A0A087Y3F9_POEFO Loading...

Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform

AlphaFold DB , UniProt , Accession A0A087Y3F9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,121 aa.

						>A0A087Y3F9_POEFO|A0A087Y3F9
MDRQQIQVSDEEREVAREESRRRRRKKAITSASSTSMDQISVEFVLPTVARGGSSPDSLLLEVAGNWTVEQVKAQVWMKAVSLNLCPDFYQRFCPDHCILLYQKKGTVCEIYDKHQVFQTLDCIRYWRALKKDVGRIQLVPRPQPTDESQQYQRYLNYLIGYDVTDVSNVHDDELEFTRRKLLTPRRIELSDRDPNLYSMDPWVTRKPLPEHLLSKVNNGYILVVIHVSTSSQTIKVSIDDTPSQVLASFFAKTANKRVLLGIPEHLSDEDFVLRVCGREEYLYGEKALQSFNWIRQSLKNGEEIHLVLETPPDPELDLVQREDWAQVDDCTGVAGTHEQLTIAEKDHERVFTISMWDCNRKFRVKVLGIDIPSLPKVPEFMVFIEASIFHGQQLLAQERTTSKTFNEEVLWNCWLEFNIKIKDLPKGARLNLQVICGKQPQTPNSKSSYHDNTSGSSTLEGKTKNRLLYYVNLLLIDHRSLLRQGEFILHMWKMPEKSEESSSSINADKLTSATNPDKASSMAIAILLDKYCYPVVLPKSREVGRDCGAGSEEGDGGERGQREMPNHLKKQFAAIVSTDPLHPLSPEDKELLWHFRHECMRDPRAYPKLLGSVRWGKQEDVLATHRLLDRSNAWDTSGLDVGLAMQLLDCHYSDAQVRSMAVRKLETLEDDDVLRYLLQLVQAVKFEPYHDSALVRFLLKRALRSKRIGHFLFWFLRSEIAQSMHYQQRYAVLLEAYLRGCGENMLQDFRKQVEMTEALQKVTREMKAMSADKYDVTQQVVIQLRQKLETLQLSGLPESFRVPYDPGLRAGTLLIEQCKVMASKKKPLWLQFKRADPTTLSKDPVGIIFKDGDDLRQDMLILQILLIMESIWETESLDLCLLPYGCISTGNKIGMIEIVKDATTIATIQQSVVGSTGAFKDEILYQWLRDKCVSEEKFQQAVERFLYSCGGYCVATYVLGIGDRHNDNIMITESGNLFHIDFGHILGNYKSFMGISKEWVPFVLTPDFLYVMGTSGKKSSPHFQKFQDVCVKAYLALRHHTNLLIILFSMMLMTGMPQLTSKEDIEYIREALTVGRSEDEAQRHLLDQIEICREKGWMVQINWFVHLVLGIKQGVEKRST
					

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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	35.5	Very low	28	Very low	225 Å²	225	156.5 Å²	156.5	100%	1.108	78%	0.776	S	S	*	*				0	79.3	0	-70.6	-166.2	-81.8	0	0	106.1
2	D	29.2	Very low	27.8	Very low	137 Å²	137	159.7 Å²	159.7	73%	0.733	79%	0.788	S	S	*	*				80.3	99.2	97	-73.2	-45.5	0	0	0	109.1
3	R	24.9	Very low	27.6	Very low	202 Å²	202	164.6 Å²	164.6	76%	0.762	79%	0.792	S	S	*	*				77.9	125.8	80.6	-92	-172.4	172.9	-173	0.7	111.7
4	Q	26.7	Very low	27.4	Very low	154 Å²	154	167.2 Å²	167.2	72%	0.72	80%	0.803	S	S	*	*			trans	75.7	137	145.5	-66.1	168.5	-17.3	0	0	116.2
5	Q	27	Very low	27.4	Very low	184 Å²	184	165.4 Å²	165.4	86%	0.86	81%	0.806	S	S	*	*			cis	-153.2	136.8	42.6	-136.6	160.4	17	0	0	112.3
6	I	30.3	Very low	27.2	Very low	141 Å²	141	161.4 Å²	161.4	72%	0.723	81%	0.808	S	S	*	*			trans	-84.5	146.8	164.4	-69.9	164.8	0	0	0	107	V8	I6-V8 HydrophobicContact CG2-CB 4.29Å; I6-V8 HydrophobicContact CG2-CG2 3.41Å; I6-V8 VanDerWaalsContact CG2-CG2 3.41Å
7	Q	25.3	Very low	27.2	Very low	199 Å²	199	166.3 Å²	166.3	93%	0.93	82%	0.815	S	S	*	*			trans	-136.2	129.6	144	-134.5	174.4	5.1	0	0	110.5
8	V	28.5	Very low	27.1	Very low	92 Å²	92	167.5 Å²	167.5	56%	0.558	82%	0.818	S	S	*	*			trans	-117.5	151.3	-172	159.1	0	0	0	0	106.9	I6 D10	I6-V8 HydrophobicContact CG2-CB 4.29Å; I6-V8 HydrophobicContact CG2-CG2 3.41Å; I6-V8 VanDerWaalsContact CG2-CG2 3.41Å; V8-D10 WeakPolarHBondContact CG1-OD1 3.4Å
9	S	24.1	Very low	27.1	Very low	110 Å²	110	169.4 Å²	169.4	77%	0.769	83%	0.825	S	S	*	*			trans	-159.6	108.1	138.9	58.3	0	0	0	0	106.5
10	D	27.9	Very low	27.1	Very low	123 Å²	123	166.5 Å²	166.5	66%	0.658	82%	0.823	S	S	*	*				67.2	133.4	73.2	-70.7	-17.9	0	0	0	110.9	V8	V8-D10 WeakPolarHBondContact CG1-OD1 3.4Å
11	E	28.4	Very low	27.2	Very low	154 Å²	154	170.8 Å²	170.8	72%	0.72	83%	0.83	S	S	*	*			cis	-164.1	157.1	10.2	-108.9	168.3	166	0	0	105
12	E	26.4	Very low	26.9	Very low	195 Å²	195	172.3 Å²	172.3	91%	0.911	82%	0.823	S	S	*	*				-160	147.7	77.7	-85.5	178.7	155.9	0	0	111.8
13	R	24.2	Very low	26.8	Very low	224 Å²	224	177.6 Å²	177.6	85%	0.845	83%	0.833	S	S	*	*			trans	-103.1	141.4	-178	-74.3	171.9	167.3	173.4	-1.8	110.7
14	E	25.2	Very low	27	Very low	201 Å²	201	180.3 Å²	180.3	94%	0.939	84%	0.843	S	S	*	*			trans	-142.4	149.8	143.5	-95.9	-166.5	160.8	0	0	110.7
15	V	26.9	Very low	27.1	Very low	140 Å²	140	184.8 Å²	184.8	85%	0.848	85%	0.853	S	S	*	*			trans	-107	134.1	-156.2	168.9	0	0	0	0	111.5
16	A	24.2	Very low	27.2	Very low	102 Å²	102	186.1 Å²	186.1	84%	0.843	86%	0.856	S	S	*	*			trans	-165.5	132	143.7	0	0	0	0	0	113.8
17	R	27.4	Very low	26.9	Very low	244 Å²	244	189.1 Å²	189.1	92%	0.921	86%	0.864	S	S	*	*			trans	-17	124.5	175.5	-77.2	171.3	167.8	165	-3.9	122.5
18	E	26.4	Very low	27	Very low	188 Å²	188	184.7 Å²	184.7	88%	0.879	86%	0.862	S	S	*	*			trans	-0.9	129	139	-86.3	172.6	152.1	0	0	122.2
19	E	27	Very low	26.9	Very low	203 Å²	203	187.9 Å²	187.9	95%	0.949	87%	0.874	S	S	*	*				-159	132.5	116.7	-120.4	-179.7	-179.7	0	0	111.2
20	S	27	Very low	26.9	Very low	111 Å²	111	188.5 Å²	188.5	78%	0.776	87%	0.873	S	S	*	*			trans	-106.4	144.5	-164.9	68	0	0	0	0	113.9
21	R	28.8	Very low	27	Very low	257 Å²	257	188.9 Å²	188.9	97%	0.97	89%	0.885	S	S	*	*			trans	-161	111.2	147.2	-106.9	165.5	-170.1	-165.8	3.4	111.1
22	R	28.8	Very low	27	Very low	257 Å²	257	185.7 Å²	185.7	97%	0.97	89%	0.885	S	S	*	*			trans	-106.6	129.6	175.5	-99.7	-178.9	174.2	174	-0.8	111.3
23	R	27.6	Very low	27	Very low	249 Å²	249	181.8 Å²	181.8	94%	0.94	88%	0.879	S	S	*	*			trans	-78	145	162.4	-74.4	173.5	168.2	171.4	-4.8	110.3
24	R	28.9	Very low	27.2	Very low	258 Å²	258	176.3 Å²	176.3	97%	0.974	88%	0.876	S	S	*	*			trans	-131.5	141.6	163	-105.9	-176.3	176.4	177.6	-0.9	111.1
25	R	29	Very low	27.6	Very low	248 Å²	248	173.7 Å²	173.7	94%	0.936	87%	0.874	S	S	*	*			trans	-58.5	152.4	-171.4	-71.1	166.9	161.9	169.2	-6.4	115.9
26	K	28.1	Very low	28	Very low	213 Å²	213	171.5 Å²	171.5	93%	0.926	87%	0.865	S	S	*	*			trans	-134.5	156.9	146.3	-96.7	-174.9	179.1	177.8	0	111.4
27	K	25.3	Very low	29.1	Very low	204 Å²	204	170.5 Å²	170.5	89%	0.887	84%	0.843	S	S	*	*			trans	-54.8	157.6	-160.3	-78.3	166.9	166.4	179.8	0	118.1
28	A	27.7	Very low	30.8	Very low	106 Å²	106	163.5 Å²	163.5	88%	0.876	82%	0.824	S	S	*	*			trans	-55.2	130.9	172.2	0	0	0	0	0	113.5
29	I	26.6	Very low	33	Very low	159 Å²	159	160.8 Å²	160.8	82%	0.815	81%	0.812	S	S	*	*			trans	-117.4	133.7	160	-67.5	171.8	0	0	0	105.7
30	T	23.1	Very low	35.6	Very low	123 Å²	123	152.1 Å²	152.1	76%	0.755	77%	0.771	S	S	*	*			trans	-44.4	137.6	179.1	40.7	0	0	0	0	114.4	A32	T30-A32 PolarHBondContact O-N 3.31Å
31	S	30.9	Very low	38.5	Very low	130 Å²	130	148.2 Å²	148.2	91%	0.909	74%	0.744	S	S	*	*			trans	-58.5	98	166.8	51.6	0	0	0	0	111.5
32	A	27.1	Very low	41.4	Very low	87 Å²	87	136 Å²	136	72%	0.719	70%	0.698	S	S	*	*			trans	-155	89.7	166	0	0	0	0	0	109.6	T30	T30-A32 PolarHBondContact O-N 3.31Å
33	S	26.7	Very low	44.5	Very low	113 Å²	113	126.6 Å²	126.6	79%	0.79	67%	0.665	S	S	*	*			trans	156.9	62	146.4	69.5	0	0	0	0	109.1	T35	S33-T35 PolarHBondContact O-N 2.83Å
34	S	28.5	Very low	47.5	Very low	110 Å²	110	114.7 Å²	114.7	77%	0.769	62%	0.62	S	S	*	*			trans	-59.8	118.5	146.6	52.7	0	0	0	0	105.6	S36	S34-S36 PolarHBondContact O-N 3.16Å
35	T	33.3	Very low	50.4	Low	146 Å²	146	102.9 Å²	102.9	90%	0.896	58%	0.577	S	S	*	*			trans	-57.8	92.3	164.2	19.4	0	0	0	0	107.1	S33 M37	S33-T35 PolarHBondContact O-N 2.83Å; T35-M37 PolarHBondContact O-N 3.03Å
36	S	36	Very low	53.2	Low	94 Å²	94	91.2 Å²	91.2	66%	0.657	53%	0.533	S	S	*	.			trans	-56.6	134	168.1	51.7	0	0	0	0	106.8	S34 D38	S34-S36 PolarHBondContact O-N 3.16Å; S36-D38 PolarHBondContact O-N 2.87Å
37	M	47.9	Very low	55.7	Low	81 Å²	81	82.9 Å²	82.9	40%	0.399	50%	0.5	S	S	.	.			trans	-49.6	136.6	166.4	-68.4	-172.8	-173.4	0	0	108.7	T35 Q39 R350	T35-M37 PolarHBondContact O-N 3.03Å; M37-Q39 PolarHBondContact O-N 3.5Å; M37-R350 HydrophobicContact CE-CB 4.01Å; M37-R350 VanDerWaalsContact CE-CD 3.44Å; M37-R350 HydrophobicContact CE-CG 4.05Å
38	D	61.7	Low	58.2	Low	96 Å²	96	73.4 Å²	73.4	51%	0.513	46%	0.46	S	S	.	.			trans	-62.1	89.7	164.1	-84.4	3.1	0	0	0	107.3	S36 G65 R128	S36-D38 PolarHBondContact O-N 2.87Å; D38-G65 PolarHBondContact O-N 3.41Å; D38-R128 IonicContact OD2-CZ 2.71Å; D38-R128 IonicContact OD2-NE 3.95Å; D38-R128 IonicContact OD2-NH2 3.61Å; D38-R128 PolarHBondContact OD2-NH2 3.28Å
39	Q	73.2	Confident	60.3	Low	132 Å²	132	72.1 Å²	72.1	62%	0.617	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	129.7	161.5	-71.8	-171.1	-24.6	0	0	106.8	M37	M37-Q39 PolarHBondContact O-N 3.5Å
40	I	81	Confident	61.9	Low	20 Å²	20	66.6 Å²	66.6	10%	0.103	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	111.2	-176.4	-55	172.1	0	0	0	106.9	V42 V63 F118 Q119 I124	I40-V42 HydrophobicContact CG2-CG2 3.78Å; I40-V42 PolarHBondContact O-N 3.28Å; I40-V63 PolarHBondContact N-O 2.9Å; I40-V63 PolarHBondContact O-N 3.04Å; I40-F118 HydrophobicContact CD1-CD1 4.24Å; I40-Q119 HydrophobicContact CD1-CB 4.37Å; I40-I124 HydrophobicContact CD1-CD1 4.13Å; I40-I124 HydrophobicContact CD1-CG1 4.11Å; I40-I124 HydrophobicContact CD1-CG2 3.82Å; I40-I124 HydrophobicContact CG2-CD1 3.82Å
41	S	88.2	Confident	63.4	Low	30 Å²	30	71.2 Å²	71.2	21%	0.21	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	118.2	173	-51.4	0	0	0	0	110	E62 V134 G135	S41-E62 VanDerWaalsContact CB-OE1 3.27Å; S41-E62 WeakPolarHBondContact CB-OE1 3.32Å; S41-E62 PolarHBondContact N-OE2 2.93Å; S41-E62 PolarHBondContact OG-OE1 3.48Å; S41-E62 PolarHBondContact OG-OE2 2.94Å; S41-E62 VanDerWaalsContact OG-OE2 3.12Å; S41-V134 WeakPolarHBondContact O-CA 3.3Å; S41-G135 PolarHBondContact O-N 3.39Å; S41-G135 VanDerWaalsContact O-N 3.08Å
42	V	90.8	Very high	64.5	Low	0 Å²	0	69.3 Å²	69.3	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129.1	178.8	-176.6	0	0	0	0	111.1	I40 F44 L61 V63 F118 W127 G135 I137	I40-V42 HydrophobicContact CG2-CG2 3.78Å; I40-V42 PolarHBondContact O-N 3.28Å; V42-F44 HydrophobicContact CB-CD2 4.35Å; V42-F44 HydrophobicContact CB-CE2 3.74Å; V42-F44 HydrophobicContact CB-CZ 4.15Å; V42-F44 HydrophobicContact CG1-CD2 4.06Å; V42-F44 HydrophobicContact CG1-CE1 4.27Å; V42-F44 HydrophobicContact CG1-CE2 3.65Å; V42-F44 HydrophobicContact CG1-CZ 3.75Å; V42-L61 PolarHBondContact N-O 2.71Å; V42-L61 PolarHBondContact O-N 3.04Å; V42-V63 HydrophobicContact CB-CG2 4.43Å; V42-V63 HydrophobicContact CG2-CG2 4.35Å; V42-F118 HydrophobicContact CG2-CE1 3.82Å; V42-F118 HydrophobicContact CG2-CZ 4Å; V42-W127 HydrophobicContact CG2-CZ3 4.25Å; V42-G135 WeakPolarHBondContact CA-O 3.41Å; V42-I137 HydrophobicContact CG1-CB 4.22Å; V42-I137 HydrophobicContact CG1-CD1 3.8Å; V42-I137 HydrophobicContact CG1-CG1 3.75Å
43	E	92.4	Very high	65.8	Low	59 Å²	59	67 Å²	67	28%	0.276	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115	168.3	-173.7	-167.8	-162	0	0	109.8	L60 V134 G135 R136 I137	E43-L60 HydrophobicContact CB-CD1 4.42Å; E43-V134 HydrophobicContact CB-CG1 4.3Å; E43-G135 PolarHBondContact N-O 3.17Å; E43-R136 WeakPolarHBondContact O-CA 3.1Å; E43-R136 IonicContact OE2-NE 2.6Å; E43-R136 PolarHBondContact OE2-NE 3.19Å; E43-I137 PolarHBondContact O-N 2.85Å
44	F	91.1	Very high	67.1	Low	0 Å²	0	67.8 Å²	67.8	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114	174	-69.5	-87.4	0	0	0	110.5	V42 S58 L59 L61 V63 V72 V76 L100 F118 I137	V42-F44 HydrophobicContact CB-CD2 4.35Å; V42-F44 HydrophobicContact CB-CE2 3.74Å; V42-F44 HydrophobicContact CB-CZ 4.15Å; V42-F44 HydrophobicContact CG1-CD2 4.06Å; V42-F44 HydrophobicContact CG1-CE1 4.27Å; V42-F44 HydrophobicContact CG1-CE2 3.65Å; V42-F44 HydrophobicContact CG1-CZ 3.75Å; F44-S58 CarbonylContact O-C 3.58Å; F44-S58 WeakPolarHBondContact O-CA 3.39Å; F44-L59 HydrophobicContact CB-CB 4.48Å; F44-L59 PolarHBondContact N-O 2.84Å; F44-L59 PolarHBondContact O-N 2.96Å; F44-L61 HydrophobicContact CD2-CB 4.14Å; F44-L61 HydrophobicContact CE2-CB 4.1Å; F44-V63 HydrophobicContact CE2-CG2 4.05Å; F44-V63 HydrophobicContact CZ-CG2 4.25Å; F44-V72 HydrophobicContact CE1-CG1 4Å; F44-V72 HydrophobicContact CE2-CG1 4.32Å; F44-V72 HydrophobicContact CZ-CG1 3.45Å; F44-V72 VanDerWaalsContact CZ-CG1 3.45Å; F44-V76 HydrophobicContact CB-CG1 4.15Å; F44-V76 HydrophobicContact CB-CG2 4.42Å; F44-V76 HydrophobicContact CD1-CG1 4.4Å; F44-V76 HydrophobicContact CD1-CG2 3.79Å; F44-V76 HydrophobicContact CD2-CG2 3.62Å; F44-V76 HydrophobicContact CE1-CG2 3.87Å; F44-V76 HydrophobicContact CE2-CG2 3.71Å; F44-V76 HydrophobicContact CG-CG1 4.2Å; F44-V76 HydrophobicContact CG-CG2 3.66Å; F44-V76 HydrophobicContact CZ-CG2 3.84Å; F44-L100 HydrophobicContact CD1-CD2 4.41Å; F44-L100 HydrophobicContact CE1-CD2 4.34Å; F44-F118 HydrophobicContact CZ-CZ 4.34Å; F44-I137 CarbonylContact C-O 3.3Å; F44-I137 VanDerWaalsContact CA-O 3.27Å; F44-I137 WeakPolarHBondContact CA-O 3.33Å; F44-I137 HydrophobicContact CD1-CB 3.94Å; F44-I137 HydrophobicContact CD1-CG2 4.1Å; F44-I137 HydrophobicContact CE1-CB 3.94Å; F44-I137 HydrophobicContact CE1-CD1 4Å; F44-I137 HydrophobicContact CE1-CG1 4.47Å; F44-I137 HydrophobicContact CE1-CG2 4.02Å; F44-I137 HydrophobicContact CZ-CD1 4.3Å
45	V	90.2	Very high	68.8	Low	9 Å²	9	66.1 Å²	66.1	6%	0.055	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122	170.6	-174.6	0	0	0	0	108.3	P56 R136 I137 Q138 L139	V45-P56 HydrophobicContact CG1-CB 3.73Å; V45-P56 HydrophobicContact CG1-CG 3.61Å; V45-R136 HydrophobicContact CG2-CG 4.13Å; V45-R136 VanDerWaalsContact CG2-NE 3.33Å; V45-I137 PolarHBondContact N-O 3.21Å; V45-Q138 HydrophobicContact CB-CG 4.1Å; V45-Q138 HydrophobicContact CG2-CG 4.34Å; V45-L139 PolarHBondContact O-N 2.69Å
46	L	87.9	Confident	70.8	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.021	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	159.8	-175.7	-63.1	179.2	0	0	0	111.6	T48 D57 L59 V76 A80 L85 L139	L46-T48 PolarHBondContact O-N 3.25Å; L46-D57 HydrophobicContact CB-CB 4.13Å; L46-D57 HydrophobicContact CD1-CB 4.05Å; L46-D57 PolarHBondContact N-O 3.03Å; L46-L59 HydrophobicContact CD1-CD1 3.74Å; L46-L59 HydrophobicContact CD1-CG 3.84Å; L46-L59 HydrophobicContact CD2-CD1 4.2Å; L46-L59 HydrophobicContact CG-CD1 4.32Å; L46-L59 HydrophobicContact CG-CG 4.36Å; L46-V76 HydrophobicContact CD2-CG1 3.91Å; L46-A80 HydrophobicContact CD1-CB 4.07Å; L46-L85 HydrophobicContact CD1-CD1 3.56Å; L46-L139 HydrophobicContact CD2-CD2 4.1Å
47	P	79.8	Confident	73	Confident	37 Å²	37	58.7 Å²	58.7	24%	0.24	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-4.2	179.2	31.7	-35.8	0	0	0	113.3	F89 L139 P141	P47-F89 HydrophobicContact CB-CZ 4.12Å; P47-F89 HydrophobicContact CG-CD1 4.36Å; P47-F89 HydrophobicContact CG-CE1 3.55Å; P47-F89 HydrophobicContact CG-CE2 4.33Å; P47-F89 HydrophobicContact CG-CZ 3.54Å; P47-L139 VanDerWaalsContact CD-O 3.28Å; P47-L139 WeakPolarHBondContact CD-O 3.4Å; P47-P141 HydrophobicContact CB-CG 4.09Å
48	T	78.8	Confident	74.7	Confident	6 Å²	6	58 Å²	58	4%	0.037	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	152.6	-176.9	58.5	0	0	0	0	111.3	L46 D57 C86 F89 Y90	L46-T48 PolarHBondContact O-N 3.25Å; T48-D57 PolarHBondContact O-N 3.33Å; T48-D57 PolarHBondContact OG1-OD2 3.14Å; T48-C86 HydrophobicContact CG2-CB 3.6Å; T48-F89 HydrophobicContact CG2-CB 3.87Å; T48-F89 HydrophobicContact CG2-CD1 3.95Å; T48-F89 HydrophobicContact CG2-CD2 4.49Å; T48-F89 HydrophobicContact CG2-CG 3.85Å; T48-Y90 HydrophobicContact CG2-CE2 3.88Å
49	V	70.8	Confident	76	Confident	79 Å²	79	54.3 Å²	54.3	48%	0.479	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.9	176.8	-176.9	0	0	0	0	108.5	G53	V49-G53 WeakPolarHBondContact CG1-O 3.43Å
50	A	61.6	Low	76.8	Confident	42 Å²	42	53.2 Å²	53.2	35%	0.347	33%	0.334	S	S	.	.			trans	-53.2	138.8	176.2	0	0	0	0	0	111.5	G52 G53 D57	A50-G52 PolarHBondContact O-N 3.39Å; A50-G53 PolarHBondContact O-N 3.04Å; A50-D57 WeakPolarHBondContact CA-OD1 3.45Å; A50-D57 WeakPolarHBondContact CB-OD1 3.39Å; A50-D57 PolarHBondContact N-OD1 3.18Å; A50-D57 VanDerWaalsContact N-OD1 3.16Å
51	R	53.1	Low	77.2	Confident	220 Å²	220	52.4 Å²	52.4	83%	0.83	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	104	175.7	-75.8	-174	179.9	-170.7	0.2	109.8
52	G	53.9	Low	77.1	Confident	91 Å²	91	55 Å²	55	94%	0.938	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.2	3.5	178.8	0	0	0	0	0	116.3	A50	A50-G52 PolarHBondContact O-N 3.39Å
53	G	53.9	Low	76.8	Confident	39 Å²	39	55 Å²	55	40%	0.402	34%	0.339	S	S	.	.			trans	-109.3	160.6	176.8	0	0	0	0	0	113.7	V49 A50	V49-G53 WeakPolarHBondContact CG1-O 3.43Å; A50-G53 PolarHBondContact O-N 3.04Å
54	S	55.8	Low	76.1	Confident	128 Å²	128	52.8 Å²	52.8	90%	0.895	33%	0.331	S	S	*	.	S	Bend	trans	-97.7	-4.5	175	59	0	0	0	0	114.1
55	S	63.6	Low	75.1	Confident	76 Å²	76	53 Å²	53	53%	0.531	33%	0.332	S	S	.	.	S	Bend	trans	-107.8	141.7	-178	57.5	0	0	0	0	112.2
56	P	74.9	Confident	74.2	Confident	62 Å²	62	54.4 Å²	54.4	40%	0.403	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	148.9	177.1	26.6	-33.7	0	0	0	112	V45	V45-P56 HydrophobicContact CG1-CB 3.73Å; V45-P56 HydrophobicContact CG1-CG 3.61Å
57	D	81.8	Confident	73.7	Confident	21 Å²	21	57 Å²	57	11%	0.112	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	142.4	176.9	-63.8	-43.1	0	0	0	110.5	L46 T48 A50 L85	L46-D57 HydrophobicContact CB-CB 4.13Å; L46-D57 HydrophobicContact CD1-CB 4.05Å; L46-D57 PolarHBondContact N-O 3.03Å; T48-D57 PolarHBondContact O-N 3.33Å; T48-D57 PolarHBondContact OG1-OD2 3.14Å; A50-D57 WeakPolarHBondContact CA-OD1 3.45Å; A50-D57 WeakPolarHBondContact CB-OD1 3.39Å; A50-D57 PolarHBondContact N-OD1 3.18Å; A50-D57 VanDerWaalsContact N-OD1 3.16Å; D57-L85 HydrophobicContact CB-CD1 4.49Å
58	S	84.8	Confident	73.6	Confident	68 Å²	68	56.1 Å²	56.1	48%	0.476	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	137.5	179.4	60.3	0	0	0	0	111.8	F44	F44-S58 CarbonylContact O-C 3.58Å; F44-S58 WeakPolarHBondContact O-CA 3.39Å
59	L	88.7	Confident	74	Confident	17 Å²	17	56 Å²	56	9%	0.089	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.6	176.1	-69.5	179	0	0	0	111	F44 L46 K79 A80 L83 L85	F44-L59 HydrophobicContact CB-CB 4.48Å; F44-L59 PolarHBondContact N-O 2.84Å; F44-L59 PolarHBondContact O-N 2.96Å; L46-L59 HydrophobicContact CD1-CD1 3.74Å; L46-L59 HydrophobicContact CD1-CG 3.84Å; L46-L59 HydrophobicContact CD2-CD1 4.2Å; L46-L59 HydrophobicContact CG-CD1 4.32Å; L46-L59 HydrophobicContact CG-CG 4.36Å; L59-K79 HydrophobicContact CD1-CB 4.33Å; L59-A80 HydrophobicContact CD1-CB 4.01Å; L59-L83 HydrophobicContact CD2-CD1 3.39Å; L59-L85 HydrophobicContact CD1-CD1 4.46Å; L59-L85 HydrophobicContact CD2-CD1 3.99Å; L59-L85 HydrophobicContact CG-CD1 4.32Å
60	L	89.3	Confident	74.7	Confident	109 Å²	109	55.8 Å²	55.8	57%	0.571	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	126	168.7	-171.9	66.9	0	0	0	109.8	E43 V134	E43-L60 HydrophobicContact CB-CD1 4.42Å; L60-V134 HydrophobicContact CD1-CG1 3.89Å
61	L	89.5	Confident	75.9	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	129.9	-178.4	-163.2	142.3	0	0	0	110.8	V42 F44 V63 W67 V76 K79	V42-L61 PolarHBondContact N-O 2.71Å; V42-L61 PolarHBondContact O-N 3.04Å; F44-L61 HydrophobicContact CD2-CB 4.14Å; F44-L61 HydrophobicContact CE2-CB 4.1Å; L61-V63 HydrophobicContact CD2-CB 4.39Å; L61-V63 HydrophobicContact CD2-CG2 3.48Å; L61-V63 VanDerWaalsContact CD2-CG2 3.48Å; L61-V63 PolarHBondContact O-N 3.29Å; L61-W67 HydrophobicContact CD2-CZ3 4.21Å; L61-V76 HydrophobicContact CD1-CG2 4.3Å; L61-K79 HydrophobicContact CD1-CD 3.72Å; L61-K79 HydrophobicContact CD1-CG 4.28Å
62	E	87	Confident	77.5	Confident	83 Å²	83	46.3 Å²	46.3	39%	0.388	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	106.6	168.2	-68.3	-55.1	139.1	0	0	109.2	S41	S41-E62 VanDerWaalsContact CB-OE1 3.27Å; S41-E62 WeakPolarHBondContact CB-OE1 3.32Å; S41-E62 PolarHBondContact N-OE2 2.93Å; S41-E62 PolarHBondContact OG-OE1 3.48Å; S41-E62 PolarHBondContact OG-OE2 2.94Å; S41-E62 VanDerWaalsContact OG-OE2 3.12Å
63	V	83.9	Confident	79.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.2	-178.7	-179	0	0	0	0	108.9	I40 V42 F44 L61 G65 W67 V72 F118	I40-V63 PolarHBondContact N-O 2.9Å; I40-V63 PolarHBondContact O-N 3.04Å; V42-V63 HydrophobicContact CB-CG2 4.43Å; V42-V63 HydrophobicContact CG2-CG2 4.35Å; F44-V63 HydrophobicContact CE2-CG2 4.05Å; F44-V63 HydrophobicContact CZ-CG2 4.25Å; L61-V63 HydrophobicContact CD2-CB 4.39Å; L61-V63 HydrophobicContact CD2-CG2 3.48Å; L61-V63 VanDerWaalsContact CD2-CG2 3.48Å; L61-V63 PolarHBondContact O-N 3.29Å; V63-G65 PolarHBondContact O-N 3.45Å; V63-W67 HydrophobicContact CG1-CE3 4.2Å; V63-V72 HydrophobicContact CG1-CG2 3.52Å; V63-V72 HydrophobicContact CG2-CG1 4.25Å; V63-F118 HydrophobicContact CB-CD1 4.08Å; V63-F118 HydrophobicContact CB-CE1 3.95Å; V63-F118 HydrophobicContact CG1-CB 4.29Å; V63-F118 HydrophobicContact CG1-CD1 3.43Å; V63-F118 VanDerWaalsContact CG1-CD1 3.43Å; V63-F118 HydrophobicContact CG1-CD2 4.46Å; V63-F118 HydrophobicContact CG1-CE1 3.74Å; V63-F118 HydrophobicContact CG1-CG 3.82Å; V63-F118 HydrophobicContact CG1-CZ 4.38Å; V63-F118 HydrophobicContact CG2-CE1 4.12Å; V63-F118 HydrophobicContact CG2-CZ 4.35Å
64	A	78.1	Confident	80.8	Confident	14 Å²	14	43.1 Å²	43.1	12%	0.116	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	129.7	169.6	0	0	0	0	0	109.7	N66 W67	A64-N66 VanDerWaalsContact CB-OD1 3.3Å; A64-N66 WeakPolarHBondContact CB-OD1 3.49Å; A64-N66 PolarHBondContact O-N 3.38Å; A64-W67 HydrophobicContact CB-CD2 4.24Å; A64-W67 HydrophobicContact CB-CG 4.13Å; A64-W67 PolarHBondContact O-N 2.91Å
65	G	70.6	Confident	82.3	Confident	3 Å²	3	40.3 Å²	40.3	3%	0.031	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-23	-175.8	0	0	0	0	0	115.4	D38 V63 V117 Q119	D38-G65 PolarHBondContact O-N 3.41Å; V63-G65 PolarHBondContact O-N 3.45Å; G65-V117 VanDerWaalsContact O-CG1 3.27Å; G65-V117 WeakPolarHBondContact O-CG1 3.34Å; G65-Q119 WeakPolarHBondContact O-CB 3.26Å; G65-Q119 WeakPolarHBondContact O-CG 3.04Å; G65-Q119 PolarHBondContact O-N 2.83Å
66	N	69.6	Low	83.5	Confident	39 Å²	39	36.7 Å²	36.7	21%	0.209	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-4.8	179.6	63.2	-18.4	0	0	0	114.9	A64 R350 F352	A64-N66 VanDerWaalsContact CB-OD1 3.3Å; A64-N66 WeakPolarHBondContact CB-OD1 3.49Å; A64-N66 PolarHBondContact O-N 3.38Å; N66-R350 PolarHBondContact ND2-O 2.92Å; N66-F352 HydrophobicContact CB-CD2 4.28Å; N66-F352 WeakPolarHBondContact ND2-CD2 3.38Å; N66-F352 WeakPolarHBondContact ND2-CE2 3.12Å
67	W	77.6	Confident	84.2	Confident	58 Å²	58	34.9 Å²	34.9	22%	0.22	18%	0.184	C	C	.	.	S	Bend	trans	-67.9	149.7	175.3	-72.8	3.4	0	0	0	111.6	L61 V63 A64 Q71 V72 Q75 F118 F352	L61-W67 HydrophobicContact CD2-CZ3 4.21Å; V63-W67 HydrophobicContact CG1-CE3 4.2Å; A64-W67 HydrophobicContact CB-CD2 4.24Å; A64-W67 HydrophobicContact CB-CG 4.13Å; A64-W67 PolarHBondContact O-N 2.91Å; W67-Q71 HydrophobicContact CB-CB 4.39Å; W67-V72 HydrophobicContact CB-CG2 3.88Å; W67-V72 HydrophobicContact CE3-CG2 3.98Å; W67-Q75 HydrophobicContact CE3-CG 4.3Å; W67-Q75 HydrophobicContact CH2-CB 4.49Å; W67-Q75 HydrophobicContact CH2-CG 3.88Å; W67-Q75 HydrophobicContact CZ3-CB 3.92Å; W67-Q75 HydrophobicContact CZ3-CG 3.61Å; W67-F118 WeakPolarHBondContact O-CB 3.15Å; W67-F118 PolarHBondContact O-N 3.37Å; W67-F352 AromaticContact CD1-CE2 3.79Å; W67-F352 AromaticContact CD1-CZ 3.97Å
68	T	79.5	Confident	84.4	Confident	20 Å²	20	38.9 Å²	38.9	12%	0.123	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-79	158	169	68.2	0	0	0	0	111.1	E70 Q71 V72 Q116	T68-E70 PolarHBondContact O-N 2.95Å; T68-Q71 WeakPolarHBondContact O-CB 3.46Å; T68-Q71 PolarHBondContact O-N 2.86Å; T68-Q71 VanDerWaalsContact O-N 3.11Å; T68-Q71 VanDerWaalsContact OG1-CG 3.29Å; T68-Q71 WeakPolarHBondContact OG1-CG 3.44Å; T68-Q71 PolarHBondContact OG1-N 2.87Å; T68-V72 WeakPolarHBondContact O-CG2 3.43Å; T68-V72 PolarHBondContact O-N 3.33Å; T68-Q116 CarbonylContact C-O 3.24Å; T68-Q116 VanDerWaalsContact CA-O 3.29Å; T68-Q116 WeakPolarHBondContact CA-O 3.4Å
69	V	86.1	Confident	84.5	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-54.3	-41.4	174	172.2	0	0	0	0	111.5	V72 K73 L100 I111 K114 Q116 L121	V69-V72 PolarHBondContact O-N 2.78Å; V69-K73 VanDerWaalsContact O-CB 3.28Å; V69-K73 WeakPolarHBondContact O-CB 3.48Å; V69-K73 PolarHBondContact O-N 2.95Å; V69-L100 HydrophobicContact CG1-CD1 3.75Å; V69-I111 HydrophobicContact CB-CG2 4.21Å; V69-I111 HydrophobicContact CG1-CG2 3.65Å; V69-I111 HydrophobicContact CG2-CG2 3.44Å; V69-I111 VanDerWaalsContact CG2-CG2 3.44Å; V69-K114 PolarHBondContact N-O 3.06Å; V69-Q116 HydrophobicContact CG2-CB 4.18Å; V69-Q116 WeakPolarHBondContact CG2-O 3.33Å; V69-Q116 PolarHBondContact N-O 3Å; V69-L121 HydrophobicContact CG2-CD1 4.28Å; V69-L121 HydrophobicContact CG2-CD2 4.13Å
70	E	86.5	Confident	84.3	Confident	73 Å²	73	38.8 Å²	38.8	34%	0.341	19%	0.193	S	C	.	.	H	α-helix	trans	-60.3	-45	175.9	-173.9	169.4	-140.2	0	0	112.4	T68 K73 A74 K114 H115	T68-E70 PolarHBondContact O-N 2.95Å; E70-K73 PolarHBondContact O-N 3.43Å; E70-A74 WeakPolarHBondContact O-CB 3.33Å; E70-A74 PolarHBondContact O-N 2.88Å; E70-K114 HydrophobicContact CB-CB 4.23Å; E70-K114 WeakPolarHBondContact CB-O 3.47Å; E70-K114 PolarHBondContact N-O 2.77Å; E70-K114 IonicContact OE1-NZ 2.71Å; E70-H115 IonicContact OE2-CE1 3.51Å; E70-H115 IonicContact OE2-ND1 2.77Å
71	Q	85.1	Confident	84.1	Confident	63 Å²	63	37.3 Å²	37.3	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-64.2	-44.7	176.9	-72.3	170.6	-25.1	0	0	111.7	W67 T68 K73 A74 Q75 F352	W67-Q71 HydrophobicContact CB-CB 4.39Å; T68-Q71 WeakPolarHBondContact O-CB 3.46Å; T68-Q71 PolarHBondContact O-N 2.86Å; T68-Q71 VanDerWaalsContact O-N 3.11Å; T68-Q71 VanDerWaalsContact OG1-CG 3.29Å; T68-Q71 WeakPolarHBondContact OG1-CG 3.44Å; T68-Q71 PolarHBondContact OG1-N 2.87Å; Q71-K73 VanDerWaalsContact C-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.04Å; Q71-A74 PolarHBondContact O-N 3.28Å; Q71-Q75 WeakPolarHBondContact O-CB 3.46Å; Q71-Q75 VanDerWaalsContact O-CG 3.26Å; Q71-Q75 WeakPolarHBondContact O-CG 3.28Å; Q71-Q75 PolarHBondContact O-N 3.22Å; Q71-F352 VanDerWaalsContact NE2-CD1 3.3Å
72	V	87.4	Confident	83.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-47.2	175.7	173.6	0	0	0	0	110.1	F44 V63 W67 T68 V69 A74 Q75 V76 F118	F44-V72 HydrophobicContact CE1-CG1 4Å; F44-V72 HydrophobicContact CE2-CG1 4.32Å; F44-V72 HydrophobicContact CZ-CG1 3.45Å; F44-V72 VanDerWaalsContact CZ-CG1 3.45Å; V63-V72 HydrophobicContact CG1-CG2 3.52Å; V63-V72 HydrophobicContact CG2-CG1 4.25Å; W67-V72 HydrophobicContact CB-CG2 3.88Å; W67-V72 HydrophobicContact CE3-CG2 3.98Å; T68-V72 WeakPolarHBondContact O-CG2 3.43Å; T68-V72 PolarHBondContact O-N 3.33Å; V69-V72 PolarHBondContact O-N 2.78Å; V72-A74 PolarHBondContact O-N 3.39Å; V72-Q75 PolarHBondContact O-N 3.4Å; V72-V76 HydrophobicContact CG1-CG2 4.39Å; V72-V76 VanDerWaalsContact O-CG2 3.28Å; V72-V76 WeakPolarHBondContact O-CG2 3.4Å; V72-V76 PolarHBondContact O-N 3.31Å; V72-F118 HydrophobicContact CB-CD2 4.29Å; V72-F118 HydrophobicContact CB-CE2 4.41Å; V72-F118 HydrophobicContact CG1-CD2 4.27Å; V72-F118 HydrophobicContact CG1-CE2 3.91Å; V72-F118 HydrophobicContact CG1-CZ 4.44Å; V72-F118 HydrophobicContact CG2-CB 4.3Å; V72-F118 HydrophobicContact CG2-CD2 3.71Å; V72-F118 HydrophobicContact CG2-CE2 4.18Å; V72-F118 HydrophobicContact CG2-CG 4.03Å
73	K	89.1	Confident	83.8	Confident	26 Å²	26	42.4 Å²	42.4	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-42.9	179.1	-164.3	-175.2	-172.5	-166.8	0	112.2	V69 E70 Q71 V76 W77 P95 C98 L100 L139	V69-K73 VanDerWaalsContact O-CB 3.28Å; V69-K73 WeakPolarHBondContact O-CB 3.48Å; V69-K73 PolarHBondContact O-N 2.95Å; E70-K73 PolarHBondContact O-N 3.43Å; Q71-K73 VanDerWaalsContact C-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.04Å; K73-V76 PolarHBondContact O-N 2.95Å; K73-W77 WeakPolarHBondContact O-CB 3.31Å; K73-W77 PolarHBondContact O-N 2.97Å; K73-P95 HydrophobicContact CD-CB 4.27Å; K73-P95 WeakPolarHBondContact CE-O 3.37Å; K73-P95 HydrophobicContact CG-CB 4.27Å; K73-P95 PolarHBondContact NZ-O 3.45Å; K73-C98 WeakPolarHBondContact CE-O 3.49Å; K73-C98 PolarHBondContact NZ-O 2.94Å; K73-L100 HydrophobicContact CB-CD1 4.35Å; K73-L100 HydrophobicContact CG-CD1 4.46Å; K73-L139 HydrophobicContact CG-CD1 4.41Å
74	A	88.1	Confident	83.4	Confident	38 Å²	38	48 Å²	48	31%	0.314	26%	0.255	S	S	.	.	H	α-helix	trans	-63.7	-40.7	175.3	0	0	0	0	0	112.1	E70 Q71 V72 W77 M78	E70-A74 WeakPolarHBondContact O-CB 3.33Å; E70-A74 PolarHBondContact O-N 2.88Å; Q71-A74 PolarHBondContact O-N 3.28Å; V72-A74 PolarHBondContact O-N 3.39Å; A74-W77 WeakPolarHBondContact O-CB 3.22Å; A74-W77 PolarHBondContact O-N 3.49Å; A74-M78 WeakPolarHBondContact O-CG 3.46Å; A74-M78 PolarHBondContact O-N 3.16Å
75	Q	87.9	Confident	83.4	Confident	68 Å²	68	49.2 Å²	49.2	32%	0.318	26%	0.259	S	S	.	.	H	α-helix	trans	-67.5	-41.9	177.6	-71.6	-69.6	-15.6	0	0	112.4	W67 Q71 V72 W77 M78 K79	W67-Q75 HydrophobicContact CE3-CG 4.3Å; W67-Q75 HydrophobicContact CH2-CB 4.49Å; W67-Q75 HydrophobicContact CH2-CG 3.88Å; W67-Q75 HydrophobicContact CZ3-CB 3.92Å; W67-Q75 HydrophobicContact CZ3-CG 3.61Å; Q71-Q75 WeakPolarHBondContact O-CB 3.46Å; Q71-Q75 VanDerWaalsContact O-CG 3.26Å; Q71-Q75 WeakPolarHBondContact O-CG 3.28Å; Q71-Q75 PolarHBondContact O-N 3.22Å; V72-Q75 PolarHBondContact O-N 3.4Å; Q75-W77 VanDerWaalsContact C-N 3.3Å; Q75-W77 PolarHBondContact O-N 2.97Å; Q75-M78 VanDerWaalsContact CD-CE 3.42Å; Q75-M78 HydrophobicContact CG-CE 4.29Å; Q75-M78 VanDerWaalsContact NE2-CE 3.31Å; Q75-M78 PolarHBondContact O-N 3.2Å; Q75-K79 PolarHBondContact O-N 3.4Å
76	V	88.3	Confident	83.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-44.3	172.2	172.4	0	0	0	0	110.2	F44 L46 L61 V72 K73 K79 A80 L139	F44-V76 HydrophobicContact CB-CG1 4.15Å; F44-V76 HydrophobicContact CB-CG2 4.42Å; F44-V76 HydrophobicContact CD1-CG1 4.4Å; F44-V76 HydrophobicContact CD1-CG2 3.79Å; F44-V76 HydrophobicContact CD2-CG2 3.62Å; F44-V76 HydrophobicContact CE1-CG2 3.87Å; F44-V76 HydrophobicContact CE2-CG2 3.71Å; F44-V76 HydrophobicContact CG-CG1 4.2Å; F44-V76 HydrophobicContact CG-CG2 3.66Å; F44-V76 HydrophobicContact CZ-CG2 3.84Å; L46-V76 HydrophobicContact CD2-CG1 3.91Å; L61-V76 HydrophobicContact CD1-CG2 4.3Å; V72-V76 HydrophobicContact CG1-CG2 4.39Å; V72-V76 VanDerWaalsContact O-CG2 3.28Å; V72-V76 WeakPolarHBondContact O-CG2 3.4Å; V72-V76 PolarHBondContact O-N 3.31Å; K73-V76 PolarHBondContact O-N 2.95Å; V76-K79 PolarHBondContact O-N 2.92Å; V76-A80 WeakPolarHBondContact O-CB 3.2Å; V76-A80 PolarHBondContact O-N 3.25Å; V76-L139 HydrophobicContact CG1-CD2 4.48Å
77	W	88.5	Confident	83.6	Confident	24 Å²	24	51.1 Å²	51.1	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-48.8	177.7	-159.5	-86.6	0	0	0	112.5	K73 A74 Q75 K79 A80 V81 F89 Y90 F93 C94 P95 C98 L139	K73-W77 WeakPolarHBondContact O-CB 3.31Å; K73-W77 PolarHBondContact O-N 2.97Å; A74-W77 WeakPolarHBondContact O-CB 3.22Å; A74-W77 PolarHBondContact O-N 3.49Å; Q75-W77 VanDerWaalsContact C-N 3.3Å; Q75-W77 PolarHBondContact O-N 2.97Å; W77-K79 PolarHBondContact O-N 2.9Å; W77-A80 PolarHBondContact O-N 2.8Å; W77-V81 WeakPolarHBondContact O-CG2 3.29Å; W77-V81 PolarHBondContact O-N 3.04Å; W77-F89 HydrophobicContact CH2-CD1 4.48Å; W77-F89 AromaticContact CH2-CE1 3.84Å; W77-F89 HydrophobicContact CH2-CE1 3.84Å; W77-F89 HydrophobicContact CZ3-CE1 4.31Å; W77-Y90 AromaticContact CD2-CD1 3.81Å; W77-Y90 HydrophobicContact CD2-CD1 3.81Å; W77-Y90 AromaticContact CD2-CE1 3.98Å; W77-Y90 HydrophobicContact CD2-CE1 3.98Å; W77-Y90 AromaticContact CE2-CD1 3.46Å; W77-Y90 VanDerWaalsContact CE2-CD1 3.46Å; W77-Y90 HydrophobicContact CE3-CD1 4.2Å; W77-Y90 AromaticContact CE3-CE1 3.98Å; W77-Y90 HydrophobicContact CE3-CE1 3.98Å; W77-Y90 HydrophobicContact CG-CD1 4.35Å; W77-Y90 AromaticContact CH2-CD1 3.96Å; W77-Y90 HydrophobicContact CH2-CD1 3.96Å; W77-Y90 HydrophobicContact CH2-CE1 4.17Å; W77-Y90 AromaticContact CZ2-CD1 3.52Å; W77-Y90 HydrophobicContact CZ2-CD1 3.52Å; W77-Y90 HydrophobicContact CZ2-CE1 4.17Å; W77-Y90 HydrophobicContact CZ2-CG 4.4Å; W77-Y90 HydrophobicContact CZ3-CD1 4.27Å; W77-Y90 HydrophobicContact CZ3-CE1 4.08Å; W77-Y90 AromaticContact NE1-CD1 3.8Å; W77-F93 HydrophobicContact CH2-CB 4.07Å; W77-F93 HydrophobicContact CZ2-CB 4.34Å; W77-F93 VanDerWaalsContact CZ2-O 3.29Å; W77-F93 WeakPolarHBondContact CZ2-O 3.48Å; W77-C94 WeakPolarHBondContact CH2-O 3.34Å; W77-P95 HydrophobicContact CB-CG 3.97Å; W77-P95 HydrophobicContact CD2-CB 4.32Å; W77-P95 HydrophobicContact CD2-CG 3.7Å; W77-P95 HydrophobicContact CE3-CB 4.23Å; W77-P95 HydrophobicContact CE3-CG 4.12Å; W77-P95 HydrophobicContact CG-CG 3.65Å; W77-C98 HydrophobicContact CZ3-CB 4.46Å; W77-L139 HydrophobicContact CE3-CD2 4.29Å; W77-L139 HydrophobicContact CZ3-CD2 4.35Å
78	M	86.7	Confident	83.5	Confident	104 Å²	104	53.4 Å²	53.4	51%	0.512	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-42.3	178.4	-74.4	-168.6	-63.5	0	0	112.1	A74 Q75 V81 S82	A74-M78 WeakPolarHBondContact O-CG 3.46Å; A74-M78 PolarHBondContact O-N 3.16Å; Q75-M78 VanDerWaalsContact CD-CE 3.42Å; Q75-M78 HydrophobicContact CG-CE 4.29Å; Q75-M78 VanDerWaalsContact NE2-CE 3.31Å; Q75-M78 PolarHBondContact O-N 3.2Å; M78-V81 PolarHBondContact O-N 3.15Å; M78-S82 WeakPolarHBondContact O-CB 3.42Å; M78-S82 PolarHBondContact O-N 2.98Å; M78-S82 PolarHBondContact O-OG 3.07Å
79	K	86.8	Confident	83.6	Confident	84 Å²	84	54 Å²	54	37%	0.365	29%	0.292	S	S	.	.	H	α-helix	trans	-63.1	-43.9	175.1	-76.6	-153.3	-167.8	175.1	0	111.8	L59 L61 Q75 V76 W77 V81 S82 L83	L59-K79 HydrophobicContact CD1-CB 4.33Å; L61-K79 HydrophobicContact CD1-CD 3.72Å; L61-K79 HydrophobicContact CD1-CG 4.28Å; Q75-K79 PolarHBondContact O-N 3.4Å; V76-K79 PolarHBondContact O-N 2.92Å; W77-K79 PolarHBondContact O-N 2.9Å; K79-V81 VanDerWaalsContact C-N 3.33Å; K79-V81 PolarHBondContact O-N 2.87Å; K79-S82 WeakPolarHBondContact CA-OG 3.42Å; K79-S82 PolarHBondContact O-N 3.42Å; K79-S82 PolarHBondContact O-OG 2.95Å; K79-L83 WeakPolarHBondContact O-CB 3.44Å; K79-L83 WeakPolarHBondContact O-CG 3.41Å; K79-L83 PolarHBondContact O-N 3.3Å
80	A	85.5	Confident	83.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-43.6	178	0	0	0	0	0	112.2	L46 L59 V76 W77 L83 N84 L85 Y90	L46-A80 HydrophobicContact CD1-CB 4.07Å; L59-A80 HydrophobicContact CD1-CB 4.01Å; V76-A80 WeakPolarHBondContact O-CB 3.2Å; V76-A80 PolarHBondContact O-N 3.25Å; W77-A80 PolarHBondContact O-N 2.8Å; A80-L83 PolarHBondContact O-N 3.02Å; A80-N84 PolarHBondContact O-N 2.77Å; A80-L85 HydrophobicContact CB-CD1 4.49Å; A80-L85 PolarHBondContact O-N 2.97Å; A80-Y90 HydrophobicContact CB-CD1 4.49Å; A80-Y90 HydrophobicContact CB-CE1 3.77Å; A80-Y90 HydrophobicContact CB-CE2 4.2Å
81	V	85.1	Confident	83	Confident	77 Å²	77	58.9 Å²	58.9	47%	0.467	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-44.4	174.5	173.7	0	0	0	0	111.4	W77 M78 K79 L83 N84 Y90	W77-V81 WeakPolarHBondContact O-CG2 3.29Å; W77-V81 PolarHBondContact O-N 3.04Å; M78-V81 PolarHBondContact O-N 3.15Å; K79-V81 VanDerWaalsContact C-N 3.33Å; K79-V81 PolarHBondContact O-N 2.87Å; V81-L83 VanDerWaalsContact C-N 3.26Å; V81-L83 PolarHBondContact O-N 2.78Å; V81-N84 PolarHBondContact O-N 3.32Å; V81-Y90 HydrophobicContact CG2-CD1 4.2Å; V81-Y90 HydrophobicContact CG2-CG 4.16Å
