolarHBondContact O-N 3.36Å; L574-M576 PolarHBondContact O-N 3.26Å; M576-F578 VanDerWaalsContact C-N 3.27Å; M576-F578 PolarHBondContact O-N 3.23Å; M576-L579 WeakPolarHBondContact O-CB 3.34Å; M576-L579 PolarHBondContact O-N 2.82Å; M576-A755 HydrophobicContact CE-CB 4.48Å; M576-A755 HydrophobicContact SD-CB 4.35Å; M576-I758 HydrophobicContact CE-CB 3.69Å; M576-I758 HydrophobicContact CE-CD1 3.99Å; M576-I758 HydrophobicContact CE-CG1 4.47Å; M576-I758 HydrophobicContact CE-CG2 3.4Å
577	S	93.5	Very high	92.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.7	-39.5	178	-62.9	0	0	0	0	111.9	A510 G512 R513 G514 A573 L574	A510-S577 WeakPolarHBondContact CB-OG 3.44Å; A510-S577 WeakPolarHBondContact O-CA 3.38Å; G512-S577 CarbonylContact C-O 3.49Å; G512-S577 PolarHBondContact N-O 2.89Å; R513-S577 PolarHBondContact N-O 2.7Å; G514-S577 VanDerWaalsContact CA-O 3.29Å; G514-S577 WeakPolarHBondContact CA-O 3.39Å; G514-S577 PolarHBondContact N-O 3.38Å; A573-S577 VanDerWaalsContact O-CB 3.26Å; A573-S577 WeakPolarHBondContact O-CB 3.43Å; A573-S577 PolarHBondContact O-N 3.49Å; A573-S577 PolarHBondContact O-OG 2.87Å; L574-S577 PolarHBondContact O-N 3.21Å
578	F	93.3	Very high	92.8	Very high	5 Å²	5	26.5 Å²	26.5	2%	0.022	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	20.9	-177.7	-72.3	-85.6	0	0	0	113.4	R515 F518 L574 M576 R580 S581 D583 I586 I617	R515-F578 HydrophobicContact CG-CE1 4.22Å; F518-F578 HydrophobicContact CB-CZ 4.31Å; F518-F578 HydrophobicContact CD2-CD2 4.48Å; F518-F578 AromaticContact CD2-CE2 3.32Å; F518-F578 HydrophobicContact CD2-CE2 3.32Å; F518-F578 AromaticContact CD2-CZ 3.35Å; F518-F578 HydrophobicContact CD2-CZ 3.35Å; F518-F578 HydrophobicContact CE2-CD2 4.32Å; F518-F578 AromaticContact CE2-CE2 3.42Å; F518-F578 HydrophobicContact CE2-CE2 3.42Å; F518-F578 VanDerWaalsContact CE2-CE2 3.42Å; F518-F578 AromaticContact CE2-CZ 3.97Å; F518-F578 HydrophobicContact CE2-CZ 3.97Å; F518-F578 HydrophobicContact CG-CE2 4.29Å; F518-F578 HydrophobicContact CG-CZ 4.1Å; F518-F578 HydrophobicContact CZ-CE2 4.42Å; L574-F578 HydrophobicContact CD1-CD2 3.94Å; L574-F578 HydrophobicContact CD1-CE2 3.85Å; L574-F578 HydrophobicContact CG-CD2 4.47Å; L574-F578 PolarHBondContact O-N 3.17Å; L574-F578 VanDerWaalsContact O-N 3.14Å; M576-F578 VanDerWaalsContact C-N 3.27Å; M576-F578 PolarHBondContact O-N 3.23Å; F578-R580 PolarHBondContact O-N 3.36Å; F578-S581 WeakPolarHBondContact CB-OG 3.2Å; F578-S581 VanDerWaalsContact O-CB 3.25Å; F578-S581 WeakPolarHBondContact O-CB 3.3Å; F578-S581 PolarHBondContact O-N 2.84Å; F578-S581 PolarHBondContact O-OG 3.29Å; F578-D583 HydrophobicContact CD1-CB 4.23Å; F578-I586 HydrophobicContact CD1-CG1 4.12Å; F578-I586 HydrophobicContact CD2-CB 4.41Å; F578-I586 HydrophobicContact CD2-CG1 4.3Å; F578-I586 HydrophobicContact CD2-CG2 3.7Å; F578-I586 HydrophobicContact CE1-CD1 4.49Å; F578-I586 HydrophobicContact CE1-CG1 3.76Å; F578-I586 HydrophobicContact CE2-CB 4.49Å; F578-I586 HydrophobicContact CE2-CD1 4.13Å; F578-I586 HydrophobicContact CE2-CG1 3.93Å; F578-I586 HydrophobicContact CE2-CG2 3.94Å; F578-I586 HydrophobicContact CG-CB 4.4Å; F578-I586 HydrophobicContact CG-CG1 4.36Å; F578-I586 HydrophobicContact CG-CG2 4.05Å; F578-I586 HydrophobicContact CZ-CD1 3.92Å; F578-I586 HydrophobicContact CZ-CG1 3.65Å; F578-I617 HydrophobicContact CB-CD1 3.9Å; F578-I617 HydrophobicContact CB-CG1 3.79Å; F578-I617 HydrophobicContact CB-CG2 4.34Å
579	L	93.2	Very high	92.7	Very high	7 Å²	7	31.7 Å²	31.7	4%	0.037	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	127	177.4	-175.6	65.8	0	0	0	110.4	L511 G575 M576 S581 L616 D751 I754	L511-L579 HydrophobicContact CD1-CD2 3.88Å; G575-L579 PolarHBondContact O-N 3.45Å; G575-L579 VanDerWaalsContact O-N 3.16Å; M576-L579 WeakPolarHBondContact O-CB 3.34Å; M576-L579 PolarHBondContact O-N 2.82Å; L579-S581 PolarHBondContact O-N 2.92Å; L579-L616 HydrophobicContact CD1-CB 3.85Å; L579-L616 HydrophobicContact CD1-CD2 3.94Å; L579-L616 HydrophobicContact CD1-CG 4.37Å; L579-D751 HydrophobicContact CD2-CB 3.8Å; L579-I754 HydrophobicContact CD1-CG2 4.3Å; L579-I754 HydrophobicContact CD2-CB 4.5Å; L579-I754 HydrophobicContact CD2-CG2 4.34Å
580	R	91.2	Very high	92.6	Very high	68 Å²	68	31.6 Å²	31.6	26%	0.257	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	17.7	178.7	-63.7	164.1	174.2	-174.1	-11.3	115.6	F578 L616 W619 V749 D751	F578-R580 PolarHBondContact O-N 3.36Å; R580-L616 PolarHBondContact N-O 3.41Å; R580-W619 HydrophobicContact CB-CB 4.38Å; R580-W619 HydrophobicContact CG-CB 3.66Å; R580-W619 HydrophobicContact CG-CD2 4.12Å; R580-W619 HydrophobicContact CG-CG 3.6Å; R580-V749 VanDerWaalsContact CZ-O 3.29Å; R580-V749 PolarHBondContact NH1-O 2.96Å; R580-V749 PolarHBondContact NH2-O 2.86Å; R580-D751 WeakPolarHBondContact CD-OD1 3.28Å; R580-D751 IonicContact CZ-OD1 2.69Å; R580-D751 IonicContact NE-OD1 2.68Å; R580-D751 IonicContact NH1-OD1 3.08Å; R580-D751 PolarHBondContact NH1-OD1 3.4Å
581	S	90.9	Very high	92.5	Very high	18 Å²	18	35.5 Å²	35.5	13%	0.126	18%	0.177	C	C	.	.			trans	-81.7	-13.5	-177.2	68.4	0	0	0	0	113.9	R515 F578 L579 D583	R515-S581 PolarHBondContact NH2-O 3.48Å; F578-S581 WeakPolarHBondContact CB-OG 3.2Å; F578-S581 VanDerWaalsContact O-CB 3.25Å; F578-S581 WeakPolarHBondContact O-CB 3.3Å; F578-S581 PolarHBondContact O-N 2.84Å; F578-S581 PolarHBondContact O-OG 3.29Å; L579-S581 PolarHBondContact O-N 2.92Å; S581-D583 PolarHBondContact O-N 3.18Å; S581-D583 VanDerWaalsContact O-N 3.12Å; S581-D583 PolarHBondContact OG-N 2.86Å
582	R	91	Very high	92.3	Very high	157 Å²	157	36 Å²	36	59%	0.592	18%	0.18	S	C	*	.			trans	52.6	26.8	-173	-54.7	179.3	-175.2	177.3	-2.6	113.6	A584 I617 D620	R582-A584 PolarHBondContact O-N 2.73Å; R582-I617 PolarHBondContact N-O 2.81Å; R582-I617 VanDerWaalsContact N-O 3.14Å; R582-D620 WeakPolarHBondContact CG-OD2 3.38Å; R582-D620 VanDerWaalsContact CZ-CG 3.42Å; R582-D620 IonicContact CZ-OD1 3.74Å; R582-D620 IonicContact CZ-OD2 3.43Å; R582-D620 IonicContact NE-OD1 3.8Å; R582-D620 IonicContact NE-OD2 3.98Å; R582-D620 PolarHBondContact NE-OD2 3.05Å; R582-D620 IonicContact NH2-OD1 2.82Å; R582-D620 PolarHBondContact NH2-OD1 3.28Å; R582-D620 IonicContact NH2-OD2 3.65Å; R582-D620 PolarHBondContact NH2-OD2 3.21Å
583	D	91.5	Very high	92.1	Very high	44 Å²	44	37.3 Å²	37.3	24%	0.235	19%	0.188	C	C	.	.			trans	-80.7	97.7	-178.8	-166.9	-27.6	0	0	0	110.7	F578 S581 G585 I586 A587	F578-D583 HydrophobicContact CD1-CB 4.23Å; S581-D583 PolarHBondContact O-N 3.18Å; S581-D583 VanDerWaalsContact O-N 3.12Å; S581-D583 PolarHBondContact OG-N 2.86Å; D583-G585 VanDerWaalsContact C-N 3.27Å; D583-G585 PolarHBondContact O-N 3Å; D583-G585 PolarHBondContact OD1-N 3.31Å; D583-I586 HydrophobicContact CB-CB 4.43Å; D583-I586 HydrophobicContact CB-CG1 4.42Å; D583-I586 PolarHBondContact O-N 3.21Å; D583-I586 PolarHBondContact OD1-N 2.96Å; D583-A587 WeakPolarHBondContact O-CB 3.17Å; D583-A587 PolarHBondContact O-N 3.32Å
584	A	90.6	Very high	91.7	Very high	63 Å²	63	43.5 Å²	43.5	52%	0.521	22%	0.216	S	C	.	.	H	α-helix	trans	-63.7	-31.3	179.9	0	0	0	0	0	112.9	R582 A587 E588	R582-A584 PolarHBondContact O-N 2.73Å; A584-A587 PolarHBondContact O-N 3.28Å; A584-E588 PolarHBondContact O-N 3.09Å
585	G	90	Very high	91.3	Very high	45 Å²	45	52.1 Å²	52.1	46%	0.464	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-39.6	-178.4	0	0	0	0	0	111.9	D583 W589	D583-G585 VanDerWaalsContact C-N 3.27Å; D583-G585 PolarHBondContact O-N 3Å; D583-G585 PolarHBondContact OD1-N 3.31Å; G585-W589 VanDerWaalsContact O-CD1 3.22Å; G585-W589 PolarHBondContact O-NE1 2.99Å
586	I	91.1	Very high	90.9	Very high	12 Å²	12	54.3 Å²	54.3	6%	0.062	26%	0.261	C	S	.	.	H	α-helix	trans	-75.9	-39	174.5	-58.8	-63.8	0	0	0	111.5	L527 L574 F578 D583 E588 W589 I617	L527-I586 HydrophobicContact CD1-CD1 3.84Å; L527-I586 HydrophobicContact CD2-CD1 3.64Å; L527-I586 HydrophobicContact CG-CD1 4.42Å; L574-I586 HydrophobicContact CD1-CG2 3.68Å; L574-I586 HydrophobicContact CD2-CG2 3.79Å; L574-I586 HydrophobicContact CG-CG2 3.64Å; F578-I586 HydrophobicContact CD1-CG1 4.12Å; F578-I586 HydrophobicContact CD2-CB 4.41Å; F578-I586 HydrophobicContact CD2-CG1 4.3Å; F578-I586 HydrophobicContact CD2-CG2 3.7Å; F578-I586 HydrophobicContact CE1-CD1 4.49Å; F578-I586 HydrophobicContact CE1-CG1 3.76Å; F578-I586 HydrophobicContact CE2-CB 4.49Å; F578-I586 HydrophobicContact CE2-CD1 4.13Å; F578-I586 HydrophobicContact CE2-CG1 3.93Å; F578-I586 HydrophobicContact CE2-CG2 3.94Å; F578-I586 HydrophobicContact CG-CB 4.4Å; F578-I586 HydrophobicContact CG-CG1 4.36Å; F578-I586 HydrophobicContact CG-CG2 4.05Å; F578-I586 HydrophobicContact CZ-CD1 3.92Å; F578-I586 HydrophobicContact CZ-CG1 3.65Å; D583-I586 HydrophobicContact CB-CB 4.43Å; D583-I586 HydrophobicContact CB-CG1 4.42Å; D583-I586 PolarHBondContact O-N 3.21Å; D583-I586 PolarHBondContact OD1-N 2.96Å; I586-E588 PolarHBondContact O-N 3.39Å; I586-W589 PolarHBondContact O-N 3.11Å; I586-I617 HydrophobicContact CG2-CD1 3.97Å
587	A	91.6	Very high	90.4	Very high	2 Å²	2	61.3 Å²	61.3	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-31.8	179.2	0	0	0	0	0	112.6	D583 A584 W589 L590 K591 Y614 I617 M618	D583-A587 WeakPolarHBondContact O-CB 3.17Å; D583-A587 PolarHBondContact O-N 3.32Å; A584-A587 PolarHBondContact O-N 3.28Å; A587-W589 VanDerWaalsContact C-N 3.3Å; A587-W589 PolarHBondContact O-N 3.29Å; A587-L590 PolarHBondContact O-N 3.43Å; A587-K591 PolarHBondContact O-N 3.35Å; A587-Y614 HydrophobicContact CB-CD2 3.84Å; A587-Y614 HydrophobicContact CB-CE2 3.81Å; A587-Y614 WeakPolarHBondContact O-CD2 3.47Å; A587-I617 HydrophobicContact CB-CG2 4.15Å; A587-M618 HydrophobicContact CB-CG 4.09Å; A587-M618 HydrophobicContact CB-SD 4.15Å
588	E	92	Very high	90.1	Very high	110 Å²	110	64.9 Å²	64.9	51%	0.514	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-39.1	179	-163.6	62.5	-153.9	0	0	112.7	A584 I586 L590 K591	A584-E588 PolarHBondContact O-N 3.09Å; I586-E588 PolarHBondContact O-N 3.39Å; E588-L590 PolarHBondContact O-N 2.89Å; E588-L590 VanDerWaalsContact O-N 3.15Å; E588-K591 PolarHBondContact O-N 3.27Å; E588-K591 IonicContact OE1-NZ 2.63Å; E588-K591 WeakPolarHBondContact OE2-CD 3.42Å; E588-K591 WeakPolarHBondContact OE2-CE 3.47Å; E588-K591 IonicContact OE2-NZ 3.68Å; E588-K591 PolarHBondContact OE2-NZ 3.35Å
589	W	90.8	Very high	89.7	Confident	125 Å²	125	64.6 Å²	64.6	47%	0.473	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18	177.3	-62	105.7	0	0	0	114	V531 H535 G585 I586 A587	V531-W589 HydrophobicContact CG1-CD2 4.28Å; V531-W589 HydrophobicContact CG1-CE3 3.83Å; V531-W589 HydrophobicContact CG1-CZ3 4.08Å; V531-W589 HydrophobicContact CG2-CD2 4.28Å; V531-W589 HydrophobicContact CG2-CG 4.28Å; H535-W589 PolarHBondContact CE1-O 3.33Å; H535-W589 PolarHBondContact NE2-O 2.97Å; G585-W589 VanDerWaalsContact O-CD1 3.22Å; G585-W589 PolarHBondContact O-NE1 2.99Å; I586-W589 PolarHBondContact O-N 3.11Å; A587-W589 VanDerWaalsContact C-N 3.3Å; A587-W589 PolarHBondContact O-N 3.29Å
590	L	92.7	Very high	89.3	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-4.8	-179.5	-66	174	0	0	0	112.8	I534 I571 L574 A587 E588 R610 I617	I534-L590 HydrophobicContact CD1-CD2 4.2Å; I571-L590 HydrophobicContact CB-CD2 4.42Å; I571-L590 HydrophobicContact CG1-CD2 4.23Å; I571-L590 HydrophobicContact CG2-CD2 4.07Å; L574-L590 HydrophobicContact CD2-CD1 4.12Å; L574-L590 HydrophobicContact CD2-CD2 4.1Å; L574-L590 HydrophobicContact CD2-CG 4.02Å; A587-L590 PolarHBondContact O-N 3.43Å; E588-L590 PolarHBondContact O-N 2.89Å; E588-L590 VanDerWaalsContact O-N 3.15Å; L590-R610 WeakPolarHBondContact O-CB 3.17Å; L590-I617 HydrophobicContact CD1-CD1 3.67Å
591	K	91.9	Very high	89.1	Confident	83 Å²	83	69.6 Å²	69.6	36%	0.361	35%	0.348	S	S	.	.	S	Bend	trans	-66.4	150.6	176	-72.2	-175.1	-176.6	167.4	0	111.2	A587 E588 Y614	A587-K591 PolarHBondContact O-N 3.35Å; E588-K591 PolarHBondContact O-N 3.27Å; E588-K591 IonicContact OE1-NZ 2.63Å; E588-K591 WeakPolarHBondContact OE2-CD 3.42Å; E588-K591 WeakPolarHBondContact OE2-CE 3.47Å; E588-K591 IonicContact OE2-NZ 3.68Å; E588-K591 PolarHBondContact OE2-NZ 3.35Å; K591-Y614 HydrophobicContact CD-CE2 4.16Å; K591-Y614 VanDerWaalsContact CE-CE2 3.45Å; K591-Y614 HydrophobicContact CG-CD2 3.83Å; K591-Y614 HydrophobicContact CG-CE2 3.64Å
592	L	91.6	Very high	89	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.063	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-73.7	137.4	171.8	-66	177.6	0	0	0	109.6	L599 A607 R610 V611 P634 L637 A664	L592-L599 HydrophobicContact CB-CD1 4.41Å; L592-A607 HydrophobicContact CD2-CB 3.86Å; L592-R610 HydrophobicContact CD2-CB 4.37Å; L592-V611 HydrophobicContact CD1-CG2 3.69Å; L592-V611 HydrophobicContact CG-CG2 4.02Å; L592-P634 HydrophobicContact CB-CG 3.57Å; L592-L637 HydrophobicContact CD1-CD1 4.27Å; L592-A664 HydrophobicContact CD1-CB 3.87Å
593	P	90.4	Very high	88.9	Confident	27 Å²	27	65.4 Å²	65.4	18%	0.175	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-66.9	149.9	-179.1	28.7	-35.2	0	0	0	111.6	D598 L599 I602	P593-D598 HydrophobicContact CB-CB 3.65Å; P593-D598 HydrophobicContact CG-CB 3.7Å; P593-L599 HydrophobicContact CG-CB 4.31Å; P593-L599 HydrophobicContact CG-CD1 4.18Å; P593-I602 HydrophobicContact CG-CD1 3.6Å
594	H	85.7	Confident	88.8	Confident	132 Å²	132	64.4 Å²	64.4	61%	0.611	33%	0.326	S	S	*	.	S	Bend	trans	-84.4	-21.7	176.5	-69.5	-69.7	0	0	0	113.5
595	R	87	Confident	88.7	Confident	181 Å²	181	61.9 Å²	61.9	68%	0.683	30%	0.304	S	S	*	.	S	Bend	trans	-79.4	138.8	177.2	-66.4	-178.3	177.6	176.6	-0.7	110.1	D598 L599	R595-D598 HydrophobicContact CB-CB 4.32Å; R595-D598 WeakPolarHBondContact CB-OD2 3.39Å; R595-D598 WeakPolarHBondContact CD-OD2 3.26Å; R595-L599 PolarHBondContact O-N 2.64Å
596	L	83.6	Confident	88.8	Confident	47 Å²	47	60.2 Å²	60.2	25%	0.246	29%	0.286	C	S	.	.	H	α-helix	trans	-69.5	-39	-174	-166.3	62.4	0	0	0	112.8	L599 Q600 P636 L652 L657	L596-L599 WeakPolarHBondContact O-CB 3.48Å; L596-L599 PolarHBondContact O-N 3.25Å; L596-Q600 WeakPolarHBondContact O-CG 3.44Å; L596-Q600 PolarHBondContact O-N 3.01Å; L596-P636 HydrophobicContact CD1-CB 4.19Å; L596-L652 HydrophobicContact CD2-CD2 3.13Å; L596-L652 HydrophobicContact CG-CD2 4.34Å; L596-L657 HydrophobicContact CD1-CD1 3.81Å; L596-L657 HydrophobicContact CD1-CD2 3.45Å; L596-L657 VanDerWaalsContact CD1-CD2 3.45Å; L596-L657 HydrophobicContact CD1-CG 4.26Å
597	E	84.8	Confident	88.8	Confident	149 Å²	149	59.6 Å²	59.6	70%	0.696	28%	0.283	S	S	*	.	H	α-helix	trans	-61.3	-47.8	178.1	-63.9	170.3	-173.3	0	0	111.2	L599 Q600 C601	E597-L599 PolarHBondContact O-N 2.78Å; E597-Q600 PolarHBondContact O-N 3.25Å; E597-C601 PolarHBondContact O-N 2.64Å; E597-C601 VanDerWaalsContact O-N 3.17Å; E597-C601 PolarHBondContact O-SG 3.49Å
598	D	86.4	Confident	88.8	Confident	75 Å²	75	59.6 Å²	59.6	40%	0.401	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-34.7	176.9	-63.9	-30.6	0	0	0	111.7	P593 R595 C601 I602	P593-D598 HydrophobicContact CB-CB 3.65Å; P593-D598 HydrophobicContact CG-CB 3.7Å; R595-D598 HydrophobicContact CB-CB 4.32Å; R595-D598 WeakPolarHBondContact CB-OD2 3.39Å; R595-D598 WeakPolarHBondContact CD-OD2 3.26Å; D598-C601 PolarHBondContact O-N 2.68Å; D598-I602 WeakPolarHBondContact O-CG1 3.21Å
599	L	86	Confident	88.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-70.3	-40.9	178.6	-165.8	67	0	0	0	111.5	L592 P593 R595 L596 E597 C601 I602 L637 L657 I660	L592-L599 HydrophobicContact CB-CD1 4.41Å; P593-L599 HydrophobicContact CG-CB 4.31Å; P593-L599 HydrophobicContact CG-CD1 4.18Å; R595-L599 PolarHBondContact O-N 2.64Å; L596-L599 WeakPolarHBondContact O-CB 3.48Å; L596-L599 PolarHBondContact O-N 3.25Å; E597-L599 PolarHBondContact O-N 2.78Å; L599-C601 PolarHBondContact O-N 2.79Å; L599-I602 PolarHBondContact O-N 3.41Å; L599-I602 VanDerWaalsContact O-N 3.16Å; L599-L637 HydrophobicContact CD2-CD1 4.12Å; L599-L637 HydrophobicContact CD2-CD2 3.76Å; L599-L637 HydrophobicContact CD2-CG 3.8Å; L599-L657 HydrophobicContact CD2-CD2 3.93Å; L599-I660 HydrophobicContact CD1-CG2 3.97Å; L599-I660 HydrophobicContact CG-CD1 4.09Å; L599-I660 HydrophobicContact CG-CG2 4.19Å; L599-I660 WeakPolarHBondContact O-CD1 3.5Å
600	Q	84.6	Confident	89.1	Confident	71 Å²	71	49 Å²	49	33%	0.332	24%	0.238	S	C	.	.	H	α-helix	trans	-65	-26.6	175.8	-73	174.3	-18.4	0	0	112.8	L596 E597 I602	L596-Q600 WeakPolarHBondContact O-CG 3.44Å; L596-Q600 PolarHBondContact O-N 3.01Å; E597-Q600 PolarHBondContact O-N 3.25Å; Q600-I602 VanDerWaalsContact C-N 3.27Å; Q600-I602 PolarHBondContact O-N 3.06Å
601	C	86.2	Confident	89.1	Confident	108 Å²	108	49.5 Å²	49.5	73%	0.73	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-15.3	175.6	-64.8	0	0	0	0	113.6	E597 D598 L599	E597-C601 PolarHBondContact O-N 2.64Å; E597-C601 VanDerWaalsContact O-N 3.17Å; E597-C601 PolarHBondContact O-SG 3.49Å; D598-C601 PolarHBondContact O-N 2.68Å; L599-C601 PolarHBondContact O-N 2.79Å
602	I	89	Confident	89.1	Confident	18 Å²	18	45.6 Å²	45.6	9%	0.092	22%	0.223	C	C	.	.	S	Bend	trans	-90.8	125.8	-177.4	-63.6	166.5	0	0	0	109.9	P593 D598 L599 Q600 A606 A607	P593-I602 HydrophobicContact CG-CD1 3.6Å; D598-I602 WeakPolarHBondContact O-CG1 3.21Å; L599-I602 PolarHBondContact O-N 3.41Å; L599-I602 VanDerWaalsContact O-N 3.16Å; Q600-I602 VanDerWaalsContact C-N 3.27Å; Q600-I602 PolarHBondContact O-N 3.06Å; I602-A606 HydrophobicContact CG2-CB 4.22Å; I602-A607 HydrophobicContact CG2-CB 3.96Å
603	R	89.4	Confident	89.3	Confident	70 Å²	70	45 Å²	45	26%	0.264	22%	0.22	S	C	.	.			trans	-60.2	135.1	171.8	-160.2	-177.1	167.8	-179.4	3.7	110.1	E496 H564 D605 A606 A607	E496-R603 IonicContact OE1-NH1 2.74Å; E496-R603 IonicContact OE2-NH1 2.63Å; H564-R603 PolarHBondContact O-NH1 3.36Å; R603-D605 VanDerWaalsContact C-N 3.29Å; R603-D605 WeakPolarHBondContact CB-OD1 3.49Å; R603-D605 WeakPolarHBondContact CD-OD1 3.43Å; R603-D605 WeakPolarHBondContact CG-OD1 3.11Å; R603-D605 IonicContact CZ-OD2 3.83Å; R603-D605 IonicContact NE-OD1 3.75Å; R603-D605 PolarHBondContact NE-OD1 2.83Å; R603-D605 IonicContact NE-OD2 2.94Å; R603-D605 PolarHBondContact NE-OD2 3.26Å; R603-D605 VanDerWaalsContact NE-OD2 3.11Å; R603-D605 IonicContact NH1-OD2 3.87Å; R603-D605 IonicContact NH2-OD2 3.73Å; R603-D605 PolarHBondContact O-N 3.19Å; R603-A606 HydrophobicContact CB-CB 4.31Å; R603-A606 WeakPolarHBondContact O-CB 3.49Å; R603-A606 PolarHBondContact O-N 3.41Å; R603-A607 PolarHBondContact O-N 3.19Å
604	P	89	Confident	89.5	Confident	22 Å²	22	45.9 Å²	45.9	14%	0.143	22%	0.221	C	C	.	.	H	α-helix	trans	-56.5	-37.2	-175.8	-27.8	33.8	0	0	0	114.6	A607 M608 Q659 I660 Y663	P604-A607 WeakPolarHBondContact O-CB 3.34Å; P604-A607 PolarHBondContact O-N 3.37Å; P604-M608 PolarHBondContact O-N 3.04Å; P604-M608 VanDerWaalsContact O-N 3.09Å; P604-Q659 HydrophobicContact CB-CB 4.38Å; P604-Q659 HydrophobicContact CG-CB 4.07Å; P604-I660 HydrophobicContact CB-CG1 4.47Å; P604-I660 HydrophobicContact CG-CG1 4.22Å; P604-Y663 HydrophobicContact CB-CD1 4.35Å; P604-Y663 HydrophobicContact CB-CD2 3.45Å; P604-Y663 VanDerWaalsContact CB-CD2 3.45Å; P604-Y663 HydrophobicContact CB-CE2 3.84Å; P604-Y663 HydrophobicContact CB-CG 3.73Å; P604-Y663 WeakPolarHBondContact O-CB 3.33Å; P604-Y663 WeakPolarHBondContact O-CD1 3.23Å
605	D	89	Confident	89.8	Confident	11 Å²	11	39.7 Å²	39.7	6%	0.059	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-39.6	175.6	56.6	-2.2	0	0	0	112.6	R603 A607 M608 L609 Y663 R764	R603-D605 VanDerWaalsContact C-N 3.29Å; R603-D605 WeakPolarHBondContact CB-OD1 3.49Å; R603-D605 WeakPolarHBondContact CD-OD1 3.43Å; R603-D605 WeakPolarHBondContact CG-OD1 3.11Å; R603-D605 IonicContact CZ-OD2 3.83Å; R603-D605 IonicContact NE-OD1 3.75Å; R603-D605 PolarHBondContact NE-OD1 2.83Å; R603-D605 IonicContact NE-OD2 2.94Å; R603-D605 PolarHBondContact NE-OD2 3.26Å; R603-D605 VanDerWaalsContact NE-OD2 3.11Å; R603-D605 IonicContact NH1-OD2 3.87Å; R603-D605 IonicContact NH2-OD2 3.73Å; R603-D605 PolarHBondContact O-N 3.19Å; D605-A607 VanDerWaalsContact C-N 3.33Å; D605-A607 PolarHBondContact O-N 3.49Å; D605-M608 WeakPolarHBondContact O-CB 3.26Å; D605-M608 PolarHBondContact O-N 2.77Å; D605-L609 WeakPolarHBondContact O-CG 3.39Å; D605-L609 PolarHBondContact O-N 2.91Å; D605-L609 VanDerWaalsContact O-N 3.08Å; D605-Y663 HydrophobicContact CB-CE1 4.2Å; D605-R764 IonicContact OD2-CZ 3.28Å; D605-R764 IonicContact OD2-NE 3.07Å; D605-R764 PolarHBondContact OD2-NE 3.22Å; D605-R764 VanDerWaalsContact OD2-NE 3.13Å; D605-R764 IonicContact OD2-NH2 3.45Å; D605-R764 PolarHBondContact OD2-NH2 3.4Å
606	A	92.3	Very high	90.1	Very high	9 Å²	9	31.1 Å²	31.1	7%	0.074	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-37.2	171.9	0	0	0	0	0	111.8	I571 I602 R603 M608 L609 R610	I571-A606 HydrophobicContact CD1-CB 4.09Å; I602-A606 HydrophobicContact CG2-CB 4.22Å; R603-A606 HydrophobicContact CB-CB 4.31Å; R603-A606 WeakPolarHBondContact O-CB 3.49Å; R603-A606 PolarHBondContact O-N 3.41Å; A606-M608 PolarHBondContact O-N 3.27Å; A606-L609 PolarHBondContact O-N 3.05Å; A606-R610 WeakPolarHBondContact O-CB 3.34Å; A606-R610 WeakPolarHBondContact O-CG 3.38Å; A606-R610 PolarHBondContact O-N 2.87Å
607	A	91.8	Very high	90.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.9	-42.5	175.1	0	0	0	0	0	112.1	L592 I602 R603 P604 D605 R610 V611 I660	L592-A607 HydrophobicContact CD2-CB 3.86Å; I602-A607 HydrophobicContact CG2-CB 3.96Å; R603-A607 PolarHBondContact O-N 3.19Å; P604-A607 WeakPolarHBondContact O-CB 3.34Å; P604-A607 PolarHBondContact O-N 3.37Å; D605-A607 VanDerWaalsContact C-N 3.33Å; D605-A607 PolarHBondContact O-N 3.49Å; A607-R610 WeakPolarHBondContact O-CB 3.37Å; A607-R610 PolarHBondContact O-N 3Å; A607-V611 WeakPolarHBondContact O-CG2 3.46Å; A607-V611 PolarHBondContact O-N 3.28Å; A607-V611 VanDerWaalsContact O-N 3.14Å; A607-I660 HydrophobicContact CB-CG2 4.1Å
608	M	91.2	Very high	91.1	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-60.5	-47.7	173.4	175.7	179.2	55	0	0	112.1	P604 D605 A606 R610 V611 L612 Y663 P763 F943	P604-M608 PolarHBondContact O-N 3.04Å; P604-M608 VanDerWaalsContact O-N 3.09Å; D605-M608 WeakPolarHBondContact O-CB 3.26Å; D605-M608 PolarHBondContact O-N 2.77Å; A606-M608 PolarHBondContact O-N 3.27Å; M608-R610 VanDerWaalsContact C-N 3.3Å; M608-R610 PolarHBondContact O-N 3.01Å; M608-V611 PolarHBondContact O-N 2.89Å; M608-L612 WeakPolarHBondContact O-CB 3.35Å; M608-L612 PolarHBondContact O-N 3.49Å; M608-Y663 WeakPolarHBondContact CA-O 3.37Å; M608-Y663 HydrophobicContact CB-CD1 3.92Å; M608-Y663 VanDerWaalsContact CB-O 3.24Å; M608-Y663 WeakPolarHBondContact CB-O 3.45Å; M608-Y663 HydrophobicContact CE-CD1 3.85Å; M608-Y663 HydrophobicContact CE-CE1 4.05Å; M608-Y663 WeakPolarHBondContact CG-O 3.41Å; M608-Y663 HydrophobicContact SD-CD1 4.01Å; M608-P763 HydrophobicContact CE-CB 3.49Å; M608-P763 VanDerWaalsContact CE-CB 3.49Å; M608-P763 HydrophobicContact CE-CG 3.1Å; M608-P763 HydrophobicContact SD-CB 3.77Å; M608-P763 HydrophobicContact SD-CG 3.77Å; M608-F943 HydrophobicContact SD-CZ 4.07Å
609	L	93.2	Very high	91.3	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-65.4	-33.4	180	-66.1	178.8	0	0	0	112.3	A568 I571 L572 D605 A606 L612 S613 Y762 P763	A568-L609 HydrophobicContact CB-CD1 3.6Å; I571-L609 HydrophobicContact CB-CB 4.48Å; I571-L609 HydrophobicContact CD1-CB 4.41Å; I571-L609 VanDerWaalsContact CG2-C 3.45Å; I571-L609 HydrophobicContact CG2-CB 3.8Å; I571-L609 VanDerWaalsContact CG2-O 3.24Å; I571-L609 WeakPolarHBondContact CG2-O 3.42Å; L572-L609 HydrophobicContact CD1-CD1 4.36Å; L572-L609 HydrophobicContact CD1-CD2 4.38Å; L572-L609 HydrophobicContact CD2-CD2 4.21Å; L572-L609 HydrophobicContact CG-CD1 4.5Å; L572-L609 HydrophobicContact CG-CD2 4.39Å; D605-L609 WeakPolarHBondContact O-CG 3.39Å; D605-L609 PolarHBondContact O-N 2.91Å; D605-L609 VanDerWaalsContact O-N 3.08Å; A606-L609 PolarHBondContact O-N 3.05Å; L609-L612 HydrophobicContact CD2-CD2 4.4Å; L609-S613 VanDerWaalsContact O-CB 3.24Å; L609-S613 WeakPolarHBondContact O-CB 3.42Å; L609-S613 PolarHBondContact O-N 3.39Å; L609-S613 PolarHBondContact O-OG 2.82Å; L609-Y762 HydrophobicContact CD1-CE2 4.06Å; L609-Y762 HydrophobicContact CD2-CE2 3.94Å; L609-P763 HydrophobicContact CD2-CG 4.31Å