82	S	85.2	Confident	82.8	Confident	93 Å²	93	65.7 Å²	65.7	65%	0.65	34%	0.336	S	S	*	.	H	α-helix	trans	-63.7	-31	179.9	74.1	0	0	0	0	113.5	M78 K79 N84	M78-S82 WeakPolarHBondContact O-CB 3.42Å; M78-S82 PolarHBondContact O-N 2.98Å; M78-S82 PolarHBondContact O-OG 3.07Å; K79-S82 WeakPolarHBondContact CA-OG 3.42Å; K79-S82 PolarHBondContact O-N 3.42Å; K79-S82 PolarHBondContact O-OG 2.95Å; S82-N84 VanDerWaalsContact C-N 3.26Å
83	L	83.6	Confident	82.6	Confident	102 Å²	102	69.1 Å²	69.1	53%	0.534	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	2.1	176.9	-67	169.1	0	0	0	112.6	L59 K79 A80 V81 L85	L59-L83 HydrophobicContact CD2-CD1 3.39Å; K79-L83 WeakPolarHBondContact O-CB 3.44Å; K79-L83 WeakPolarHBondContact O-CG 3.41Å; K79-L83 PolarHBondContact O-N 3.3Å; A80-L83 PolarHBondContact O-N 3.02Å; V81-L83 VanDerWaalsContact C-N 3.26Å; V81-L83 PolarHBondContact O-N 2.78Å; L83-L85 HydrophobicContact CB-CD1 4.29Å; L83-L85 HydrophobicContact CB-CG 4.01Å; L83-L85 PolarHBondContact O-N 3.03Å
84	N	76.4	Confident	82.3	Confident	116 Å²	116	70 Å²	70	62%	0.62	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	36.3	179.7	-157.9	23.9	0	0	0	113.8	A80 V81 S82 C86	A80-N84 PolarHBondContact O-N 2.77Å; V81-N84 PolarHBondContact O-N 3.32Å; S82-N84 VanDerWaalsContact C-N 3.26Å; N84-C86 PolarHBondContact O-N 2.88Å
85	L	77.1	Confident	82	Confident	40 Å²	40	69.8 Å²	69.8	21%	0.209	36%	0.355	C	S	.	.			trans	-74.3	114.8	176.5	-61.2	174.9	0	0	0	108.7	L46 D57 L59 A80 L83 Y90	L46-L85 HydrophobicContact CD1-CD1 3.56Å; D57-L85 HydrophobicContact CB-CD1 4.49Å; L59-L85 HydrophobicContact CD1-CD1 4.46Å; L59-L85 HydrophobicContact CD2-CD1 3.99Å; L59-L85 HydrophobicContact CG-CD1 4.32Å; A80-L85 HydrophobicContact CB-CD1 4.49Å; A80-L85 PolarHBondContact O-N 2.97Å; L83-L85 HydrophobicContact CB-CD1 4.29Å; L83-L85 HydrophobicContact CB-CG 4.01Å; L83-L85 PolarHBondContact O-N 3.03Å; L85-Y90 WeakPolarHBondContact O-CD2 3.37Å; L85-Y90 WeakPolarHBondContact O-CE2 3.42Å
86	C	73.5	Confident	81.8	Confident	47 Å²	47	71 Å²	71	32%	0.318	37%	0.365	S	S	.	.	S	Bend	trans	40.7	69.4	177.5	-159.7	0	0	0	0	115.2	T48 N84 D88 F89 Y90	T48-C86 HydrophobicContact CG2-CB 3.6Å; N84-C86 PolarHBondContact O-N 2.88Å; C86-D88 PolarHBondContact O-N 2.9Å; C86-D88 VanDerWaalsContact O-N 3.07Å; C86-F89 PolarHBondContact O-N 3.2Å; C86-Y90 WeakPolarHBondContact O-CD2 3.45Å
87	P	70.8	Confident	81.6	Confident	36 Å²	36	75.3 Å²	75.3	23%	0.234	38%	0.384	C	S	.	.	H	α-helix	trans	-56.5	-30.1	-171.6	17.8	-30.4	0	0	0	114.7	F89 Y90 Q91	P87-F89 VanDerWaalsContact C-N 3.3Å; P87-F89 PolarHBondContact O-N 3.14Å; P87-Y90 PolarHBondContact O-N 2.82Å; P87-Q91 WeakPolarHBondContact O-CB 3.36Å; P87-Q91 VanDerWaalsContact O-CG 3.26Å; P87-Q91 WeakPolarHBondContact O-CG 3.45Å; P87-Q91 PolarHBondContact O-N 2.75Å
88	D	76.5	Confident	81.5	Confident	106 Å²	106	74.2 Å²	74.2	57%	0.567	38%	0.38	S	S	*	.	H	α-helix	trans	-63	-33.7	179.2	-57.4	-42.3	0	0	0	112.8	C86 R92	C86-D88 PolarHBondContact O-N 2.9Å; C86-D88 VanDerWaalsContact O-N 3.07Å; D88-R92 WeakPolarHBondContact O-CB 3.38Å
89	F	82	Confident	81.6	Confident	33 Å²	33	70 Å²	70	15%	0.145	36%	0.36	C	S	.	.	H	α-helix	trans	-71.9	-50.1	177.4	-179.9	-92.4	0	0	0	111.1	P47 T48 W77 C86 P87 Q91 R92 F93 P141	P47-F89 HydrophobicContact CB-CZ 4.12Å; P47-F89 HydrophobicContact CG-CD1 4.36Å; P47-F89 HydrophobicContact CG-CE1 3.55Å; P47-F89 HydrophobicContact CG-CE2 4.33Å; P47-F89 HydrophobicContact CG-CZ 3.54Å; T48-F89 HydrophobicContact CG2-CB 3.87Å; T48-F89 HydrophobicContact CG2-CD1 3.95Å; T48-F89 HydrophobicContact CG2-CD2 4.49Å; T48-F89 HydrophobicContact CG2-CG 3.85Å; W77-F89 HydrophobicContact CH2-CD1 4.48Å; W77-F89 AromaticContact CH2-CE1 3.84Å; W77-F89 HydrophobicContact CH2-CE1 3.84Å; W77-F89 HydrophobicContact CZ3-CE1 4.31Å; C86-F89 PolarHBondContact O-N 3.2Å; P87-F89 VanDerWaalsContact C-N 3.3Å; P87-F89 PolarHBondContact O-N 3.14Å; F89-Q91 VanDerWaalsContact C-N 3.29Å; F89-Q91 PolarHBondContact O-N 3.11Å; F89-R92 PolarHBondContact O-N 3.4Å; F89-R92 VanDerWaalsContact O-N 3.15Å; F89-F93 AromaticContact CD2-CD2 3.72Å; F89-F93 HydrophobicContact CD2-CD2 3.72Å; F89-F93 AromaticContact CD2-CE2 3.98Å; F89-F93 HydrophobicContact CD2-CE2 3.98Å; F89-F93 AromaticContact CE2-CD2 3.64Å; F89-F93 HydrophobicContact CE2-CD2 3.64Å; F89-F93 AromaticContact CE2-CE2 3.92Å; F89-F93 HydrophobicContact CE2-CE2 3.92Å; F89-F93 HydrophobicContact CE2-CG 4.41Å; F89-F93 HydrophobicContact CG-CD2 4.22Å; F89-F93 HydrophobicContact CZ-CD2 4.08Å; F89-F93 HydrophobicContact CZ-CG 4.46Å; F89-F93 WeakPolarHBondContact O-CD2 3.42Å; F89-F93 PolarHBondContact O-N 3.34Å; F89-P141 HydrophobicContact CE2-CG 4.25Å; F89-P141 HydrophobicContact CZ-CG 4.29Å
90	Y	80.8	Confident	81.8	Confident	18 Å²	18	66.2 Å²	66.2	7%	0.071	34%	0.343	C	S	.	.	H	α-helix	trans	-74.7	-15.4	-174.8	-66	-84	0	0	0	114	T48 W77 A80 V81 L85 C86 P87	T48-Y90 HydrophobicContact CG2-CE2 3.88Å; W77-Y90 AromaticContact CD2-CD1 3.81Å; W77-Y90 HydrophobicContact CD2-CD1 3.81Å; W77-Y90 AromaticContact CD2-CE1 3.98Å; W77-Y90 HydrophobicContact CD2-CE1 3.98Å; W77-Y90 AromaticContact CE2-CD1 3.46Å; W77-Y90 VanDerWaalsContact CE2-CD1 3.46Å; W77-Y90 HydrophobicContact CE3-CD1 4.2Å; W77-Y90 AromaticContact CE3-CE1 3.98Å; W77-Y90 HydrophobicContact CE3-CE1 3.98Å; W77-Y90 HydrophobicContact CG-CD1 4.35Å; W77-Y90 AromaticContact CH2-CD1 3.96Å; W77-Y90 HydrophobicContact CH2-CD1 3.96Å; W77-Y90 HydrophobicContact CH2-CE1 4.17Å; W77-Y90 AromaticContact CZ2-CD1 3.52Å; W77-Y90 HydrophobicContact CZ2-CD1 3.52Å; W77-Y90 HydrophobicContact CZ2-CE1 4.17Å; W77-Y90 HydrophobicContact CZ2-CG 4.4Å; W77-Y90 HydrophobicContact CZ3-CD1 4.27Å; W77-Y90 HydrophobicContact CZ3-CE1 4.08Å; W77-Y90 AromaticContact NE1-CD1 3.8Å; A80-Y90 HydrophobicContact CB-CD1 4.49Å; A80-Y90 HydrophobicContact CB-CE1 3.77Å; A80-Y90 HydrophobicContact CB-CE2 4.2Å; V81-Y90 HydrophobicContact CG2-CD1 4.2Å; V81-Y90 HydrophobicContact CG2-CG 4.16Å; L85-Y90 WeakPolarHBondContact O-CD2 3.37Å; L85-Y90 WeakPolarHBondContact O-CE2 3.42Å; C86-Y90 WeakPolarHBondContact O-CD2 3.45Å; P87-Y90 PolarHBondContact O-N 2.82Å
91	Q	79.7	Confident	82	Confident	161 Å²	161	67.1 Å²	67.1	75%	0.752	35%	0.348	S	S	*	.	H	α-helix	trans	-80.8	-29	168.5	-74.1	177	12.9	0	0	112.9	P87 F89	P87-Q91 WeakPolarHBondContact O-CB 3.36Å; P87-Q91 VanDerWaalsContact O-CG 3.26Å; P87-Q91 WeakPolarHBondContact O-CG 3.45Å; P87-Q91 PolarHBondContact O-N 2.75Å; F89-Q91 VanDerWaalsContact C-N 3.29Å; F89-Q91 PolarHBondContact O-N 3.11Å
92	R	79.5	Confident	82.3	Confident	205 Å²	205	63.8 Å²	63.8	77%	0.774	33%	0.327	S	S	*	.	H	α-helix	trans	-89.8	-30.2	-176.2	-174.1	172.4	-179.6	174	0	113.4	D88 F89	D88-R92 WeakPolarHBondContact O-CB 3.38Å; F89-R92 PolarHBondContact O-N 3.4Å; F89-R92 VanDerWaalsContact O-N 3.15Å
93	F	83.3	Confident	82.4	Confident	73 Å²	73	65.4 Å²	65.4	32%	0.32	33%	0.325	S	S	.	.			trans	-114.8	165.3	-177.2	-63.6	-76.6	0	0	0	111.4	W77 F89 H97	W77-F93 HydrophobicContact CH2-CB 4.07Å; W77-F93 HydrophobicContact CZ2-CB 4.34Å; W77-F93 VanDerWaalsContact CZ2-O 3.29Å; W77-F93 WeakPolarHBondContact CZ2-O 3.48Å; F89-F93 AromaticContact CD2-CD2 3.72Å; F89-F93 HydrophobicContact CD2-CD2 3.72Å; F89-F93 AromaticContact CD2-CE2 3.98Å; F89-F93 HydrophobicContact CD2-CE2 3.98Å; F89-F93 AromaticContact CE2-CD2 3.64Å; F89-F93 HydrophobicContact CE2-CD2 3.64Å; F89-F93 AromaticContact CE2-CE2 3.92Å; F89-F93 HydrophobicContact CE2-CE2 3.92Å; F89-F93 HydrophobicContact CE2-CG 4.41Å; F89-F93 HydrophobicContact CG-CD2 4.22Å; F89-F93 HydrophobicContact CZ-CD2 4.08Å; F89-F93 HydrophobicContact CZ-CG 4.46Å; F89-F93 WeakPolarHBondContact O-CD2 3.42Å; F89-F93 PolarHBondContact O-N 3.34Å; F93-H97 HydrophobicContact CB-CB 4.21Å; F93-H97 HydrophobicContact CD1-CB 3.87Å; F93-H97 AromaticContact CD1-CG 3.91Å; F93-H97 HydrophobicContact CG-CB 4.46Å
94	C	83.6	Confident	82.4	Confident	44 Å²	44	62.5 Å²	62.5	30%	0.297	31%	0.308	S	S	.	.			trans	-121	168.4	169.9	82.4	0	0	0	0	109.5	W77 D96 H97	W77-C94 WeakPolarHBondContact CH2-O 3.34Å; C94-D96 PolarHBondContact O-N 3.19Å; C94-D96 VanDerWaalsContact O-N 3.1Å; C94-H97 PolarHBondContact N-ND1 2.97Å; C94-H97 VanDerWaalsContact N-ND1 3.16Å; C94-H97 WeakPolarHBondContact O-CB 3.49Å; C94-H97 PolarHBondContact O-N 3.49Å; C94-H97 PolarHBondContact O-ND1 3.31Å; C94-H97 PolarHBondContact SG-CE1 2.81Å; C94-H97 PolarHBondContact SG-ND1 3.3Å
95	P	81.8	Confident	82.7	Confident	33 Å²	33	65.3 Å²	65.3	21%	0.214	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-46.9	-43.8	177.5	-28	33.5	0	0	0	113	K73 W77 H97 C98	K73-P95 HydrophobicContact CD-CB 4.27Å; K73-P95 WeakPolarHBondContact CE-O 3.37Å; K73-P95 HydrophobicContact CG-CB 4.27Å; K73-P95 PolarHBondContact NZ-O 3.45Å; W77-P95 HydrophobicContact CB-CG 3.97Å; W77-P95 HydrophobicContact CD2-CB 4.32Å; W77-P95 HydrophobicContact CD2-CG 3.7Å; W77-P95 HydrophobicContact CE3-CB 4.23Å; W77-P95 HydrophobicContact CE3-CG 4.12Å; W77-P95 HydrophobicContact CG-CG 3.65Å; P95-H97 PolarHBondContact O-N 3.09Å; P95-H97 VanDerWaalsContact O-N 3.08Å; P95-C98 PolarHBondContact O-N 3.39Å
96	D	82.6	Confident	82.8	Confident	95 Å²	95	66.1 Å²	66.1	51%	0.508	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21	-176	-62.7	-30.4	0	0	0	114.9	C94 C98	C94-D96 PolarHBondContact O-N 3.19Å; C94-D96 VanDerWaalsContact O-N 3.1Å; D96-C98 PolarHBondContact O-N 2.77Å
97	H	85.8	Confident	83.2	Confident	91 Å²	91	66.7 Å²	66.7	42%	0.421	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-75.9	-6.8	174.7	-63.8	91.5	0	0	0	113.5	F93 C94 P95 R142	F93-H97 HydrophobicContact CB-CB 4.21Å; F93-H97 HydrophobicContact CD1-CB 3.87Å; F93-H97 AromaticContact CD1-CG 3.91Å; F93-H97 HydrophobicContact CG-CB 4.46Å; C94-H97 PolarHBondContact N-ND1 2.97Å; C94-H97 VanDerWaalsContact N-ND1 3.16Å; C94-H97 WeakPolarHBondContact O-CB 3.49Å; C94-H97 PolarHBondContact O-N 3.49Å; C94-H97 PolarHBondContact O-ND1 3.31Å; C94-H97 PolarHBondContact SG-CE1 2.81Å; C94-H97 PolarHBondContact SG-ND1 3.3Å; P95-H97 PolarHBondContact O-N 3.09Å; P95-H97 VanDerWaalsContact O-N 3.08Å; H97-R142 WeakPolarHBondContact O-CB 3.39Å; H97-R142 PolarHBondContact O-N 3.3Å
98	C	86.3	Confident	83.9	Confident	1 Å²	1	68 Å²	68	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	157.9	177.5	-63.6	0	0	0	0	111.8	K73 W77 P95 D96 L139 V140	K73-C98 WeakPolarHBondContact CE-O 3.49Å; K73-C98 PolarHBondContact NZ-O 2.94Å; W77-C98 HydrophobicContact CZ3-CB 4.46Å; P95-C98 PolarHBondContact O-N 3.39Å; D96-C98 PolarHBondContact O-N 2.77Å; C98-L139 HydrophobicContact CB-CD1 3.49Å; C98-L139 VanDerWaalsContact CB-CD1 3.49Å; C98-L139 HydrophobicContact CB-CD2 4.49Å; C98-L139 HydrophobicContact CB-CG 3.84Å; C98-V140 CarbonylContact C-O 3.43Å; C98-V140 WeakPolarHBondContact CA-O 3.49Å; C98-V140 WeakPolarHBondContact CB-O 3.49Å
99	I	88.6	Confident	84.4	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.082	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.9	172.3	65.5	179.7	0	0	0	109.6	L101 E110 L139 V140 R142	I99-L101 HydrophobicContact CD1-CD1 4.4Å; I99-L101 HydrophobicContact CD1-CD2 3.9Å; I99-L101 HydrophobicContact CD1-CG 4.28Å; I99-L101 HydrophobicContact CG1-CD2 4.18Å; I99-L101 HydrophobicContact CG1-CG 4.25Å; I99-E110 HydrophobicContact CB-CG 4.5Å; I99-L139 WeakPolarHBondContact O-CA 3.22Å; I99-V140 HydrophobicContact CG1-CG2 3.88Å; I99-V140 PolarHBondContact N-O 2.71Å; I99-V140 PolarHBondContact O-N 3.27Å; I99-R142 HydrophobicContact CG2-CB 4.25Å; I99-R142 HydrophobicContact CG2-CG 4.41Å
100	L	90.1	Very high	84.7	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.1	178.2	-68.9	172.3	0	0	0	109.2	F44 V69 K73 E110 I111 I137 Q138 L139	F44-L100 HydrophobicContact CD1-CD2 4.41Å; F44-L100 HydrophobicContact CE1-CD2 4.34Å; V69-L100 HydrophobicContact CG1-CD1 3.75Å; K73-L100 HydrophobicContact CB-CD1 4.35Å; K73-L100 HydrophobicContact CG-CD1 4.46Å; L100-E110 WeakPolarHBondContact O-CA 3.39Å; L100-I111 HydrophobicContact CB-CB 4.06Å; L100-I111 HydrophobicContact CB-CD1 4.23Å; L100-I111 PolarHBondContact O-N 3.34Å; L100-I137 HydrophobicContact CB-CG2 4.04Å; L100-I137 HydrophobicContact CD2-CG2 3.84Å; L100-I137 HydrophobicContact CG-CG2 4.47Å; L100-Q138 CarbonylContact C-O 3.43Å; L100-Q138 WeakPolarHBondContact CA-O 3.3Å; L100-L139 HydrophobicContact CD2-CB 4.24Å; L100-L139 HydrophobicContact CD2-CD1 3.54Å; L100-L139 HydrophobicContact CG-CD1 4.24Å
101	L	90.3	Very high	85	Confident	20 Å²	20	61.4 Å²	61.4	11%	0.105	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.9	-179.4	-57	-175.5	0	0	0	111	I99 V108 C109 E110 I137 Q138 V140 A326	I99-L101 HydrophobicContact CD1-CD1 4.4Å; I99-L101 HydrophobicContact CD1-CD2 3.9Å; I99-L101 HydrophobicContact CD1-CG 4.28Å; I99-L101 HydrophobicContact CG1-CD2 4.18Å; I99-L101 HydrophobicContact CG1-CG 4.25Å; L101-V108 HydrophobicContact CB-CG1 3.92Å; L101-V108 HydrophobicContact CD1-CG1 3.76Å; L101-V108 HydrophobicContact CD2-CG1 4.34Å; L101-V108 HydrophobicContact CG-CG1 4.23Å; L101-C109 CarbonylContact C-O 3.54Å; L101-C109 VanDerWaalsContact CA-O 3.27Å; L101-C109 WeakPolarHBondContact CA-O 3.43Å; L101-E110 HydrophobicContact CD2-CB 3.64Å; L101-E110 HydrophobicContact CD2-CG 3.95Å; L101-I137 CarbonylContact O-C 3.57Å; L101-I137 WeakPolarHBondContact O-CA 3.45Å; L101-I137 WeakPolarHBondContact O-CG2 3.46Å; L101-Q138 HydrophobicContact CB-CB 4.44Å; L101-Q138 PolarHBondContact N-O 2.74Å; L101-Q138 PolarHBondContact O-N 3.28Å; L101-V140 HydrophobicContact CB-CG2 4.47Å; L101-V140 HydrophobicContact CD1-CG2 3.44Å; L101-V140 VanDerWaalsContact CD1-CG2 3.44Å; L101-V140 HydrophobicContact CG-CG2 3.67Å; L101-A326 HydrophobicContact CD2-CB 3.86Å
102	Y	91	Very high	85.2	Confident	6 Å²	6	55.7 Å²	55.7	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	163.4	169.7	73.7	-83.2	0	0	0	110.6	K104 C109 I111 D122 C123 D329	Y102-K104 HydrophobicContact CD2-CB 4.29Å; Y102-K104 HydrophobicContact CE2-CB 3.77Å; Y102-K104 HydrophobicContact CE2-CD 4.34Å; Y102-C109 HydrophobicContact CD1-CB 3.86Å; Y102-C109 WeakPolarHBondContact CD1-O 3.32Å; Y102-C109 HydrophobicContact CD2-CB 4.44Å; Y102-C109 HydrophobicContact CE1-CB 3.39Å; Y102-C109 HydrophobicContact CE2-CB 4.02Å; Y102-C109 HydrophobicContact CG-CB 4.39Å; Y102-C109 VanDerWaalsContact CZ-CB 3.49Å; Y102-C109 PolarHBondContact N-O 2.73Å; Y102-C109 PolarHBondContact O-N 2.87Å; Y102-I111 HydrophobicContact CD1-CD1 4.18Å; Y102-I111 HydrophobicContact CD1-CG1 3.79Å; Y102-I111 HydrophobicContact CE1-CG1 4.04Å; Y102-D122 PolarHBondContact OH-OD2 2.69Å; Y102-C123 HydrophobicContact CD1-CB 3.88Å; Y102-C123 HydrophobicContact CD2-CB 3.34Å; Y102-C123 HydrophobicContact CE1-CB 3.87Å; Y102-C123 HydrophobicContact CE2-CB 3.34Å; Y102-C123 HydrophobicContact CG-CB 3.6Å; Y102-C123 PolarHBondContact OH-N 3.44Å; Y102-D329 WeakPolarHBondContact CE1-OD2 2.96Å; Y102-D329 PolarHBondContact OH-OD2 2.95Å
103	Q	87.2	Confident	85.4	Confident	128 Å²	128	46 Å²	46	60%	0.598	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.2	179.6	-161.9	177.4	11.6	0	0	111.2	T107	Q103-T107 WeakPolarHBondContact CA-O 3.48Å
104	K	84.6	Confident	85.3	Confident	41 Å²	41	47 Å²	47	18%	0.178	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	118.9	176	-177.8	176.3	169.9	-177	0	109.3	Y102 G106 T107 D122 Y126	Y102-K104 HydrophobicContact CD2-CB 4.29Å; Y102-K104 HydrophobicContact CE2-CB 3.77Å; Y102-K104 HydrophobicContact CE2-CD 4.34Å; K104-G106 PolarHBondContact O-N 3.23Å; K104-G106 VanDerWaalsContact O-N 3.11Å; K104-T107 PolarHBondContact N-O 3.38Å; K104-T107 PolarHBondContact O-N 2.74Å; K104-D122 IonicContact NZ-OD1 2.7Å; K104-D122 PolarHBondContact NZ-OD1 3.25Å; K104-D122 IonicContact NZ-OD2 3.11Å; K104-D122 PolarHBondContact NZ-OD2 2.98Å; K104-Y126 HydrophobicContact CB-CE1 4.47Å; K104-Y126 HydrophobicContact CD-CG 4.47Å; K104-Y126 HydrophobicContact CG-CD1 4.19Å; K104-Y126 HydrophobicContact CG-CD2 4.12Å; K104-Y126 HydrophobicContact CG-CE1 4.23Å; K104-Y126 HydrophobicContact CG-CE2 4.15Å; K104-Y126 HydrophobicContact CG-CG 4.12Å
105	K	82.1	Confident	85.1	Confident	175 Å²	175	48 Å²	48	76%	0.761	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	38	179.7	-59.5	-177	176.2	-177	0	114.4	T107 Y126	K105-T107 VanDerWaalsContact C-N 3.33Å; K105-Y126 HydrophobicContact CG-CE2 4.02Å; K105-Y126 PolarHBondContact N-OH 3.36Å
106	G	79	Confident	85	Confident	57 Å²	57	46.4 Å²	46.4	59%	0.588	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.4	-17.4	-178.5	0	0	0	0	0	115	K104	K104-G106 PolarHBondContact O-N 3.23Å; K104-G106 VanDerWaalsContact O-N 3.11Å
107	T	82	Confident	84.8	Confident	58 Å²	58	42.2 Å²	42.2	36%	0.356	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	143.8	179.2	-48.4	0	0	0	0	111.7	Q103 K104 K105	Q103-T107 WeakPolarHBondContact CA-O 3.48Å; K104-T107 PolarHBondContact N-O 3.38Å; K104-T107 PolarHBondContact O-N 2.74Å; K105-T107 VanDerWaalsContact C-N 3.33Å
108	V	85.6	Confident	84.5	Confident	65 Å²	65	37.9 Å²	37.9	39%	0.394	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.2	173.9	-177.6	0	0	0	0	109.4	L101 Q327	L101-V108 HydrophobicContact CB-CG1 3.92Å; L101-V108 HydrophobicContact CD1-CG1 3.76Å; L101-V108 HydrophobicContact CD2-CG1 4.34Å; L101-V108 HydrophobicContact CG-CG1 4.23Å; V108-Q327 PolarHBondContact O-N 3.33Å
109	C	87.1	Confident	84.1	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.027	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.9	-179.5	-61.5	0	0	0	0	110.3	L101 Y102 Q327	L101-C109 CarbonylContact C-O 3.54Å; L101-C109 VanDerWaalsContact CA-O 3.27Å; L101-C109 WeakPolarHBondContact CA-O 3.43Å; Y102-C109 HydrophobicContact CD1-CB 3.86Å; Y102-C109 WeakPolarHBondContact CD1-O 3.32Å; Y102-C109 HydrophobicContact CD2-CB 4.44Å; Y102-C109 HydrophobicContact CE1-CB 3.39Å; Y102-C109 HydrophobicContact CE2-CB 4.02Å; Y102-C109 HydrophobicContact CG-CB 4.39Å; Y102-C109 VanDerWaalsContact CZ-CB 3.49Å; Y102-C109 PolarHBondContact N-O 2.73Å; Y102-C109 PolarHBondContact O-N 2.87Å; C109-Q327 CarbonylContact C-O 3.53Å; C109-Q327 WeakPolarHBondContact CA-O 3.41Å
110	E	88	Confident	83.5	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.028	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.9	173.1	-175	-176.5	-175.9	0	0	111.2	I99 L100 L101 Y112 R180 A326 Q327 D329	I99-E110 HydrophobicContact CB-CG 4.5Å; L100-E110 WeakPolarHBondContact O-CA 3.39Å; L101-E110 HydrophobicContact CD2-CB 3.64Å; L101-E110 HydrophobicContact CD2-CG 3.95Å; E110-Y112 VanDerWaalsContact C-N 3.28Å; E110-Y112 PolarHBondContact O-N 3Å; E110-Y112 VanDerWaalsContact O-N 3.08Å; E110-R180 IonicContact OE2-CZ 3.47Å; E110-R180 IonicContact OE2-NH2 3.53Å; E110-R180 PolarHBondContact OE2-NH2 2.69Å; E110-A326 HydrophobicContact CB-CB 3.83Å; E110-Q327 PolarHBondContact N-O 3.28Å; E110-D329 PolarHBondContact O-N 3.32Å; E110-D329 VanDerWaalsContact O-N 3.11Å
111	I	87.6	Confident	83.1	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.036	20%	0.204	C	C	.	.			trans	-81.1	83.9	165	-56.4	170.3	0	0	0	107.2	V69 L100 Y102 L121 I137	V69-I111 HydrophobicContact CB-CG2 4.21Å; V69-I111 HydrophobicContact CG1-CG2 3.65Å; V69-I111 HydrophobicContact CG2-CG2 3.44Å; V69-I111 VanDerWaalsContact CG2-CG2 3.44Å; L100-I111 HydrophobicContact CB-CB 4.06Å; L100-I111 HydrophobicContact CB-CD1 4.23Å; L100-I111 PolarHBondContact O-N 3.34Å; Y102-I111 HydrophobicContact CD1-CD1 4.18Å; Y102-I111 HydrophobicContact CD1-CG1 3.79Å; Y102-I111 HydrophobicContact CE1-CG1 4.04Å; I111-L121 HydrophobicContact CB-CD2 4.48Å; I111-L121 HydrophobicContact CD1-CD1 4.05Å; I111-L121 HydrophobicContact CG1-CD2 4.33Å; I111-L121 HydrophobicContact CG2-CD1 4.23Å; I111-L121 HydrophobicContact CG2-CD2 3.49Å; I111-L121 VanDerWaalsContact CG2-CD2 3.49Å; I111-I137 HydrophobicContact CD1-CD1 3.79Å; I111-I137 HydrophobicContact CD1-CG1 4.49Å; I111-I137 HydrophobicContact CD1-CG2 4.33Å
112	Y	83.8	Confident	82.7	Confident	41 Å²	41	39.5 Å²	39.5	16%	0.161	20%	0.204	C	C	.	.			trans	-79.5	-41.8	-170	179.6	-102.7	0	0	0	113.3	E110 K114 F177 R180 V328	E110-Y112 VanDerWaalsContact C-N 3.28Å; E110-Y112 PolarHBondContact O-N 3Å; E110-Y112 VanDerWaalsContact O-N 3.08Å; Y112-K114 PolarHBondContact O-N 3.4Å; Y112-K114 VanDerWaalsContact O-N 3.12Å; Y112-F177 HydrophobicContact CD1-CD2 4.22Å; Y112-F177 HydrophobicContact CE1-CD2 4.05Å; Y112-R180 HydrophobicContact CD2-CG 4.4Å; Y112-R180 HydrophobicContact CE1-CB 4.28Å; Y112-R180 HydrophobicContact CE1-CG 4.16Å; Y112-R180 HydrophobicContact CE2-CB 4.47Å; Y112-R180 HydrophobicContact CE2-CG 3.78Å; Y112-V328 HydrophobicContact CG-CG2 4.37Å
113	D	83.4	Confident	82.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.202	C	C	.	.			trans	-79.7	99.9	-173.7	-175.4	11.2	0	0	0	111.3	H115 Q116 T332 G333 R480	D113-H115 PolarHBondContact O-N 3.45Å; D113-H115 VanDerWaalsContact O-N 3.12Å; D113-H115 PolarHBondContact OD1-N 2.91Å; D113-Q116 HydrophobicContact CB-CB 3.97Å; D113-Q116 VanDerWaalsContact O-CB 3.28Å; D113-Q116 WeakPolarHBondContact O-CB 3.49Å; D113-Q116 PolarHBondContact O-N 3.19Å; D113-T332 HydrophobicContact CB-CG2 4.2Å; D113-G333 WeakPolarHBondContact OD2-CA 3.31Å; D113-G333 PolarHBondContact OD2-N 2.96Å; D113-G333 VanDerWaalsContact OD2-N 3.12Å; D113-R480 IonicContact OD1-CZ 3.8Å; D113-R480 IonicContact OD1-NE 3.07Å; D113-R480 PolarHBondContact OD1-NE 3.1Å; D113-R480 IonicContact OD1-NH2 3.93Å; D113-R480 IonicContact OD2-NE 2.71Å; D113-R480 PolarHBondContact OD2-NE 3.32Å
114	K	81.8	Confident	82.2	Confident	95 Å²	95	33.2 Å²	33.2	41%	0.413	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.5	-179	69.9	176.2	-176.4	163.5	0	113.9	V69 E70 Y112	V69-K114 PolarHBondContact N-O 3.06Å; E70-K114 HydrophobicContact CB-CB 4.23Å; E70-K114 WeakPolarHBondContact CB-O 3.47Å; E70-K114 PolarHBondContact N-O 2.77Å; E70-K114 IonicContact OE1-NZ 2.71Å; Y112-K114 PolarHBondContact O-N 3.4Å; Y112-K114 VanDerWaalsContact O-N 3.12Å
115	H	79.3	Confident	81.9	Confident	65 Å²	65	37 Å²	37	30%	0.301	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-7.2	-179.6	-60.5	-53.9	0	0	0	113.4	E70 D113 V334	E70-H115 IonicContact OE2-CE1 3.51Å; E70-H115 IonicContact OE2-ND1 2.77Å; D113-H115 PolarHBondContact O-N 3.45Å; D113-H115 VanDerWaalsContact O-N 3.12Å; D113-H115 PolarHBondContact OD1-N 2.91Å; H115-V334 HydrophobicContact CB-CG2 4.18Å; H115-V334 WeakPolarHBondContact O-CG2 3.37Å
116	Q	79.6	Confident	82	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	-62.5	141.1	178.4	-177.3	169.9	9.8	0	0	111	T68 V69 D113 T120 L121 C331	T68-Q116 CarbonylContact C-O 3.24Å; T68-Q116 VanDerWaalsContact CA-O 3.29Å; T68-Q116 WeakPolarHBondContact CA-O 3.4Å; V69-Q116 HydrophobicContact CG2-CB 4.18Å; V69-Q116 WeakPolarHBondContact CG2-O 3.33Å; V69-Q116 PolarHBondContact N-O 3Å; D113-Q116 HydrophobicContact CB-CB 3.97Å; D113-Q116 VanDerWaalsContact O-CB 3.28Å; D113-Q116 WeakPolarHBondContact O-CB 3.49Å; D113-Q116 PolarHBondContact O-N 3.19Å; Q116-T120 WeakPolarHBondContact CG-OG1 3.41Å; Q116-L121 HydrophobicContact CG-CD2 3.98Å; Q116-L121 VanDerWaalsContact OE1-CD2 3.3Å; Q116-C331 VanDerWaalsContact NE2-C 3.3Å; Q116-C331 PolarHBondContact NE2-O 3.35Å
117	V	77.9	Confident	82.3	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.042	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-75.1	132.2	174.7	-176	0	0	0	0	109.3	G65 Q119 T120 V334	G65-V117 VanDerWaalsContact O-CG1 3.27Å; G65-V117 WeakPolarHBondContact O-CG1 3.34Å; V117-Q119 HydrophobicContact CG1-CG 4Å; V117-Q119 PolarHBondContact O-N 3.3Å; V117-T120 HydrophobicContact CB-CG2 4.07Å; V117-T120 PolarHBondContact O-N 3.08Å; V117-T120 PolarHBondContact O-OG1 3.37Å; V117-V334 HydrophobicContact CG2-CG1 3.68Å
118	F	80.4	Confident	82.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-60.9	-40.1	-168.8	-161.4	-102	0	0	0	113.4	I40 V42 F44 V63 W67 V72 T120 L121 I124 I137	I40-F118 HydrophobicContact CD1-CD1 4.24Å; V42-F118 HydrophobicContact CG2-CE1 3.82Å; V42-F118 HydrophobicContact CG2-CZ 4Å; F44-F118 HydrophobicContact CZ-CZ 4.34Å; V63-F118 HydrophobicContact CB-CD1 4.08Å; V63-F118 HydrophobicContact CB-CE1 3.95Å; V63-F118 HydrophobicContact CG1-CB 4.29Å; V63-F118 HydrophobicContact CG1-CD1 3.43Å; V63-F118 VanDerWaalsContact CG1-CD1 3.43Å; V63-F118 HydrophobicContact CG1-CD2 4.46Å; V63-F118 HydrophobicContact CG1-CE1 3.74Å; V63-F118 HydrophobicContact CG1-CG 3.82Å; V63-F118 HydrophobicContact CG1-CZ 4.38Å; V63-F118 HydrophobicContact CG2-CE1 4.12Å; V63-F118 HydrophobicContact CG2-CZ 4.35Å; W67-F118 WeakPolarHBondContact O-CB 3.15Å; W67-F118 PolarHBondContact O-N 3.37Å; V72-F118 HydrophobicContact CB-CD2 4.29Å; V72-F118 HydrophobicContact CB-CE2 4.41Å; V72-F118 HydrophobicContact CG1-CD2 4.27Å; V72-F118 HydrophobicContact CG1-CE2 3.91Å; V72-F118 HydrophobicContact CG1-CZ 4.44Å; V72-F118 HydrophobicContact CG2-CB 4.3Å; V72-F118 HydrophobicContact CG2-CD2 3.71Å; V72-F118 HydrophobicContact CG2-CE2 4.18Å; V72-F118 HydrophobicContact CG2-CG 4.03Å; F118-T120 PolarHBondContact O-N 3.1Å; F118-L121 HydrophobicContact CB-CD1 4.45Å; F118-L121 HydrophobicContact CD2-CD1 3.36Å; F118-L121 HydrophobicContact CE2-CD1 3.63Å; F118-L121 HydrophobicContact CG-CD1 3.88Å; F118-L121 HydrophobicContact CZ-CD1 4.34Å; F118-L121 WeakPolarHBondContact O-CB 3.45Å; F118-L121 WeakPolarHBondContact O-CD1 3.31Å; F118-L121 VanDerWaalsContact O-CG 3.26Å; F118-L121 WeakPolarHBondContact O-CG 3.47Å; F118-L121 PolarHBondContact O-N 2.73Å; F118-I124 HydrophobicContact CD1-CD1 4.32Å; F118-I124 HydrophobicContact CD1-CG1 4.48Å; F118-I124 HydrophobicContact CE1-CD1 3.91Å; F118-I124 VanDerWaalsContact O-CG1 3.31Å; F118-I124 WeakPolarHBondContact O-CG1 3.48Å; F118-I137 HydrophobicContact CE2-CD1 3.92Å; F118-I137 HydrophobicContact CZ-CD1 3.62Å
119	Q	77.9	Confident	82.3	Confident	48 Å²	48	32.6 Å²	32.6	22%	0.224	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-65.8	-17.9	176.9	71.6	-169.7	3.2	0	0	114.6	I40 G65 V117	I40-Q119 HydrophobicContact CD1-CB 4.37Å; G65-Q119 WeakPolarHBondContact O-CB 3.26Å; G65-Q119 WeakPolarHBondContact O-CG 3.04Å; G65-Q119 PolarHBondContact O-N 2.83Å; V117-Q119 HydrophobicContact CG1-CG 4Å; V117-Q119 PolarHBondContact O-N 3.3Å
120	T	75.7	Confident	82.2	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.043	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-89.9	-8.7	-179.7	73.9	0	0	0	0	112.5	Q116 V117 F118 C331	Q116-T120 WeakPolarHBondContact CG-OG1 3.41Å; V117-T120 HydrophobicContact CB-CG2 4.07Å; V117-T120 PolarHBondContact O-N 3.08Å; V117-T120 PolarHBondContact O-OG1 3.37Å; F118-T120 PolarHBondContact O-N 3.1Å; T120-C331 VanDerWaalsContact O-CB 3.29Å; T120-C331 WeakPolarHBondContact O-CB 3.37Å
121	L	80.9	Confident	82.1	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-57.5	142.2	175.9	-65.9	169.4	0	0	0	111.2	V69 I111 Q116 F118 C123 I124 R125	V69-L121 HydrophobicContact CG2-CD1 4.28Å; V69-L121 HydrophobicContact CG2-CD2 4.13Å; I111-L121 HydrophobicContact CB-CD2 4.48Å; I111-L121 HydrophobicContact CD1-CD1 4.05Å; I111-L121 HydrophobicContact CG1-CD2 4.33Å; I111-L121 HydrophobicContact CG2-CD1 4.23Å; I111-L121 HydrophobicContact CG2-CD2 3.49Å; I111-L121 VanDerWaalsContact CG2-CD2 3.49Å; Q116-L121 HydrophobicContact CG-CD2 3.98Å; Q116-L121 VanDerWaalsContact OE1-CD2 3.3Å; F118-L121 HydrophobicContact CB-CD1 4.45Å; F118-L121 HydrophobicContact CD2-CD1 3.36Å; F118-L121 HydrophobicContact CE2-CD1 3.63Å; F118-L121 HydrophobicContact CG-CD1 3.88Å; F118-L121 HydrophobicContact CZ-CD1 4.34Å; F118-L121 WeakPolarHBondContact O-CB 3.45Å; F118-L121 WeakPolarHBondContact O-CD1 3.31Å; F118-L121 VanDerWaalsContact O-CG 3.26Å; F118-L121 WeakPolarHBondContact O-CG 3.47Å; F118-L121 PolarHBondContact O-N 2.73Å; L121-C123 VanDerWaalsContact C-N 3.25Å; L121-C123 VanDerWaalsContact CB-SG 3.56Å; L121-C123 PolarHBondContact O-N 2.88Å; L121-I124 HydrophobicContact CB-CG1 4.17Å; L121-I124 PolarHBondContact O-N 2.84Å; L121-R125 PolarHBondContact O-N 2.98Å
122	D	81.8	Confident	81.8	Confident	18 Å²	18	50.3 Å²	50.3	10%	0.096	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-32.2	178.6	178.6	35.7	0	0	0	111.3	Y102 K104 I124 R125 Y126 D329 C331	Y102-D122 PolarHBondContact OH-OD2 2.69Å; K104-D122 IonicContact NZ-OD1 2.7Å; K104-D122 PolarHBondContact NZ-OD1 3.25Å; K104-D122 IonicContact NZ-OD2 3.11Å; K104-D122 PolarHBondContact NZ-OD2 2.98Å; D122-I124 VanDerWaalsContact C-N 3.31Å; D122-I124 PolarHBondContact O-N 3.47Å; D122-R125 PolarHBondContact O-N 3.22Å; D122-Y126 VanDerWaalsContact O-CB 3.3Å; D122-Y126 WeakPolarHBondContact O-CB 3.3Å; D122-Y126 PolarHBondContact O-N 3.43Å; D122-D329 WeakPolarHBondContact CB-OD1 3.42Å; D122-D329 WeakPolarHBondContact CB-OD2 3.21Å; D122-D329 PolarHBondContact N-OD1 3.38Å; D122-D329 PolarHBondContact N-OD2 3.33Å; D122-C331 HydrophobicContact CB-CB 4.03Å
123	C	83.6	Confident	81.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-55.9	-42.2	173.2	66.8	0	0	0	0	112.9	Y102 L121 Y126 W127	Y102-C123 HydrophobicContact CD1-CB 3.88Å; Y102-C123 HydrophobicContact CD2-CB 3.34Å; Y102-C123 HydrophobicContact CE1-CB 3.87Å; Y102-C123 HydrophobicContact CE2-CB 3.34Å; Y102-C123 HydrophobicContact CG-CB 3.6Å; Y102-C123 PolarHBondContact OH-N 3.44Å; L121-C123 VanDerWaalsContact C-N 3.25Å; L121-C123 VanDerWaalsContact CB-SG 3.56Å; L121-C123 PolarHBondContact O-N 2.88Å; C123-Y126 PolarHBondContact O-N 3.22Å; C123-W127 HydrophobicContact CB-CH2 4Å; C123-W127 HydrophobicContact CB-CZ2 3.83Å; C123-W127 HydrophobicContact CB-CZ3 4.46Å; C123-W127 PolarHBondContact O-N 2.94Å
124	I	83.7	Confident	81.5	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-45.5	178.7	-58.7	-46.5	0	0	0	110.7	I40 F118 L121 D122 Y126 W127 R128	I40-I124 HydrophobicContact CD1-CD1 4.13Å; I40-I124 HydrophobicContact CD1-CG1 4.11Å; I40-I124 HydrophobicContact CD1-CG2 3.82Å; I40-I124 HydrophobicContact CG2-CD1 3.82Å; F118-I124 HydrophobicContact CD1-CD1 4.32Å; F118-I124 HydrophobicContact CD1-CG1 4.48Å; F118-I124 HydrophobicContact CE1-CD1 3.91Å; F118-I124 VanDerWaalsContact O-CG1 3.31Å; F118-I124 WeakPolarHBondContact O-CG1 3.48Å; L121-I124 HydrophobicContact CB-CG1 4.17Å; L121-I124 PolarHBondContact O-N 2.84Å; D122-I124 VanDerWaalsContact C-N 3.31Å; D122-I124 PolarHBondContact O-N 3.47Å; I124-Y126 VanDerWaalsContact C-N 3.28Å; I124-Y126 PolarHBondContact O-N 3.46Å; I124-W127 HydrophobicContact CD1-CE3 3.52Å; I124-W127 HydrophobicContact CD1-CH2 4.4Å; I124-W127 HydrophobicContact CD1-CZ3 3.32Å; I124-W127 PolarHBondContact O-N 2.91Å; I124-R128 WeakPolarHBondContact O-CB 3.37Å; I124-R128 WeakPolarHBondContact O-CG 3.23Å; I124-R128 PolarHBondContact O-N 3.2Å
125	R	79.7	Confident	81.7	Confident	120 Å²	120	54.5 Å²	54.5	45%	0.453	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-43	176.8	-65.4	177.6	177.3	-156.8	-7.3	111	L121 D122 A129	L121-R125 PolarHBondContact O-N 2.98Å; D122-R125 PolarHBondContact O-N 3.22Å; R125-A129 WeakPolarHBondContact O-CB 3.43Å; R125-A129 PolarHBondContact O-N 3.17Å
126	Y	83.3	Confident	82.2	Confident	49 Å²	49	57.6 Å²	57.6	19%	0.192	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-46.2	177.4	177.3	-112.8	0	0	0	112.2	K104 K105 D122 C123 I124 A129 L130	K104-Y126 HydrophobicContact CB-CE1 4.47Å; K104-Y126 HydrophobicContact CD-CG 4.47Å; K104-Y126 HydrophobicContact CG-CD1 4.19Å; K104-Y126 HydrophobicContact CG-CD2 4.12Å; K104-Y126 HydrophobicContact CG-CE1 4.23Å; K104-Y126 HydrophobicContact CG-CE2 4.15Å; K104-Y126 HydrophobicContact CG-CG 4.12Å; K105-Y126 HydrophobicContact CG-CE2 4.02Å; K105-Y126 PolarHBondContact N-OH 3.36Å; D122-Y126 VanDerWaalsContact O-CB 3.3Å; D122-Y126 WeakPolarHBondContact O-CB 3.3Å; D122-Y126 PolarHBondContact O-N 3.43Å; C123-Y126 PolarHBondContact O-N 3.22Å; I124-Y126 VanDerWaalsContact C-N 3.28Å; I124-Y126 PolarHBondContact O-N 3.46Å; Y126-A129 PolarHBondContact O-N 2.81Å; Y126-L130 HydrophobicContact CD1-CD1 4.09Å; Y126-L130 HydrophobicContact CD2-CD1 4.28Å; Y126-L130 HydrophobicContact CE1-CD1 3.53Å; Y126-L130 HydrophobicContact CE2-CD1 3.76Å; Y126-L130 HydrophobicContact CE2-CG 4.25Å; Y126-L130 HydrophobicContact CG-CD1 4.44Å; Y126-L130 WeakPolarHBondContact O-CG 3.31Å; Y126-L130 PolarHBondContact O-N 3.43Å
127	W	86.5	Confident	82.9	Confident	17 Å²	17	57.6 Å²	57.6	6%	0.064	28%	0.275	C	S	.	.	H	α-helix	trans	-65.9	-40.6	177.6	-60.1	-25.3	0	0	0	112.7	V42 C123 I124 A129 L130 K131 K132 G135 I137	V42-W127 HydrophobicContact CG2-CZ3 4.25Å; C123-W127 HydrophobicContact CB-CH2 4Å; C123-W127 HydrophobicContact CB-CZ2 3.83Å; C123-W127 HydrophobicContact CB-CZ3 4.46Å; C123-W127 PolarHBondContact O-N 2.94Å; I124-W127 HydrophobicContact CD1-CE3 3.52Å; I124-W127 HydrophobicContact CD1-CH2 4.4Å; I124-W127 HydrophobicContact CD1-CZ3 3.32Å; I124-W127 PolarHBondContact O-N 2.91Å; W127-A129 PolarHBondContact O-N 3.23Å; W127-L130 CarbonylContact O-C 3.53Å; W127-L130 PolarHBondContact O-N 3.49Å; W127-K131 PolarHBondContact O-N 2.96Å; W127-K132 HydrophobicContact CB-CB 4.2Å; W127-K132 PolarHBondContact O-N 3.48Å; W127-G135 VanDerWaalsContact CE3-CA 3.43Å; W127-G135 VanDerWaalsContact CZ3-CA 3.43Å; W127-I137 HydrophobicContact CH2-CD1 4.09Å; W127-I137 HydrophobicContact CH2-CG1 3.74Å; W127-I137 HydrophobicContact CZ2-CG1 4.45Å
128	R	83.2	Confident	83.5	Confident	113 Å²	113	61.2 Å²	61.2	43%	0.426	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-44.6	172.9	-76.2	179.6	177.3	144.9	-7.7	111.7	D38 I124 L130 K131	D38-R128 IonicContact OD2-CZ 2.71Å; D38-R128 IonicContact OD2-NE 3.95Å; D38-R128 IonicContact OD2-NH2 3.61Å; D38-R128 PolarHBondContact OD2-NH2 3.28Å; I124-R128 WeakPolarHBondContact O-CB 3.37Å; I124-R128 WeakPolarHBondContact O-CG 3.23Å; I124-R128 PolarHBondContact O-N 3.2Å; R128-L130 PolarHBondContact O-N 3.34Å; R128-K131 PolarHBondContact O-N 3.01Å
129	A	83.8	Confident	84	Confident	84 Å²	84	61.3 Å²	61.3	69%	0.694	29%	0.292	S	S	*	.	H	α-helix	trans	-62.1	-33.7	176.5	0	0	0	0	0	112.4	R125 Y126 W127 K131	R125-A129 WeakPolarHBondContact O-CB 3.43Å; R125-A129 PolarHBondContact O-N 3.17Å; Y126-A129 PolarHBondContact O-N 2.81Å; W127-A129 PolarHBondContact O-N 3.23Å; A129-K131 VanDerWaalsContact C-N 3.33Å
130	L	85.1	Confident	84.5	Confident	85 Å²	85	61.2 Å²	61.2	45%	0.445	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-0.9	174.8	-67.9	179.2	0	0	0	114.4	Y126 W127 R128 K132	Y126-L130 HydrophobicContact CD1-CD1 4.09Å; Y126-L130 HydrophobicContact CD2-CD1 4.28Å; Y126-L130 HydrophobicContact CE1-CD1 3.53Å; Y126-L130 HydrophobicContact CE2-CD1 3.76Å; Y126-L130 HydrophobicContact CE2-CG 4.25Å; Y126-L130 HydrophobicContact CG-CD1 4.44Å; Y126-L130 WeakPolarHBondContact O-CG 3.31Å; Y126-L130 PolarHBondContact O-N 3.43Å; W127-L130 CarbonylContact O-C 3.53Å; W127-L130 PolarHBondContact O-N 3.49Å; R128-L130 PolarHBondContact O-N 3.34Å; L130-K132 HydrophobicContact CB-CG 4.2Å; L130-K132 PolarHBondContact O-N 3.05Å
131	K	84.6	Confident	85	Confident	184 Å²	184	63.9 Å²	63.9	80%	0.8	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	40.2	-173	-55.7	-179.2	179.7	-179.9	0	113	W127 R128 A129	W127-K131 PolarHBondContact O-N 2.96Å; R128-K131 PolarHBondContact O-N 3.01Å; A129-K131 VanDerWaalsContact C-N 3.33Å
132	K	82.1	Confident	85.1	Confident	120 Å²	120	70 Å²	70	52%	0.522	34%	0.335	S	S	.	.			trans	-86.3	127.9	172	-75	-169.1	173.6	-168.9	0	110.1	W127 L130	W127-K132 HydrophobicContact CB-CB 4.2Å; W127-K132 PolarHBondContact O-N 3.48Å; L130-K132 HydrophobicContact CB-CG 4.2Å; L130-K132 PolarHBondContact O-N 3.05Å
133	D	76.4	Confident	85	Confident	150 Å²	150	73.3 Å²	73.3	80%	0.802	36%	0.358	S	S	*	.	S	Bend	trans	-79.7	-28.8	179.8	-58.7	-40.4	0	0	0	112.9
134	V	84.8	Confident	84.8	Confident	70 Å²	70	81 Å²	81	42%	0.424	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	124.6	178.6	-175.4	0	0	0	0	110.6	S41 E43 L60	S41-V134 WeakPolarHBondContact O-CA 3.3Å; E43-V134 HydrophobicContact CB-CG1 4.3Å; L60-V134 HydrophobicContact CD1-CG1 3.89Å
135	G	85.3	Confident	84.6	Confident	4 Å²	4	84.4 Å²	84.4	4%	0.041	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	157.4	172.9	0	0	0	0	0	112.6	S41 V42 E43 W127	S41-G135 PolarHBondContact O-N 3.39Å; S41-G135 VanDerWaalsContact O-N 3.08Å; V42-G135 WeakPolarHBondContact CA-O 3.41Å; E43-G135 PolarHBondContact N-O 3.17Å; W127-G135 VanDerWaalsContact CE3-CA 3.43Å; W127-G135 VanDerWaalsContact CZ3-CA 3.43Å
136	R	90.8	Very high	84.9	Confident	130 Å²	130	82 Å²	82	49%	0.491	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.8	177.1	-166.1	177.2	-169.9	-159.1	1	110.9	E43 V45	E43-R136 WeakPolarHBondContact O-CA 3.1Å; E43-R136 IonicContact OE2-NE 2.6Å; E43-R136 PolarHBondContact OE2-NE 3.19Å; V45-R136 HydrophobicContact CG2-CG 4.13Å; V45-R136 VanDerWaalsContact CG2-NE 3.33Å
137	I	92.9	Very high	85.1	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.6	178.3	-59.3	-177.7	0	0	0	109	V42 E43 F44 V45 L100 L101 I111 F118 W127	V42-I137 HydrophobicContact CG1-CB 4.22Å; V42-I137 HydrophobicContact CG1-CD1 3.8Å; V42-I137 HydrophobicContact CG1-CG1 3.75Å; E43-I137 PolarHBondContact O-N 2.85Å; F44-I137 CarbonylContact C-O 3.3Å; F44-I137 VanDerWaalsContact CA-O 3.27Å; F44-I137 WeakPolarHBondContact CA-O 3.33Å; F44-I137 HydrophobicContact CD1-CB 3.94Å; F44-I137 HydrophobicContact CD1-CG2 4.1Å; F44-I137 HydrophobicContact CE1-CB 3.94Å; F44-I137 HydrophobicContact CE1-CD1 4Å; F44-I137 HydrophobicContact CE1-CG1 4.47Å; F44-I137 HydrophobicContact CE1-CG2 4.02Å; F44-I137 HydrophobicContact CZ-CD1 4.3Å; V45-I137 PolarHBondContact N-O 3.21Å; L100-I137 HydrophobicContact CB-CG2 4.04Å; L100-I137 HydrophobicContact CD2-CG2 3.84Å; L100-I137 HydrophobicContact CG-CG2 4.47Å; L101-I137 CarbonylContact O-C 3.57Å; L101-I137 WeakPolarHBondContact O-CA 3.45Å; L101-I137 WeakPolarHBondContact O-CG2 3.46Å; I111-I137 HydrophobicContact CD1-CD1 3.79Å; I111-I137 HydrophobicContact CD1-CG1 4.49Å; I111-I137 HydrophobicContact CD1-CG2 4.33Å; F118-I137 HydrophobicContact CE2-CD1 3.92Å; F118-I137 HydrophobicContact CZ-CD1 3.62Å; W127-I137 HydrophobicContact CH2-CD1 4.09Å; W127-I137 HydrophobicContact CH2-CG1 3.74Å; W127-I137 HydrophobicContact CZ2-CG1 4.45Å
138	Q	91.6	Very high	85.2	Confident	83 Å²	83	92.1 Å²	92.1	39%	0.388	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.2	176.2	-60.7	179.8	-10.2	0	0	109.7	V45 L100 L101	V45-Q138 HydrophobicContact CB-CG 4.1Å; V45-Q138 HydrophobicContact CG2-CG 4.34Å; L100-Q138 CarbonylContact C-O 3.43Å; L100-Q138 WeakPolarHBondContact CA-O 3.3Å; L101-Q138 HydrophobicContact CB-CB 4.44Å; L101-Q138 PolarHBondContact N-O 2.74Å; L101-Q138 PolarHBondContact O-N 3.28Å
139	L	90.1	Very high	85.3	Confident	3 Å²	3	88.1 Å²	88.1	2%	0.016	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.7	169.3	-175.8	72.8	0	0	0	108	V45 L46 P47 K73 V76 W77 C98 I99 L100	V45-L139 PolarHBondContact O-N 2.69Å; L46-L139 HydrophobicContact CD2-CD2 4.1Å; P47-L139 VanDerWaalsContact CD-O 3.28Å; P47-L139 WeakPolarHBondContact CD-O 3.4Å; K73-L139 HydrophobicContact CG-CD1 4.41Å; V76-L139 HydrophobicContact CG1-CD2 4.48Å; W77-L139 HydrophobicContact CE3-CD2 4.29Å; W77-L139 HydrophobicContact CZ3-CD2 4.35Å; C98-L139 HydrophobicContact CB-CD1 3.49Å; C98-L139 VanDerWaalsContact CB-CD1 3.49Å; C98-L139 HydrophobicContact CB-CD2 4.49Å; C98-L139 HydrophobicContact CB-CG 3.84Å; I99-L139 WeakPolarHBondContact O-CA 3.22Å; L100-L139 HydrophobicContact CD2-CB 4.24Å; L100-L139 HydrophobicContact CD2-CD1 3.54Å; L100-L139 HydrophobicContact CG-CD1 4.24Å
140	V	88.5	Confident	85.6	Confident	45 Å²	45	87.6 Å²	87.6	27%	0.273	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.1	-176.5	-102.7	0	0	0	0	110.9	C98 I99 L101	C98-V140 CarbonylContact C-O 3.43Å; C98-V140 WeakPolarHBondContact CA-O 3.49Å; C98-V140 WeakPolarHBondContact CB-O 3.49Å; I99-V140 HydrophobicContact CG1-CG2 3.88Å; I99-V140 PolarHBondContact N-O 2.71Å; I99-V140 PolarHBondContact O-N 3.27Å; L101-V140 HydrophobicContact CB-CG2 4.47Å; L101-V140 HydrophobicContact CD1-CG2 3.44Å; L101-V140 VanDerWaalsContact CD1-CG2 3.44Å; L101-V140 HydrophobicContact CG-CG2 3.67Å
141	P	86.5	Confident	85.8	Confident	64 Å²	64	89.5 Å²	89.5	42%	0.416	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	139.8	174	-18.3	33.2	0	0	0	110.1	P47 F89	P47-P141 HydrophobicContact CB-CG 4.09Å; F89-P141 HydrophobicContact CE2-CG 4.25Å; F89-P141 HydrophobicContact CZ-CG 4.29Å
142	R	83.4	Confident	86.1	Confident	127 Å²	127	82.4 Å²	82.4	48%	0.479	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-60	125.8	175.8	-177.5	179.8	-69.8	-97.4	-2.5	108.4	H97 I99 Q144	H97-R142 WeakPolarHBondContact O-CB 3.39Å; H97-R142 PolarHBondContact O-N 3.3Å; I99-R142 HydrophobicContact CG2-CB 4.25Å; I99-R142 HydrophobicContact CG2-CG 4.41Å; R142-Q144 PolarHBondContact O-N 2.97Å
143	P	79.3	Confident	86.6	Confident	89 Å²	89	77.8 Å²	77.8	58%	0.578	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.2	132.7	176.8	-20.3	30.7	0	0	0	110.3
144	Q	78.9	Confident	87.4	Confident	162 Å²	162	78.7 Å²	78.7	76%	0.757	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-76.5	138.7	168.8	-68.8	-68.1	-19	0	0	108.8	R142 T146	R142-Q144 PolarHBondContact O-N 2.97Å; Q144-T146 PolarHBondContact O-N 3.29Å
145	P	79.8	Confident	87.9	Confident	73 Å²	73	77.7 Å²	77.7	47%	0.474	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-65.2	127.6	178.8	26.9	-32.5	0	0	0	110	Q150	P145-Q150 HydrophobicContact CB-CG 4.27Å
146	T	87.1	Confident	88.4	Confident	71 Å²	71	77.5 Å²	77.5	44%	0.436	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-69.4	158.4	175.1	60.3	0	0	0	0	110.9	Q144 E148 S149 Q150	Q144-T146 PolarHBondContact O-N 3.29Å; T146-E148 PolarHBondContact O-N 3.36Å; T146-S149 PolarHBondContact O-N 3.29Å; T146-S149 VanDerWaalsContact O-N 3.15Å; T146-S149 WeakPolarHBondContact OG1-CB 3.43Å; T146-S149 PolarHBondContact OG1-N 3.3Å; T146-S149 VanDerWaalsContact OG1-N 3.15Å; T146-Q150 WeakPolarHBondContact O-CG 3.46Å; T146-Q150 PolarHBondContact O-N 3.41Å
147	D	87.3	Confident	88.7	Confident	119 Å²	119	72.4 Å²	72.4	64%	0.636	36%	0.358	S	S	*	.	H	α-helix	trans	-58.7	-36.9	175.1	-71.7	-21.6	0	0	0	111.7	Q150 Q151	D147-Q150 PolarHBondContact O-N 3.35Å; D147-Q151 WeakPolarHBondContact O-CG 3.2Å; D147-Q151 PolarHBondContact O-N 3.44Å
148	E	87.1	Confident	88.9	Confident	158 Å²	158	76.4 Å²	76.4	74%	0.738	37%	0.374	S	S	*	.	H	α-helix	trans	-61.2	-46.8	174.2	-67.2	178.1	177.6	0	0	111.7	T146 Q150 Q151 Y152	T146-E148 PolarHBondContact O-N 3.36Å; E148-Q150 VanDerWaalsContact C-N 3.3Å; E148-Q150 PolarHBondContact O-N 3.08Å; E148-Q151 PolarHBondContact O-N 2.9Å; E148-Y152 WeakPolarHBondContact O-CB 3.41Å; E148-Y152 PolarHBondContact O-N 2.8Å
149	S	86.3	Confident	89.1	Confident	29 Å²	29	72.5 Å²	72.5	20%	0.203	36%	0.355	C	S	.	.	H	α-helix	trans	-61.3	-38.8	177	171.2	0	0	0	0	111.8	T146 Q153	T146-S149 PolarHBondContact O-N 3.29Å; T146-S149 VanDerWaalsContact O-N 3.15Å; T146-S149 WeakPolarHBondContact OG1-CB 3.43Å; T146-S149 PolarHBondContact OG1-N 3.3Å; T146-S149 VanDerWaalsContact OG1-N 3.15Å; S149-Q153 WeakPolarHBondContact O-CB 3.12Å; S149-Q153 PolarHBondContact O-N 3.39Å
150	Q	89.1	Confident	89.5	Confident	74 Å²	74	72.4 Å²	72.4	35%	0.346	36%	0.355	S	S	.	.	H	α-helix	trans	-68.6	-41.6	176.8	-66.3	179.7	26.8	0	0	112.3	P145 T146 D147 E148 Q153 R154	P145-Q150 HydrophobicContact CB-CG 4.27Å; T146-Q150 WeakPolarHBondContact O-CG 3.46Å; T146-Q150 PolarHBondContact O-N 3.41Å; D147-Q150 PolarHBondContact O-N 3.35Å; E148-Q150 VanDerWaalsContact C-N 3.3Å; E148-Q150 PolarHBondContact O-N 3.08Å; Q150-Q153 PolarHBondContact O-N 3.48Å; Q150-R154 WeakPolarHBondContact O-CG 3.28Å; Q150-R154 PolarHBondContact O-N 3.1Å
151	Q	91	Very high	89.7	Confident	125 Å²	125	72.8 Å²	72.8	58%	0.584	37%	0.368	S	S	*	.	H	α-helix	trans	-63.6	-43.4	175.4	-73.1	177.3	17.8	0	0	111.4	D147 E148 Q153 R154 Y155	D147-Q151 WeakPolarHBondContact O-CG 3.2Å; D147-Q151 PolarHBondContact O-N 3.44Å; E148-Q151 PolarHBondContact O-N 2.9Å; Q151-Q153 PolarHBondContact O-N 2.65Å; Q151-R154 PolarHBondContact O-N 3.35Å; Q151-Y155 PolarHBondContact O-N 2.6Å
152	Y	91	Very high	90.1	Very high	35 Å²	35	71.4 Å²	71.4	14%	0.137	36%	0.355	C	S	.	.	H	α-helix	trans	-62.5	-41.9	175.9	-172.6	-118.1	0	0	0	111.7	E148 R154 Y155 L156 R740 L747	E148-Y152 WeakPolarHBondContact O-CB 3.41Å; E148-Y152 PolarHBondContact O-N 2.8Å; Y152-R154 PolarHBondContact O-N 3.32Å; Y152-Y155 HydrophobicContact CD2-CD1 4.26Å; Y152-Y155 HydrophobicContact CE2-CD1 4.28Å; Y152-Y155 WeakPolarHBondContact O-CB 3.36Å; Y152-Y155 PolarHBondContact O-N 3.33Å; Y152-L156 HydrophobicContact CD1-CD1 4.11Å; Y152-L156 HydrophobicContact CE1-CD1 3.76Å; Y152-L156 HydrophobicContact CE1-CG 4.25Å; Y152-L156 HydrophobicContact CE2-CD2 4.38Å; Y152-L156 WeakPolarHBondContact O-CG 2.95Å; Y152-L156 PolarHBondContact O-N 3.41Å; Y152-R740 HydrophobicContact CE1-CG 4.3Å; Y152-L747 HydrophobicContact CE2-CD1 4.25Å
153	Q	91.8	Very high	90.6	Very high	22 Å²	22	68.6 Å²	68.6	10%	0.103	35%	0.35	C	S	.	.	H	α-helix	trans	-60.2	-43.2	173.5	-174	67.1	62.5	0	0	112.3	S149 Q150 Q151 Y155 L156 N157 T165 E736	S149-Q153 WeakPolarHBondContact O-CB 3.12Å; S149-Q153 PolarHBondContact O-N 3.39Å; Q150-Q153 PolarHBondContact O-N 3.48Å; Q151-Q153 PolarHBondContact O-N 2.65Å; Q153-Y155 VanDerWaalsContact C-N 3.3Å; Q153-Y155 PolarHBondContact O-N 2.9Å; Q153-L156 PolarHBondContact O-N 3.46Å; Q153-N157 PolarHBondContact NE2-OD1 2.94Å; Q153-N157 WeakPolarHBondContact O-CB 3.12Å; Q153-N157 PolarHBondContact O-N 3.44Å; Q153-N157 PolarHBondContact O-OD1 3.39Å; Q153-T165 HydrophobicContact CG-CG2 3.97Å; Q153-E736 PolarHBondContact NE2-OE1 3.21Å; Q153-E736 PolarHBondContact OE1-OE1 3.01Å; Q153-E736 VanDerWaalsContact OE1-OE1 3.09Å
154	R	94	Very high	91	Very high	170 Å²	170	65 Å²	65	64%	0.642	33%	0.326	S	S	*	.	H	α-helix	trans	-62	-39.3	175.9	-70.6	176.6	-169.2	163.7	7.4	111.9	Q150 Q151 Y152 N157 Y158	Q150-R154 WeakPolarHBondContact O-CG 3.28Å; Q150-R154 PolarHBondContact O-N 3.1Å; Q151-R154 PolarHBondContact O-N 3.35Å; Y152-R154 PolarHBondContact O-N 3.32Å; R154-N157 PolarHBondContact O-N 2.91Å; R154-Y158 PolarHBondContact O-N 2.88Å
155	Y	95.1	Very high	91.3	Very high	48 Å²	48	60.3 Å²	60.3	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-45	175.5	175.9	-123.6	0	0	0	111.9	Q151 Y152 Q153 Y158 L159 L747 R751	Q151-Y155 PolarHBondContact O-N 2.6Å; Y152-Y155 HydrophobicContact CD2-CD1 4.26Å; Y152-Y155 HydrophobicContact CE2-CD1 4.28Å; Y152-Y155 WeakPolarHBondContact O-CB 3.36Å; Y152-Y155 PolarHBondContact O-N 3.33Å; Q153-Y155 VanDerWaalsContact C-N 3.3Å; Q153-Y155 PolarHBondContact O-N 2.9Å; Y155-Y158 WeakPolarHBondContact O-CB 3.43Å; Y155-Y158 PolarHBondContact O-N 2.95Å; Y155-L159 HydrophobicContact CE1-CD1 4.17Å; Y155-L159 HydrophobicContact CE2-CD1 4.29Å; Y155-L159 HydrophobicContact CE2-CD2 4.46Å; Y155-L159 HydrophobicContact CE2-CG 4.32Å; Y155-L159 PolarHBondContact O-N 2.9Å; Y155-L747 HydrophobicContact CE1-CB 4.38Å; Y155-L747 HydrophobicContact CE1-CD2 4.46Å; Y155-L747 PolarHBondContact OH-O 3.45Å; Y155-R751 HydrophobicContact CE2-CB 4.34Å; Y155-R751 HydrophobicContact CE2-CG 4.16Å; Y155-R751 WeakPolarHBondContact OH-CB 3.14Å
156	L	95.4	Very high	91.5	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-44.6	174.7	-64.6	-178.4	0	0	0	111.9	Y152 Q153 Y158 L159 I160 E736 L739 R740 L747	Y152-L156 HydrophobicContact CD1-CD1 4.11Å; Y152-L156 HydrophobicContact CE1-CD1 3.76Å; Y152-L156 HydrophobicContact CE1-CG 4.25Å; Y152-L156 HydrophobicContact CE2-CD2 4.38Å; Y152-L156 WeakPolarHBondContact O-CG 2.95Å; Y152-L156 PolarHBondContact O-N 3.41Å; Q153-L156 PolarHBondContact O-N 3.46Å; L156-Y158 PolarHBondContact O-N 3.08Å; L156-L159 PolarHBondContact O-N 2.89Å; L156-L159 VanDerWaalsContact O-N 3.13Å; L156-I160 HydrophobicContact CB-CD1 4.46Å; L156-I160 WeakPolarHBondContact O-CB 3.21Å; L156-I160 WeakPolarHBondContact O-CD1 3.21Å; L156-I160 WeakPolarHBondContact O-CG1 3.27Å; L156-I160 PolarHBondContact O-N 3.41Å; L156-E736 HydrophobicContact CD1-CG 4.45Å; L156-L739 HydrophobicContact CD2-CB 3.75Å; L156-L739 HydrophobicContact CD2-CD1 4.31Å; L156-R740 HydrophobicContact CD1-CG 3.48Å; L156-R740 VanDerWaalsContact CD1-CG 3.48Å; L156-L747 HydrophobicContact CD2-CD2 4.08Å
157	N	96.1	Very high	91	Very high	24 Å²	24	61 Å²	61	13%	0.128	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-37.6	177.3	-70.1	1.3	0	0	0	111.8	Q153 R154 G161 Y162 D163	Q153-N157 PolarHBondContact NE2-OD1 2.94Å; Q153-N157 WeakPolarHBondContact O-CB 3.12Å; Q153-N157 PolarHBondContact O-N 3.44Å; Q153-N157 PolarHBondContact O-OD1 3.39Å; R154-N157 PolarHBondContact O-N 2.91Å; N157-G161 PolarHBondContact O-N 2.88Å; N157-Y162 PolarHBondContact O-N 3.21Å; N157-D163 PolarHBondContact ND2-OD1 3.49Å
158	Y	96.9	Very high	90.4	Very high	84 Å²	84	58.6 Å²	58.6	33%	0.329	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-48.6	173.8	169.7	-109.2	0	0	0	112.1	R154 Y155 L156 I160 G161 V754 E758	R154-Y158 PolarHBondContact O-N 2.88Å; Y155-Y158 WeakPolarHBondContact O-CB 3.43Å; Y155-Y158 PolarHBondContact O-N 2.95Å; L156-Y158 PolarHBondContact O-N 3.08Å; Y158-I160 PolarHBondContact O-N 3.01Å; Y158-G161 PolarHBondContact O-N 3.22Å; Y158-V754 HydrophobicContact CE1-CG1 4.17Å; Y158-E758 WeakPolarHBondContact CE2-OE2 3.49Å; Y158-E758 PolarHBondContact OH-OE2 3.48Å
159	L	97.2	Very high	90	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-42.3	178.4	-65.2	-179.2	0	0	0	112.2	Y155 L156 G161 F714 R718 L739 L747 R751 V754	Y155-L159 HydrophobicContact CE1-CD1 4.17Å; Y155-L159 HydrophobicContact CE2-CD1 4.29Å; Y155-L159 HydrophobicContact CE2-CD2 4.46Å; Y155-L159 HydrophobicContact CE2-CG 4.32Å; Y155-L159 PolarHBondContact O-N 2.9Å; L156-L159 PolarHBondContact O-N 2.89Å; L156-L159 VanDerWaalsContact O-N 3.13Å; L159-G161 VanDerWaalsContact C-N 3.33Å; L159-F714 HydrophobicContact CB-CE2 4.43Å; L159-R718 WeakPolarHBondContact O-CD 3.44Å; L159-R718 PolarHBondContact O-NE 2.98Å; L159-L739 HydrophobicContact CB-CD1 4.01Å; L159-L739 HydrophobicContact CD1-CD1 4.43Å; L159-L739 HydrophobicContact CD1-CD2 4.47Å; L159-L747 HydrophobicContact CD1-CD2 3.82Å; L159-R751 HydrophobicContact CD2-CB 4Å; L159-V754 HydrophobicContact CD2-CG2 4.36Å
160	I	97.1	Very high	89.8	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-65.7	-36.6	178.8	-66	167.4	0	0	0	111	L156 Y158 Y162 V164 I721 A732 L735 E736 L739	L156-I160 HydrophobicContact CB-CD1 4.46Å; L156-I160 WeakPolarHBondContact O-CB 3.21Å; L156-I160 WeakPolarHBondContact O-CD1 3.21Å; L156-I160 WeakPolarHBondContact O-CG1 3.27Å; L156-I160 PolarHBondContact O-N 3.41Å; Y158-I160 PolarHBondContact O-N 3.01Å; I160-Y162 VanDerWaalsContact C-N 3.3Å; I160-V164 HydrophobicContact CD1-CG1 3.99Å; I160-I721 HydrophobicContact CG2-CD1 3.97Å; I160-A732 HydrophobicContact CG2-CB 3.77Å; I160-L735 HydrophobicContact CB-CD2 4.24Å; I160-L735 HydrophobicContact CG1-CB 4.39Å; I160-L735 HydrophobicContact CG1-CD2 3.96Å; I160-L735 HydrophobicContact CG1-CG 3.99Å; I160-L735 HydrophobicContact CG2-CD2 4.23Å; I160-E736 HydrophobicContact CD1-CB 3.87Å; I160-L739 HydrophobicContact CD1-CD1 4.32Å; I160-L739 HydrophobicContact CG1-CD1 3.71Å
161	G	94.6	Very high	89.2	Confident	54 Å²	54	52 Å²	52	56%	0.557	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	17.5	-170.9	0	0	0	0	0	113.5	N157 Y158 L159	N157-G161 PolarHBondContact O-N 2.88Å; Y158-G161 PolarHBondContact O-N 3.22Å; L159-G161 VanDerWaalsContact C-N 3.33Å
162	Y	94.2	Very high	88.8	Confident	35 Å²	35	47.9 Å²	47.9	14%	0.137	25%	0.253	C	S	.	.	S	Bend	trans	-151.7	145.6	177.9	-175.7	-99	0	0	0	110.3	N157 I160 V164 I721 Q728 Q729 A732	N157-Y162 PolarHBondContact O-N 3.21Å; I160-Y162 VanDerWaalsContact C-N 3.3Å; Y162-V164 HydrophobicContact CD1-CG1 4.49Å; Y162-V164 PolarHBondContact O-N 2.91Å; Y162-I721 HydrophobicContact CG-CG2 4.48Å; Y162-Q728 HydrophobicContact CD2-CG 4.36Å; Y162-Q728 HydrophobicContact CE2-CG 4.12Å; Y162-Q729 HydrophobicContact CE1-CG 4.1Å; Y162-Q729 WeakPolarHBondContact OH-CG 3.41Å; Y162-A732 HydrophobicContact CD1-CB 3.58Å; Y162-A732 HydrophobicContact CE1-CB 4.41Å; Y162-A732 HydrophobicContact CG-CB 4.22Å
163	D	93	Very high	88.5	Confident	68 Å²	68	49.2 Å²	49.2	36%	0.364	26%	0.262	S	S	.	.			trans	-86.5	101.8	174.9	-172	-5	0	0	0	110.8	N157 T165 D166	N157-D163 PolarHBondContact ND2-OD1 3.49Å; D163-T165 PolarHBondContact O-N 3.18Å; D163-T165 WeakPolarHBondContact OD1-CB 3.41Å; D163-T165 PolarHBondContact OD1-N 3.44Å; D163-T165 PolarHBondContact OD1-OG1 3.19Å; D163-T165 PolarHBondContact OD2-OG1 2.91Å; D163-D166 HydrophobicContact CB-CB 4.28Å; D163-D166 VanDerWaalsContact O-CB 3.29Å; D163-D166 WeakPolarHBondContact O-CB 3.34Å; D163-D166 PolarHBondContact O-N 3.45Å
164	V	87.4	Confident	88.4	Confident	14 Å²	14	48.3 Å²	48.3	9%	0.085	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-12.3	178.3	-65.4	0	0	0	0	114.1	I160 Y162 A732 E736	I160-V164 HydrophobicContact CD1-CG1 3.99Å; Y162-V164 HydrophobicContact CD1-CG1 4.49Å; Y162-V164 PolarHBondContact O-N 2.91Å; V164-A732 HydrophobicContact CG1-CB 3.55Å; V164-A732 WeakPolarHBondContact CG1-O 3.22Å; V164-E736 HydrophobicContact CG1-CB 4.27Å; V164-E736 HydrophobicContact CG2-CB 4.43Å; V164-E736 HydrophobicContact CG2-CG 4.26Å; V164-E736 WeakPolarHBondContact CG2-OE2 3.38Å
165	T	86.3	Confident	88.2	Confident	62 Å²	62	41.2 Å²	41.2	38%	0.38	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-4	176.3	69.3	0	0	0	0	112.9	Q153 D163 V167	Q153-T165 HydrophobicContact CG-CG2 3.97Å; D163-T165 PolarHBondContact O-N 3.18Å; D163-T165 WeakPolarHBondContact OD1-CB 3.41Å; D163-T165 PolarHBondContact OD1-N 3.44Å; D163-T165 PolarHBondContact OD1-OG1 3.19Å; D163-T165 PolarHBondContact OD2-OG1 2.91Å; T165-V167 PolarHBondContact O-N 3.16Å
166	D	82.9	Confident	87.8	Confident	56 Å²	56	41.8 Å²	41.8	30%	0.299	24%	0.237	S	C	.	.			trans	-69.9	111.4	178.3	-179	21.5	0	0	0	111.8	D163 S168	D163-D166 HydrophobicContact CB-CB 4.28Å; D163-D166 VanDerWaalsContact O-CB 3.29Å; D163-D166 WeakPolarHBondContact O-CB 3.34Å; D163-D166 PolarHBondContact O-N 3.45Å; D166-S168 VanDerWaalsContact CG-OG 3.24Å; D166-S168 WeakPolarHBondContact OD1-CB 3.48Å; D166-S168 PolarHBondContact OD1-N 2.94Å; D166-S168 PolarHBondContact OD1-OG 2.97Å; D166-S168 PolarHBondContact OD2-OG 3.01Å
167	V	76.6	Confident	87.4	Confident	102 Å²	102	42.3 Å²	42.3	62%	0.618	24%	0.239	S	C	*	.			trans	-101.7	11.1	174.8	-64	0	0	0	0	112.6	T165 N169 V170	T165-V167 PolarHBondContact O-N 3.16Å; V167-N169 VanDerWaalsContact C-N 3.27Å; V167-N169 PolarHBondContact O-N 3.29Å; V167-V170 HydrophobicContact CB-CG2 3.96Å; V167-V170 HydrophobicContact CG1-CG2 4.41Å; V167-V170 WeakPolarHBondContact O-CG2 3.38Å
168	S	75.7	Confident	87.2	Confident	70 Å²	70	41.3 Å²	41.3	49%	0.49	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.9	-177.5	69.1	0	0	0	0	113.3	D166 K519	D166-S168 VanDerWaalsContact CG-OG 3.24Å; D166-S168 WeakPolarHBondContact OD1-CB 3.48Å; D166-S168 PolarHBondContact OD1-N 2.94Å; D166-S168 PolarHBondContact OD1-OG 2.97Å; D166-S168 PolarHBondContact OD2-OG 3.01Å; S168-K519 WeakPolarHBondContact O-CE 3.46Å; S168-K519 PolarHBondContact O-NZ 2.92Å
169	N	78.9	Confident	86.9	Confident	7 Å²	7	38.2 Å²	38.2	4%	0.037	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	42.7	-177.8	-171.1	44.8	0	0	0	112.9	V167 T515 N516 P517 Q729	V167-N169 VanDerWaalsContact C-N 3.27Å; V167-N169 PolarHBondContact O-N 3.29Å; N169-T515 PolarHBondContact ND2-O 3.47Å; N169-T515 PolarHBondContact OD1-OG1 2.86Å; N169-T515 VanDerWaalsContact OD1-OG1 3.08Å; N169-N516 PolarHBondContact OD1-O 3.03Å; N169-P517 HydrophobicContact CB-CB 4.16Å; N169-P517 VanDerWaalsContact CG-CA 3.42Å; N169-P517 WeakPolarHBondContact ND2-CA 3.41Å; N169-P517 WeakPolarHBondContact ND2-CB 3.49Å; N169-Q729 PolarHBondContact O-NE2 2.77Å
170	V	81.2	Confident	86.4	Confident	45 Å²	45	39.2 Å²	39.2	27%	0.273	23%	0.225	S	C	.	.			trans	-126.7	145.8	174	-50.7	0	0	0	0	110	V167 D172 L175	V167-V170 HydrophobicContact CB-CG2 3.96Å; V167-V170 HydrophobicContact CG1-CG2 4.41Å; V167-V170 WeakPolarHBondContact O-CG2 3.38Å; V170-D172 VanDerWaalsContact CG2-O 3.32Å; V170-D172 WeakPolarHBondContact CG2-O 3.3Å; V170-L175 HydrophobicContact CG1-CD1 3.56Å
171	H	77.8	Confident	85.9	Confident	71 Å²	71	39.7 Å²	39.7	33%	0.329	23%	0.227	S	C	.	.	S	Bend	trans	-110.1	-3.1	175.8	61.3	-86.8	0	0	0	112.3	R484	H171-R484 PolarHBondContact CD2-NH1 3.22Å; H171-R484 VanDerWaalsContact CD2-NH1 3.31Å; H171-R484 PolarHBondContact NE2-NH1 3.18Å
172	D	81.3	Confident	85.8	Confident	38 Å²	38	37.1 Å²	37.1	20%	0.203	20%	0.201	C	C	.	.	S	Bend	trans	-145.9	-175.7	173	60.4	38.2	0	0	0	110.6	V170 E174 R484	V170-D172 VanDerWaalsContact CG2-O 3.32Å; V170-D172 WeakPolarHBondContact CG2-O 3.3Å; D172-E174 VanDerWaalsContact OD1-CB 3.26Å; D172-E174 WeakPolarHBondContact OD1-CB 3.49Å; D172-E174 PolarHBondContact OD1-N 2.98Å; D172-R484 IonicContact OD2-CZ 3.64Å; D172-R484 VanDerWaalsContact OD2-CZ 3.23Å; D172-R484 IonicContact OD2-NH1 2.69Å; D172-R484 PolarHBondContact OD2-NH1 3.47Å; D172-R484 IonicContact OD2-NH2 3.44Å; D172-R484 PolarHBondContact OD2-NH2 2.82Å
173	D	85.8	Confident	85.6	Confident	62 Å²	62	35.5 Å²	35.5	33%	0.332	19%	0.194	S	C	.	.	S	Bend	trans	-101.7	19.2	-179.4	70.5	-23.3	0	0	0	113.4	L175 E176 F177 H479 R480	D173-L175 VanDerWaalsContact C-N 3.32Å; D173-L175 PolarHBondContact O-N 2.98Å; D173-E176 PolarHBondContact O-N 2.78Å; D173-F177 VanDerWaalsContact O-CB 3.25Å; D173-F177 WeakPolarHBondContact O-CB 3.46Å; D173-F177 PolarHBondContact O-N 3.01Å; D173-H479 IonicContact OD1-CE1 3.89Å; D173-H479 PolarHBondContact OD1-CE1 3.05Å; D173-H479 IonicContact OD1-NE2 3.52Å; D173-R480 IonicContact OD1-CZ 2.75Å; D173-R480 IonicContact OD1-NH1 3.18Å; D173-R480 PolarHBondContact OD1-NH1 3.06Å; D173-R480 IonicContact OD1-NH2 3.51Å; D173-R480 PolarHBondContact OD1-NH2 3.21Å; D173-R480 IonicContact OD2-CZ 3.44Å; D173-R480 IonicContact OD2-NH1 3.28Å; D173-R480 PolarHBondContact OD2-NH1 3.31Å; D173-R480 IonicContact OD2-NH2 3.47Å; D173-R480 PolarHBondContact OD2-NH2 3.02Å
174	E	89.5	Confident	85.3	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-39.3	-175.5	-170.1	-176.8	164.3	0	0	112.3	D172 F177 T178 H479 Y690 H691	D172-E174 VanDerWaalsContact OD1-CB 3.26Å; D172-E174 WeakPolarHBondContact OD1-CB 3.49Å; D172-E174 PolarHBondContact OD1-N 2.98Å; E174-F177 PolarHBondContact O-N 3.2Å; E174-T178 WeakPolarHBondContact O-CB 3.22Å; E174-T178 PolarHBondContact O-N 2.86Å; E174-T178 PolarHBondContact O-OG1 3.15Å; E174-H479 HydrophobicContact CG-CB 3.9Å; E174-Y690 WeakPolarHBondContact OE1-CA 3.36Å; E174-Y690 VanDerWaalsContact OE1-CB 3.29Å; E174-Y690 WeakPolarHBondContact OE1-CB 3.34Å; E174-H691 VanDerWaalsContact CD-CD2 3.46Å; E174-H691 HydrophobicContact CG-CB 4.5Å; E174-H691 IonicContact OE1-CD2 3.62Å; E174-H691 PolarHBondContact OE1-CD2 2.84Å; E174-H691 IonicContact OE1-CG 3.71Å; E174-H691 PolarHBondContact OE1-N 2.94Å; E174-H691 IonicContact OE2-CD2 3.26Å
175	L	89	Confident	85.4	Confident	21 Å²	21	33 Å²	33	11%	0.11	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-50.9	178.2	-77.7	167.3	0	0	0	111.6	V170 D173 F177 T178 R179 Q729 V733	V170-L175 HydrophobicContact CG1-CD1 3.56Å; D173-L175 VanDerWaalsContact C-N 3.32Å; D173-L175 PolarHBondContact O-N 2.98Å; L175-F177 VanDerWaalsContact C-N 3.34Å; L175-F177 PolarHBondContact O-N 2.92Å; L175-T178 WeakPolarHBondContact O-CB 3.07Å; L175-T178 PolarHBondContact O-N 3.3Å; L175-T178 VanDerWaalsContact O-N 3.14Å; L175-R179 WeakPolarHBondContact O-CG 3.42Å; L175-R179 PolarHBondContact O-N 2.8Å; L175-Q729 HydrophobicContact CD1-CB 3.86Å; L175-Q729 HydrophobicContact CD1-CG 4.11Å; L175-Q729 HydrophobicContact CD2-CB 4.01Å; L175-V733 HydrophobicContact CD2-CG2 3.79Å
176	E	86.9	Confident	85.7	Confident	60 Å²	60	30.2 Å²	30.2	28%	0.28	17%	0.165	S	C	.	.	H	α-helix	trans	-64.5	-40.8	178.5	-173.9	58.8	-154.4	0	0	111.1	D173 T178 R179 R180	D173-E176 PolarHBondContact O-N 2.78Å; E176-T178 VanDerWaalsContact C-N 3.27Å; E176-T178 PolarHBondContact O-N 3.28Å; E176-R179 PolarHBondContact O-N 3.13Å; E176-R179 IonicContact OE1-NH1 3.54Å; E176-R179 WeakPolarHBondContact OE2-CD 3.41Å; E176-R179 IonicContact OE2-CZ 2.98Å; E176-R179 IonicContact OE2-NE 3.44Å; E176-R179 IonicContact OE2-NH1 2.77Å; E176-R179 PolarHBondContact OE2-NH1 3.25Å; E176-R180 VanDerWaalsContact O-CG 3.29Å; E176-R180 WeakPolarHBondContact O-CG 3.37Å; E176-R180 PolarHBondContact O-N 3.05Å; E176-R180 VanDerWaalsContact O-N 3.13Å
177	F	87.4	Confident	86	Confident	11 Å²	11	30.9 Å²	30.9	5%	0.048	16%	0.163	C	C	.	.	H	α-helix	trans	-56.5	-42.7	172.8	178.9	-91.3	0	0	0	111.9	Y112 D173 E174 L175 R180 K181 T332 H479	Y112-F177 HydrophobicContact CD1-CD2 4.22Å; Y112-F177 HydrophobicContact CE1-CD2 4.05Å; D173-F177 VanDerWaalsContact O-CB 3.25Å; D173-F177 WeakPolarHBondContact O-CB 3.46Å; D173-F177 PolarHBondContact O-N 3.01Å; E174-F177 PolarHBondContact O-N 3.2Å; L175-F177 VanDerWaalsContact C-N 3.34Å; L175-F177 PolarHBondContact O-N 2.92Å; F177-R180 PolarHBondContact O-N 3.25Å; F177-K181 HydrophobicContact CD1-CG 4.06Å; F177-K181 HydrophobicContact CE1-CD 4.49Å; F177-K181 HydrophobicContact CE1-CG 3.61Å; F177-K181 HydrophobicContact CZ-CD 4.46Å; F177-K181 HydrophobicContact CZ-CG 3.89Å; F177-K181 WeakPolarHBondContact O-CB 3.4Å; F177-K181 PolarHBondContact O-N 3.16Å; F177-T332 HydrophobicContact CE2-CG2 4.45Å; F177-T332 WeakPolarHBondContact CZ-OG1 3.3Å; F177-H479 AromaticContact CD1-CD2 3.42Å; F177-H479 VanDerWaalsContact CD1-CD2 3.42Å; F177-H479 WeakPolarHBondContact CD1-CD2 3.39Å; F177-H479 AromaticContact CE1-CD2 3.78Å; F177-H479 AromaticContact CG-CD2 3.6Å; F177-H479 AromaticContact CG-NE2 3.71Å
178	T	90.9	Very high	86.7	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-43.9	178.8	-58.3	0	0	0	0	111.7	E174 L175 E176 R180 K181 L182 H691 D692 V733	E174-T178 WeakPolarHBondContact O-CB 3.22Å; E174-T178 PolarHBondContact O-N 2.86Å; E174-T178 PolarHBondContact O-OG1 3.15Å; L175-T178 WeakPolarHBondContact O-CB 3.07Å; L175-T178 PolarHBondContact O-N 3.3Å; L175-T178 VanDerWaalsContact O-N 3.14Å; E176-T178 VanDerWaalsContact C-N 3.27Å; E176-T178 PolarHBondContact O-N 3.28Å; T178-R180 PolarHBondContact O-N 3.21Å; T178-K181 PolarHBondContact O-N 3.18Å; T178-L182 HydrophobicContact CG2-CD1 3.97Å; T178-L182 HydrophobicContact CG2-CG 4.08Å; T178-L182 WeakPolarHBondContact O-CG 3.26Å; T178-L182 PolarHBondContact O-N 3.45Å; T178-H691 HydrophobicContact CG2-CB 3.96Å; T178-H691 WeakPolarHBondContact OG1-CB 3.3Å; T178-D692 HydrophobicContact CG2-CB 4.07Å; T178-V733 HydrophobicContact CG2-CG1 3.83Å
179	R	90.9	Very high	87.5	Confident	19 Å²	19	27 Å²	27	7%	0.072	13%	0.132	C	C	.	.	H	α-helix	trans	-53.5	-43.1	175	-68.6	174.2	73.4	-150	4.4	111.5	L175 E176 V733 E736	L175-R179 WeakPolarHBondContact O-CG 3.42Å; L175-R179 PolarHBondContact O-N 2.8Å; E176-R179 PolarHBondContact O-N 3.13Å; E176-R179 IonicContact OE1-NH1 3.54Å; E176-R179 WeakPolarHBondContact OE2-CD 3.41Å; E176-R179 IonicContact OE2-CZ 2.98Å; E176-R179 IonicContact OE2-NE 3.44Å; E176-R179 IonicContact OE2-NH1 2.77Å; E176-R179 PolarHBondContact OE2-NH1 3.25Å; R179-V733 HydrophobicContact CG-CB 4.33Å; R179-V733 HydrophobicContact CG-CG1 3.7Å; R179-V733 HydrophobicContact CG-CG2 3.79Å; R179-E736 IonicContact CZ-OE1 3.9Å; R179-E736 IonicContact CZ-OE2 3.4Å; R179-E736 IonicContact NE-OE1 3.38Å; R179-E736 IonicContact NE-OE2 2.7Å; R179-E736 PolarHBondContact NE-OE2 2.88Å; R179-E736 IonicContact NH2-OE1 2.73Å; R179-E736 PolarHBondContact NH2-OE1 3.48Å; R179-E736 IonicContact NH2-OE2 3.53Å; R179-E736 PolarHBondContact NH2-OE2 2.94Å
180	R	87	Confident	88.1	Confident	21 Å²	21	28.7 Å²	28.7	8%	0.079	14%	0.141	C	C	.	.	H	α-helix	trans	-71.8	-37	177.4	-59.9	-68.5	-64.5	-174.2	3.2	112.4	E110 Y112 E176 F177 T178 L183 V328	E110-R180 IonicContact OE2-CZ 3.47Å; E110-R180 IonicContact OE2-NH2 3.53Å; E110-R180 PolarHBondContact OE2-NH2 2.69Å; Y112-R180 HydrophobicContact CD2-CG 4.4Å; Y112-R180 HydrophobicContact CE1-CB 4.28Å; Y112-R180 HydrophobicContact CE1-CG 4.16Å; Y112-R180 HydrophobicContact CE2-CB 4.47Å; Y112-R180 HydrophobicContact CE2-CG 3.78Å; E176-R180 VanDerWaalsContact O-CG 3.29Å; E176-R180 WeakPolarHBondContact O-CG 3.37Å; E176-R180 PolarHBondContact O-N 3.05Å; E176-R180 VanDerWaalsContact O-N 3.13Å; F177-R180 PolarHBondContact O-N 3.25Å; T178-R180 PolarHBondContact O-N 3.21Å; R180-L183 WeakPolarHBondContact O-CB 3.35Å; R180-L183 PolarHBondContact O-N 3.37Å; R180-V328 HydrophobicContact CB-CG2 3.7Å; R180-V328 VanDerWaalsContact O-CG2 3.32Å; R180-V328 WeakPolarHBondContact O-CG2 3.17Å
181	K	87.6	Confident	88.6	Confident	11 Å²	11	30.8 Å²	30.8	5%	0.048	16%	0.158	C	C	.	.	H	α-helix	trans	-69.9	-37.3	179.3	-91.3	-73	-176.5	-171.5	0	114.4	F177 T178 L183 T184 P185 V328 D329 D330 T332	F177-K181 HydrophobicContact CD1-CG 4.06Å; F177-K181 HydrophobicContact CE1-CD 4.49Å; F177-K181 HydrophobicContact CE1-CG 3.61Å; F177-K181 HydrophobicContact CZ-CD 4.46Å; F177-K181 HydrophobicContact CZ-CG 3.89Å; F177-K181 WeakPolarHBondContact O-CB 3.4Å; F177-K181 PolarHBondContact O-N 3.16Å; T178-K181 PolarHBondContact O-N 3.18Å; K181-L183 PolarHBondContact O-N 3.42Å; K181-L183 VanDerWaalsContact O-N 3.16Å; K181-T184 PolarHBondContact O-N 3.03Å; K181-P185 WeakPolarHBondContact O-CD 3.3Å; K181-V328 HydrophobicContact CD-CG1 4.46Å; K181-D329 PolarHBondContact NZ-O 3.43Å; K181-D330 PolarHBondContact NZ-O 3.38Å; K181-T332 WeakPolarHBondContact CE-OG1 3.33Å; K181-T332 PolarHBondContact NZ-OG1 3.33Å
182	L	91.2	Very high	89.3	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-7.9	179.4	-67.3	-179.4	0	0	0	113.2	T178 P185 R186 V696 R697 L700 V733 A737	T178-L182 HydrophobicContact CG2-CD1 3.97Å; T178-L182 HydrophobicContact CG2-CG 4.08Å; T178-L182 WeakPolarHBondContact O-CG 3.26Å; T178-L182 PolarHBondContact O-N 3.45Å; L182-P185 WeakPolarHBondContact O-CD 3.15Å; L182-R186 WeakPolarHBondContact O-CB 3.42Å; L182-R186 PolarHBondContact O-N 3.09Å; L182-V696 HydrophobicContact CD1-CG1 4.26Å; L182-V696 HydrophobicContact CD2-CG1 4.09Å; L182-R697 HydrophobicContact CD2-CG 4.12Å; L182-L700 HydrophobicContact CB-CD2 4.16Å; L182-L700 HydrophobicContact CD2-CD2 4.23Å; L182-V733 HydrophobicContact CD1-CG1 4.05Å; L182-A737 HydrophobicContact CB-CB 3.92Å; L182-A737 HydrophobicContact CD1-CB 3.87Å
183	L	89.6	Confident	89.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.9	-47.3	173.1	-158.5	65.1	0	0	0	113.3	R180 K181 R186 R187 E323 W325 A326	R180-L183 WeakPolarHBondContact O-CB 3.35Å; R180-L183 PolarHBondContact O-N 3.37Å; K181-L183 PolarHBondContact O-N 3.42Å; K181-L183 VanDerWaalsContact O-N 3.16Å; L183-R186 PolarHBondContact O-N 3.32Å; L183-R187 WeakPolarHBondContact O-CG 3.4Å; L183-R187 PolarHBondContact O-N 3.45Å; L183-E323 HydrophobicContact CD1-CG 4.25Å; L183-E323 WeakPolarHBondContact CD1-OE1 3.36Å; L183-E323 WeakPolarHBondContact CD1-OE2 3.39Å; L183-E323 WeakPolarHBondContact CD2-OE1 3.48Å; L183-E323 WeakPolarHBondContact CG-OE1 3.5Å; L183-W325 HydrophobicContact CD1-CE3 3.87Å; L183-W325 HydrophobicContact CD2-CB 3.62Å; L183-W325 HydrophobicContact CD2-CE3 4.43Å; L183-A326 WeakPolarHBondContact CD2-O 3.32Å
184	T	86.9	Confident	90.1	Very high	9 Å²	9	33.3 Å²	33.3	6%	0.055	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-51.6	-175.7	-59.1	0	0	0	0	111.6	K181 R186 R187 I188 Q327	K181-T184 PolarHBondContact O-N 3.03Å; T184-R186 VanDerWaalsContact C-N 3.26Å; T184-R186 PolarHBondContact O-N 3Å; T184-R187 PolarHBondContact O-N 3.18Å; T184-I188 HydrophobicContact CG2-CD1 3.78Å; T184-I188 HydrophobicContact CG2-CG1 4.44Å; T184-I188 WeakPolarHBondContact O-CG1 3.24Å; T184-I188 PolarHBondContact O-N 2.99Å; T184-Q327 HydrophobicContact CG2-CG 4.37Å; T184-Q327 VanDerWaalsContact CG2-NE2 3.3Å; T184-Q327 VanDerWaalsContact OG1-CG 3.23Å; T184-Q327 WeakPolarHBondContact OG1-CG 3.42Å
185	P	90.8	Very high	90.2	Very high	21 Å²	21	36.5 Å²	36.5	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-55.3	-40.3	174.1	-25.5	33.9	0	0	0	113.3	K181 L182 E189 R697 L700	K181-P185 WeakPolarHBondContact O-CD 3.3Å; L182-P185 WeakPolarHBondContact O-CD 3.15Å; P185-E189 PolarHBondContact O-N 2.81Å; P185-R697 HydrophobicContact CG-CG 4.11Å; P185-L700 HydrophobicContact CB-CD2 4.48Å
186	R	92.4	Very high	90.4	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-49.5	177.1	179.2	174.1	77.5	-149.4	10.2	111.9	L182 L183 T184 I188 E189 L190 E323 L704 A737	L182-R186 WeakPolarHBondContact O-CB 3.42Å; L182-R186 PolarHBondContact O-N 3.09Å; L183-R186 PolarHBondContact O-N 3.32Å; T184-R186 VanDerWaalsContact C-N 3.26Å; T184-R186 PolarHBondContact O-N 3Å; R186-I188 VanDerWaalsContact C-N 3.35Å; R186-I188 PolarHBondContact O-N 3.07Å; R186-E189 PolarHBondContact O-N 3.27Å; R186-L190 HydrophobicContact CG-CD1 3.85Å; R186-L190 HydrophobicContact CG-CG 4.27Å; R186-L190 WeakPolarHBondContact O-CB 3.16Å; R186-L190 VanDerWaalsContact O-CG 3.28Å; R186-L190 WeakPolarHBondContact O-CG 3.3Å; R186-L190 PolarHBondContact O-N 2.92Å; R186-E323 IonicContact CZ-OE2 3.18Å; R186-E323 IonicContact NE-OE2 3.97Å; R186-E323 PolarHBondContact NE-OE2 2.9Å; R186-E323 IonicContact NH2-OE1 2.72Å; R186-E323 IonicContact NH2-OE2 2.66Å; R186-E323 PolarHBondContact NH2-OE2 3.35Å; R186-L704 HydrophobicContact CB-CD1 4.07Å; R186-L704 HydrophobicContact CG-CD1 3.78Å; R186-A737 VanDerWaalsContact CD-O 3.28Å; R186-A737 WeakPolarHBondContact CD-O 3.3Å; R186-A737 PolarHBondContact NH1-O 2.73Å