610	R	94.8	Very high	91.4	Very high	13 Å²	13	23.8 Å²	23.8	5%	0.049	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-51.2	174.1	-83.8	-175	-171.3	-154.8	5	111.2	I534 I571 L590 L592 A606 A607 M608 L612 S613 Y614	I534-R610 PolarHBondContact O-NH2 2.86Å; I534-R610 VanDerWaalsContact O-NH2 3.13Å; I571-R610 HydrophobicContact CD1-CG 3.65Å; I571-R610 HydrophobicContact CG1-CG 4Å; I571-R610 HydrophobicContact CG2-CG 4.46Å; L590-R610 WeakPolarHBondContact O-CB 3.17Å; L592-R610 HydrophobicContact CD2-CB 4.37Å; A606-R610 WeakPolarHBondContact O-CB 3.34Å; A606-R610 WeakPolarHBondContact O-CG 3.38Å; A606-R610 PolarHBondContact O-N 2.87Å; A607-R610 WeakPolarHBondContact O-CB 3.37Å; A607-R610 PolarHBondContact O-N 3Å; M608-R610 VanDerWaalsContact C-N 3.3Å; M608-R610 PolarHBondContact O-N 3.01Å; R610-L612 VanDerWaalsContact C-N 3.34Å; R610-L612 PolarHBondContact O-N 2.97Å; R610-S613 PolarHBondContact O-N 2.83Å; R610-Y614 VanDerWaalsContact O-CB 3.24Å; R610-Y614 WeakPolarHBondContact O-CB 3.41Å; R610-Y614 PolarHBondContact O-N 3.24Å
611	V	92.8	Very high	91.6	Very high	9 Å²	9	25.4 Å²	25.4	6%	0.055	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-41.5	177.6	176.8	0	0	0	0	111.5	L592 A607 M608 S615 L632 A664 A668	L592-V611 HydrophobicContact CD1-CG2 3.69Å; L592-V611 HydrophobicContact CG-CG2 4.02Å; A607-V611 WeakPolarHBondContact O-CG2 3.46Å; A607-V611 PolarHBondContact O-N 3.28Å; A607-V611 VanDerWaalsContact O-N 3.14Å; M608-V611 PolarHBondContact O-N 2.89Å; V611-S615 WeakPolarHBondContact O-CB 3.43Å; V611-S615 PolarHBondContact O-N 3.21Å; V611-S615 VanDerWaalsContact O-N 3.08Å; V611-S615 PolarHBondContact O-OG 2.96Å; V611-L632 HydrophobicContact CG1-CD1 4.22Å; V611-A664 HydrophobicContact CG2-CB 4.1Å; V611-A668 HydrophobicContact CG1-CB 3.91Å
612	L	92.6	Very high	91.6	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-59.8	-54.3	174.8	176	63.2	0	0	0	111	M608 L609 R610 Y614 S615 L616 F670 A671 L674	M608-L612 WeakPolarHBondContact O-CB 3.35Å; M608-L612 PolarHBondContact O-N 3.49Å; L609-L612 HydrophobicContact CD2-CD2 4.4Å; R610-L612 VanDerWaalsContact C-N 3.34Å; R610-L612 PolarHBondContact O-N 2.97Å; L612-Y614 PolarHBondContact O-N 3.42Å; L612-S615 CarbonylContact O-C 3.48Å; L612-S615 WeakPolarHBondContact O-CB 3.49Å; L612-S615 PolarHBondContact O-N 3.43Å; L612-S615 VanDerWaalsContact O-N 3.08Å; L612-L616 HydrophobicContact CD1-CD1 4.45Å; L612-L616 HydrophobicContact CD1-CG 4.37Å; L612-L616 HydrophobicContact CG-CD1 4.18Å; L612-L616 HydrophobicContact CG-CG 4.48Å; L612-L616 WeakPolarHBondContact O-CG 3.08Å; L612-L616 PolarHBondContact O-N 2.9Å; L612-F670 HydrophobicContact CD1-CB 4.32Å; L612-F670 HydrophobicContact CD1-CD1 4.18Å; L612-F670 HydrophobicContact CD1-CG 4.16Å; L612-F670 HydrophobicContact CD2-CD1 3.77Å; L612-F670 HydrophobicContact CD2-CE1 3.86Å; L612-A671 HydrophobicContact CD1-CB 3.91Å; L612-L674 HydrophobicContact CD1-CD1 4.07Å
613	S	94.7	Very high	91.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.5	-37.2	-175.8	-59.4	0	0	0	0	112.4	I571 L609 R610 S615 L616 I617	I571-S613 VanDerWaalsContact CG2-OG 3.25Å; I571-S613 WeakPolarHBondContact CG2-OG 3.36Å; I571-S613 PolarHBondContact O-OG 2.84Å; L609-S613 VanDerWaalsContact O-CB 3.24Å; L609-S613 WeakPolarHBondContact O-CB 3.42Å; L609-S613 PolarHBondContact O-N 3.39Å; L609-S613 PolarHBondContact O-OG 2.82Å; R610-S613 PolarHBondContact O-N 2.83Å; S613-S615 VanDerWaalsContact C-N 3.31Å; S613-S615 PolarHBondContact O-N 3.16Å; S613-L616 PolarHBondContact O-N 3.33Å; S613-I617 WeakPolarHBondContact O-CG1 3.29Å; S613-I617 PolarHBondContact O-N 3.44Å; S613-I617 VanDerWaalsContact O-N 3.11Å
614	Y	95.3	Very high	91	Very high	46 Å²	46	18.4 Å²	18.4	18%	0.18	10%	0.101	C	C	.	.	H	α-helix	trans	-55.5	-48	169.3	174.6	-93	0	0	0	111.3	A587 K591 R610 L612 L616 I617 M618 L632	A587-Y614 HydrophobicContact CB-CD2 3.84Å; A587-Y614 HydrophobicContact CB-CE2 3.81Å; A587-Y614 WeakPolarHBondContact O-CD2 3.47Å; K591-Y614 HydrophobicContact CD-CE2 4.16Å; K591-Y614 VanDerWaalsContact CE-CE2 3.45Å; K591-Y614 HydrophobicContact CG-CD2 3.83Å; K591-Y614 HydrophobicContact CG-CE2 3.64Å; R610-Y614 VanDerWaalsContact O-CB 3.24Å; R610-Y614 WeakPolarHBondContact O-CB 3.41Å; R610-Y614 PolarHBondContact O-N 3.24Å; L612-Y614 PolarHBondContact O-N 3.42Å; Y614-L616 PolarHBondContact O-N 2.94Å; Y614-I617 PolarHBondContact O-N 3.16Å; Y614-M618 HydrophobicContact CE1-CG 4.37Å; Y614-M618 HydrophobicContact CE2-CG 4.27Å; Y614-M618 PolarHBondContact O-N 3.31Å; Y614-L632 HydrophobicContact CD1-CD2 3.86Å; Y614-L632 HydrophobicContact CE1-CD2 3.51Å
615	S	92.9	Very high	90.7	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-68.6	-33	-179.6	-54.4	0	0	0	0	112.4	V611 L612 S613 M618 W619	V611-S615 WeakPolarHBondContact O-CB 3.43Å; V611-S615 PolarHBondContact O-N 3.21Å; V611-S615 VanDerWaalsContact O-N 3.08Å; V611-S615 PolarHBondContact O-OG 2.96Å; L612-S615 CarbonylContact O-C 3.48Å; L612-S615 WeakPolarHBondContact O-CB 3.49Å; L612-S615 PolarHBondContact O-N 3.43Å; L612-S615 VanDerWaalsContact O-N 3.08Å; S613-S615 VanDerWaalsContact C-N 3.31Å; S613-S615 PolarHBondContact O-N 3.16Å; S615-M618 CarbonylContact O-C 3.57Å; S615-M618 PolarHBondContact O-N 3.26Å; S615-W619 WeakPolarHBondContact O-CA 3.18Å; S615-W619 PolarHBondContact O-N 3.44Å
616	L	93	Very high	90.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.1	-37.5	174.2	-69.8	175.3	0	0	0	112.6	L579 R580 L612 S613 Y614 W619 L674 I754 I758	L579-L616 HydrophobicContact CD1-CB 3.85Å; L579-L616 HydrophobicContact CD1-CD2 3.94Å; L579-L616 HydrophobicContact CD1-CG 4.37Å; R580-L616 PolarHBondContact N-O 3.41Å; L612-L616 HydrophobicContact CD1-CD1 4.45Å; L612-L616 HydrophobicContact CD1-CG 4.37Å; L612-L616 HydrophobicContact CG-CD1 4.18Å; L612-L616 HydrophobicContact CG-CG 4.48Å; L612-L616 WeakPolarHBondContact O-CG 3.08Å; L612-L616 PolarHBondContact O-N 2.9Å; S613-L616 PolarHBondContact O-N 3.33Å; Y614-L616 PolarHBondContact O-N 2.94Å; L616-W619 HydrophobicContact CD2-CE3 4.14Å; L616-W619 HydrophobicContact CD2-CZ3 3.81Å; L616-L674 HydrophobicContact CD2-CD1 4.12Å; L616-I754 HydrophobicContact CD2-CG2 4.17Å; L616-I758 HydrophobicContact CD1-CD1 3.45Å; L616-I758 VanDerWaalsContact CD1-CD1 3.45Å; L616-I758 HydrophobicContact CD1-CG1 4.48Å; L616-I758 HydrophobicContact CD2-CD1 4.21Å; L616-I758 HydrophobicContact CG-CD1 4.5Å
617	I	94.7	Very high	90.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-70.5	-44.9	174.6	-62.9	175.2	0	0	0	110.2	F578 R582 I586 A587 L590 S613 Y614 W619	F578-I617 HydrophobicContact CB-CD1 3.9Å; F578-I617 HydrophobicContact CB-CG1 3.79Å; F578-I617 HydrophobicContact CB-CG2 4.34Å; R582-I617 PolarHBondContact N-O 2.81Å; R582-I617 VanDerWaalsContact N-O 3.14Å; I586-I617 HydrophobicContact CG2-CD1 3.97Å; A587-I617 HydrophobicContact CB-CG2 4.15Å; L590-I617 HydrophobicContact CD1-CD1 3.67Å; S613-I617 WeakPolarHBondContact O-CG1 3.29Å; S613-I617 PolarHBondContact O-N 3.44Å; S613-I617 VanDerWaalsContact O-N 3.11Å; Y614-I617 PolarHBondContact O-N 3.16Å; I617-W619 VanDerWaalsContact C-N 3.29Å; I617-W619 PolarHBondContact O-N 3.25Å
618	M	93.3	Very high	90	Very high	26 Å²	26	35.1 Å²	35.1	13%	0.128	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	45.6	179.7	-56.8	-55.3	-65.2	0	0	112.5	A587 Y614 S615 D620 I621	A587-M618 HydrophobicContact CB-CG 4.09Å; A587-M618 HydrophobicContact CB-SD 4.15Å; Y614-M618 HydrophobicContact CE1-CG 4.37Å; Y614-M618 HydrophobicContact CE2-CG 4.27Å; Y614-M618 PolarHBondContact O-N 3.31Å; S615-M618 CarbonylContact O-C 3.57Å; S615-M618 PolarHBondContact O-N 3.26Å; M618-D620 VanDerWaalsContact C-N 3.26Å; M618-D620 PolarHBondContact O-N 3.41Å; M618-D620 VanDerWaalsContact O-N 3.14Å; M618-I621 HydrophobicContact CB-CD1 4.47Å; M618-I621 HydrophobicContact CE-CD1 3.35Å; M618-I621 HydrophobicContact CE-CG1 4.41Å; M618-I621 PolarHBondContact O-N 2.98Å
619	W	90.9	Very high	89.7	Confident	14 Å²	14	35.1 Å²	35.1	5%	0.053	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-54.7	-35.1	-169.6	-175.8	-100.2	0	0	0	115	R580 S615 L616 I617 I622 L674 R675 V749 I754	R580-W619 HydrophobicContact CB-CB 4.38Å; R580-W619 HydrophobicContact CG-CB 3.66Å; R580-W619 HydrophobicContact CG-CD2 4.12Å; R580-W619 HydrophobicContact CG-CG 3.6Å; S615-W619 WeakPolarHBondContact O-CA 3.18Å; S615-W619 PolarHBondContact O-N 3.44Å; L616-W619 HydrophobicContact CD2-CE3 4.14Å; L616-W619 HydrophobicContact CD2-CZ3 3.81Å; I617-W619 VanDerWaalsContact C-N 3.29Å; I617-W619 PolarHBondContact O-N 3.25Å; W619-I622 HydrophobicContact CD2-CD1 4.35Å; W619-I622 HydrophobicContact CE3-CD1 3.99Å; W619-I622 HydrophobicContact CZ3-CD1 4.5Å; W619-I622 WeakPolarHBondContact O-CD1 3.22Å; W619-I622 WeakPolarHBondContact O-CG1 3.07Å; W619-L674 HydrophobicContact CH2-CB 4.2Å; W619-L674 HydrophobicContact CZ3-CB 4.3Å; W619-R675 HydrophobicContact CH2-CB 4.15Å; W619-R675 HydrophobicContact CZ2-CB 4.17Å; W619-R675 HydrophobicContact CZ2-CG 4.47Å; W619-R675 VanDerWaalsContact NE1-CD 3.33Å; W619-V749 HydrophobicContact CZ2-CG1 3.77Å; W619-I754 HydrophobicContact CH2-CD1 3.43Å; W619-I754 VanDerWaalsContact CH2-CD1 3.43Å; W619-I754 HydrophobicContact CH2-CG1 4.23Å; W619-I754 HydrophobicContact CZ2-CD1 3.74Å; W619-I754 HydrophobicContact CZ3-CD1 4.01Å
620	D	87.9	Confident	89.4	Confident	77 Å²	77	36.3 Å²	36.3	41%	0.412	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-80.5	-17	-172.9	-50.8	-91.5	0	0	0	113.9	R582 M618 I622	R582-D620 WeakPolarHBondContact CG-OD2 3.38Å; R582-D620 VanDerWaalsContact CZ-CG 3.42Å; R582-D620 IonicContact CZ-OD1 3.74Å; R582-D620 IonicContact CZ-OD2 3.43Å; R582-D620 IonicContact NE-OD1 3.8Å; R582-D620 IonicContact NE-OD2 3.98Å; R582-D620 PolarHBondContact NE-OD2 3.05Å; R582-D620 IonicContact NH2-OD1 2.82Å; R582-D620 PolarHBondContact NH2-OD1 3.28Å; R582-D620 IonicContact NH2-OD2 3.65Å; R582-D620 PolarHBondContact NH2-OD2 3.21Å; M618-D620 VanDerWaalsContact C-N 3.26Å; M618-D620 PolarHBondContact O-N 3.41Å; M618-D620 VanDerWaalsContact O-N 3.14Å; D620-I622 VanDerWaalsContact C-N 3.32Å
621	I	89.1	Confident	89.1	Confident	105 Å²	105	38.7 Å²	38.7	54%	0.538	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-87.8	-8.1	-178.6	-54.2	-178.6	0	0	0	111	M618 G623 W628	M618-I621 HydrophobicContact CB-CD1 4.47Å; M618-I621 HydrophobicContact CE-CD1 3.35Å; M618-I621 HydrophobicContact CE-CG1 4.41Å; M618-I621 PolarHBondContact O-N 2.98Å; I621-G623 PolarHBondContact O-N 2.86Å; I621-W628 VanDerWaalsContact O-CD1 3.28Å; I621-W628 PolarHBondContact O-NE1 3.46Å; I621-W628 VanDerWaalsContact O-NE1 3.13Å
622	I	87.7	Confident	88.9	Confident	11 Å²	11	40.1 Å²	40.1	6%	0.056	20%	0.2	C	C	.	.			trans	-62.6	111.7	-177.9	-58.9	174.1	0	0	0	110	W619 D620 W628 M672 R675 F676	W619-I622 HydrophobicContact CD2-CD1 4.35Å; W619-I622 HydrophobicContact CE3-CD1 3.99Å; W619-I622 HydrophobicContact CZ3-CD1 4.5Å; W619-I622 WeakPolarHBondContact O-CD1 3.22Å; W619-I622 WeakPolarHBondContact O-CG1 3.07Å; D620-I622 VanDerWaalsContact C-N 3.32Å; I622-W628 HydrophobicContact CB-CZ2 4.04Å; I622-W628 HydrophobicContact CG1-CH2 4.33Å; I622-W628 HydrophobicContact CG1-CZ2 3.78Å; I622-W628 HydrophobicContact CG2-CH2 3.93Å; I622-W628 HydrophobicContact CG2-CZ2 3.9Å; I622-W628 HydrophobicContact CG2-CZ3 4.32Å; I622-M672 HydrophobicContact CG2-CB 4.43Å; I622-R675 HydrophobicContact CB-CB 4.34Å; I622-R675 HydrophobicContact CB-CG 4.04Å; I622-R675 HydrophobicContact CD1-CB 3.88Å; I622-R675 HydrophobicContact CD1-CG 4.24Å; I622-R675 HydrophobicContact CG2-CB 3.91Å; I622-R675 HydrophobicContact CG2-CG 3.96Å; I622-F676 HydrophobicContact CG2-CE2 4.05Å
623	G	84	Confident	88.6	Confident	24 Å²	24	40.2 Å²	40.2	25%	0.247	20%	0.201	C	C	.	.			trans	-87.1	164.3	176.4	0	0	0	0	0	113.3	I621 M672	I621-G623 PolarHBondContact O-N 2.86Å; G623-M672 WeakPolarHBondContact O-CE 3.22Å
624	S	81.4	Confident	88.3	Confident	15 Å²	15	40.4 Å²	40.4	11%	0.105	20%	0.202	C	C	.	.	S	Bend	trans	-85.9	-10.4	175.9	55.1	0	0	0	0	114.5	T687	S624-T687 PolarHBondContact O-OG1 3.27Å
625	D	82.3	Confident	87.6	Confident	66 Å²	66	43.4 Å²	43.4	35%	0.353	22%	0.22	S	C	.	.	S	Bend	trans	-107.4	152.8	-166.1	-58.8	-17.5	0	0	0	112.1	R627 W628	D625-R627 PolarHBondContact O-N 3.27Å; D625-R627 VanDerWaalsContact O-N 3.09Å; D625-W628 WeakPolarHBondContact O-CB 3.45Å; D625-W628 PolarHBondContact O-N 2.95Å
626	Y	82.9	Confident	86.9	Confident	86 Å²	86	44.9 Å²	44.9	34%	0.337	23%	0.229	S	C	.	.	H	α-helix	trans	-56.4	-27.9	175.2	-174.5	-93.9	0	0	0	113.4	W628 I629 D630 Y661	Y626-W628 PolarHBondContact O-N 3.11Å; Y626-I629 HydrophobicContact CD2-CD1 4.46Å; Y626-I629 WeakPolarHBondContact O-CB 3.47Å; Y626-I629 PolarHBondContact O-N 3.2Å; Y626-I629 VanDerWaalsContact O-N 3.07Å; Y626-D630 HydrophobicContact CE1-CB 4.49Å; Y626-D630 VanDerWaalsContact CE1-CG 3.4Å; Y626-D630 WeakPolarHBondContact CE1-OD1 3.2Å; Y626-D630 PolarHBondContact O-N 2.99Å; Y626-D630 PolarHBondContact OH-OD1 3.14Å; Y626-Y661 PolarHBondContact OH-OH 3.23Å
627	R	86.2	Confident	86.3	Confident	210 Å²	210	44.9 Å²	44.9	79%	0.792	23%	0.229	S	C	*	.	H	α-helix	trans	-58.5	-34.3	176.7	-67.2	-178.6	178.4	175.7	0.1	112.8	D625 A631	D625-R627 PolarHBondContact O-N 3.27Å; D625-R627 VanDerWaalsContact O-N 3.09Å; R627-A631 WeakPolarHBondContact O-CB 3.28Å; R627-A631 PolarHBondContact O-N 3.23Å
628	W	89.1	Confident	85.6	Confident	31 Å²	31	49 Å²	49	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-41	176.2	172.2	82.8	0	0	0	111.2	I621 I622 D625 Y626 A631 L632 A668 A671 M672	I621-W628 VanDerWaalsContact O-CD1 3.28Å; I621-W628 PolarHBondContact O-NE1 3.46Å; I621-W628 VanDerWaalsContact O-NE1 3.13Å; I622-W628 HydrophobicContact CB-CZ2 4.04Å; I622-W628 HydrophobicContact CG1-CH2 4.33Å; I622-W628 HydrophobicContact CG1-CZ2 3.78Å; I622-W628 HydrophobicContact CG2-CH2 3.93Å; I622-W628 HydrophobicContact CG2-CZ2 3.9Å; I622-W628 HydrophobicContact CG2-CZ3 4.32Å; D625-W628 WeakPolarHBondContact O-CB 3.45Å; D625-W628 PolarHBondContact O-N 2.95Å; Y626-W628 PolarHBondContact O-N 3.11Å; W628-A631 WeakPolarHBondContact O-CB 3.23Å; W628-A631 PolarHBondContact O-N 3.03Å; W628-L632 HydrophobicContact CD2-CD1 4.19Å; W628-L632 HydrophobicContact CE3-CD1 4.25Å; W628-L632 HydrophobicContact CH2-CD1 3.61Å; W628-L632 HydrophobicContact CZ2-CD1 3.53Å; W628-L632 HydrophobicContact CZ2-CG 4.44Å; W628-L632 HydrophobicContact CZ3-CD1 3.98Å; W628-L632 PolarHBondContact O-N 3.18Å; W628-A668 HydrophobicContact CH2-CB 4.35Å; W628-A668 HydrophobicContact CZ3-CB 3.98Å; W628-A668 WeakPolarHBondContact CZ3-O 3.4Å; W628-A671 HydrophobicContact CH2-CB 4.28Å; W628-M672 HydrophobicContact CE3-CE 3.65Å; W628-M672 HydrophobicContact CZ3-CB 4.15Å; W628-M672 HydrophobicContact CZ3-CE 3.96Å
629	I	85.5	Confident	84.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-48.9	175.9	-58.7	179.4	0	0	0	110.2	Y626 A631 L632 V665 A668 M672 T687 L691	Y626-I629 HydrophobicContact CD2-CD1 4.46Å; Y626-I629 WeakPolarHBondContact O-CB 3.47Å; Y626-I629 PolarHBondContact O-N 3.2Å; Y626-I629 VanDerWaalsContact O-N 3.07Å; I629-A631 PolarHBondContact O-N 3.16Å; I629-L632 PolarHBondContact O-N 3.33Å; I629-L632 VanDerWaalsContact O-N 3.14Å; I629-V665 HydrophobicContact CG2-CG1 4.22Å; I629-V665 HydrophobicContact CG2-CG2 4.23Å; I629-A668 HydrophobicContact CB-CB 4.45Å; I629-A668 HydrophobicContact CG1-CB 4.18Å; I629-A668 HydrophobicContact CG2-CB 3.96Å; I629-M672 HydrophobicContact CD1-CE 3.81Å; I629-M672 HydrophobicContact CG1-CE 3.83Å; I629-T687 HydrophobicContact CD1-CG2 4.23Å; I629-L691 HydrophobicContact CD1-CD1 3.87Å
630	D	85.8	Confident	83.3	Confident	27 Å²	27	55.5 Å²	55.5	14%	0.144	28%	0.275	C	S	.	.	H	α-helix	trans	-56.5	-39.3	175.9	-96.1	6.9	0	0	0	111.5	Y626 L632 L633 R638 R642	Y626-D630 HydrophobicContact CE1-CB 4.49Å; Y626-D630 VanDerWaalsContact CE1-CG 3.4Å; Y626-D630 WeakPolarHBondContact CE1-OD1 3.2Å; Y626-D630 PolarHBondContact O-N 2.99Å; Y626-D630 PolarHBondContact OH-OD1 3.14Å; D630-L632 VanDerWaalsContact C-N 3.28Å; D630-L632 PolarHBondContact O-N 3.3Å; D630-L633 PolarHBondContact O-N 3.12Å; D630-R638 VanDerWaalsContact O-CZ 3.24Å; D630-R638 PolarHBondContact O-NE 3.24Å; D630-R638 PolarHBondContact O-NH2 2.86Å; D630-R642 IonicContact OD2-NH2 3.13Å; D630-R642 PolarHBondContact OD2-NH2 2.63Å
631	A	88.8	Confident	81.9	Confident	62 Å²	62	53.7 Å²	53.7	51%	0.512	28%	0.275	S	S	.	.	H	α-helix	trans	-65.4	-26.8	-179.4	0	0	0	0	0	113.7	R627 W628 I629 R638	R627-A631 WeakPolarHBondContact O-CB 3.28Å; R627-A631 PolarHBondContact O-N 3.23Å; W628-A631 WeakPolarHBondContact O-CB 3.23Å; W628-A631 PolarHBondContact O-N 3.03Å; I629-A631 PolarHBondContact O-N 3.16Å; A631-R638 VanDerWaalsContact C-NH2 3.26Å; A631-R638 VanDerWaalsContact CA-NH2 3.33Å; A631-R638 PolarHBondContact O-NH2 3.04Å
632	L	88.3	Confident	80.2	Confident	39 Å²	39	56.7 Å²	56.7	20%	0.204	28%	0.279	C	S	.	.	H	α-helix	trans	-77.2	-25.2	178.2	-68.3	172.1	0	0	0	113.6	V611 Y614 W628 I629 D630 A668	V611-L632 HydrophobicContact CG1-CD1 4.22Å; Y614-L632 HydrophobicContact CD1-CD2 3.86Å; Y614-L632 HydrophobicContact CE1-CD2 3.51Å; W628-L632 HydrophobicContact CD2-CD1 4.19Å; W628-L632 HydrophobicContact CE3-CD1 4.25Å; W628-L632 HydrophobicContact CH2-CD1 3.61Å; W628-L632 HydrophobicContact CZ2-CD1 3.53Å; W628-L632 HydrophobicContact CZ2-CG 4.44Å; W628-L632 HydrophobicContact CZ3-CD1 3.98Å; W628-L632 PolarHBondContact O-N 3.18Å; I629-L632 PolarHBondContact O-N 3.33Å; I629-L632 VanDerWaalsContact O-N 3.14Å; D630-L632 VanDerWaalsContact C-N 3.28Å; D630-L632 PolarHBondContact O-N 3.3Å; L632-A668 HydrophobicContact CD1-CB 3.87Å
633	L	87.6	Confident	78.2	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	30%	0.302	C	S	.	.	S	Bend	trans	-80.6	137.7	-173.6	-61.3	176.5	0	0	0	111.8	D630 L637 R638 Y661 A664 V665	D630-L633 PolarHBondContact O-N 3.12Å; L633-L637 HydrophobicContact CB-CB 4.38Å; L633-L637 HydrophobicContact CD2-CD1 4.45Å; L633-R638 HydrophobicContact CB-CG 3.98Å; L633-R638 PolarHBondContact O-NE 2.89Å; L633-R638 PolarHBondContact O-NH2 2.87Å; L633-Y661 HydrophobicContact CD1-CD2 4Å; L633-Y661 HydrophobicContact CD1-CE2 3.66Å; L633-A664 HydrophobicContact CD2-CB 3.5Å; L633-A664 VanDerWaalsContact CD2-CB 3.5Å; L633-V665 HydrophobicContact CD1-CG2 3.88Å
634	P	86.7	Confident	76.1	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.026	31%	0.307	C	S	.	.			trans	-58.8	153.7	168.2	-26.5	35	0	0	0	113.3	L592 P636 L637 R638	L592-P634 HydrophobicContact CB-CG 3.57Å; P634-P636 VanDerWaalsContact C-CD 3.43Å; P634-P636 VanDerWaalsContact C-N 3.35Å; P634-L637 PolarHBondContact O-N 3.48Å; P634-R638 PolarHBondContact O-N 3.46Å
635	I	82.5	Confident	74.3	Confident	108 Å²	108	65.6 Å²	65.6	55%	0.554	33%	0.331	S	S	*	.	H	α-helix	trans	-50	-44.8	-179.5	-57.6	165.3	0	0	0	113.1	L637 R638 N639	I635-L637 VanDerWaalsContact C-N 3.26Å; I635-L637 PolarHBondContact O-N 2.92Å; I635-R638 PolarHBondContact O-N 2.95Å; I635-N639 PolarHBondContact O-N 3.41Å
636	P	77.5	Confident	72.5	Confident	33 Å²	33	66.5 Å²	66.5	21%	0.214	35%	0.347	C	S	.	.	H	α-helix	trans	-57.6	-37.6	178.4	-25.2	34.9	0	0	0	113.5	L596 P634	L596-P636 HydrophobicContact CD1-CB 4.19Å; P634-P636 VanDerWaalsContact C-CD 3.43Å; P634-P636 VanDerWaalsContact C-N 3.35Å
637	L	81.2	Confident	70.8	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-78.6	-35.9	179.9	-65.3	-174.6	0	0	0	112.4	L592 L599 L633 P634 I635 N639 Y640 G641 L657 I660 Y661	L592-L637 HydrophobicContact CD1-CD1 4.27Å; L599-L637 HydrophobicContact CD2-CD1 4.12Å; L599-L637 HydrophobicContact CD2-CD2 3.76Å; L599-L637 HydrophobicContact CD2-CG 3.8Å; L633-L637 HydrophobicContact CB-CB 4.38Å; L633-L637 HydrophobicContact CD2-CD1 4.45Å; P634-L637 PolarHBondContact O-N 3.48Å; I635-L637 VanDerWaalsContact C-N 3.26Å; I635-L637 PolarHBondContact O-N 2.92Å; L637-N639 VanDerWaalsContact C-N 3.27Å; L637-N639 PolarHBondContact O-N 3.44Å; L637-Y640 WeakPolarHBondContact O-CB 3.36Å; L637-Y640 PolarHBondContact O-N 3.34Å; L637-G641 PolarHBondContact O-N 3.19Å; L637-L657 HydrophobicContact CD2-CD2 4.47Å; L637-I660 HydrophobicContact CD1-CG2 3.86Å; L637-I660 HydrophobicContact CD2-CG2 4.33Å; L637-Y661 HydrophobicContact CB-CD2 4.25Å; L637-Y661 WeakPolarHBondContact O-CD2 3.11Å
638	R	78.6	Confident	68.8	Low	88 Å²	88	69.3 Å²	69.3	33%	0.332	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-38.1	175.4	-68.5	-176	-171.2	179.3	4.6	112.3	D630 A631 L633 P634 I635 Y640 G641	D630-R638 VanDerWaalsContact O-CZ 3.24Å; D630-R638 PolarHBondContact O-NE 3.24Å; D630-R638 PolarHBondContact O-NH2 2.86Å; A631-R638 VanDerWaalsContact C-NH2 3.26Å; A631-R638 VanDerWaalsContact CA-NH2 3.33Å; A631-R638 PolarHBondContact O-NH2 3.04Å; L633-R638 HydrophobicContact CB-CG 3.98Å; L633-R638 PolarHBondContact O-NE 2.89Å; L633-R638 PolarHBondContact O-NH2 2.87Å; P634-R638 PolarHBondContact O-N 3.46Å; I635-R638 PolarHBondContact O-N 2.95Å; R638-Y640 VanDerWaalsContact C-N 3.29Å; R638-Y640 PolarHBondContact O-N 3.39Å; R638-G641 PolarHBondContact O-N 3.25Å
639	N	69.9	Low	66.9	Low	86 Å²	86	70.6 Å²	70.6	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-29.3	179.3	-68.8	-15.3	0	0	0	112.2	I635 L637	I635-N639 PolarHBondContact O-N 3.41Å; L637-N639 VanDerWaalsContact C-N 3.27Å; L637-N639 PolarHBondContact O-N 3.44Å
640	Y	65.8	Low	65.1	Low	90 Å²	90	77 Å²	77	35%	0.353	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-41.3	174.9	-169.2	-91.1	0	0	0	112	L637 R638 R642 G654 G658 Y661	L637-Y640 WeakPolarHBondContact O-CB 3.36Å; L637-Y640 PolarHBondContact O-N 3.34Å; R638-Y640 VanDerWaalsContact C-N 3.29Å; R638-Y640 PolarHBondContact O-N 3.39Å; Y640-R642 VanDerWaalsContact C-N 3.28Å; Y640-R642 PolarHBondContact O-N 2.7Å; Y640-G654 PolarHBondContact OH-O 2.89Å; Y640-G658 VanDerWaalsContact CZ-CA 3.47Å; Y640-G658 WeakPolarHBondContact OH-CA 3.39Å; Y640-Y661 HydrophobicContact CD1-CD1 4.38Å; Y640-Y661 HydrophobicContact CD1-CG 4.26Å
641	G	58.6	Low	63.5	Low	39 Å²	39	83.1 Å²	83.1	40%	0.402	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-10.6	-178.2	0	0	0	0	0	116.1	L637 R638	L637-G641 PolarHBondContact O-N 3.19Å; R638-G641 PolarHBondContact O-N 3.25Å
642	R	54.3	Low	62	Low	167 Å²	167	83.8 Å²	83.8	63%	0.63	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	22.4	-169.5	-71.2	-173.8	179.6	-179.6	1.4	115.7	D630 Y640	D630-R642 IonicContact OD2-NH2 3.13Å; D630-R642 PolarHBondContact OD2-NH2 2.63Å; Y640-R642 VanDerWaalsContact C-N 3.28Å; Y640-R642 PolarHBondContact O-N 2.7Å
643	S	46.2	Very low	60.9	Low	77 Å²	77	87.1 Å²	87.1	54%	0.538	45%	0.451	S	S	.	.			trans	81.4	99.1	-179.9	-50.7	0	0	0	0	114.5	E931	S643-E931 PolarHBondContact OG-OE2 2.92Å
644	I	38.8	Very low	60.1	Low	67 Å²	67	87.6 Å²	87.6	34%	0.344	46%	0.457	S	S	.	.			trans	-130.3	121.6	152.7	-55.4	174	0	0	0	106.4	K648	I644-K648 HydrophobicContact CG2-CB 3.98Å; I644-K648 HydrophobicContact CG2-CD 4.39Å
645	P	42.8	Very low	59.7	Low	94 Å²	94	93.1 Å²	93.1	61%	0.61	48%	0.483	S	S	*	.			trans	-60	141.4	176.1	24.7	-31.1	0	0	0	109.5	K647 K648	P645-K647 PolarHBondContact O-N 3.5Å; P645-K648 PolarHBondContact O-N 3.49Å
646	A	46.4	Very low	59.7	Low	84 Å²	84	89.9 Å²	89.9	69%	0.694	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-43.3	-22.4	-174.4	0	0	0	0	0	116.1	K648 W649	A646-K648 VanDerWaalsContact C-N 3.26Å; A646-K648 PolarHBondContact O-N 3.01Å; A646-K648 VanDerWaalsContact O-N 3.1Å; A646-W649 PolarHBondContact O-N 2.73Å
647	K	46.1	Very low	59.9	Low	182 Å²	182	88.4 Å²	88.4	79%	0.791	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-62	-11.6	-177.6	-70.5	-172.2	172.9	-173	0	117.2	P645	P645-K647 PolarHBondContact O-N 3.5Å
648	K	44.1	Very low	59.9	Low	174 Å²	174	88.5 Å²	88.5	76%	0.757	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-96.8	-8.6	178.7	-113	-175.9	-178.7	-176.8	0	114.3	I644 P645 A646	I644-K648 HydrophobicContact CG2-CB 3.98Å; I644-K648 HydrophobicContact CG2-CD 4.39Å; P645-K648 PolarHBondContact O-N 3.49Å; A646-K648 VanDerWaalsContact C-N 3.26Å; A646-K648 PolarHBondContact O-N 3.01Å; A646-K648 VanDerWaalsContact O-N 3.1Å
649	W	48.8	Very low	60.1	Low	57 Å²	57	85.6 Å²	85.6	22%	0.216	45%	0.449	C	S	.	.			trans	-107.6	10.3	-175	-64.9	94.1	0	0	0	113.1	A646 N651 L652 L657	A646-W649 PolarHBondContact O-N 2.73Å; W649-N651 PolarHBondContact O-N 2.86Å; W649-L652 HydrophobicContact CE3-CB 3.74Å; W649-L652 HydrophobicContact CZ3-CB 4.06Å; W649-L652 HydrophobicContact CZ3-CD2 4.35Å; W649-L652 CarbonylContact O-C 3.6Å; W649-L652 PolarHBondContact O-N 3.11Å; W649-L652 VanDerWaalsContact O-N 3.09Å; W649-L657 HydrophobicContact CE3-CD1 3.96Å; W649-L657 HydrophobicContact CH2-CD1 3.64Å; W649-L657 HydrophobicContact CZ3-CD1 3.2Å
650	D	48.2	Very low	60.9	Low	136 Å²	136	81.5 Å²	81.5	73%	0.727	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-12	176.3	-67.7	-25.8	0	0	0	113.1
651	N	52.2	Low	61.9	Low	155 Å²	155	78.7 Å²	78.7	83%	0.829	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	1.1	177.2	-69	-14.1	0	0	0	115	W649	W649-N651 PolarHBondContact O-N 2.86Å
652	L	56.7	Low	63.1	Low	75 Å²	75	77.3 Å²	77.3	39%	0.393	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.8	131.3	178.2	-89.7	102.5	0	0	0	109.5	L596 W649 G654	L596-L652 HydrophobicContact CD2-CD2 3.13Å; L596-L652 HydrophobicContact CG-CD2 4.34Å; W649-L652 HydrophobicContact CE3-CB 3.74Å; W649-L652 HydrophobicContact CZ3-CB 4.06Å; W649-L652 HydrophobicContact CZ3-CD2 4.35Å; W649-L652 CarbonylContact O-C 3.6Å; W649-L652 PolarHBondContact O-N 3.11Å; W649-L652 VanDerWaalsContact O-N 3.09Å; L652-G654 PolarHBondContact O-N 3.38Å
653	D	66.2	Low	64.7	Low	110 Å²	110	69.9 Å²	69.9	59%	0.588	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	76.9	-177.8	-67.4	-17.7	0	0	0	114	E655 T656 L657	D653-E655 PolarHBondContact O-N 3.47Å; D653-T656 PolarHBondContact O-N 3.14Å; D653-T656 VanDerWaalsContact O-N 3.15Å; D653-L657 PolarHBondContact O-N 3.22Å
654	G	71.5	Confident	66.7	Low	14 Å²	14	66.2 Å²	66.2	14%	0.144	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-19.6	-179.2	0	0	0	0	0	112	Y640 L652 G658	Y640-G654 PolarHBondContact OH-O 2.89Å; L652-G654 PolarHBondContact O-N 3.38Å; G654-G658 PolarHBondContact O-N 3.05Å
655	E	77.5	Confident	69	Low	120 Å²	120	63.2 Å²	63.2	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-66.5	-49.8	171.4	-168.4	-179.5	167.4	0	0	111.3	D653 L657 G658 Q659 Y942	D653-E655 PolarHBondContact O-N 3.47Å; E655-L657 VanDerWaalsContact C-N 3.33Å; E655-L657 PolarHBondContact O-N 3.3Å; E655-G658 PolarHBondContact O-N 2.76Å; E655-Q659 WeakPolarHBondContact O-CG 3.41Å; E655-Q659 PolarHBondContact O-N 3.46Å; E655-Q659 PolarHBondContact OE1-NE2 3.29Å; E655-Y942 PolarHBondContact OE1-OH 2.98Å
656	T	81.5	Confident	70.9	Confident	39 Å²	39	58.9 Å²	58.9	24%	0.239	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-44.6	178.9	-55.5	0	0	0	0	111	D653 Q659 I660	D653-T656 PolarHBondContact O-N 3.14Å; D653-T656 VanDerWaalsContact O-N 3.15Å; T656-Q659 PolarHBondContact O-N 2.9Å; T656-I660 HydrophobicContact CG2-CD1 4.06Å; T656-I660 VanDerWaalsContact O-CG1 3.3Å; T656-I660 WeakPolarHBondContact O-CG1 3.15Å; T656-I660 PolarHBondContact O-N 3.49Å
657	L	82.2	Confident	72.9	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-38.8	177.1	-65.1	170.7	0	0	0	112.4	L596 L599 L637 W649 D653 E655 I660 Y661	L596-L657 HydrophobicContact CD1-CD1 3.81Å; L596-L657 HydrophobicContact CD1-CD2 3.45Å; L596-L657 VanDerWaalsContact CD1-CD2 3.45Å; L596-L657 HydrophobicContact CD1-CG 4.26Å; L599-L657 HydrophobicContact CD2-CD2 3.93Å; L637-L657 HydrophobicContact CD2-CD2 4.47Å; W649-L657 HydrophobicContact CE3-CD1 3.96Å; W649-L657 HydrophobicContact CH2-CD1 3.64Å; W649-L657 HydrophobicContact CZ3-CD1 3.2Å; D653-L657 PolarHBondContact O-N 3.22Å; E655-L657 VanDerWaalsContact C-N 3.33Å; E655-L657 PolarHBondContact O-N 3.3Å; L657-I660 PolarHBondContact O-N 2.91Å; L657-Y661 WeakPolarHBondContact O-CB 3.39Å; L657-Y661 PolarHBondContact O-N 3.41Å
658	G	80.8	Confident	74.9	Confident	2 Å²	2	46.3 Å²	46.3	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-44	173.3	0	0	0	0	0	112	Y640 G654 E655 Y661 C662	Y640-G658 VanDerWaalsContact CZ-CA 3.47Å; Y640-G658 WeakPolarHBondContact OH-CA 3.39Å; G654-G658 PolarHBondContact O-N 3.05Å; E655-G658 PolarHBondContact O-N 2.76Å; G658-Y661 WeakPolarHBondContact O-CB 3.32Å; G658-Y661 PolarHBondContact O-N 2.82Å; G658-C662 PolarHBondContact O-N 2.95Å; G658-C662 PolarHBondContact O-SG 3Å
659	Q	83.7	Confident	76.8	Confident	26 Å²	26	38 Å²	38	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-50.8	175.1	-69	173.2	19.6	0	0	111	P604 E655 T656 Y661 C662 Y663 Y942	P604-Q659 HydrophobicContact CB-CB 4.38Å; P604-Q659 HydrophobicContact CG-CB 4.07Å; E655-Q659 WeakPolarHBondContact O-CG 3.41Å; E655-Q659 PolarHBondContact O-N 3.46Å; E655-Q659 PolarHBondContact OE1-NE2 3.29Å; T656-Q659 PolarHBondContact O-N 2.9Å; Q659-Y661 VanDerWaalsContact C-N 3.29Å; Q659-Y661 PolarHBondContact O-N 2.99Å; Q659-C662 WeakPolarHBondContact O-CB 3.4Å; Q659-C662 PolarHBondContact O-N 2.77Å; Q659-Y663 VanDerWaalsContact O-CD2 3.29Å; Q659-Y663 WeakPolarHBondContact O-CD2 3.46Å; Q659-Y663 PolarHBondContact O-N 3.02Å; Q659-Y942 HydrophobicContact CG-CD2 4.28Å; Q659-Y942 HydrophobicContact CG-CE2 4.13Å; Q659-Y942 VanDerWaalsContact NE2-CE2 3.31Å; Q659-Y942 PolarHBondContact NE2-OH 3.16Å
660	I	87.1	Confident	78.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.8	-41.7	179.4	-66.3	169.1	0	0	0	111.1	L599 P604 A607 L637 T656 L657 C662 Y663 A664	L599-I660 HydrophobicContact CD1-CG2 3.97Å; L599-I660 HydrophobicContact CG-CD1 4.09Å; L599-I660 HydrophobicContact CG-CG2 4.19Å; L599-I660 WeakPolarHBondContact O-CD1 3.5Å; P604-I660 HydrophobicContact CB-CG1 4.47Å; P604-I660 HydrophobicContact CG-CG1 4.22Å; A607-I660 HydrophobicContact CB-CG2 4.1Å; L637-I660 HydrophobicContact CD1-CG2 3.86Å; L637-I660 HydrophobicContact CD2-CG2 4.33Å; T656-I660 HydrophobicContact CG2-CD1 4.06Å; T656-I660 VanDerWaalsContact O-CG1 3.3Å; T656-I660 WeakPolarHBondContact O-CG1 3.15Å; T656-I660 PolarHBondContact O-N 3.49Å; L657-I660 PolarHBondContact O-N 2.91Å; I660-C662 PolarHBondContact O-N 3.27Å; I660-Y663 PolarHBondContact O-N 3.03Å; I660-A664 WeakPolarHBondContact O-CB 3.29Å; I660-A664 PolarHBondContact O-N 3.48Å
661	Y	87.1	Confident	80.6	Confident	31 Å²	31	29 Å²	29	12%	0.122	15%	0.153	C	C	.	.	H	α-helix	trans	-56.3	-50	173.3	175	-96.3	0	0	0	111.5	Y626 L633 L637 Y640 L657 G658 Q659 Y663 A664 V665	Y626-Y661 PolarHBondContact OH-OH 3.23Å; L633-Y661 HydrophobicContact CD1-CD2 4Å; L633-Y661 HydrophobicContact CD1-CE2 3.66Å; L637-Y661 HydrophobicContact CB-CD2 4.25Å; L637-Y661 WeakPolarHBondContact O-CD2 3.11Å; Y640-Y661 HydrophobicContact CD1-CD1 4.38Å; Y640-Y661 HydrophobicContact CD1-CG 4.26Å; L657-Y661 WeakPolarHBondContact O-CB 3.39Å; L657-Y661 PolarHBondContact O-N 3.41Å; G658-Y661 WeakPolarHBondContact O-CB 3.32Å; G658-Y661 PolarHBondContact O-N 2.82Å; Q659-Y661 VanDerWaalsContact C-N 3.29Å; Q659-Y661 PolarHBondContact O-N 2.99Å; Y661-Y663 PolarHBondContact O-N 3.23Å; Y661-A664 PolarHBondContact O-N 3.18Å; Y661-V665 HydrophobicContact CD1-CG2 4.5Å; Y661-V665 HydrophobicContact CD2-CG2 4.39Å; Y661-V665 HydrophobicContact CE1-CG2 4.15Å; Y661-V665 HydrophobicContact CE2-CG2 4.04Å; Y661-V665 WeakPolarHBondContact O-CB 3.42Å; Y661-V665 WeakPolarHBondContact O-CG2 3.27Å; Y661-V665 PolarHBondContact O-N 3.41Å
662	C	83.2	Confident	82.2	Confident	11 Å²	11	21.6 Å²	21.6	7%	0.074	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-46	-179.4	-65.1	0	0	0	0	112	G658 Q659 I660 S666 F939	G658-C662 PolarHBondContact O-N 2.95Å; G658-C662 PolarHBondContact O-SG 3Å; Q659-C662 WeakPolarHBondContact O-CB 3.4Å; Q659-C662 PolarHBondContact O-N 2.77Å; I660-C662 PolarHBondContact O-N 3.27Å; C662-S666 WeakPolarHBondContact O-CB 3.45Å; C662-S666 PolarHBondContact O-N 3.41Å; C662-S666 PolarHBondContact O-OG 3.06Å; C662-F939 HydrophobicContact CB-CD2 3.45Å; C662-F939 VanDerWaalsContact CB-CD2 3.45Å; C662-F939 HydrophobicContact CB-CE1 4.4Å; C662-F939 HydrophobicContact CB-CE2 3.19Å; C662-F939 HydrophobicContact CB-CG 4.17Å; C662-F939 HydrophobicContact CB-CZ 3.72Å; C662-F939 WeakPolarHBondContact O-CZ 3.4Å; C662-F939 WeakPolarHBondContact SG-CD2 3.33Å; C662-F939 WeakPolarHBondContact SG-CE2 3.16Å
663	Y	87.2	Confident	83.5	Confident	11 Å²	11	18 Å²	18	4%	0.043	10%	0.095	C	C	.	.	H	α-helix	trans	-67.8	-40.1	179.1	-88.2	-90.7	0	0	0	112.5	P604 D605 M608 Q659 I660 Y661 S666 G667 Y942 F943	P604-Y663 HydrophobicContact CB-CD1 4.35Å; P604-Y663 HydrophobicContact CB-CD2 3.45Å; P604-Y663 VanDerWaalsContact CB-CD2 3.45Å; P604-Y663 HydrophobicContact CB-CE2 3.84Å; P604-Y663 HydrophobicContact CB-CG 3.73Å; P604-Y663 WeakPolarHBondContact O-CB 3.33Å; P604-Y663 WeakPolarHBondContact O-CD1 3.23Å; D605-Y663 HydrophobicContact CB-CE1 4.2Å; M608-Y663 WeakPolarHBondContact CA-O 3.37Å; M608-Y663 HydrophobicContact CB-CD1 3.92Å; M608-Y663 VanDerWaalsContact CB-O 3.24Å; M608-Y663 WeakPolarHBondContact CB-O 3.45Å; M608-Y663 HydrophobicContact CE-CD1 3.85Å; M608-Y663 HydrophobicContact CE-CE1 4.05Å; M608-Y663 WeakPolarHBondContact CG-O 3.41Å; M608-Y663 HydrophobicContact SD-CD1 4.01Å; Q659-Y663 VanDerWaalsContact O-CD2 3.29Å; Q659-Y663 WeakPolarHBondContact O-CD2 3.46Å; Q659-Y663 PolarHBondContact O-N 3.02Å; I660-Y663 PolarHBondContact O-N 3.03Å; Y661-Y663 PolarHBondContact O-N 3.23Å; Y663-S666 WeakPolarHBondContact O-CB 3.34Å; Y663-S666 PolarHBondContact O-N 3.1Å; Y663-G667 PolarHBondContact O-N 3.31Å; Y663-Y942 PolarHBondContact OH-O 3.23Å; Y663-F943 HydrophobicContact CD1-CZ 4.4Å; Y663-F943 HydrophobicContact CE1-CE2 4.46Å; Y663-F943 HydrophobicContact CE1-CZ 4.15Å
664	A	88.5	Confident	84.4	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-65.1	-45.2	177.3	0	0	0	0	0	112	L592 V611 L633 I660 Y661 S666 G667 A668	L592-A664 HydrophobicContact CD1-CB 3.87Å; V611-A664 HydrophobicContact CG2-CB 4.1Å; L633-A664 HydrophobicContact CD2-CB 3.5Å; L633-A664 VanDerWaalsContact CD2-CB 3.5Å; I660-A664 WeakPolarHBondContact O-CB 3.29Å; I660-A664 PolarHBondContact O-N 3.48Å; Y661-A664 PolarHBondContact O-N 3.18Å; A664-S666 VanDerWaalsContact C-N 3.29Å; A664-S666 PolarHBondContact O-N 3.1Å; A664-G667 PolarHBondContact O-N 2.85Å; A664-A668 PolarHBondContact O-N 3.15Å
665	V	86.7	Confident	85.1	Confident	3 Å²	3	14.2 Å²	14.2	2%	0.018	7%	0.069	C	C	.	.	H	α-helix	trans	-61.4	-40.4	173.9	171.3	0	0	0	0	110.8	I629 L633 Y661 G667 A668 A669 L691	I629-V665 HydrophobicContact CG2-CG1 4.22Å; I629-V665 HydrophobicContact CG2-CG2 4.23Å; L633-V665 HydrophobicContact CD1-CG2 3.88Å; Y661-V665 HydrophobicContact CD1-CG2 4.5Å; Y661-V665 HydrophobicContact CD2-CG2 4.39Å; Y661-V665 HydrophobicContact CE1-CG2 4.15Å; Y661-V665 HydrophobicContact CE2-CG2 4.04Å; Y661-V665 WeakPolarHBondContact O-CB 3.42Å; Y661-V665 WeakPolarHBondContact O-CG2 3.27Å; Y661-V665 PolarHBondContact O-N 3.41Å; V665-G667 VanDerWaalsContact C-N 3.35Å; V665-G667 PolarHBondContact O-N 3.41Å; V665-A668 PolarHBondContact O-N 3.17Å; V665-A669 WeakPolarHBondContact O-CB 3.07Å; V665-A669 PolarHBondContact O-N 3.19Å; V665-L691 HydrophobicContact CG1-CD1 3.98Å; V665-L691 HydrophobicContact CG1-CD2 3.66Å; V665-L691 HydrophobicContact CG1-CG 4.49Å
666	S	83.8	Confident	85.3	Confident	4 Å²	4	8.9 Å²	8.9	3%	0.028	4%	0.044	C	C	.	.	H	α-helix	trans	-62.4	-40.5	175.3	-58.1	0	0	0	0	112.3	C662 Y663 A664 A669 F670 F939	C662-S666 WeakPolarHBondContact O-CB 3.45Å; C662-S666 PolarHBondContact O-N 3.41Å; C662-S666 PolarHBondContact O-OG 3.06Å; Y663-S666 WeakPolarHBondContact O-CB 3.34Å; Y663-S666 PolarHBondContact O-N 3.1Å; A664-S666 VanDerWaalsContact C-N 3.29Å; A664-S666 PolarHBondContact O-N 3.1Å; S666-A669 PolarHBondContact O-N 2.94Å; S666-F670 WeakPolarHBondContact O-CB 3.35Å; S666-F670 PolarHBondContact O-N 3.32Å; S666-F939 WeakPolarHBondContact OG-CE1 3.22Å; S666-F939 WeakPolarHBondContact OG-CZ 3.25Å
667	G	87.3	Confident	85	Confident	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-64.3	-41.3	176.4	0	0	0	0	0	112.6	Y663 A664 V665 F670 A671	Y663-G667 PolarHBondContact O-N 3.31Å; A664-G667 PolarHBondContact O-N 2.85Å; V665-G667 VanDerWaalsContact C-N 3.35Å; V665-G667 PolarHBondContact O-N 3.41Å; G667-F670 PolarHBondContact O-N 3.33Å; G667-A671 PolarHBondContact O-N 3.14Å
668	A	88.6	Confident	84.5	Confident	1 Å²	1	7.4 Å²	7.4	1%	0.008	4%	0.035	C	C	.	.	H	α-helix	trans	-65.8	-44.1	174.2	0	0	0	0	0	111.8	V611 W628 I629 L632 A664 V665 F670 A671 M672	V611-A668 HydrophobicContact CG1-CB 3.91Å; W628-A668 HydrophobicContact CH2-CB 4.35Å; W628-A668 HydrophobicContact CZ3-CB 3.98Å; W628-A668 WeakPolarHBondContact CZ3-O 3.4Å; I629-A668 HydrophobicContact CB-CB 4.45Å; I629-A668 HydrophobicContact CG1-CB 4.18Å; I629-A668 HydrophobicContact CG2-CB 3.96Å; L632-A668 HydrophobicContact CD1-CB 3.87Å; A664-A668 PolarHBondContact O-N 3.15Å; V665-A668 PolarHBondContact O-N 3.17Å; A668-F670 VanDerWaalsContact C-N 3.31Å; A668-F670 PolarHBondContact O-N 3.15Å; A668-A671 PolarHBondContact O-N 3.33Å; A668-M672 WeakPolarHBondContact O-CB 3.18Å; A668-M672 PolarHBondContact O-N 2.95Å
669	A	85	Confident	84.1	Confident	1 Å²	1	10.4 Å²	10.4	1%	0.008	5%	0.053	C	C	.	.	H	α-helix	trans	-61	-40	175.8	0	0	0	0	0	112	V665 S666 M672 A673 L688 L691 F694	V665-A669 WeakPolarHBondContact O-CB 3.07Å; V665-A669 PolarHBondContact O-N 3.19Å; S666-A669 PolarHBondContact O-N 2.94Å; A669-M672 PolarHBondContact O-N 3.33Å; A669-A673 VanDerWaalsContact O-CB 3.32Å; A669-A673 WeakPolarHBondContact O-CB 3.29Å; A669-A673 PolarHBondContact O-N 3Å; A669-L688 HydrophobicContact CB-CD2 3.71Å; A669-L691 HydrophobicContact CB-CD1 3.82Å; A669-F694 HydrophobicContact CB-CD2 4.06Å; A669-F694 HydrophobicContact CB-CE2 4.28Å
670	F	86.7	Confident	83.3	Confident	2 Å²	2	11.1 Å²	11.1	1%	0.009	7%	0.067	C	C	.	.	H	α-helix	trans	-65.9	-43.8	175.7	-171.1	-173.8	0	0	0	111.4	L612 S666 G667 A668 M672 A673 L674 F694 L761	L612-F670 HydrophobicContact CD1-CB 4.32Å; L612-F670 HydrophobicContact CD1-CD1 4.18Å; L612-F670 HydrophobicContact CD1-CG 4.16Å; L612-F670 HydrophobicContact CD2-CD1 3.77Å; L612-F670 HydrophobicContact CD2-CE1 3.86Å; S666-F670 WeakPolarHBondContact O-CB 3.35Å; S666-F670 PolarHBondContact O-N 3.32Å; G667-F670 PolarHBondContact O-N 3.33Å; A668-F670 VanDerWaalsContact C-N 3.31Å; A668-F670 PolarHBondContact O-N 3.15Å; F670-M672 PolarHBondContact O-N 3.24Å; F670-A673 WeakPolarHBondContact O-CA 3.29Å; F670-A673 WeakPolarHBondContact O-CB 3.19Å; F670-A673 PolarHBondContact O-N 3.12Å; F670-A673 VanDerWaalsContact O-N 3.08Å; F670-L674 HydrophobicContact CD2-CD1 4.07Å; F670-L674 HydrophobicContact CD2-CG 3.91Å; F670-L674 HydrophobicContact CE2-CD1 3.78Å; F670-L674 HydrophobicContact CE2-CD2 3.87Å; F670-L674 HydrophobicContact CE2-CG 3.7Å; F670-L674 HydrophobicContact CZ-CD1 4.34Å; F670-L674 PolarHBondContact O-N 3Å; F670-F694 HydrophobicContact CB-CE1 3.76Å; F670-F694 HydrophobicContact CB-CZ 3.83Å; F670-F694 HydrophobicContact CD1-CE1 4.45Å; F670-F694 HydrophobicContact CD2-CE1 4.04Å; F670-F694 AromaticContact CG-CE1 3.85Å; F670-F694 HydrophobicContact CG-CE1 3.85Å; F670-F694 HydrophobicContact CG-CZ 4.27Å; F670-L761 HydrophobicContact CE2-CB 4.27Å; F670-L761 HydrophobicContact CZ-CB 3.84Å
671	A	88.8	Confident	82.5	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.3	-44	175.3	0	0	0	0	0	112.5	L612 W628 G667 A668 A673 L674 R675	L612-A671 HydrophobicContact CD1-CB 3.91Å; W628-A671 HydrophobicContact CH2-CB 4.28Å; G667-A671 PolarHBondContact O-N 3.14Å; A668-A671 PolarHBondContact O-N 3.33Å; A671-A673 PolarHBondContact O-N 3.44Å; A671-L674 PolarHBondContact O-N 2.86Å; A671-R675 PolarHBondContact O-N 3.06Å
672	M	86.4	Confident	81.8	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-57.8	-41.7	172.1	-173.2	-173.9	-68.4	0	0	110.6	I622 G623 W628 I629 A668 A669 F670 R675 F676 V684 T687 L688	I622-M672 HydrophobicContact CG2-CB 4.43Å; G623-M672 WeakPolarHBondContact O-CE 3.22Å; W628-M672 HydrophobicContact CE3-CE 3.65Å; W628-M672 HydrophobicContact CZ3-CB 4.15Å; W628-M672 HydrophobicContact CZ3-CE 3.96Å; I629-M672 HydrophobicContact CD1-CE 3.81Å; I629-M672 HydrophobicContact CG1-CE 3.83Å; A668-M672 WeakPolarHBondContact O-CB 3.18Å; A668-M672 PolarHBondContact O-N 2.95Å; A669-M672 PolarHBondContact O-N 3.33Å; F670-M672 PolarHBondContact O-N 3.24Å; M672-R675 PolarHBondContact O-N 3.02Å; M672-F676 HydrophobicContact CG-CD2 3.72Å; M672-F676 HydrophobicContact CG-CE2 3.87Å; M672-F676 WeakPolarHBondContact O-CD2 3.47Å; M672-F676 PolarHBondContact O-N 2.95Å; M672-V684 HydrophobicContact CG-CG1 3.99Å; M672-V684 HydrophobicContact SD-CG1 3.99Å; M672-T687 HydrophobicContact CE-CG2 4.17Å; M672-T687 HydrophobicContact SD-CG2 4.13Å; M672-L688 HydrophobicContact SD-CD2 4.29Å; M672-L688 HydrophobicContact SD-CG 4.43Å
673	A	83.2	Confident	81.4	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.3	-39.3	-179.8	0	0	0	0	0	113.8	A669 F670 A671 V677 L688 Q696 V697	A669-A673 VanDerWaalsContact O-CB 3.32Å; A669-A673 WeakPolarHBondContact O-CB 3.29Å; A669-A673 PolarHBondContact O-N 3Å; F670-A673 WeakPolarHBondContact O-CA 3.29Å; F670-A673 WeakPolarHBondContact O-CB 3.19Å; F670-A673 PolarHBondContact O-N 3.12Å; F670-A673 VanDerWaalsContact O-N 3.08Å; A671-A673 PolarHBondContact O-N 3.44Å; A673-V677 WeakPolarHBondContact O-CA 3.23Å; A673-V677 WeakPolarHBondContact O-CB 3.42Å; A673-V677 PolarHBondContact O-N 2.61Å; A673-V677 VanDerWaalsContact O-N 3.1Å; A673-L688 HydrophobicContact CB-CD1 4.25Å; A673-Q696 HydrophobicContact CB-CB 4.11Å; A673-V697 HydrophobicContact CB-CG2 3.57Å
674	L	85.9	Confident	80.9	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-66.7	-37.9	173.6	-69.9	172.9	0	0	0	111.8	L612 L616 W619 F670 A671 V677 L757 I758	L612-L674 HydrophobicContact CD1-CD1 4.07Å; L616-L674 HydrophobicContact CD2-CD1 4.12Å; W619-L674 HydrophobicContact CH2-CB 4.2Å; W619-L674 HydrophobicContact CZ3-CB 4.3Å; F670-L674 HydrophobicContact CD2-CD1 4.07Å; F670-L674 HydrophobicContact CD2-CG 3.91Å; F670-L674 HydrophobicContact CE2-CD1 3.78Å; F670-L674 HydrophobicContact CE2-CD2 3.87Å; F670-L674 HydrophobicContact CE2-CG 3.7Å; F670-L674 HydrophobicContact CZ-CD1 4.34Å; F670-L674 PolarHBondContact O-N 3Å; A671-L674 PolarHBondContact O-N 2.86Å; L674-V677 WeakPolarHBondContact O-CG1 3.3Å; L674-L757 HydrophobicContact CD2-CB 3.93Å; L674-L757 HydrophobicContact CD2-CD1 4.19Å; L674-I758 HydrophobicContact CD1-CD1 4.39Å; L674-I758 HydrophobicContact CD1-CG1 3.84Å
675	R	85.6	Confident	80	Confident	43 Å²	43	17.2 Å²	17.2	16%	0.162	11%	0.106	C	C	.	.	H	α-helix	trans	-67.6	-40.7	-179	175.2	61.6	-176.3	82.8	0.6	113.5	W619 I622 A671 M672	W619-R675 HydrophobicContact CH2-CB 4.15Å; W619-R675 HydrophobicContact CZ2-CB 4.17Å; W619-R675 HydrophobicContact CZ2-CG 4.47Å; W619-R675 VanDerWaalsContact NE1-CD 3.33Å; I622-R675 HydrophobicContact CB-CB 4.34Å; I622-R675 HydrophobicContact CB-CG 4.04Å; I622-R675 HydrophobicContact CD1-CB 3.88Å; I622-R675 HydrophobicContact CD1-CG 4.24Å; I622-R675 HydrophobicContact CG2-CB 3.91Å; I622-R675 HydrophobicContact CG2-CG 3.96Å; A671-R675 PolarHBondContact O-N 3.06Å; M672-R675 PolarHBondContact O-N 3.02Å
676	F	80.9	Confident	79.4	Confident	8 Å²	8	24.6 Å²	24.6	4%	0.035	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	25.4	-177.3	-57	-70.8	0	0	0	111.8	I622 M672 S678 T679 V684 F816	I622-F676 HydrophobicContact CG2-CE2 4.05Å; M672-F676 HydrophobicContact CG-CD2 3.72Å; M672-F676 HydrophobicContact CG-CE2 3.87Å; M672-F676 WeakPolarHBondContact O-CD2 3.47Å; M672-F676 PolarHBondContact O-N 2.95Å; F676-S678 PolarHBondContact O-N 3.09Å; F676-T679 HydrophobicContact CB-CG2 4.48Å; F676-T679 PolarHBondContact O-N 3.13Å; F676-T679 PolarHBondContact O-OG1 3.45Å; F676-V684 HydrophobicContact CB-CG1 4.27Å; F676-V684 HydrophobicContact CB-CG2 4.09Å; F676-V684 HydrophobicContact CD1-CG2 4.32Å; F676-V684 HydrophobicContact CD2-CG1 4.19Å; F676-V684 HydrophobicContact CD2-CG2 3.51Å; F676-V684 HydrophobicContact CE2-CG2 3.98Å; F676-V684 HydrophobicContact CG-CG2 3.72Å; F676-F816 AromaticContact CD1-CE1 3.48Å; F676-F816 HydrophobicContact CD1-CE1 3.48Å; F676-F816 VanDerWaalsContact CD1-CE1 3.48Å; F676-F816 AromaticContact CD1-CZ 3.4Å; F676-F816 HydrophobicContact CD1-CZ 3.4Å; F676-F816 VanDerWaalsContact CD1-CZ 3.4Å; F676-F816 AromaticContact CE1-CE1 3.22Å; F676-F816 HydrophobicContact CE1-CE1 3.22Å; F676-F816 AromaticContact CE1-CZ 3.24Å; F676-F816 HydrophobicContact CE1-CZ 3.24Å; F676-F816 HydrophobicContact CZ-CE1 4.42Å
677	V	76.8	Confident	78.8	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.024	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	131.2	179.2	71.4	0	0	0	0	109.9	A673 L674 T679 A699 F747 V749	A673-V677 WeakPolarHBondContact O-CA 3.23Å; A673-V677 WeakPolarHBondContact O-CB 3.42Å; A673-V677 PolarHBondContact O-N 2.61Å; A673-V677 VanDerWaalsContact O-N 3.1Å; L674-V677 WeakPolarHBondContact O-CG1 3.3Å; V677-T679 PolarHBondContact O-N 3.33Å; V677-A699 HydrophobicContact CG2-CB 4.5Å; V677-F747 HydrophobicContact CG1-CB 4.21Å; V677-F747 HydrophobicContact CG2-CB 3.72Å; V677-F747 HydrophobicContact CG2-CD2 3.57Å; V677-F747 HydrophobicContact CG2-CG 4.09Å; V677-V749 HydrophobicContact CG1-CG2 3.55Å
678	S	71.6	Confident	78.1	Confident	7 Å²	7	25.7 Å²	25.7	5%	0.049	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	13.4	179.3	-61.9	0	0	0	0	116.1	F676 V697 A699 A746 F747	F676-S678 PolarHBondContact O-N 3.09Å; S678-V697 PolarHBondContact N-O 3.05Å; S678-A699 PolarHBondContact OG-O 3.4Å; S678-A746 VanDerWaalsContact OG-CB 3.31Å; S678-A746 WeakPolarHBondContact OG-CB 3.19Å; S678-F747 PolarHBondContact OG-N 2.92Å; S678-F747 VanDerWaalsContact OG-N 3.11Å
679	T	71.4	Confident	76.7	Confident	65 Å²	65	28.9 Å²	28.9	40%	0.399	17%	0.167	S	C	.	.	S	Bend	trans	-82.3	-21	175.9	65.2	0	0	0	0	113	F676 V677 C681	F676-T679 HydrophobicContact CB-CG2 4.48Å; F676-T679 PolarHBondContact O-N 3.13Å; F676-T679 PolarHBondContact O-OG1 3.45Å; V677-T679 PolarHBondContact O-N 3.33Å; T679-C681 PolarHBondContact O-N 3.31Å; T679-C681 PolarHBondContact OG1-N 3.2Å
680	G	67.4	Low	75	Confident	41 Å²	41	32.4 Å²	32.4	42%	0.423	19%	0.188	S	C	.	.			trans	67.8	15.9	-177.9	0	0	0	0	0	114.7	A682	G680-A682 PolarHBondContact O-N 2.92Å; G680-A682 VanDerWaalsContact O-N 3.17Å
681	C	70.8	Confident	73.4	Confident	15 Å²	15	33.7 Å²	33.7	10%	0.101	20%	0.195	C	C	.	.			trans	-59.7	117.4	-178.2	178.4	0	0	0	0	112	T679 R683 V684 I685 D820	T679-C681 PolarHBondContact O-N 3.31Å; T679-C681 PolarHBondContact OG1-N 3.2Å; C681-R683 VanDerWaalsContact C-N 3.32Å; C681-R683 PolarHBondContact O-N 3.46Å; C681-V684 HydrophobicContact CB-CB 4.27Å; C681-V684 HydrophobicContact CB-CG2 3.99Å; C681-V684 PolarHBondContact O-N 3.42Å; C681-I685 WeakPolarHBondContact O-CG1 3.42Å; C681-I685 PolarHBondContact O-N 3.17Å; C681-D820 PolarHBondContact SG-OD2 3.2Å
682	A	71.1	Confident	71.5	Confident	68 Å²	68	35.9 Å²	35.9	56%	0.562	21%	0.21	S	C	*	.	H	α-helix	trans	-62.2	-35.8	-177.2	0	0	0	0	0	112.9	G680 I685 K686	G680-A682 PolarHBondContact O-N 2.92Å; G680-A682 VanDerWaalsContact O-N 3.17Å; A682-I685 PolarHBondContact O-N 3.16Å; A682-K686 WeakPolarHBondContact O-CB 3.46Å; A682-K686 PolarHBondContact O-N 3.01Å
683	R	75.1	Confident	69.9	Low	77 Å²	77	38.8 Å²	38.8	29%	0.291	23%	0.23	S	C	.	.	H	α-helix	trans	-60.3	-46.9	175.6	-75.1	-167	-76.9	-177.1	-16	111.6	C681 K686 T687 D820	C681-R683 VanDerWaalsContact C-N 3.32Å; C681-R683 PolarHBondContact O-N 3.46Å; R683-K686 PolarHBondContact O-N 2.97Å; R683-T687 PolarHBondContact O-N 3.33Å; R683-T687 PolarHBondContact O-OG1 3.29Å; R683-T687 VanDerWaalsContact O-OG1 3.05Å; R683-D820 IonicContact CZ-OD1 3.34Å; R683-D820 IonicContact CZ-OD2 3.71Å; R683-D820 IonicContact NE-OD1 3.6Å; R683-D820 PolarHBondContact NE-OD1 2.91Å; R683-D820 IonicContact NE-OD2 3.96Å; R683-D820 PolarHBondContact NE-OD2 3.44Å; R683-D820 IonicContact NH2-OD1 3.28Å; R683-D820 PolarHBondContact NH2-OD1 3.28Å; R683-D820 IonicContact NH2-OD2 3.04Å; R683-D820 PolarHBondContact NH2-OD2 2.92Å
684	V	76.1	Confident	68.5	Low	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-43.9	179.1	-179.9	0	0	0	0	110.6	M672 F676 C681 K686 T687 L688 V697	M672-V684 HydrophobicContact CG-CG1 3.99Å; M672-V684 HydrophobicContact SD-CG1 3.99Å; F676-V684 HydrophobicContact CB-CG1 4.27Å; F676-V684 HydrophobicContact CB-CG2 4.09Å; F676-V684 HydrophobicContact CD1-CG2 4.32Å; F676-V684 HydrophobicContact CD2-CG1 4.19Å; F676-V684 HydrophobicContact CD2-CG2 3.51Å; F676-V684 HydrophobicContact CE2-CG2 3.98Å; F676-V684 HydrophobicContact CG-CG2 3.72Å; C681-V684 HydrophobicContact CB-CB 4.27Å; C681-V684 HydrophobicContact CB-CG2 3.99Å; C681-V684 PolarHBondContact O-N 3.42Å; V684-K686 VanDerWaalsContact C-N 3.27Å; V684-K686 PolarHBondContact O-N 3.21Å; V684-T687 PolarHBondContact O-N 3.09Å; V684-L688 HydrophobicContact CG1-CD1 3.75Å; V684-L688 HydrophobicContact CG1-CG 4.11Å; V684-L688 WeakPolarHBondContact O-CB 3.43Å; V684-L688 WeakPolarHBondContact O-CG 3.44Å; V684-L688 PolarHBondContact O-N 2.88Å; V684-V697 HydrophobicContact CB-CG1 4.33Å; V684-V697 HydrophobicContact CG1-CB 4.41Å; V684-V697 HydrophobicContact CG1-CG1 3.81Å; V684-V697 HydrophobicContact CG1-CG2 3.84Å