187	R	89.4	Confident	90.7	Very high	69 Å²	69	38.9 Å²	38.9	26%	0.26	21%	0.206	S	C	.	.	H	α-helix	trans	-62.1	-41.7	-179.3	-75.6	-177.2	176.8	-165.9	-6.6	112.8	L183 T184 L190 S191 E323 W325	L183-R187 WeakPolarHBondContact O-CG 3.4Å; L183-R187 PolarHBondContact O-N 3.45Å; T184-R187 PolarHBondContact O-N 3.18Å; R187-L190 PolarHBondContact O-N 2.66Å; R187-S191 PolarHBondContact O-N 2.96Å; R187-S191 PolarHBondContact O-OG 3.47Å; R187-E323 IonicContact CZ-OE1 4Å; R187-E323 IonicContact NE-OE1 3.37Å; R187-E323 PolarHBondContact NE-OE1 3.11Å; R187-E323 IonicContact NE-OE2 2.8Å; R187-E323 IonicContact NH2-OE1 3.68Å; R187-E323 PolarHBondContact NH2-OE1 3Å; R187-W325 PolarHBondContact NH2-O 3.31Å
188	I	90	Very high	91.1	Very high	86 Å²	86	38.4 Å²	38.4	44%	0.441	20%	0.204	S	C	.	.	H	α-helix	trans	-60.6	-48.2	176.6	-67.8	167.6	0	0	0	109.8	T184 R186 L190 S191 D192	T184-I188 HydrophobicContact CG2-CD1 3.78Å; T184-I188 HydrophobicContact CG2-CG1 4.44Å; T184-I188 WeakPolarHBondContact O-CG1 3.24Å; T184-I188 PolarHBondContact O-N 2.99Å; R186-I188 VanDerWaalsContact C-N 3.35Å; R186-I188 PolarHBondContact O-N 3.07Å; I188-L190 PolarHBondContact O-N 3.28Å; I188-S191 PolarHBondContact O-N 3.33Å; I188-S191 PolarHBondContact O-OG 3.43Å; I188-D192 WeakPolarHBondContact O-CB 3.32Å; I188-D192 VanDerWaalsContact O-CG 3.27Å; I188-D192 PolarHBondContact O-N 3.26Å
189	E	93.8	Very high	91.3	Very high	5 Å²	5	38.8 Å²	38.8	2%	0.023	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-39.8	-179.7	-168.9	58.5	-147.8	0	0	111.7	P185 R186 S191 D192 R193 K701 L704 R705	P185-E189 PolarHBondContact O-N 2.81Å; R186-E189 PolarHBondContact O-N 3.27Å; E189-S191 VanDerWaalsContact C-N 3.3Å; E189-S191 PolarHBondContact O-N 2.85Å; E189-D192 PolarHBondContact O-N 2.66Å; E189-R193 WeakPolarHBondContact O-CB 3.5Å; E189-R193 PolarHBondContact O-N 3.17Å; E189-K701 HydrophobicContact CG-CG 4.29Å; E189-K701 WeakPolarHBondContact OE2-CG 3.31Å; E189-L704 HydrophobicContact CB-CB 4.36Å; E189-L704 HydrophobicContact CB-CD1 4.42Å; E189-L704 HydrophobicContact CG-CB 3.77Å; E189-R705 WeakPolarHBondContact OE1-CB 3.44Å; E189-R705 IonicContact OE1-CZ 3.84Å; E189-R705 IonicContact OE1-NE 3.67Å; E189-R705 PolarHBondContact OE1-NE 3.47Å; E189-R705 IonicContact OE1-NH2 3.76Å; E189-R705 PolarHBondContact OE1-NH2 3.41Å; E189-R705 VanDerWaalsContact OE1-NH2 3.16Å; E189-R705 IonicContact OE2-CZ 3.35Å; E189-R705 IonicContact OE2-NE 2.77Å; E189-R705 IonicContact OE2-NH2 3.7Å; E189-R705 PolarHBondContact OE2-NH2 3.05Å
190	L	91.4	Very high	91.4	Very high	43 Å²	43	38.2 Å²	38.2	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-32.1	175.7	-70.7	176.8	0	0	0	113.5	R186 R187 I188 V320 G741	R186-L190 HydrophobicContact CG-CD1 3.85Å; R186-L190 HydrophobicContact CG-CG 4.27Å; R186-L190 WeakPolarHBondContact O-CB 3.16Å; R186-L190 VanDerWaalsContact O-CG 3.28Å; R186-L190 WeakPolarHBondContact O-CG 3.3Å; R186-L190 PolarHBondContact O-N 2.92Å; R187-L190 PolarHBondContact O-N 2.66Å; I188-L190 PolarHBondContact O-N 3.28Å; L190-V320 HydrophobicContact CD1-CB 4.35Å; L190-V320 HydrophobicContact CD1-CG1 4.22Å; L190-V320 HydrophobicContact CD1-CG2 4.09Å; L190-V320 HydrophobicContact CD2-CG2 3.9Å; L190-G741 WeakPolarHBondContact CD2-O 3.44Å
191	S	90.3	Very high	91.7	Very high	89 Å²	89	38.8 Å²	38.8	62%	0.622	21%	0.21	S	C	*	.	H	α-helix	trans	-77.1	-32	175.9	60.9	0	0	0	0	113.1	R187 I188 E189	R187-S191 PolarHBondContact O-N 2.96Å; R187-S191 PolarHBondContact O-OG 3.47Å; I188-S191 PolarHBondContact O-N 3.33Å; I188-S191 PolarHBondContact O-OG 3.43Å; E189-S191 VanDerWaalsContact C-N 3.3Å; E189-S191 PolarHBondContact O-N 2.85Å
192	D	92.2	Very high	92.1	Very high	112 Å²	112	39.5 Å²	39.5	60%	0.599	22%	0.215	S	C	*	.	H	α-helix	trans	-86.6	-18.1	-178.1	-67.4	-4	0	0	0	112.4	I188 E189 D194	I188-D192 WeakPolarHBondContact O-CB 3.32Å; I188-D192 VanDerWaalsContact O-CG 3.27Å; I188-D192 PolarHBondContact O-N 3.26Å; E189-D192 PolarHBondContact O-N 2.66Å; D192-D194 PolarHBondContact O-N 3.31Å
193	R	91.4	Very high	92.2	Very high	39 Å²	39	42.5 Å²	42.5	15%	0.147	23%	0.226	C	C	.	.	S	Bend	trans	-69.6	123.6	-177.8	-177.9	177.6	82.8	179.4	3.2	111.6	E189 Y198 D318 L704 G741	E189-R193 WeakPolarHBondContact O-CB 3.5Å; E189-R193 PolarHBondContact O-N 3.17Å; R193-Y198 VanDerWaalsContact CD-CG 3.47Å; R193-Y198 HydrophobicContact CG-CD2 4.38Å; R193-Y198 HydrophobicContact CG-CG 4.15Å; R193-Y198 VanDerWaalsContact NH1-CZ 3.33Å; R193-D318 PolarHBondContact NH2-O 3.3Å; R193-L704 VanDerWaalsContact CD-O 3.22Å; R193-L704 WeakPolarHBondContact CD-O 3.45Å; R193-G741 PolarHBondContact NH1-O 2.82Å
194	D	93.1	Very high	92.5	Very high	73 Å²	73	44.2 Å²	44.2	39%	0.39	24%	0.237	S	C	.	.			trans	-69.9	123.6	168.8	-179.1	-70.1	0	0	0	110	D192 N196 L197 Y198	D192-D194 PolarHBondContact O-N 3.31Å; D194-N196 PolarHBondContact O-N 3.42Å; D194-N196 PolarHBondContact OD1-N 3.05Å; D194-L197 HydrophobicContact CB-CB 3.99Å; D194-L197 HydrophobicContact CB-CD1 3.84Å; D194-L197 HydrophobicContact CB-CG 4.25Å; D194-L197 PolarHBondContact OD1-N 2.92Å; D194-Y198 WeakPolarHBondContact O-CB 3.45Å; D194-Y198 PolarHBondContact O-N 3.4Å
195	P	92.8	Very high	92.7	Very high	70 Å²	70	44 Å²	44	46%	0.455	24%	0.235	S	C	.	.	H	α-helix	trans	-67.6	-36.2	-173.1	25.6	-33.4	0	0	0	112.8	S199 P315	P195-S199 WeakPolarHBondContact O-CB 3.49Å; P195-S199 PolarHBondContact O-N 3.31Å; P195-P315 HydrophobicContact CB-CB 3.81Å
196	N	92.8	Very high	92.6	Very high	58 Å²	58	51.5 Å²	51.5	31%	0.31	26%	0.261	S	S	.	.	H	α-helix	trans	-74.1	-45.9	-178.5	-68.8	-32.1	0	0	0	110.7	D194 Y198 S199 M200 Y284	D194-N196 PolarHBondContact O-N 3.42Å; D194-N196 PolarHBondContact OD1-N 3.05Å; N196-Y198 VanDerWaalsContact C-N 3.31Å; N196-Y198 PolarHBondContact O-N 3.43Å; N196-S199 PolarHBondContact O-N 3.17Å; N196-M200 HydrophobicContact CB-CE 3.77Å; N196-M200 VanDerWaalsContact O-CE 3.23Å; N196-M200 WeakPolarHBondContact O-CE 3.24Å; N196-M200 PolarHBondContact O-N 3.5Å; N196-Y284 HydrophobicContact CB-CE1 4.27Å
197	L	93.7	Very high	92.4	Very high	73 Å²	73	53.6 Å²	53.6	38%	0.382	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-40.1	175.1	-77.7	168.6	0	0	0	111.6	D194 D201 P202 Y284	D194-L197 HydrophobicContact CB-CB 3.99Å; D194-L197 HydrophobicContact CB-CD1 3.84Å; D194-L197 HydrophobicContact CB-CG 4.25Å; D194-L197 PolarHBondContact OD1-N 2.92Å; L197-D201 WeakPolarHBondContact O-CA 3.43Å; L197-D201 PolarHBondContact O-N 2.88Å; L197-P202 HydrophobicContact CD2-CG 4.08Å; L197-Y284 HydrophobicContact CD2-CD1 3.79Å; L197-Y284 HydrophobicContact CD2-CE1 3.86Å; L197-Y284 HydrophobicContact CG-CD1 4.46Å; L197-Y284 HydrophobicContact CG-CE1 4.08Å
198	Y	95.1	Very high	92.4	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-68.9	-39.2	175.7	-177	-107.9	0	0	0	112.3	R193 D194 N196 M200 D318 L704 R705 K707 C742	R193-Y198 VanDerWaalsContact CD-CG 3.47Å; R193-Y198 HydrophobicContact CG-CD2 4.38Å; R193-Y198 HydrophobicContact CG-CG 4.15Å; R193-Y198 VanDerWaalsContact NH1-CZ 3.33Å; D194-Y198 WeakPolarHBondContact O-CB 3.45Å; D194-Y198 PolarHBondContact O-N 3.4Å; N196-Y198 VanDerWaalsContact C-N 3.31Å; N196-Y198 PolarHBondContact O-N 3.43Å; Y198-M200 VanDerWaalsContact C-N 3.34Å; Y198-M200 PolarHBondContact O-N 3.27Å; Y198-D318 HydrophobicContact CD1-CB 4.06Å; Y198-D318 HydrophobicContact CE1-CB 4.11Å; Y198-L704 VanDerWaalsContact CE2-O 3.26Å; Y198-L704 WeakPolarHBondContact CE2-O 3.43Å; Y198-R705 WeakPolarHBondContact CD2-O 3.46Å; Y198-K707 HydrophobicContact CD1-CG 4.45Å; Y198-K707 HydrophobicContact CD2-CG 4.03Å; Y198-K707 HydrophobicContact CE1-CD 4.37Å; Y198-K707 VanDerWaalsContact CE1-CE 3.43Å; Y198-K707 HydrophobicContact CE1-CG 4.01Å; Y198-K707 HydrophobicContact CE2-CG 3.56Å; Y198-K707 HydrophobicContact CG-CG 4.47Å; Y198-K707 VanDerWaalsContact O-CD 3.26Å; Y198-K707 WeakPolarHBondContact O-CD 3.5Å; Y198-K707 WeakPolarHBondContact O-CE 3.18Å; Y198-C742 WeakPolarHBondContact CE1-O 3.42Å; Y198-C742 WeakPolarHBondContact OH-CA 3.46Å; Y198-C742 PolarHBondContact OH-O 3.22Å
199	S	94.3	Very high	92.3	Very high	10 Å²	10	52 Å²	52	7%	0.07	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-42.1	-178.8	-161	0	0	0	0	112	P195 N196 D318 K707	P195-S199 WeakPolarHBondContact O-CB 3.49Å; P195-S199 PolarHBondContact O-N 3.31Å; N196-S199 PolarHBondContact O-N 3.17Å; S199-D318 WeakPolarHBondContact CA-OD2 3.24Å; S199-D318 WeakPolarHBondContact CB-OD2 3.5Å; S199-D318 PolarHBondContact OG-OD2 3.5Å; S199-K707 PolarHBondContact O-NZ 2.86Å
200	M	94	Very high	92	Very high	6 Å²	6	52.4 Å²	52.4	3%	0.03	28%	0.277	C	S	.	.	H	α-helix	trans	-91	-23.5	-178.2	-70.6	178.2	-81.1	0	0	114.8	N196 Y198 V273 Y282 Y284 P312 P313	N196-M200 HydrophobicContact CB-CE 3.77Å; N196-M200 VanDerWaalsContact O-CE 3.23Å; N196-M200 WeakPolarHBondContact O-CE 3.24Å; N196-M200 PolarHBondContact O-N 3.5Å; Y198-M200 VanDerWaalsContact C-N 3.34Å; Y198-M200 PolarHBondContact O-N 3.27Å; M200-V273 HydrophobicContact SD-CB 4.29Å; M200-V273 HydrophobicContact SD-CG1 4.47Å; M200-V273 HydrophobicContact SD-CG2 3.77Å; M200-Y282 HydrophobicContact CB-CD2 4.12Å; M200-Y282 HydrophobicContact CB-CG 3.95Å; M200-Y282 HydrophobicContact CG-CD1 4.12Å; M200-Y282 HydrophobicContact CG-CD2 4.32Å; M200-Y282 HydrophobicContact CG-CG 3.98Å; M200-Y282 VanDerWaalsContact O-CD2 3.3Å; M200-Y282 WeakPolarHBondContact O-CD2 3.4Å; M200-Y284 HydrophobicContact CE-CD1 3.51Å; M200-Y284 HydrophobicContact CE-CD2 3.58Å; M200-Y284 HydrophobicContact CE-CE1 3.5Å; M200-Y284 HydrophobicContact CE-CE2 3.57Å; M200-Y284 HydrophobicContact CE-CG 3.55Å; M200-Y284 HydrophobicContact SD-CD1 4.17Å; M200-Y284 HydrophobicContact SD-CD2 3.76Å; M200-Y284 HydrophobicContact SD-CE2 4.31Å; M200-Y284 HydrophobicContact SD-CG 3.68Å; M200-P312 HydrophobicContact SD-CB 4.32Å; M200-P313 HydrophobicContact CG-CG 3.57Å
201	D	93.9	Very high	91.7	Very high	34 Å²	34	57.3 Å²	57.3	18%	0.182	30%	0.299	C	S	.	.			trans	37.5	67.2	177.4	-167.2	43.7	0	0	0	114.4	L197 W203 S706 K707 R708	L197-D201 WeakPolarHBondContact O-CA 3.43Å; L197-D201 PolarHBondContact O-N 2.88Å; D201-W203 PolarHBondContact O-N 3.35Å; D201-S706 WeakPolarHBondContact OD1-CA 3.32Å; D201-S706 WeakPolarHBondContact OD1-CB 3.35Å; D201-S706 PolarHBondContact OD1-OG 3.41Å; D201-S706 PolarHBondContact OD2-OG 3.23Å; D201-K707 HydrophobicContact CB-CB 4.11Å; D201-K707 HydrophobicContact CB-CG 4.47Å; D201-K707 PolarHBondContact OD1-N 3.28Å; D201-K707 WeakPolarHBondContact OD2-CB 3.45Å; D201-K707 PolarHBondContact OD2-N 2.9Å; D201-K707 VanDerWaalsContact OD2-N 3.12Å; D201-R708 WeakPolarHBondContact OD2-CB 3.42Å; D201-R708 PolarHBondContact OD2-N 3.08Å
202	P	94.4	Very high	91.3	Very high	25 Å²	25	55.2 Å²	55.2	16%	0.162	28%	0.279	C	S	.	.			trans	-63.1	125.2	-174.1	25.9	-34.3	0	0	0	112	L197 V204 F292	L197-P202 HydrophobicContact CD2-CG 4.08Å; P202-V204 HydrophobicContact CB-CG1 4.26Å; P202-V204 PolarHBondContact O-N 3.19Å; P202-F292 HydrophobicContact CB-CE1 3.97Å
203	W	94.9	Very high	90.9	Very high	64 Å²	64	50.1 Å²	50.1	24%	0.242	25%	0.252	C	S	.	.			trans	-85.4	96.4	-179.6	-172.7	25.6	0	0	0	111.5	D201 N293 D672	D201-W203 PolarHBondContact O-N 3.35Å; W203-N293 HydrophobicContact CD2-CB 3.63Å; W203-N293 HydrophobicContact CE3-CB 3.89Å; W203-N293 HydrophobicContact CG-CB 4.05Å; W203-N293 HydrophobicContact CH2-CB 4.26Å; W203-N293 HydrophobicContact CZ2-CB 4.03Å; W203-N293 HydrophobicContact CZ3-CB 4.2Å; W203-N293 PolarHBondContact NE1-ND2 3.31Å; W203-N293 PolarHBondContact O-N 3.46Å; W203-D672 PolarHBondContact NE1-OD1 3.05Å
204	V	94.5	Very high	90.7	Very high	37 Å²	37	52.5 Å²	52.5	22%	0.224	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-128	159.9	-170.9	-62.3	0	0	0	0	113.5	P202 K287 S291 F292	P202-V204 HydrophobicContact CB-CG1 4.26Å; P202-V204 PolarHBondContact O-N 3.19Å; V204-K287 HydrophobicContact CG1-CG 4.48Å; V204-S291 CarbonylContact C-O 3.58Å; V204-S291 WeakPolarHBondContact CA-O 2.84Å; V204-F292 HydrophobicContact CG1-CD1 3.57Å; V204-F292 HydrophobicContact CG1-CD2 4.41Å; V204-F292 HydrophobicContact CG1-CE1 3.56Å; V204-F292 HydrophobicContact CG1-CE2 4.42Å; V204-F292 HydrophobicContact CG1-CG 4.02Å; V204-F292 HydrophobicContact CG1-CZ 4.02Å
205	T	91.8	Very high	90.3	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.018	28%	0.281	C	S	.	.			trans	-134.4	146	172.8	-174.5	0	0	0	0	110.8	K207 S291	T205-K207 PolarHBondContact OG1-N 2.78Å; T205-S291 PolarHBondContact N-O 2.97Å; T205-S291 VanDerWaalsContact O-CB 3.27Å; T205-S291 WeakPolarHBondContact O-CB 3.5Å; T205-S291 PolarHBondContact O-OG 3.07Å
206	R	88.7	Confident	89.8	Confident	179 Å²	179	55.1 Å²	55.1	68%	0.675	28%	0.28	S	S	*	.			trans	-93.1	-2.7	172.1	-54.3	-170.6	-158.5	159.1	-7.5	113.5	E670	R206-E670 WeakPolarHBondContact CB-OE1 3.23Å; R206-E670 WeakPolarHBondContact CB-OE2 3.46Å; R206-E670 WeakPolarHBondContact CD-OE1 3.46Å; R206-E670 WeakPolarHBondContact CG-OE1 3.42Å; R206-E670 WeakPolarHBondContact CG-OE2 3.32Å; R206-E670 IonicContact CZ-OE1 3.6Å; R206-E670 PolarHBondContact N-OE2 3.35Å; R206-E670 VanDerWaalsContact N-OE2 3.1Å; R206-E670 IonicContact NE-OE1 2.84Å; R206-E670 PolarHBondContact NE-OE1 3.32Å; R206-E670 IonicContact NH1-OE1 3.68Å
207	K	87.9	Confident	89.6	Confident	49 Å²	49	53.2 Å²	53.2	21%	0.213	27%	0.27	C	S	.	.	S	Bend	trans	-58.3	143.5	175.2	-66.3	177.3	-175.9	170.4	0	109.3	T205 R296 D673 S871	T205-K207 PolarHBondContact OG1-N 2.78Å; K207-R296 PolarHBondContact O-NH1 2.82Å; K207-R296 PolarHBondContact O-NH2 2.71Å; K207-D673 IonicContact NZ-OD1 2.87Å; K207-D673 PolarHBondContact NZ-OD1 3.46Å; K207-D673 IonicContact NZ-OD2 3.47Å; K207-S871 PolarHBondContact NZ-OG 3.46Å
208	P	89	Confident	89.2	Confident	111 Å²	111	55.5 Å²	55.5	72%	0.721	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-61.7	162.3	174.9	27.9	-34.5	0	0	0	110.7	P210 R296	P208-P210 WeakPolarHBondContact O-CD 3.45Å; P208-R296 PolarHBondContact O-NH1 2.67Å
209	L	87.9	Confident	88.8	Confident	11 Å²	11	62.2 Å²	62.2	6%	0.058	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-73	125.1	172.5	-161.8	73.3	0	0	0	108.7	L213 L214 V217 I239 R296	L209-L213 HydrophobicContact CD1-CB 4.13Å; L209-L213 HydrophobicContact CD1-CD1 4Å; L209-L213 HydrophobicContact CD2-CB 4.17Å; L209-L213 HydrophobicContact CG-CB 3.87Å; L209-L214 HydrophobicContact CB-CD2 4.34Å; L209-L214 HydrophobicContact CB-CG 4.21Å; L209-L214 HydrophobicContact CD2-CD2 3.86Å; L209-L214 HydrophobicContact CD2-CG 3.99Å; L209-L214 HydrophobicContact CG-CG 4.35Å; L209-L214 WeakPolarHBondContact O-CD1 3.42Å; L209-V217 HydrophobicContact CD2-CG2 4.17Å; L209-I239 HydrophobicContact CD2-CD1 3.79Å; L209-R296 HydrophobicContact CD1-CG 3.94Å
210	P	86.9	Confident	88.6	Confident	13 Å²	13	63.1 Å²	63.1	8%	0.084	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-59.1	151.2	178.7	-24.9	33.2	0	0	0	113	P208 H212 L213 L214 E874	P208-P210 WeakPolarHBondContact O-CD 3.45Å; P210-H212 VanDerWaalsContact C-N 3.28Å; P210-H212 WeakPolarHBondContact CB-CE1 3.34Å; P210-H212 WeakPolarHBondContact CB-ND1 3.49Å; P210-H212 PolarHBondContact O-N 3.32Å; P210-L213 HydrophobicContact CG-CD1 4.42Å; P210-L213 PolarHBondContact O-N 2.84Å; P210-L214 PolarHBondContact O-N 2.7Å; P210-E874 HydrophobicContact CB-CG 4.39Å; P210-E874 HydrophobicContact CG-CG 3.57Å; P210-E874 WeakPolarHBondContact CG-OE1 3.48Å
211	E	85.3	Confident	88.5	Confident	146 Å²	146	67.9 Å²	67.9	68%	0.682	35%	0.348	S	S	*	.	H	α-helix	trans	-55.4	-40.7	-178.7	-67.6	-170.4	167.6	0	0	113.1	L213 L214 S215	E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.48Å; E211-L214 WeakPolarHBondContact O-CB 3.19Å; E211-L214 PolarHBondContact O-N 2.79Å; E211-S215 PolarHBondContact O-N 3.05Å; E211-S215 VanDerWaalsContact O-N 3.07Å
212	H	81.9	Confident	88.5	Confident	45 Å²	45	66.8 Å²	66.8	21%	0.208	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-30.9	178.6	67.2	-91.9	0	0	0	112.8	P210 S215	P210-H212 VanDerWaalsContact C-N 3.28Å; P210-H212 WeakPolarHBondContact CB-CE1 3.34Å; P210-H212 WeakPolarHBondContact CB-ND1 3.49Å; P210-H212 PolarHBondContact O-N 3.32Å; H212-S215 PolarHBondContact O-OG 2.88Å
213	L	84.9	Confident	88.5	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-79.1	-36.6	172.9	-64.3	-169.4	0	0	0	111.9	L209 P210 E211 S215 K216 R296 K300	L209-L213 HydrophobicContact CD1-CB 4.13Å; L209-L213 HydrophobicContact CD1-CD1 4Å; L209-L213 HydrophobicContact CD2-CB 4.17Å; L209-L213 HydrophobicContact CG-CB 3.87Å; P210-L213 HydrophobicContact CG-CD1 4.42Å; P210-L213 PolarHBondContact O-N 2.84Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.48Å; L213-S215 PolarHBondContact O-N 3.35Å; L213-K216 WeakPolarHBondContact O-CB 3.48Å; L213-K216 PolarHBondContact O-N 2.67Å; L213-R296 HydrophobicContact CD1-CB 4.28Å; L213-K300 HydrophobicContact CD2-CB 3.85Å; L213-K300 HydrophobicContact CD2-CG 4.35Å
214	L	86.4	Confident	88.6	Confident	89 Å²	89	68.1 Å²	68.1	47%	0.466	35%	0.352	S	S	.	.	H	α-helix	trans	-56.9	-38.3	174	-78.5	165.2	0	0	0	111.6	L209 P210 E211 K216 V217	L209-L214 HydrophobicContact CB-CD2 4.34Å; L209-L214 HydrophobicContact CB-CG 4.21Å; L209-L214 HydrophobicContact CD2-CD2 3.86Å; L209-L214 HydrophobicContact CD2-CG 3.99Å; L209-L214 HydrophobicContact CG-CG 4.35Å; L209-L214 WeakPolarHBondContact O-CD1 3.42Å; P210-L214 PolarHBondContact O-N 2.7Å; E211-L214 WeakPolarHBondContact O-CB 3.19Å; E211-L214 PolarHBondContact O-N 2.79Å; L214-K216 PolarHBondContact O-N 2.92Å; L214-K216 VanDerWaalsContact O-N 3.15Å; L214-V217 PolarHBondContact O-N 3.15Å
215	S	84.2	Confident	88.6	Confident	97 Å²	97	67 Å²	67	68%	0.678	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.8	175.9	80.9	0	0	0	0	114.3	E211 H212 L213	E211-S215 PolarHBondContact O-N 3.05Å; E211-S215 VanDerWaalsContact O-N 3.07Å; H212-S215 PolarHBondContact O-OG 2.88Å; L213-S215 PolarHBondContact O-N 3.35Å
216	K	83.9	Confident	88.8	Confident	102 Å²	102	66.8 Å²	66.8	44%	0.443	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-8.8	178.4	-61.7	-173.4	175.5	-177.6	0	113	L213 L214 L299 K300	L213-K216 WeakPolarHBondContact O-CB 3.48Å; L213-K216 PolarHBondContact O-N 2.67Å; L214-K216 PolarHBondContact O-N 2.92Å; L214-K216 VanDerWaalsContact O-N 3.15Å; K216-L299 WeakPolarHBondContact CD-O 3.49Å; K216-L299 PolarHBondContact NZ-O 3.4Å; K216-K300 PolarHBondContact NZ-O 3.32Å
217	V	87.6	Confident	89	Confident	18 Å²	18	59.8 Å²	59.8	11%	0.109	32%	0.319	C	S	.	.	S	Bend	trans	-95.3	124.4	179.3	-176.3	0	0	0	0	109	L209 L214 N219 I222 I239 L299	L209-V217 HydrophobicContact CD2-CG2 4.17Å; L214-V217 PolarHBondContact O-N 3.15Å; V217-N219 PolarHBondContact O-N 2.8Å; V217-I222 HydrophobicContact CG1-CG2 4.12Å; V217-I222 HydrophobicContact CG2-CG2 4.42Å; V217-I239 HydrophobicContact CG1-CD1 4.41Å; V217-I239 HydrophobicContact CG2-CD1 3.79Å; V217-L299 HydrophobicContact CG2-CD1 4.2Å; V217-L299 HydrophobicContact CG2-CD2 4.46Å
218	N	85.9	Confident	89.1	Confident	121 Å²	121	58 Å²	58	65%	0.647	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-89.5	106.4	-175.8	-169.3	-4.6	0	0	0	111	G220 Y221	N218-G220 PolarHBondContact O-N 3.16Å; N218-Y221 PolarHBondContact N-O 3.05Å; N218-Y221 PolarHBondContact O-N 2.68Å
219	N	86.1	Confident	88.7	Confident	143 Å²	143	58.2 Å²	58.2	77%	0.765	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	33.6	-178.8	-64.5	-21.9	0	0	0	113.9	V217 Y221	V217-N219 PolarHBondContact O-N 2.8Å; N219-Y221 VanDerWaalsContact C-N 3.34Å; N219-Y221 WeakPolarHBondContact O-CD2 3.07Å; N219-Y221 WeakPolarHBondContact O-CE2 3.02Å
220	G	89.4	Confident	88.2	Confident	29 Å²	29	64.5 Å²	64.5	30%	0.299	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	4.8	-178.3	0	0	0	0	0	115.3	N218 I239	N218-G220 PolarHBondContact O-N 3.16Å; G220-I239 PolarHBondContact O-N 3.4Å
221	Y	93.5	Very high	88.2	Confident	106 Å²	106	66.1 Å²	66.1	42%	0.416	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147.7	-179.4	-64.2	-92.5	0	0	0	112.6	N218 N219 K236 V237	N218-Y221 PolarHBondContact N-O 3.05Å; N218-Y221 PolarHBondContact O-N 2.68Å; N219-Y221 VanDerWaalsContact C-N 3.34Å; N219-Y221 WeakPolarHBondContact O-CD2 3.07Å; N219-Y221 WeakPolarHBondContact O-CE2 3.02Å; Y221-K236 HydrophobicContact CD1-CD 4.4Å; Y221-K236 HydrophobicContact CD1-CG 4.06Å; Y221-K236 HydrophobicContact CG-CD 4.41Å; Y221-K236 HydrophobicContact CG-CG 4.29Å; Y221-V237 VanDerWaalsContact CA-O 3.29Å; Y221-V237 WeakPolarHBondContact CA-O 3.31Å; Y221-V237 WeakPolarHBondContact CD1-O 3.44Å
222	I	94.3	Very high	88.4	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.056	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	157	172.4	61.3	172.1	0	0	0	110.6	V217 V224 V237 I239 L289 I295 L299 I305	V217-I222 HydrophobicContact CG1-CG2 4.12Å; V217-I222 HydrophobicContact CG2-CG2 4.42Å; I222-V224 HydrophobicContact CD1-CG2 4.06Å; I222-V224 HydrophobicContact CG1-CG2 4.19Å; I222-V237 HydrophobicContact CD1-CG2 4.37Å; I222-V237 HydrophobicContact CG1-CG2 3.75Å; I222-V237 PolarHBondContact N-O 3.39Å; I222-V237 PolarHBondContact O-N 3.18Å; I222-I239 HydrophobicContact CD1-CG1 4.38Å; I222-I239 HydrophobicContact CG2-CD1 4.4Å; I222-I239 HydrophobicContact CG2-CG1 4.29Å; I222-L289 HydrophobicContact CD1-CD1 3.94Å; I222-I295 HydrophobicContact CD1-CG2 4.17Å; I222-L299 HydrophobicContact CG2-CD2 4.08Å; I222-I305 HydrophobicContact CD1-CD1 3.85Å
223	L	94.5	Very high	88.8	Confident	115 Å²	115	62.6 Å²	62.6	60%	0.602	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.6	172.7	-65.1	176.5	0	0	0	108.9	T234 K236	L223-T234 HydrophobicContact CB-CG2 4.35Å; L223-T234 HydrophobicContact CD2-CG2 4.46Å; L223-K236 HydrophobicContact CD2-CB 3.93Å; L223-K236 HydrophobicContact CD2-CG 4.26Å
224	V	95.5	Very high	89.3	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.006	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.6	178.2	178.9	0	0	0	0	108.4	I222 I226 T234 I235 V237 I305 L307	I222-V224 HydrophobicContact CD1-CG2 4.06Å; I222-V224 HydrophobicContact CG1-CG2 4.19Å; V224-I226 HydrophobicContact CG1-CG1 4.06Å; V224-T234 WeakPolarHBondContact O-CA 3.39Å; V224-I235 HydrophobicContact CB-CG1 4.19Å; V224-I235 PolarHBondContact N-O 3.41Å; V224-I235 PolarHBondContact O-N 2.93Å; V224-V237 HydrophobicContact CB-CG2 4.42Å; V224-V237 HydrophobicContact CG2-CG2 3.67Å; V224-I305 HydrophobicContact CG1-CG2 4.24Å; V224-I305 HydrophobicContact CG2-CB 4.44Å; V224-I305 HydrophobicContact CG2-CG2 4.24Å; V224-L307 HydrophobicContact CG1-CD1 3.5Å; V224-L307 VanDerWaalsContact CG1-CD1 3.5Å; V224-L307 HydrophobicContact CG1-CG 3.89Å
225	V	95.9	Very high	89.6	Confident	13 Å²	13	61.2 Å²	61.2	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.3	176.7	-176.1	0	0	0	0	108.1	T234 I305 H306 L307	V225-T234 HydrophobicContact CG2-CG2 4.17Å; V225-I305 PolarHBondContact N-O 3.06Å; V225-H306 WeakPolarHBondContact CB-ND1 3.36Å; V225-H306 WeakPolarHBondContact O-CA 3.37Å; V225-L307 PolarHBondContact O-N 2.92Å
226	I	95.2	Very high	90.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.4	178.2	-60	179.2	0	0	0	109.1	V224 S232 Q233 I235 V246 F250 L274 L307 L309	V224-I226 HydrophobicContact CG1-CG1 4.06Å; I226-S232 CarbonylContact O-C 3.52Å; I226-S232 VanDerWaalsContact O-CA 3.32Å; I226-S232 WeakPolarHBondContact O-CA 3.4Å; I226-Q233 PolarHBondContact N-O 2.9Å; I226-Q233 PolarHBondContact O-N 3.38Å; I226-I235 HydrophobicContact CD1-CD1 3.51Å; I226-I235 HydrophobicContact CD1-CG1 4.25Å; I226-I235 HydrophobicContact CG1-CD1 4.31Å; I226-V246 HydrophobicContact CD1-CG1 4.2Å; I226-F250 HydrophobicContact CB-CD2 3.95Å; I226-F250 HydrophobicContact CB-CE2 3.77Å; I226-F250 HydrophobicContact CD1-CB 4Å; I226-F250 HydrophobicContact CD1-CD2 3.68Å; I226-F250 HydrophobicContact CD1-CE2 4.37Å; I226-F250 HydrophobicContact CD1-CG 3.96Å; I226-F250 HydrophobicContact CG1-CD2 4.32Å; I226-F250 HydrophobicContact CG2-CD2 4.1Å; I226-F250 HydrophobicContact CG2-CE2 3.75Å; I226-F250 HydrophobicContact CG2-CZ 4.06Å; I226-L274 HydrophobicContact CD1-CD2 3.94Å; I226-L274 HydrophobicContact CG1-CD2 4.37Å; I226-L274 HydrophobicContact CG2-CD2 4.34Å; I226-L307 CarbonylContact C-O 3.39Å; I226-L307 WeakPolarHBondContact CA-O 3.39Å; I226-L309 HydrophobicContact CG2-CB 4.09Å
227	H	93.3	Very high	90.6	Very high	31 Å²	31	57.9 Å²	57.9	14%	0.144	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135	177.6	-63.6	-96.1	0	0	0	110.4	S231 S232 C277 H306 L307 V308 L309	H227-S231 CarbonylContact C-O 3.54Å; H227-S231 WeakPolarHBondContact CA-O 3.45Å; H227-S232 WeakPolarHBondContact ND1-CB 3.45Å; H227-C277 VanDerWaalsContact CD2-SG 3.53Å; H227-H306 AromaticContact NE2-CG 3.84Å; H227-H306 AromaticContact NE2-ND1 3.3Å; H227-H306 PolarHBondContact NE2-ND1 3.33Å; H227-L307 PolarHBondContact CD2-O 3.12Å; H227-L307 PolarHBondContact N-O 3.26Å; H227-V308 WeakPolarHBondContact O-CA 3.49Å; H227-L309 PolarHBondContact O-N 3.18Å
228	V	89	Confident	91	Very high	12 Å²	12	58.1 Å²	58.1	7%	0.073	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	107.4	173.4	-171.8	0	0	0	0	107.2	T230 S231 F250 L261 I263 L309	V228-T230 PolarHBondContact O-N 2.98Å; V228-S231 PolarHBondContact N-O 3.47Å; V228-S231 PolarHBondContact O-N 3.32Å; V228-F250 HydrophobicContact CG2-CE1 4.32Å; V228-F250 HydrophobicContact CG2-CZ 3.74Å; V228-L261 HydrophobicContact CG1-CB 4.49Å; V228-L261 VanDerWaalsContact CG1-O 3.28Å; V228-L261 WeakPolarHBondContact CG1-O 3.48Å; V228-I263 HydrophobicContact CG1-CD1 4.32Å; V228-I263 HydrophobicContact CG1-CG1 4.08Å; V228-L309 HydrophobicContact CG2-CB 4.02Å; V228-L309 HydrophobicContact CG2-CD2 3.96Å
229	S	80.4	Confident	91.4	Very high	116 Å²	116	52.6 Å²	52.6	81%	0.811	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	-109.2	-171.4	-58.6	0	0	0	0	112
230	T	78.8	Confident	91.8	Very high	143 Å²	143	50.2 Å²	50.2	88%	0.877	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-7.5	179	53.9	0	0	0	0	113.8	V228	V228-T230 PolarHBondContact O-N 2.98Å
231	S	85.5	Confident	92.1	Very high	46 Å²	46	50.8 Å²	50.8	32%	0.322	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	150.7	-179	-64.9	0	0	0	0	110.7	H227 V228	H227-S231 CarbonylContact C-O 3.54Å; H227-S231 WeakPolarHBondContact CA-O 3.45Å; V228-S231 PolarHBondContact N-O 3.47Å; V228-S231 PolarHBondContact O-N 3.32Å
232	S	90	Very high	92.3	Very high	69 Å²	69	46.6 Å²	46.6	48%	0.483	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.5	175.8	69.6	0	0	0	0	111.7	I226 H227	I226-S232 CarbonylContact O-C 3.52Å; I226-S232 VanDerWaalsContact O-CA 3.32Å; I226-S232 WeakPolarHBondContact O-CA 3.4Å; H227-S232 WeakPolarHBondContact ND1-CB 3.45Å
233	Q	90.9	Very high	92.4	Very high	48 Å²	48	46.2 Å²	46.2	22%	0.224	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	124.3	178.7	178.9	64.7	68.8	0	0	109.8	I226 I235 F250 T254	I226-Q233 PolarHBondContact N-O 2.9Å; I226-Q233 PolarHBondContact O-N 3.38Å; Q233-I235 HydrophobicContact CG-CG2 4.41Å; Q233-F250 HydrophobicContact CB-CE2 4.03Å; Q233-F250 HydrophobicContact CG-CE2 4.41Å; Q233-T254 HydrophobicContact CG-CG2 4.08Å
234	T	93.9	Very high	92.3	Very high	62 Å²	62	43.5 Å²	43.5	38%	0.38	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.7	173.7	-44.6	0	0	0	0	110.5	L223 V224 V225 K253	L223-T234 HydrophobicContact CB-CG2 4.35Å; L223-T234 HydrophobicContact CD2-CG2 4.46Å; V224-T234 WeakPolarHBondContact O-CA 3.39Å; V225-T234 HydrophobicContact CG2-CG2 4.17Å; T234-K253 PolarHBondContact O-NZ 3.4Å
235	I	93.9	Very high	92.3	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.7	175.1	61.9	170.2	0	0	0	110.1	V224 I226 Q233 V237 V246 F250 K253	V224-I235 HydrophobicContact CB-CG1 4.19Å; V224-I235 PolarHBondContact N-O 3.41Å; V224-I235 PolarHBondContact O-N 2.93Å; I226-I235 HydrophobicContact CD1-CD1 3.51Å; I226-I235 HydrophobicContact CD1-CG1 4.25Å; I226-I235 HydrophobicContact CG1-CD1 4.31Å; Q233-I235 HydrophobicContact CG-CG2 4.41Å; I235-V237 HydrophobicContact CB-CG1 4.48Å; I235-V237 HydrophobicContact CD1-CG1 3.6Å; I235-V237 HydrophobicContact CG1-CG1 3.92Å; I235-V246 HydrophobicContact CD1-CG1 3.81Å; I235-F250 HydrophobicContact CD1-CB 4.26Å; I235-F250 HydrophobicContact CG2-CD2 4.25Å; I235-K253 HydrophobicContact CG2-CD 3.87Å
236	K	94.5	Very high	92.3	Very high	127 Å²	127	47.6 Å²	47.6	55%	0.552	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.6	173	-178.8	-178	176.3	-177.2	0	106.6	Y221 L223	Y221-K236 HydrophobicContact CD1-CD 4.4Å; Y221-K236 HydrophobicContact CD1-CG 4.06Å; Y221-K236 HydrophobicContact CG-CD 4.41Å; Y221-K236 HydrophobicContact CG-CG 4.29Å; L223-K236 HydrophobicContact CD2-CB 3.93Å; L223-K236 HydrophobicContact CD2-CG 4.26Å
237	V	94.9	Very high	92.2	Very high	2 Å²	2	48 Å²	48	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.6	-175.1	-64.5	0	0	0	0	110.1	Y221 I222 V224 I235 V246 L289	Y221-V237 VanDerWaalsContact CA-O 3.29Å; Y221-V237 WeakPolarHBondContact CA-O 3.31Å; Y221-V237 WeakPolarHBondContact CD1-O 3.44Å; I222-V237 HydrophobicContact CD1-CG2 4.37Å; I222-V237 HydrophobicContact CG1-CG2 3.75Å; I222-V237 PolarHBondContact N-O 3.39Å; I222-V237 PolarHBondContact O-N 3.18Å; V224-V237 HydrophobicContact CB-CG2 4.42Å; V224-V237 HydrophobicContact CG2-CG2 3.67Å; I235-V237 HydrophobicContact CB-CG1 4.48Å; I235-V237 HydrophobicContact CD1-CG1 3.6Å; I235-V237 HydrophobicContact CG1-CG1 3.92Å; V237-V246 HydrophobicContact CB-CG2 4.43Å; V237-V246 HydrophobicContact CG1-CG1 4.26Å; V237-V246 HydrophobicContact CG1-CG2 4.29Å; V237-L289 HydrophobicContact CG2-CD1 3.71Å
238	S	95.4	Very high	92.2	Very high	23 Å²	23	48.5 Å²	48.5	16%	0.161	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	145.3	171.5	-173.2	0	0	0	0	108.9	D240 D241	S238-D240 PolarHBondContact O-N 3.42Å; S238-D240 PolarHBondContact OG-N 2.78Å; S238-D241 VanDerWaalsContact CB-CG 3.5Å; S238-D241 WeakPolarHBondContact CB-OD1 3.47Å; S238-D241 WeakPolarHBondContact CB-OD2 3.44Å; S238-D241 PolarHBondContact N-OD2 3.01Å; S238-D241 WeakPolarHBondContact O-CB 3.08Å; S238-D241 PolarHBondContact O-N 2.89Å
239	I	93.7	Very high	92.3	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.031	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17	174.9	-150.3	-175.8	0	0	0	112.5	L209 V217 G220 I222 L289 Q290 L299	L209-I239 HydrophobicContact CD2-CD1 3.79Å; V217-I239 HydrophobicContact CG1-CD1 4.41Å; V217-I239 HydrophobicContact CG2-CD1 3.79Å; G220-I239 PolarHBondContact O-N 3.4Å; I222-I239 HydrophobicContact CD1-CG1 4.38Å; I222-I239 HydrophobicContact CG2-CD1 4.4Å; I222-I239 HydrophobicContact CG2-CG1 4.29Å; I239-L289 PolarHBondContact O-N 3.32Å; I239-Q290 HydrophobicContact CD1-CB 3.77Å; I239-Q290 HydrophobicContact CG1-CB 3.78Å; I239-Q290 PolarHBondContact O-N 3Å; I239-L299 HydrophobicContact CD1-CD1 3.98Å
240	D	95	Very high	92.9	Very high	93 Å²	93	44.8 Å²	44.8	50%	0.497	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.6	175	-63.1	-53.5	0	0	0	113.3	S238 Q290	S238-D240 PolarHBondContact O-N 3.42Å; S238-D240 PolarHBondContact OG-N 2.78Å; D240-Q290 PolarHBondContact OD1-NE2 3.36Å
241	D	96.4	Very high	93.4	Very high	40 Å²	40	38.1 Å²	38.1	21%	0.214	22%	0.221	C	C	.	.			trans	-65.1	145.5	179.3	-70.2	-22.9	0	0	0	110.6	S238 Q245 V246 A288 L289	S238-D241 VanDerWaalsContact CB-CG 3.5Å; S238-D241 WeakPolarHBondContact CB-OD1 3.47Å; S238-D241 WeakPolarHBondContact CB-OD2 3.44Å; S238-D241 PolarHBondContact N-OD2 3.01Å; S238-D241 WeakPolarHBondContact O-CB 3.08Å; S238-D241 PolarHBondContact O-N 2.89Å; D241-Q245 VanDerWaalsContact CA-OE1 3.28Å; D241-Q245 HydrophobicContact CB-CB 4.21Å; D241-V246 HydrophobicContact CB-CG2 4.03Å; D241-A288 CarbonylContact O-C 3.57Å; D241-A288 WeakPolarHBondContact O-CA 3.33Å; D241-L289 WeakPolarHBondContact O-CG 3.47Å; D241-L289 PolarHBondContact O-N 3.35Å
242	T	96.8	Very high	93.5	Very high	19 Å²	19	39.6 Å²	39.6	12%	0.117	24%	0.236	C	C	.	.			trans	-83.2	158.1	169	67.8	0	0	0	0	110.9	S244 Q245 V246	T242-S244 PolarHBondContact O-N 2.84Å; T242-S244 VanDerWaalsContact O-N 3.16Å; T242-Q245 WeakPolarHBondContact O-CB 3.24Å; T242-Q245 PolarHBondContact O-N 2.72Å; T242-Q245 WeakPolarHBondContact OG1-CG 3.37Å; T242-Q245 PolarHBondContact OG1-N 3.3Å; T242-V246 WeakPolarHBondContact O-CG2 3.5Å; T242-V246 PolarHBondContact O-N 3.18Å
243	P	95.9	Very high	93.4	Very high	3 Å²	3	42 Å²	42	2%	0.019	24%	0.238	C	C	.	.	H	α-helix	trans	-50.2	-39.7	174.7	-29.1	33.8	0	0	0	113.7	Q245 V246 L247 L283 G285 K287 F292	P243-Q245 PolarHBondContact O-N 3.12Å; P243-V246 WeakPolarHBondContact O-CB 3.39Å; P243-V246 PolarHBondContact O-N 2.84Å; P243-L247 WeakPolarHBondContact O-CG 3.4Å; P243-L247 PolarHBondContact O-N 3.5Å; P243-L283 HydrophobicContact CB-CB 4.43Å; P243-L283 VanDerWaalsContact CB-O 3.31Å; P243-L283 WeakPolarHBondContact CB-O 3.4Å; P243-L283 HydrophobicContact CG-CB 4.13Å; P243-G285 WeakPolarHBondContact CD-O 3.35Å; P243-K287 WeakPolarHBondContact CD-O 3.35Å; P243-F292 HydrophobicContact CG-CE2 3.96Å; P243-F292 HydrophobicContact CG-CZ 3.81Å
244	S	94.4	Very high	93.1	Very high	57 Å²	57	39.7 Å²	39.7	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-63.3	-40.6	176.6	-45.6	0	0	0	0	112.2	T242 L247 A248	T242-S244 PolarHBondContact O-N 2.84Å; T242-S244 VanDerWaalsContact O-N 3.16Å; S244-L247 PolarHBondContact O-N 3.25Å; S244-A248 WeakPolarHBondContact O-CB 3.28Å; S244-A248 PolarHBondContact O-N 3.45Å
245	Q	95.1	Very high	92.4	Very high	99 Å²	99	39 Å²	39	46%	0.463	23%	0.227	S	C	.	.	H	α-helix	trans	-68	-36.4	175.5	-68.9	169.4	-26.2	0	0	112	D241 T242 P243 A248 S249	D241-Q245 VanDerWaalsContact CA-OE1 3.28Å; D241-Q245 HydrophobicContact CB-CB 4.21Å; T242-Q245 WeakPolarHBondContact O-CB 3.24Å; T242-Q245 PolarHBondContact O-N 2.72Å; T242-Q245 WeakPolarHBondContact OG1-CG 3.37Å; T242-Q245 PolarHBondContact OG1-N 3.3Å; P243-Q245 PolarHBondContact O-N 3.12Å; Q245-A248 PolarHBondContact O-N 3.32Å; Q245-S249 WeakPolarHBondContact O-CB 3.45Å; Q245-S249 PolarHBondContact O-N 3.12Å
246	V	95.1	Very high	91.7	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-44.8	174.2	175.7	0	0	0	0	110.7	I226 I235 V237 D241 T242 P243 S249 F250 L274 L289	I226-V246 HydrophobicContact CD1-CG1 4.2Å; I235-V246 HydrophobicContact CD1-CG1 3.81Å; V237-V246 HydrophobicContact CB-CG2 4.43Å; V237-V246 HydrophobicContact CG1-CG1 4.26Å; V237-V246 HydrophobicContact CG1-CG2 4.29Å; D241-V246 HydrophobicContact CB-CG2 4.03Å; T242-V246 WeakPolarHBondContact O-CG2 3.5Å; T242-V246 PolarHBondContact O-N 3.18Å; P243-V246 WeakPolarHBondContact O-CB 3.39Å; P243-V246 PolarHBondContact O-N 2.84Å; V246-S249 PolarHBondContact O-N 2.83Å; V246-F250 WeakPolarHBondContact O-CB 3.47Å; V246-F250 PolarHBondContact O-N 3.23Å; V246-L274 HydrophobicContact CB-CD1 4.07Å; V246-L274 HydrophobicContact CG1-CD1 3.65Å; V246-L289 HydrophobicContact CG2-CD1 3.74Å; V246-L289 HydrophobicContact CG2-CD2 4.21Å; V246-L289 HydrophobicContact CG2-CG 4.12Å