685	I	71.5	Confident	66.9	Low	21 Å²	21	41 Å²	41	11%	0.108	24%	0.241	C	C	.	.	H	α-helix	trans	-58.8	-42.2	176.1	-65.1	168.7	0	0	0	110.3	C681 A682 L688 S689 V697 T698	C681-I685 WeakPolarHBondContact O-CG1 3.42Å; C681-I685 PolarHBondContact O-N 3.17Å; A682-I685 PolarHBondContact O-N 3.16Å; I685-L688 PolarHBondContact O-N 3.32Å; I685-S689 WeakPolarHBondContact O-CB 3.44Å; I685-S689 PolarHBondContact O-N 3.28Å; I685-S689 PolarHBondContact O-OG 3.13Å; I685-V697 HydrophobicContact CG1-CG1 4.17Å; I685-T698 HydrophobicContact CD1-CG2 3.64Å; I685-T698 HydrophobicContact CG1-CG2 3.77Å
686	K	73.5	Confident	65.4	Low	158 Å²	158	39.8 Å²	39.8	69%	0.687	24%	0.237	S	C	*	.	H	α-helix	trans	-66.5	-41	176.2	-173.3	178.1	-179.7	178.6	0	112.7	A682 R683 V684 S689 V690	A682-K686 WeakPolarHBondContact O-CB 3.46Å; A682-K686 PolarHBondContact O-N 3.01Å; R683-K686 PolarHBondContact O-N 2.97Å; V684-K686 VanDerWaalsContact C-N 3.27Å; V684-K686 PolarHBondContact O-N 3.21Å; K686-S689 PolarHBondContact O-OG 2.95Å; K686-V690 WeakPolarHBondContact O-CG2 3.5Å
687	T	71.1	Confident	64	Low	20 Å²	20	39.5 Å²	39.5	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-41.8	176.7	-59.7	0	0	0	0	111.1	S624 I629 M672 R683 V684	S624-T687 PolarHBondContact O-OG1 3.27Å; I629-T687 HydrophobicContact CD1-CG2 4.23Å; M672-T687 HydrophobicContact CE-CG2 4.17Å; M672-T687 HydrophobicContact SD-CG2 4.13Å; R683-T687 PolarHBondContact O-N 3.33Å; R683-T687 PolarHBondContact O-OG1 3.29Å; R683-T687 VanDerWaalsContact O-OG1 3.05Å; V684-T687 PolarHBondContact O-N 3.09Å
688	L	71.7	Confident	62.8	Low	6 Å²	6	39.4 Å²	39.4	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-79.8	-29.2	-178.8	-67.3	-178.4	0	0	0	113.7	A669 M672 A673 V684 I685 V690 L691 S692 F694 V697	A669-L688 HydrophobicContact CB-CD2 3.71Å; M672-L688 HydrophobicContact SD-CD2 4.29Å; M672-L688 HydrophobicContact SD-CG 4.43Å; A673-L688 HydrophobicContact CB-CD1 4.25Å; V684-L688 HydrophobicContact CG1-CD1 3.75Å; V684-L688 HydrophobicContact CG1-CG 4.11Å; V684-L688 WeakPolarHBondContact O-CB 3.43Å; V684-L688 WeakPolarHBondContact O-CG 3.44Å; V684-L688 PolarHBondContact O-N 2.88Å; I685-L688 PolarHBondContact O-N 3.32Å; L688-V690 PolarHBondContact O-N 3.15Å; L688-L691 HydrophobicContact CD2-CD1 4.44Å; L688-L691 CarbonylContact O-C 3.51Å; L688-L691 WeakPolarHBondContact O-CA 3.46Å; L688-L691 PolarHBondContact O-N 3.49Å; L688-S692 PolarHBondContact O-N 2.85Å; L688-F694 HydrophobicContact CD1-CB 4.42Å; L688-V697 HydrophobicContact CD1-CB 3.95Å; L688-V697 HydrophobicContact CD1-CG2 3.19Å
689	S	60.1	Low	62.1	Low	69 Å²	69	39.1 Å²	39.1	48%	0.483	23%	0.234	S	C	.	.	H	α-helix	trans	-62.3	-33.1	175.8	68.1	0	0	0	0	111.2	I685 K686 L691 S692	I685-S689 WeakPolarHBondContact O-CB 3.44Å; I685-S689 PolarHBondContact O-N 3.28Å; I685-S689 PolarHBondContact O-OG 3.13Å; K686-S689 PolarHBondContact O-OG 2.95Å; S689-L691 VanDerWaalsContact C-N 3.27Å; S689-L691 PolarHBondContact O-N 3.14Å; S689-S692 PolarHBondContact O-N 3.34Å
690	V	49.7	Very low	61.2	Low	74 Å²	74	36 Å²	36	45%	0.448	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-35.3	171.2	177.4	0	0	0	0	111.4	K686 L688 S692	K686-V690 WeakPolarHBondContact O-CG2 3.5Å; L688-V690 PolarHBondContact O-N 3.15Å; V690-S692 VanDerWaalsContact C-N 3.32Å; V690-S692 PolarHBondContact O-N 3.49Å
691	L	53.2	Low	60.8	Low	30 Å²	30	35.4 Å²	35.4	16%	0.157	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	4.5	-178.2	-60.6	176.2	0	0	0	114	I629 V665 A669 L688 S689 S693	I629-L691 HydrophobicContact CD1-CD1 3.87Å; V665-L691 HydrophobicContact CG1-CD1 3.98Å; V665-L691 HydrophobicContact CG1-CD2 3.66Å; V665-L691 HydrophobicContact CG1-CG 4.49Å; A669-L691 HydrophobicContact CB-CD1 3.82Å; L688-L691 HydrophobicContact CD2-CD1 4.44Å; L688-L691 CarbonylContact O-C 3.51Å; L688-L691 WeakPolarHBondContact O-CA 3.46Å; L688-L691 PolarHBondContact O-N 3.49Å; S689-L691 VanDerWaalsContact C-N 3.27Å; S689-L691 PolarHBondContact O-N 3.14Å; L691-S693 PolarHBondContact O-N 2.86Å; L691-S693 PolarHBondContact O-OG 2.97Å
692	S	49.4	Very low	60.2	Low	46 Å²	46	35 Å²	35	32%	0.322	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	7.8	163.5	-56.3	0	0	0	0	118.5	L688 S689 V690	L688-S692 PolarHBondContact O-N 2.85Å; S689-S692 PolarHBondContact O-N 3.34Å; V690-S692 VanDerWaalsContact C-N 3.32Å; V690-S692 PolarHBondContact O-N 3.49Å
693	S	51.9	Low	60	Low	60 Å²	60	34.6 Å²	34.6	42%	0.42	19%	0.188	S	C	.	.			trans	-139.4	-6.1	-167.1	-39.5	0	0	0	0	116.7	L691	L691-S693 PolarHBondContact O-N 2.86Å; L691-S693 PolarHBondContact O-OG 2.97Å
694	F	53.6	Low	59.6	Low	34 Å²	34	34.6 Å²	34.6	15%	0.149	20%	0.198	C	C	.	.			trans	-120.4	98.3	-175.1	-76.9	-83.6	0	0	0	112.4	A669 F670 L688 Q696	A669-F694 HydrophobicContact CB-CD2 4.06Å; A669-F694 HydrophobicContact CB-CE2 4.28Å; F670-F694 HydrophobicContact CB-CE1 3.76Å; F670-F694 HydrophobicContact CB-CZ 3.83Å; F670-F694 HydrophobicContact CD1-CE1 4.45Å; F670-F694 HydrophobicContact CD2-CE1 4.04Å; F670-F694 AromaticContact CG-CE1 3.85Å; F670-F694 HydrophobicContact CG-CE1 3.85Å; F670-F694 HydrophobicContact CG-CZ 4.27Å; L688-F694 HydrophobicContact CD1-CB 4.42Å; F694-Q696 VanDerWaalsContact C-N 3.29Å; F694-Q696 HydrophobicContact CD1-CG 4.26Å
695	T	51.9	Low	59.2	Low	15 Å²	15	39.4 Å²	39.4	9%	0.092	22%	0.224	C	C	.	.			trans	-86.2	-0.1	171.6	65.3	0	0	0	0	112.8	V697 T698 V706 A734	T695-V697 VanDerWaalsContact C-N 3.29Å; T695-V697 PolarHBondContact O-N 2.82Å; T695-T698 PolarHBondContact O-N 3.06Å; T695-T698 PolarHBondContact O-OG1 3.23Å; T695-T698 VanDerWaalsContact O-OG1 3.09Å; T695-V706 HydrophobicContact CG2-CG1 3.22Å; T695-A734 HydrophobicContact CG2-CB 3.59Å; T695-A734 WeakPolarHBondContact OG1-CA 3.44Å; T695-A734 WeakPolarHBondContact OG1-CB 3.47Å; T695-A734 PolarHBondContact OG1-O 2.82Å; T695-A734 VanDerWaalsContact OG1-O 3.1Å
696	Q	53.8	Low	58.9	Low	17 Å²	17	39.2 Å²	39.2	8%	0.079	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-65.2	-30.8	-174	-62.3	175.1	12.8	0	0	112.5	A673 F694 T698 A699 L737 L761	A673-Q696 HydrophobicContact CB-CB 4.11Å; F694-Q696 VanDerWaalsContact C-N 3.29Å; F694-Q696 HydrophobicContact CD1-CG 4.26Å; Q696-T698 VanDerWaalsContact C-N 3.26Å; Q696-T698 PolarHBondContact O-N 2.93Å; Q696-A699 PolarHBondContact O-N 2.69Å; Q696-L737 HydrophobicContact CG-CD1 4.37Å; Q696-L761 HydrophobicContact CG-CD1 4.07Å
697	V	52.7	Low	58.7	Low	2 Å²	2	33.1 Å²	33.1	1%	0.012	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-66.9	-27.7	179.9	173.3	0	0	0	0	113	A673 S678 V684 I685 L688 T695 A699	A673-V697 HydrophobicContact CB-CG2 3.57Å; S678-V697 PolarHBondContact N-O 3.05Å; V684-V697 HydrophobicContact CB-CG1 4.33Å; V684-V697 HydrophobicContact CG1-CB 4.41Å; V684-V697 HydrophobicContact CG1-CG1 3.81Å; V684-V697 HydrophobicContact CG1-CG2 3.84Å; I685-V697 HydrophobicContact CG1-CG1 4.17Å; L688-V697 HydrophobicContact CD1-CB 3.95Å; L688-V697 HydrophobicContact CD1-CG2 3.19Å; T695-V697 VanDerWaalsContact C-N 3.29Å; T695-V697 PolarHBondContact O-N 2.82Å; V697-A699 VanDerWaalsContact C-N 3.34Å
698	T	52.2	Low	58.7	Low	3 Å²	3	36 Å²	36	2%	0.018	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-101	28.7	-178.2	53	0	0	0	0	112	I685 T695 Q696 G700 S701 H703 V706	I685-T698 HydrophobicContact CD1-CG2 3.64Å; I685-T698 HydrophobicContact CG1-CG2 3.77Å; T695-T698 PolarHBondContact O-N 3.06Å; T695-T698 PolarHBondContact O-OG1 3.23Å; T695-T698 VanDerWaalsContact O-OG1 3.09Å; Q696-T698 VanDerWaalsContact C-N 3.26Å; Q696-T698 PolarHBondContact O-N 2.93Å; T698-G700 PolarHBondContact O-N 3.34Å; T698-G700 VanDerWaalsContact O-N 3.11Å; T698-S701 WeakPolarHBondContact CB-OG 3.17Å; T698-S701 PolarHBondContact O-N 3.47Å; T698-S701 PolarHBondContact O-OG 3.09Å; T698-H703 HydrophobicContact CG2-CB 4.02Å; T698-V706 HydrophobicContact CG2-CG2 3.93Å; T698-V706 WeakPolarHBondContact OG1-CG1 3.45Å; T698-V706 WeakPolarHBondContact OG1-CG2 3.24Å
699	A	55.1	Low	58.4	Low	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	119.4	177.6	0	0	0	0	0	111	V677 S678 Q696 V697 S701 L737 F747	V677-A699 HydrophobicContact CG2-CB 4.5Å; S678-A699 PolarHBondContact OG-O 3.4Å; Q696-A699 PolarHBondContact O-N 2.69Å; V697-A699 VanDerWaalsContact C-N 3.34Å; A699-S701 PolarHBondContact O-N 3.48Å; A699-L737 CarbonylContact C-O 3.59Å; A699-L737 VanDerWaalsContact CA-O 3.23Å; A699-L737 WeakPolarHBondContact CA-O 3.2Å; A699-F747 HydrophobicContact CB-CD2 3.35Å; A699-F747 HydrophobicContact CB-CE2 3.35Å
700	G	53.1	Low	58.8	Low	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	-1.5	-177.1	0	0	0	0	0	115.7	R217 T698 L737 A738 G743 F831	R217-G700 VanDerWaalsContact CZ-O 3.24Å; R217-G700 PolarHBondContact NH1-O 2.98Å; R217-G700 PolarHBondContact NH2-O 3.5Å; T698-G700 PolarHBondContact O-N 3.34Å; T698-G700 VanDerWaalsContact O-N 3.11Å; G700-L737 PolarHBondContact N-O 3.11Å; G700-A738 CarbonylContact C-O 3.27Å; G700-A738 VanDerWaalsContact C-O 3.27Å; G700-A738 VanDerWaalsContact CA-O 3.26Å; G700-A738 WeakPolarHBondContact CA-O 3.4Å; G700-A738 PolarHBondContact N-O 3.19Å; G700-G743 WeakPolarHBondContact O-CA 3.3Å; G700-F831 WeakPolarHBondContact O-CE2 3.5Å; G700-F831 WeakPolarHBondContact O-CZ 3.22Å
701	S	59.1	Low	59.8	Low	28 Å²	28	36.5 Å²	36.5	20%	0.196	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-28.1	-177.6	84.1	0	0	0	0	112.9	R217 T698 A699 H703 A738	R217-S701 VanDerWaalsContact NH2-C 3.34Å; R217-S701 PolarHBondContact NH2-O 3.2Å; T698-S701 WeakPolarHBondContact CB-OG 3.17Å; T698-S701 PolarHBondContact O-N 3.47Å; T698-S701 PolarHBondContact O-OG 3.09Å; A699-S701 PolarHBondContact O-N 3.48Å; S701-H703 VanDerWaalsContact C-N 3.35Å; S701-A738 PolarHBondContact N-O 2.88Å
702	G	58.4	Low	60.5	Low	6 Å²	6	36.8 Å²	36.8	6%	0.062	22%	0.219	C	C	.	.			trans	72.6	22.1	-179	0	0	0	0	0	114.7	A738	G702-A738 WeakPolarHBondContact CA-O 3.43Å; G702-A738 PolarHBondContact N-O 3.29Å
703	H	66.4	Low	61.3	Low	60 Å²	60	36.4 Å²	36.4	28%	0.278	21%	0.212	S	C	.	.			trans	-55.9	127.3	-173.5	-161.7	-78	0	0	0	112.1	T698 S701 D705 V706 L707	T698-H703 HydrophobicContact CG2-CB 4.02Å; S701-H703 VanDerWaalsContact C-N 3.35Å; H703-D705 IonicContact CE1-OD2 3.38Å; H703-D705 PolarHBondContact CE1-OD2 3.49Å; H703-D705 VanDerWaalsContact CE1-OD2 3.28Å; H703-D705 PolarHBondContact ND1-N 3.35Å; H703-D705 IonicContact ND1-OD2 3.74Å; H703-D705 PolarHBondContact O-N 3.1Å; H703-V706 HydrophobicContact CB-CB 4.42Å; H703-V706 HydrophobicContact CB-CG2 4.06Å; H703-V706 WeakPolarHBondContact O-CB 3.46Å; H703-V706 PolarHBondContact O-N 3.28Å; H703-V706 VanDerWaalsContact O-N 3.13Å; H703-L707 PolarHBondContact O-N 3.49Å
704	P	68	Low	62.1	Low	77 Å²	77	33.6 Å²	33.6	50%	0.5	19%	0.193	S	C	.	.	H	α-helix	trans	-61.7	-40.5	-171.5	23	-34	0	0	0	112.6	V706 L707 C708	P704-V706 PolarHBondContact O-N 3.32Å; P704-L707 PolarHBondContact O-N 3.04Å; P704-C708 WeakPolarHBondContact O-CB 3.31Å; P704-C708 PolarHBondContact O-N 3.08Å; P704-C708 PolarHBondContact O-SG 2.82Å
705	D	66.3	Low	62.8	Low	101 Å²	101	36.1 Å²	36.1	54%	0.54	21%	0.21	S	C	.	.	H	α-helix	trans	-58.3	-35.9	179	-63.6	-12.5	0	0	0	112.7	H703 A709	H703-D705 IonicContact CE1-OD2 3.38Å; H703-D705 PolarHBondContact CE1-OD2 3.49Å; H703-D705 VanDerWaalsContact CE1-OD2 3.28Å; H703-D705 PolarHBondContact ND1-N 3.35Å; H703-D705 IonicContact ND1-OD2 3.74Å; H703-D705 PolarHBondContact O-N 3.1Å; D705-A709 VanDerWaalsContact O-CB 3.28Å; D705-A709 WeakPolarHBondContact O-CB 3.39Å; D705-A709 PolarHBondContact O-N 3.49Å
706	V	66.1	Low	63.5	Low	18 Å²	18	44.6 Å²	44.6	11%	0.109	24%	0.241	C	C	.	.	H	α-helix	trans	-73.1	-43.3	-178.6	178.5	0	0	0	0	110.3	T695 T698 H703 P704 A709 A710 A738	T695-V706 HydrophobicContact CG2-CG1 3.22Å; T698-V706 HydrophobicContact CG2-CG2 3.93Å; T698-V706 WeakPolarHBondContact OG1-CG1 3.45Å; T698-V706 WeakPolarHBondContact OG1-CG2 3.24Å; H703-V706 HydrophobicContact CB-CB 4.42Å; H703-V706 HydrophobicContact CB-CG2 4.06Å; H703-V706 WeakPolarHBondContact O-CB 3.46Å; H703-V706 PolarHBondContact O-N 3.28Å; H703-V706 VanDerWaalsContact O-N 3.13Å; P704-V706 PolarHBondContact O-N 3.32Å; V706-A709 PolarHBondContact O-N 3.49Å; V706-A710 WeakPolarHBondContact O-CB 3.06Å; V706-A710 PolarHBondContact O-N 3.12Å; V706-A738 HydrophobicContact CG1-CB 4.42Å
707	L	70	Confident	63.9	Low	30 Å²	30	45 Å²	45	16%	0.157	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-43	174.6	-65.8	174.6	0	0	0	111.5	H703 P704 A710 R711 I735 A738 L739	H703-L707 PolarHBondContact O-N 3.49Å; P704-L707 PolarHBondContact O-N 3.04Å; L707-A710 PolarHBondContact O-N 3.13Å; L707-R711 WeakPolarHBondContact O-CB 3.37Å; L707-R711 PolarHBondContact O-N 3.32Å; L707-I735 HydrophobicContact CD2-CG2 3.88Å; L707-A738 HydrophobicContact CD2-CB 4.1Å; L707-L739 HydrophobicContact CD1-CD2 4.36Å; L707-L739 HydrophobicContact CD2-CD1 4.21Å; L707-L739 HydrophobicContact CD2-CD2 4.45Å; L707-L739 HydrophobicContact CD2-CG 4.12Å
708	C	70.9	Confident	64.2	Low	80 Å²	80	47.8 Å²	47.8	54%	0.541	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-44.3	176	-75.4	0	0	0	0	111.9	P704 R711 A712	P704-C708 WeakPolarHBondContact O-CB 3.31Å; P704-C708 PolarHBondContact O-N 3.08Å; P704-C708 PolarHBondContact O-SG 2.82Å; C708-R711 PolarHBondContact O-N 2.85Å; C708-A712 WeakPolarHBondContact O-CB 3.44Å; C708-A712 PolarHBondContact O-N 3.38Å
709	A	65.5	Low	64.2	Low	42 Å²	42	50.3 Å²	50.3	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-50.8	176.1	0	0	0	0	0	111.2	D705 V706 R711 A712 H713	D705-A709 VanDerWaalsContact O-CB 3.28Å; D705-A709 WeakPolarHBondContact O-CB 3.39Å; D705-A709 PolarHBondContact O-N 3.49Å; V706-A709 PolarHBondContact O-N 3.49Å; A709-R711 VanDerWaalsContact C-N 3.31Å; A709-R711 PolarHBondContact O-N 3.49Å; A709-A712 WeakPolarHBondContact O-CB 3.29Å; A709-A712 PolarHBondContact O-N 3.22Å; A709-A712 VanDerWaalsContact O-N 3.12Å; A709-H713 PolarHBondContact O-CD2 3.08Å; A709-H713 PolarHBondContact O-N 2.94Å
710	A	66.6	Low	64.4	Low	8 Å²	8	56.2 Å²	56.2	7%	0.066	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-38.7	179.5	0	0	0	0	0	112.2	V706 L707 H713 L714 I735	V706-A710 WeakPolarHBondContact O-CB 3.06Å; V706-A710 PolarHBondContact O-N 3.12Å; L707-A710 PolarHBondContact O-N 3.13Å; A710-H713 WeakPolarHBondContact O-CB 3.42Å; A710-H713 PolarHBondContact O-N 3.3Å; A710-L714 WeakPolarHBondContact O-CG 3.3Å; A710-L714 PolarHBondContact O-N 3.37Å; A710-I735 HydrophobicContact CB-CD1 3.98Å; A710-I735 HydrophobicContact CB-CG1 3.43Å; A710-I735 VanDerWaalsContact CB-CG1 3.43Å
711	R	70.9	Confident	64.5	Low	109 Å²	109	60.4 Å²	60.4	41%	0.411	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-45.6	172.1	179.3	-176.8	170.6	167.1	10.8	112	E226 F230 L707 C708 A709 H713 L714 V715	E226-R711 IonicContact OE1-CZ 2.84Å; E226-R711 IonicContact OE1-NE 3.71Å; E226-R711 IonicContact OE1-NH1 2.7Å; E226-R711 PolarHBondContact OE1-NH1 3.03Å; E226-R711 IonicContact OE1-NH2 3.71Å; E226-R711 PolarHBondContact OE1-NH2 2.94Å; E226-R711 IonicContact OE2-CZ 2.85Å; E226-R711 IonicContact OE2-NH1 2.68Å; E226-R711 PolarHBondContact OE2-NH1 3.43Å; E226-R711 VanDerWaalsContact OE2-NH1 3.08Å; F230-R711 HydrophobicContact CE2-CG 4.5Å; F230-R711 HydrophobicContact CZ-CG 4.04Å; L707-R711 WeakPolarHBondContact O-CB 3.37Å; L707-R711 PolarHBondContact O-N 3.32Å; C708-R711 PolarHBondContact O-N 2.85Å; A709-R711 VanDerWaalsContact C-N 3.31Å; A709-R711 PolarHBondContact O-N 3.49Å; R711-H713 PolarHBondContact O-N 3.47Å; R711-L714 PolarHBondContact O-N 2.83Å; R711-V715 WeakPolarHBondContact O-CG2 3.05Å; R711-V715 PolarHBondContact O-N 2.85Å
712	A	69.1	Low	64.2	Low	37 Å²	37	67.4 Å²	67.4	31%	0.306	37%	0.365	S	S	.	.	H	α-helix	trans	-59.7	-37.8	177.5	0	0	0	0	0	111.2	C708 A709 R716	C708-A712 WeakPolarHBondContact O-CB 3.44Å; C708-A712 PolarHBondContact O-N 3.38Å; A709-A712 WeakPolarHBondContact O-CB 3.29Å; A709-A712 PolarHBondContact O-N 3.22Å; A709-A712 VanDerWaalsContact O-N 3.12Å; A712-R716 WeakPolarHBondContact O-CB 3.35Å; A712-R716 WeakPolarHBondContact O-CG 3.43Å; A712-R716 PolarHBondContact O-N 3.4Å
713	H	66.7	Low	64.2	Low	37 Å²	37	68.6 Å²	68.6	17%	0.171	38%	0.378	C	S	.	.	H	α-helix	trans	-63.2	-53.9	171.9	-82.4	-109.9	0	0	0	111.6	A709 A710 R711 V715 R716 Y717	A709-H713 PolarHBondContact O-CD2 3.08Å; A709-H713 PolarHBondContact O-N 2.94Å; A710-H713 WeakPolarHBondContact O-CB 3.42Å; A710-H713 PolarHBondContact O-N 3.3Å; R711-H713 PolarHBondContact O-N 3.47Å; H713-V715 PolarHBondContact O-N 3.01Å; H713-V715 VanDerWaalsContact O-N 3.14Å; H713-R716 PolarHBondContact O-N 3.33Å; H713-Y717 HydrophobicContact CB-CD2 4.41Å; H713-Y717 HydrophobicContact CB-CE2 4.42Å; H713-Y717 AromaticContact ND1-CE2 3.62Å; H713-Y717 WeakPolarHBondContact O-CD2 3.47Å; H713-Y717 PolarHBondContact O-N 3.45Å
714	L	67.6	Low	64.3	Low	2 Å²	2	66.1 Å²	66.1	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-50.8	-42.9	178.2	-74.8	175	0	0	0	112.8	A710 R711 S718 I735	A710-L714 WeakPolarHBondContact O-CG 3.3Å; A710-L714 PolarHBondContact O-N 3.37Å; R711-L714 PolarHBondContact O-N 2.83Å; L714-S718 PolarHBondContact O-N 3.28Å; L714-I735 HydrophobicContact CD1-CD1 3.41Å; L714-I735 VanDerWaalsContact CD1-CD1 3.41Å; L714-I735 HydrophobicContact CG-CD1 4.38Å
715	V	68.9	Low	64.8	Low	86 Å²	86	62.5 Å²	62.5	52%	0.521	34%	0.344	S	S	.	.	H	α-helix	trans	-69.1	-47.2	179.3	175.7	0	0	0	0	111	R711 H713 Y717 S718	R711-V715 WeakPolarHBondContact O-CG2 3.05Å; R711-V715 PolarHBondContact O-N 2.85Å; H713-V715 PolarHBondContact O-N 3.01Å; H713-V715 VanDerWaalsContact O-N 3.14Å; V715-Y717 VanDerWaalsContact C-N 3.35Å; V715-Y717 PolarHBondContact O-N 3.38Å; V715-S718 WeakPolarHBondContact O-CB 3.45Å; V715-S718 PolarHBondContact O-N 3.49Å; V715-S718 PolarHBondContact O-OG 2.87Å
716	R	66.7	Low	65.5	Low	194 Å²	194	57.9 Å²	57.9	73%	0.732	32%	0.32	S	S	*	.	H	α-helix	trans	-61.9	-37.5	-178.1	-77.1	173.5	-177.3	-178.1	2.6	113.4	A712 H713	A712-R716 WeakPolarHBondContact O-CB 3.35Å; A712-R716 WeakPolarHBondContact O-CG 3.43Å; A712-R716 PolarHBondContact O-N 3.4Å; H713-R716 PolarHBondContact O-N 3.33Å
717	Y	61.2	Low	66	Low	25 Å²	25	57.8 Å²	57.8	10%	0.098	32%	0.32	C	S	.	.	H	α-helix	trans	-90.9	-2	-176.5	-69.4	-81.3	0	0	0	114.7	H713 V715 G719 R720 V940	H713-Y717 HydrophobicContact CB-CD2 4.41Å; H713-Y717 HydrophobicContact CB-CE2 4.42Å; H713-Y717 AromaticContact ND1-CE2 3.62Å; H713-Y717 WeakPolarHBondContact O-CD2 3.47Å; H713-Y717 PolarHBondContact O-N 3.45Å; V715-Y717 VanDerWaalsContact C-N 3.35Å; V715-Y717 PolarHBondContact O-N 3.38Å; Y717-G719 PolarHBondContact O-N 3.45Å; Y717-R720 PolarHBondContact O-N 3.31Å; Y717-V940 HydrophobicContact CE1-CG1 3.82Å; Y717-V940 WeakPolarHBondContact OH-CB 3.33Å; Y717-V940 WeakPolarHBondContact OH-CG1 3.4Å; Y717-V940 WeakPolarHBondContact OH-CG2 3.49Å
718	S	59.3	Low	66.5	Low	60 Å²	60	56.6 Å²	56.6	42%	0.42	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.3	-179.2	63	0	0	0	0	114.7	L714 V715	L714-S718 PolarHBondContact O-N 3.28Å; V715-S718 WeakPolarHBondContact O-CB 3.45Å; V715-S718 PolarHBondContact O-N 3.49Å; V715-S718 PolarHBondContact O-OG 2.87Å
719	G	52.6	Low	67.1	Low	56 Å²	56	52.9 Å²	52.9	58%	0.577	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-11.7	-178.5	0	0	0	0	0	117.1	Y717	Y717-G719 PolarHBondContact O-N 3.45Å
720	R	60	Low	68	Low	125 Å²	125	53 Å²	53	47%	0.472	29%	0.285	S	S	.	.			trans	-88.2	143.9	-177.4	-68.9	-171.3	179.4	171	1.7	111.2	Y717 A724	Y717-R720 PolarHBondContact O-N 3.31Å; R720-A724 WeakPolarHBondContact O-CB 3.2Å
721	T	54.1	Low	68.6	Low	88 Å²	88	53.1 Å²	53.1	54%	0.54	29%	0.286	S	S	.	.	S	Bend	trans	-94.7	-36.4	179.3	42.8	0	0	0	0	113	K262	K262-T721 HydrophobicContact CD-CG2 4.04Å; K262-T721 HydrophobicContact CG-CG2 4.18Å
722	E	52.6	Low	69.3	Low	174 Å²	174	48 Å²	48	81%	0.813	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	136.2	-179.2	-66.2	177.7	-179	0	0	110.7	A724	E722-A724 PolarHBondContact O-N 2.9Å; E722-A724 VanDerWaalsContact O-N 3.1Å
723	G	58.2	Low	70.1	Confident	32 Å²	32	46.5 Å²	46.5	33%	0.33	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	7.7	-174.6	0	0	0	0	0	114.1	F725 S727	G723-F725 PolarHBondContact O-N 2.86Å; G723-S727 WeakPolarHBondContact O-CB 3.34Å; G723-S727 PolarHBondContact O-N 3.17Å; G723-S727 VanDerWaalsContact O-N 3.11Å; G723-S727 PolarHBondContact O-OG 2.78Å
724	A	69.4	Low	70.8	Confident	7 Å²	7	45.2 Å²	45.2	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-40.7	-173.7	0	0	0	0	0	111.5	L265 R720 E722 S727 Q728	L265-A724 HydrophobicContact CD1-CB 4.36Å; R720-A724 WeakPolarHBondContact O-CB 3.2Å; E722-A724 PolarHBondContact O-N 2.9Å; E722-A724 VanDerWaalsContact O-N 3.1Å; A724-S727 PolarHBondContact O-OG 3.12Å; A724-S727 VanDerWaalsContact O-OG 3.08Å; A724-Q728 WeakPolarHBondContact O-CB 3.48Å; A724-Q728 WeakPolarHBondContact O-CG 3.24Å; A724-Q728 PolarHBondContact O-N 3.21Å; A724-Q728 VanDerWaalsContact O-N 3.16Å
725	F	78.8	Confident	71.4	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-51.2	-179.1	-178.9	-104.8	0	0	0	111.8	L268 A269 G723 S727 Q728 L729 P766 H769	L268-F725 HydrophobicContact CB-CE2 4.31Å; A269-F725 HydrophobicContact CB-CD2 4.21Å; A269-F725 HydrophobicContact CB-CE2 3.89Å; G723-F725 PolarHBondContact O-N 2.86Å; F725-S727 PolarHBondContact O-N 3.41Å; F725-Q728 PolarHBondContact O-N 2.92Å; F725-L729 HydrophobicContact CE1-CD2 4.25Å; F725-L729 HydrophobicContact CZ-CD1 4.42Å; F725-L729 WeakPolarHBondContact O-CB 3.45Å; F725-L729 PolarHBondContact O-N 3.26Å; F725-P766 HydrophobicContact CD1-CB 4.24Å; F725-P766 HydrophobicContact CD1-CG 3.78Å; F725-P766 HydrophobicContact CE1-CB 4.41Å; F725-P766 HydrophobicContact CE1-CG 3.71Å; F725-H769 HydrophobicContact CD1-CB 4.46Å; F725-H769 HydrophobicContact CD2-CB 4.35Å; F725-H769 HydrophobicContact CE1-CB 4.45Å; F725-H769 HydrophobicContact CE2-CB 4.34Å; F725-H769 HydrophobicContact CG-CB 4.4Å; F725-H769 HydrophobicContact CZ-CB 4.4Å
726	G	79.4	Confident	72.1	Confident	4 Å²	4	41.8 Å²	41.8	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-47.3	-179.7	0	0	0	0	0	113.2	Q728 L729 V730 P766	G726-Q728 VanDerWaalsContact C-N 3.34Å; G726-Q728 PolarHBondContact O-N 3.24Å; G726-L729 WeakPolarHBondContact O-CA 3.4Å; G726-L729 VanDerWaalsContact O-CB 3.31Å; G726-L729 WeakPolarHBondContact O-CB 3.23Å; G726-L729 PolarHBondContact O-N 3.1Å; G726-L729 VanDerWaalsContact O-N 3.12Å; G726-V730 WeakPolarHBondContact O-CG2 3.4Å; G726-V730 PolarHBondContact O-N 3.49Å; G726-P766 WeakPolarHBondContact CA-O 3.44Å; G726-P766 PolarHBondContact N-O 2.84Å
727	S	77.4	Confident	73	Confident	15 Å²	15	32.6 Å²	32.6	11%	0.105	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-39	177.9	54.9	0	0	0	0	113.1	G723 A724 F725 S731	G723-S727 WeakPolarHBondContact O-CB 3.34Å; G723-S727 PolarHBondContact O-N 3.17Å; G723-S727 VanDerWaalsContact O-N 3.11Å; G723-S727 PolarHBondContact O-OG 2.78Å; A724-S727 PolarHBondContact O-OG 3.12Å; A724-S727 VanDerWaalsContact O-OG 3.08Å; F725-S727 PolarHBondContact O-N 3.41Å; S727-S731 PolarHBondContact O-N 3.47Å; S727-S731 PolarHBondContact O-OG 3.1Å
728	Q	80.7	Confident	73.8	Confident	5 Å²	5	31.4 Å²	31.4	2%	0.023	19%	0.188	C	C	.	.	H	α-helix	trans	-69	-38.8	174.1	-61.5	-68.7	-31.9	0	0	110.7	R266 A269 A724 F725 G726 S731 H732	R266-Q728 HydrophobicContact CB-CG 4.15Å; R266-Q728 HydrophobicContact CG-CG 4.46Å; R266-Q728 VanDerWaalsContact CG-OE1 3.25Å; A269-Q728 HydrophobicContact CB-CB 4.15Å; A724-Q728 WeakPolarHBondContact O-CB 3.48Å; A724-Q728 WeakPolarHBondContact O-CG 3.24Å; A724-Q728 PolarHBondContact O-N 3.21Å; A724-Q728 VanDerWaalsContact O-N 3.16Å; F725-Q728 PolarHBondContact O-N 2.92Å; G726-Q728 VanDerWaalsContact C-N 3.34Å; G726-Q728 PolarHBondContact O-N 3.24Å; Q728-S731 PolarHBondContact O-N 3.19Å; Q728-H732 WeakPolarHBondContact O-CB 3.48Å; Q728-H732 PolarHBondContact O-CD2 3.19Å; Q728-H732 PolarHBondContact O-N 3.43Å
729	L	84.2	Confident	74.8	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-46.2	175.4	-164.3	67.3	0	0	0	112	A269 I272 F725 G726 S731 H732 M733 F765 P766	A269-L729 HydrophobicContact CB-CB 4.27Å; A269-L729 HydrophobicContact CB-CD1 3.93Å; I272-L729 HydrophobicContact CB-CD1 4.48Å; I272-L729 HydrophobicContact CD1-CD1 3.49Å; I272-L729 VanDerWaalsContact CD1-CD1 3.49Å; I272-L729 HydrophobicContact CD1-CD2 4.39Å; I272-L729 HydrophobicContact CD1-CG 4.24Å; I272-L729 HydrophobicContact CG1-CD1 4.03Å; F725-L729 HydrophobicContact CE1-CD2 4.25Å; F725-L729 HydrophobicContact CZ-CD1 4.42Å; F725-L729 WeakPolarHBondContact O-CB 3.45Å; F725-L729 PolarHBondContact O-N 3.26Å; G726-L729 WeakPolarHBondContact O-CA 3.4Å; G726-L729 VanDerWaalsContact O-CB 3.31Å; G726-L729 WeakPolarHBondContact O-CB 3.23Å; G726-L729 PolarHBondContact O-N 3.1Å; G726-L729 VanDerWaalsContact O-N 3.12Å; L729-S731 VanDerWaalsContact C-N 3.32Å; L729-S731 PolarHBondContact O-N 3.24Å; L729-H732 PolarHBondContact O-N 2.95Å; L729-M733 VanDerWaalsContact O-CB 3.24Å; L729-M733 WeakPolarHBondContact O-CB 3.29Å; L729-M733 PolarHBondContact O-N 3.46Å; L729-F765 HydrophobicContact CD2-CD1 4.25Å; L729-P766 HydrophobicContact CD2-CG 3.82Å
730	V	82.7	Confident	76.4	Confident	44 Å²	44	25.9 Å²	25.9	27%	0.267	14%	0.141	S	C	.	.	H	α-helix	trans	-58.1	-48.4	176.1	-171.3	0	0	0	0	110.3	G726 H732 M733 A734 F765	G726-V730 WeakPolarHBondContact O-CG2 3.4Å; G726-V730 PolarHBondContact O-N 3.49Å; V730-H732 PolarHBondContact O-N 3.22Å; V730-M733 PolarHBondContact O-N 2.74Å; V730-A734 WeakPolarHBondContact O-CB 3.42Å; V730-A734 PolarHBondContact O-N 2.88Å; V730-F765 HydrophobicContact CB-CD2 4.44Å; V730-F765 HydrophobicContact CB-CE1 4.28Å; V730-F765 HydrophobicContact CB-CE2 4.16Å; V730-F765 HydrophobicContact CB-CZ 4.07Å; V730-F765 HydrophobicContact CG1-CE2 3.95Å; V730-F765 HydrophobicContact CG1-CZ 3.92Å; V730-F765 HydrophobicContact CG2-CB 4.05Å; V730-F765 HydrophobicContact CG2-CD1 3.59Å; V730-F765 HydrophobicContact CG2-CD2 3.19Å; V730-F765 HydrophobicContact CG2-CE1 3.7Å; V730-F765 HydrophobicContact CG2-CE2 3.32Å; V730-F765 HydrophobicContact CG2-CG 3.32Å; V730-F765 HydrophobicContact CG2-CZ 3.56Å
731	S	80	Confident	77.5	Confident	12 Å²	12	20.1 Å²	20.1	8%	0.084	12%	0.12	C	C	.	.	H	α-helix	trans	-66.5	-40.6	-175.7	-57.3	0	0	0	0	111.3	S727 Q728 L729 A734 I735	S727-S731 PolarHBondContact O-N 3.47Å; S727-S731 PolarHBondContact O-OG 3.1Å; Q728-S731 PolarHBondContact O-N 3.19Å; L729-S731 VanDerWaalsContact C-N 3.32Å; L729-S731 PolarHBondContact O-N 3.24Å; S731-A734 WeakPolarHBondContact O-CB 3.26Å; S731-A734 PolarHBondContact O-N 3.03Å; S731-I735 VanDerWaalsContact O-CG1 3.28Å; S731-I735 WeakPolarHBondContact O-CG1 3.35Å; S731-I735 PolarHBondContact O-N 3.21Å; S731-I735 VanDerWaalsContact O-N 3.1Å
732	H	85.6	Confident	78.7	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.009	10%	0.096	C	C	.	.	H	α-helix	trans	-66	-46.9	174.5	-85.2	-57.1	0	0	0	111.7	R266 T270 A273 Q728 L729 V730 A734 I735 G736	R266-H732 PolarHBondContact O-NE2 3.34Å; T270-H732 PolarHBondContact OG1-NE2 3.48Å; A273-H732 HydrophobicContact CB-CB 3.85Å; A273-H732 WeakPolarHBondContact CB-O 3.48Å; Q728-H732 WeakPolarHBondContact O-CB 3.48Å; Q728-H732 PolarHBondContact O-CD2 3.19Å; Q728-H732 PolarHBondContact O-N 3.43Å; L729-H732 PolarHBondContact O-N 2.95Å; V730-H732 PolarHBondContact O-N 3.22Å; H732-A734 VanDerWaalsContact C-N 3.28Å; H732-A734 PolarHBondContact O-N 2.86Å; H732-I735 PolarHBondContact O-N 3.2Å; H732-G736 PolarHBondContact O-N 3.22Å
733	M	86.1	Confident	79.8	Confident	5 Å²	5	7.9 Å²	7.9	3%	0.025	6%	0.058	C	C	.	.	H	α-helix	trans	-57.1	-43.9	173.4	176.7	160.9	-146.8	0	0	111	M276 L729 V730 I735 G736 L737 A760 L761 F765 Y783	M276-M733 HydrophobicContact CE-CB 4.31Å; M276-M733 HydrophobicContact CE-CE 3.54Å; M276-M733 HydrophobicContact CE-CG 3.65Å; M276-M733 HydrophobicContact CE-SD 4.22Å; M276-M733 HydrophobicContact SD-CB 4.5Å; M276-M733 HydrophobicContact SD-CG 4.17Å; L729-M733 VanDerWaalsContact O-CB 3.24Å; L729-M733 WeakPolarHBondContact O-CB 3.29Å; L729-M733 PolarHBondContact O-N 3.46Å; V730-M733 PolarHBondContact O-N 2.74Å; M733-I735 PolarHBondContact O-N 3.27Å; M733-G736 PolarHBondContact O-N 2.96Å; M733-L737 HydrophobicContact CG-CD1 3.86Å; M733-L737 HydrophobicContact CG-CG 4.22Å; M733-L737 WeakPolarHBondContact O-CB 3.13Å; M733-L737 WeakPolarHBondContact O-CG 3.45Å; M733-L737 PolarHBondContact O-N 2.74Å; M733-A760 HydrophobicContact CE-CB 4.37Å; M733-L761 HydrophobicContact CE-CD2 3.34Å; M733-L761 HydrophobicContact CE-CG 4.22Å; M733-L761 HydrophobicContact CG-CD2 4.26Å; M733-L761 HydrophobicContact SD-CD2 3.76Å; M733-F765 HydrophobicContact SD-CE1 4.39Å; M733-Y783 HydrophobicContact CE-CD1 4.36Å
734	A	80.7	Confident	80.8	Confident	10 Å²	10	7.3 Å²	7.3	8%	0.083	5%	0.047	C	C	.	.	H	α-helix	trans	-58.4	-44.9	178	0	0	0	0	0	113.5	T695 V730 S731 H732 A738	T695-A734 HydrophobicContact CG2-CB 3.59Å; T695-A734 WeakPolarHBondContact OG1-CA 3.44Å; T695-A734 WeakPolarHBondContact OG1-CB 3.47Å; T695-A734 PolarHBondContact OG1-O 2.82Å; T695-A734 VanDerWaalsContact OG1-O 3.1Å; V730-A734 WeakPolarHBondContact O-CB 3.42Å; V730-A734 PolarHBondContact O-N 2.88Å; S731-A734 WeakPolarHBondContact O-CB 3.26Å; S731-A734 PolarHBondContact O-N 3.03Å; H732-A734 VanDerWaalsContact C-N 3.28Å; H732-A734 PolarHBondContact O-N 2.86Å; A734-A738 PolarHBondContact O-N 3.42Å
735	I	80.4	Confident	81.5	Confident	15 Å²	15	7.8 Å²	7.8	8%	0.077	5%	0.047	C	C	.	.	H	α-helix	trans	-69.5	-42.7	176.2	-61	167.2	0	0	0	110.3	F231 L707 A710 L714 S731 H732 M733 L737 A738 L739	F231-I735 HydrophobicContact CE1-CB 4.41Å; F231-I735 HydrophobicContact CE1-CG2 3.97Å; F231-I735 HydrophobicContact CZ-CB 4.2Å; F231-I735 HydrophobicContact CZ-CG2 3.52Å; L707-I735 HydrophobicContact CD2-CG2 3.88Å; A710-I735 HydrophobicContact CB-CD1 3.98Å; A710-I735 HydrophobicContact CB-CG1 3.43Å; A710-I735 VanDerWaalsContact CB-CG1 3.43Å; L714-I735 HydrophobicContact CD1-CD1 3.41Å; L714-I735 VanDerWaalsContact CD1-CD1 3.41Å; L714-I735 HydrophobicContact CG-CD1 4.38Å; S731-I735 VanDerWaalsContact O-CG1 3.28Å; S731-I735 WeakPolarHBondContact O-CG1 3.35Å; S731-I735 PolarHBondContact O-N 3.21Å; S731-I735 VanDerWaalsContact O-N 3.1Å; H732-I735 PolarHBondContact O-N 3.2Å; M733-I735 PolarHBondContact O-N 3.27Å; I735-L737 PolarHBondContact O-N 2.9Å; I735-A738 PolarHBondContact O-N 3.32Å; I735-L739 HydrophobicContact CG2-CD1 4.11Å; I735-L739 PolarHBondContact O-N 3.1Å; I735-L739 VanDerWaalsContact O-N 3.1Å
736	G	84.6	Confident	81.7	Confident	0 Å²	0	7.7 Å²	7.7	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-59.9	-44	178	0	0	0	0	0	112.5	M276 H732 M733 L739 L740	M276-G736 WeakPolarHBondContact CB-O 3.38Å; H732-G736 PolarHBondContact O-N 3.22Å; M733-G736 PolarHBondContact O-N 2.96Å; G736-L739 CarbonylContact O-C 3.47Å; G736-L739 VanDerWaalsContact O-C 3.27Å; G736-L739 PolarHBondContact O-N 3.45Å; G736-L740 WeakPolarHBondContact O-CA 3.38Å; G736-L740 PolarHBondContact O-N 2.74Å
737	L	85.1	Confident	82.1	Confident	2 Å²	2	7.6 Å²	7.6	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-63.6	-42.5	174.9	-65.9	168.7	0	0	0	111.3	M276 Q696 A699 G700 M733 I735 L739 L740 F747 L761	M276-L737 HydrophobicContact CE-CD2 4.21Å; M276-L737 HydrophobicContact CE-CG 4.43Å; M276-L737 HydrophobicContact SD-CD2 4.11Å; M276-L737 HydrophobicContact SD-CG 3.98Å; Q696-L737 HydrophobicContact CG-CD1 4.37Å; A699-L737 CarbonylContact C-O 3.59Å; A699-L737 VanDerWaalsContact CA-O 3.23Å; A699-L737 WeakPolarHBondContact CA-O 3.2Å; G700-L737 PolarHBondContact N-O 3.11Å; M733-L737 HydrophobicContact CG-CD1 3.86Å; M733-L737 HydrophobicContact CG-CG 4.22Å; M733-L737 WeakPolarHBondContact O-CB 3.13Å; M733-L737 WeakPolarHBondContact O-CG 3.45Å; M733-L737 PolarHBondContact O-N 2.74Å; I735-L737 PolarHBondContact O-N 2.9Å; L737-L739 PolarHBondContact O-N 3.44Å; L737-L740 WeakPolarHBondContact O-CB 3.31Å; L737-L740 PolarHBondContact O-N 3.3Å; L737-F747 HydrophobicContact CD2-CE2 3.7Å; L737-F747 HydrophobicContact CD2-CZ 3.4Å; L737-L761 HydrophobicContact CD1-CD2 3.71Å
738	A	78.6	Confident	82.6	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.8	-27.9	177.4	0	0	0	0	0	112.8	G700 S701 G702 V706 L707 A734 I735	G700-A738 CarbonylContact C-O 3.27Å; G700-A738 VanDerWaalsContact C-O 3.27Å; G700-A738 VanDerWaalsContact CA-O 3.26Å; G700-A738 WeakPolarHBondContact CA-O 3.4Å; G700-A738 PolarHBondContact N-O 3.19Å; S701-A738 PolarHBondContact N-O 2.88Å; G702-A738 WeakPolarHBondContact CA-O 3.43Å; G702-A738 PolarHBondContact N-O 3.29Å; V706-A738 HydrophobicContact CG1-CB 4.42Å; L707-A738 HydrophobicContact CD2-CB 4.1Å; A734-A738 PolarHBondContact O-N 3.42Å; I735-A738 PolarHBondContact O-N 3.32Å
739	L	80	Confident	82.8	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	27.8	180	-59.7	174.3	0	0	0	113	F218 I227 F231 F277 L707 I735 G736 L737 G741 A742	F218-L739 HydrophobicContact CE1-CD2 4.05Å; F218-L739 HydrophobicContact CE2-CD2 4Å; F218-L739 HydrophobicContact CZ-CD2 3.4Å; F218-L739 VanDerWaalsContact CZ-CD2 3.4Å; I227-L739 HydrophobicContact CD1-CD1 3.55Å; I227-L739 HydrophobicContact CD1-CD2 4.42Å; I227-L739 HydrophobicContact CG1-CD1 3.86Å; I227-L739 HydrophobicContact CG2-CD1 4.12Å; F231-L739 HydrophobicContact CE2-CD1 4.28Å; F277-L739 HydrophobicContact CD2-CB 3.95Å; F277-L739 HydrophobicContact CD2-CD1 4.44Å; L707-L739 HydrophobicContact CD1-CD2 4.36Å; L707-L739 HydrophobicContact CD2-CD1 4.21Å; L707-L739 HydrophobicContact CD2-CD2 4.45Å; L707-L739 HydrophobicContact CD2-CG 4.12Å; I735-L739 HydrophobicContact CG2-CD1 4.11Å; I735-L739 PolarHBondContact O-N 3.1Å; I735-L739 VanDerWaalsContact O-N 3.1Å; G736-L739 CarbonylContact O-C 3.47Å; G736-L739 VanDerWaalsContact O-C 3.27Å; G736-L739 PolarHBondContact O-N 3.45Å; L737-L739 PolarHBondContact O-N 3.44Å; L739-G741 PolarHBondContact O-N 2.96Å; L739-G741 VanDerWaalsContact O-N 3.17Å; L739-A742 PolarHBondContact O-N 3.49Å
740	L	86.3	Confident	83.1	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-53.8	119.7	-172.8	-170.8	69.9	0	0	0	112.1	M276 L279 G736 L737 A742 G743 Y745 F747 Y783 A787	M276-L740 HydrophobicContact CB-CD1 4.18Å; M276-L740 HydrophobicContact CG-CD1 4.46Å; L279-L740 HydrophobicContact CD2-CD1 4.02Å; L279-L740 HydrophobicContact CD2-CG 4.29Å; G736-L740 WeakPolarHBondContact O-CA 3.38Å; G736-L740 PolarHBondContact O-N 2.74Å; L737-L740 WeakPolarHBondContact O-CB 3.31Å; L737-L740 PolarHBondContact O-N 3.3Å; L740-A742 VanDerWaalsContact C-N 3.31Å; L740-A742 PolarHBondContact O-N 3.45Å; L740-G743 WeakPolarHBondContact O-CA 3.5Å; L740-G743 PolarHBondContact O-N 3.44Å; L740-Y745 PolarHBondContact O-N 2.83Å; L740-F747 HydrophobicContact CD1-CZ 4.43Å; L740-F747 HydrophobicContact CD2-CD1 4.27Å; L740-F747 HydrophobicContact CD2-CE1 3.68Å; L740-F747 HydrophobicContact CD2-CE2 4.16Å; L740-F747 HydrophobicContact CD2-CZ 3.6Å; L740-Y783 HydrophobicContact CD1-CD2 4.03Å; L740-Y783 HydrophobicContact CD1-CE2 3.93Å; L740-A787 HydrophobicContact CD2-CB 4.13Å
741	G	83.5	Confident	83.5	Confident	3 Å²	3	13.1 Å²	13.1	3%	0.031	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	48.7	48.1	-175	0	0	0	0	0	113.3	M276 F277 L739 G743 N744	M276-G741 PolarHBondContact O-N 3.48Å; F277-G741 CarbonylContact O-C 3.58Å; F277-G741 WeakPolarHBondContact O-CA 3.04Å; L739-G741 PolarHBondContact O-N 2.96Å; L739-G741 VanDerWaalsContact O-N 3.17Å; G741-G743 PolarHBondContact O-N 3.37Å; G741-G743 VanDerWaalsContact O-N 3.09Å; G741-N744 VanDerWaalsContact O-CB 3.26Å; G741-N744 WeakPolarHBondContact O-CB 3.46Å; G741-N744 PolarHBondContact O-N 3.45Å; G741-N744 PolarHBondContact O-ND2 3.02Å
742	A	79.5	Confident	84.2	Confident	5 Å²	5	14.6 Å²	14.6	4%	0.041	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	58.8	18.3	-175.1	0	0	0	0	0	114.4	L214 F277 L739 L740	L214-A742 HydrophobicContact CB-CB 4.39Å; L214-A742 HydrophobicContact CD1-CB 3.95Å; L214-A742 WeakPolarHBondContact CD1-O 3.43Å; L214-A742 HydrophobicContact CD2-CB 4.18Å; L214-A742 HydrophobicContact CG-CB 4.39Å; F277-A742 HydrophobicContact CE2-CB 4.25Å; F277-A742 PolarHBondContact O-N 3.14Å; L739-A742 PolarHBondContact O-N 3.49Å; L740-A742 VanDerWaalsContact C-N 3.31Å; L740-A742 PolarHBondContact O-N 3.45Å
743	G	75.2	Confident	84.5	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.01	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	92.6	3.6	-175.2	0	0	0	0	0	114.5	R217 G700 L740 G741 Y745	R217-G743 VanDerWaalsContact NH1-CA 3.3Å; R217-G743 PolarHBondContact NH1-O 3.38Å; G700-G743 WeakPolarHBondContact O-CA 3.3Å; L740-G743 WeakPolarHBondContact O-CA 3.5Å; L740-G743 PolarHBondContact O-N 3.44Å; G741-G743 PolarHBondContact O-N 3.37Å; G741-G743 VanDerWaalsContact O-N 3.09Å; G743-Y745 VanDerWaalsContact C-N 3.32Å
744	N	78.3	Confident	84.8	Confident	19 Å²	19	14.4 Å²	14.4	10%	0.102	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.8	176.1	-70.1	-48.4	0	0	0	113.5	D211 L213 G741 R789 R790 S791	D211-N744 PolarHBondContact OD2-ND2 2.96Å; L213-N744 WeakPolarHBondContact CD1-OD1 3.23Å; G741-N744 VanDerWaalsContact O-CB 3.26Å; G741-N744 WeakPolarHBondContact O-CB 3.46Å; G741-N744 PolarHBondContact O-N 3.45Å; G741-N744 PolarHBondContact O-ND2 3.02Å; N744-R789 WeakPolarHBondContact O-CA 3.12Å; N744-R790 PolarHBondContact O-N 3.26Å; N744-S791 WeakPolarHBondContact CA-OG 3.12Å; N744-S791 WeakPolarHBondContact CB-OG 3.31Å; N744-S791 PolarHBondContact O-N 2.95Å; N744-S791 PolarHBondContact O-OG 3.22Å; N744-S791 WeakPolarHBondContact OD1-CB 3.47Å; N744-S791 PolarHBondContact OD1-OG 2.79Å
745	Y	84.4	Confident	85.5	Confident	17 Å²	17	14 Å²	14	7%	0.067	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.8	-172.6	-70.9	-95.6	0	0	0	112	L279 R280 L740 G743 A787 E788 R789 F831	L279-Y745 HydrophobicContact CD2-CD1 4.24Å; L279-Y745 HydrophobicContact CD2-CD2 4.42Å; L279-Y745 HydrophobicContact CD2-CG 4.09Å; R280-Y745 HydrophobicContact CB-CE2 4.13Å; R280-Y745 WeakPolarHBondContact CB-OH 2.99Å; R280-Y745 WeakPolarHBondContact CD-OH 3.39Å; L740-Y745 PolarHBondContact O-N 2.83Å; G743-Y745 VanDerWaalsContact C-N 3.32Å; Y745-A787 HydrophobicContact CD1-CB 4.38Å; Y745-E788 CarbonylContact C-O 3.52Å; Y745-E788 VanDerWaalsContact CA-O 3.24Å; Y745-E788 WeakPolarHBondContact CA-O 3.15Å; Y745-E788 VanDerWaalsContact CD1-C 3.43Å; Y745-R789 HydrophobicContact CD1-CB 4.27Å; Y745-R789 HydrophobicContact CE1-CB 3.87Å; Y745-F831 WeakPolarHBondContact O-CE1 3.11Å; Y745-F831 WeakPolarHBondContact O-CZ 3.32Å
746	A	84.1	Confident	86.1	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	173.3	170.2	0	0	0	0	0	110.1	S678 A787 E788 R790 F831	S678-A746 VanDerWaalsContact OG-CB 3.31Å; S678-A746 WeakPolarHBondContact OG-CB 3.19Å; A746-A787 CarbonylContact O-C 3.57Å; A746-A787 WeakPolarHBondContact O-CA 2.85Å; A746-E788 PolarHBondContact N-O 3.25Å; A746-E788 PolarHBondContact O-N 2.72Å; A746-R790 HydrophobicContact CB-CB 4.12Å; A746-R790 HydrophobicContact CB-CG 4.11Å; A746-F831 HydrophobicContact CB-CD1 3.1Å; A746-F831 HydrophobicContact CB-CE1 3.02Å; A746-F831 HydrophobicContact CB-CG 4.11Å; A746-F831 HydrophobicContact CB-CZ 3.95Å
747	F	87.5	Confident	86.4	Confident	2 Å²	2	13.4 Å²	13.4	1%	0.009	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	143.2	171.2	-64.3	-56.6	0	0	0	112.9	V677 S678 A699 L737 L740 L757 Y783 A786 A787 R790	V677-F747 HydrophobicContact CG1-CB 4.21Å; V677-F747 HydrophobicContact CG2-CB 3.72Å; V677-F747 HydrophobicContact CG2-CD2 3.57Å; V677-F747 HydrophobicContact CG2-CG 4.09Å; S678-F747 PolarHBondContact OG-N 2.92Å; S678-F747 VanDerWaalsContact OG-N 3.11Å; A699-F747 HydrophobicContact CB-CD2 3.35Å; A699-F747 HydrophobicContact CB-CE2 3.35Å; L737-F747 HydrophobicContact CD2-CE2 3.7Å; L737-F747 HydrophobicContact CD2-CZ 3.4Å; L740-F747 HydrophobicContact CD1-CZ 4.43Å; L740-F747 HydrophobicContact CD2-CD1 4.27Å; L740-F747 HydrophobicContact CD2-CE1 3.68Å; L740-F747 HydrophobicContact CD2-CE2 4.16Å; L740-F747 HydrophobicContact CD2-CZ 3.6Å; F747-L757 HydrophobicContact CB-CD1 4.13Å; F747-L757 HydrophobicContact CD1-CD2 3.87Å; F747-L757 HydrophobicContact CD2-CD2 4.2Å; F747-L757 HydrophobicContact CE1-CD2 3.88Å; F747-L757 HydrophobicContact CE2-CD2 4.19Å; F747-L757 HydrophobicContact CG-CD1 4.15Å; F747-L757 HydrophobicContact CG-CD2 4.05Å; F747-L757 HydrophobicContact CZ-CD2 4.04Å; F747-Y783 HydrophobicContact CE1-CD2 4.41Å; F747-Y783 WeakPolarHBondContact CE1-O 3.48Å; F747-Y783 HydrophobicContact CZ-CD2 4.48Å; F747-A786 WeakPolarHBondContact CA-O 3.48Å; F747-A786 HydrophobicContact CD1-CB 3.65Å; F747-A786 HydrophobicContact CE1-CB 4.26Å; F747-A787 HydrophobicContact CE1-CB 4.33Å; F747-R790 PolarHBondContact O-NH1 2.93Å
748	K	86.4	Confident	86.8	Confident	64 Å²	64	13.4 Å²	13.4	28%	0.278	7%	0.07	S	C	.	.			trans	-78.2	153.2	165.1	-58.2	-175.3	-178.3	-132.8	0	111.8	D750 S753 A786 E788	K748-D750 WeakPolarHBondContact CB-OD1 3.4Å; K748-S753 WeakPolarHBondContact O-CB 3.32Å; K748-A786 PolarHBondContact N-O 2.98Å; K748-E788 HydrophobicContact CD-CB 4.29Å; K748-E788 VanDerWaalsContact CE-CB 3.48Å; K748-E788 WeakPolarHBondContact CE-OE1 3.24Å; K748-E788 WeakPolarHBondContact CE-OE2 3.28Å; K748-E788 HydrophobicContact CG-CB 3.75Å; K748-E788 HydrophobicContact CG-CG 4.47Å; K748-E788 WeakPolarHBondContact CG-OE2 3.09Å; K748-E788 VanDerWaalsContact NZ-CD 3.31Å; K748-E788 IonicContact NZ-OE1 2.65Å; K748-E788 PolarHBondContact NZ-OE1 2.86Å; K748-E788 IonicContact NZ-OE2 3.58Å
749	V	85.7	Confident	87.5	Confident	29 Å²	29	13.4 Å²	13.4	18%	0.176	7%	0.07	C	C	.	.			trans	-113	35	-179.3	-168	0	0	0	0	109	R580 W619 V677 I754 E834	R580-V749 VanDerWaalsContact CZ-O 3.29Å; R580-V749 PolarHBondContact NH1-O 2.96Å; R580-V749 PolarHBondContact NH2-O 2.86Å; W619-V749 HydrophobicContact CZ2-CG1 3.77Å; V677-V749 HydrophobicContact CG1-CG2 3.55Å; V749-I754 HydrophobicContact CG1-CD1 4.28Å; V749-E834 WeakPolarHBondContact CA-OE2 3.49Å; V749-E834 VanDerWaalsContact CB-OE2 3.24Å; V749-E834 WeakPolarHBondContact CB-OE2 3.36Å; V749-E834 WeakPolarHBondContact CG2-OE2 3.26Å; V749-E834 PolarHBondContact N-OE1 3.4Å; V749-E834 PolarHBondContact N-OE2 3.29Å
750	D	90.2	Very high	88	Confident	51 Å²	51	13.4 Å²	13.4	27%	0.273	7%	0.07	S	C	.	.	S	Bend	trans	-85.9	161.3	165.9	65	-66.3	0	0	0	111.6	K748 I752 S753 I754	K748-D750 WeakPolarHBondContact CB-OD1 3.4Å; D750-I752 VanDerWaalsContact C-N 3.29Å; D750-I752 PolarHBondContact O-N 3.44Å; D750-I752 WeakPolarHBondContact OD2-CB 2.95Å; D750-I752 PolarHBondContact OD2-N 2.79Å; D750-S753 VanDerWaalsContact CG-OG 3.23Å; D750-S753 PolarHBondContact O-N 3.42Å; D750-S753 WeakPolarHBondContact OD1-CB 3.22Å; D750-S753 PolarHBondContact OD1-OG 3Å; D750-S753 PolarHBondContact OD2-N 3.37Å; D750-S753 PolarHBondContact OD2-OG 2.97Å; D750-I754 WeakPolarHBondContact O-CG1 3.47Å; D750-I754 PolarHBondContact O-N 2.9Å
751	D	92.2	Very high	88.2	Confident	39 Å²	39	13.9 Å²	13.9	21%	0.209	7%	0.073	C	C	.	.	H	α-helix	trans	-60.2	-40.1	-175.1	-63.6	-5.4	0	0	0	111.8	L511 L579 R580 A755	L511-D751 HydrophobicContact CD2-CB 4.13Å; L511-D751 HydrophobicContact CG-CB 4.16Å; L579-D751 HydrophobicContact CD2-CB 3.8Å; R580-D751 WeakPolarHBondContact CD-OD1 3.28Å; R580-D751 IonicContact CZ-OD1 2.69Å; R580-D751 IonicContact NE-OD1 2.68Å; R580-D751 IonicContact NH1-OD1 3.08Å; R580-D751 PolarHBondContact NH1-OD1 3.4Å; D751-A755 WeakPolarHBondContact O-CB 3.23Å; D751-A755 PolarHBondContact O-N 2.91Å
752	I	93.3	Very high	88.5	Confident	42 Å²	42	14.2 Å²	14.2	22%	0.215	7%	0.073	C	C	.	.	H	α-helix	trans	-68.3	-45.4	-180	-62.7	175.1	0	0	0	109.9	V421 Q467 L511 D750 I754 A755 C756	V421-I752 HydrophobicContact CG1-CG2 4.11Å; Q467-I752 HydrophobicContact CG-CG1 4.39Å; L511-I752 HydrophobicContact CD2-CB 4.45Å; L511-I752 HydrophobicContact CD2-CG1 3.92Å; D750-I752 VanDerWaalsContact C-N 3.29Å; D750-I752 PolarHBondContact O-N 3.44Å; D750-I752 WeakPolarHBondContact OD2-CB 2.95Å; D750-I752 PolarHBondContact OD2-N 2.79Å; I752-I754 PolarHBondContact O-N 3.5Å; I752-A755 PolarHBondContact O-N 3.49Å; I752-C756 WeakPolarHBondContact O-CB 2.94Å; I752-C756 PolarHBondContact O-N 3.19Å; I752-C756 PolarHBondContact O-SG 3.39Å
753	S	92.6	Very high	88.8	Confident	3 Å²	3	14.4 Å²	14.4	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-62.3	-41.7	176.4	-65.8	0	0	0	0	112.6	K748 D750 A755 C756 L757 A786	K748-S753 WeakPolarHBondContact O-CB 3.32Å; D750-S753 VanDerWaalsContact CG-OG 3.23Å; D750-S753 PolarHBondContact O-N 3.42Å; D750-S753 WeakPolarHBondContact OD1-CB 3.22Å; D750-S753 PolarHBondContact OD1-OG 3Å; D750-S753 PolarHBondContact OD2-N 3.37Å; D750-S753 PolarHBondContact OD2-OG 2.97Å; S753-A755 VanDerWaalsContact C-N 3.34Å; S753-A755 PolarHBondContact O-N 3.24Å; S753-C756 PolarHBondContact O-N 3.33Å; S753-L757 WeakPolarHBondContact O-CB 3.43Å; S753-L757 VanDerWaalsContact O-CG 3.27Å; S753-L757 WeakPolarHBondContact O-CG 3.4Å; S753-L757 PolarHBondContact O-N 3.07Å; S753-A786 WeakPolarHBondContact OG-CA 3.2Å
754	I	92.3	Very high	89.2	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-60.9	-45.7	174.5	-70.7	166.8	0	0	0	110.4	L579 L616 W619 V749 D750 I752 C756 L757 I758	L579-I754 HydrophobicContact CD1-CG2 4.3Å; L579-I754 HydrophobicContact CD2-CB 4.5Å; L579-I754 HydrophobicContact CD2-CG2 4.34Å; L616-I754 HydrophobicContact CD2-CG2 4.17Å; W619-I754 HydrophobicContact CH2-CD1 3.43Å; W619-I754 VanDerWaalsContact CH2-CD1 3.43Å; W619-I754 HydrophobicContact CH2-CG1 4.23Å; W619-I754 HydrophobicContact CZ2-CD1 3.74Å; W619-I754 HydrophobicContact CZ3-CD1 4.01Å; V749-I754 HydrophobicContact CG1-CD1 4.28Å; D750-I754 WeakPolarHBondContact O-CG1 3.47Å; D750-I754 PolarHBondContact O-N 2.9Å; I752-I754 PolarHBondContact O-N 3.5Å; I754-C756 VanDerWaalsContact C-N 3.34Å; I754-C756 PolarHBondContact O-N 3.38Å; I754-L757 PolarHBondContact O-N 2.94Å; I754-I758 HydrophobicContact CG2-CD1 3.74Å; I754-I758 HydrophobicContact CG2-CG1 4.39Å; I754-I758 WeakPolarHBondContact O-CD1 3.34Å; I754-I758 VanDerWaalsContact O-CG1 3.25Å; I754-I758 WeakPolarHBondContact O-CG1 3.45Å; I754-I758 PolarHBondContact O-N 2.88Å
755	A	94.2	Very high	89.5	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-61.1	-42.8	176.8	0	0	0	0	0	112	L508 L511 M576 D751 I752 S753 I758 C759	L508-A755 HydrophobicContact CD2-CB 3.55Å; L511-A755 HydrophobicContact CD1-CB 3.81Å; L511-A755 HydrophobicContact CD2-CB 3.98Å; M576-A755 HydrophobicContact CE-CB 4.48Å; M576-A755 HydrophobicContact SD-CB 4.35Å; D751-A755 WeakPolarHBondContact O-CB 3.23Å; D751-A755 PolarHBondContact O-N 2.91Å; I752-A755 PolarHBondContact O-N 3.49Å; S753-A755 VanDerWaalsContact C-N 3.34Å; S753-A755 PolarHBondContact O-N 3.24Å; A755-I758 PolarHBondContact O-N 3.39Å; A755-C759 PolarHBondContact O-N 3.18Å; A755-C759 PolarHBondContact O-SG 3.1Å
756	C	93.6	Very high	89.6	Confident	1 Å²	1	17.4 Å²	17.4	1%	0.007	9%	0.085	C	C	.	.	H	α-helix	trans	-64.3	-39	176	-68.1	0	0	0	0	112.1	I752 S753 I754 C759 A760 L782 L785	I752-C756 WeakPolarHBondContact O-CB 2.94Å; I752-C756 PolarHBondContact O-N 3.19Å; I752-C756 PolarHBondContact O-SG 3.39Å; S753-C756 PolarHBondContact O-N 3.33Å; I754-C756 VanDerWaalsContact C-N 3.34Å; I754-C756 PolarHBondContact O-N 3.38Å; C756-C759 PolarHBondContact O-N 3.37Å; C756-A760 WeakPolarHBondContact O-CB 3Å; C756-A760 PolarHBondContact O-N 3.41Å; C756-L782 HydrophobicContact CB-CB 4.42Å; C756-L785 HydrophobicContact CB-CB 4.39Å
757	L	92.1	Very high	89.3	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-65.7	-42.7	174.7	-75	172.7	0	0	0	111.5	L674 F747 S753 I754 C759 A760 L761 A786	L674-L757 HydrophobicContact CD2-CB 3.93Å; L674-L757 HydrophobicContact CD2-CD1 4.19Å; F747-L757 HydrophobicContact CB-CD1 4.13Å; F747-L757 HydrophobicContact CD1-CD2 3.87Å; F747-L757 HydrophobicContact CD2-CD2 4.2Å; F747-L757 HydrophobicContact CE1-CD2 3.88Å; F747-L757 HydrophobicContact CE2-CD2 4.19Å; F747-L757 HydrophobicContact CG-CD1 4.15Å; F747-L757 HydrophobicContact CG-CD2 4.05Å; F747-L757 HydrophobicContact CZ-CD2 4.04Å; S753-L757 WeakPolarHBondContact O-CB 3.43Å; S753-L757 VanDerWaalsContact O-CG 3.27Å; S753-L757 WeakPolarHBondContact O-CG 3.4Å; S753-L757 PolarHBondContact O-N 3.07Å; I754-L757 PolarHBondContact O-N 2.94Å; L757-C759 VanDerWaalsContact C-N 3.29Å; L757-C759 PolarHBondContact O-N 2.8Å; L757-A760 PolarHBondContact O-N 3.08Å; L757-L761 HydrophobicContact CB-CD1 4.27Å; L757-L761 HydrophobicContact CD2-CD1 3.97Å; L757-L761 WeakPolarHBondContact O-CB 3.44Å; L757-L761 WeakPolarHBondContact O-CG 3.4Å; L757-L761 PolarHBondContact O-N 3.16Å; L757-A786 HydrophobicContact CD1-CB 4.2Å; L757-A786 HydrophobicContact CD2-CB 4.01Å; L757-A786 HydrophobicContact CG-CB 3.76Å