247	L	94.3	Very high	90.9	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-51	174.6	-72.8	169.4	0	0	0	110.9	P243 S244 S249 F250 F251 D269 F272 L274 L309	P243-L247 WeakPolarHBondContact O-CG 3.4Å; P243-L247 PolarHBondContact O-N 3.5Å; S244-L247 PolarHBondContact O-N 3.25Å; L247-S249 VanDerWaalsContact C-N 3.3Å; L247-S249 PolarHBondContact O-N 3.17Å; L247-F250 WeakPolarHBondContact O-CA 3.22Å; L247-F250 WeakPolarHBondContact O-CB 3.16Å; L247-F250 PolarHBondContact O-N 3.02Å; L247-F251 VanDerWaalsContact O-CD2 3.31Å; L247-F251 WeakPolarHBondContact O-CD2 3.3Å; L247-F251 PolarHBondContact O-N 2.75Å; L247-D269 HydrophobicContact CB-CB 4.3Å; L247-F272 WeakPolarHBondContact CD1-O 3.38Å; L247-L274 HydrophobicContact CD2-CD1 4.33Å; L247-L274 HydrophobicContact CD2-CD2 3.73Å; L247-L274 HydrophobicContact CD2-CG 3.78Å; L247-L274 HydrophobicContact CG-CD1 4.23Å; L247-L274 HydrophobicContact CG-CG 4.07Å; L247-L309 HydrophobicContact CD2-CD1 3.31Å
248	A	92.3	Very high	89.9	Confident	40 Å²	40	48.9 Å²	48.9	33%	0.331	28%	0.276	S	S	.	.	H	α-helix	trans	-55.9	-44.1	177.5	0	0	0	0	0	112.3	S244 Q245 F251 A252	S244-A248 WeakPolarHBondContact O-CB 3.28Å; S244-A248 PolarHBondContact O-N 3.45Å; Q245-A248 PolarHBondContact O-N 3.32Å; A248-F251 PolarHBondContact O-N 3.45Å; A248-A252 VanDerWaalsContact O-CB 3.32Å; A248-A252 WeakPolarHBondContact O-CB 3.38Å; A248-A252 PolarHBondContact O-N 2.96Å
249	S	91.7	Very high	88.7	Confident	50 Å²	50	53 Å²	53	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-42.6	175.7	-176.8	0	0	0	0	112.3	Q245 V246 L247 A252 K253	Q245-S249 WeakPolarHBondContact O-CB 3.45Å; Q245-S249 PolarHBondContact O-N 3.12Å; V246-S249 PolarHBondContact O-N 2.83Å; L247-S249 VanDerWaalsContact C-N 3.3Å; L247-S249 PolarHBondContact O-N 3.17Å; S249-A252 PolarHBondContact O-N 3.26Å; S249-K253 WeakPolarHBondContact O-CB 3.26Å; S249-K253 PolarHBondContact O-N 2.9Å
250	F	91.9	Very high	87.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-48.6	175	174.8	-96.5	0	0	0	111.8	I226 V228 Q233 I235 V246 L247 K253 T254 L261 I263 L309	I226-F250 HydrophobicContact CB-CD2 3.95Å; I226-F250 HydrophobicContact CB-CE2 3.77Å; I226-F250 HydrophobicContact CD1-CB 4Å; I226-F250 HydrophobicContact CD1-CD2 3.68Å; I226-F250 HydrophobicContact CD1-CE2 4.37Å; I226-F250 HydrophobicContact CD1-CG 3.96Å; I226-F250 HydrophobicContact CG1-CD2 4.32Å; I226-F250 HydrophobicContact CG2-CD2 4.1Å; I226-F250 HydrophobicContact CG2-CE2 3.75Å; I226-F250 HydrophobicContact CG2-CZ 4.06Å; V228-F250 HydrophobicContact CG2-CE1 4.32Å; V228-F250 HydrophobicContact CG2-CZ 3.74Å; Q233-F250 HydrophobicContact CB-CE2 4.03Å; Q233-F250 HydrophobicContact CG-CE2 4.41Å; I235-F250 HydrophobicContact CD1-CB 4.26Å; I235-F250 HydrophobicContact CG2-CD2 4.25Å; V246-F250 WeakPolarHBondContact O-CB 3.47Å; V246-F250 PolarHBondContact O-N 3.23Å; L247-F250 WeakPolarHBondContact O-CA 3.22Å; L247-F250 WeakPolarHBondContact O-CB 3.16Å; L247-F250 PolarHBondContact O-N 3.02Å; F250-K253 PolarHBondContact O-N 3.39Å; F250-T254 HydrophobicContact CD2-CG2 4.25Å; F250-T254 HydrophobicContact CE1-CG2 4.37Å; F250-T254 HydrophobicContact CE2-CG2 3.94Å; F250-T254 HydrophobicContact CZ-CG2 3.99Å; F250-T254 WeakPolarHBondContact O-CB 3.5Å; F250-T254 WeakPolarHBondContact O-CG2 3.2Å; F250-T254 PolarHBondContact O-N 2.9Å; F250-T254 PolarHBondContact O-OG1 3.11Å; F250-L261 HydrophobicContact CZ-CD1 4.41Å; F250-I263 HydrophobicContact CE1-CD1 4.35Å; F250-L309 HydrophobicContact CE1-CD2 3.92Å
251	F	89.8	Confident	86.4	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-68.5	-33.4	-179.1	-87	-83.9	0	0	0	113	L247 A248 A255 I263 D269 F272 L309	L247-F251 VanDerWaalsContact O-CD2 3.31Å; L247-F251 WeakPolarHBondContact O-CD2 3.3Å; L247-F251 PolarHBondContact O-N 2.75Å; A248-F251 PolarHBondContact O-N 3.45Å; F251-A255 PolarHBondContact O-N 3.27Å; F251-I263 HydrophobicContact CE1-CD1 4.21Å; F251-I263 HydrophobicContact CE1-CG2 4.14Å; F251-I263 HydrophobicContact CZ-CD1 4.4Å; F251-D269 HydrophobicContact CB-CB 4.49Å; F251-D269 HydrophobicContact CD2-CB 3.47Å; F251-D269 VanDerWaalsContact CD2-CB 3.47Å; F251-D269 HydrophobicContact CE2-CB 3.81Å; F251-D269 HydrophobicContact CG-CB 4.05Å; F251-F272 HydrophobicContact CE2-CD2 4.2Å; F251-F272 AromaticContact CZ-CD2 3.66Å; F251-F272 HydrophobicContact CZ-CD2 3.66Å; F251-F272 AromaticContact CZ-CE2 3.84Å; F251-F272 HydrophobicContact CZ-CE2 3.84Å; F251-F272 HydrophobicContact CZ-CG 4.47Å; F251-L309 HydrophobicContact CE2-CD1 4.49Å; F251-L309 HydrophobicContact CE2-CD2 4.36Å; F251-L309 HydrophobicContact CZ-CD2 4.21Å
252	A	88.4	Confident	85.2	Confident	77 Å²	77	57.3 Å²	57.3	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-65.3	-44.1	172.3	0	0	0	0	0	111.2	A248 S249 T254	A248-A252 VanDerWaalsContact O-CB 3.32Å; A248-A252 WeakPolarHBondContact O-CB 3.38Å; A248-A252 PolarHBondContact O-N 2.96Å; S249-A252 PolarHBondContact O-N 3.26Å; A252-T254 VanDerWaalsContact C-N 3.34Å; A252-T254 PolarHBondContact O-N 3.32Å
253	K	86.5	Confident	84.3	Confident	119 Å²	119	56.7 Å²	56.7	52%	0.517	33%	0.333	S	S	.	.	H	α-helix	trans	-70.7	-29.1	179.3	-165.2	-178.5	-176.6	177.9	0	113	T234 I235 S249 F250	T234-K253 PolarHBondContact O-NZ 3.4Å; I235-K253 HydrophobicContact CG2-CD 3.87Å; S249-K253 WeakPolarHBondContact O-CB 3.26Å; S249-K253 PolarHBondContact O-N 2.9Å; F250-K253 PolarHBondContact O-N 3.39Å
254	T	84.3	Confident	83.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-103	6.9	-176.3	59.4	0	0	0	0	114.1	Q233 F250 A252 N256 K257 R258 L261	Q233-T254 HydrophobicContact CG-CG2 4.08Å; F250-T254 HydrophobicContact CD2-CG2 4.25Å; F250-T254 HydrophobicContact CE1-CG2 4.37Å; F250-T254 HydrophobicContact CE2-CG2 3.94Å; F250-T254 HydrophobicContact CZ-CG2 3.99Å; F250-T254 WeakPolarHBondContact O-CB 3.5Å; F250-T254 WeakPolarHBondContact O-CG2 3.2Å; F250-T254 PolarHBondContact O-N 2.9Å; F250-T254 PolarHBondContact O-OG1 3.11Å; A252-T254 VanDerWaalsContact C-N 3.34Å; A252-T254 PolarHBondContact O-N 3.32Å; T254-N256 VanDerWaalsContact C-N 3.3Å; T254-N256 PolarHBondContact O-N 3.4Å; T254-N256 VanDerWaalsContact O-N 3.16Å; T254-K257 CarbonylContact O-C 3.49Å; T254-K257 WeakPolarHBondContact O-CA 3.46Å; T254-K257 PolarHBondContact O-N 3.12Å; T254-R258 PolarHBondContact O-N 2.76Å; T254-R258 VanDerWaalsContact O-N 3.17Å; T254-L261 HydrophobicContact CG2-CD1 3.81Å
255	A	80.1	Confident	82.3	Confident	46 Å²	46	64.1 Å²	64.1	38%	0.38	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-49.2	-45.7	-177	0	0	0	0	0	113.8	F251 K257	F251-A255 PolarHBondContact O-N 3.27Å; A255-K257 VanDerWaalsContact C-N 3.25Å; A255-K257 PolarHBondContact O-N 3.19Å
256	N	78.5	Confident	81.4	Confident	163 Å²	163	66.7 Å²	66.7	87%	0.872	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-79.2	-2.7	-179.9	-62.1	-24.6	0	0	0	114.2	T254	T254-N256 VanDerWaalsContact C-N 3.3Å; T254-N256 PolarHBondContact O-N 3.4Å; T254-N256 VanDerWaalsContact O-N 3.16Å
257	K	77.6	Confident	80.7	Confident	109 Å²	109	68.7 Å²	68.7	47%	0.474	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-121.6	6.5	-175.8	-62.5	-176	-177.4	179.8	0	113.2	T254 A255 V259 L260 L261	T254-K257 CarbonylContact O-C 3.49Å; T254-K257 WeakPolarHBondContact O-CA 3.46Å; T254-K257 PolarHBondContact O-N 3.12Å; A255-K257 VanDerWaalsContact C-N 3.25Å; A255-K257 PolarHBondContact O-N 3.19Å; K257-V259 VanDerWaalsContact C-N 3.35Å; K257-V259 PolarHBondContact O-N 2.96Å; K257-L260 WeakPolarHBondContact O-CA 3.46Å; K257-L260 WeakPolarHBondContact O-CB 3.28Å; K257-L260 PolarHBondContact O-N 2.71Å; K257-L261 HydrophobicContact CB-CD1 4.4Å; K257-L261 WeakPolarHBondContact O-CG 3.48Å; K257-L261 PolarHBondContact O-N 3.1Å
258	R	75.4	Confident	80.2	Confident	67 Å²	67	70.2 Å²	70.2	25%	0.253	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-46.6	-176	-69.9	-176.5	179.6	-160.9	1.5	113	T254 L260 L261 G262 I263	T254-R258 PolarHBondContact O-N 2.76Å; T254-R258 VanDerWaalsContact O-N 3.17Å; R258-L260 VanDerWaalsContact C-N 3.31Å; R258-L260 PolarHBondContact O-N 3.37Å; R258-L261 CarbonylContact O-C 3.59Å; R258-L261 PolarHBondContact O-N 3.02Å; R258-L261 VanDerWaalsContact O-N 3.14Å; R258-G262 PolarHBondContact O-N 2.87Å; R258-I263 PolarHBondContact O-N 2.89Å
259	V	69.4	Low	79.7	Confident	111 Å²	111	71 Å²	71	67%	0.673	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-38.3	177	-178.7	0	0	0	0	111.9	K257 L261 G262	K257-V259 VanDerWaalsContact C-N 3.35Å; K257-V259 PolarHBondContact O-N 2.96Å; V259-L261 VanDerWaalsContact C-N 3.34Å; V259-G262 PolarHBondContact O-N 2.65Å
260	L	69.3	Low	79.4	Confident	145 Å²	145	76.8 Å²	76.8	76%	0.759	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-29.3	176.8	-87.5	143.4	0	0	0	113	K257 R258 G262	K257-L260 WeakPolarHBondContact O-CA 3.46Å; K257-L260 WeakPolarHBondContact O-CB 3.28Å; K257-L260 PolarHBondContact O-N 2.71Å; R258-L260 VanDerWaalsContact C-N 3.31Å; R258-L260 PolarHBondContact O-N 3.37Å; L260-G262 VanDerWaalsContact C-N 3.28Å
261	L	71.5	Confident	79.2	Confident	21 Å²	21	80.1 Å²	80.1	11%	0.11	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-1.6	176	-67	170.2	0	0	0	112.7	V228 F250 T254 K257 R258 V259 I263	V228-L261 HydrophobicContact CG1-CB 4.49Å; V228-L261 VanDerWaalsContact CG1-O 3.28Å; V228-L261 WeakPolarHBondContact CG1-O 3.48Å; F250-L261 HydrophobicContact CZ-CD1 4.41Å; T254-L261 HydrophobicContact CG2-CD1 3.81Å; K257-L261 HydrophobicContact CB-CD1 4.4Å; K257-L261 WeakPolarHBondContact O-CG 3.48Å; K257-L261 PolarHBondContact O-N 3.1Å; R258-L261 CarbonylContact O-C 3.59Å; R258-L261 PolarHBondContact O-N 3.02Å; R258-L261 VanDerWaalsContact O-N 3.14Å; V259-L261 VanDerWaalsContact C-N 3.34Å; L261-I263 VanDerWaalsContact C-N 3.31Å; L261-I263 HydrophobicContact CB-CD1 4.3Å; L261-I263 HydrophobicContact CB-CG1 4.24Å
262	G	71.2	Confident	79.3	Confident	62 Å²	62	81.2 Å²	81.2	64%	0.639	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	19.2	-179.1	0	0	0	0	0	114.2	R258 V259 L260 P264	R258-G262 PolarHBondContact O-N 2.87Å; V259-G262 PolarHBondContact O-N 2.65Å; L260-G262 VanDerWaalsContact C-N 3.28Å; G262-P264 WeakPolarHBondContact O-CD 3.4Å
263	I	78.6	Confident	79.7	Confident	7 Å²	7	77.7 Å²	77.7	4%	0.036	41%	0.412	C	S	.	.			trans	-90.8	119.4	178.1	-55.7	175.3	0	0	0	109.1	V228 F250 F251 R258 L261 F272 L309	V228-I263 HydrophobicContact CG1-CD1 4.32Å; V228-I263 HydrophobicContact CG1-CG1 4.08Å; F250-I263 HydrophobicContact CE1-CD1 4.35Å; F251-I263 HydrophobicContact CE1-CD1 4.21Å; F251-I263 HydrophobicContact CE1-CG2 4.14Å; F251-I263 HydrophobicContact CZ-CD1 4.4Å; R258-I263 PolarHBondContact O-N 2.89Å; L261-I263 VanDerWaalsContact C-N 3.31Å; L261-I263 HydrophobicContact CB-CD1 4.3Å; L261-I263 HydrophobicContact CB-CG1 4.24Å; I263-F272 HydrophobicContact CG2-CE2 4.26Å; I263-F272 HydrophobicContact CG2-CZ 4.09Å; I263-L309 HydrophobicContact CD1-CD2 3.92Å
264	P	76.4	Confident	80.2	Confident	55 Å²	55	72 Å²	72	36%	0.357	39%	0.388	S	S	.	.			trans	-59.3	141.4	176.1	-22.3	31.5	0	0	0	113.2	G262 H266 L267	G262-P264 WeakPolarHBondContact O-CD 3.4Å; P264-H266 WeakPolarHBondContact CB-CE1 3.44Å; P264-H266 VanDerWaalsContact CB-ND1 3.34Å; P264-H266 WeakPolarHBondContact CB-ND1 3.5Å; P264-H266 PolarHBondContact O-N 3.01Å; P264-L267 HydrophobicContact CB-CD1 4.3Å; P264-L267 HydrophobicContact CB-CG 4.34Å; P264-L267 HydrophobicContact CG-CD1 3.96Å; P264-L267 PolarHBondContact O-N 3.47Å
265	E	72.1	Confident	80.7	Confident	161 Å²	161	72.5 Å²	72.5	75%	0.752	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-20	-178.1	-69.8	-173.9	167	0	0	114.5
266	H	75.9	Confident	81.5	Confident	153 Å²	153	70.4 Å²	70.4	71%	0.708	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-12.7	-179.8	65.9	-88.8	0	0	0	113.8	P264	P264-H266 WeakPolarHBondContact CB-CE1 3.44Å; P264-H266 VanDerWaalsContact CB-ND1 3.34Å; P264-H266 WeakPolarHBondContact CB-ND1 3.5Å; P264-H266 PolarHBondContact O-N 3.01Å
267	L	80.6	Confident	82.3	Confident	43 Å²	43	63.4 Å²	63.4	23%	0.225	34%	0.335	C	S	.	.			trans	-92.6	138.3	-179.8	-61.9	177.2	0	0	0	110.7	P264 D271 F272	P264-L267 HydrophobicContact CB-CD1 4.3Å; P264-L267 HydrophobicContact CB-CG 4.34Å; P264-L267 HydrophobicContact CG-CD1 3.96Å; P264-L267 PolarHBondContact O-N 3.47Å; L267-D271 HydrophobicContact CB-CB 4.5Å; L267-D271 HydrophobicContact CD2-CB 4.24Å; L267-F272 HydrophobicContact CB-CE2 3.84Å; L267-F272 HydrophobicContact CB-CZ 4.23Å; L267-F272 HydrophobicContact CD1-CE2 4.21Å; L267-F272 HydrophobicContact CD1-CZ 3.77Å
268	S	82.3	Confident	83	Confident	42 Å²	42	58.4 Å²	58.4	29%	0.294	32%	0.315	S	S	.	.			trans	-96.1	176.6	177.4	69.8	0	0	0	0	111.1	E270 D271 F272	S268-E270 VanDerWaalsContact C-N 3.26Å; S268-E270 PolarHBondContact OG-N 2.73Å; S268-D271 PolarHBondContact N-OD2 2.72Å; S268-D271 PolarHBondContact OG-OD2 2.9Å; S268-F272 WeakPolarHBondContact O-CD2 3.26Å; S268-F272 WeakPolarHBondContact O-CE2 3.09Å
269	D	82.4	Confident	83.8	Confident	55 Å²	55	56.2 Å²	56.2	29%	0.294	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-67.8	-24.4	171.1	51.5	-39.8	0	0	0	113.2	L247 F251 D271	L247-D269 HydrophobicContact CB-CB 4.3Å; F251-D269 HydrophobicContact CB-CB 4.49Å; F251-D269 HydrophobicContact CD2-CB 3.47Å; F251-D269 VanDerWaalsContact CD2-CB 3.47Å; F251-D269 HydrophobicContact CE2-CB 3.81Å; F251-D269 HydrophobicContact CG-CB 4.05Å; D269-D271 VanDerWaalsContact C-N 3.26Å; D269-D271 PolarHBondContact O-N 2.86Å
270	E	84.6	Confident	85	Confident	172 Å²	172	53.4 Å²	53.4	80%	0.804	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-71.6	-18.9	177.7	-59.7	-175.4	170.9	0	0	113.2	S268 F272	S268-E270 VanDerWaalsContact C-N 3.26Å; S268-E270 PolarHBondContact OG-N 2.73Å; E270-F272 VanDerWaalsContact C-N 3.26Å; E270-F272 PolarHBondContact O-N 3.03Å
271	D	88.9	Confident	86.2	Confident	70 Å²	70	47.2 Å²	47.2	37%	0.374	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-82.3	-2.6	-178.7	-61.3	-62.2	0	0	0	113.4	L267 S268 D269 P312	L267-D271 HydrophobicContact CB-CB 4.5Å; L267-D271 HydrophobicContact CD2-CB 4.24Å; S268-D271 PolarHBondContact N-OD2 2.72Å; S268-D271 PolarHBondContact OG-OD2 2.9Å; D269-D271 VanDerWaalsContact C-N 3.26Å; D269-D271 PolarHBondContact O-N 2.86Å; D271-P312 WeakPolarHBondContact O-CD 3.39Å
272	F	92.4	Very high	87.4	Confident	28 Å²	28	47.9 Å²	47.9	12%	0.123	25%	0.254	C	S	.	.			trans	-124.3	157.1	-174.8	-64.6	-86.9	0	0	0	112.6	L247 F251 I263 L267 S268 E270 L309 E310	L247-F272 WeakPolarHBondContact CD1-O 3.38Å; F251-F272 HydrophobicContact CE2-CD2 4.2Å; F251-F272 AromaticContact CZ-CD2 3.66Å; F251-F272 HydrophobicContact CZ-CD2 3.66Å; F251-F272 AromaticContact CZ-CE2 3.84Å; F251-F272 HydrophobicContact CZ-CE2 3.84Å; F251-F272 HydrophobicContact CZ-CG 4.47Å; I263-F272 HydrophobicContact CG2-CE2 4.26Å; I263-F272 HydrophobicContact CG2-CZ 4.09Å; L267-F272 HydrophobicContact CB-CE2 3.84Å; L267-F272 HydrophobicContact CB-CZ 4.23Å; L267-F272 HydrophobicContact CD1-CE2 4.21Å; L267-F272 HydrophobicContact CD1-CZ 3.77Å; S268-F272 WeakPolarHBondContact O-CD2 3.26Å; S268-F272 WeakPolarHBondContact O-CE2 3.09Å; E270-F272 VanDerWaalsContact C-N 3.26Å; E270-F272 PolarHBondContact O-N 3.03Å; F272-L309 HydrophobicContact CB-CD1 3.57Å; F272-L309 HydrophobicContact CB-CG 4.03Å; F272-L309 HydrophobicContact CD1-CD1 4.3Å; F272-L309 HydrophobicContact CD1-CD2 4.13Å; F272-L309 HydrophobicContact CD1-CG 3.77Å; F272-L309 HydrophobicContact CE1-CD2 4.45Å; F272-L309 HydrophobicContact CE1-CG 4.48Å; F272-L309 HydrophobicContact CG-CD1 4.04Å; F272-L309 HydrophobicContact CG-CD2 4.27Å; F272-L309 HydrophobicContact CG-CG 3.99Å; F272-E310 CarbonylContact C-O 3.51Å; F272-E310 WeakPolarHBondContact CA-O 3.25Å
273	V	95.3	Very high	88.6	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.4	170.1	67.4	0	0	0	0	110.2	M200 Y282 Y284 E310 P312	M200-V273 HydrophobicContact SD-CB 4.29Å; M200-V273 HydrophobicContact SD-CG1 4.47Å; M200-V273 HydrophobicContact SD-CG2 3.77Å; V273-Y282 HydrophobicContact CG1-CD1 3.86Å; V273-Y282 HydrophobicContact CG1-CE1 4.12Å; V273-Y282 HydrophobicContact CG2-CD1 4.14Å; V273-Y284 HydrophobicContact CG2-CD2 4.31Å; V273-E310 PolarHBondContact N-O 3.04Å; V273-E310 PolarHBondContact O-N 3.01Å; V273-E310 VanDerWaalsContact O-N 3.09Å; V273-P312 HydrophobicContact CB-CG 4.18Å; V273-P312 HydrophobicContact CG1-CB 4.34Å; V273-P312 HydrophobicContact CG1-CG 4.24Å
274	L	96.6	Very high	89.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	122.9	171	-64.5	173.3	0	0	0	109.5	I226 V246 L247 L283 L307 L309	I226-L274 HydrophobicContact CD1-CD2 3.94Å; I226-L274 HydrophobicContact CG1-CD2 4.37Å; I226-L274 HydrophobicContact CG2-CD2 4.34Å; V246-L274 HydrophobicContact CB-CD1 4.07Å; V246-L274 HydrophobicContact CG1-CD1 3.65Å; L247-L274 HydrophobicContact CD2-CD1 4.33Å; L247-L274 HydrophobicContact CD2-CD2 3.73Å; L247-L274 HydrophobicContact CD2-CG 3.78Å; L247-L274 HydrophobicContact CG-CD1 4.23Å; L247-L274 HydrophobicContact CG-CG 4.07Å; L274-L283 HydrophobicContact CB-CB 4.08Å; L274-L283 PolarHBondContact O-N 3.07Å; L274-L307 HydrophobicContact CB-CD1 4.22Å; L274-L307 HydrophobicContact CD1-CD1 4.06Å; L274-L307 HydrophobicContact CD2-CB 4.49Å; L274-L307 HydrophobicContact CD2-CD1 4.47Å; L274-L307 HydrophobicContact CG-CD1 4.48Å; L274-L309 HydrophobicContact CD2-CD1 4.19Å
275	R	96.4	Very high	90	Very high	11 Å²	11	46.5 Å²	46.5	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	148.9	173.2	-171.5	-179.2	61.9	83.5	-9.4	110.1	R279 E281 Y282 L307 V308 E310 D837 T839	R275-R279 WeakPolarHBondContact CG-O 3.45Å; R275-R279 PolarHBondContact NH1-O 3.32Å; R275-E281 CarbonylContact C-O 3.59Å; R275-E281 WeakPolarHBondContact CA-O 3.37Å; R275-E281 VanDerWaalsContact CG-O 3.31Å; R275-E281 WeakPolarHBondContact CG-O 3.45Å; R275-Y282 HydrophobicContact CB-CD1 3.92Å; R275-Y282 HydrophobicContact CB-CE1 4.03Å; R275-Y282 HydrophobicContact CG-CD1 3.96Å; R275-Y282 HydrophobicContact CG-CE1 3.89Å; R275-Y282 HydrophobicContact CG-CG 4.37Å; R275-L307 CarbonylContact O-C 3.58Å; R275-L307 VanDerWaalsContact O-CA 3.26Å; R275-L307 WeakPolarHBondContact O-CA 3.23Å; R275-V308 HydrophobicContact CB-CG1 3.84Å; R275-V308 PolarHBondContact N-O 3.48Å; R275-V308 PolarHBondContact O-N 3.41Å; R275-E310 IonicContact CZ-OE1 3.37Å; R275-E310 IonicContact CZ-OE2 2.77Å; R275-E310 IonicContact NE-OE1 3.63Å; R275-E310 IonicContact NE-OE2 3.42Å; R275-E310 PolarHBondContact NE-OE2 3.43Å; R275-E310 IonicContact NH2-OE1 3.11Å; R275-E310 PolarHBondContact NH2-OE1 3.28Å; R275-E310 IonicContact NH2-OE2 3.71Å; R275-E310 PolarHBondContact NH2-OE2 2.91Å; R275-D837 IonicContact CZ-OD2 3.37Å; R275-D837 IonicContact NH1-OD2 2.73Å; R275-D837 PolarHBondContact NH1-OD2 3.48Å; R275-D837 IonicContact NH2-OD1 2.69Å; R275-D837 IonicContact NH2-OD2 3.48Å; R275-D837 PolarHBondContact NH2-OD2 3.04Å; R275-T839 PolarHBondContact NH2-OG1 3.26Å
276	V	96.2	Very high	90.9	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	133.2	175.4	175.5	0	0	0	0	110.5	G278 R279 E281 L283 W294 L307	V276-G278 PolarHBondContact O-N 2.77Å; V276-R279 HydrophobicContact CB-CB 4.15Å; V276-R279 HydrophobicContact CG1-CB 3.98Å; V276-R279 HydrophobicContact CG1-CG 4.22Å; V276-R279 PolarHBondContact O-N 2.92Å; V276-E281 HydrophobicContact CB-CB 4.25Å; V276-E281 HydrophobicContact CG2-CB 4.02Å; V276-E281 PolarHBondContact N-O 2.68Å; V276-L283 HydrophobicContact CG2-CD1 3.81Å; V276-W294 HydrophobicContact CG1-CD2 3.84Å; V276-W294 HydrophobicContact CG1-CG 4.16Å; V276-W294 HydrophobicContact CG1-CH2 4.46Å; V276-W294 HydrophobicContact CG1-CZ2 3.66Å; V276-W294 VanDerWaalsContact CG1-NE1 3.31Å; V276-W294 HydrophobicContact CG2-CB 4.23Å; V276-W294 VanDerWaalsContact CG2-CD1 3.42Å; V276-W294 HydrophobicContact CG2-CD2 4.18Å; V276-W294 HydrophobicContact CG2-CG 3.66Å; V276-L307 HydrophobicContact CG2-CD2 4.17Å
277	C	94.6	Very high	91.8	Very high	16 Å²	16	42.3 Å²	42.3	11%	0.108	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	126.4	178.4	-69.8	0	0	0	0	112	H227 R279 H306 L841	H227-C277 VanDerWaalsContact CD2-SG 3.53Å; C277-R279 VanDerWaalsContact C-N 3.28Å; C277-R279 PolarHBondContact O-N 2.88Å; C277-H306 HydrophobicContact CB-CB 4.09Å; C277-H306 PolarHBondContact N-O 2.94Å; C277-L841 HydrophobicContact CB-CD1 4.46Å; C277-L841 HydrophobicContact CB-CG 4.49Å
278	G	92.1	Very high	92.5	Very high	4 Å²	4	41.2 Å²	41.2	4%	0.041	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	7.5	178.5	0	0	0	0	0	115.3	V276 D837 T839	V276-G278 PolarHBondContact O-N 2.77Å; G278-D837 WeakPolarHBondContact CA-OD2 3.27Å; G278-D837 PolarHBondContact N-OD2 2.83Å; G278-T839 PolarHBondContact N-OG1 2.97Å
279	R	93.9	Very high	93.2	Very high	22 Å²	22	39.3 Å²	39.3	8%	0.083	19%	0.192	C	C	.	.	S	Bend	trans	-138.8	143.8	-178.7	-63	179.7	67.8	83.1	7.4	111.5	R275 V276 C277 E281 D806 G808 L809 D837	R275-R279 WeakPolarHBondContact CG-O 3.45Å; R275-R279 PolarHBondContact NH1-O 3.32Å; V276-R279 HydrophobicContact CB-CB 4.15Å; V276-R279 HydrophobicContact CG1-CB 3.98Å; V276-R279 HydrophobicContact CG1-CG 4.22Å; V276-R279 PolarHBondContact O-N 2.92Å; C277-R279 VanDerWaalsContact C-N 3.28Å; C277-R279 PolarHBondContact O-N 2.88Å; R279-E281 HydrophobicContact CB-CB 4.44Å; R279-E281 HydrophobicContact CB-CG 4.46Å; R279-E281 IonicContact CZ-OE1 3.23Å; R279-E281 IonicContact CZ-OE2 2.78Å; R279-E281 IonicContact NE-OE1 2.81Å; R279-E281 IonicContact NE-OE2 3.24Å; R279-E281 PolarHBondContact NE-OE2 3.35Å; R279-E281 IonicContact NH2-OE1 3.19Å; R279-E281 PolarHBondContact NH2-OE1 2.85Å; R279-E281 IonicContact NH2-OE2 3.97Å; R279-E281 PolarHBondContact O-N 2.81Å; R279-D806 IonicContact CZ-OD2 3.29Å; R279-D806 IonicContact NH1-OD2 3.93Å; R279-D806 PolarHBondContact NH1-OD2 3.22Å; R279-D806 IonicContact NH2-OD1 2.71Å; R279-D806 PolarHBondContact NH2-OD1 3.13Å; R279-D806 IonicContact NH2-OD2 3.73Å; R279-D806 PolarHBondContact NH2-OD2 3.33Å; R279-G808 CarbonylContact C-O 3.53Å; R279-G808 VanDerWaalsContact CA-O 3.3Å; R279-G808 WeakPolarHBondContact CA-O 3.34Å; R279-L809 HydrophobicContact CG-CD2 4.05Å; R279-L809 VanDerWaalsContact NH1-CG 3.32Å; R279-D837 PolarHBondContact N-OD2 2.77Å
280	E	93.1	Very high	93.7	Very high	52 Å²	52	38.9 Å²	38.9	24%	0.243	19%	0.188	C	C	.	.	S	Bend	trans	-83	56.8	172.7	-68.1	178.2	133.1	0	0	110.6	R802 G808 R810	E280-R802 IonicContact OE1-NH2 3.42Å; E280-R802 PolarHBondContact OE1-NH2 3.16Å; E280-R802 IonicContact OE2-CZ 2.92Å; E280-R802 IonicContact OE2-NE 3.71Å; E280-R802 IonicContact OE2-NH1 2.67Å; E280-R802 PolarHBondContact OE2-NH1 3.05Å; E280-R802 IonicContact OE2-NH2 2.71Å; E280-R802 PolarHBondContact OE2-NH2 3.46Å; E280-G808 PolarHBondContact N-O 3Å; E280-R810 IonicContact OE1-NE 3.44Å; E280-R810 PolarHBondContact OE1-NE 3.26Å; E280-R810 WeakPolarHBondContact OE2-CD 3.4Å; E280-R810 IonicContact OE2-NE 3.33Å
281	E	95.1	Very high	94.2	Very high	14 Å²	14	31.8 Å²	31.8	7%	0.065	16%	0.157	C	C	.	.			trans	-124.1	122.7	178.4	-72.8	178.8	170.3	0	0	109.6	R275 V276 R279 R708	R275-E281 CarbonylContact C-O 3.59Å; R275-E281 WeakPolarHBondContact CA-O 3.37Å; R275-E281 VanDerWaalsContact CG-O 3.31Å; R275-E281 WeakPolarHBondContact CG-O 3.45Å; V276-E281 HydrophobicContact CB-CB 4.25Å; V276-E281 HydrophobicContact CG2-CB 4.02Å; V276-E281 PolarHBondContact N-O 2.68Å; R279-E281 HydrophobicContact CB-CB 4.44Å; R279-E281 HydrophobicContact CB-CG 4.46Å; R279-E281 IonicContact CZ-OE1 3.23Å; R279-E281 IonicContact CZ-OE2 2.78Å; R279-E281 IonicContact NE-OE1 2.81Å; R279-E281 IonicContact NE-OE2 3.24Å; R279-E281 PolarHBondContact NE-OE2 3.35Å; R279-E281 IonicContact NH2-OE1 3.19Å; R279-E281 PolarHBondContact NH2-OE1 2.85Å; R279-E281 IonicContact NH2-OE2 3.97Å; R279-E281 PolarHBondContact O-N 2.81Å; E281-R708 IonicContact OE1-CZ 2.84Å; E281-R708 IonicContact OE1-NH1 3.34Å; E281-R708 PolarHBondContact OE1-NH1 3.06Å; E281-R708 IonicContact OE1-NH2 3.58Å
282	Y	96.1	Very high	94.5	Very high	35 Å²	35	28.6 Å²	28.6	14%	0.137	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.8	-172.4	-61.9	-94.4	0	0	0	111.6	M200 V273 R275 P313	M200-Y282 HydrophobicContact CB-CD2 4.12Å; M200-Y282 HydrophobicContact CB-CG 3.95Å; M200-Y282 HydrophobicContact CG-CD1 4.12Å; M200-Y282 HydrophobicContact CG-CD2 4.32Å; M200-Y282 HydrophobicContact CG-CG 3.98Å; M200-Y282 VanDerWaalsContact O-CD2 3.3Å; M200-Y282 WeakPolarHBondContact O-CD2 3.4Å; V273-Y282 HydrophobicContact CG1-CD1 3.86Å; V273-Y282 HydrophobicContact CG1-CE1 4.12Å; V273-Y282 HydrophobicContact CG2-CD1 4.14Å; R275-Y282 HydrophobicContact CB-CD1 3.92Å; R275-Y282 HydrophobicContact CB-CE1 4.03Å; R275-Y282 HydrophobicContact CG-CD1 3.96Å; R275-Y282 HydrophobicContact CG-CE1 3.89Å; R275-Y282 HydrophobicContact CG-CG 4.37Å; Y282-P313 HydrophobicContact CE1-CG 4.34Å
283	L	96.3	Very high	94.6	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	96.5	170.1	-77	69.3	0	0	0	107.5	P243 L274 V276 L289 F292 I295 L307	P243-L283 HydrophobicContact CB-CB 4.43Å; P243-L283 VanDerWaalsContact CB-O 3.31Å; P243-L283 WeakPolarHBondContact CB-O 3.4Å; P243-L283 HydrophobicContact CG-CB 4.13Å; L274-L283 HydrophobicContact CB-CB 4.08Å; L274-L283 PolarHBondContact O-N 3.07Å; V276-L283 HydrophobicContact CG2-CD1 3.81Å; L283-L289 HydrophobicContact CD2-CD2 3.83Å; L283-F292 HydrophobicContact CB-CD1 4.46Å; L283-F292 HydrophobicContact CB-CE1 4.17Å; L283-F292 HydrophobicContact CB-CZ 4.35Å; L283-F292 HydrophobicContact CG-CD1 3.97Å; L283-F292 HydrophobicContact CG-CE1 4.19Å; L283-F292 HydrophobicContact CG-CG 4.21Å; L283-I295 HydrophobicContact CD2-CD1 4.15Å; L283-I295 HydrophobicContact CD2-CG1 4.34Å; L283-L307 HydrophobicContact CD1-CD2 4.02Å; L283-L307 HydrophobicContact CD2-CD1 3.85Å; L283-L307 HydrophobicContact CD2-CD2 4.12Å
284	Y	94.1	Very high	94.6	Very high	75 Å²	75	30.2 Å²	30.2	29%	0.294	15%	0.146	S	C	.	.			trans	-141.5	152.2	-173.9	-178.3	-102.7	0	0	0	111.9	N196 L197 M200 V273	N196-Y284 HydrophobicContact CB-CE1 4.27Å; L197-Y284 HydrophobicContact CD2-CD1 3.79Å; L197-Y284 HydrophobicContact CD2-CE1 3.86Å; L197-Y284 HydrophobicContact CG-CD1 4.46Å; L197-Y284 HydrophobicContact CG-CE1 4.08Å; M200-Y284 HydrophobicContact CE-CD1 3.51Å; M200-Y284 HydrophobicContact CE-CD2 3.58Å; M200-Y284 HydrophobicContact CE-CE1 3.5Å; M200-Y284 HydrophobicContact CE-CE2 3.57Å; M200-Y284 HydrophobicContact CE-CG 3.55Å; M200-Y284 HydrophobicContact SD-CD1 4.17Å; M200-Y284 HydrophobicContact SD-CD2 3.76Å; M200-Y284 HydrophobicContact SD-CE2 4.31Å; M200-Y284 HydrophobicContact SD-CG 3.68Å; V273-Y284 HydrophobicContact CG2-CD2 4.31Å
285	G	91.4	Very high	94.5	Very high	16 Å²	16	30.2 Å²	30.2	17%	0.165	15%	0.146	C	C	.	.	S	Bend	trans	90	174.4	178.2	0	0	0	0	0	114.6	P243 K287	P243-G285 WeakPolarHBondContact CD-O 3.35Å; G285-K287 PolarHBondContact O-N 2.84Å
286	E	91.9	Very high	94.3	Very high	143 Å²	143	30.4 Å²	30.4	67%	0.668	15%	0.147	S	C	*	.	S	Bend	trans	-79.9	56.2	-176.5	-61.9	-56.5	136	0	0	112.3
287	K	93.9	Very high	94.1	Very high	84 Å²	84	34.2 Å²	34.2	37%	0.365	17%	0.165	S	C	.	.			trans	-121.9	141.1	176.5	-61.2	-62	177	-165	0	109.7	V204 P243 G285 F292	V204-K287 HydrophobicContact CG1-CG 4.48Å; P243-K287 WeakPolarHBondContact CD-O 3.35Å; G285-K287 PolarHBondContact O-N 2.84Å; K287-F292 HydrophobicContact CB-CE2 3.99Å; K287-F292 HydrophobicContact CB-CZ 4.18Å
288	A	95.8	Very high	94	Very high	20 Å²	20	33.5 Å²	33.5	17%	0.165	16%	0.16	C	C	.	.			trans	-66.9	151.6	175.5	0	0	0	0	0	111.2	D241 Q290 S291 F292	D241-A288 CarbonylContact O-C 3.57Å; D241-A288 WeakPolarHBondContact O-CA 3.33Å; A288-Q290 HydrophobicContact CB-CG 3.94Å; A288-Q290 PolarHBondContact O-N 2.95Å; A288-S291 WeakPolarHBondContact O-CB 3.5Å; A288-S291 PolarHBondContact O-N 3.25Å; A288-F292 WeakPolarHBondContact O-CD2 3.4Å
289	L	95.3	Very high	94	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-54.4	-37.6	177.4	-70	-175.2	0	0	0	113	I222 V237 I239 D241 V246 L283 S291 F292 I295	I222-L289 HydrophobicContact CD1-CD1 3.94Å; V237-L289 HydrophobicContact CG2-CD1 3.71Å; I239-L289 PolarHBondContact O-N 3.32Å; D241-L289 WeakPolarHBondContact O-CG 3.47Å; D241-L289 PolarHBondContact O-N 3.35Å; V246-L289 HydrophobicContact CG2-CD1 3.74Å; V246-L289 HydrophobicContact CG2-CD2 4.21Å; V246-L289 HydrophobicContact CG2-CG 4.12Å; L283-L289 HydrophobicContact CD2-CD2 3.83Å; L289-S291 PolarHBondContact O-N 3.11Å; L289-S291 VanDerWaalsContact O-N 3.11Å; L289-F292 PolarHBondContact O-N 3.16Å; L289-F292 VanDerWaalsContact O-N 3.14Å; L289-I295 WeakPolarHBondContact O-CB 3.18Å
290	Q	94.1	Very high	93.6	Very high	46 Å²	46	36.2 Å²	36.2	22%	0.215	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-60.2	-19.7	175.8	60.9	-179.5	-20.7	0	0	114.1	I239 D240 A288 R296	I239-Q290 HydrophobicContact CD1-CB 3.77Å; I239-Q290 HydrophobicContact CG1-CB 3.78Å; I239-Q290 PolarHBondContact O-N 3Å; D240-Q290 PolarHBondContact OD1-NE2 3.36Å; A288-Q290 HydrophobicContact CB-CG 3.94Å; A288-Q290 PolarHBondContact O-N 2.95Å; Q290-R296 VanDerWaalsContact O-CZ 3.23Å; Q290-R296 PolarHBondContact O-NE 3.47Å; Q290-R296 PolarHBondContact O-NH2 3.38Å
291	S	94.7	Very high	93.3	Very high	22 Å²	22	37 Å²	37	15%	0.154	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-83	-13.4	179.1	-69	0	0	0	0	113.3	V204 T205 A288 L289	V204-S291 CarbonylContact C-O 3.58Å; V204-S291 WeakPolarHBondContact CA-O 2.84Å; T205-S291 PolarHBondContact N-O 2.97Å; T205-S291 VanDerWaalsContact O-CB 3.27Å; T205-S291 WeakPolarHBondContact O-CB 3.5Å; T205-S291 PolarHBondContact O-OG 3.07Å; A288-S291 WeakPolarHBondContact O-CB 3.5Å; A288-S291 PolarHBondContact O-N 3.25Å; L289-S291 PolarHBondContact O-N 3.11Å; L289-S291 VanDerWaalsContact O-N 3.11Å
292	F	95.9	Very high	92.8	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.018	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-82.3	126.7	-179.1	-70.1	-93.2	0	0	0	111	P202 V204 P243 L283 K287 A288 L289 W294 I295 R296	P202-F292 HydrophobicContact CB-CE1 3.97Å; V204-F292 HydrophobicContact CG1-CD1 3.57Å; V204-F292 HydrophobicContact CG1-CD2 4.41Å; V204-F292 HydrophobicContact CG1-CE1 3.56Å; V204-F292 HydrophobicContact CG1-CE2 4.42Å; V204-F292 HydrophobicContact CG1-CG 4.02Å; V204-F292 HydrophobicContact CG1-CZ 4.02Å; P243-F292 HydrophobicContact CG-CE2 3.96Å; P243-F292 HydrophobicContact CG-CZ 3.81Å; L283-F292 HydrophobicContact CB-CD1 4.46Å; L283-F292 HydrophobicContact CB-CE1 4.17Å; L283-F292 HydrophobicContact CB-CZ 4.35Å; L283-F292 HydrophobicContact CG-CD1 3.97Å; L283-F292 HydrophobicContact CG-CE1 4.19Å; L283-F292 HydrophobicContact CG-CG 4.21Å; K287-F292 HydrophobicContact CB-CE2 3.99Å; K287-F292 HydrophobicContact CB-CZ 4.18Å; A288-F292 WeakPolarHBondContact O-CD2 3.4Å; L289-F292 PolarHBondContact O-N 3.16Å; L289-F292 VanDerWaalsContact O-N 3.14Å; F292-W294 VanDerWaalsContact C-N 3.28Å; F292-W294 PolarHBondContact O-N 2.98Å; F292-I295 HydrophobicContact CB-CB 4.27Å; F292-I295 HydrophobicContact CB-CG1 3.84Å; F292-I295 PolarHBondContact O-N 3.48Å; F292-I295 VanDerWaalsContact O-N 3.08Å; F292-R296 PolarHBondContact O-N 3.45Å; F292-R296 VanDerWaalsContact O-N 3.1Å
293	N	94.1	Very high	92.4	Very high	19 Å²	19	42.6 Å²	42.6	10%	0.102	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-34.6	-176.1	-80.3	-38.4	0	0	0	112.5	W203 I295 R296 Q297 D672	W203-N293 HydrophobicContact CD2-CB 3.63Å; W203-N293 HydrophobicContact CE3-CB 3.89Å; W203-N293 HydrophobicContact CG-CB 4.05Å; W203-N293 HydrophobicContact CH2-CB 4.26Å; W203-N293 HydrophobicContact CZ2-CB 4.03Å; W203-N293 HydrophobicContact CZ3-CB 4.2Å; W203-N293 PolarHBondContact NE1-ND2 3.31Å; W203-N293 PolarHBondContact O-N 3.46Å; N293-I295 PolarHBondContact O-N 2.93Å; N293-R296 PolarHBondContact O-N 3.42Å; N293-Q297 WeakPolarHBondContact O-CB 3.45Å; N293-Q297 PolarHBondContact O-N 3.31Å; N293-D672 PolarHBondContact ND2-OD1 3.46Å
294	W	94.4	Very high	92.2	Very high	45 Å²	45	49.1 Å²	49.1	17%	0.17	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-43.5	173.5	-175.6	-98.7	0	0	0	112.5	V276 F292 R296 Q297 S298	V276-W294 HydrophobicContact CG1-CD2 3.84Å; V276-W294 HydrophobicContact CG1-CG 4.16Å; V276-W294 HydrophobicContact CG1-CH2 4.46Å; V276-W294 HydrophobicContact CG1-CZ2 3.66Å; V276-W294 VanDerWaalsContact CG1-NE1 3.31Å; V276-W294 HydrophobicContact CG2-CB 4.23Å; V276-W294 VanDerWaalsContact CG2-CD1 3.42Å; V276-W294 HydrophobicContact CG2-CD2 4.18Å; V276-W294 HydrophobicContact CG2-CG 3.66Å; F292-W294 VanDerWaalsContact C-N 3.28Å; F292-W294 PolarHBondContact O-N 2.98Å; W294-R296 PolarHBondContact O-N 3.47Å; W294-Q297 PolarHBondContact O-N 3.48Å; W294-S298 PolarHBondContact O-N 3.15Å; W294-S298 PolarHBondContact O-OG 2.65Å
295	I	95.1	Very high	92.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-44.2	177.8	-60.3	-64.1	0	0	0	110.4	I222 L283 L289 F292 N293 Q297 S298 L299 I305	I222-I295 HydrophobicContact CD1-CG2 4.17Å; L283-I295 HydrophobicContact CD2-CD1 4.15Å; L283-I295 HydrophobicContact CD2-CG1 4.34Å; L289-I295 WeakPolarHBondContact O-CB 3.18Å; F292-I295 HydrophobicContact CB-CB 4.27Å; F292-I295 HydrophobicContact CB-CG1 3.84Å; F292-I295 PolarHBondContact O-N 3.48Å; F292-I295 VanDerWaalsContact O-N 3.08Å; N293-I295 PolarHBondContact O-N 2.93Å; I295-Q297 VanDerWaalsContact C-N 3.32Å; I295-Q297 PolarHBondContact O-N 2.96Å; I295-S298 PolarHBondContact O-N 3.39Å; I295-L299 HydrophobicContact CG2-CD1 4.19Å; I295-L299 VanDerWaalsContact O-CG 3.3Å; I295-L299 WeakPolarHBondContact O-CG 3.23Å; I295-L299 PolarHBondContact O-N 3.4Å; I295-I305 HydrophobicContact CD1-CD1 4.03Å; I295-I305 HydrophobicContact CD1-CG1 4.39Å; I295-I305 HydrophobicContact CD1-CG2 3.54Å; I295-I305 HydrophobicContact CG2-CD1 4.19Å
296	R	93.3	Very high	92.5	Very high	14 Å²	14	47.3 Å²	47.3	5%	0.053	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-43.1	174.7	-64.9	-176.3	179.9	-133.6	-8.3	111.9	K207 P208 L209 L213 Q290 F292 N293 W294 L299 K300	K207-R296 PolarHBondContact O-NH1 2.82Å; K207-R296 PolarHBondContact O-NH2 2.71Å; P208-R296 PolarHBondContact O-NH1 2.67Å; L209-R296 HydrophobicContact CD1-CG 3.94Å; L213-R296 HydrophobicContact CD1-CB 4.28Å; Q290-R296 VanDerWaalsContact O-CZ 3.23Å; Q290-R296 PolarHBondContact O-NE 3.47Å; Q290-R296 PolarHBondContact O-NH2 3.38Å; F292-R296 PolarHBondContact O-N 3.45Å; F292-R296 VanDerWaalsContact O-N 3.1Å; N293-R296 PolarHBondContact O-N 3.42Å; W294-R296 PolarHBondContact O-N 3.47Å; R296-L299 PolarHBondContact O-N 2.94Å; R296-K300 WeakPolarHBondContact O-CB 3.37Å; R296-K300 PolarHBondContact O-N 2.97Å