758	I	92.2	Very high	88.8	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-60.6	-41.7	174.8	-67	160.6	0	0	0	110.4	L572 M576 L616 L674 I754 A755 Y762	L572-I758 HydrophobicContact CD2-CG2 3.98Å; M576-I758 HydrophobicContact CE-CB 3.69Å; M576-I758 HydrophobicContact CE-CD1 3.99Å; M576-I758 HydrophobicContact CE-CG1 4.47Å; M576-I758 HydrophobicContact CE-CG2 3.4Å; L616-I758 HydrophobicContact CD1-CD1 3.45Å; L616-I758 VanDerWaalsContact CD1-CD1 3.45Å; L616-I758 HydrophobicContact CD1-CG1 4.48Å; L616-I758 HydrophobicContact CD2-CD1 4.21Å; L616-I758 HydrophobicContact CG-CD1 4.5Å; L674-I758 HydrophobicContact CD1-CD1 4.39Å; L674-I758 HydrophobicContact CD1-CG1 3.84Å; I754-I758 HydrophobicContact CG2-CD1 3.74Å; I754-I758 HydrophobicContact CG2-CG1 4.39Å; I754-I758 WeakPolarHBondContact O-CD1 3.34Å; I754-I758 VanDerWaalsContact O-CG1 3.25Å; I754-I758 WeakPolarHBondContact O-CG1 3.45Å; I754-I758 PolarHBondContact O-N 2.88Å; A755-I758 PolarHBondContact O-N 3.39Å; I758-Y762 PolarHBondContact O-N 3.43Å; I758-Y762 VanDerWaalsContact O-N 3.14Å
759	C	92.9	Very high	88.4	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.2	-49.1	175.5	-63	0	0	0	0	111.4	F459 A755 C756 L757 L761 H775 L782	F459-C759 HydrophobicContact CE2-CB 4.42Å; F459-C759 HydrophobicContact CZ-CB 4.18Å; A755-C759 PolarHBondContact O-N 3.18Å; A755-C759 PolarHBondContact O-SG 3.1Å; C756-C759 PolarHBondContact O-N 3.37Å; L757-C759 VanDerWaalsContact C-N 3.29Å; L757-C759 PolarHBondContact O-N 2.8Å; C759-L761 PolarHBondContact O-N 3.44Å; C759-H775 PolarHBondContact O-CE1 2.85Å; C759-H775 PolarHBondContact O-NE2 3.45Å; C759-L782 HydrophobicContact CB-CD1 3.76Å
760	A	92.1	Very high	88	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.8	-35.1	-177.7	0	0	0	0	0	113.1	M733 C756 L757 L779 R780 L782	M733-A760 HydrophobicContact CE-CB 4.37Å; C756-A760 WeakPolarHBondContact O-CB 3Å; C756-A760 PolarHBondContact O-N 3.41Å; L757-A760 PolarHBondContact O-N 3.08Å; A760-L779 WeakPolarHBondContact CA-O 3.36Å; A760-R780 WeakPolarHBondContact O-CD 3.48Å; A760-R780 PolarHBondContact O-NH1 3.02Å; A760-L782 HydrophobicContact CB-CB 4.28Å
761	L	89.6	Confident	87.6	Confident	10 Å²	10	24.7 Å²	24.7	5%	0.052	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	20.3	-173	-58.4	164.7	0	0	0	112.4	F670 Q696 M733 L737 L757 C759	F670-L761 HydrophobicContact CE2-CB 4.27Å; F670-L761 HydrophobicContact CZ-CB 3.84Å; Q696-L761 HydrophobicContact CG-CD1 4.07Å; M733-L761 HydrophobicContact CE-CD2 3.34Å; M733-L761 HydrophobicContact CE-CG 4.22Å; M733-L761 HydrophobicContact CG-CD2 4.26Å; M733-L761 HydrophobicContact SD-CD2 3.76Å; L737-L761 HydrophobicContact CD1-CD2 3.71Å; L757-L761 HydrophobicContact CB-CD1 4.27Å; L757-L761 HydrophobicContact CD2-CD1 3.97Å; L757-L761 WeakPolarHBondContact O-CB 3.44Å; L757-L761 WeakPolarHBondContact O-CG 3.4Å; L757-L761 PolarHBondContact O-N 3.16Å; C759-L761 PolarHBondContact O-N 3.44Å
762	Y	90.5	Very high	87.2	Confident	10 Å²	10	23.3 Å²	23.3	4%	0.039	11%	0.106	C	C	.	.			trans	-51.6	126.2	178.6	-176	-106.5	0	0	0	110.7	L500 L572 L609 I758 R764 H775 R780	L500-Y762 HydrophobicContact CD1-CE2 3.84Å; L500-Y762 HydrophobicContact CD2-CD1 3.78Å; L500-Y762 HydrophobicContact CD2-CD2 4.2Å; L500-Y762 HydrophobicContact CD2-CE1 3.37Å; L500-Y762 HydrophobicContact CD2-CE2 3.89Å; L500-Y762 HydrophobicContact CD2-CG 4.16Å; L500-Y762 VanDerWaalsContact CD2-CZ 3.46Å; L572-Y762 HydrophobicContact CD1-CD2 4.17Å; L572-Y762 HydrophobicContact CD1-CE2 3.8Å; L609-Y762 HydrophobicContact CD1-CE2 4.06Å; L609-Y762 HydrophobicContact CD2-CE2 3.94Å; I758-Y762 PolarHBondContact O-N 3.43Å; I758-Y762 VanDerWaalsContact O-N 3.14Å; Y762-R764 HydrophobicContact CD1-CB 3.95Å; Y762-R764 HydrophobicContact CD1-CG 4.4Å; Y762-R764 HydrophobicContact CE1-CB 3.61Å; Y762-R764 HydrophobicContact CE1-CG 3.68Å; Y762-R764 PolarHBondContact O-N 3.16Å; Y762-H775 HydrophobicContact CD1-CB 3.68Å; Y762-H775 AromaticContact CD1-CG 3.76Å; Y762-H775 AromaticContact CD1-ND1 3.82Å; Y762-H775 HydrophobicContact CE1-CB 4.16Å; Y762-H775 AromaticContact CG-ND1 3.92Å; Y762-R780 VanDerWaalsContact N-NH1 3.16Å; Y762-R780 VanDerWaalsContact O-CZ 3.24Å; Y762-R780 PolarHBondContact O-NH1 2.93Å; Y762-R780 PolarHBondContact O-NH2 3.1Å
763	P	84.6	Confident	86.9	Confident	9 Å²	9	26.7 Å²	26.7	6%	0.058	12%	0.116	C	C	.	.	S	Bend	trans	-75.6	7.3	-161.1	28.4	-37.3	0	0	0	115.4	M608 L609 F943	M608-P763 HydrophobicContact CE-CB 3.49Å; M608-P763 VanDerWaalsContact CE-CB 3.49Å; M608-P763 HydrophobicContact CE-CG 3.1Å; M608-P763 HydrophobicContact SD-CB 3.77Å; M608-P763 HydrophobicContact SD-CG 3.77Å; L609-P763 HydrophobicContact CD2-CG 4.31Å; P763-F943 HydrophobicContact CB-CE1 4.36Å
764	R	84.8	Confident	86.6	Confident	48 Å²	48	28.3 Å²	28.3	18%	0.181	12%	0.124	C	C	.	.			trans	-104.8	107.7	171.4	-61	-67.7	-120.1	141.8	4.9	110.6	D605 Y762 H774 R780	D605-R764 IonicContact OD2-CZ 3.28Å; D605-R764 IonicContact OD2-NE 3.07Å; D605-R764 PolarHBondContact OD2-NE 3.22Å; D605-R764 VanDerWaalsContact OD2-NE 3.13Å; D605-R764 IonicContact OD2-NH2 3.45Å; D605-R764 PolarHBondContact OD2-NH2 3.4Å; Y762-R764 HydrophobicContact CD1-CB 3.95Å; Y762-R764 HydrophobicContact CD1-CG 4.4Å; Y762-R764 HydrophobicContact CE1-CB 3.61Å; Y762-R764 HydrophobicContact CE1-CG 3.68Å; Y762-R764 PolarHBondContact O-N 3.16Å; R764-H774 HydrophobicContact CB-CB 4.3Å; R764-R780 PolarHBondContact O-NH2 3.4Å
765	F	84.5	Confident	86.6	Confident	43 Å²	43	28.7 Å²	28.7	19%	0.189	13%	0.125	C	C	.	.			trans	-91.5	153.6	179.7	-71.1	-90	0	0	0	111.8	L729 V730 M733 M767	L729-F765 HydrophobicContact CD2-CD1 4.25Å; V730-F765 HydrophobicContact CB-CD2 4.44Å; V730-F765 HydrophobicContact CB-CE1 4.28Å; V730-F765 HydrophobicContact CB-CE2 4.16Å; V730-F765 HydrophobicContact CB-CZ 4.07Å; V730-F765 HydrophobicContact CG1-CE2 3.95Å; V730-F765 HydrophobicContact CG1-CZ 3.92Å; V730-F765 HydrophobicContact CG2-CB 4.05Å; V730-F765 HydrophobicContact CG2-CD1 3.59Å; V730-F765 HydrophobicContact CG2-CD2 3.19Å; V730-F765 HydrophobicContact CG2-CE1 3.7Å; V730-F765 HydrophobicContact CG2-CE2 3.32Å; V730-F765 HydrophobicContact CG2-CG 3.32Å; V730-F765 HydrophobicContact CG2-CZ 3.56Å; M733-F765 HydrophobicContact SD-CE1 4.39Å; F765-M767 PolarHBondContact O-N 3.11Å
766	P	85.1	Confident	86.4	Confident	8 Å²	8	29 Å²	29	5%	0.052	13%	0.128	C	C	.	.			trans	-63.6	131.9	-178.2	25.7	-35.7	0	0	0	111.7	F725 G726 L729 F768 D771 Q777	F725-P766 HydrophobicContact CD1-CB 4.24Å; F725-P766 HydrophobicContact CD1-CG 3.78Å; F725-P766 HydrophobicContact CE1-CB 4.41Å; F725-P766 HydrophobicContact CE1-CG 3.71Å; G726-P766 WeakPolarHBondContact CA-O 3.44Å; G726-P766 PolarHBondContact N-O 2.84Å; L729-P766 HydrophobicContact CD2-CG 3.82Å; P766-F768 VanDerWaalsContact C-N 3.3Å; P766-F768 PolarHBondContact O-N 2.94Å; P766-D771 HydrophobicContact CB-CB 3.89Å; P766-D771 WeakPolarHBondContact CB-O 3.5Å; P766-Q777 HydrophobicContact CB-CG 4.3Å; P766-Q777 HydrophobicContact CG-CG 4.16Å
767	M	79.7	Confident	86.3	Confident	103 Å²	103	29 Å²	29	51%	0.507	13%	0.128	S	C	.	.	S	Bend	trans	-67.5	-35.4	177.9	-67.5	-170.2	179	0	0	111.8	F765 D771	F765-M767 PolarHBondContact O-N 3.11Å; M767-D771 PolarHBondContact N-OD2 3.21Å
768	F	77	Confident	86.4	Confident	75 Å²	75	29 Å²	29	33%	0.329	13%	0.128	S	C	.	.	S	Bend	trans	-139.3	164	178.1	50.4	-89.1	0	0	0	110	P766 R770 D771	P766-F768 VanDerWaalsContact C-N 3.3Å; P766-F768 PolarHBondContact O-N 2.94Å; F768-R770 VanDerWaalsContact C-N 3.25Å; F768-R770 HydrophobicContact CD2-CB 4.04Å; F768-R770 HydrophobicContact CE2-CB 4.03Å; F768-R770 PolarHBondContact O-N 3.02Å; F768-R770 VanDerWaalsContact O-N 3.09Å; F768-D771 HydrophobicContact CD1-CB 4.07Å; F768-D771 HydrophobicContact CD2-CB 3.82Å; F768-D771 HydrophobicContact CE1-CB 3.91Å; F768-D771 HydrophobicContact CE2-CB 3.65Å; F768-D771 HydrophobicContact CG-CB 4.01Å; F768-D771 HydrophobicContact CZ-CB 3.69Å; F768-D771 WeakPolarHBondContact O-CB 3.34Å; F768-D771 PolarHBondContact O-N 2.85Å
769	H	76.5	Confident	86.5	Confident	25 Å²	25	29 Å²	29	12%	0.116	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.8	-172.2	56.4	-83.7	0	0	0	115.5	I319 W322 P323 F725 Q777	I319-H769 WeakPolarHBondContact CA-CD2 3.47Å; I319-H769 VanDerWaalsContact CA-NE2 3.31Å; I319-H769 WeakPolarHBondContact CA-NE2 3.46Å; I319-H769 WeakPolarHBondContact CB-NE2 3.49Å; I319-H769 WeakPolarHBondContact CG1-NE2 3.48Å; I319-H769 WeakPolarHBondContact CG2-NE2 3.25Å; I319-H769 PolarHBondContact O-CD2 2.67Å; W322-H769 WeakPolarHBondContact CB-O 3.44Å; W322-H769 VanDerWaalsContact CD1-O 3.25Å; P323-H769 HydrophobicContact CG-CB 4.42Å; F725-H769 HydrophobicContact CD1-CB 4.46Å; F725-H769 HydrophobicContact CD2-CB 4.35Å; F725-H769 HydrophobicContact CE1-CB 4.45Å; F725-H769 HydrophobicContact CE2-CB 4.34Å; F725-H769 HydrophobicContact CG-CB 4.4Å; F725-H769 HydrophobicContact CZ-CB 4.4Å; H769-Q777 PolarHBondContact O-NE2 3.24Å
770	R	78.2	Confident	86.4	Confident	90 Å²	90	29.1 Å²	29.1	34%	0.34	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-5.2	174.3	-71.1	179.7	-158.3	175.6	7.3	114.5	N318 I319 F768 N772	N318-R770 VanDerWaalsContact C-CZ 3.46Å; N318-R770 VanDerWaalsContact CB-NH2 3.3Å; N318-R770 WeakPolarHBondContact O-CG 3.2Å; N318-R770 PolarHBondContact O-NE 3.35Å; I319-R770 VanDerWaalsContact CG1-NH2 3.31Å; F768-R770 VanDerWaalsContact C-N 3.25Å; F768-R770 HydrophobicContact CD2-CB 4.04Å; F768-R770 HydrophobicContact CE2-CB 4.03Å; F768-R770 PolarHBondContact O-N 3.02Å; F768-R770 VanDerWaalsContact O-N 3.09Å; R770-N772 PolarHBondContact O-N 2.92Å
771	D	81.8	Confident	86.6	Confident	6 Å²	6	29.1 Å²	29.1	3%	0.032	13%	0.128	C	C	.	.			trans	-73.3	112.9	-168.7	-173.2	12.2	0	0	0	111.4	P766 M767 F768 R773 Q777	P766-D771 HydrophobicContact CB-CB 3.89Å; P766-D771 WeakPolarHBondContact CB-O 3.5Å; M767-D771 PolarHBondContact N-OD2 3.21Å; F768-D771 HydrophobicContact CD1-CB 4.07Å; F768-D771 HydrophobicContact CD2-CB 3.82Å; F768-D771 HydrophobicContact CE1-CB 3.91Å; F768-D771 HydrophobicContact CE2-CB 3.65Å; F768-D771 HydrophobicContact CG-CB 4.01Å; F768-D771 HydrophobicContact CZ-CB 3.69Å; F768-D771 WeakPolarHBondContact O-CB 3.34Å; F768-D771 PolarHBondContact O-N 2.85Å; D771-R773 VanDerWaalsContact OD1-CB 3.23Å; D771-R773 WeakPolarHBondContact OD1-CB 3.33Å; D771-R773 WeakPolarHBondContact OD1-CD 3.42Å; D771-R773 WeakPolarHBondContact OD1-CG 3.06Å; D771-R773 PolarHBondContact OD1-N 3.49Å; D771-Q777 PolarHBondContact O-NE2 3.32Å
772	N	84.4	Confident	86.8	Confident	11 Å²	11	28.6 Å²	28.6	6%	0.059	13%	0.126	C	C	.	.			trans	-117.7	12.9	169.7	-70.7	-43.8	0	0	0	111.9	W322 R770 H774 Q777	W322-N772 VanDerWaalsContact CE2-ND2 3.31Å; W322-N772 WeakPolarHBondContact CZ2-ND2 3.43Å; W322-N772 PolarHBondContact NE1-ND2 2.9Å; W322-N772 VanDerWaalsContact NE1-ND2 3.11Å; R770-N772 PolarHBondContact O-N 2.92Å; N772-H774 VanDerWaalsContact C-N 3.27Å; N772-H774 PolarHBondContact O-N 3.19Å; N772-Q777 WeakPolarHBondContact OD1-CG 3.31Å; N772-Q777 PolarHBondContact OD1-N 2.87Å
773	R	86.1	Confident	86.8	Confident	112 Å²	112	28.1 Å²	28.1	42%	0.423	12%	0.124	S	C	.	.	S	Bend	trans	-57.1	-39.3	-169.6	-67.8	175.9	178.6	179.3	0.1	113.2	S493 E496 G497 D771	S493-R773 WeakPolarHBondContact O-CA 3.44Å; S493-R773 WeakPolarHBondContact O-CB 3.42Å; S493-R773 WeakPolarHBondContact O-CG 3.26Å; E496-R773 CarbonylContact C-O 3.4Å; E496-R773 WeakPolarHBondContact CB-O 3.49Å; G497-R773 WeakPolarHBondContact CA-O 3.25Å; G497-R773 PolarHBondContact N-O 3.13Å; D771-R773 VanDerWaalsContact OD1-CB 3.23Å; D771-R773 WeakPolarHBondContact OD1-CB 3.33Å; D771-R773 WeakPolarHBondContact OD1-CD 3.42Å; D771-R773 WeakPolarHBondContact OD1-CG 3.06Å; D771-R773 PolarHBondContact OD1-N 3.49Å
774	H	87.1	Confident	87.3	Confident	38 Å²	38	27.7 Å²	27.7	18%	0.176	12%	0.121	C	C	.	.	S	Bend	trans	-106	-28	-176.3	-59.9	-58.8	0	0	0	113.7	E496 L500 R764 N772	E496-H774 IonicContact OE2-CE1 3.11Å; E496-H774 PolarHBondContact OE2-CE1 2.78Å; E496-H774 IonicContact OE2-ND1 3.25Å; E496-H774 PolarHBondContact OE2-ND1 3.02Å; L500-H774 WeakPolarHBondContact CD2-O 3.34Å; R764-H774 HydrophobicContact CB-CB 4.3Å; N772-H774 VanDerWaalsContact C-N 3.27Å; N772-H774 PolarHBondContact O-N 3.19Å
775	H	90.9	Very high	87.6	Confident	8 Å²	8	27.4 Å²	27.4	4%	0.037	12%	0.123	C	C	.	.	S	Bend	trans	-159.7	132	-175.7	-179.6	74.2	0	0	0	110	L500 C759 Y762 Q777 R780	L500-H775 HydrophobicContact CD2-CB 4.11Å; C759-H775 PolarHBondContact O-CE1 2.85Å; C759-H775 PolarHBondContact O-NE2 3.45Å; Y762-H775 HydrophobicContact CD1-CB 3.68Å; Y762-H775 AromaticContact CD1-CG 3.76Å; Y762-H775 AromaticContact CD1-ND1 3.82Å; Y762-H775 HydrophobicContact CE1-CB 4.16Å; Y762-H775 AromaticContact CG-ND1 3.92Å; H775-Q777 PolarHBondContact O-N 2.84Å; H775-R780 PolarHBondContact CD2-NE 3.38Å
776	A	91.1	Very high	87.9	Confident	9 Å²	9	25.4 Å²	25.4	7%	0.074	11%	0.114	C	C	.	.			trans	-69.2	121.4	-179.1	0	0	0	0	0	111.2	T455 I778 L779	T455-A776 HydrophobicContact CG2-CB 4.21Å; A776-I778 HydrophobicContact CB-CG2 4.15Å; A776-I778 PolarHBondContact O-N 2.95Å; A776-I778 VanDerWaalsContact O-N 3.13Å; A776-L779 HydrophobicContact CB-CD1 4.18Å; A776-L779 HydrophobicContact CB-CG 4.13Å; A776-L779 PolarHBondContact O-N 3.14Å; A776-L779 VanDerWaalsContact O-N 3.1Å
777	Q	91.6	Very high	88.1	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-60	-26.1	-176.8	-72.3	-177.3	39.5	0	0	113.6	W322 H326 P766 H769 D771 N772 H775 L779 R780	W322-Q777 HydrophobicContact CD2-CB 3.84Å; W322-Q777 HydrophobicContact CE3-CB 3.62Å; W322-Q777 HydrophobicContact CH2-CB 4.19Å; W322-Q777 HydrophobicContact CZ2-CB 4.37Å; W322-Q777 HydrophobicContact CZ3-CB 3.82Å; H326-Q777 PolarHBondContact NE2-OE1 3.32Å; P766-Q777 HydrophobicContact CB-CG 4.3Å; P766-Q777 HydrophobicContact CG-CG 4.16Å; H769-Q777 PolarHBondContact O-NE2 3.24Å; D771-Q777 PolarHBondContact O-NE2 3.32Å; N772-Q777 WeakPolarHBondContact OD1-CG 3.31Å; N772-Q777 PolarHBondContact OD1-N 2.87Å; H775-Q777 PolarHBondContact O-N 2.84Å; Q777-L779 VanDerWaalsContact C-N 3.25Å; Q777-L779 PolarHBondContact O-N 3.04Å; Q777-R780 VanDerWaalsContact O-CB 3.25Å; Q777-R780 WeakPolarHBondContact O-CB 3.25Å; Q777-R780 WeakPolarHBondContact O-CG 3.39Å; Q777-R780 PolarHBondContact O-N 3.32Å
778	I	93.2	Very high	88.5	Confident	1 Å²	1	23 Å²	23	1%	0.005	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-59.4	-35.1	176.4	-166.7	171	0	0	0	112.6	W322 F325 F381 L414 T456 A776 R780 H781	W322-I778 HydrophobicContact CH2-CB 3.81Å; W322-I778 HydrophobicContact CH2-CG2 4.44Å; W322-I778 HydrophobicContact CZ3-CB 3.78Å; W322-I778 VanDerWaalsContact CZ3-N 3.3Å; F325-I778 HydrophobicContact CE1-CB 4.46Å; F325-I778 HydrophobicContact CE1-CD1 4.23Å; F325-I778 HydrophobicContact CE1-CG1 3.82Å; F325-I778 HydrophobicContact CE2-CD1 4.46Å; F325-I778 HydrophobicContact CZ-CD1 3.63Å; F325-I778 HydrophobicContact CZ-CG1 3.74Å; F381-I778 HydrophobicContact CD1-CD1 4.26Å; F381-I778 HydrophobicContact CD1-CG1 3.8Å; F381-I778 HydrophobicContact CE1-CD1 4.43Å; F381-I778 HydrophobicContact CE1-CG1 3.63Å; F381-I778 VanDerWaalsContact CE1-O 3.3Å; F381-I778 WeakPolarHBondContact CE1-O 2.98Å; F381-I778 HydrophobicContact CG-CD1 4.47Å; F381-I778 HydrophobicContact CG-CG1 4.46Å; F381-I778 HydrophobicContact CZ-CG1 4.24Å; L414-I778 HydrophobicContact CB-CD1 4.33Å; L414-I778 HydrophobicContact CD2-CD1 3.79Å; L414-I778 HydrophobicContact CD2-CG1 3.78Å; L414-I778 HydrophobicContact CD2-CG2 4.15Å; T456-I778 HydrophobicContact CG2-CD1 4.11Å; A776-I778 HydrophobicContact CB-CG2 4.15Å; A776-I778 PolarHBondContact O-N 2.95Å; A776-I778 VanDerWaalsContact O-N 3.13Å; I778-R780 PolarHBondContact O-N 3.22Å; I778-R780 VanDerWaalsContact O-N 3.14Å; I778-H781 PolarHBondContact O-N 3.07Å
779	L	93.9	Very high	88.7	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-68	-16.3	-176.9	-56	-180	0	0	0	112.5	L414 F459 L504 A760 A776 Q777 H781 L782	L414-L779 HydrophobicContact CD2-CD2 4.08Å; F459-L779 HydrophobicContact CB-CD2 4.29Å; F459-L779 HydrophobicContact CD1-CD2 3.49Å; F459-L779 VanDerWaalsContact CD1-CD2 3.49Å; F459-L779 HydrophobicContact CD2-CD1 4.05Å; F459-L779 HydrophobicContact CD2-CD2 3.95Å; F459-L779 HydrophobicContact CE1-CD2 3.69Å; F459-L779 HydrophobicContact CE2-CD1 4.17Å; F459-L779 HydrophobicContact CE2-CD2 4.11Å; F459-L779 HydrophobicContact CG-CD1 4.45Å; F459-L779 HydrophobicContact CG-CD2 3.62Å; F459-L779 HydrophobicContact CZ-CD2 3.99Å; L504-L779 HydrophobicContact CD1-CD1 4.45Å; A760-L779 WeakPolarHBondContact CA-O 3.36Å; A776-L779 HydrophobicContact CB-CD1 4.18Å; A776-L779 HydrophobicContact CB-CG 4.13Å; A776-L779 PolarHBondContact O-N 3.14Å; A776-L779 VanDerWaalsContact O-N 3.1Å; Q777-L779 VanDerWaalsContact C-N 3.25Å; Q777-L779 PolarHBondContact O-N 3.04Å; L779-H781 PolarHBondContact O-N 3.25Å; L779-H781 VanDerWaalsContact O-N 3.1Å; L779-L782 HydrophobicContact CB-CD1 4.04Å; L779-L782 HydrophobicContact CD2-CD1 3.91Å; L779-L782 WeakPolarHBondContact O-CB 3.28Å; L779-L782 WeakPolarHBondContact O-CG 3.32Å; L779-L782 PolarHBondContact O-N 3.44Å; L779-L782 VanDerWaalsContact O-N 3.09Å
780	R	92.7	Very high	88.7	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.008	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-59.8	-20.1	177.5	-62.1	-57.5	-172.9	178.1	-4.4	113.9	I272 A760 Y762 R764 H775 Q777 I778 Y783	I272-R780 HydrophobicContact CD1-CB 4.26Å; A760-R780 WeakPolarHBondContact O-CD 3.48Å; A760-R780 PolarHBondContact O-NH1 3.02Å; Y762-R780 VanDerWaalsContact N-NH1 3.16Å; Y762-R780 VanDerWaalsContact O-CZ 3.24Å; Y762-R780 PolarHBondContact O-NH1 2.93Å; Y762-R780 PolarHBondContact O-NH2 3.1Å; R764-R780 PolarHBondContact O-NH2 3.4Å; H775-R780 PolarHBondContact CD2-NE 3.38Å; Q777-R780 VanDerWaalsContact O-CB 3.25Å; Q777-R780 WeakPolarHBondContact O-CB 3.25Å; Q777-R780 WeakPolarHBondContact O-CG 3.39Å; Q777-R780 PolarHBondContact O-N 3.32Å; I778-R780 PolarHBondContact O-N 3.22Å; I778-R780 VanDerWaalsContact O-N 3.14Å; R780-Y783 WeakPolarHBondContact O-CD1 3.45Å
781	H	94.5	Very high	88.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-92.3	0.6	178.2	-59.2	-74.1	0	0	0	115	H326 V329 F381 L385 I778 L779 Y783 V784	H326-H781 AromaticContact CE1-NE2 3.91Å; H326-H781 AromaticContact CG-NE2 3.83Å; H326-H781 AromaticContact ND1-CD2 3.75Å; H326-H781 AromaticContact ND1-CE1 3.62Å; H326-H781 AromaticContact ND1-NE2 2.92Å; H326-H781 PolarHBondContact ND1-NE2 2.92Å; V329-H781 HydrophobicContact CG1-CB 4.15Å; F381-H781 HydrophobicContact CE1-CB 3.72Å; F381-H781 HydrophobicContact CZ-CB 4.31Å; L385-H781 HydrophobicContact CD1-CB 4.12Å; I778-H781 PolarHBondContact O-N 3.07Å; L779-H781 PolarHBondContact O-N 3.25Å; L779-H781 VanDerWaalsContact O-N 3.1Å; H781-Y783 HydrophobicContact CB-CE1 4.27Å; H781-Y783 AromaticContact ND1-CE1 4Å; H781-Y783 PolarHBondContact O-N 3.01Å; H781-Y783 VanDerWaalsContact O-N 3.11Å; H781-V784 WeakPolarHBondContact O-CG2 3.49Å; H781-V784 PolarHBondContact O-N 3.35Å
782	L	93.7	Very high	87.7	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-11.2	179.6	-66.7	172.4	0	0	0	114	F381 F459 L463 C756 C759 A760 L779 V784 L785	F381-L782 HydrophobicContact CZ-CD2 4.35Å; F459-L782 HydrophobicContact CD1-CD1 4.49Å; F459-L782 HydrophobicContact CE1-CD1 3.38Å; F459-L782 HydrophobicContact CE1-CD2 4.35Å; F459-L782 HydrophobicContact CE1-CG 4.5Å; F459-L782 HydrophobicContact CE2-CD1 4.45Å; F459-L782 HydrophobicContact CZ-CD1 3.35Å; L463-L782 HydrophobicContact CD2-CD2 4.45Å; C756-L782 HydrophobicContact CB-CB 4.42Å; C759-L782 HydrophobicContact CB-CD1 3.76Å; A760-L782 HydrophobicContact CB-CB 4.28Å; L779-L782 HydrophobicContact CB-CD1 4.04Å; L779-L782 HydrophobicContact CD2-CD1 3.91Å; L779-L782 WeakPolarHBondContact O-CB 3.28Å; L779-L782 WeakPolarHBondContact O-CG 3.32Å; L779-L782 PolarHBondContact O-N 3.44Å; L779-L782 VanDerWaalsContact O-N 3.09Å; L782-V784 PolarHBondContact O-N 3.48Å; L782-V784 VanDerWaalsContact O-N 3.09Å; L782-L785 HydrophobicContact CD2-CD1 4.01Å; L782-L785 PolarHBondContact O-N 3.12Å; L782-L785 VanDerWaalsContact O-N 3.08Å
783	Y	92.4	Very high	86.9	Confident	0 Å²	0	27 Å²	27	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-54.9	-26.4	171.9	70.8	-91.4	0	0	0	112.3	M276 L333 M733 L740 F747 R780 H781 L785 A786 A787	M276-Y783 HydrophobicContact CB-CE2 4.34Å; M276-Y783 HydrophobicContact CE-CD1 3.5Å; M276-Y783 VanDerWaalsContact CE-CD1 3.5Å; M276-Y783 HydrophobicContact CE-CD2 4.41Å; M276-Y783 HydrophobicContact CE-CE1 3.25Å; M276-Y783 HydrophobicContact CE-CE2 4.22Å; M276-Y783 HydrophobicContact CE-CG 4.1Å; M276-Y783 HydrophobicContact CG-CD2 4.28Å; M276-Y783 HydrophobicContact CG-CE1 3.92Å; M276-Y783 HydrophobicContact CG-CE2 3.49Å; M276-Y783 VanDerWaalsContact CG-CE2 3.49Å; M276-Y783 VanDerWaalsContact CG-OH 3.24Å; M276-Y783 WeakPolarHBondContact CG-OH 3.38Å; M276-Y783 PolarHBondContact N-OH 3.08Å; L333-Y783 WeakPolarHBondContact CD1-OH 3.18Å; M733-Y783 HydrophobicContact CE-CD1 4.36Å; L740-Y783 HydrophobicContact CD1-CD2 4.03Å; L740-Y783 HydrophobicContact CD1-CE2 3.93Å; F747-Y783 HydrophobicContact CE1-CD2 4.41Å; F747-Y783 WeakPolarHBondContact CE1-O 3.48Å; F747-Y783 HydrophobicContact CZ-CD2 4.48Å; R780-Y783 WeakPolarHBondContact O-CD1 3.45Å; H781-Y783 HydrophobicContact CB-CE1 4.27Å; H781-Y783 AromaticContact ND1-CE1 4Å; H781-Y783 PolarHBondContact O-N 3.01Å; H781-Y783 VanDerWaalsContact O-N 3.11Å; Y783-L785 VanDerWaalsContact C-N 3.26Å; Y783-L785 PolarHBondContact O-N 2.87Å; Y783-A786 WeakPolarHBondContact O-CB 3.41Å; Y783-A786 PolarHBondContact O-N 2.72Å; Y783-A787 PolarHBondContact O-N 3.08Å
784	V	93.3	Very high	86	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-32.9	179.4	176.9	0	0	0	0	112	L279 L333 L385 H781 L782 A786 A787	L279-V784 HydrophobicContact CD1-CG1 4.09Å; L279-V784 HydrophobicContact CD1-CG2 4.16Å; L333-V784 HydrophobicContact CD1-CG2 3.64Å; L333-V784 HydrophobicContact CD2-CB 4.29Å; L333-V784 HydrophobicContact CD2-CG1 3.88Å; L333-V784 HydrophobicContact CD2-CG2 3.66Å; L333-V784 HydrophobicContact CG-CG2 4.29Å; L385-V784 HydrophobicContact CB-CB 4.46Å; L385-V784 HydrophobicContact CB-CG1 4.05Å; L385-V784 HydrophobicContact CD1-CB 4.29Å; L385-V784 HydrophobicContact CD1-CG2 4.33Å; L385-V784 HydrophobicContact CD2-CB 4.47Å; H781-V784 WeakPolarHBondContact O-CG2 3.49Å; H781-V784 PolarHBondContact O-N 3.35Å; L782-V784 PolarHBondContact O-N 3.48Å; L782-V784 VanDerWaalsContact O-N 3.09Å; V784-A786 PolarHBondContact O-N 3.34Å; V784-A787 WeakPolarHBondContact O-CB 3.45Å; V784-A787 PolarHBondContact O-N 2.96Å
785	L	92	Very high	84.9	Confident	42 Å²	42	26.8 Å²	26.8	22%	0.22	13%	0.131	C	C	.	.	H	α-helix	trans	-68	-28.3	176.1	-64.6	178	0	0	0	111.9	L385 A418 V421 L463 C756 L782 Y783	L385-L785 HydrophobicContact CD2-CD1 4.35Å; L385-L785 HydrophobicContact CD2-CD2 3.98Å; L385-L785 HydrophobicContact CD2-CG 3.85Å; A418-L785 HydrophobicContact CB-CD1 4.37Å; A418-L785 HydrophobicContact CB-CD2 4.42Å; V421-L785 HydrophobicContact CG2-CD1 4.19Å; L463-L785 HydrophobicContact CD1-CD1 4.32Å; L463-L785 HydrophobicContact CD2-CD1 4.25Å; C756-L785 HydrophobicContact CB-CB 4.39Å; L782-L785 HydrophobicContact CD2-CD1 4.01Å; L782-L785 PolarHBondContact O-N 3.12Å; L782-L785 VanDerWaalsContact O-N 3.08Å; Y783-L785 VanDerWaalsContact C-N 3.26Å; Y783-L785 PolarHBondContact O-N 2.87Å
786	A	91	Very high	83.5	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-82.7	-14.4	174.7	0	0	0	0	0	113.4	F747 K748 S753 L757 Y783 V784	F747-A786 WeakPolarHBondContact CA-O 3.48Å; F747-A786 HydrophobicContact CD1-CB 3.65Å; F747-A786 HydrophobicContact CE1-CB 4.26Å; K748-A786 PolarHBondContact N-O 2.98Å; S753-A786 WeakPolarHBondContact OG-CA 3.2Å; L757-A786 HydrophobicContact CD1-CB 4.2Å; L757-A786 HydrophobicContact CD2-CB 4.01Å; L757-A786 HydrophobicContact CG-CB 3.76Å; Y783-A786 WeakPolarHBondContact O-CB 3.41Å; Y783-A786 PolarHBondContact O-N 2.72Å; V784-A786 PolarHBondContact O-N 3.34Å
787	A	90.1	Very high	81.8	Confident	6 Å²	6	29.4 Å²	29.4	5%	0.05	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.3	-173.1	0	0	0	0	0	112.8	L279 R280 L740 Y745 A746 F747 Y783 V784	L279-A787 HydrophobicContact CD2-CB 3.81Å; R280-A787 PolarHBondContact NH1-O 3.38Å; L740-A787 HydrophobicContact CD2-CB 4.13Å; Y745-A787 HydrophobicContact CD1-CB 4.38Å; A746-A787 CarbonylContact O-C 3.57Å; A746-A787 WeakPolarHBondContact O-CA 2.85Å; F747-A787 HydrophobicContact CE1-CB 4.33Å; Y783-A787 PolarHBondContact O-N 3.08Å; V784-A787 WeakPolarHBondContact O-CB 3.45Å; V784-A787 PolarHBondContact O-N 2.96Å
788	E	86.2	Confident	80	Confident	55 Å²	55	33.5 Å²	33.5	26%	0.257	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141.1	178	-176.2	170.4	-128.6	0	0	111.5	Y745 A746 K748 R790	Y745-E788 CarbonylContact C-O 3.52Å; Y745-E788 VanDerWaalsContact CA-O 3.24Å; Y745-E788 WeakPolarHBondContact CA-O 3.15Å; Y745-E788 VanDerWaalsContact CD1-C 3.43Å; A746-E788 PolarHBondContact N-O 3.25Å; A746-E788 PolarHBondContact O-N 2.72Å; K748-E788 HydrophobicContact CD-CB 4.29Å; K748-E788 VanDerWaalsContact CE-CB 3.48Å; K748-E788 WeakPolarHBondContact CE-OE1 3.24Å; K748-E788 WeakPolarHBondContact CE-OE2 3.28Å; K748-E788 HydrophobicContact CG-CB 3.75Å; K748-E788 HydrophobicContact CG-CG 4.47Å; K748-E788 WeakPolarHBondContact CG-OE2 3.09Å; K748-E788 VanDerWaalsContact NZ-CD 3.31Å; K748-E788 IonicContact NZ-OE1 2.65Å; K748-E788 PolarHBondContact NZ-OE1 2.86Å; K748-E788 IonicContact NZ-OE2 3.58Å; E788-R790 HydrophobicContact CB-CG 4.33Å; E788-R790 HydrophobicContact CG-CG 4.11Å; E788-R790 PolarHBondContact O-N 3.39Å; E788-R790 IonicContact OE2-CZ 3.18Å; E788-R790 IonicContact OE2-NE 3.7Å; E788-R790 PolarHBondContact OE2-NE 3.04Å; E788-R790 IonicContact OE2-NH2 2.85Å; E788-R790 PolarHBondContact OE2-NH2 3.28Å; E788-R790 VanDerWaalsContact OE2-NH2 3.16Å
789	R	83.1	Confident	78.8	Confident	125 Å²	125	37.7 Å²	37.7	47%	0.472	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	115	173.3	-174.4	176	-179.9	167	1.8	108.9	N744 Y745	N744-R789 WeakPolarHBondContact O-CA 3.12Å; Y745-R789 HydrophobicContact CD1-CB 4.27Å; Y745-R789 HydrophobicContact CE1-CB 3.87Å
790	R	74.6	Confident	77.5	Confident	15 Å²	15	39.7 Å²	39.7	6%	0.057	22%	0.219	C	C	.	.			trans	-128.2	7.9	-179	-67.2	-162.7	-176.7	169.5	-2.3	113.3	N744 A746 F747 E788 F831 Q832 E834	N744-R790 PolarHBondContact O-N 3.26Å; A746-R790 HydrophobicContact CB-CB 4.12Å; A746-R790 HydrophobicContact CB-CG 4.11Å; F747-R790 PolarHBondContact O-NH1 2.93Å; E788-R790 HydrophobicContact CB-CG 4.33Å; E788-R790 HydrophobicContact CG-CG 4.11Å; E788-R790 PolarHBondContact O-N 3.39Å; E788-R790 IonicContact OE2-CZ 3.18Å; E788-R790 IonicContact OE2-NE 3.7Å; E788-R790 PolarHBondContact OE2-NE 3.04Å; E788-R790 IonicContact OE2-NH2 2.85Å; E788-R790 PolarHBondContact OE2-NH2 3.28Å; E788-R790 VanDerWaalsContact OE2-NH2 3.16Å; R790-F831 HydrophobicContact CB-CD1 3.68Å; R790-F831 HydrophobicContact CB-CE1 4.17Å; R790-Q832 VanDerWaalsContact CD-O 3.27Å; R790-Q832 WeakPolarHBondContact CD-O 3.48Å; R790-Q832 PolarHBondContact O-N 3.11Å; R790-E834 IonicContact CZ-OE2 3.4Å; R790-E834 IonicContact NH1-OE2 3.11Å; R790-E834 IonicContact NH2-OE1 2.99Å; R790-E834 PolarHBondContact NH2-OE1 3.24Å; R790-E834 IonicContact NH2-OE2 3.38Å; R790-E834 PolarHBondContact NH2-OE2 3.23Å
791	S	71.1	Confident	76.2	Confident	26 Å²	26	41.8 Å²	41.8	18%	0.182	23%	0.234	C	C	.	.			trans	-72.3	133	169	54.6	0	0	0	0	111.2	N744	N744-S791 WeakPolarHBondContact CA-OG 3.12Å; N744-S791 WeakPolarHBondContact CB-OG 3.31Å; N744-S791 PolarHBondContact O-N 2.95Å; N744-S791 PolarHBondContact O-OG 3.22Å; N744-S791 WeakPolarHBondContact OD1-CB 3.47Å; N744-S791 PolarHBondContact OD1-OG 2.79Å
792	L	69.2	Low	74.8	Confident	68 Å²	68	42.5 Å²	42.5	36%	0.356	24%	0.238	S	C	.	.			trans	-106.8	125.1	170.2	-176.2	71	0	0	0	108.3	I807 W809	L792-I807 HydrophobicContact CD2-CD1 3.57Å; L792-W809 HydrophobicContact CD2-CH2 3.98Å; L792-W809 HydrophobicContact CD2-CZ2 4.03Å
793	E	66.5	Low	73.3	Confident	58 Å²	58	44.2 Å²	44.2	27%	0.271	25%	0.249	S	C	.	.			trans	-107.1	128.4	174.5	-178.3	177.3	177.7	0	0	108.7	L213 Q795 P802	L213-E793 HydrophobicContact CD2-CB 4.13Å; L213-E793 HydrophobicContact CD2-CG 3.77Å; E793-Q795 VanDerWaalsContact CD-NE2 3.29Å; E793-Q795 HydrophobicContact CG-CG 3.9Å; E793-Q795 PolarHBondContact OE1-NE2 2.8Å; E793-P802 HydrophobicContact CG-CB 4.15Å; E793-P802 WeakPolarHBondContact OE1-CB 3.47Å
794	V	67	Low	72	Confident	47 Å²	47	51 Å²	51	29%	0.285	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.9	168.7	-178.9	0	0	0	0	106.6	P802 V803 A805 I807	V794-P802 CarbonylContact O-C 3.59Å; V794-P802 VanDerWaalsContact O-CA 3.23Å; V794-P802 WeakPolarHBondContact O-CA 3.28Å; V794-V803 PolarHBondContact O-N 3.07Å; V794-A805 HydrophobicContact CB-CB 4.25Å; V794-A805 HydrophobicContact CG1-CB 3.98Å; V794-A805 HydrophobicContact CG2-CB 4.06Å; V794-I807 HydrophobicContact CG2-CD1 3.91Å
795	Q	65	Low	70.3	Confident	98 Å²	98	52.6 Å²	52.6	46%	0.458	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141.5	177.7	-64	-177.7	-21.4	0	0	108.9	E793 S797 S801	E793-Q795 VanDerWaalsContact CD-NE2 3.29Å; E793-Q795 HydrophobicContact CG-CG 3.9Å; E793-Q795 PolarHBondContact OE1-NE2 2.8Å; Q795-S797 PolarHBondContact O-N 3.13Å; Q795-S801 CarbonylContact C-O 3.57Å; Q795-S801 VanDerWaalsContact CA-O 3.3Å; Q795-S801 WeakPolarHBondContact CA-O 3.17Å
796	D	61.2	Low	68.6	Low	32 Å²	32	54.2 Å²	54.2	17%	0.171	30%	0.303	C	S	.	.			trans	-68.8	125.2	167.5	167	12.8	0	0	0	108.9	T798 T799 G800 S801 V803	D796-T798 VanDerWaalsContact C-N 3.25Å; D796-T798 VanDerWaalsContact CG-OG1 3.24Å; D796-T798 PolarHBondContact O-N 3.37Å; D796-T798 PolarHBondContact OD1-N 3.22Å; D796-T798 PolarHBondContact OD1-OG1 3.25Å; D796-T798 PolarHBondContact OD2-OG1 2.75Å; D796-T799 WeakPolarHBondContact CB-OG1 3.34Å; D796-T799 VanDerWaalsContact CG-OG1 3.24Å; D796-T799 WeakPolarHBondContact OD2-CB 3.34Å; D796-T799 VanDerWaalsContact OD2-CG2 3.26Å; D796-T799 WeakPolarHBondContact OD2-CG2 3.47Å; D796-T799 PolarHBondContact OD2-OG1 3.28Å; D796-G800 WeakPolarHBondContact O-CA 3.36Å; D796-G800 PolarHBondContact O-N 2.99Å; D796-S801 PolarHBondContact N-O 3.39Å; D796-V803 HydrophobicContact CB-CG2 3.52Å
797	S	56.4	Low	67.1	Low	39 Å²	39	55.8 Å²	55.8	27%	0.273	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-27.5	-179.5	44.3	0	0	0	0	114.1	Q795 E883 F884	Q795-S797 PolarHBondContact O-N 3.13Å; S797-E883 WeakPolarHBondContact OG-CA 3.15Å; S797-F884 PolarHBondContact OG-N 2.65Å; S797-F884 PolarHBondContact OG-O 2.93Å
798	T	53.9	Low	65.3	Low	88 Å²	88	57.2 Å²	57.2	54%	0.54	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-43.8	-177.5	64.2	0	0	0	0	111.3	D796 M885	D796-T798 VanDerWaalsContact C-N 3.25Å; D796-T798 VanDerWaalsContact CG-OG1 3.24Å; D796-T798 PolarHBondContact O-N 3.37Å; D796-T798 PolarHBondContact OD1-N 3.22Å; D796-T798 PolarHBondContact OD1-OG1 3.25Å; D796-T798 PolarHBondContact OD2-OG1 2.75Å; T798-M885 HydrophobicContact CG2-CG 4.13Å
799	T	67.5	Low	64	Low	89 Å²	89	58 Å²	58	55%	0.546	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-17.7	-176.9	61.1	0	0	0	0	113.8	D796 S801	D796-T799 WeakPolarHBondContact CB-OG1 3.34Å; D796-T799 VanDerWaalsContact CG-OG1 3.24Å; D796-T799 WeakPolarHBondContact OD2-CB 3.34Å; D796-T799 VanDerWaalsContact OD2-CG2 3.26Å; D796-T799 WeakPolarHBondContact OD2-CG2 3.47Å; D796-T799 PolarHBondContact OD2-OG1 3.28Å; T799-S801 PolarHBondContact O-N 3.39Å; T799-S801 WeakPolarHBondContact OG1-CB 3.44Å; T799-S801 PolarHBondContact OG1-N 2.99Å; T799-S801 PolarHBondContact OG1-OG 2.72Å
800	G	65.2	Low	62.6	Low	44 Å²	44	57.4 Å²	57.4	45%	0.454	32%	0.323	S	S	.	.			trans	66.4	4.7	-167.9	0	0	0	0	0	113.6	D796	D796-G800 WeakPolarHBondContact O-CA 3.36Å; D796-G800 PolarHBondContact O-N 2.99Å
801	S	65.5	Low	61.9	Low	46 Å²	46	62 Å²	62	32%	0.322	34%	0.343	S	S	.	.			trans	-84.8	145.6	-177.1	75.5	0	0	0	0	110.7	Q795 D796 T799	Q795-S801 CarbonylContact C-O 3.57Å; Q795-S801 VanDerWaalsContact CA-O 3.3Å; Q795-S801 WeakPolarHBondContact CA-O 3.17Å; D796-S801 PolarHBondContact N-O 3.39Å; T799-S801 PolarHBondContact O-N 3.39Å; T799-S801 WeakPolarHBondContact OG1-CB 3.44Å; T799-S801 PolarHBondContact OG1-N 2.99Å; T799-S801 PolarHBondContact OG1-OG 2.72Å
802	P	65.2	Low	61.1	Low	14 Å²	14	65.8 Å²	65.8	9%	0.091	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	151.7	174.1	12.9	-21.4	0	0	0	110.8	P212 R216 E793 V794	P212-P802 HydrophobicContact CB-CG 4.27Å; R216-P802 PolarHBondContact NH1-O 3.01Å; R216-P802 PolarHBondContact NH2-O 3.37Å; E793-P802 HydrophobicContact CG-CB 4.15Å; E793-P802 WeakPolarHBondContact OE1-CB 3.47Å; V794-P802 CarbonylContact O-C 3.59Å; V794-P802 VanDerWaalsContact O-CA 3.23Å; V794-P802 WeakPolarHBondContact O-CA 3.28Å
803	V	64	Low	60.3	Low	37 Å²	37	66.9 Å²	66.9	22%	0.224	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.3	175.8	178.4	0	0	0	0	110.2	V794 D796 W848	V794-V803 PolarHBondContact O-N 3.07Å; D796-V803 HydrophobicContact CB-CG2 3.52Å; V803-W848 HydrophobicContact CG1-CH2 4.36Å; V803-W848 HydrophobicContact CG1-CZ2 4.33Å
804	K	63.5	Low	59.1	Low	142 Å²	142	68 Å²	68	62%	0.617	39%	0.387	S	S	*	.			trans	-82.9	120.5	170.7	-69.6	-179.7	176.5	179.2	0	108.9	Y828	K804-Y828 HydrophobicContact CD-CE2 4.01Å; K804-Y828 HydrophobicContact CG-CD2 4.4Å; K804-Y828 HydrophobicContact CG-CE1 3.91Å; K804-Y828 HydrophobicContact CG-CE2 3.6Å; K804-Y828 VanDerWaalsContact CG-OH 3.23Å; K804-Y828 WeakPolarHBondContact CG-OH 3.41Å
805	A	58.2	Low	58	Low	34 Å²	34	70.8 Å²	70.8	28%	0.281	40%	0.404	S	S	.	.			trans	-125.9	149.1	172.2	0	0	0	0	0	110.5	V794	V794-A805 HydrophobicContact CB-CB 4.25Å; V794-A805 HydrophobicContact CG1-CB 3.98Å; V794-A805 HydrophobicContact CG2-CB 4.06Å
806	T	56.6	Low	57.1	Low	75 Å²	75	69.6 Å²	69.6	46%	0.46	40%	0.397	S	S	.	.			trans	-88.6	118	174.3	-58.6	0	0	0	0	108.6
807	I	58.5	Low	56	Low	34 Å²	34	72.4 Å²	72.4	17%	0.174	41%	0.412	C	S	.	.			trans	-117.7	129.3	-178.1	-59.2	168	0	0	0	108.6	L792 V794 W809 V829	L792-I807 HydrophobicContact CD2-CD1 3.57Å; V794-I807 HydrophobicContact CG2-CD1 3.91Å; I807-W809 HydrophobicContact CB-CZ2 4.32Å; I807-W809 HydrophobicContact CG2-CD2 4.3Å; I807-W809 HydrophobicContact CG2-CH2 4.33Å; I807-W809 HydrophobicContact CG2-CZ2 3.49Å; I807-W809 VanDerWaalsContact CG2-CZ2 3.49Å; I807-V829 HydrophobicContact CB-CG2 3.89Å; I807-V829 HydrophobicContact CD1-CG2 3.56Å; I807-V829 HydrophobicContact CG1-CG2 4.11Å
808	T	52.6	Low	55	Low	36 Å²	36	75.9 Å²	75.9	22%	0.221	43%	0.434	C	S	.	.	B	Isolated β-bridge	trans	-101.6	142.4	172.5	77.7	0	0	0	0	110.5	R841 D843	T808-R841 WeakPolarHBondContact CA-O 3.49Å; T808-R841 VanDerWaalsContact CB-O 3.27Å; T808-R841 WeakPolarHBondContact CB-O 3.48Å; T808-R841 PolarHBondContact N-O 3.38Å; T808-R841 PolarHBondContact O-N 3.03Å; T808-R841 WeakPolarHBondContact OG1-CA 3.49Å; T808-R841 WeakPolarHBondContact OG1-CB 3.31Å; T808-R841 PolarHBondContact OG1-O 3.01Å; T808-D843 HydrophobicContact CG2-CB 4.11Å
809	W	59.1	Low	54.2	Low	71 Å²	71	75.5 Å²	75.5	27%	0.269	44%	0.435	S	S	.	.			trans	-121	131.1	-173.8	-59.1	88.9	0	0	0	109.7	L792 I807 F811 V829 Q832 F837	L792-W809 HydrophobicContact CD2-CH2 3.98Å; L792-W809 HydrophobicContact CD2-CZ2 4.03Å; I807-W809 HydrophobicContact CB-CZ2 4.32Å; I807-W809 HydrophobicContact CG2-CD2 4.3Å; I807-W809 HydrophobicContact CG2-CH2 4.33Å; I807-W809 HydrophobicContact CG2-CZ2 3.49Å; I807-W809 VanDerWaalsContact CG2-CZ2 3.49Å; W809-F811 HydrophobicContact CB-CE2 4.4Å; W809-V829 HydrophobicContact CH2-CG1 4.39Å; W809-V829 HydrophobicContact CZ2-CB 4.38Å; W809-V829 HydrophobicContact CZ2-CG1 3.42Å; W809-V829 VanDerWaalsContact CZ2-CG1 3.42Å; W809-V829 HydrophobicContact CZ2-CG2 4.2Å; W809-Q832 HydrophobicContact CH2-CG 3.85Å; W809-Q832 HydrophobicContact CZ3-CG 3.94Å; W809-F837 HydrophobicContact CE3-CZ 4.39Å; W809-F837 HydrophobicContact CH2-CZ 4.18Å; W809-F837 HydrophobicContact CZ3-CE1 4.16Å; W809-F837 HydrophobicContact CZ3-CE2 4.05Å; W809-F837 AromaticContact CZ3-CZ 3.46Å; W809-F837 HydrophobicContact CZ3-CZ 3.46Å; W809-F837 VanDerWaalsContact CZ3-CZ 3.46Å
810	E	55	Low	52.8	Low	113 Å²	113	73.6 Å²	73.6	53%	0.528	42%	0.422	S	S	.	.			trans	-107.8	125.4	170.9	-66.4	-175.5	-179.3	0	0	109.5
811	F	58.9	Low	51.4	Low	111 Å²	111	75.8 Å²	75.8	49%	0.487	43%	0.426	S	S	.	.			trans	-94.3	130.3	179.2	-65.3	-106.3	0	0	0	109.7	W809 D813 P833	W809-F811 HydrophobicContact CB-CE2 4.4Å; F811-D813 VanDerWaalsContact C-N 3.34Å; F811-D813 PolarHBondContact O-N 2.84Å; F811-P833 HydrophobicContact CD1-CB 4.09Å; F811-P833 HydrophobicContact CD1-CG 3.88Å; F811-P833 HydrophobicContact CE1-CB 3.29Å; F811-P833 HydrophobicContact CE1-CG 3.03Å; F811-P833 HydrophobicContact CE2-CG 4.39Å; F811-P833 HydrophobicContact CZ-CB 4.02Å; F811-P833 HydrophobicContact CZ-CG 3.34Å
812	R	54.4	Low	49.5	Very low	105 Å²	105	78.6 Å²	78.6	40%	0.396	45%	0.445	S	S	.	.	S	Bend	trans	-70.2	-24.8	-177.5	-80.8	-164.2	-164.9	-178.4	0.5	115.1	I835 L836 F837 Q838	R812-I835 HydrophobicContact CB-CG2 4.32Å; R812-L836 VanDerWaalsContact CD-O 3.22Å; R812-L836 WeakPolarHBondContact CD-O 3.38Å; R812-L836 HydrophobicContact CG-CB 4.41Å; R812-L836 VanDerWaalsContact CG-O 3.25Å; R812-L836 WeakPolarHBondContact CG-O 3.44Å; R812-L836 PolarHBondContact NE-O 3.42Å; R812-F837 PolarHBondContact NH2-O 2.68Å; R812-Q838 HydrophobicContact CG-CB 4.42Å
813	D	51.3	Low	47.7	Very low	91 Å²	91	81.2 Å²	81.2	49%	0.487	46%	0.464	S	S	.	.	S	Bend	trans	-116.2	110.1	-176.5	-64.4	-36.4	0	0	0	109.2	F811 V815	F811-D813 VanDerWaalsContact C-N 3.34Å; F811-D813 PolarHBondContact O-N 2.84Å; D813-V815 HydrophobicContact CB-CG2 4.37Å; D813-V815 PolarHBondContact O-N 3.28Å
814	G	43.3	Very low	45.8	Very low	81 Å²	81	84.1 Å²	84.1	84%	0.835	49%	0.492	S	S	*	.			trans	-65.8	35.6	-179.3	0	0	0	0	0	115.7	F816	G814-F816 VanDerWaalsContact C-N 3.28Å
815	V	42.2	Very low	44.1	Very low	107 Å²	107	82.4 Å²	82.4	65%	0.648	49%	0.489	S	S	*	.			trans	-89.9	7.7	-178.3	-172.3	0	0	0	0	111.8	D813	D813-V815 HydrophobicContact CB-CG2 4.37Å; D813-V815 PolarHBondContact O-N 3.28Å
816	F	45.8	Very low	42.5	Very low	72 Å²	72	85.2 Å²	85.2	32%	0.316	51%	0.506	S	S	.	.	S	Bend	trans	-130.5	128.8	164.1	-76.8	-93	0	0	0	109.5	F676 G814	F676-F816 AromaticContact CD1-CE1 3.48Å; F676-F816 HydrophobicContact CD1-CE1 3.48Å; F676-F816 VanDerWaalsContact CD1-CE1 3.48Å; F676-F816 AromaticContact CD1-CZ 3.4Å; F676-F816 HydrophobicContact CD1-CZ 3.4Å; F676-F816 VanDerWaalsContact CD1-CZ 3.4Å; F676-F816 AromaticContact CE1-CE1 3.22Å; F676-F816 HydrophobicContact CE1-CE1 3.22Å; F676-F816 AromaticContact CE1-CZ 3.24Å; F676-F816 HydrophobicContact CE1-CZ 3.24Å; F676-F816 HydrophobicContact CZ-CE1 4.42Å; G814-F816 VanDerWaalsContact C-N 3.28Å
817	D	38.7	Very low	41.2	Very low	91 Å²	91	88.9 Å²	88.9	49%	0.487	52%	0.516	S	S	.	.			trans	-50.5	124.7	175.8	-99.4	-38.2	0	0	0	110.5	S819 D820	D817-S819 PolarHBondContact O-N 3.28Å; D817-D820 WeakPolarHBondContact O-CB 3.26Å; D817-D820 PolarHBondContact O-N 3.23Å
818	P	35.6	Very low	39.8	Very low	113 Å²	113	89.5 Å²	89.5	73%	0.734	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-58.2	-21.6	175.7	-21.6	30.9	0	0	0	113.2	D820 V821	P818-D820 PolarHBondContact O-N 3.15Å; P818-V821 PolarHBondContact O-N 2.96Å
819	S	37.1	Very low	38.9	Very low	80 Å²	80	88.9 Å²	88.9	56%	0.559	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-71.5	-11.9	177.5	52.8	0	0	0	0	114.1	D817 S822	D817-S819 PolarHBondContact O-N 3.28Å; S819-S822 PolarHBondContact O-OG 2.92Å
820	D	37.8	Very low	37.7	Very low	49 Å²	49	87.8 Å²	87.8	26%	0.262	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-87.4	-9.5	177	-113.5	16.7	0	0	0	114	C681 R683 D817 P818	C681-D820 PolarHBondContact SG-OD2 3.2Å; R683-D820 IonicContact CZ-OD1 3.34Å; R683-D820 IonicContact CZ-OD2 3.71Å; R683-D820 IonicContact NE-OD1 3.6Å; R683-D820 PolarHBondContact NE-OD1 2.91Å; R683-D820 IonicContact NE-OD2 3.96Å; R683-D820 PolarHBondContact NE-OD2 3.44Å; R683-D820 IonicContact NH2-OD1 3.28Å; R683-D820 PolarHBondContact NH2-OD1 3.28Å; R683-D820 IonicContact NH2-OD2 3.04Å; R683-D820 PolarHBondContact NH2-OD2 2.92Å; D817-D820 WeakPolarHBondContact O-CB 3.26Å; D817-D820 PolarHBondContact O-N 3.23Å; P818-D820 PolarHBondContact O-N 3.15Å
821	V	36.9	Very low	37.1	Very low	90 Å²	90	83.7 Å²	83.7	55%	0.545	50%	0.495	S	S	.	.	S	Bend	trans	-107.7	10.5	179.6	-162.1	0	0	0	0	110.6	P818 S823	P818-V821 PolarHBondContact O-N 2.96Å; V821-S823 CarbonylContact O-C 3.44Å; V821-S823 PolarHBondContact O-N 2.94Å
822	S	25.7	Very low	36.2	Very low	104 Å²	104	81.3 Å²	81.3	73%	0.727	49%	0.486	S	S	*	.			trans	-74.3	20.3	-175	80.4	0	0	0	0	115.8	S819	S819-S822 PolarHBondContact O-OG 2.92Å
823	S	25.7	Very low	35.5	Very low	70 Å²	70	78.6 Å²	78.6	49%	0.49	48%	0.481	S	S	.	.	S	Bend	trans	-103.4	113	153.1	48.5	0	0	0	0	107.2	V821 I825	V821-S823 CarbonylContact O-C 3.44Å; V821-S823 PolarHBondContact O-N 2.94Å; S823-I825 WeakPolarHBondContact O-CG1 3.26Å; S823-I825 PolarHBondContact O-N 2.88Å; S823-I825 WeakPolarHBondContact OG-CD1 3.44Å; S823-I825 WeakPolarHBondContact OG-CG1 3.34Å
824	A	24.6	Very low	34.7	Very low	98 Å²	98	77.5 Å²	77.5	81%	0.81	47%	0.473	S	S	*	.			trans	-48.9	85.7	145.2	0	0	0	0	0	107.2	S826	A824-S826 PolarHBondContact O-N 3.44Å
825	I	28.9	Very low	34.2	Very low	106 Å²	106	78.5 Å²	78.5	54%	0.544	46%	0.458	S	S	.	.			trans	-79.8	91.7	173.7	-66.2	-177.7	0	0	0	103.1	S823 F827	S823-I825 WeakPolarHBondContact O-CG1 3.26Å; S823-I825 PolarHBondContact O-N 2.88Å; S823-I825 WeakPolarHBondContact OG-CD1 3.44Å; S823-I825 WeakPolarHBondContact OG-CG1 3.34Å; I825-F827 HydrophobicContact CB-CD2 4.4Å; I825-F827 HydrophobicContact CG2-CB 3.65Å; I825-F827 HydrophobicContact CG2-CD2 3.39Å; I825-F827 HydrophobicContact CG2-CE2 4.42Å; I825-F827 HydrophobicContact CG2-CG 3.91Å; I825-F827 PolarHBondContact O-N 3.01Å
826	S	24.5	Very low	33.7	Very low	93 Å²	93	78.8 Å²	78.8	65%	0.65	46%	0.456	S	S	*	.			trans	-63.3	46.9	166.1	49.5	0	0	0	0	111.6	A824	A824-S826 PolarHBondContact O-N 3.44Å
827	F	28.3	Very low	32.9	Very low	151 Å²	151	79.8 Å²	79.8	66%	0.662	46%	0.46	S	S	*	.	S	Bend	trans	-132.1	135.1	177	-59.9	-100.3	0	0	0	108.4	I825 V829	I825-F827 HydrophobicContact CB-CD2 4.4Å; I825-F827 HydrophobicContact CG2-CB 3.65Å; I825-F827 HydrophobicContact CG2-CD2 3.39Å; I825-F827 HydrophobicContact CG2-CE2 4.42Å; I825-F827 HydrophobicContact CG2-CG 3.91Å; I825-F827 PolarHBondContact O-N 3.01Å; F827-V829 PolarHBondContact O-N 3.03Å; F827-V829 VanDerWaalsContact O-N 3.15Å
828	Y	30.1	Very low	32.3	Very low	48 Å²	48	81.4 Å²	81.4	19%	0.188	47%	0.465	C	S	.	.			trans	-22.6	112.2	172.5	-72.8	-83.6	0	0	0	112.7	R216 K804 P830	R216-Y828 HydrophobicContact CB-CE1 4.3Å; R216-Y828 HydrophobicContact CB-CE2 3.71Å; R216-Y828 WeakPolarHBondContact CB-OH 2.84Å; R216-Y828 VanDerWaalsContact CD-OH 3.24Å; R216-Y828 WeakPolarHBondContact CD-OH 3.41Å; R216-Y828 WeakPolarHBondContact CG-OH 3.43Å; R216-Y828 PolarHBondContact NH1-OH 2.94Å; R216-Y828 WeakPolarHBondContact O-CE2 3.08Å; K804-Y828 HydrophobicContact CD-CE2 4.01Å; K804-Y828 HydrophobicContact CG-CD2 4.4Å; K804-Y828 HydrophobicContact CG-CE1 3.91Å; K804-Y828 HydrophobicContact CG-CE2 3.6Å; K804-Y828 VanDerWaalsContact CG-OH 3.23Å; K804-Y828 WeakPolarHBondContact CG-OH 3.41Å; Y828-P830 WeakPolarHBondContact O-CD 3.41Å
829	V	32.4	Very low	32.1	Very low	22 Å²	22	78.2 Å²	78.2	13%	0.133	45%	0.452	C	S	.	.			trans	-45.9	103.2	-176.7	179.7	0	0	0	0	109.4	I807 W809 F827	I807-V829 HydrophobicContact CB-CG2 3.89Å; I807-V829 HydrophobicContact CD1-CG2 3.56Å; I807-V829 HydrophobicContact CG1-CG2 4.11Å; W809-V829 HydrophobicContact CH2-CG1 4.39Å; W809-V829 HydrophobicContact CZ2-CB 4.38Å; W809-V829 HydrophobicContact CZ2-CG1 3.42Å; W809-V829 VanDerWaalsContact CZ2-CG1 3.42Å; W809-V829 HydrophobicContact CZ2-CG2 4.2Å; F827-V829 PolarHBondContact O-N 3.03Å; F827-V829 VanDerWaalsContact O-N 3.15Å
830	P	35.5	Very low	31.9	Very low	49 Å²	49	76.4 Å²	76.4	32%	0.318	45%	0.446	S	S	.	.			trans	-80.8	-25.6	-169.7	27.5	-26.9	0	0	0	111	Y828	Y828-P830 WeakPolarHBondContact O-CD 3.41Å
831	F	42.5	Very low	31.5	Very low	26 Å²	26	81.3 Å²	81.3	11%	0.114	46%	0.461	C	S	.	.			trans	-154.4	129.2	-175.7	-73.6	-63.5	0	0	0	113.3	G700 Y745 A746 R790 P833	G700-F831 WeakPolarHBondContact O-CE2 3.5Å; G700-F831 WeakPolarHBondContact O-CZ 3.22Å; Y745-F831 WeakPolarHBondContact O-CE1 3.11Å; Y745-F831 WeakPolarHBondContact O-CZ 3.32Å; A746-F831 HydrophobicContact CB-CD1 3.1Å; A746-F831 HydrophobicContact CB-CE1 3.02Å; A746-F831 HydrophobicContact CB-CG 4.11Å; A746-F831 HydrophobicContact CB-CZ 3.95Å; R790-F831 HydrophobicContact CB-CD1 3.68Å; R790-F831 HydrophobicContact CB-CE1 4.17Å; F831-P833 WeakPolarHBondContact O-CD 3.41Å
832	Q	40.1	Very low	31.4	Very low	62 Å²	62	79.9 Å²	79.9	29%	0.29	45%	0.448	S	S	.	.			trans	-67.5	124.4	156.4	-70.5	-170.6	-18.1	0	0	108.9	R790 W809	R790-Q832 VanDerWaalsContact CD-O 3.27Å; R790-Q832 WeakPolarHBondContact CD-O 3.48Å; R790-Q832 PolarHBondContact O-N 3.11Å; W809-Q832 HydrophobicContact CH2-CG 3.85Å; W809-Q832 HydrophobicContact CZ3-CG 3.94Å
833	P	38	Very low	31.9	Very low	47 Å²	47	79.8 Å²	79.8	31%	0.305	44%	0.439	S	S	.	.			trans	-68.2	142.5	167.2	15.6	-10.1	0	0	0	109.7	F811 F831 I835	F811-P833 HydrophobicContact CD1-CB 4.09Å; F811-P833 HydrophobicContact CD1-CG 3.88Å; F811-P833 HydrophobicContact CE1-CB 3.29Å; F811-P833 HydrophobicContact CE1-CG 3.03Å; F811-P833 HydrophobicContact CE2-CG 4.39Å; F811-P833 HydrophobicContact CZ-CB 4.02Å; F811-P833 HydrophobicContact CZ-CG 3.34Å; F831-P833 WeakPolarHBondContact O-CD 3.41Å; P833-I835 PolarHBondContact O-N 3.31Å; P833-I835 VanDerWaalsContact O-N 3.15Å
834	E	36	Very low	32.3	Very low	69 Å²	69	79.1 Å²	79.1	32%	0.322	44%	0.439	S	S	.	.	S	Bend	trans	-72.4	104.9	176.1	-159.2	166.8	-167	0	0	107.8	V749 R790	V749-E834 WeakPolarHBondContact CA-OE2 3.49Å; V749-E834 VanDerWaalsContact CB-OE2 3.24Å; V749-E834 WeakPolarHBondContact CB-OE2 3.36Å; V749-E834 WeakPolarHBondContact CG2-OE2 3.26Å; V749-E834 PolarHBondContact N-OE1 3.4Å; V749-E834 PolarHBondContact N-OE2 3.29Å; R790-E834 IonicContact CZ-OE2 3.4Å; R790-E834 IonicContact NH1-OE2 3.11Å; R790-E834 IonicContact NH2-OE1 2.99Å; R790-E834 PolarHBondContact NH2-OE1 3.24Å; R790-E834 IonicContact NH2-OE2 3.38Å; R790-E834 PolarHBondContact NH2-OE2 3.23Å
835	I	32.8	Very low	32.6	Very low	101 Å²	101	80 Å²	80	52%	0.518	43%	0.43	S	S	.	.	S	Bend	trans	168.4	125.2	153.9	-82.3	146.7	0	0	0	110	R812 P833	R812-I835 HydrophobicContact CB-CG2 4.32Å; P833-I835 PolarHBondContact O-N 3.31Å; P833-I835 VanDerWaalsContact O-N 3.15Å
836	L	30.1	Very low	32.9	Very low	113 Å²	113	81.3 Å²	81.3	59%	0.592	45%	0.445	S	S	*	.			trans	18.8	98.6	161.7	-72.4	153.3	0	0	0	118.3	R812 Q838	R812-L836 VanDerWaalsContact CD-O 3.22Å; R812-L836 WeakPolarHBondContact CD-O 3.38Å; R812-L836 HydrophobicContact CG-CB 4.41Å; R812-L836 VanDerWaalsContact CG-O 3.25Å; R812-L836 WeakPolarHBondContact CG-O 3.44Å; R812-L836 PolarHBondContact NE-O 3.42Å; L836-Q838 PolarHBondContact O-N 2.85Å
837	F	29	Very low	33.5	Very low	94 Å²	94	81.5 Å²	81.5	41%	0.412	44%	0.442	S	S	.	.			trans	-57.8	124.9	174.1	-110.1	-96.7	0	0	0	113.7	W809 R812	W809-F837 HydrophobicContact CE3-CZ 4.39Å; W809-F837 HydrophobicContact CH2-CZ 4.18Å; W809-F837 HydrophobicContact CZ3-CE1 4.16Å; W809-F837 HydrophobicContact CZ3-CE2 4.05Å; W809-F837 AromaticContact CZ3-CZ 3.46Å; W809-F837 HydrophobicContact CZ3-CZ 3.46Å; W809-F837 VanDerWaalsContact CZ3-CZ 3.46Å; R812-F837 PolarHBondContact NH2-O 2.68Å
838	Q	27.7	Very low	33.7	Very low	125 Å²	125	79 Å²	79	58%	0.584	43%	0.428	S	S	*	.			trans	-126.8	106.4	154.3	-119	169.8	-5.5	0	0	105.3	R812 L836	R812-Q838 HydrophobicContact CG-CB 4.42Å; L836-Q838 PolarHBondContact O-N 2.85Å
839	G	31.7	Very low	33.9	Very low	45 Å²	45	81.7 Å²	81.7	46%	0.464	44%	0.443	S	S	.	.			trans	34.1	112.4	171.6	0	0	0	0	0	119.1
840	G	30.9	Very low	33.7	Very low	42 Å²	42	88.5 Å²	88.5	43%	0.433	47%	0.466	S	S	.	.			trans	-71.4	138	162.4	0	0	0	0	0	110.9