297	Q	91.4	Very high	92.7	Very high	81 Å²	81	40.6 Å²	40.6	38%	0.379	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-44.7	178.4	-172.9	175.3	5.8	0	0	111.8	N293 W294 I295 L299 K300 N301	N293-Q297 WeakPolarHBondContact O-CB 3.45Å; N293-Q297 PolarHBondContact O-N 3.31Å; W294-Q297 PolarHBondContact O-N 3.48Å; I295-Q297 VanDerWaalsContact C-N 3.32Å; I295-Q297 PolarHBondContact O-N 2.96Å; Q297-L299 VanDerWaalsContact C-N 3.35Å; Q297-L299 PolarHBondContact O-N 2.8Å; Q297-K300 WeakPolarHBondContact O-CB 3.36Å; Q297-K300 PolarHBondContact O-N 2.91Å; Q297-N301 PolarHBondContact O-N 3.15Å
298	S	92	Very high	92.8	Very high	2 Å²	2	37 Å²	37	1%	0.014	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-42.6	175.3	-59.3	0	0	0	0	111.8	W294 I295 N301 G302 E303	W294-S298 PolarHBondContact O-N 3.15Å; W294-S298 PolarHBondContact O-OG 2.65Å; I295-S298 PolarHBondContact O-N 3.39Å; S298-N301 PolarHBondContact O-N 3.42Å; S298-G302 PolarHBondContact O-N 3.1Å; S298-E303 PolarHBondContact O-N 2.81Å
299	L	91.7	Very high	92.7	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-43.8	174.2	-69.3	172.9	0	0	0	111.6	K216 V217 I222 I239 I295 R296 Q297 N301 G302	K216-L299 WeakPolarHBondContact CD-O 3.49Å; K216-L299 PolarHBondContact NZ-O 3.4Å; V217-L299 HydrophobicContact CG2-CD1 4.2Å; V217-L299 HydrophobicContact CG2-CD2 4.46Å; I222-L299 HydrophobicContact CG2-CD2 4.08Å; I239-L299 HydrophobicContact CD1-CD1 3.98Å; I295-L299 HydrophobicContact CG2-CD1 4.19Å; I295-L299 VanDerWaalsContact O-CG 3.3Å; I295-L299 WeakPolarHBondContact O-CG 3.23Å; I295-L299 PolarHBondContact O-N 3.4Å; R296-L299 PolarHBondContact O-N 2.94Å; Q297-L299 VanDerWaalsContact C-N 3.35Å; Q297-L299 PolarHBondContact O-N 2.8Å; L299-N301 VanDerWaalsContact C-N 3.32Å; L299-N301 PolarHBondContact O-N 3.34Å; L299-G302 PolarHBondContact O-N 3.34Å
300	K	87.2	Confident	92.5	Very high	65 Å²	65	39.2 Å²	39.2	28%	0.283	20%	0.204	S	C	.	.	H	α-helix	trans	-58.8	-44.1	176.6	-173.8	175.2	177.8	165.2	0	111.2	L213 K216 R296 Q297 G302 E870 D879	L213-K300 HydrophobicContact CD2-CB 3.85Å; L213-K300 HydrophobicContact CD2-CG 4.35Å; K216-K300 PolarHBondContact NZ-O 3.32Å; R296-K300 WeakPolarHBondContact O-CB 3.37Å; R296-K300 PolarHBondContact O-N 2.97Å; Q297-K300 WeakPolarHBondContact O-CB 3.36Å; Q297-K300 PolarHBondContact O-N 2.91Å; K300-G302 VanDerWaalsContact C-N 3.34Å; K300-G302 PolarHBondContact O-N 2.91Å; K300-E870 IonicContact NZ-OE1 3.74Å; K300-D879 VanDerWaalsContact CE-CG 3.48Å; K300-D879 WeakPolarHBondContact CE-OD1 3.25Å; K300-D879 WeakPolarHBondContact CE-OD2 3.41Å; K300-D879 IonicContact NZ-OD1 3.97Å; K300-D879 PolarHBondContact NZ-OD1 3.47Å; K300-D879 IonicContact NZ-OD2 3.53Å
301	N	84.9	Confident	92.4	Very high	70 Å²	70	41.7 Å²	41.7	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-78.5	-17.9	-179.5	-66	-4.8	0	0	0	113.5	Q297 S298 L299 E303	Q297-N301 PolarHBondContact O-N 3.15Å; S298-N301 PolarHBondContact O-N 3.42Å; L299-N301 VanDerWaalsContact C-N 3.32Å; L299-N301 PolarHBondContact O-N 3.34Å; N301-E303 VanDerWaalsContact C-N 3.32Å; N301-E303 HydrophobicContact CB-CB 4.4Å; N301-E303 HydrophobicContact CB-CG 3.71Å; N301-E303 VanDerWaalsContact CB-OE1 3.3Å; N301-E303 WeakPolarHBondContact CB-OE1 3.44Å; N301-E303 PolarHBondContact ND2-OE1 3.48Å
302	G	85	Confident	92.3	Very high	64 Å²	64	43 Å²	43	66%	0.66	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.9	29	-171.2	0	0	0	0	0	112.4	S298 L299 K300	S298-G302 PolarHBondContact O-N 3.1Å; L299-G302 PolarHBondContact O-N 3.34Å; K300-G302 VanDerWaalsContact C-N 3.34Å; K300-G302 PolarHBondContact O-N 2.91Å
303	E	88.2	Confident	92.2	Very high	102 Å²	102	44.2 Å²	44.2	48%	0.477	24%	0.239	S	C	.	.			trans	-89	150.8	179.7	-71.4	171.1	-156.8	0	0	111.3	S298 N301	S298-E303 PolarHBondContact O-N 2.81Å; N301-E303 VanDerWaalsContact C-N 3.32Å; N301-E303 HydrophobicContact CB-CB 4.4Å; N301-E303 HydrophobicContact CB-CG 3.71Å; N301-E303 VanDerWaalsContact CB-OE1 3.3Å; N301-E303 WeakPolarHBondContact CB-OE1 3.44Å; N301-E303 PolarHBondContact ND2-OE1 3.48Å
304	E	92	Very high	92.1	Very high	140 Å²	140	47.1 Å²	47.1	65%	0.654	25%	0.254	S	S	*	.			trans	-68.5	138.1	170.3	-68.4	-171.5	168.5	0	0	110.7	H306	E304-H306 WeakPolarHBondContact CB-NE2 3.36Å; E304-H306 PolarHBondContact O-CD2 3.31Å; E304-H306 PolarHBondContact O-N 2.94Å; E304-H306 IonicContact OE2-CE1 3.31Å; E304-H306 PolarHBondContact OE2-CE1 3.26Å; E304-H306 VanDerWaalsContact OE2-CE1 3.31Å; E304-H306 IonicContact OE2-NE2 3.49Å; E304-H306 PolarHBondContact OE2-NE2 2.65Å
305	I	95.4	Very high	92	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	104.4	-179.9	-60.7	163.8	0	0	0	108.6	I222 V224 V225 I295 L307	I222-I305 HydrophobicContact CD1-CD1 3.85Å; V224-I305 HydrophobicContact CG1-CG2 4.24Å; V224-I305 HydrophobicContact CG2-CB 4.44Å; V224-I305 HydrophobicContact CG2-CG2 4.24Å; V225-I305 PolarHBondContact N-O 3.06Å; I295-I305 HydrophobicContact CD1-CD1 4.03Å; I295-I305 HydrophobicContact CD1-CG1 4.39Å; I295-I305 HydrophobicContact CD1-CG2 3.54Å; I295-I305 HydrophobicContact CG2-CD1 4.19Å; I305-L307 HydrophobicContact CG2-CD2 4.23Å; I305-L307 HydrophobicContact CG2-CG 4.21Å
306	H	95.6	Very high	91.8	Very high	47 Å²	47	53.3 Å²	53.3	22%	0.218	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.7	176.5	-60.3	-75.3	0	0	0	111.5	V225 H227 C277 E304 L841	V225-H306 WeakPolarHBondContact CB-ND1 3.36Å; V225-H306 WeakPolarHBondContact O-CA 3.37Å; H227-H306 AromaticContact NE2-CG 3.84Å; H227-H306 AromaticContact NE2-ND1 3.3Å; H227-H306 PolarHBondContact NE2-ND1 3.33Å; C277-H306 HydrophobicContact CB-CB 4.09Å; C277-H306 PolarHBondContact N-O 2.94Å; E304-H306 WeakPolarHBondContact CB-NE2 3.36Å; E304-H306 PolarHBondContact O-CD2 3.31Å; E304-H306 PolarHBondContact O-N 2.94Å; E304-H306 IonicContact OE2-CE1 3.31Å; E304-H306 PolarHBondContact OE2-CE1 3.26Å; E304-H306 VanDerWaalsContact OE2-CE1 3.31Å; E304-H306 IonicContact OE2-NE2 3.49Å; E304-H306 PolarHBondContact OE2-NE2 2.65Å; H306-L841 HydrophobicContact CB-CD1 3.58Å
307	L	96.6	Very high	91.6	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	151.2	177.2	-54.5	178.4	0	0	0	109.8	V224 V225 I226 H227 L274 R275 V276 L283 I305	V224-L307 HydrophobicContact CG1-CD1 3.5Å; V224-L307 VanDerWaalsContact CG1-CD1 3.5Å; V224-L307 HydrophobicContact CG1-CG 3.89Å; V225-L307 PolarHBondContact O-N 2.92Å; I226-L307 CarbonylContact C-O 3.39Å; I226-L307 WeakPolarHBondContact CA-O 3.39Å; H227-L307 PolarHBondContact CD2-O 3.12Å; H227-L307 PolarHBondContact N-O 3.26Å; L274-L307 HydrophobicContact CB-CD1 4.22Å; L274-L307 HydrophobicContact CD1-CD1 4.06Å; L274-L307 HydrophobicContact CD2-CB 4.49Å; L274-L307 HydrophobicContact CD2-CD1 4.47Å; L274-L307 HydrophobicContact CG-CD1 4.48Å; R275-L307 CarbonylContact O-C 3.58Å; R275-L307 VanDerWaalsContact O-CA 3.26Å; R275-L307 WeakPolarHBondContact O-CA 3.23Å; V276-L307 HydrophobicContact CG2-CD2 4.17Å; L283-L307 HydrophobicContact CD1-CD2 4.02Å; L283-L307 HydrophobicContact CD2-CD1 3.85Å; L283-L307 HydrophobicContact CD2-CD2 4.12Å; I305-L307 HydrophobicContact CG2-CD2 4.23Å; I305-L307 HydrophobicContact CG2-CG 4.21Å
308	V	95.6	Very high	91.6	Very high	8 Å²	8	53.5 Å²	53.5	5%	0.048	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139	171	67.1	0	0	0	0	109.5	H227 R275 E310 T839	H227-V308 WeakPolarHBondContact O-CA 3.49Å; R275-V308 HydrophobicContact CB-CG1 3.84Å; R275-V308 PolarHBondContact N-O 3.48Å; R275-V308 PolarHBondContact O-N 3.41Å; V308-E310 HydrophobicContact CG1-CG 3.97Å; V308-E310 HydrophobicContact CG2-CG 3.95Å; V308-T839 HydrophobicContact CB-CG2 4.47Å; V308-T839 HydrophobicContact CG1-CG2 4.4Å; V308-T839 HydrophobicContact CG2-CG2 4.07Å
309	L	94.1	Very high	91.2	Very high	12 Å²	12	58.8 Å²	58.8	6%	0.063	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	114.1	172	-171.4	73.4	0	0	0	108.8	I226 H227 V228 L247 F250 F251 I263 F272 L274	I226-L309 HydrophobicContact CG2-CB 4.09Å; H227-L309 PolarHBondContact O-N 3.18Å; V228-L309 HydrophobicContact CG2-CB 4.02Å; V228-L309 HydrophobicContact CG2-CD2 3.96Å; L247-L309 HydrophobicContact CD2-CD1 3.31Å; F250-L309 HydrophobicContact CE1-CD2 3.92Å; F251-L309 HydrophobicContact CE2-CD1 4.49Å; F251-L309 HydrophobicContact CE2-CD2 4.36Å; F251-L309 HydrophobicContact CZ-CD2 4.21Å; I263-L309 HydrophobicContact CD1-CD2 3.92Å; F272-L309 HydrophobicContact CB-CD1 3.57Å; F272-L309 HydrophobicContact CB-CG 4.03Å; F272-L309 HydrophobicContact CD1-CD1 4.3Å; F272-L309 HydrophobicContact CD1-CD2 4.13Å; F272-L309 HydrophobicContact CD1-CG 3.77Å; F272-L309 HydrophobicContact CE1-CD2 4.45Å; F272-L309 HydrophobicContact CE1-CG 4.48Å; F272-L309 HydrophobicContact CG-CD1 4.04Å; F272-L309 HydrophobicContact CG-CD2 4.27Å; F272-L309 HydrophobicContact CG-CG 3.99Å; L274-L309 HydrophobicContact CD2-CD1 4.19Å
310	E	91.7	Very high	90.9	Very high	57 Å²	57	60.1 Å²	60.1	27%	0.266	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	162.9	-178.5	-73.7	-178.1	175.4	0	0	111.2	F272 V273 R275 V308	F272-E310 CarbonylContact C-O 3.51Å; F272-E310 WeakPolarHBondContact CA-O 3.25Å; V273-E310 PolarHBondContact N-O 3.04Å; V273-E310 PolarHBondContact O-N 3.01Å; V273-E310 VanDerWaalsContact O-N 3.09Å; R275-E310 IonicContact CZ-OE1 3.37Å; R275-E310 IonicContact CZ-OE2 2.77Å; R275-E310 IonicContact NE-OE1 3.63Å; R275-E310 IonicContact NE-OE2 3.42Å; R275-E310 PolarHBondContact NE-OE2 3.43Å; R275-E310 IonicContact NH2-OE1 3.11Å; R275-E310 PolarHBondContact NH2-OE1 3.28Å; R275-E310 IonicContact NH2-OE2 3.71Å; R275-E310 PolarHBondContact NH2-OE2 2.91Å; V308-E310 HydrophobicContact CG1-CG 3.97Å; V308-E310 HydrophobicContact CG2-CG 3.95Å
311	T	91.7	Very high	90.1	Very high	98 Å²	98	62.4 Å²	62.4	60%	0.601	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-70.3	138.8	168.8	50	0	0	0	0	109.5
312	P	92.5	Very high	89.2	Confident	51 Å²	51	70.4 Å²	70.4	33%	0.331	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-53.2	144.8	175.5	-24	31.8	0	0	0	112.1	M200 D271 V273	M200-P312 HydrophobicContact SD-CB 4.32Å; D271-P312 WeakPolarHBondContact O-CD 3.39Å; V273-P312 HydrophobicContact CB-CG 4.18Å; V273-P312 HydrophobicContact CG1-CB 4.34Å; V273-P312 HydrophobicContact CG1-CG 4.24Å
313	P	93	Very high	88.3	Confident	29 Å²	29	69.2 Å²	69.2	19%	0.188	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-61.8	141.7	174.3	27.3	-33.9	0	0	0	110.2	M200 Y282 P315	M200-P313 HydrophobicContact CG-CG 3.57Å; Y282-P313 HydrophobicContact CE1-CG 4.34Å; P313-P315 VanDerWaalsContact O-CD 3.3Å; P313-P315 WeakPolarHBondContact O-CD 3.48Å
314	D	92.8	Very high	87.2	Confident	79 Å²	79	69.1 Å²	69.1	42%	0.422	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-68.5	116	179.3	-178.6	2.4	0	0	0	110.4	E316 L317	D314-E316 PolarHBondContact O-N 2.96Å; D314-E316 WeakPolarHBondContact OD1-CB 3.42Å; D314-E316 WeakPolarHBondContact OD1-CG 3.41Å; D314-E316 PolarHBondContact OD1-N 3.18Å; D314-L317 HydrophobicContact CB-CD1 4.32Å; D314-L317 HydrophobicContact CB-CG 4.25Å; D314-L317 WeakPolarHBondContact O-CB 3.42Å; D314-L317 PolarHBondContact O-N 3.16Å
315	P	91.8	Very high	86.3	Confident	39 Å²	39	65 Å²	65	25%	0.253	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-64.2	-17.8	178.4	26.6	-34.8	0	0	0	113.1	P195 P313 L317 D318	P195-P315 HydrophobicContact CB-CB 3.81Å; P313-P315 VanDerWaalsContact O-CD 3.3Å; P313-P315 WeakPolarHBondContact O-CD 3.48Å; P315-L317 PolarHBondContact O-N 3.48Å; P315-D318 PolarHBondContact O-N 2.87Å
316	E	90.9	Very high	85.5	Confident	136 Å²	136	65.6 Å²	65.6	64%	0.636	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-63.7	-24.2	176.8	-65.1	-167.5	171.8	0	0	112.5	D314 D318 L319	D314-E316 PolarHBondContact O-N 2.96Å; D314-E316 WeakPolarHBondContact OD1-CB 3.42Å; D314-E316 WeakPolarHBondContact OD1-CG 3.41Å; D314-E316 PolarHBondContact OD1-N 3.18Å; E316-D318 PolarHBondContact O-N 3.42Å; E316-L319 HydrophobicContact CB-CD1 3.9Å; E316-L319 HydrophobicContact CB-CG 4.47Å; E316-L319 HydrophobicContact CG-CD1 4.2Å; E316-L319 VanDerWaalsContact O-CB 3.31Å; E316-L319 WeakPolarHBondContact O-CB 3.45Å; E316-L319 WeakPolarHBondContact O-CD1 3.43Å; E316-L319 VanDerWaalsContact O-CG 3.24Å; E316-L319 WeakPolarHBondContact O-CG 3.08Å; E316-L319 PolarHBondContact O-N 3.44Å; E316-L319 VanDerWaalsContact O-N 3.16Å
317	L	90.5	Very high	84.8	Confident	97 Å²	97	64.8 Å²	64.8	51%	0.508	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-66.7	-18.9	174.4	-60.7	175.9	0	0	0	113.1	D314 P315 N745	D314-L317 HydrophobicContact CB-CD1 4.32Å; D314-L317 HydrophobicContact CB-CG 4.25Å; D314-L317 WeakPolarHBondContact O-CB 3.42Å; D314-L317 PolarHBondContact O-N 3.16Å; P315-L317 PolarHBondContact O-N 3.48Å; L317-N745 HydrophobicContact CB-CB 4.35Å; L317-N745 WeakPolarHBondContact O-CB 3.4Å; L317-N745 PolarHBondContact O-N 2.98Å
318	D	90.5	Very high	84.1	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.016	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-99.9	9.8	177.9	-66.5	-56.7	0	0	0	112.7	R193 Y198 S199 P315 E316 K707 G743	R193-D318 PolarHBondContact NH2-O 3.3Å; Y198-D318 HydrophobicContact CD1-CB 4.06Å; Y198-D318 HydrophobicContact CE1-CB 4.11Å; S199-D318 WeakPolarHBondContact CA-OD2 3.24Å; S199-D318 WeakPolarHBondContact CB-OD2 3.5Å; S199-D318 PolarHBondContact OG-OD2 3.5Å; P315-D318 PolarHBondContact O-N 2.87Å; E316-D318 PolarHBondContact O-N 3.42Å; D318-K707 VanDerWaalsContact OD1-CE 3.28Å; D318-K707 WeakPolarHBondContact OD1-CE 3.45Å; D318-K707 IonicContact OD1-NZ 3.39Å; D318-K707 PolarHBondContact OD1-NZ 3.11Å; D318-K707 IonicContact OD2-NZ 2.78Å; D318-K707 PolarHBondContact OD2-NZ 3.23Å; D318-G743 WeakPolarHBondContact O-CA 3.19Å
319	L	84	Confident	83	Confident	113 Å²	113	64.4 Å²	64.4	59%	0.592	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-61.2	140.5	175.2	-74	169.1	0	0	0	111.1	E316	E316-L319 HydrophobicContact CB-CD1 3.9Å; E316-L319 HydrophobicContact CB-CG 4.47Å; E316-L319 HydrophobicContact CG-CD1 4.2Å; E316-L319 VanDerWaalsContact O-CB 3.31Å; E316-L319 WeakPolarHBondContact O-CB 3.45Å; E316-L319 WeakPolarHBondContact O-CD1 3.43Å; E316-L319 VanDerWaalsContact O-CG 3.24Å; E316-L319 WeakPolarHBondContact O-CG 3.08Å; E316-L319 PolarHBondContact O-N 3.44Å; E316-L319 VanDerWaalsContact O-N 3.16Å
320	V	85.7	Confident	81.6	Confident	45 Å²	45	67.8 Å²	67.8	27%	0.273	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-97.8	131.1	178.3	179.3	0	0	0	0	108.3	L190 R740	L190-V320 HydrophobicContact CD1-CB 4.35Å; L190-V320 HydrophobicContact CD1-CG1 4.22Å; L190-V320 HydrophobicContact CD1-CG2 4.09Å; L190-V320 HydrophobicContact CD2-CG2 3.9Å; V320-R740 WeakPolarHBondContact CG1-O 3.43Å
321	Q	70.9	Confident	80.5	Confident	112 Å²	112	66 Å²	66	52%	0.523	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-56	146	176.8	-70.3	-171.7	-5.7	0	0	111.5	E323	Q321-E323 PolarHBondContact O-N 2.95Å
322	R	64.8	Low	79.1	Confident	239 Å²	239	62.4 Å²	62.4	90%	0.902	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-62.6	135.2	-177.7	-142.7	179.6	91.2	-176.2	5.8	110.1
323	E	65.9	Low	77.6	Confident	39 Å²	39	60.2 Å²	60.2	18%	0.182	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-99	126.1	-166.6	-155.8	-164.1	92.1	0	0	111.1	L183 R186 R187 Q321 W325	L183-E323 HydrophobicContact CD1-CG 4.25Å; L183-E323 WeakPolarHBondContact CD1-OE1 3.36Å; L183-E323 WeakPolarHBondContact CD1-OE2 3.39Å; L183-E323 WeakPolarHBondContact CD2-OE1 3.48Å; L183-E323 WeakPolarHBondContact CG-OE1 3.5Å; R186-E323 IonicContact CZ-OE2 3.18Å; R186-E323 IonicContact NE-OE2 3.97Å; R186-E323 PolarHBondContact NE-OE2 2.9Å; R186-E323 IonicContact NH2-OE1 2.72Å; R186-E323 IonicContact NH2-OE2 2.66Å; R186-E323 PolarHBondContact NH2-OE2 3.35Å; R187-E323 IonicContact CZ-OE1 4Å; R187-E323 IonicContact NE-OE1 3.37Å; R187-E323 PolarHBondContact NE-OE1 3.11Å; R187-E323 IonicContact NE-OE2 2.8Å; R187-E323 IonicContact NH2-OE1 3.68Å; R187-E323 PolarHBondContact NH2-OE1 3Å; Q321-E323 PolarHBondContact O-N 2.95Å; E323-W325 PolarHBondContact O-N 2.9Å
324	D	65.4	Low	76.1	Confident	99 Å²	99	59 Å²	59	53%	0.529	29%	0.292	S	S	.	.			trans	-78.3	-3.6	-172.7	-64.4	-38.2	0	0	0	114.6
325	W	73.8	Confident	74.7	Confident	53 Å²	53	55.3 Å²	55.3	20%	0.201	27%	0.273	C	S	.	.	S	Bend	trans	-96.8	140.5	-173.7	-64.5	-10.7	0	0	0	111.8	L183 R187 E323	L183-W325 HydrophobicContact CD1-CE3 3.87Å; L183-W325 HydrophobicContact CD2-CB 3.62Å; L183-W325 HydrophobicContact CD2-CE3 4.43Å; R187-W325 PolarHBondContact NH2-O 3.31Å; E323-W325 PolarHBondContact O-N 2.9Å
326	A	77.7	Confident	73.5	Confident	19 Å²	19	53.8 Å²	53.8	16%	0.157	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-76.8	151.7	168.3	0	0	0	0	0	110.3	L101 E110 L183 V328	L101-A326 HydrophobicContact CD2-CB 3.86Å; E110-A326 HydrophobicContact CB-CB 3.83Å; L183-A326 WeakPolarHBondContact CD2-O 3.32Å; A326-V328 PolarHBondContact O-N 3.1Å
327	Q	81	Confident	72.8	Confident	30 Å²	30	48.3 Å²	48.3	14%	0.14	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	130	180	-175.5	179.2	-21.5	0	0	110	V108 C109 E110 T184	V108-Q327 PolarHBondContact O-N 3.33Å; C109-Q327 CarbonylContact C-O 3.53Å; C109-Q327 WeakPolarHBondContact CA-O 3.41Å; E110-Q327 PolarHBondContact N-O 3.28Å; T184-Q327 HydrophobicContact CG2-CG 4.37Å; T184-Q327 VanDerWaalsContact CG2-NE2 3.3Å; T184-Q327 VanDerWaalsContact OG1-CG 3.23Å; T184-Q327 WeakPolarHBondContact OG1-CG 3.42Å
328	V	81.5	Confident	72.4	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	139.3	177.1	177.8	0	0	0	0	110.8	Y112 R180 K181 A326 D330 T332	Y112-V328 HydrophobicContact CG-CG2 4.37Å; R180-V328 HydrophobicContact CB-CG2 3.7Å; R180-V328 VanDerWaalsContact O-CG2 3.32Å; R180-V328 WeakPolarHBondContact O-CG2 3.17Å; K181-V328 HydrophobicContact CD-CG1 4.46Å; A326-V328 PolarHBondContact O-N 3.1Å; V328-D330 PolarHBondContact O-N 2.9Å; V328-T332 HydrophobicContact CG1-CG2 3.61Å
329	D	72.5	Confident	71.8	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-49.7	133.9	172.7	-167.7	-73	0	0	0	112.9	Y102 E110 D122 K181 C331 T332	Y102-D329 WeakPolarHBondContact CE1-OD2 2.96Å; Y102-D329 PolarHBondContact OH-OD2 2.95Å; E110-D329 PolarHBondContact O-N 3.32Å; E110-D329 VanDerWaalsContact O-N 3.11Å; D122-D329 WeakPolarHBondContact CB-OD1 3.42Å; D122-D329 WeakPolarHBondContact CB-OD2 3.21Å; D122-D329 PolarHBondContact N-OD1 3.38Å; D122-D329 PolarHBondContact N-OD2 3.33Å; K181-D329 PolarHBondContact NZ-O 3.43Å; D329-C331 VanDerWaalsContact C-N 3.3Å; D329-C331 PolarHBondContact O-N 3.27Å; D329-C331 WeakPolarHBondContact OD1-CB 3.49Å; D329-C331 PolarHBondContact OD1-N 3.04Å; D329-T332 HydrophobicContact CB-CG2 4.22Å; D329-T332 WeakPolarHBondContact O-CG2 3.47Å
330	D	65.9	Low	71.3	Confident	84 Å²	84	45.6 Å²	45.6	45%	0.449	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-29.9	-175.8	-70.5	-31.9	0	0	0	112.2	K181 V328 T332	K181-D330 PolarHBondContact NZ-O 3.38Å; V328-D330 PolarHBondContact O-N 2.9Å; D330-T332 PolarHBondContact O-N 3.39Å
331	C	67.6	Low	70.8	Confident	20 Å²	20	44 Å²	44	14%	0.135	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	8.5	-172.9	-73.2	0	0	0	0	115	Q116 T120 D122 D329	Q116-C331 VanDerWaalsContact NE2-C 3.3Å; Q116-C331 PolarHBondContact NE2-O 3.35Å; T120-C331 VanDerWaalsContact O-CB 3.29Å; T120-C331 WeakPolarHBondContact O-CB 3.37Å; D122-C331 HydrophobicContact CB-CB 4.03Å; D329-C331 VanDerWaalsContact C-N 3.3Å; D329-C331 PolarHBondContact O-N 3.27Å; D329-C331 WeakPolarHBondContact OD1-CB 3.49Å; D329-C331 PolarHBondContact OD1-N 3.04Å
332	T	61.8	Low	71	Confident	21 Å²	21	39.6 Å²	39.6	13%	0.129	19%	0.192	C	C	.	.			trans	-46.2	141.6	-177.2	61.5	0	0	0	0	114.3	D113 F177 K181 V328 D329 D330	D113-T332 HydrophobicContact CB-CG2 4.2Å; F177-T332 HydrophobicContact CE2-CG2 4.45Å; F177-T332 WeakPolarHBondContact CZ-OG1 3.3Å; K181-T332 WeakPolarHBondContact CE-OG1 3.33Å; K181-T332 PolarHBondContact NZ-OG1 3.33Å; V328-T332 HydrophobicContact CG1-CG2 3.61Å; D329-T332 HydrophobicContact CB-CG2 4.22Å; D329-T332 WeakPolarHBondContact O-CG2 3.47Å; D330-T332 PolarHBondContact O-N 3.39Å
333	G	62	Low	71.4	Confident	5 Å²	5	30.6 Å²	30.6	5%	0.052	16%	0.162	C	C	.	.	S	Bend	trans	119.7	154.2	-177	0	0	0	0	0	112.1	D113 A335	D113-G333 WeakPolarHBondContact OD2-CA 3.31Å; D113-G333 PolarHBondContact OD2-N 2.96Å; D113-G333 VanDerWaalsContact OD2-N 3.12Å; G333-A335 PolarHBondContact O-N 3.5Å
334	V	60.9	Low	71.7	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.024	18%	0.177	C	C	.	.	S	Bend	trans	-83.3	-0.6	-171.5	-160.9	0	0	0	0	112.2	H115 V117 G336 T353 R480 L482 V537	H115-V334 HydrophobicContact CB-CG2 4.18Å; H115-V334 WeakPolarHBondContact O-CG2 3.37Å; V117-V334 HydrophobicContact CG2-CG1 3.68Å; V334-G336 PolarHBondContact O-N 2.97Å; V334-T353 HydrophobicContact CG1-CG2 3.85Å; V334-R480 HydrophobicContact CG2-CB 4.4Å; V334-L482 HydrophobicContact CB-CD2 4.12Å; V334-L482 HydrophobicContact CG1-CD2 4.35Å; V334-L482 HydrophobicContact CG2-CD1 4.08Å; V334-L482 HydrophobicContact CG2-CD2 4.08Å; V334-L482 HydrophobicContact CG2-CG 4.19Å; V334-V537 HydrophobicContact CB-CG1 4.44Å; V334-V537 HydrophobicContact CB-CG2 4.2Å; V334-V537 HydrophobicContact CG1-CG2 3.8Å
335	A	63.9	Low	72	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.017	20%	0.198	C	C	.	.			trans	-84.1	119.2	-168.1	0	0	0	0	0	113.4	G333 V537 K540	G333-A335 PolarHBondContact O-N 3.5Å; A335-V537 HydrophobicContact CB-CG1 4.19Å; A335-K540 HydrophobicContact CB-CD 4.26Å; A335-K540 HydrophobicContact CB-CG 3.63Å; A335-K540 WeakPolarHBondContact O-CD 3.46Å; A335-K540 WeakPolarHBondContact O-CE 3.31Å; A335-K540 PolarHBondContact O-NZ 3.4Å
336	G	67.2	Low	71.7	Confident	7 Å²	7	38.2 Å²	38.2	7%	0.072	21%	0.205	C	C	.	.			trans	-113.1	-165.8	170.3	0	0	0	0	0	112.1	V334 K540	V334-G336 PolarHBondContact O-N 2.97Å; G336-K540 PolarHBondContact O-N 3.11Å
337	T	75.7	Confident	71.2	Confident	21 Å²	21	40.7 Å²	40.7	13%	0.129	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-74.6	159.3	170.9	59.6	0	0	0	0	110.9	E339 Q340 L341 S541 E543	T337-E339 VanDerWaalsContact C-N 3.27Å; T337-E339 PolarHBondContact O-N 3.09Å; T337-Q340 PolarHBondContact O-N 2.88Å; T337-Q340 WeakPolarHBondContact OG1-CB 3.35Å; T337-Q340 WeakPolarHBondContact OG1-CG 3.26Å; T337-Q340 PolarHBondContact OG1-N 2.91Å; T337-Q340 PolarHBondContact OG1-NE2 3.13Å; T337-Q340 PolarHBondContact OG1-OE1 3.24Å; T337-L341 WeakPolarHBondContact O-CG 3.44Å; T337-L341 PolarHBondContact O-N 3.02Å; T337-S541 CarbonylContact C-O 3.49Å; T337-S541 VanDerWaalsContact CA-O 3.26Å; T337-S541 WeakPolarHBondContact CA-O 3.48Å; T337-E543 HydrophobicContact CG2-CG 3.68Å; T337-E543 WeakPolarHBondContact OG1-CG 3.33Å; T337-E543 PolarHBondContact OG1-OE1 2.94Å
338	H	81.8	Confident	70.6	Confident	18 Å²	18	45.3 Å²	45.3	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-42.1	177	175.3	63.5	0	0	0	112.2	Q340 L341 T342 S355 W357 D358 P539 S541 R542	H338-Q340 VanDerWaalsContact C-N 3.27Å; H338-Q340 PolarHBondContact O-N 3.38Å; H338-L341 CarbonylContact O-C 3.57Å; H338-L341 PolarHBondContact O-N 3.4Å; H338-T342 WeakPolarHBondContact O-CB 3.23Å; H338-T342 PolarHBondContact O-N 3.24Å; H338-S355 PolarHBondContact CE1-OG 3.43Å; H338-S355 PolarHBondContact ND1-OG 3.15Å; H338-W357 HydrophobicContact CB-CE3 3.61Å; H338-W357 HydrophobicContact CB-CZ3 3.65Å; H338-W357 AromaticContact CG-CE3 3.66Å; H338-W357 AromaticContact ND1-CE3 3.7Å; H338-D358 IonicContact CE1-OD1 3.91Å; H338-D358 PolarHBondContact CE1-OD1 3.44Å; H338-D358 IonicContact CE1-OD2 3.74Å; H338-D358 IonicContact NE2-OD1 2.81Å; H338-P539 HydrophobicContact CB-CB 4.18Å; H338-P539 HydrophobicContact CB-CG 4.32Å; H338-S541 PolarHBondContact N-O 3.1Å; H338-R542 HydrophobicContact CB-CG 4.22Å
339	E	78.3	Confident	69.6	Low	61 Å²	61	53.5 Å²	53.5	29%	0.285	28%	0.275	S	S	.	.	H	α-helix	trans	-66.2	-31.8	-178.3	-63.2	69.7	-152.6	0	0	111.1	T337 K346 R542 E543	T337-E339 VanDerWaalsContact C-N 3.27Å; T337-E339 PolarHBondContact O-N 3.09Å; E339-K346 PolarHBondContact O-NZ 3.03Å; E339-R542 WeakPolarHBondContact OE1-CB 3.4Å; E339-R542 WeakPolarHBondContact OE1-CG 3.38Å; E339-R542 IonicContact OE1-NE 2.81Å; E339-R542 VanDerWaalsContact OE2-CA 3.32Å; E339-R542 WeakPolarHBondContact OE2-CA 3.28Å; E339-E543 HydrophobicContact CB-CG 4.34Å; E339-E543 HydrophobicContact CG-CB 4.36Å; E339-E543 PolarHBondContact OE2-N 3.46Å
340	Q	72.4	Confident	69.1	Low	76 Å²	76	60.1 Å²	60.1	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-71.4	-31.9	172.8	-72.7	164.4	9.5	0	0	112.7	T337 H338 K346 E543	T337-Q340 PolarHBondContact O-N 2.88Å; T337-Q340 WeakPolarHBondContact OG1-CB 3.35Å; T337-Q340 WeakPolarHBondContact OG1-CG 3.26Å; T337-Q340 PolarHBondContact OG1-N 2.91Å; T337-Q340 PolarHBondContact OG1-NE2 3.13Å; T337-Q340 PolarHBondContact OG1-OE1 3.24Å; H338-Q340 VanDerWaalsContact C-N 3.27Å; H338-Q340 PolarHBondContact O-N 3.38Å; Q340-K346 PolarHBondContact O-NZ 2.94Å; Q340-E543 PolarHBondContact NE2-OE1 3.47Å
341	L	75.8	Confident	69	Low	12 Å²	12	56.8 Å²	56.8	6%	0.063	28%	0.283	C	S	.	.	H	α-helix	trans	-100.3	-14.4	-173	-64.2	173.2	0	0	0	114.5	T337 H338 T353 S355 V537 P539	T337-L341 WeakPolarHBondContact O-CG 3.44Å; T337-L341 PolarHBondContact O-N 3.02Å; H338-L341 CarbonylContact O-C 3.57Å; H338-L341 PolarHBondContact O-N 3.4Å; L341-T353 WeakPolarHBondContact CD2-OG1 3.49Å; L341-S355 PolarHBondContact O-N 3.19Å; L341-S355 VanDerWaalsContact O-N 3.07Å; L341-V537 HydrophobicContact CD1-CB 4.14Å; L341-V537 HydrophobicContact CD1-CG1 3.92Å; L341-P539 HydrophobicContact CD1-CB 4.3Å; L341-P539 HydrophobicContact CD1-CG 4.28Å
342	T	75.9	Confident	69.1	Low	20 Å²	20	58.6 Å²	58.6	12%	0.123	29%	0.289	C	S	.	.			trans	-68.3	145.4	-178	-170.5	0	0	0	0	111.5	H338 A344 K346 D358	H338-T342 WeakPolarHBondContact O-CB 3.23Å; H338-T342 PolarHBondContact O-N 3.24Å; T342-A344 PolarHBondContact OG1-N 3.27Å; T342-K346 VanDerWaalsContact O-CD 3.3Å; T342-K346 WeakPolarHBondContact O-CD 3.23Å; T342-K346 WeakPolarHBondContact O-CE 3.49Å; T342-K346 PolarHBondContact O-NZ 3.33Å; T342-D358 VanDerWaalsContact CA-OD2 3.31Å; T342-D358 WeakPolarHBondContact CA-OD2 3.29Å; T342-D358 VanDerWaalsContact CB-OD2 3.31Å; T342-D358 WeakPolarHBondContact CB-OD2 3.3Å; T342-D358 PolarHBondContact OG1-OD2 2.83Å
343	I	73.4	Confident	69.7	Low	50 Å²	50	58.5 Å²	58.5	26%	0.256	29%	0.288	S	S	.	.			trans	-82.6	-24.9	174.5	-49.9	175.5	0	0	0	110.6	E345 K346 V351 I354	I343-E345 PolarHBondContact O-N 2.91Å; I343-K346 PolarHBondContact O-N 3.18Å; I343-K346 VanDerWaalsContact O-N 3.16Å; I343-V351 HydrophobicContact CG1-CG1 4.33Å; I343-V351 HydrophobicContact CG2-CG2 4.38Å; I343-I354 HydrophobicContact CD1-CB 4.2Å; I343-I354 HydrophobicContact CD1-CD1 3.54Å; I343-I354 HydrophobicContact CD1-CG1 3.53Å; I343-I354 HydrophobicContact CD1-CG2 3.68Å; I343-I354 HydrophobicContact CG1-CB 4.42Å; I343-I354 HydrophobicContact CG1-CD1 4.43Å; I343-I354 HydrophobicContact CG1-CG1 3.89Å; I343-I354 HydrophobicContact CG1-CG2 4.02Å
344	A	72.3	Confident	70.8	Confident	61 Å²	61	59.3 Å²	59.3	50%	0.504	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	131.9	-176.3	0	0	0	0	0	110.3	T342 K346	T342-A344 PolarHBondContact OG1-N 3.27Å; A344-K346 PolarHBondContact O-N 2.95Å; A344-K346 VanDerWaalsContact O-N 3.13Å
345	E	70.2	Confident	72.1	Confident	209 Å²	209	59.1 Å²	59.1	98%	0.977	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	13.5	176.9	-50.6	178.2	172.3	0	0	114.8	I343	I343-E345 PolarHBondContact O-N 2.91Å
346	K	68.3	Low	73.4	Confident	80 Å²	80	59 Å²	59	35%	0.348	29%	0.289	S	S	.	.	S	Bend	trans	-109.7	151.3	173.9	-64.3	-169.3	-170.6	141.3	0	112.2	E339 Q340 T342 I343 A344 H348	E339-K346 PolarHBondContact O-NZ 3.03Å; Q340-K346 PolarHBondContact O-NZ 2.94Å; T342-K346 VanDerWaalsContact O-CD 3.3Å; T342-K346 WeakPolarHBondContact O-CD 3.23Å; T342-K346 WeakPolarHBondContact O-CE 3.49Å; T342-K346 PolarHBondContact O-NZ 3.33Å; I343-K346 PolarHBondContact O-N 3.18Å; I343-K346 VanDerWaalsContact O-N 3.16Å; A344-K346 PolarHBondContact O-N 2.95Å; A344-K346 VanDerWaalsContact O-N 3.13Å; K346-H348 PolarHBondContact O-CD2 3.17Å; K346-H348 PolarHBondContact O-N 3Å
347	D	66.8	Low	74.5	Confident	72 Å²	72	59.9 Å²	59.9	39%	0.385	29%	0.29	S	S	.	.			trans	-70	121.4	173.1	167.7	13	0	0	0	110.2	E349 R350	D347-E349 VanDerWaalsContact C-N 3.25Å; D347-E349 PolarHBondContact O-N 2.91Å; D347-E349 PolarHBondContact OD1-N 3.35Å; D347-E349 VanDerWaalsContact OD1-N 3.15Å; D347-R350 HydrophobicContact CB-CG 4.48Å; D347-R350 WeakPolarHBondContact O-CB 3.33Å; D347-R350 PolarHBondContact O-N 2.54Å; D347-R350 WeakPolarHBondContact OD2-CD 3.37Å; D347-R350 IonicContact OD2-CZ 2.81Å; D347-R350 IonicContact OD2-NE 2.73Å; D347-R350 PolarHBondContact OD2-NE 3.36Å; D347-R350 IonicContact OD2-NH2 3.61Å
348	H	67.9	Low	75.1	Confident	127 Å²	127	61.5 Å²	61.5	59%	0.588	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-64	-26.9	-172.1	-63.6	174.6	0	0	0	113.2	K346 R350 V351	K346-H348 PolarHBondContact O-CD2 3.17Å; K346-H348 PolarHBondContact O-N 3Å; H348-R350 PolarHBondContact O-N 2.98Å; H348-V351 PolarHBondContact O-N 2.77Å
349	E	61.5	Low	75.6	Confident	172 Å²	172	61.6 Å²	61.6	80%	0.804	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-69.2	-12.8	176.5	-64.1	-170.8	167.1	0	0	112.5	D347	D347-E349 VanDerWaalsContact C-N 3.25Å; D347-E349 PolarHBondContact O-N 2.91Å; D347-E349 PolarHBondContact OD1-N 3.35Å; D347-E349 VanDerWaalsContact OD1-N 3.15Å
350	R	61.3	Low	76.2	Confident	140 Å²	140	63.3 Å²	63.3	53%	0.528	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-109.8	5.2	-175.6	-59.7	164.5	-178.2	-154.1	-0.5	112.9	M37 N66 D347 H348 F352	M37-R350 HydrophobicContact CE-CB 4.01Å; M37-R350 VanDerWaalsContact CE-CD 3.44Å; M37-R350 HydrophobicContact CE-CG 4.05Å; N66-R350 PolarHBondContact ND2-O 2.92Å; D347-R350 HydrophobicContact CB-CG 4.48Å; D347-R350 WeakPolarHBondContact O-CB 3.33Å; D347-R350 PolarHBondContact O-N 2.54Å; D347-R350 WeakPolarHBondContact OD2-CD 3.37Å; D347-R350 IonicContact OD2-CZ 2.81Å; D347-R350 IonicContact OD2-NE 2.73Å; D347-R350 PolarHBondContact OD2-NE 3.36Å; D347-R350 IonicContact OD2-NH2 3.61Å; H348-R350 PolarHBondContact O-N 2.98Å; R350-F352 WeakPolarHBondContact O-CD2 3.22Å
351	V	64.4	Low	77.3	Confident	14 Å²	14	65 Å²	65	9%	0.085	32%	0.315	C	S	.	.			trans	-88.5	125.2	178.7	179	0	0	0	0	109.3	I343 H348 T353 I354 Y534	I343-V351 HydrophobicContact CG1-CG1 4.33Å; I343-V351 HydrophobicContact CG2-CG2 4.38Å; H348-V351 PolarHBondContact O-N 2.77Å; V351-T353 WeakPolarHBondContact CG1-O 3.3Å; V351-I354 HydrophobicContact CG1-CG1 4.13Å; V351-Y534 WeakPolarHBondContact O-CD1 3.48Å; V351-Y534 WeakPolarHBondContact O-CE1 3.49Å
352	F	68.4	Low	78.3	Confident	59 Å²	59	68.3 Å²	68.3	26%	0.259	33%	0.329	S	S	.	.			trans	-115.3	-22.8	178	-66.5	-76.6	0	0	0	113.1	N66 W67 Q71 R350 P535	N66-F352 HydrophobicContact CB-CD2 4.28Å; N66-F352 WeakPolarHBondContact ND2-CD2 3.38Å; N66-F352 WeakPolarHBondContact ND2-CE2 3.12Å; W67-F352 AromaticContact CD1-CE2 3.79Å; W67-F352 AromaticContact CD1-CZ 3.97Å; Q71-F352 VanDerWaalsContact NE2-CD1 3.3Å; R350-F352 WeakPolarHBondContact O-CD2 3.22Å; F352-P535 WeakPolarHBondContact O-CD 3.43Å
353	T	75.9	Confident	79.3	Confident	19 Å²	19	67.7 Å²	67.7	12%	0.117	32%	0.324	C	S	.	.	S	Bend	trans	-142.8	154.8	176.5	55	0	0	0	0	109	V334 L341 V351 P535 V537	V334-T353 HydrophobicContact CG1-CG2 3.85Å; L341-T353 WeakPolarHBondContact CD2-OG1 3.49Å; V351-T353 WeakPolarHBondContact CG1-O 3.3Å; T353-P535 WeakPolarHBondContact CA-O 3.36Å; T353-P535 HydrophobicContact CG2-CB 4.33Å; T353-V537 HydrophobicContact CG2-CG2 3.98Å
354	I	83.8	Confident	80.4	Confident	22 Å²	22	67.9 Å²	67.9	11%	0.113	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.8	-177.6	-63.4	172	0	0	0	109.5	I343 V351 M356 Y534 P535 V536 V537	I343-I354 HydrophobicContact CD1-CB 4.2Å; I343-I354 HydrophobicContact CD1-CD1 3.54Å; I343-I354 HydrophobicContact CD1-CG1 3.53Å; I343-I354 HydrophobicContact CD1-CG2 3.68Å; I343-I354 HydrophobicContact CG1-CB 4.42Å; I343-I354 HydrophobicContact CG1-CD1 4.43Å; I343-I354 HydrophobicContact CG1-CG1 3.89Å; I343-I354 HydrophobicContact CG1-CG2 4.02Å; V351-I354 HydrophobicContact CG1-CG1 4.13Å; I354-M356 PolarHBondContact O-N 3Å; I354-Y534 HydrophobicContact CD1-CD2 3.73Å; I354-Y534 HydrophobicContact CD1-CG 4.23Å; I354-Y534 HydrophobicContact CG1-CD2 4.34Å; I354-Y534 HydrophobicContact CG1-CG 4.49Å; I354-P535 PolarHBondContact N-O 3.44Å; I354-V536 CarbonylContact O-C 3.54Å; I354-V536 WeakPolarHBondContact O-CA 3.43Å; I354-V537 PolarHBondContact O-N 3.38Å
355	S	88	Confident	81.6	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	123.6	169.3	164.8	0	0	0	0	111.6	H338 L341 W357 D358 P539	H338-S355 PolarHBondContact CE1-OG 3.43Å; H338-S355 PolarHBondContact ND1-OG 3.15Å; L341-S355 PolarHBondContact O-N 3.19Å; L341-S355 VanDerWaalsContact O-N 3.07Å; S355-W357 PolarHBondContact O-N 2.84Å; S355-W357 PolarHBondContact OG-N 3.16Å; S355-D358 PolarHBondContact O-N 2.94Å; S355-D358 VanDerWaalsContact O-N 3.09Å; S355-P539 WeakPolarHBondContact OG-CG 3.46Å
356	M	91.3	Very high	83	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-59	-28	174.5	-164.5	175.5	78.7	0	0	112.8	I354 D358 C359 I422 K423 L425 I477 V536 V537 L538	I354-M356 PolarHBondContact O-N 3Å; M356-D358 PolarHBondContact O-N 3.49Å; M356-C359 WeakPolarHBondContact O-CB 3.5Å; M356-C359 PolarHBondContact O-N 3.1Å; M356-C359 VanDerWaalsContact O-N 3.1Å; M356-I422 HydrophobicContact CG-CG2 3.67Å; M356-I422 HydrophobicContact SD-CG2 4.41Å; M356-K423 VanDerWaalsContact O-CA 3.28Å; M356-K423 WeakPolarHBondContact O-CA 3.43Å; M356-K423 WeakPolarHBondContact O-CB 3.37Å; M356-L425 HydrophobicContact CE-CB 4.43Å; M356-L425 WeakPolarHBondContact CE-O 3.2Å; M356-I477 HydrophobicContact CE-CD1 3.76Å; M356-I477 HydrophobicContact SD-CD1 3.93Å; M356-I477 HydrophobicContact SD-CG1 4.46Å; M356-V536 HydrophobicContact CB-CG1 3.75Å; M356-V536 HydrophobicContact CG-CG1 3.85Å; M356-V537 WeakPolarHBondContact CB-O 3.46Å; M356-V537 PolarHBondContact N-O 3.15Å; M356-L538 HydrophobicContact CE-CB 4.06Å; M356-L538 HydrophobicContact CE-CD1 3.44Å; M356-L538 VanDerWaalsContact CE-CD1 3.44Å; M356-L538 HydrophobicContact CE-CG 4.24Å; M356-L538 HydrophobicContact SD-CB 4.39Å