841	R	30.9	Very low	33.7	Very low	152 Å²	152	89.4 Å²	89.4	57%	0.574	47%	0.468	S	S	*	.	B	Isolated β-bridge	trans	-97.4	143.6	167.5	-93	175.7	171.5	176.5	-0.6	108.6	T808	T808-R841 WeakPolarHBondContact CA-O 3.49Å; T808-R841 VanDerWaalsContact CB-O 3.27Å; T808-R841 WeakPolarHBondContact CB-O 3.48Å; T808-R841 PolarHBondContact N-O 3.38Å; T808-R841 PolarHBondContact O-N 3.03Å; T808-R841 WeakPolarHBondContact OG1-CA 3.49Å; T808-R841 WeakPolarHBondContact OG1-CB 3.31Å; T808-R841 PolarHBondContact OG1-O 3.01Å
842	E	34.5	Very low	32.9	Very low	60 Å²	60	94 Å²	94	28%	0.28	49%	0.49	S	S	.	.			trans	-105.6	115.4	163.9	-70	-176.7	156.7	0	0	107.5
843	D	35.6	Very low	32.6	Very low	102 Å²	102	98.6 Å²	98.6	55%	0.545	51%	0.511	S	S	.	.			trans	-84.3	112.9	169	-80.4	-28.8	0	0	0	107.8	T808	T808-D843 HydrophobicContact CG2-CB 4.11Å
844	A	34.2	Very low	32	Very low	57 Å²	57	101 Å²	101	47%	0.471	53%	0.534	S	S	.	.			trans	-88.9	127	-169.4	0	0	0	0	0	112.5	W848	A844-W848 WeakPolarHBondContact CB-O 3.32Å
845	D	30.4	Very low	31.7	Very low	116 Å²	116	100.6 Å²	100.6	62%	0.62	54%	0.543	S	S	*	.			trans	-56.1	150.1	137.5	-90.2	-39	0	0	0	109.2	V847 W848	D845-V847 PolarHBondContact O-N 2.8Å; D845-W848 PolarHBondContact O-N 2.82Å
846	P	35.5	Very low	31.4	Very low	134 Å²	134	100.3 Å²	100.3	87%	0.87	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	0.6	-171.6	23.3	-34	0	0	0	116.4
847	V	38.3	Very low	31.4	Very low	97 Å²	97	100.9 Å²	100.9	59%	0.588	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-18.8	-177.7	-178.2	0	0	0	0	112.8	D845	D845-V847 PolarHBondContact O-N 2.8Å
848	W	31.8	Very low	31.2	Very low	97 Å²	97	106.3 Å²	106.3	37%	0.367	58%	0.582	S	S	.	*	S	Bend	trans	-121.8	129.7	-171.9	-54.9	107.7	0	0	0	112.3	V803 A844 D845 F884	V803-W848 HydrophobicContact CG1-CH2 4.36Å; V803-W848 HydrophobicContact CG1-CZ2 4.33Å; A844-W848 WeakPolarHBondContact CB-O 3.32Å; D845-W848 PolarHBondContact O-N 2.82Å; W848-F884 HydrophobicContact CE3-CB 4.09Å; W848-F884 HydrophobicContact CZ3-CB 4.15Å
849	Q	34.3	Very low	31.2	Very low	105 Å²	105	108.1 Å²	108.1	49%	0.491	60%	0.595	S	S	.	*			trans	-81.1	149.4	176.8	-73.7	-177	-9.9	0	0	111.2	F884	Q849-F884 HydrophobicContact CB-CD1 4.4Å; Q849-F884 HydrophobicContact CB-CE1 4.01Å; Q849-F884 WeakPolarHBondContact O-CE1 3.35Å; Q849-F884 WeakPolarHBondContact O-CZ 3.34Å
850	R	27.5	Very low	30.9	Very low	166 Å²	166	113 Å²	113	63%	0.626	61%	0.605	S	S	*	*			trans	-74.7	129.3	-174.8	-82.8	178.1	175.8	158.4	-3.3	112.9
851	L	36.4	Very low	30.7	Very low	68 Å²	68	118.6 Å²	118.6	36%	0.356	62%	0.62	S	S	.	*			trans	-102.2	104.4	162.3	-105.3	161.4	0	0	0	111	H853 F882 F884	L851-H853 HydrophobicContact CD2-CB 4.3Å; L851-F882 HydrophobicContact CD1-CB 4.43Å; L851-F882 HydrophobicContact CD1-CD1 3.82Å; L851-F884 HydrophobicContact CB-CE2 4.39Å; L851-F884 HydrophobicContact CB-CZ 3.85Å; L851-F884 HydrophobicContact CD1-CE1 4.25Å; L851-F884 HydrophobicContact CD1-CE2 3.56Å; L851-F884 HydrophobicContact CD1-CZ 3.41Å; L851-F884 VanDerWaalsContact CD1-CZ 3.41Å; L851-F884 HydrophobicContact CG-CE1 4.46Å; L851-F884 HydrophobicContact CG-CE2 4.3Å; L851-F884 HydrophobicContact CG-CZ 3.69Å
852	E	26.5	Very low	30.6	Very low	122 Å²	122	117.5 Å²	117.5	57%	0.57	64%	0.635	S	S	*	*			trans	-95	75.5	165.6	-77.9	174.7	150.4	0	0	108.9	K164	K164-E852 IonicContact NZ-OE1 2.99Å; K164-E852 IonicContact NZ-OE2 3.95Å; K164-E852 PolarHBondContact NZ-OE2 3.38Å
853	H	33.6	Very low	30.1	Very low	159 Å²	159	123.6 Å²	123.6	74%	0.736	66%	0.664	S	S	*	*			trans	-135.1	121.2	170.2	-101.6	-79.5	0	0	0	113.2	L851 A855	L851-H853 HydrophobicContact CD2-CB 4.3Å; H853-A855 PolarHBondContact O-N 2.88Å
854	A	25.2	Very low	29.6	Very low	96 Å²	96	127.1 Å²	127.1	79%	0.793	68%	0.681	S	S	*	*			trans	-68	106.7	-176.7	0	0	0	0	0	112.5
855	A	29.9	Very low	29	Very low	61 Å²	61	128.2 Å²	128.2	50%	0.504	70%	0.698	S	S	.	*			trans	-95.5	91.9	166.4	0	0	0	0	0	110	H853 T857	H853-A855 PolarHBondContact O-N 2.88Å; A855-T857 PolarHBondContact O-N 3.2Å
856	A	25.3	Very low	28.8	Very low	95 Å²	95	127 Å²	127	79%	0.785	70%	0.704	S	S	*	*			trans	-83.9	93.5	164.9	0	0	0	0	0	109	R858	A856-R858 PolarHBondContact O-N 3.45Å
857	T	29.7	Very low	28.1	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	71%	0.708	S	S	*	*			trans	-72.3	107.3	168	-1.6	0	0	0	0	108.7	A855 L859	A855-T857 PolarHBondContact O-N 3.2Å; T857-L859 PolarHBondContact O-N 2.9Å; T857-L859 VanDerWaalsContact O-N 3.1Å
858	R	24.6	Very low	27.5	Very low	207 Å²	207	136.2 Å²	136.2	78%	0.781	72%	0.722	S	S	*	*			trans	-69.8	97.5	178.7	-145.1	-176.5	-149.4	176.2	7.1	109.4	A856 E860	A856-R858 PolarHBondContact O-N 3.45Å; R858-E860 PolarHBondContact O-N 3.28Å
859	L	28.4	Very low	27.1	Very low	164 Å²	164	137.1 Å²	137.1	86%	0.859	74%	0.743	S	S	*	*			trans	-78.7	92.8	161.6	-92.7	157	0	0	0	107.9	T857 H861	T857-L859 PolarHBondContact O-N 2.9Å; T857-L859 VanDerWaalsContact O-N 3.1Å; L859-H861 VanDerWaalsContact C-N 3.34Å; L859-H861 PolarHBondContact O-N 2.82Å
860	E	25	Very low	26.6	Very low	146 Å²	146	136.7 Å²	136.7	68%	0.682	75%	0.752	S	S	*	*			trans	-67.3	90.7	167.5	-70.1	-173.4	168.2	0	0	109.2	R858	R858-E860 PolarHBondContact O-N 3.28Å
861	H	27.8	Very low	26.5	Very low	160 Å²	160	134.9 Å²	134.9	74%	0.741	76%	0.762	S	S	*	*			trans	-167.3	125.2	147	-82.5	-53.1	0	0	0	109	L859	L859-H861 VanDerWaalsContact C-N 3.34Å; L859-H861 PolarHBondContact O-N 2.82Å
862	S	27.5	Very low	26	Very low	129 Å²	129	139.6 Å²	139.6	90%	0.902	79%	0.786	S	S	*	*	S	Bend	trans	91.9	134.2	177.7	81.3	0	0	0	0	116.9
863	Q	24.5	Very low	26	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.883	80%	0.803	S	S	*	*			trans	-67.2	124.4	-161.9	-61.8	165.5	-31.5	0	0	112.3
864	I	25.9	Very low	25.6	Very low	176 Å²	176	144.7 Å²	144.7	90%	0.903	81%	0.812	S	S	*	*			trans	-177.1	125.3	142.6	-84.3	141.1	0	0	0	107
865	G	21.9	Very low	25.6	Very low	80 Å²	80	143.7 Å²	143.7	83%	0.825	80%	0.803	S	S	*	*			trans	-87.5	143.7	-169.5	0	0	0	0	0	115.2
866	A	24.3	Very low	25.4	Very low	91 Å²	91	148.9 Å²	148.9	75%	0.752	82%	0.815	S	S	*	*			trans	-140.9	116	153	0	0	0	0	0	108.9
867	R	21.4	Very low	25.3	Very low	251 Å²	251	147.8 Å²	147.8	95%	0.947	81%	0.813	S	S	*	*			trans	-82.1	127.4	173.2	-81.5	177.1	171	174.1	-3	108.9
868	I	25.9	Very low	25.1	Very low	172 Å²	172	148 Å²	148	88%	0.882	81%	0.805	S	S	*	*			trans	-131.6	120.7	154.7	-58.4	179.7	0	0	0	107.6
869	S	22.9	Very low	25.2	Very low	116 Å²	116	148.2 Å²	148.2	81%	0.811	81%	0.806	S	S	*	*			trans	-96.9	114.3	-174.4	48.6	0	0	0	0	111.2
870	S	24.9	Very low	25	Very low	96 Å²	96	150.9 Å²	150.9	67%	0.671	81%	0.805	S	S	*	*			trans	-152.3	136	144.2	77	0	0	0	0	109.4	L872	S870-L872 PolarHBondContact O-N 3.3Å
871	P	24.2	Very low	25.1	Very low	129 Å²	129	148.6 Å²	148.6	84%	0.838	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	88.8	-172.2	34.4	-28.4	0	0	0	110.5
872	L	26.3	Very low	25.1	Very low	167 Å²	167	147.1 Å²	147.1	87%	0.874	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.3	4.9	164.5	-105.9	165.9	0	0	0	115.3	S870	S870-L872 PolarHBondContact O-N 3.3Å
873	L	27.2	Very low	25.1	Very low	174 Å²	174	144 Å²	144	91%	0.911	76%	0.764	S	S	*	*			trans	-106	70.2	-179.2	-87.7	156	0	0	0	111.7
874	K	24.8	Very low	25.2	Very low	213 Å²	213	137.3 Å²	137.3	93%	0.926	73%	0.731	S	S	*	*			trans	-133.4	25.2	178.7	-133.2	-177.2	-172.8	-175.3	0	115
875	A	25.6	Very low	25.2	Very low	75 Å²	75	134.2 Å²	134.2	62%	0.62	71%	0.714	S	S	*	*	S	Bend	trans	-128.2	-13.7	-172.3	0	0	0	0	0	118.1
876	F	26.2	Very low	25.4	Very low	170 Å²	170	134.3 Å²	134.3	75%	0.746	70%	0.703	S	S	*	*			trans	-142.7	103.4	-178.5	-68.7	-81	0	0	0	112.1
877	G	23.2	Very low	25.6	Very low	72 Å²	72	138.7 Å²	138.7	74%	0.742	71%	0.708	S	S	*	*			trans	-82.5	151.9	166.3	0	0	0	0	0	110.9
878	E	25	Very low	25.8	Very low	131 Å²	131	136 Å²	136	61%	0.612	71%	0.706	S	S	*	*			trans	67.5	95.2	179.7	-55.1	-169.6	140.3	0	0	115.8	R345	R345-E878 IonicContact NH1-OE2 2.99Å; R345-E878 PolarHBondContact NH1-OE2 2.89Å
879	W	25.7	Very low	25.9	Very low	211 Å²	211	135.9 Å²	135.9	80%	0.799	71%	0.706	S	S	*	*			trans	-125.6	105.7	159.1	-68.4	91.1	0	0	0	110
880	R	24.7	Very low	25.9	Very low	220 Å²	220	133.9 Å²	133.9	83%	0.83	70%	0.704	S	S	*	*			trans	-98.9	117.8	150.6	-73.3	-177.9	-178.7	-176.1	0.3	105.5
881	V	27.8	Very low	25.8	Very low	98 Å²	98	133.7 Å²	133.7	59%	0.594	71%	0.708	S	S	*	*			trans	179.9	127.9	149.6	171	0	0	0	0	105.5	E883	V881-E883 HydrophobicContact CG1-CG 3.88Å
882	F	27.6	Very low	25.9	Very low	130 Å²	130	133.8 Å²	133.8	57%	0.57	71%	0.71	S	S	*	*			trans	-109.3	122.7	158.6	-73.8	-79.5	0	0	0	106.4	L851	L851-F882 HydrophobicContact CD1-CB 4.43Å; L851-F882 HydrophobicContact CD1-CD1 3.82Å
883	E	26.5	Very low	25.7	Very low	64 Å²	64	135.5 Å²	135.5	30%	0.299	71%	0.714	S	S	.	*			trans	-90.9	132	-175.2	-75.9	176.4	146.3	0	0	111.1	R175 Y177 S797 V881	R175-E883 IonicContact CZ-OE1 3.62Å; R175-E883 IonicContact NH2-OE1 2.75Å; R175-E883 PolarHBondContact NH2-OE1 2.89Å; R175-E883 IonicContact NH2-OE2 2.64Å; Y177-E883 PolarHBondContact OH-OE1 2.79Å; S797-E883 WeakPolarHBondContact OG-CA 3.15Å; V881-E883 HydrophobicContact CG1-CG 3.88Å
884	F	27.5	Very low	25.7	Very low	47 Å²	47	130.5 Å²	130.5	21%	0.206	71%	0.705	C	S	.	*			trans	-149	134.1	160.3	-74.3	-66.1	0	0	0	111	S797 W848 Q849 L851	S797-F884 PolarHBondContact OG-N 2.65Å; S797-F884 PolarHBondContact OG-O 2.93Å; W848-F884 HydrophobicContact CE3-CB 4.09Å; W848-F884 HydrophobicContact CZ3-CB 4.15Å; Q849-F884 HydrophobicContact CB-CD1 4.4Å; Q849-F884 HydrophobicContact CB-CE1 4.01Å; Q849-F884 WeakPolarHBondContact O-CE1 3.35Å; Q849-F884 WeakPolarHBondContact O-CZ 3.34Å; L851-F884 HydrophobicContact CB-CE2 4.39Å; L851-F884 HydrophobicContact CB-CZ 3.85Å; L851-F884 HydrophobicContact CD1-CE1 4.25Å; L851-F884 HydrophobicContact CD1-CE2 3.56Å; L851-F884 HydrophobicContact CD1-CZ 3.41Å; L851-F884 VanDerWaalsContact CD1-CZ 3.41Å; L851-F884 HydrophobicContact CG-CE1 4.46Å; L851-F884 HydrophobicContact CG-CE2 4.3Å; L851-F884 HydrophobicContact CG-CZ 3.69Å
885	M	24.9	Very low	25.8	Very low	111 Å²	111	127.6 Å²	127.6	55%	0.547	70%	0.704	S	S	.	*			trans	-100.3	146.2	174.5	-64.4	-161.2	-44.1	0	0	111.5	T174 T798	T174-M885 HydrophobicContact CG2-CE 3.35Å; T174-M885 HydrophobicContact CG2-SD 3.39Å; T174-M885 WeakPolarHBondContact CG2-SD 3.47Å; T798-M885 HydrophobicContact CG2-CG 4.13Å
886	S	27.7	Very low	25.8	Very low	83 Å²	83	134.4 Å²	134.4	58%	0.58	71%	0.714	S	S	*	*			trans	-115.6	128.3	163.2	70.4	0	0	0	0	110.8
887	E	27.1	Very low	26	Very low	183 Å²	183	133.3 Å²	133.3	86%	0.855	72%	0.716	S	S	*	*			trans	-75.2	135.2	166.8	-77.4	179.9	149.1	0	0	111.1
888	E	25.4	Very low	26.2	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	72%	0.722	S	S	*	*			trans	-69.9	129	170.9	-66.6	-179.6	149.1	0	0	111.2
889	L	27.9	Very low	26.4	Very low	171 Å²	171	135.9 Å²	135.9	90%	0.895	73%	0.727	S	S	*	*			trans	-131.1	102.8	160.3	-88.1	165.4	0	0	0	109.6
890	G	22.8	Very low	26.5	Very low	74 Å²	74	136.1 Å²	136.1	76%	0.763	73%	0.734	S	S	*	*			trans	-77.7	135.5	159.1	0	0	0	0	0	110.6
891	A	24	Very low	26.6	Very low	92 Å²	92	130.6 Å²	130.6	76%	0.76	74%	0.735	S	S	*	*			trans	172.1	121	145	0	0	0	0	0	109.2
892	C	25.8	Very low	26.7	Very low	130 Å²	130	129.1 Å²	129.1	88%	0.878	74%	0.74	S	S	*	*				160.6	89.1	128.1	-84	0	0	0	0	110.5
893	E	22.9	Very low	26.6	Very low	203 Å²	203	131.8 Å²	131.8	95%	0.949	75%	0.754	S	S	*	*			trans	-66.3	151.8	153	-70.3	-176.7	139	0	0	110.7
894	G	25.7	Very low	26.6	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	78%	0.78	S	S	*	*			trans	140.5	100.3	155	0	0	0	0	0	114.6
895	V	28.8	Very low	26.4	Very low	151 Å²	151	142 Å²	142	92%	0.915	81%	0.813	S	S	*	*				168.2	113.8	120.1	163.2	0	0	0	0	109.2
896	R	23.7	Very low	26.4	Very low	219 Å²	219	143.3 Å²	143.3	83%	0.826	82%	0.821	S	S	*	*			trans	-80.1	151	168.1	-75.9	175.9	171.4	176.9	-2.4	110.8
897	N	31	Very low	26.3	Very low	147 Å²	147	147.4 Å²	147.4	79%	0.786	83%	0.831	S	S	*	*			trans	175.5	103.5	130.8	-89	-10.9	0	0	0	108
898	E	26.9	Very low	26.2	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.874	83%	0.833	S	S	*	*				69.5	120	88.6	-76.8	-159.4	-179.4	0	0	115.5
899	G	30	Very low	26.4	Very low	70 Å²	70	144.8 Å²	144.8	72%	0.722	83%	0.826	S	S	*	*			trans	144	92	150.7	0	0	0	0	0	117.5
900	K	28	Very low	26.3	Very low	216 Å²	216	142.8 Å²	142.8	94%	0.939	82%	0.821	S	S	*	*			trans	45.1	140.3	132.8	-59.8	175	-178.7	176.5	0	118.7
901	A	27	Very low	26.4	Very low	103 Å²	103	146.6 Å²	146.6	85%	0.851	82%	0.823	S	S	*	*			cis	179.9	162.6	1.7	0	0	0	0	0	105.8
902	G	28.7	Very low	26.4	Very low	67 Å²	67	154.5 Å²	154.5	69%	0.691	83%	0.834	S	S	*	*			trans	113.1	91.9	150.2	0	0	0	0	0	118.2
903	H	25.7	Very low	26.4	Very low	187 Å²	187	153.2 Å²	153.2	87%	0.866	83%	0.832	S	S	*	*			trans	28	118.7	137	-65.4	-80.8	0	0	0	120.1
904	S	27	Very low	26.4	Very low	123 Å²	123	151.5 Å²	151.5	86%	0.86	83%	0.829	S	S	*	*				166.2	142.7	101.2	45.5	0	0	0	0	113
905	F	23	Very low	26.3	Very low	201 Å²	201	157.1 Å²	157.1	88%	0.882	84%	0.839	S	S	*	*			trans	-61.2	139.4	178.1	-102	-114.1	0	0	0	113.3
906	L	25	Very low	26.1	Very low	140 Å²	140	157 Å²	157	73%	0.733	84%	0.838	S	S	*	*			trans	144.9	121.7	132.5	-80.9	152.7	0	0	0	114.6
907	Q	25.4	Very low	26.2	Very low	168 Å²	168	152.1 Å²	152.1	79%	0.785	84%	0.837	S	S	*	*			trans	58.7	104.4	140.4	-73.8	172.4	-28.8	0	0	122.2
908	K	24.7	Very low	25.8	Very low	204 Å²	204	150.1 Å²	150.1	89%	0.887	84%	0.835	S	S	*	*			trans	62.9	158.6	143.7	-78.4	-173.8	179.7	-178.7	0	117.7
909	P	30.1	Very low	25.6	Very low	118 Å²	118	148.7 Å²	148.7	77%	0.766	83%	0.832	S	S	*	*			cis	-138.7	169.8	24.3	35.7	-13.4	0	0	0	118
910	V	25.6	Very low	25.5	Very low	129 Å²	129	152.1 Å²	152.1	78%	0.782	84%	0.839	S	S	*	*			trans	-72.9	123	163	173.1	0	0	0	0	108.2
911	D	25.2	Very low	25.5	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	84%	0.835	S	S	*	*			trans	173.2	96.6	154.2	-90.2	-25.1	0	0	0	109.9
912	R	24.5	Very low	25.5	Very low	258 Å²	258	153.5 Å²	153.5	97%	0.974	83%	0.834	S	S	*	*			trans	-161.5	77.8	166.5	-109.1	179	-168	-175.2	3.6	110.9
913	A	25.7	Very low	25.5	Very low	103 Å²	103	161 Å²	161	85%	0.851	84%	0.841	S	S	*	*			trans	-152.9	56.9	161	0	0	0	0	0	109.7
914	L	23.9	Very low	25.8	Very low	167 Å²	167	159 Å²	159	87%	0.874	84%	0.837	S	S	*	*			trans	-149.1	80.9	175.2	-108.2	163.1	0	0	0	106.8
915	M	22.4	Very low	26.1	Very low	189 Å²	189	158.3 Å²	158.3	93%	0.931	82%	0.822	S	S	*	*			trans	-173.3	71.2	165.9	-89.3	-124.7	-153.7	0	0	110.8
916	V	24.9	Very low	26.6	Very low	148 Å²	148	154 Å²	154	90%	0.897	81%	0.812	S	S	*	*			trans	-150.3	96.1	151	-174.1	0	0	0	0	108.3
917	S	25.3	Very low	26.8	Very low	116 Å²	116	156 Å²	156	81%	0.811	82%	0.815	S	S	*	*			trans	161.9	72.2	143.1	72.1	0	0	0	0	109.4
918	S	22.4	Very low	27.2	Very low	105 Å²	105	153 Å²	153	73%	0.734	80%	0.804	S	S	*	*			trans	-64.5	153	147.8	52.5	0	0	0	0	108.3
919	L	24.2	Very low	27.5	Very low	158 Å²	158	147.1 Å²	147.1	83%	0.827	78%	0.782	S	S	*	*			trans	81.6	80.9	173.5	-50.4	161	0	0	0	116
920	T	27.9	Very low	27.5	Very low	141 Å²	141	149.3 Å²	149.3	87%	0.865	78%	0.779	S	S	*	*	S	Bend		-172.1	133.8	129.4	32.1	0	0	0	0	110.7	K922	T920-K922 PolarHBondContact O-N 2.99Å
921	N	26	Very low	27.8	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	77%	0.766	S	S	*	*			trans	-25.7	110.7	-173.3	-104.8	-32.6	0	0	0	119.1
922	K	27	Very low	28.1	Very low	192 Å²	192	143.6 Å²	143.6	84%	0.835	74%	0.741	S	S	*	*			trans	-95.6	36.5	-177.2	-90.9	-173.8	176.6	178.6	0	116.2	T920	T920-K922 PolarHBondContact O-N 2.99Å
923	R	29.9	Very low	28.4	Very low	225 Å²	225	134.1 Å²	134.1	85%	0.849	71%	0.714	S	S	*	*	S	Bend	trans	-115.5	-11.6	-179	-80.2	-175.7	177.7	170.1	-0	118.3
924	N	31.8	Very low	28.5	Very low	145 Å²	145	135.2 Å²	135.2	78%	0.775	71%	0.705	S	S	*	*	S	Bend	trans	-114.8	1	-178.5	-78	-11.7	0	0	0	116.2
925	I	32.9	Very low	28.8	Very low	108 Å²	108	129.5 Å²	129.5	55%	0.554	68%	0.681	S	S	*	*	S	Bend	trans	-91.6	-16.9	-171.1	-63.3	170.6	0	0	0	112.7	K927 D929	I925-K927 PolarHBondContact O-N 3.46Å; I925-D929 PolarHBondContact O-N 3.07Å
926	T	33.8	Very low	29.2	Very low	109 Å²	109	125.3 Å²	125.3	67%	0.669	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-14.5	-172.2	50.2	0	0	0	0	115.2
927	K	30.2	Very low	29.3	Very low	182 Å²	182	120.9 Å²	120.9	79%	0.791	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-31.5	176.4	-121.7	178.1	-179.3	-178.8	0	112.7	I925	I925-K927 PolarHBondContact O-N 3.46Å
928	I	32.5	Very low	29.5	Very low	107 Å²	107	117.8 Å²	117.8	55%	0.549	61%	0.607	S	S	.	*	H	α-helix	trans	-74.9	-35.9	-179.2	-64.1	171.7	0	0	0	110.6	K930 E931 L932	I928-K930 VanDerWaalsContact C-N 3.34Å; I928-K930 PolarHBondContact O-N 3.27Å; I928-E931 PolarHBondContact O-N 3.36Å; I928-L932 HydrophobicContact CG2-CD1 3.37Å; I928-L932 WeakPolarHBondContact O-CB 3.33Å; I928-L932 WeakPolarHBondContact O-CD1 3.5Å; I928-L932 PolarHBondContact O-N 3.09Å
929	D	30.4	Very low	30	Very low	80 Å²	80	114.5 Å²	114.5	43%	0.428	58%	0.58	S	S	.	*	H	α-helix	trans	-67	-28.1	179.8	-101.7	-33.4	0	0	0	114.4	I925 S933 R936	I925-D929 PolarHBondContact O-N 3.07Å; D929-S933 WeakPolarHBondContact O-CB 3.46Å; D929-S933 PolarHBondContact O-N 2.94Å; D929-R936 IonicContact OD1-NH1 3.76Å; D929-R936 PolarHBondContact OD1-NH1 3.28Å
930	K	30.8	Very low	30.5	Very low	164 Å²	164	108.8 Å²	108.8	71%	0.713	55%	0.551	S	S	*	*	H	α-helix	trans	-77.1	-39.7	177.1	-83.3	-174.2	175.2	-177.6	0	112.5	I928 S933 L934	I928-K930 VanDerWaalsContact C-N 3.34Å; I928-K930 PolarHBondContact O-N 3.27Å; K930-S933 WeakPolarHBondContact O-CB 3.12Å; K930-S933 PolarHBondContact O-N 3.42Å; K930-S933 PolarHBondContact O-OG 3.03Å; K930-L934 PolarHBondContact O-N 3Å
931	E	32.2	Very low	30.6	Very low	108 Å²	108	109.3 Å²	109.3	51%	0.505	54%	0.541	S	S	.	.	H	α-helix	trans	-74.2	-35.9	176.5	-64	-154.9	160	0	0	111.8	S643 I928 S933 L934 A935	S643-E931 PolarHBondContact OG-OE2 2.92Å; I928-E931 PolarHBondContact O-N 3.36Å; E931-S933 VanDerWaalsContact C-N 3.29Å; E931-S933 PolarHBondContact O-N 3.45Å; E931-L934 PolarHBondContact O-N 3.35Å; E931-A935 PolarHBondContact O-N 3.13Å; E931-A935 VanDerWaalsContact O-N 3.11Å
932	L	31.7	Very low	30.8	Very low	54 Å²	54	106.6 Å²	106.6	28%	0.283	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-32.2	167.2	-97.3	122.9	0	0	0	112	I928 L934 R936	I928-L932 HydrophobicContact CG2-CD1 3.37Å; I928-L932 WeakPolarHBondContact O-CB 3.33Å; I928-L932 WeakPolarHBondContact O-CD1 3.5Å; I928-L932 PolarHBondContact O-N 3.09Å; L932-L934 VanDerWaalsContact C-N 3.31Å; L932-L934 PolarHBondContact O-N 3.15Å; L932-R936 WeakPolarHBondContact O-CA 3.44Å; L932-R936 WeakPolarHBondContact O-CB 3.38Å; L932-R936 VanDerWaalsContact O-CD 3.23Å; L932-R936 WeakPolarHBondContact O-CD 3.19Å; L932-R936 WeakPolarHBondContact O-CG 3.44Å; L932-R936 PolarHBondContact O-N 3.41Å
933	S	29.5	Very low	31.1	Very low	59 Å²	59	101.9 Å²	101.9	41%	0.413	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-32.2	176.9	84.4	0	0	0	0	113.4	D929 K930 E931 S937	D929-S933 WeakPolarHBondContact O-CB 3.46Å; D929-S933 PolarHBondContact O-N 2.94Å; K930-S933 WeakPolarHBondContact O-CB 3.12Å; K930-S933 PolarHBondContact O-N 3.42Å; K930-S933 PolarHBondContact O-OG 3.03Å; E931-S933 VanDerWaalsContact C-N 3.29Å; E931-S933 PolarHBondContact O-N 3.45Å; S933-S937 PolarHBondContact O-N 3.44Å; S933-S937 VanDerWaalsContact O-N 3.08Å
934	L	29.1	Very low	31.1	Very low	125 Å²	125	95.7 Å²	95.7	65%	0.654	48%	0.482	S	S	*	.	H	α-helix	trans	-78.8	-43.8	178.8	-140	88.4	0	0	0	110.8	K930 E931 L932 R936 S937 V938	K930-L934 PolarHBondContact O-N 3Å; E931-L934 PolarHBondContact O-N 3.35Å; L932-L934 VanDerWaalsContact C-N 3.31Å; L932-L934 PolarHBondContact O-N 3.15Å; L934-R936 VanDerWaalsContact C-N 3.31Å; L934-R936 PolarHBondContact O-N 3.37Å; L934-S937 WeakPolarHBondContact O-CB 3.47Å; L934-S937 PolarHBondContact O-N 3.03Å; L934-S937 PolarHBondContact O-OG 3.37Å; L934-V938 PolarHBondContact O-N 3.46Å
935	A	29.7	Very low	31.1	Very low	47 Å²	47	93.1 Å²	93.1	39%	0.388	47%	0.467	S	S	.	.	H	α-helix	trans	-60.5	-40.9	170	0	0	0	0	0	111.2	E931 S937 V938 F939	E931-A935 PolarHBondContact O-N 3.13Å; E931-A935 VanDerWaalsContact O-N 3.11Å; A935-S937 PolarHBondContact O-N 3.31Å; A935-V938 PolarHBondContact O-N 3.37Å; A935-F939 VanDerWaalsContact O-CB 3.32Å; A935-F939 WeakPolarHBondContact O-CB 3.48Å; A935-F939 PolarHBondContact O-N 3.13Å
936	R	30.7	Very low	31	Very low	101 Å²	101	92.3 Å²	92.3	38%	0.381	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-21.2	171	-77.9	164.4	176.7	163.7	0.6	113	D929 L932 L934 V940	D929-R936 IonicContact OD1-NH1 3.76Å; D929-R936 PolarHBondContact OD1-NH1 3.28Å; L932-R936 WeakPolarHBondContact O-CA 3.44Å; L932-R936 WeakPolarHBondContact O-CB 3.38Å; L932-R936 VanDerWaalsContact O-CD 3.23Å; L932-R936 WeakPolarHBondContact O-CD 3.19Å; L932-R936 WeakPolarHBondContact O-CG 3.44Å; L932-R936 PolarHBondContact O-N 3.41Å; L934-R936 VanDerWaalsContact C-N 3.31Å; L934-R936 PolarHBondContact O-N 3.37Å; R936-V940 WeakPolarHBondContact O-CB 3.35Å; R936-V940 WeakPolarHBondContact O-CG2 3.41Å
937	S	27.8	Very low	30.8	Very low	55 Å²	55	91.3 Å²	91.3	39%	0.385	45%	0.45	S	S	.	.	H	α-helix	trans	-86.1	-27.1	175.9	81.8	0	0	0	0	113	S933 L934 A935 K941	S933-S937 PolarHBondContact O-N 3.44Å; S933-S937 VanDerWaalsContact O-N 3.08Å; L934-S937 WeakPolarHBondContact O-CB 3.47Å; L934-S937 PolarHBondContact O-N 3.03Å; L934-S937 PolarHBondContact O-OG 3.37Å; A935-S937 PolarHBondContact O-N 3.31Å; S937-K941 PolarHBondContact O-N 2.95Å
938	V	29.1	Very low	30.9	Very low	52 Å²	52	85.6 Å²	85.6	32%	0.315	43%	0.429	S	S	.	.	H	α-helix	trans	-87.8	-39.8	178.9	178.9	0	0	0	0	110.9	L934 A935 V940 K941	L934-V938 PolarHBondContact O-N 3.46Å; A935-V938 PolarHBondContact O-N 3.37Å; V938-V940 PolarHBondContact O-N 3.17Å; V938-K941 PolarHBondContact O-N 3.12Å; V938-K941 VanDerWaalsContact O-N 3.1Å
939	F	32.1	Very low	30.8	Very low	35 Å²	35	84.2 Å²	84.2	15%	0.154	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.1	171.6	-120.6	-88.4	0	0	0	113.4	C662 S666 A935 F943	C662-F939 HydrophobicContact CB-CD2 3.45Å; C662-F939 VanDerWaalsContact CB-CD2 3.45Å; C662-F939 HydrophobicContact CB-CE1 4.4Å; C662-F939 HydrophobicContact CB-CE2 3.19Å; C662-F939 HydrophobicContact CB-CG 4.17Å; C662-F939 HydrophobicContact CB-CZ 3.72Å; C662-F939 WeakPolarHBondContact O-CZ 3.4Å; C662-F939 WeakPolarHBondContact SG-CD2 3.33Å; C662-F939 WeakPolarHBondContact SG-CE2 3.16Å; S666-F939 WeakPolarHBondContact OG-CE1 3.22Å; S666-F939 WeakPolarHBondContact OG-CZ 3.25Å; A935-F939 VanDerWaalsContact O-CB 3.32Å; A935-F939 WeakPolarHBondContact O-CB 3.48Å; A935-F939 PolarHBondContact O-N 3.13Å; F939-F943 HydrophobicContact CE1-CE2 4.47Å
940	V	35.4	Very low	30.8	Very low	38 Å²	38	84.5 Å²	84.5	23%	0.23	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-7.7	-176.3	148	0	0	0	0	112.3	Y717 R936 V938	Y717-V940 HydrophobicContact CE1-CG1 3.82Å; Y717-V940 WeakPolarHBondContact OH-CB 3.33Å; Y717-V940 WeakPolarHBondContact OH-CG1 3.4Å; Y717-V940 WeakPolarHBondContact OH-CG2 3.49Å; R936-V940 WeakPolarHBondContact O-CB 3.35Å; R936-V940 WeakPolarHBondContact O-CG2 3.41Å; V938-V940 PolarHBondContact O-N 3.17Å
941	K	29.4	Very low	30.8	Very low	152 Å²	152	78.4 Å²	78.4	66%	0.661	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-17.4	176.9	-109.5	-177.9	172.3	-173.6	0	113.2	S937 V938	S937-K941 PolarHBondContact O-N 2.95Å; V938-K941 PolarHBondContact O-N 3.12Å; V938-K941 VanDerWaalsContact O-N 3.1Å
942	Y	31.2	Very low	30.7	Very low	101 Å²	101	75.9 Å²	75.9	40%	0.396	39%	0.389	S	S	.	.			trans	-117.7	-2.9	-174	-83	-81.6	0	0	0	114.9	E655 Q659 Y663	E655-Y942 PolarHBondContact OE1-OH 2.98Å; Q659-Y942 HydrophobicContact CG-CD2 4.28Å; Q659-Y942 HydrophobicContact CG-CE2 4.13Å; Q659-Y942 VanDerWaalsContact NE2-CE2 3.31Å; Q659-Y942 PolarHBondContact NE2-OH 3.16Å; Y663-Y942 PolarHBondContact OH-O 3.23Å
943	F	32.5	Very low	30.6	Very low	92 Å²	92	77.9 Å²	77.9	40%	0.404	40%	0.398	S	S	.	.			trans	-114.2	0	163.6	-79.9	-80.8	0	0	0	108.7	M608 Y663 P763 F939	M608-F943 HydrophobicContact SD-CZ 4.07Å; Y663-F943 HydrophobicContact CD1-CZ 4.4Å; Y663-F943 HydrophobicContact CE1-CE2 4.46Å; Y663-F943 HydrophobicContact CE1-CZ 4.15Å; P763-F943 HydrophobicContact CB-CE1 4.36Å; F939-F943 HydrophobicContact CE1-CE2 4.47Å

Retrieved 943 of 943 residues in 1696.6 ms (Link to these results)

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