357	W	90.3	Very high	84.4	Confident	24 Å²	24	53.1 Å²	53.1	9%	0.091	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-68.2	-18	178.7	-64.9	-16.1	0	0	0	114	H338 S355 C359 P539 R542 Q619 L623	H338-W357 HydrophobicContact CB-CE3 3.61Å; H338-W357 HydrophobicContact CB-CZ3 3.65Å; H338-W357 AromaticContact CG-CE3 3.66Å; H338-W357 AromaticContact ND1-CE3 3.7Å; S355-W357 PolarHBondContact O-N 2.84Å; S355-W357 PolarHBondContact OG-N 3.16Å; W357-C359 VanDerWaalsContact C-N 3.33Å; W357-P539 HydrophobicContact CD2-CB 4.24Å; W357-P539 HydrophobicContact CD2-CG 3.76Å; W357-P539 HydrophobicContact CE3-CB 4.09Å; W357-P539 HydrophobicContact CE3-CG 3.9Å; W357-P539 HydrophobicContact CG-CG 4.1Å; W357-P539 HydrophobicContact CH2-CB 3.97Å; W357-P539 HydrophobicContact CZ2-CB 4.18Å; W357-P539 HydrophobicContact CZ2-CG 4.46Å; W357-P539 HydrophobicContact CZ3-CB 3.94Å; W357-P539 HydrophobicContact CZ3-CG 4.28Å; W357-R542 HydrophobicContact CZ3-CG 3.82Å; W357-Q619 HydrophobicContact CD2-CG 4.35Å; W357-Q619 VanDerWaalsContact CD2-NE2 3.34Å; W357-Q619 HydrophobicContact CG-CG 4.15Å; W357-L623 HydrophobicContact CH2-CD1 3.98Å; W357-L623 HydrophobicContact CH2-CD2 3.64Å; W357-L623 HydrophobicContact CH2-CG 4.29Å; W357-L623 HydrophobicContact CZ2-CD1 4.23Å; W357-L623 HydrophobicContact CZ2-CD2 3.78Å; W357-L623 HydrophobicContact CZ2-CG 4.25Å; W357-L623 HydrophobicContact CZ3-CD1 4.24Å
358	D	89.8	Confident	85.8	Confident	55 Å²	55	52 Å²	52	29%	0.294	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-83	-14.1	174.8	-65.7	-32.8	0	0	0	112.1	H338 T342 S355 M356 N360	H338-D358 IonicContact CE1-OD1 3.91Å; H338-D358 PolarHBondContact CE1-OD1 3.44Å; H338-D358 IonicContact CE1-OD2 3.74Å; H338-D358 IonicContact NE2-OD1 2.81Å; T342-D358 VanDerWaalsContact CA-OD2 3.31Å; T342-D358 WeakPolarHBondContact CA-OD2 3.29Å; T342-D358 VanDerWaalsContact CB-OD2 3.31Å; T342-D358 WeakPolarHBondContact CB-OD2 3.3Å; T342-D358 PolarHBondContact OG1-OD2 2.83Å; S355-D358 PolarHBondContact O-N 2.94Å; S355-D358 VanDerWaalsContact O-N 3.09Å; M356-D358 PolarHBondContact O-N 3.49Å; D358-N360 PolarHBondContact O-N 3.35Å
359	C	90.8	Very high	87.2	Confident	20 Å²	20	46.1 Å²	46.1	14%	0.135	21%	0.211	C	C	.	.			trans	-80.3	88	-176.4	-58.9	0	0	0	0	111.7	M356 W357 R361 I422 K423	M356-C359 WeakPolarHBondContact O-CB 3.5Å; M356-C359 PolarHBondContact O-N 3.1Å; M356-C359 VanDerWaalsContact O-N 3.1Å; W357-C359 VanDerWaalsContact C-N 3.33Å; C359-R361 VanDerWaalsContact C-N 3.26Å; C359-R361 PolarHBondContact O-N 3.4Å; C359-I422 HydrophobicContact CB-CB 3.79Å; C359-I422 HydrophobicContact CB-CD1 4.32Å; C359-I422 HydrophobicContact CB-CG2 3.65Å; C359-K423 PolarHBondContact O-N 2.93Å; C359-K423 VanDerWaalsContact O-N 3.15Å
360	N	92.4	Very high	88.8	Confident	98 Å²	98	38.1 Å²	38.1	52%	0.524	17%	0.174	S	C	.	.			trans	-77.8	-1.1	178.3	-79.9	-52.5	0	0	0	115.3	D358 K423	D358-N360 PolarHBondContact O-N 3.35Å; N360-K423 WeakPolarHBondContact OD1-CD 3.45Å; N360-K423 VanDerWaalsContact OD1-CE 3.32Å; N360-K423 WeakPolarHBondContact OD1-CE 3.22Å; N360-K423 PolarHBondContact OD1-NZ 3.35Å
361	R	93.9	Very high	90.4	Very high	110 Å²	110	35.3 Å²	35.3	42%	0.415	17%	0.169	S	C	.	.	S	Bend	trans	-72.1	148.7	178.8	-166.4	-171.6	-179.1	164	9	111.1	C359 R364 K421 I422 D530	C359-R361 VanDerWaalsContact C-N 3.26Å; C359-R361 PolarHBondContact O-N 3.4Å; R361-R364 VanDerWaalsContact NH2-NH2 3.14Å; R361-K421 CarbonylContact O-C 3.53Å; R361-K421 VanDerWaalsContact O-CA 3.31Å; R361-K421 WeakPolarHBondContact O-CA 3.25Å; R361-I422 HydrophobicContact CB-CD1 4.08Å; R361-I422 PolarHBondContact O-N 3.41Å; R361-D530 IonicContact CZ-OD2 3.7Å; R361-D530 IonicContact NH1-OD2 3.75Å
362	K	96.7	Very high	91.6	Very high	83 Å²	83	35 Å²	35	36%	0.361	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	140.4	166.9	-71.7	-177.6	176	-175.2	0	111.1	E417 I420	K362-E417 HydrophobicContact CB-CG 3.8Å; K362-E417 HydrophobicContact CD-CG 4.1Å; K362-I420 CarbonylContact C-O 3.09Å; K362-I420 WeakPolarHBondContact CA-O 3.48Å
363	F	97.6	Very high	92.5	Very high	7 Å²	7	35.3 Å²	35.3	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.7	173.4	176.7	-97.3	0	0	0	109.9	I389 F418 I420 I422 L425 L476 L529	F363-I389 HydrophobicContact CD1-CD1 3.52Å; F363-I389 HydrophobicContact CE1-CD1 3.85Å; F363-I389 HydrophobicContact CG-CD1 4.43Å; F363-F418 AromaticContact CD1-CD2 3.5Å; F363-F418 HydrophobicContact CD1-CD2 3.5Å; F363-F418 AromaticContact CD1-CE2 3.89Å; F363-F418 HydrophobicContact CD1-CE2 3.89Å; F363-F418 HydrophobicContact CD1-CG 4.23Å; F363-F418 AromaticContact CE1-CD2 3.92Å; F363-F418 HydrophobicContact CE1-CD2 3.92Å; F363-F418 AromaticContact CE1-CE2 3.79Å; F363-F418 HydrophobicContact CE1-CE2 3.79Å; F363-F418 PolarHBondContact O-N 2.9Å; F363-I420 HydrophobicContact CB-CG2 4.25Å; F363-I420 PolarHBondContact N-O 2.87Å; F363-I422 HydrophobicContact CB-CG1 4.29Å; F363-L425 HydrophobicContact CB-CD1 4.33Å; F363-L425 HydrophobicContact CD2-CD1 3.89Å; F363-L425 HydrophobicContact CG-CD1 4.2Å; F363-L476 HydrophobicContact CE1-CD1 4.4Å; F363-L476 HydrophobicContact CE1-CD2 4.16Å; F363-L476 HydrophobicContact CE2-CD2 3.85Å; F363-L476 HydrophobicContact CZ-CD1 4.25Å; F363-L476 HydrophobicContact CZ-CD2 3.4Å; F363-L476 VanDerWaalsContact CZ-CD2 3.4Å; F363-L476 HydrophobicContact CZ-CG 4.48Å; F363-L529 HydrophobicContact CE2-CD2 4.17Å; F363-L529 HydrophobicContact CZ-CD2 3.75Å
364	R	96.9	Very high	92.8	Very high	53 Å²	53	38.1 Å²	38.1	20%	0.2	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.4	175.9	61.8	176.3	-170.2	165.4	10	111.2	R361 W415 L416 E417 D530	R361-R364 VanDerWaalsContact NH2-NH2 3.14Å; R364-W415 HydrophobicContact CB-CE3 4.07Å; R364-W415 HydrophobicContact CB-CZ3 4.47Å; R364-W415 HydrophobicContact CG-CE3 3.66Å; R364-W415 HydrophobicContact CG-CZ3 3.72Å; R364-L416 CarbonylContact C-O 3.57Å; R364-L416 WeakPolarHBondContact CA-O 3.11Å; R364-L416 VanDerWaalsContact CB-O 3.26Å; R364-L416 WeakPolarHBondContact CB-O 3.4Å; R364-E417 HydrophobicContact CB-CB 4.07Å; R364-E417 HydrophobicContact CB-CG 4.31Å; R364-D530 WeakPolarHBondContact CG-OD2 3.32Å; R364-D530 IonicContact CZ-OD1 3.31Å; R364-D530 VanDerWaalsContact CZ-OD1 3.31Å; R364-D530 IonicContact CZ-OD2 3.82Å; R364-D530 IonicContact NE-OD1 3.03Å; R364-D530 PolarHBondContact NE-OD1 3.38Å; R364-D530 IonicContact NE-OD2 2.9Å; R364-D530 PolarHBondContact NE-OD2 3.36Å; R364-D530 IonicContact NH2-OD1 2.75Å; R364-D530 PolarHBondContact NH2-OD1 2.86Å; R364-D530 IonicContact NH2-OD2 3.87Å
365	V	97.9	Very high	92.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	140	173.5	66	0	0	0	0	109	L416 F418 L431 I527 L529	V365-L416 HydrophobicContact CG1-CB 4.14Å; V365-L416 PolarHBondContact N-O 3.29Å; V365-L416 PolarHBondContact O-N 3.32Å; V365-F418 HydrophobicContact CB-CE2 4.46Å; V365-F418 HydrophobicContact CG1-CE2 3.71Å; V365-F418 HydrophobicContact CG1-CZ 4.14Å; V365-L431 HydrophobicContact CB-CD2 4.45Å; V365-L431 HydrophobicContact CG2-CD2 4.19Å; V365-I527 HydrophobicContact CG2-CB 3.99Å; V365-I527 HydrophobicContact CG2-CD1 4.26Å; V365-I527 HydrophobicContact CG2-CG2 4.4Å; V365-L529 HydrophobicContact CB-CD2 4.06Å; V365-L529 HydrophobicContact CG2-CD2 3.77Å
366	K	98.2	Very high	91.7	Very high	40 Å²	40	42.8 Å²	42.8	17%	0.174	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.8	171.5	-162.3	-176.2	-175	-165.2	0	109.3	L368 N413 C414 W415 I527 L528	K366-L368 HydrophobicContact CD-CD2 3.97Å; K366-L368 HydrophobicContact CG-CD2 4.34Å; K366-N413 WeakPolarHBondContact CE-OD1 3.46Å; K366-N413 PolarHBondContact NZ-OD1 2.96Å; K366-C414 CarbonylContact C-O 3.44Å; K366-C414 VanDerWaalsContact CA-O 3.28Å; K366-C414 WeakPolarHBondContact CA-O 3.39Å; K366-C414 WeakPolarHBondContact CG-O 3.44Å; K366-W415 HydrophobicContact CB-CD2 3.72Å; K366-W415 HydrophobicContact CB-CE3 3.71Å; K366-W415 HydrophobicContact CB-CG 4.37Å; K366-W415 HydrophobicContact CB-CH2 4.01Å; K366-W415 HydrophobicContact CB-CZ2 4.02Å; K366-W415 HydrophobicContact CB-CZ3 3.85Å; K366-W415 HydrophobicContact CD-CD2 4.33Å; K366-W415 HydrophobicContact CD-CZ2 3.97Å; K366-W415 HydrophobicContact CG-CD2 3.96Å; K366-W415 HydrophobicContact CG-CE3 4.45Å; K366-W415 HydrophobicContact CG-CG 4.18Å; K366-W415 HydrophobicContact CG-CZ2 4.37Å; K366-I527 CarbonylContact O-C 3.47Å; K366-I527 VanDerWaalsContact O-CA 3.25Å; K366-I527 WeakPolarHBondContact O-CA 3.42Å; K366-L528 HydrophobicContact CB-CB 4.05Å; K366-L528 WeakPolarHBondContact CB-O 3.19Å; K366-L528 HydrophobicContact CD-CD2 3.96Å; K366-L528 PolarHBondContact N-O 2.5Å; K366-L528 PolarHBondContact O-N 3Å
367	V	97.8	Very high	90.5	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	111.7	172.5	-179.7	0	0	0	0	107.5	I385 T401 W412 N413 C414 L416 I525	V367-I385 HydrophobicContact CG1-CG1 4.11Å; V367-T401 HydrophobicContact CB-CG2 4.26Å; V367-T401 HydrophobicContact CG1-CG2 4.35Å; V367-T401 HydrophobicContact CG2-CG2 4.21Å; V367-W412 HydrophobicContact CG1-CB 4.4Å; V367-W412 HydrophobicContact CG1-CE3 4.34Å; V367-N413 VanDerWaalsContact O-CA 3.26Å; V367-N413 WeakPolarHBondContact O-CA 3.4Å; V367-N413 PolarHBondContact O-N 3.29Å; V367-C414 PolarHBondContact N-O 3.05Å; V367-C414 PolarHBondContact O-N 2.67Å; V367-C414 VanDerWaalsContact O-N 3.1Å; V367-L416 HydrophobicContact CG2-CD1 3.76Å; V367-L416 HydrophobicContact CG2-CG 4.26Å; V367-I525 HydrophobicContact CG1-CD1 4.49Å
368	L	97.3	Very high	89.1	Confident	48 Å²	48	55.8 Å²	55.8	25%	0.251	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-57.2	179.9	-60.4	174.3	0	0	0	109.7	K366 L411 W412 N413 A526	K366-L368 HydrophobicContact CD-CD2 3.97Å; K366-L368 HydrophobicContact CG-CD2 4.34Å; L368-L411 CarbonylContact O-C 3.51Å; L368-L411 WeakPolarHBondContact O-CA 3.22Å; L368-W412 PolarHBondContact O-N 2.7Å; L368-N413 PolarHBondContact O-N 2.97Å; L368-A526 HydrophobicContact CB-CB 4.03Å; L368-A526 WeakPolarHBondContact CB-O 3.34Å; L368-A526 HydrophobicContact CD1-CB 4.2Å; L368-A526 PolarHBondContact N-O 3.15Å
369	G	95.9	Very high	87.3	Confident	5 Å²	5	58.2 Å²	58.2	5%	0.052	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.2	179	180	0	0	0	0	0	113.3	V410 A526	G369-V410 CarbonylContact C-O 3.4Å; G369-V410 WeakPolarHBondContact CA-O 3.48Å; G369-A526 PolarHBondContact N-O 2.86Å; G369-A526 PolarHBondContact O-N 3.34Å
370	I	95.9	Very high	85.7	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	150.3	170.6	63.3	-177	0	0	0	110	V383 I385 F406 E409 V410 W412 V435 M523 A524 I525	I370-V383 HydrophobicContact CD1-CG2 4.46Å; I370-I385 HydrophobicContact CG2-CD1 3.75Å; I370-F406 HydrophobicContact CD1-CE2 4.27Å; I370-E409 WeakPolarHBondContact O-CA 3.36Å; I370-V410 HydrophobicContact CD1-CB 4.24Å; I370-V410 HydrophobicContact CD1-CG2 4.38Å; I370-V410 HydrophobicContact CG1-CB 3.84Å; I370-V410 HydrophobicContact CG1-CG2 4.29Å; I370-V410 PolarHBondContact N-O 2.63Å; I370-V410 PolarHBondContact O-N 3.42Å; I370-W412 HydrophobicContact CD1-CH2 4.12Å; I370-W412 HydrophobicContact CD1-CZ3 4.03Å; I370-W412 HydrophobicContact CG1-CZ3 3.97Å; I370-W412 HydrophobicContact CG2-CZ3 4.31Å; I370-V435 HydrophobicContact CD1-CG1 4.21Å; I370-V435 HydrophobicContact CG2-CG2 4.39Å; I370-M523 HydrophobicContact CB-SD 4.43Å; I370-M523 HydrophobicContact CD1-SD 4.12Å; I370-A524 CarbonylContact C-O 3.32Å; I370-A524 VanDerWaalsContact CA-O 3.23Å; I370-A524 WeakPolarHBondContact CA-O 3.41Å; I370-I525 HydrophobicContact CG2-CB 3.99Å; I370-I525 HydrophobicContact CG2-CD1 4.16Å; I370-I525 HydrophobicContact CG2-CG1 3.88Å
371	D	94.6	Very high	84.9	Confident	81 Å²	81	62 Å²	62	43%	0.433	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.3	177.2	-174.9	-92.7	0	0	0	109.6	E408 M523 A524	D371-E408 CarbonylContact C-O 3.58Å; D371-E408 WeakPolarHBondContact CA-O 3.38Å; D371-M523 CarbonylContact O-C 3.51Å; D371-M523 VanDerWaalsContact O-CA 3.28Å; D371-M523 WeakPolarHBondContact O-CA 3.27Å; D371-M523 VanDerWaalsContact O-CG 3.31Å; D371-M523 WeakPolarHBondContact O-CG 3.35Å; D371-A524 PolarHBondContact N-O 3.05Å; D371-A524 PolarHBondContact O-N 3.48Å
372	I	91.1	Very high	84.6	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.036	31%	0.311	C	S	.	.			trans	-132.8	126	175.5	-169.5	172.6	0	0	0	111.1	S374 L375 F406 E408 Y470 M523	I372-S374 VanDerWaalsContact C-N 3.26Å; I372-S374 WeakPolarHBondContact CD1-O 3.41Å; I372-S374 PolarHBondContact O-N 3.04Å; I372-L375 HydrophobicContact CG2-CD2 4.23Å; I372-F406 HydrophobicContact CG2-CE2 4.26Å; I372-F406 HydrophobicContact CG2-CZ 4.4Å; I372-E408 PolarHBondContact N-O 3.39Å; I372-Y470 HydrophobicContact CD1-CE2 4.37Å; I372-Y470 VanDerWaalsContact CD1-OH 3.24Å; I372-Y470 WeakPolarHBondContact CD1-OH 3.17Å; I372-M523 HydrophobicContact CB-CB 4.05Å; I372-M523 HydrophobicContact CB-CG 3.94Å; I372-M523 HydrophobicContact CB-SD 4.36Å; I372-M523 HydrophobicContact CD1-CB 4.11Å; I372-M523 HydrophobicContact CG1-CB 4.01Å; I372-M523 HydrophobicContact CG1-CG 4.44Å
373	P	86.7	Confident	84.3	Confident	66 Å²	66	55.4 Å²	55.4	43%	0.429	29%	0.293	S	S	.	.	S	Bend	trans	-63.9	-25.2	-177.8	-27.1	35.4	0	0	0	115.4	A520 S522	P373-A520 WeakPolarHBondContact CG-O 3.46Å; P373-S522 WeakPolarHBondContact CD-O 3.43Å
374	S	81.4	Confident	84.2	Confident	77 Å²	77	55.7 Å²	55.7	54%	0.538	30%	0.295	S	S	.	.	S	Bend	trans	-145.3	123.7	177.7	63	0	0	0	0	111.7	I372	I372-S374 VanDerWaalsContact C-N 3.26Å; I372-S374 WeakPolarHBondContact CD1-O 3.41Å; I372-S374 PolarHBondContact O-N 3.04Å
375	L	76.8	Confident	84.1	Confident	66 Å²	66	53.2 Å²	53.2	35%	0.346	29%	0.285	S	S	.	.			trans	-71.9	143.1	178.4	-82.1	164.5	0	0	0	111.8	I372 F406 E408	I372-L375 HydrophobicContact CG2-CD2 4.23Å; L375-F406 HydrophobicContact CD2-CD1 4.25Å; L375-F406 HydrophobicContact CD2-CD2 4.26Å; L375-F406 HydrophobicContact CD2-CE1 4.27Å; L375-F406 HydrophobicContact CD2-CE2 4.26Å; L375-F406 HydrophobicContact CD2-CG 4.25Å; L375-F406 HydrophobicContact CD2-CZ 4.27Å; L375-E408 HydrophobicContact CD1-CG 3.64Å; L375-E408 HydrophobicContact CG-CG 3.84Å
376	P	72.6	Confident	84	Confident	54 Å²	54	54.1 Å²	54.1	35%	0.351	29%	0.29	S	S	.	.			trans	-58.4	142.1	168.5	-22.2	33.8	0	0	0	111.5	V378 F406	P376-V378 PolarHBondContact O-N 3.22Å; P376-F406 HydrophobicContact CG-CE1 3.97Å
377	K	65.7	Low	84	Confident	215 Å²	215	52.2 Å²	52.2	94%	0.935	28%	0.282	S	S	*	.	S	Bend	trans	-66.6	8.3	-173.5	-64.5	-176	177.9	-178.9	0	116.1
378	V	60.2	Low	83.9	Confident	82 Å²	82	52.3 Å²	52.3	50%	0.497	28%	0.282	S	S	.	.	S	Bend	trans	-105.7	120	-177.2	-173.1	0	0	0	0	108.7	P376 F381	P376-V378 PolarHBondContact O-N 3.22Å; V378-F381 HydrophobicContact CB-CE2 3.68Å; V378-F381 HydrophobicContact CB-CZ 4.1Å; V378-F381 HydrophobicContact CG1-CE2 3.79Å; V378-F381 HydrophobicContact CG1-CZ 3.7Å; V378-F381 HydrophobicContact CG2-CE2 4.47Å
379	P	52.1	Low	83.9	Confident	107 Å²	107	50 Å²	50	70%	0.695	27%	0.27	S	S	*	.			trans	-79.7	144.9	-176.1	32.3	-31.5	0	0	0	110.7
380	E	58.6	Low	83.9	Confident	158 Å²	158	52.4 Å²	52.4	74%	0.738	28%	0.279	S	S	*	.			trans	80.1	51.4	167.7	-54.1	179.1	178.6	0	0	118.3
381	F	75.8	Confident	83.8	Confident	40 Å²	40	52.3 Å²	52.3	18%	0.175	28%	0.279	C	S	.	.			trans	-95.3	137.2	164.4	-67.8	-48.6	0	0	0	112.5	V378 F406 C437	V378-F381 HydrophobicContact CB-CE2 3.68Å; V378-F381 HydrophobicContact CB-CZ 4.1Å; V378-F381 HydrophobicContact CG1-CE2 3.79Å; V378-F381 HydrophobicContact CG1-CZ 3.7Å; V378-F381 HydrophobicContact CG2-CE2 4.47Å; F381-F406 HydrophobicContact CB-CB 4.31Å; F381-F406 HydrophobicContact CB-CD1 4.49Å; F381-F406 VanDerWaalsContact O-CB 3.29Å; F381-F406 WeakPolarHBondContact O-CB 3.32Å; F381-F406 PolarHBondContact O-N 3.3Å; F381-C437 VanDerWaalsContact CB-SG 3.51Å; F381-C437 WeakPolarHBondContact CD1-SG 3Å; F381-C437 WeakPolarHBondContact CG-SG 3.42Å
382	M	86.6	Confident	83.5	Confident	53 Å²	53	48.5 Å²	48.5	26%	0.261	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.5	163.6	-68.1	-69	-72.8	0	0	108	S403 K404 C437 G438	M382-S403 WeakPolarHBondContact CE-O 3.35Å; M382-K404 CarbonylContact C-O 3.56Å; M382-K404 WeakPolarHBondContact CA-O 3.41Å; M382-C437 CarbonylContact O-C 3.59Å; M382-C437 WeakPolarHBondContact O-CA 3.18Å; M382-G438 PolarHBondContact N-O 2.81Å; M382-G438 PolarHBondContact O-N 3.08Å
383	V	91.4	Very high	83.1	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	147	177.5	-70.3	0	0	0	0	111.3	I370 S403 K404 F406 W412 V435 I436 C437 L469	I370-V383 HydrophobicContact CD1-CG2 4.46Å; V383-S403 CarbonylContact O-C 3.5Å; V383-S403 WeakPolarHBondContact O-CA 3.25Å; V383-K404 PolarHBondContact N-O 2.78Å; V383-K404 PolarHBondContact O-N 3.27Å; V383-F406 HydrophobicContact CB-CB 4.41Å; V383-F406 HydrophobicContact CB-CD2 4.48Å; V383-F406 HydrophobicContact CB-CG 4.48Å; V383-F406 HydrophobicContact CG1-CB 3.76Å; V383-F406 HydrophobicContact CG1-CD1 3.96Å; V383-F406 HydrophobicContact CG1-CD2 3.94Å; V383-F406 HydrophobicContact CG1-CG 3.62Å; V383-F406 HydrophobicContact CG2-CB 3.84Å; V383-F406 HydrophobicContact CG2-CD2 3.8Å; V383-F406 HydrophobicContact CG2-CG 4.03Å; V383-W412 HydrophobicContact CG2-CH2 4.19Å; V383-V435 HydrophobicContact CB-CG1 4.17Å; V383-V435 HydrophobicContact CG1-CG1 4.19Å; V383-I436 VanDerWaalsContact CA-O 3.27Å; V383-I436 WeakPolarHBondContact CA-O 3.1Å; V383-C437 HydrophobicContact CG1-CB 4.35Å; V383-L469 HydrophobicContact CG1-CD1 4.46Å
384	F	94.2	Very high	83.3	Confident	14 Å²	14	51 Å²	51	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	160.5	166.8	63.4	-87.5	0	0	0	109.4	E386 R400 I436	F384-E386 HydrophobicContact CE2-CB 4.35Å; F384-R400 HydrophobicContact CD2-CB 4.41Å; F384-R400 HydrophobicContact CD2-CG 4.43Å; F384-R400 HydrophobicContact CE2-CG 4.28Å; F384-I436 HydrophobicContact CD2-CB 4.44Å; F384-I436 HydrophobicContact CE1-CB 3.97Å; F384-I436 HydrophobicContact CE1-CG2 3.77Å; F384-I436 HydrophobicContact CE2-CB 3.9Å; F384-I436 HydrophobicContact CE2-CD1 3.97Å; F384-I436 HydrophobicContact CE2-CG1 4.4Å; F384-I436 HydrophobicContact CE2-CG2 4.26Å; F384-I436 HydrophobicContact CZ-CB 3.64Å; F384-I436 HydrophobicContact CZ-CD1 4.13Å; F384-I436 HydrophobicContact CZ-CG1 4.45Å; F384-I436 HydrophobicContact CZ-CG2 3.51Å; F384-I436 PolarHBondContact N-O 2.87Å; F384-I436 PolarHBondContact O-N 3.38Å
385	I	95.4	Very high	83.9	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.4	175.7	-51.6	-59.8	0	0	0	108	V367 I370 R400 T401 W412 L433 Q434 V435 I525	V367-I385 HydrophobicContact CG1-CG1 4.11Å; I370-I385 HydrophobicContact CG2-CD1 3.75Å; I385-R400 WeakPolarHBondContact O-CA 3.44Å; I385-T401 HydrophobicContact CB-CG2 3.88Å; I385-T401 HydrophobicContact CG1-CG2 4.44Å; I385-T401 PolarHBondContact N-OG1 3.46Å; I385-T401 PolarHBondContact O-N 2.93Å; I385-W412 HydrophobicContact CD1-CH2 4.04Å; I385-W412 HydrophobicContact CD1-CZ3 3.95Å; I385-W412 HydrophobicContact CG1-CD2 4.47Å; I385-W412 HydrophobicContact CG1-CE3 4.02Å; I385-W412 HydrophobicContact CG1-CH2 3.86Å; I385-W412 HydrophobicContact CG1-CZ2 4.32Å; I385-W412 HydrophobicContact CG1-CZ3 3.69Å; I385-L433 HydrophobicContact CG2-CD2 4.5Å; I385-Q434 WeakPolarHBondContact CA-O 3.42Å; I385-V435 HydrophobicContact CD1-CB 4.27Å; I385-V435 HydrophobicContact CD1-CG1 4.33Å; I385-V435 HydrophobicContact CD1-CG2 3.5Å; I385-I525 HydrophobicContact CD1-CD1 4.22Å; I385-I525 HydrophobicContact CG1-CD1 4.45Å; I385-I525 HydrophobicContact CG2-CD1 3.97Å
386	E	96.4	Very high	84.8	Confident	20 Å²	20	49.6 Å²	49.6	9%	0.093	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.9	166.7	177.3	169.1	104.9	0	0	108.5	F384 Q398 R400 Q434 I436	F384-E386 HydrophobicContact CE2-CB 4.35Å; E386-Q398 HydrophobicContact CG-CG 4.36Å; E386-Q398 PolarHBondContact OE1-NE2 3.01Å; E386-Q398 PolarHBondContact OE2-NE2 3.27Å; E386-R400 HydrophobicContact CB-CG 4.24Å; E386-R400 HydrophobicContact CG-CG 4.2Å; E386-R400 IonicContact OE2-CZ 3.13Å; E386-R400 IonicContact OE2-NE 3.4Å; E386-R400 PolarHBondContact OE2-NE 2.8Å; E386-R400 IonicContact OE2-NH2 2.73Å; E386-R400 PolarHBondContact OE2-NH2 3.49Å; E386-Q434 HydrophobicContact CB-CB 4.31Å; E386-Q434 PolarHBondContact N-O 3.46Å; E386-Q434 PolarHBondContact O-N 3.41Å; E386-I436 HydrophobicContact CB-CD1 3.7Å; E386-I436 HydrophobicContact CB-CG1 4.45Å; E386-I436 HydrophobicContact CG-CD1 4.35Å
387	A	97.3	Very high	85.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.2	177	0	0	0	0	0	108.6	Q398 E399 L416 F418 L431 N432 L433	A387-Q398 WeakPolarHBondContact O-CA 3.48Å; A387-E399 PolarHBondContact N-O 3.25Å; A387-E399 PolarHBondContact O-N 3.35Å; A387-E399 VanDerWaalsContact O-O 3.12Å; A387-L416 HydrophobicContact CB-CD1 3.81Å; A387-F418 HydrophobicContact CB-CE1 4.32Å; A387-F418 HydrophobicContact CB-CZ 3.77Å; A387-F418 WeakPolarHBondContact O-CE1 3.39Å; A387-L431 HydrophobicContact CB-CD1 4.36Å; A387-N432 WeakPolarHBondContact CA-O 3.46Å; A387-L433 HydrophobicContact CB-CD2 3.67Å
388	S	96.7	Very high	87.4	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.014	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.8	-174.1	-64.8	0	0	0	0	110.4	A397 Q398 N432	S388-A397 CarbonylContact C-O 3.53Å; S388-A397 WeakPolarHBondContact CA-O 3.43Å; S388-Q398 WeakPolarHBondContact OG-CG 3.34Å; S388-N432 PolarHBondContact N-O 3.01Å; S388-N432 PolarHBondContact O-N 2.96Å
389	I	97.2	Very high	89.2	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.3	177.2	-58.6	175.4	0	0	0	108.3	F363 L396 A397 F418 I420 L425 R430 L431 L476	F363-I389 HydrophobicContact CD1-CD1 3.52Å; F363-I389 HydrophobicContact CE1-CD1 3.85Å; F363-I389 HydrophobicContact CG-CD1 4.43Å; I389-L396 HydrophobicContact CB-CB 4.47Å; I389-L396 HydrophobicContact CG2-CB 4.23Å; I389-L396 HydrophobicContact CG2-CD1 4.21Å; I389-L396 WeakPolarHBondContact O-CB 3.43Å; I389-L396 PolarHBondContact O-N 3.46Å; I389-A397 HydrophobicContact CD1-CB 4.5Å; I389-A397 PolarHBondContact N-O 3.33Å; I389-F418 HydrophobicContact CD1-CB 4.21Å; I389-F418 HydrophobicContact CD1-CD1 3.77Å; I389-F418 HydrophobicContact CD1-CD2 4.08Å; I389-F418 HydrophobicContact CD1-CE1 4.08Å; I389-F418 HydrophobicContact CD1-CE2 4.35Å; I389-F418 HydrophobicContact CD1-CG 3.76Å; I389-F418 HydrophobicContact CD1-CZ 4.36Å; I389-F418 HydrophobicContact CG1-CD1 4.07Å; I389-F418 HydrophobicContact CG1-CE1 3.97Å; I389-F418 HydrophobicContact CG1-CZ 4.33Å; I389-I420 HydrophobicContact CD1-CG2 3.82Å; I389-L425 HydrophobicContact CD1-CD2 4.47Å; I389-L425 HydrophobicContact CG2-CD2 4.2Å; I389-R430 WeakPolarHBondContact CA-O 3.4Å; I389-L431 HydrophobicContact CG1-CD1 4.23Å; I389-L476 HydrophobicContact CD1-CD1 4.29Å; I389-L476 HydrophobicContact CG1-CD1 4.39Å; I389-L476 HydrophobicContact CG2-CD1 4.02Å
390	F	94.9	Very high	91.2	Very high	54 Å²	54	41.4 Å²	41.4	24%	0.237	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	148.6	-179.7	-70	-84.9	0	0	0	112	Q394 L395 A429 R430 N432	F390-Q394 VanDerWaalsContact CA-O 3.32Å; F390-Q394 WeakPolarHBondContact CA-O 3.48Å; F390-L395 HydrophobicContact CD1-CB 4.14Å; F390-L395 HydrophobicContact CD1-CD1 4.17Å; F390-L395 HydrophobicContact CE1-CB 3.77Å; F390-L395 HydrophobicContact CE1-CD1 3.69Å; F390-L395 HydrophobicContact CE1-CG 4.33Å; F390-L395 HydrophobicContact CE2-CD1 4.13Å; F390-L395 HydrophobicContact CZ-CD1 3.67Å; F390-A429 WeakPolarHBondContact O-CA 3.48Å; F390-R430 PolarHBondContact N-O 3.39Å; F390-R430 PolarHBondContact O-N 2.88Å; F390-N432 HydrophobicContact CD2-CB 3.87Å; F390-N432 HydrophobicContact CE2-CB 4Å
391	H	93.9	Very high	93	Very high	3 Å²	3	34.6 Å²	34.6	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.3	162.6	178.9	-92.4	0	0	0	108.6	Q393 Q394 L396 P426 K427 W616	H391-Q393 PolarHBondContact O-N 3.32Å; H391-Q394 PolarHBondContact N-O 3.37Å; H391-Q394 WeakPolarHBondContact O-CB 3.37Å; H391-Q394 PolarHBondContact O-N 2.99Å; H391-L396 HydrophobicContact CB-CD1 3.91Å; H391-L396 HydrophobicContact CB-CD2 4.47Å; H391-L396 HydrophobicContact CB-CG 4.32Å; H391-P426 HydrophobicContact CB-CG 3.9Å; H391-P426 VanDerWaalsContact CD2-CG 3.5Å; H391-P426 WeakPolarHBondContact CD2-CG 3.33Å; H391-K427 PolarHBondContact CD2-O 3.46Å; H391-K427 PolarHBondContact NE2-O 2.98Å; H391-W616 HydrophobicContact CB-CB 4.36Å; H391-W616 AromaticContact CE1-CD2 3.46Å; H391-W616 VanDerWaalsContact CE1-CD2 3.46Å; H391-W616 AromaticContact CE1-CE3 3.55Å; H391-W616 AromaticContact CE1-CG 3.7Å; H391-W616 AromaticContact ND1-CD1 3.81Å; H391-W616 AromaticContact ND1-CD2 3.65Å; H391-W616 AromaticContact ND1-CG 3.35Å; H391-W616 VanDerWaalsContact ND1-CG 3.35Å
392	G	88	Confident	93.8	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	-129	-160.6	0	0	0	0	0	109.9	R430 C651 S654	G392-R430 PolarHBondContact O-NH2 2.99Å; G392-C651 CarbonylContact C-O 3.57Å; G392-C651 WeakPolarHBondContact CA-O 3.48Å; G392-S654 WeakPolarHBondContact CA-OG 3.37Å; G392-S654 PolarHBondContact N-OG 2.77Å
393	Q	84.3	Confident	94.1	Very high	59 Å²	59	38 Å²	38	28%	0.276	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.9	170	-63.4	-162.1	5.7	0	0	114	H391 L395 I506 C651 H652	H391-Q393 PolarHBondContact O-N 3.32Å; Q393-L395 PolarHBondContact O-N 2.89Å; Q393-I506 VanDerWaalsContact OE1-CD1 3.23Å; Q393-C651 PolarHBondContact NE2-SG 2.9Å; Q393-H652 PolarHBondContact OE1-NE2 2.81Å
394	Q	89.9	Confident	94.1	Very high	65 Å²	65	41.4 Å²	41.4	30%	0.304	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.9	-178.2	-172	-179.5	29.6	0	0	110.6	F390 H391 L396 W616	F390-Q394 VanDerWaalsContact CA-O 3.32Å; F390-Q394 WeakPolarHBondContact CA-O 3.48Å; H391-Q394 PolarHBondContact N-O 3.37Å; H391-Q394 WeakPolarHBondContact O-CB 3.37Å; H391-Q394 PolarHBondContact O-N 2.99Å; Q394-L396 HydrophobicContact CG-CD2 4.11Å; Q394-L396 PolarHBondContact O-N 2.97Å; Q394-W616 VanDerWaalsContact OE1-CD1 3.23Å
395	L	93.8	Very high	93.8	Very high	79 Å²	79	44.5 Å²	44.5	41%	0.414	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	122.8	169	-178.2	67	0	0	0	109.8	F390 Q393 Q398	F390-L395 HydrophobicContact CD1-CB 4.14Å; F390-L395 HydrophobicContact CD1-CD1 4.17Å; F390-L395 HydrophobicContact CE1-CB 3.77Å; F390-L395 HydrophobicContact CE1-CD1 3.69Å; F390-L395 HydrophobicContact CE1-CG 4.33Å; F390-L395 HydrophobicContact CE2-CD1 4.13Å; F390-L395 HydrophobicContact CZ-CD1 3.67Å; Q393-L395 PolarHBondContact O-N 2.89Å; L395-Q398 HydrophobicContact CD1-CB 4.24Å; L395-Q398 HydrophobicContact CD2-CB 4.3Å
396	L	95.7	Very high	93.5	Very high	35 Å²	35	45.5 Å²	45.5	18%	0.183	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-43	178.6	-56.5	-173	0	0	0	112.1	I389 H391 Q394 I420 P426	I389-L396 HydrophobicContact CB-CB 4.47Å; I389-L396 HydrophobicContact CG2-CB 4.23Å; I389-L396 HydrophobicContact CG2-CD1 4.21Å; I389-L396 WeakPolarHBondContact O-CB 3.43Å; I389-L396 PolarHBondContact O-N 3.46Å; H391-L396 HydrophobicContact CB-CD1 3.91Å; H391-L396 HydrophobicContact CB-CD2 4.47Å; H391-L396 HydrophobicContact CB-CG 4.32Å; Q394-L396 HydrophobicContact CG-CD2 4.11Å; Q394-L396 PolarHBondContact O-N 2.97Å; L396-I420 HydrophobicContact CB-CD1 3.99Å; L396-I420 HydrophobicContact CD1-CD1 4.13Å; L396-P426 HydrophobicContact CD1-CG 3.98Å
397	A	96.3	Very high	93.1	Very high	11 Å²	11	48.6 Å²	48.6	9%	0.091	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	155.4	177.2	0	0	0	0	0	110.6	S388 I389 F418 I420	S388-A397 CarbonylContact C-O 3.53Å; S388-A397 WeakPolarHBondContact CA-O 3.43Å; I389-A397 HydrophobicContact CD1-CB 4.5Å; I389-A397 PolarHBondContact N-O 3.33Å; A397-F418 HydrophobicContact CB-CB 3.96Å; A397-F418 HydrophobicContact CB-CD1 3.83Å; A397-F418 HydrophobicContact CB-CG 4.36Å; A397-I420 HydrophobicContact CB-CB 4.27Å; A397-I420 HydrophobicContact CB-CG2 3.99Å
398	Q	96.8	Very high	92.7	Very high	69 Å²	69	54.1 Å²	54.1	32%	0.322	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	138	-177.2	177	175	5.2	0	0	110.7	E386 A387 S388 L395	E386-Q398 HydrophobicContact CG-CG 4.36Å; E386-Q398 PolarHBondContact OE1-NE2 3.01Å; E386-Q398 PolarHBondContact OE2-NE2 3.27Å; A387-Q398 WeakPolarHBondContact O-CA 3.48Å; S388-Q398 WeakPolarHBondContact OG-CG 3.34Å; L395-Q398 HydrophobicContact CD1-CB 4.24Å; L395-Q398 HydrophobicContact CD2-CB 4.3Å
399	E	97.2	Very high	92.5	Very high	69 Å²	69	59.7 Å²	59.7	32%	0.322	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	158.9	177.4	-65.6	-59.2	155.2	0	0	110.6	A387 L416 F418	A387-E399 PolarHBondContact N-O 3.25Å; A387-E399 PolarHBondContact O-N 3.35Å; A387-E399 VanDerWaalsContact O-O 3.12Å; E399-L416 HydrophobicContact CB-CB 4.05Å; E399-L416 HydrophobicContact CB-CD1 4.38Å; E399-L416 HydrophobicContact CB-CD2 4.45Å; E399-F418 HydrophobicContact CB-CD1 4.28Å; E399-F418 HydrophobicContact CB-CE1 4.04Å; E399-F418 HydrophobicContact CB-CZ 4.41Å; E399-F418 HydrophobicContact CG-CD1 3.69Å; E399-F418 HydrophobicContact CG-CE1 3.97Å; E399-F418 HydrophobicContact CG-CG 4.03Å
400	R	95.8	Very high	92.3	Very high	138 Å²	138	60 Å²	60	52%	0.521	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	148.4	-177.7	-65.4	176.6	177.2	158.6	2.3	112.2	F384 I385 E386	F384-R400 HydrophobicContact CD2-CB 4.41Å; F384-R400 HydrophobicContact CD2-CG 4.43Å; F384-R400 HydrophobicContact CE2-CG 4.28Å; I385-R400 WeakPolarHBondContact O-CA 3.44Å; E386-R400 HydrophobicContact CB-CG 4.24Å; E386-R400 HydrophobicContact CG-CG 4.2Å; E386-R400 IonicContact OE2-CZ 3.13Å; E386-R400 IonicContact OE2-NE 3.4Å; E386-R400 PolarHBondContact OE2-NE 2.8Å; E386-R400 IonicContact OE2-NH2 2.73Å; E386-R400 PolarHBondContact OE2-NH2 3.49Å
401	T	96.2	Very high	92.4	Very high	14 Å²	14	62 Å²	62	9%	0.086	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-84.3	171.1	170.6	69	0	0	0	0	111.9	V367 I385 W412 L416	V367-T401 HydrophobicContact CB-CG2 4.26Å; V367-T401 HydrophobicContact CG1-CG2 4.35Å; V367-T401 HydrophobicContact CG2-CG2 4.21Å; I385-T401 HydrophobicContact CB-CG2 3.88Å; I385-T401 HydrophobicContact CG1-CG2 4.44Å; I385-T401 PolarHBondContact N-OG1 3.46Å; I385-T401 PolarHBondContact O-N 2.93Å; T401-W412 HydrophobicContact CG2-CG 4.26Å; T401-W412 PolarHBondContact OG1-NE1 3.32Å; T401-L416 HydrophobicContact CG2-CD1 4Å; T401-L416 HydrophobicContact CG2-CD2 4.13Å; T401-L416 HydrophobicContact CG2-CG 4.4Å
402	T	93	Very high	92.5	Very high	97 Å²	97	62.8 Å²	62.8	60%	0.595	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-70.9	144.9	172	50.6	0	0	0	0	111.1	W412	T402-W412 PolarHBondContact O-NE1 2.94Å
403	S	92.3	Very high	92.9	Very high	67 Å²	67	67.7 Å²	67.7	47%	0.469	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-68.7	134.5	175.9	-54.3	0	0	0	0	111.7	M382 V383	M382-S403 WeakPolarHBondContact CE-O 3.35Å; V383-S403 CarbonylContact O-C 3.5Å; V383-S403 WeakPolarHBondContact O-CA 3.25Å
404	K	91.6	Very high	93.5	Very high	72 Å²	72	66.6 Å²	66.6	31%	0.313	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	157.6	176.6	-67.2	-167.5	176.6	-162.1	0	111.1	M382 V383 F406 V410 L411 W412	M382-K404 CarbonylContact C-O 3.56Å; M382-K404 WeakPolarHBondContact CA-O 3.41Å; V383-K404 PolarHBondContact N-O 2.78Å; V383-K404 PolarHBondContact O-N 3.27Å; K404-F406 PolarHBondContact O-N 3.04Å; K404-V410 HydrophobicContact CB-CG1 3.75Å; K404-V410 HydrophobicContact CD-CG1 3.93Å; K404-V410 HydrophobicContact CG-CG1 4.43Å; K404-L411 PolarHBondContact NZ-O 3.17Å; K404-W412 HydrophobicContact CB-CZ2 4.13Å; K404-W412 HydrophobicContact CD-CD2 4.39Å; K404-W412 HydrophobicContact CD-CG 4.46Å; K404-W412 HydrophobicContact CD-CZ2 4.44Å; K404-W412 HydrophobicContact CG-CZ2 4.28Å
405	T	88.3	Confident	93.8	Very high	80 Å²	80	68.1 Å²	68.1	49%	0.491	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	134.8	174.2	-49.8	0	0	0	0	110.2	N407 V410	T405-N407 PolarHBondContact O-N 3.1Å; T405-V410 WeakPolarHBondContact O-CG2 3.44Å
406	F	89	Confident	94	Very high	20 Å²	20	65 Å²	65	9%	0.088	33%	0.328	C	S	.	.			trans	-78.2	107.4	179.3	-167.8	-157.2	0	0	0	110.9	I370 I372 L375 P376 F381 V383 K404 V410 L469 Y470 M523	I370-F406 HydrophobicContact CD1-CE2 4.27Å; I372-F406 HydrophobicContact CG2-CE2 4.26Å; I372-F406 HydrophobicContact CG2-CZ 4.4Å; L375-F406 HydrophobicContact CD2-CD1 4.25Å; L375-F406 HydrophobicContact CD2-CD2 4.26Å; L375-F406 HydrophobicContact CD2-CE1 4.27Å; L375-F406 HydrophobicContact CD2-CE2 4.26Å; L375-F406 HydrophobicContact CD2-CG 4.25Å; L375-F406 HydrophobicContact CD2-CZ 4.27Å; P376-F406 HydrophobicContact CG-CE1 3.97Å; F381-F406 HydrophobicContact CB-CB 4.31Å; F381-F406 HydrophobicContact CB-CD1 4.49Å; F381-F406 VanDerWaalsContact O-CB 3.29Å; F381-F406 WeakPolarHBondContact O-CB 3.32Å; F381-F406 PolarHBondContact O-N 3.3Å; V383-F406 HydrophobicContact CB-CB 4.41Å; V383-F406 HydrophobicContact CB-CD2 4.48Å; V383-F406 HydrophobicContact CB-CG 4.48Å; V383-F406 HydrophobicContact CG1-CB 3.76Å; V383-F406 HydrophobicContact CG1-CD1 3.96Å; V383-F406 HydrophobicContact CG1-CD2 3.94Å; V383-F406 HydrophobicContact CG1-CG 3.62Å; V383-F406 HydrophobicContact CG2-CB 3.84Å; V383-F406 HydrophobicContact CG2-CD2 3.8Å; V383-F406 HydrophobicContact CG2-CG 4.03Å; K404-F406 PolarHBondContact O-N 3.04Å; F406-V410 HydrophobicContact CD2-CG2 4.5Å; F406-L469 HydrophobicContact CE1-CD1 4.08Å; F406-Y470 HydrophobicContact CZ-CE2 4.33Å; F406-M523 HydrophobicContact CE2-SD 4.45Å
407	N	87.5	Confident	94.1	Very high	85 Å²	85	67.9 Å²	67.9	46%	0.455	34%	0.341	S	S	.	.			trans	-120.6	174.1	175.8	-65.3	-26	0	0	0	109.8	T405 E409 V410	T405-N407 PolarHBondContact O-N 3.1Å; N407-E409 PolarHBondContact O-N 3.44Å; N407-V410 HydrophobicContact CB-CG2 4.28Å
408	E	88.1	Confident	94.2	Very high	117 Å²	117	67.4 Å²	67.4	55%	0.547	34%	0.337	S	S	.	.	S	Bend	trans	-55	-43.5	176.2	-65.7	176.8	172	0	0	110.9	D371 I372 L375	D371-E408 CarbonylContact C-O 3.58Å; D371-E408 WeakPolarHBondContact CA-O 3.38Å; I372-E408 PolarHBondContact N-O 3.39Å; L375-E408 HydrophobicContact CD1-CG 3.64Å; L375-E408 HydrophobicContact CG-CG 3.84Å
409	E	92.8	Very high	94.1	Very high	118 Å²	118	70.2 Å²	70.2	55%	0.551	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.1	172	-172.2	-175.7	-158.3	0	0	110.1	I370 N407 L411	I370-E409 WeakPolarHBondContact O-CA 3.36Å; N407-E409 PolarHBondContact O-N 3.44Å; E409-L411 HydrophobicContact CG-CD2 4.07Å; E409-L411 HydrophobicContact CG-CG 4.22Å
410	V	93.7	Very high	94.1	Very high	7 Å²	7	67.5 Å²	67.5	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	113	173.9	-172.9	0	0	0	0	109.9	G369 I370 K404 T405 F406 N407 W412	G369-V410 CarbonylContact C-O 3.4Å; G369-V410 WeakPolarHBondContact CA-O 3.48Å; I370-V410 HydrophobicContact CD1-CB 4.24Å; I370-V410 HydrophobicContact CD1-CG2 4.38Å; I370-V410 HydrophobicContact CG1-CB 3.84Å; I370-V410 HydrophobicContact CG1-CG2 4.29Å; I370-V410 PolarHBondContact N-O 2.63Å; I370-V410 PolarHBondContact O-N 3.42Å; K404-V410 HydrophobicContact CB-CG1 3.75Å; K404-V410 HydrophobicContact CD-CG1 3.93Å; K404-V410 HydrophobicContact CG-CG1 4.43Å; T405-V410 WeakPolarHBondContact O-CG2 3.44Å; F406-V410 HydrophobicContact CD2-CG2 4.5Å; N407-V410 HydrophobicContact CB-CG2 4.28Å; V410-W412 HydrophobicContact CB-CH2 4.09Å; V410-W412 HydrophobicContact CB-CZ3 3.93Å; V410-W412 HydrophobicContact CG1-CD2 4.46Å; V410-W412 HydrophobicContact CG1-CE3 4.1Å; V410-W412 HydrophobicContact CG1-CH2 3.48Å; V410-W412 VanDerWaalsContact CG1-CH2 3.48Å; V410-W412 HydrophobicContact CG1-CZ2 3.88Å; V410-W412 HydrophobicContact CG1-CZ3 3.61Å
411	L	96.3	Very high	94.2	Very high	96 Å²	96	65 Å²	65	50%	0.503	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.5	-178.7	-58	179.1	0	0	0	111.1	L368 K404 E409	L368-L411 CarbonylContact O-C 3.51Å; L368-L411 WeakPolarHBondContact O-CA 3.22Å; K404-L411 PolarHBondContact NZ-O 3.17Å; E409-L411 HydrophobicContact CG-CD2 4.07Å; E409-L411 HydrophobicContact CG-CG 4.22Å
412	W	96.3	Very high	94.2	Very high	20 Å²	20	64.4 Å²	64.4	8%	0.076	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-43.8	171.1	-82	-87	0	0	0	112.9	V367 L368 I370 V383 I385 T401 T402 K404 V410 C414	V367-W412 HydrophobicContact CG1-CB 4.4Å; V367-W412 HydrophobicContact CG1-CE3 4.34Å; L368-W412 PolarHBondContact O-N 2.7Å; I370-W412 HydrophobicContact CD1-CH2 4.12Å; I370-W412 HydrophobicContact CD1-CZ3 4.03Å; I370-W412 HydrophobicContact CG1-CZ3 3.97Å; I370-W412 HydrophobicContact CG2-CZ3 4.31Å; V383-W412 HydrophobicContact CG2-CH2 4.19Å; I385-W412 HydrophobicContact CD1-CH2 4.04Å; I385-W412 HydrophobicContact CD1-CZ3 3.95Å; I385-W412 HydrophobicContact CG1-CD2 4.47Å; I385-W412 HydrophobicContact CG1-CE3 4.02Å; I385-W412 HydrophobicContact CG1-CH2 3.86Å; I385-W412 HydrophobicContact CG1-CZ2 4.32Å; I385-W412 HydrophobicContact CG1-CZ3 3.69Å; T401-W412 HydrophobicContact CG2-CG 4.26Å; T401-W412 PolarHBondContact OG1-NE1 3.32Å; T402-W412 PolarHBondContact O-NE1 2.94Å; K404-W412 HydrophobicContact CB-CZ2 4.13Å; K404-W412 HydrophobicContact CD-CD2 4.39Å; K404-W412 HydrophobicContact CD-CG 4.46Å; K404-W412 HydrophobicContact CD-CZ2 4.44Å; K404-W412 HydrophobicContact CG-CZ2 4.28Å; V410-W412 HydrophobicContact CB-CH2 4.09Å; V410-W412 HydrophobicContact CB-CZ3 3.93Å; V410-W412 HydrophobicContact CG1-CD2 4.46Å; V410-W412 HydrophobicContact CG1-CE3 4.1Å; V410-W412 HydrophobicContact CG1-CH2 3.48Å; V410-W412 VanDerWaalsContact CG1-CH2 3.48Å; V410-W412 HydrophobicContact CG1-CZ2 3.88Å; V410-W412 HydrophobicContact CG1-CZ3 3.61Å; W412-C414 PolarHBondContact O-N 3.3Å
413	N	96	Very high	94.2	Very high	103 Å²	103	61.7 Å²	61.7	55%	0.551	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.2	39.1	-175.3	-166.8	29.1	0	0	0	113.4	K366 V367 L368	K366-N413 WeakPolarHBondContact CE-OD1 3.46Å; K366-N413 PolarHBondContact NZ-OD1 2.96Å; V367-N413 VanDerWaalsContact O-CA 3.26Å; V367-N413 WeakPolarHBondContact O-CA 3.4Å; V367-N413 PolarHBondContact O-N 3.29Å; L368-N413 PolarHBondContact O-N 2.97Å
414	C	96.5	Very high	94.4	Very high	37 Å²	37	59.8 Å²	59.8	25%	0.25	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	148.3	-175.7	70.2	0	0	0	0	112.2	K366 V367 W412	K366-C414 CarbonylContact C-O 3.44Å; K366-C414 VanDerWaalsContact CA-O 3.28Å; K366-C414 WeakPolarHBondContact CA-O 3.39Å; K366-C414 WeakPolarHBondContact CG-O 3.44Å; V367-C414 PolarHBondContact N-O 3.05Å; V367-C414 PolarHBondContact O-N 2.67Å; V367-C414 VanDerWaalsContact O-N 3.1Å; W412-C414 PolarHBondContact O-N 3.3Å
415	W	97.7	Very high	94.7	Very high	97 Å²	97	56.5 Å²	56.5	37%	0.367	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.2	170.6	-75.1	98.3	0	0	0	109.8	R364 K366 L528 D530	R364-W415 HydrophobicContact CB-CE3 4.07Å; R364-W415 HydrophobicContact CB-CZ3 4.47Å; R364-W415 HydrophobicContact CG-CE3 3.66Å; R364-W415 HydrophobicContact CG-CZ3 3.72Å; K366-W415 HydrophobicContact CB-CD2 3.72Å; K366-W415 HydrophobicContact CB-CE3 3.71Å; K366-W415 HydrophobicContact CB-CG 4.37Å; K366-W415 HydrophobicContact CB-CH2 4.01Å; K366-W415 HydrophobicContact CB-CZ2 4.02Å; K366-W415 HydrophobicContact CB-CZ3 3.85Å; K366-W415 HydrophobicContact CD-CD2 4.33Å; K366-W415 HydrophobicContact CD-CZ2 3.97Å; K366-W415 HydrophobicContact CG-CD2 3.96Å; K366-W415 HydrophobicContact CG-CE3 4.45Å; K366-W415 HydrophobicContact CG-CG 4.18Å; K366-W415 HydrophobicContact CG-CZ2 4.37Å; W415-L528 HydrophobicContact CZ2-CD2 4.4Å; W415-D530 WeakPolarHBondContact CH2-OD1 2.8Å
416	L	97.7	Very high	95	Very high	12 Å²	12	53.1 Å²	53.1	6%	0.063	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	111.3	167.2	-58.1	-179	0	0	0	107.6	R364 V365 V367 A387 E399 T401 F418	R364-L416 CarbonylContact C-O 3.57Å; R364-L416 WeakPolarHBondContact CA-O 3.11Å; R364-L416 VanDerWaalsContact CB-O 3.26Å; R364-L416 WeakPolarHBondContact CB-O 3.4Å; V365-L416 HydrophobicContact CG1-CB 4.14Å; V365-L416 PolarHBondContact N-O 3.29Å; V365-L416 PolarHBondContact O-N 3.32Å; V367-L416 HydrophobicContact CG2-CD1 3.76Å; V367-L416 HydrophobicContact CG2-CG 4.26Å; A387-L416 HydrophobicContact CB-CD1 3.81Å; E399-L416 HydrophobicContact CB-CB 4.05Å; E399-L416 HydrophobicContact CB-CD1 4.38Å; E399-L416 HydrophobicContact CB-CD2 4.45Å; T401-L416 HydrophobicContact CG2-CD1 4Å; T401-L416 HydrophobicContact CG2-CD2 4.13Å; T401-L416 HydrophobicContact CG2-CG 4.4Å; L416-F418 HydrophobicContact CB-CE2 4.45Å
417	E	97.8	Very high	95.2	Very high	97 Å²	97	55 Å²	55	45%	0.453	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.8	175.4	-177	177.1	-96.1	0	0	109.5	K362 R364	K362-E417 HydrophobicContact CB-CG 3.8Å; K362-E417 HydrophobicContact CD-CG 4.1Å; R364-E417 HydrophobicContact CB-CB 4.07Å; R364-E417 HydrophobicContact CB-CG 4.31Å
418	F	97.4	Very high	95.5	Very high	1 Å²	1	51 Å²	51	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	150.2	-175.9	-64.5	-98.2	0	0	0	111.2	F363 V365 A387 I389 A397 E399 L416 I420 L431	F363-F418 AromaticContact CD1-CD2 3.5Å; F363-F418 HydrophobicContact CD1-CD2 3.5Å; F363-F418 AromaticContact CD1-CE2 3.89Å; F363-F418 HydrophobicContact CD1-CE2 3.89Å; F363-F418 HydrophobicContact CD1-CG 4.23Å; F363-F418 AromaticContact CE1-CD2 3.92Å; F363-F418 HydrophobicContact CE1-CD2 3.92Å; F363-F418 AromaticContact CE1-CE2 3.79Å; F363-F418 HydrophobicContact CE1-CE2 3.79Å; F363-F418 PolarHBondContact O-N 2.9Å; V365-F418 HydrophobicContact CB-CE2 4.46Å; V365-F418 HydrophobicContact CG1-CE2 3.71Å; V365-F418 HydrophobicContact CG1-CZ 4.14Å; A387-F418 HydrophobicContact CB-CE1 4.32Å; A387-F418 HydrophobicContact CB-CZ 3.77Å; A387-F418 WeakPolarHBondContact O-CE1 3.39Å; I389-F418 HydrophobicContact CD1-CB 4.21Å; I389-F418 HydrophobicContact CD1-CD1 3.77Å; I389-F418 HydrophobicContact CD1-CD2 4.08Å; I389-F418 HydrophobicContact CD1-CE1 4.08Å; I389-F418 HydrophobicContact CD1-CE2 4.35Å; I389-F418 HydrophobicContact CD1-CG 3.76Å; I389-F418 HydrophobicContact CD1-CZ 4.36Å; I389-F418 HydrophobicContact CG1-CD1 4.07Å; I389-F418 HydrophobicContact CG1-CE1 3.97Å; I389-F418 HydrophobicContact CG1-CZ 4.33Å; A397-F418 HydrophobicContact CB-CB 3.96Å; A397-F418 HydrophobicContact CB-CD1 3.83Å; A397-F418 HydrophobicContact CB-CG 4.36Å; E399-F418 HydrophobicContact CB-CD1 4.28Å; E399-F418 HydrophobicContact CB-CE1 4.04Å; E399-F418 HydrophobicContact CB-CZ 4.41Å; E399-F418 HydrophobicContact CG-CD1 3.69Å; E399-F418 HydrophobicContact CG-CE1 3.97Å; E399-F418 HydrophobicContact CG-CG 4.03Å; L416-F418 HydrophobicContact CB-CE2 4.45Å; F418-I420 HydrophobicContact CB-CG2 3.88Å; F418-I420 PolarHBondContact O-N 3.31Å; F418-L431 HydrophobicContact CZ-CD1 4Å
419	N	95.8	Very high	95.8	Very high	128 Å²	128	45.4 Å²	45.4	68%	0.684	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	46.5	171.3	-163.1	31.2	0	0	0	113.6
420	I	96.6	Very high	96	Very high	11 Å²	11	40.6 Å²	40.6	6%	0.056	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.3	172.7	-172.4	162.6	0	0	0	109.2	K362 F363 I389 L396 A397 F418 D424 L425	K362-I420 CarbonylContact C-O 3.09Å; K362-I420 WeakPolarHBondContact CA-O 3.48Å; F363-I420 HydrophobicContact CB-CG2 4.25Å; F363-I420 PolarHBondContact N-O 2.87Å; I389-I420 HydrophobicContact CD1-CG2 3.82Å; L396-I420 HydrophobicContact CB-CD1 3.99Å; L396-I420 HydrophobicContact CD1-CD1 4.13Å; A397-I420 HydrophobicContact CB-CB 4.27Å; A397-I420 HydrophobicContact CB-CG2 3.99Å; F418-I420 HydrophobicContact CB-CG2 3.88Å; F418-I420 PolarHBondContact O-N 3.31Å; I420-D424 HydrophobicContact CG1-CB 4.18Å; I420-L425 HydrophobicContact CD1-CD2 3.99Å; I420-L425 HydrophobicContact CG1-CD2 4.36Å; I420-L425 HydrophobicContact CG2-CD2 4.25Å
421	K	97.3	Very high	96.1	Very high	87 Å²	87	40.3 Å²	40.3	38%	0.378	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	152.5	177.4	-60.7	174.7	-179	173.4	0	110.3	R361 K423 D424	R361-K421 CarbonylContact O-C 3.53Å; R361-K421 VanDerWaalsContact O-CA 3.31Å; R361-K421 WeakPolarHBondContact O-CA 3.25Å; K421-K423 VanDerWaalsContact C-N 3.29Å; K421-K423 HydrophobicContact CB-CG 4Å; K421-K423 PolarHBondContact O-N 3.38Å; K421-D424 HydrophobicContact CB-CB 4.47Å; K421-D424 WeakPolarHBondContact CB-OD2 3.5Å; K421-D424 PolarHBondContact O-N 3.28Å
422	I	96.1	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-58.4	-42.8	177.8	-66	162.8	0	0	0	111.2	M356 C359 R361 F363 D424 L425 L483 Y532	M356-I422 HydrophobicContact CG-CG2 3.67Å; M356-I422 HydrophobicContact SD-CG2 4.41Å; C359-I422 HydrophobicContact CB-CB 3.79Å; C359-I422 HydrophobicContact CB-CD1 4.32Å; C359-I422 HydrophobicContact CB-CG2 3.65Å; R361-I422 HydrophobicContact CB-CD1 4.08Å; R361-I422 PolarHBondContact O-N 3.41Å; F363-I422 HydrophobicContact CB-CG1 4.29Å; I422-D424 PolarHBondContact O-N 3.28Å; I422-D424 VanDerWaalsContact O-N 3.13Å; I422-L425 WeakPolarHBondContact O-CB 3.28Å; I422-L425 PolarHBondContact O-N 3.42Å; I422-L425 VanDerWaalsContact O-N 3.17Å; I422-L483 HydrophobicContact CG2-CD2 3.78Å; I422-Y532 HydrophobicContact CD1-CE1 4.35Å; I422-Y532 WeakPolarHBondContact CD1-OH 3.42Å
423	K	94.6	Very high	96.1	Very high	40 Å²	40	35.1 Å²	35.1	17%	0.174	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-58.7	-24.8	176.9	68.3	173.1	-168.6	179.1	0	114.8	M356 C359 N360 K421 Q619	M356-K423 VanDerWaalsContact O-CA 3.28Å; M356-K423 WeakPolarHBondContact O-CA 3.43Å; M356-K423 WeakPolarHBondContact O-CB 3.37Å; C359-K423 PolarHBondContact O-N 2.93Å; C359-K423 VanDerWaalsContact O-N 3.15Å; N360-K423 WeakPolarHBondContact OD1-CD 3.45Å; N360-K423 VanDerWaalsContact OD1-CE 3.32Å; N360-K423 WeakPolarHBondContact OD1-CE 3.22Å; N360-K423 PolarHBondContact OD1-NZ 3.35Å; K421-K423 VanDerWaalsContact C-N 3.29Å; K421-K423 HydrophobicContact CB-CG 4Å; K421-K423 PolarHBondContact O-N 3.38Å; K423-Q619 WeakPolarHBondContact O-CB 3.21Å
424	D	96.3	Very high	96.1	Very high	28 Å²	28	31.8 Å²	31.8	15%	0.15	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-94.9	1.5	-175	-69.8	-48.7	0	0	0	112.3	I420 K421 I422 P426 G617 Q619	I420-D424 HydrophobicContact CG1-CB 4.18Å; K421-D424 HydrophobicContact CB-CB 4.47Å; K421-D424 WeakPolarHBondContact CB-OD2 3.5Å; K421-D424 PolarHBondContact O-N 3.28Å; I422-D424 PolarHBondContact O-N 3.28Å; I422-D424 VanDerWaalsContact O-N 3.13Å; D424-P426 VanDerWaalsContact O-CD 3.27Å; D424-P426 WeakPolarHBondContact O-CD 3.35Å; D424-G617 WeakPolarHBondContact CB-O 3.33Å; D424-Q619 WeakPolarHBondContact OD1-CB 3.26Å; D424-Q619 PolarHBondContact OD1-N 3.04Å
425	L	96.6	Very high	95.9	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-74.5	116.9	173.8	-67.8	173.2	0	0	0	110.4	M356 F363 I389 I420 I422 L476 L483	M356-L425 HydrophobicContact CE-CB 4.43Å; M356-L425 WeakPolarHBondContact CE-O 3.2Å; F363-L425 HydrophobicContact CB-CD1 4.33Å; F363-L425 HydrophobicContact CD2-CD1 3.89Å; F363-L425 HydrophobicContact CG-CD1 4.2Å; I389-L425 HydrophobicContact CD1-CD2 4.47Å; I389-L425 HydrophobicContact CG2-CD2 4.2Å; I420-L425 HydrophobicContact CD1-CD2 3.99Å; I420-L425 HydrophobicContact CG1-CD2 4.36Å; I420-L425 HydrophobicContact CG2-CD2 4.25Å; I422-L425 WeakPolarHBondContact O-CB 3.28Å; I422-L425 PolarHBondContact O-N 3.42Å; I422-L425 VanDerWaalsContact O-N 3.17Å; L425-L476 HydrophobicContact CD1-CD1 4.16Å; L425-L476 HydrophobicContact CD2-CD1 3.85Å; L425-L483 HydrophobicContact CD1-CD1 4.13Å
426	P	94.9	Very high	95.6	Very high	8 Å²	8	26 Å²	26	5%	0.052	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-76.9	158.1	177.4	31.3	-35.3	0	0	0	112.1	H391 L396 D424 A429 W616	H391-P426 HydrophobicContact CB-CG 3.9Å; H391-P426 VanDerWaalsContact CD2-CG 3.5Å; H391-P426 WeakPolarHBondContact CD2-CG 3.33Å; L396-P426 HydrophobicContact CD1-CG 3.98Å; D424-P426 VanDerWaalsContact O-CD 3.27Å; D424-P426 WeakPolarHBondContact O-CD 3.35Å; P426-A429 HydrophobicContact CG-CB 4.16Å; P426-A429 WeakPolarHBondContact O-CB 3.26Å; P426-A429 PolarHBondContact O-N 3.14Å; P426-A429 VanDerWaalsContact O-N 3.08Å; P426-W616 HydrophobicContact CG-CB 4.44Å; P426-W616 WeakPolarHBondContact CG-O 3.46Å
427	K	93.3	Very high	95	Very high	59 Å²	59	25.7 Å²	25.7	26%	0.257	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	137.4	170.1	-165.3	168.4	179.2	168	0	109.8	H391 A429 S481 L538 Y690	H391-K427 PolarHBondContact CD2-O 3.46Å; H391-K427 PolarHBondContact NE2-O 2.98Å; K427-A429 VanDerWaalsContact C-N 3.3Å; K427-S481 PolarHBondContact NZ-OG 3.25Å; K427-L538 HydrophobicContact CB-CD2 3.61Å; K427-L538 HydrophobicContact CD-CD2 4.23Å; K427-L538 HydrophobicContact CG-CD2 4.15Å; K427-Y690 HydrophobicContact CD-CE2 4.45Å; K427-Y690 HydrophobicContact CG-CE2 4.06Å; K427-Y690 WeakPolarHBondContact CG-OH 3.44Å
428	G	93.1	Very high	93.9	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.01	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	5.5	-172.6	0	0	0	0	0	114.5	R430 Y690	G428-R430 PolarHBondContact O-N 2.98Å; G428-Y690 PolarHBondContact N-OH 3Å
429	A	95.9	Very high	92.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.138	C	C	.	.			trans	-61.7	132.7	168.7	0	0	0	0	0	111.1	F390 P426 K427 L476	F390-A429 WeakPolarHBondContact O-CA 3.48Å; P426-A429 HydrophobicContact CG-CB 4.16Å; P426-A429 WeakPolarHBondContact O-CB 3.26Å; P426-A429 PolarHBondContact O-N 3.14Å; P426-A429 VanDerWaalsContact O-N 3.08Å; K427-A429 VanDerWaalsContact C-N 3.3Å; A429-L476 HydrophobicContact CB-CD1 4.33Å; A429-L476 PolarHBondContact O-N 2.83Å
430	R	95.4	Very high	90.2	Very high	18 Å²	18	29.2 Å²	29.2	7%	0.068	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	128.9	-176.7	-67.2	175.5	-62.1	-174.4	-1.8	110.5	I389 F390 G392 G428 L474 L475 L511	I389-R430 WeakPolarHBondContact CA-O 3.4Å; F390-R430 PolarHBondContact N-O 3.39Å; F390-R430 PolarHBondContact O-N 2.88Å; G392-R430 PolarHBondContact O-NH2 2.99Å; G428-R430 PolarHBondContact O-N 2.98Å; R430-L474 WeakPolarHBondContact CA-O 3.28Å; R430-L475 HydrophobicContact CG-CD2 3.62Å; R430-L475 HydrophobicContact CG-CG 4.41Å; R430-L511 PolarHBondContact NH1-O 3.42Å
431	L	97.2	Very high	88	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	108	164.2	178.8	64.8	0	0	0	108.4	V365 A387 I389 F418 L433 N473 L474 L476 I527	V365-L431 HydrophobicContact CB-CD2 4.45Å; V365-L431 HydrophobicContact CG2-CD2 4.19Å; A387-L431 HydrophobicContact CB-CD1 4.36Å; I389-L431 HydrophobicContact CG1-CD1 4.23Å; F418-L431 HydrophobicContact CZ-CD1 4Å; L431-L433 HydrophobicContact CD1-CD2 4.35Å; L431-L433 HydrophobicContact CD2-CD1 4.44Å; L431-L433 HydrophobicContact CD2-CD2 4.37Å; L431-L433 HydrophobicContact CD2-CG 4.47Å; L431-L433 HydrophobicContact CG-CD2 4.2Å; L431-L433 HydrophobicContact CG-CG 4.19Å; L431-N473 CarbonylContact O-C 3.52Å; L431-N473 WeakPolarHBondContact O-CA 3.38Å; L431-L474 PolarHBondContact N-O 3.17Å; L431-L474 PolarHBondContact O-N 3.19Å; L431-L476 HydrophobicContact CB-CD2 3.75Å; L431-L476 HydrophobicContact CB-CG 4.12Å; L431-L476 HydrophobicContact CD2-CD2 4.37Å; L431-I527 HydrophobicContact CD2-CD1 4.29Å
432	N	96.1	Very high	85.2	Confident	8 Å²	8	38.9 Å²	38.9	4%	0.043	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.6	173.6	173.7	-109.9	0	0	0	109	A387 S388 F390 Q434 N473	A387-N432 WeakPolarHBondContact CA-O 3.46Å; S388-N432 PolarHBondContact N-O 3.01Å; S388-N432 PolarHBondContact O-N 2.96Å; F390-N432 HydrophobicContact CD2-CB 3.87Å; F390-N432 HydrophobicContact CE2-CB 4Å; N432-Q434 VanDerWaalsContact OD1-CD 3.31Å; N432-Q434 VanDerWaalsContact OD1-CG 3.29Å; N432-Q434 WeakPolarHBondContact OD1-CG 3.38Å; N432-Q434 PolarHBondContact OD1-NE2 3.08Å; N432-N473 WeakPolarHBondContact CB-OD1 3.45Å; N432-N473 PolarHBondContact ND2-OD1 3.31Å
433	L	96.6	Very high	82.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.3	179.1	-64.1	168.4	0	0	0	108.8	I385 A387 L431 Y471 V472 L490 M492 I525 I527	I385-L433 HydrophobicContact CG2-CD2 4.5Å; A387-L433 HydrophobicContact CB-CD2 3.67Å; L431-L433 HydrophobicContact CD1-CD2 4.35Å; L431-L433 HydrophobicContact CD2-CD1 4.44Å; L431-L433 HydrophobicContact CD2-CD2 4.37Å; L431-L433 HydrophobicContact CD2-CG 4.47Å; L431-L433 HydrophobicContact CG-CD2 4.2Å; L431-L433 HydrophobicContact CG-CG 4.19Å; L433-Y471 CarbonylContact O-C 3.57Å; L433-Y471 VanDerWaalsContact O-CA 3.28Å; L433-Y471 WeakPolarHBondContact O-CA 3.4Å; L433-V472 HydrophobicContact CB-CG1 4.03Å; L433-V472 HydrophobicContact CD1-CG1 4.34Å; L433-V472 PolarHBondContact N-O 2.75Å; L433-V472 PolarHBondContact O-N 3.14Å; L433-L490 HydrophobicContact CD1-CD1 4.22Å; L433-M492 WeakPolarHBondContact O-CE 3.43Å; L433-I525 HydrophobicContact CB-CD1 4.33Å; L433-I525 HydrophobicContact CD1-CD1 4.24Å; L433-I525 HydrophobicContact CD1-CG2 4.28Å; L433-I527 HydrophobicContact CD1-CD1 3.91Å; L433-I527 HydrophobicContact CD1-CG2 3.89Å
434	Q	94.9	Very high	79.6	Confident	33 Å²	33	48.3 Å²	48.3	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.2	-174.2	-71.1	-172.8	13.9	0	0	111	I385 E386 N432 I436 L468 Y470	I385-Q434 WeakPolarHBondContact CA-O 3.42Å; E386-Q434 HydrophobicContact CB-CB 4.31Å; E386-Q434 PolarHBondContact N-O 3.46Å; E386-Q434 PolarHBondContact O-N 3.41Å; N432-Q434 VanDerWaalsContact OD1-CD 3.31Å; N432-Q434 VanDerWaalsContact OD1-CG 3.29Å; N432-Q434 WeakPolarHBondContact OD1-CG 3.38Å; N432-Q434 PolarHBondContact OD1-NE2 3.08Å; Q434-I436 HydrophobicContact CB-CG1 4.3Å; Q434-L468 HydrophobicContact CB-CD1 3.54Å; Q434-L468 HydrophobicContact CG-CD1 3.76Å; Q434-Y470 WeakPolarHBondContact CA-O 3.35Å
435	V	93.2	Very high	76.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	113.2	171	-174.6	0	0	0	0	108.6	I370 V383 I385 L469 Y470 M492 M523	I370-V435 HydrophobicContact CD1-CG1 4.21Å; I370-V435 HydrophobicContact CG2-CG2 4.39Å; V383-V435 HydrophobicContact CB-CG1 4.17Å; V383-V435 HydrophobicContact CG1-CG1 4.19Å; I385-V435 HydrophobicContact CD1-CB 4.27Å; I385-V435 HydrophobicContact CD1-CG1 4.33Å; I385-V435 HydrophobicContact CD1-CG2 3.5Å; V435-L469 PolarHBondContact O-N 3.48Å; V435-Y470 HydrophobicContact CB-CD2 4.37Å; V435-Y470 PolarHBondContact N-O 3.07Å; V435-Y470 PolarHBondContact O-N 2.98Å; V435-M492 HydrophobicContact CG2-CE 3.75Å; V435-M492 HydrophobicContact CG2-SD 3.86Å; V435-M523 HydrophobicContact CB-CE 3.78Å; V435-M523 HydrophobicContact CG1-CE 4.18Å; V435-M523 HydrophobicContact CG2-CE 3.21Å; V435-M523 HydrophobicContact CG2-SD 4.42Å
436	I	89.9	Confident	73.8	Confident	13 Å²	13	59.2 Å²	59.2	7%	0.067	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.4	-175.7	-58.2	178.7	0	0	0	108.8	V383 F384 E386 Q434 N466 L468	V383-I436 VanDerWaalsContact CA-O 3.27Å; V383-I436 WeakPolarHBondContact CA-O 3.1Å; F384-I436 HydrophobicContact CD2-CB 4.44Å; F384-I436 HydrophobicContact CE1-CB 3.97Å; F384-I436 HydrophobicContact CE1-CG2 3.77Å; F384-I436 HydrophobicContact CE2-CB 3.9Å; F384-I436 HydrophobicContact CE2-CD1 3.97Å; F384-I436 HydrophobicContact CE2-CG1 4.4Å; F384-I436 HydrophobicContact CE2-CG2 4.26Å; F384-I436 HydrophobicContact CZ-CB 3.64Å; F384-I436 HydrophobicContact CZ-CD1 4.13Å; F384-I436 HydrophobicContact CZ-CG1 4.45Å; F384-I436 HydrophobicContact CZ-CG2 3.51Å; F384-I436 PolarHBondContact N-O 2.87Å; F384-I436 PolarHBondContact O-N 3.38Å; E386-I436 HydrophobicContact CB-CD1 3.7Å; E386-I436 HydrophobicContact CB-CG1 4.45Å; E386-I436 HydrophobicContact CG-CD1 4.35Å; Q434-I436 HydrophobicContact CB-CG1 4.3Å; I436-N466 HydrophobicContact CG2-CB 3.75Å; I436-L468 HydrophobicContact CG1-CD1 4.08Å
437	C	86.8	Confident	70.9	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.034	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.8	177.2	163.8	0	0	0	0	110.7	F381 M382 V383 N466 R467 L469	F381-C437 VanDerWaalsContact CB-SG 3.51Å; F381-C437 WeakPolarHBondContact CD1-SG 3Å; F381-C437 WeakPolarHBondContact CG-SG 3.42Å; M382-C437 CarbonylContact O-C 3.59Å; M382-C437 WeakPolarHBondContact O-CA 3.18Å; V383-C437 HydrophobicContact CG1-CB 4.35Å; C437-N466 CarbonylContact O-C 3.58Å; C437-N466 WeakPolarHBondContact O-CA 3.45Å; C437-R467 PolarHBondContact N-O 2.85Å; C437-R467 PolarHBondContact O-N 3.11Å; C437-L469 HydrophobicContact CB-CD1 3.67Å; C437-L469 HydrophobicContact CB-CD2 4.44Å; C437-L469 HydrophobicContact CB-CG 3.9Å
438	G	74	Confident	67.9	Low	8 Å²	8	71.2 Å²	71.2	8%	0.082	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.5	171.5	0	0	0	0	0	112.2	M382	M382-G438 PolarHBondContact N-O 2.81Å; M382-G438 PolarHBondContact O-N 3.08Å
439	K	63.1	Low	64.9	Low	156 Å²	156	76.8 Å²	76.8	68%	0.678	43%	0.426	S	S	*	.			trans	-76	146.6	170.7	-73.5	-173.6	176.4	-177.2	0	110.3	T464	K439-T464 HydrophobicContact CB-CG2 4.31Å
440	Q	53.1	Low	61.8	Low	135 Å²	135	87 Å²	87	63%	0.631	47%	0.467	S	S	*	.			trans	-57.3	132.1	174.8	-163.6	177.4	14	0	0	110.1	Q442	Q440-Q442 PolarHBondContact O-N 3.22Å; Q440-Q442 VanDerWaalsContact O-N 3.13Å
441	P	48.9	Very low	58.8	Low	110 Å²	110	94.2 Å²	94.2	71%	0.714	50%	0.501	S	S	*	.			trans	-63.7	115.7	168.5	24.4	-29.8	0	0	0	108	T443	P441-T443 PolarHBondContact O-N 3.1Å
442	Q	40.1	Very low	55.6	Low	191 Å²	191	100.9 Å²	100.9	89%	0.893	54%	0.536	S	S	*	.			trans	-61.3	122.9	173.5	-71.4	-172.8	-4.4	0	0	108.4	Q440	Q440-Q442 PolarHBondContact O-N 3.22Å; Q440-Q442 VanDerWaalsContact O-N 3.13Å
443	T	33.6	Very low	52.4	Low	111 Å²	111	107.3 Å²	107.3	68%	0.681	57%	0.571	S	S	*	*			trans	-58.8	135.6	170.3	41.7	0	0	0	0	109.7	P441 N445	P441-T443 PolarHBondContact O-N 3.1Å; T443-N445 PolarHBondContact O-N 3.44Å
444	P	38.3	Very low	49.2	Very low	128 Å²	128	114 Å²	114	83%	0.831	61%	0.612	S	S	*	*			trans	-68.3	103.1	173.4	26.8	-29.5	0	0	0	108.2	S446	P444-S446 PolarHBondContact O-N 2.85Å; P444-S446 VanDerWaalsContact O-N 3.1Å
445	N	32.1	Very low	46.1	Very low	150 Å²	150	118.1 Å²	118.1	80%	0.802	64%	0.644	S	S	*	*			trans	-66.4	112.1	172.9	-100.1	-14	0	0	0	108.8	T443 K447	T443-N445 PolarHBondContact O-N 3.44Å; N445-K447 PolarHBondContact O-N 3.21Å; N445-K447 VanDerWaalsContact O-N 3.13Å
446	S	38.4	Very low	43	Very low	110 Å²	110	121.7 Å²	121.7	77%	0.769	68%	0.681	S	S	*	*			trans	-60.3	108.4	165.2	54.7	0	0	0	0	109.6	P444	P444-S446 PolarHBondContact O-N 2.85Å; P444-S446 VanDerWaalsContact O-N 3.1Å
447	K	34.1	Very low	40.1	Very low	205 Å²	205	127.4 Å²	127.4	89%	0.891	72%	0.722	S	S	*	*			trans	-159.9	114	145.4	-105.2	167.9	-165.8	-174.7	0	109.7	N445	N445-K447 PolarHBondContact O-N 3.21Å; N445-K447 VanDerWaalsContact O-N 3.13Å
448	S	31	Very low	37.3	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	75%	0.75	S	S	*	*			trans	-60.3	137	175	50	0	0	0	0	113.7
449	S	29.3	Very low	35.1	Very low	118 Å²	118	137.8 Å²	137.8	83%	0.825	79%	0.788	S	S	*	*			trans	-150.8	122.1	135.5	64.6	0	0	0	0	110
450	Y	32.5	Very low	33.5	Very low	215 Å²	215	137.8 Å²	137.8	84%	0.843	79%	0.794	S	S	*	*			trans	-55.1	131.3	174.1	-82.4	-109.2	0	0	0	112.2
451	H	31.8	Very low	32.4	Very low	169 Å²	169	140.1 Å²	140.1	78%	0.782	81%	0.805	S	S	*	*				-176.9	132.1	113.4	-107	-76.1	0	0	0	113.8
452	D	29.3	Very low	31.4	Very low	140 Å²	140	138 Å²	138	75%	0.749	80%	0.803	S	S	*	*			trans	71.9	135.9	149.5	-87.7	-50	0	0	0	126.1
453	N	30.2	Very low	31.3	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	80%	0.802	S	S	*	*			trans	-76.5	141.9	-173.3	-71.7	-49.9	0	0	0	112.6
454	T	28.9	Very low	31.8	Very low	141 Å²	141	137.4 Å²	137.4	87%	0.865	80%	0.796	S	S	*	*				-164.1	129	125.7	11.2	0	0	0	0	112.1
455	S	30.4	Very low	32.7	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	80%	0.795	S	S	*	*			trans	-18.2	133.6	169.3	52.8	0	0	0	0	120.2
456	G	26.3	Very low	34.8	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	78%	0.779	S	S	*	*			trans	171.7	93.9	158.2	0	0	0	0	0	112.9	S458	G456-S458 PolarHBondContact O-N 2.82Å
457	S	30.7	Very low	36.9	Very low	132 Å²	132	136.1 Å²	136.1	92%	0.923	76%	0.758	S	S	*	*			trans	-65	107.4	172.9	152.6	0	0	0	0	111.2
458	S	26.5	Very low	39.4	Very low	87 Å²	87	128.3 Å²	128.3	61%	0.608	73%	0.726	S	S	*	*			trans	-147.1	121	154.4	59.4	0	0	0	0	110	G456 L460	G456-S458 PolarHBondContact O-N 2.82Å; S458-L460 VanDerWaalsContact C-N 3.33Å; S458-L460 PolarHBondContact O-N 2.81Å
459	T	28.4	Very low	42.1	Very low	144 Å²	144	123.9 Å²	123.9	88%	0.883	69%	0.693	S	S	*	*			trans	-65.1	89.1	170.5	26.9	0	0	0	0	109.5	E461	T459-E461 PolarHBondContact O-N 3.06Å
460	L	29.6	Very low	45	Very low	157 Å²	157	119 Å²	119	82%	0.822	66%	0.657	S	S	*	*			trans	-79.2	83.8	165.1	-97.9	118.7	0	0	0	109.4	S458 G462	S458-L460 VanDerWaalsContact C-N 3.33Å; S458-L460 PolarHBondContact O-N 2.81Å; L460-G462 PolarHBondContact O-N 2.81Å
461	E	30.3	Very low	48	Very low	184 Å²	184	109.3 Å²	109.3	86%	0.86	62%	0.619	S	S	*	*			trans	-71.5	101.4	155.7	-78.9	-173.5	164.6	0	0	108.2	T459 K463	T459-E461 PolarHBondContact O-N 3.06Å; E461-K463 PolarHBondContact O-N 2.7Å
462	G	28.4	Very low	51	Low	65 Å²	65	101.2 Å²	101.2	67%	0.67	58%	0.581	S	S	*	*			trans	-63.9	102.5	173.7	0	0	0	0	0	110.9	L460 T464	L460-G462 PolarHBondContact O-N 2.81Å; G462-T464 PolarHBondContact O-N 3.41Å
463	K	36.2	Very low	54.1	Low	201 Å²	201	94.8 Å²	94.8	87%	0.874	55%	0.547	S	S	*	.			trans	-56.1	102.8	171.7	-77	179.4	176.5	175.9	0	110.2	E461 K465	E461-K463 PolarHBondContact O-N 2.7Å; K463-K465 PolarHBondContact O-N 3.15Å
464	T	44.1	Very low	57.3	Low	88 Å²	88	88 Å²	88	54%	0.54	51%	0.511	S	S	.	.			trans	-65.7	113.1	166.2	-13.2	0	0	0	0	107.2	K439 G462 N466	K439-T464 HydrophobicContact CB-CG2 4.31Å; G462-T464 PolarHBondContact O-N 3.41Å; T464-N466 PolarHBondContact O-N 3.13Å
465	K	58.5	Low	60.5	Low	186 Å²	186	81.5 Å²	81.5	81%	0.809	47%	0.47	S	S	*	.			trans	-68.9	101.4	-179.8	-83.2	-171.6	175.6	-172	0	109.8	K463	K463-K465 PolarHBondContact O-N 3.15Å
466	N	75.1	Confident	63.6	Low	87 Å²	87	75.9 Å²	75.9	47%	0.465	43%	0.431	S	S	.	.			trans	-74	137.7	168.7	-71.5	-16.1	0	0	0	110	I436 C437 T464	I436-N466 HydrophobicContact CG2-CB 3.75Å; C437-N466 CarbonylContact O-C 3.58Å; C437-N466 WeakPolarHBondContact O-CA 3.45Å; T464-N466 PolarHBondContact O-N 3.13Å
467	R	82.9	Confident	66.8	Low	88 Å²	88	72.2 Å²	72.2	33%	0.332	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.9	-178.6	-173	174.1	73.6	168.3	4	111.2	C437 L469 E500	C437-R467 PolarHBondContact N-O 2.85Å; C437-R467 PolarHBondContact O-N 3.11Å; R467-L469 HydrophobicContact CG-CD2 4.47Å; R467-E500 IonicContact NH1-OE1 3.12Å; R467-E500 PolarHBondContact NH1-OE1 3.23Å; R467-E500 VanDerWaalsContact NH1-OE1 3.12Å
468	L	86.5	Confident	69.7	Low	41 Å²	41	67 Å²	67	22%	0.215	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	125.2	172.2	178.4	63.4	0	0	0	110.1	Q434 I436 Y470 M495	Q434-L468 HydrophobicContact CB-CD1 3.54Å; Q434-L468 HydrophobicContact CG-CD1 3.76Å; I436-L468 HydrophobicContact CG1-CD1 4.08Å; L468-Y470 WeakPolarHBondContact CD1-O 3.41Å; L468-M495 HydrophobicContact CD2-CE 4.2Å; L468-M495 HydrophobicContact CD2-CG 3.85Å; L468-M495 HydrophobicContact CD2-SD 4.1Å; L468-M495 HydrophobicContact CG-CG 3.77Å
469	L	87.6	Confident	72.6	Confident	21 Å²	21	64 Å²	64	11%	0.11	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-43.7	-179.9	-64.7	-177.3	0	0	0	112.6	V383 F406 V435 C437 R467 M495	V383-L469 HydrophobicContact CG1-CD1 4.46Å; F406-L469 HydrophobicContact CE1-CD1 4.08Å; V435-L469 PolarHBondContact O-N 3.48Å; C437-L469 HydrophobicContact CB-CD1 3.67Å; C437-L469 HydrophobicContact CB-CD2 4.44Å; C437-L469 HydrophobicContact CB-CG 3.9Å; R467-L469 HydrophobicContact CG-CD2 4.47Å; L469-M495 WeakPolarHBondContact O-CB 3.45Å; L469-M495 PolarHBondContact O-N 3.33Å
470	Y	91.8	Very high	75.3	Confident	16 Å²	16	57.7 Å²	57.7	6%	0.063	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	152.8	-174.1	-56.9	-90.3	0	0	0	111.2	I372 F406 Q434 V435 L468 W493 K494 M523	I372-Y470 HydrophobicContact CD1-CE2 4.37Å; I372-Y470 VanDerWaalsContact CD1-OH 3.24Å; I372-Y470 WeakPolarHBondContact CD1-OH 3.17Å; F406-Y470 HydrophobicContact CZ-CE2 4.33Å; Q434-Y470 WeakPolarHBondContact CA-O 3.35Å; V435-Y470 HydrophobicContact CB-CD2 4.37Å; V435-Y470 PolarHBondContact N-O 3.07Å; V435-Y470 PolarHBondContact O-N 2.98Å; L468-Y470 WeakPolarHBondContact CD1-O 3.41Å; Y470-W493 CarbonylContact C-O 3.49Å; Y470-W493 WeakPolarHBondContact CA-O 3.19Å; Y470-K494 HydrophobicContact CD1-CB 3.93Å; Y470-K494 HydrophobicContact CD1-CG 4.22Å; Y470-K494 HydrophobicContact CE1-CB 3.76Å; Y470-K494 HydrophobicContact CE1-CD 4.26Å; Y470-K494 HydrophobicContact CE1-CG 3.75Å; Y470-M523 HydrophobicContact CD1-CB 4.26Å; Y470-M523 HydrophobicContact CD1-CE 4Å; Y470-M523 HydrophobicContact CD2-CE 3.16Å; Y470-M523 HydrophobicContact CD2-SD 3.74Å; Y470-M523 HydrophobicContact CE1-CB 4.29Å; Y470-M523 HydrophobicContact CE2-CE 3.95Å; Y470-M523 HydrophobicContact CE2-SD 3.92Å; Y470-M523 HydrophobicContact CG-CE 3.2Å; Y470-M523 HydrophobicContact CG-SD 4.19Å
471	Y	93.9	Very high	78.2	Confident	10 Å²	10	50.9 Å²	50.9	4%	0.039	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.8	176.8	71.1	-84.5	0	0	0	112.2	L433 W493 M495 D509 K510 H726	L433-Y471 CarbonylContact O-C 3.57Å; L433-Y471 VanDerWaalsContact O-CA 3.28Å; L433-Y471 WeakPolarHBondContact O-CA 3.4Å; Y471-W493 HydrophobicContact CD1-CB 4.1Å; Y471-W493 HydrophobicContact CD2-CB 4.43Å; Y471-W493 HydrophobicContact CE1-CB 3.59Å; Y471-W493 HydrophobicContact CE2-CB 3.95Å; Y471-W493 AromaticContact CE2-CD1 3.84Å; Y471-W493 HydrophobicContact CE2-CG 4.13Å; Y471-W493 HydrophobicContact CG-CB 4.5Å; Y471-W493 PolarHBondContact N-O 2.97Å; Y471-W493 PolarHBondContact O-N 3.06Å; Y471-M495 HydrophobicContact CD1-CG 4.05Å; Y471-M495 HydrophobicContact CD1-SD 3.62Å; Y471-M495 HydrophobicContact CE1-CG 4.43Å; Y471-M495 HydrophobicContact CE1-SD 3.6Å; Y471-M495 VanDerWaalsContact CE1-SD 3.6Å; Y471-D509 PolarHBondContact OH-O 2.91Å; Y471-K510 HydrophobicContact CE1-CG 4.45Å; Y471-K510 HydrophobicContact CE2-CB 4.37Å; Y471-K510 HydrophobicContact CE2-CG 4.36Å; Y471-H726 PolarHBondContact OH-NE2 2.92Å
472	V	95.6	Very high	81	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	153.2	166.8	71.4	0	0	0	0	109.3	L433 L490 M492 T515 I525	L433-V472 HydrophobicContact CB-CG1 4.03Å; L433-V472 HydrophobicContact CD1-CG1 4.34Å; L433-V472 PolarHBondContact N-O 2.75Å; L433-V472 PolarHBondContact O-N 3.14Å; V472-L490 HydrophobicContact CG1-CB 3.96Å; V472-L490 HydrophobicContact CG1-CD1 4.13Å; V472-L490 HydrophobicContact CG2-CB 4.08Å; V472-M492 HydrophobicContact CB-CB 4.37Å; V472-M492 HydrophobicContact CB-CE 4.42Å; V472-M492 HydrophobicContact CB-CG 4.03Å; V472-M492 HydrophobicContact CG1-CE 4.06Å; V472-M492 HydrophobicContact CG1-CG 3.96Å; V472-T515 HydrophobicContact CG2-CG2 4.34Å; V472-I525 HydrophobicContact CG1-CG2 3.82Å
473	N	94.9	Very high	84.1	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.027	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.6	176	-51.3	-66.4	0	0	0	111.2	L431 N432 K510 T512	L431-N473 CarbonylContact O-C 3.52Å; L431-N473 WeakPolarHBondContact O-CA 3.38Å; N432-N473 WeakPolarHBondContact CB-OD1 3.45Å; N432-N473 PolarHBondContact ND2-OD1 3.31Å; N473-K510 PolarHBondContact ND2-O 3.28Å; N473-T512 WeakPolarHBondContact CB-O 3.38Å; N473-T512 PolarHBondContact ND2-O 2.87Å
474	L	96	Very high	86.9	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.9	171.7	-178.2	66.3	0	0	0	109.2	R430 L431 L476 F488 L490 I527 L529	R430-L474 WeakPolarHBondContact CA-O 3.28Å; L431-L474 PolarHBondContact N-O 3.17Å; L431-L474 PolarHBondContact O-N 3.19Å; L474-L476 PolarHBondContact O-N 3.47Å; L474-F488 HydrophobicContact CD1-CD1 4.33Å; L474-F488 HydrophobicContact CD1-CE1 4.37Å; L474-F488 HydrophobicContact CD2-CD1 4.28Å; L474-F488 HydrophobicContact CD2-CD2 4.29Å; L474-F488 HydrophobicContact CD2-CE1 4.49Å; L474-F488 HydrophobicContact CD2-CG 4.19Å; L474-L490 HydrophobicContact CB-CD1 4.17Å; L474-L490 HydrophobicContact CD2-CD1 4.43Å; L474-I527 HydrophobicContact CD2-CD1 4.03Å; L474-L529 HydrophobicContact CD2-CD1 4.13Å
475	L	95.9	Very high	89.2	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	124.6	170.3	-74.8	162.4	0	0	0	109.4	R430 I477 R484 P689 Y690	R430-L475 HydrophobicContact CG-CD2 3.62Å; R430-L475 HydrophobicContact CG-CG 4.41Å; L475-I477 VanDerWaalsContact C-N 3.29Å; L475-I477 PolarHBondContact O-N 3.43Å; L475-R484 WeakPolarHBondContact O-CD 3.4Å; L475-R484 PolarHBondContact O-NE 3.41Å; L475-P689 WeakPolarHBondContact CD1-O 3.28Å; L475-P689 HydrophobicContact CD2-CB 4.14Å; L475-Y690 HydrophobicContact CD1-CD1 4.03Å; L475-Y690 HydrophobicContact CD1-CE1 3.88Å
476	L	96.3	Very high	90.9	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.109	C	C	.	.	S	Bend	trans	-70.8	-30.2	180	-69.4	178.4	0	0	0	112.3	F363 I389 L425 A429 L431 L474 R484	F363-L476 HydrophobicContact CE1-CD1 4.4Å; F363-L476 HydrophobicContact CE1-CD2 4.16Å; F363-L476 HydrophobicContact CE2-CD2 3.85Å; F363-L476 HydrophobicContact CZ-CD1 4.25Å; F363-L476 HydrophobicContact CZ-CD2 3.4Å; F363-L476 VanDerWaalsContact CZ-CD2 3.4Å; F363-L476 HydrophobicContact CZ-CG 4.48Å; I389-L476 HydrophobicContact CD1-CD1 4.29Å; I389-L476 HydrophobicContact CG1-CD1 4.39Å; I389-L476 HydrophobicContact CG2-CD1 4.02Å; L425-L476 HydrophobicContact CD1-CD1 4.16Å; L425-L476 HydrophobicContact CD2-CD1 3.85Å; A429-L476 HydrophobicContact CB-CD1 4.33Å; A429-L476 PolarHBondContact O-N 2.83Å; L431-L476 HydrophobicContact CB-CD2 3.75Å; L431-L476 HydrophobicContact CB-CG 4.12Å; L431-L476 HydrophobicContact CD2-CD2 4.37Å; L474-L476 PolarHBondContact O-N 3.47Å; L476-R484 PolarHBondContact O-N 3.01Å
477	I	94.4	Very high	91.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-116.7	122.5	177.9	-58.1	177.9	0	0	0	108	M356 L475 L482 L538 Y690	M356-I477 HydrophobicContact CE-CD1 3.76Å; M356-I477 HydrophobicContact SD-CD1 3.93Å; M356-I477 HydrophobicContact SD-CG1 4.46Å; L475-I477 VanDerWaalsContact C-N 3.29Å; L475-I477 PolarHBondContact O-N 3.43Å; I477-L482 CarbonylContact C-O 3.59Å; I477-L482 VanDerWaalsContact CA-O 3.31Å; I477-L482 WeakPolarHBondContact CA-O 3.42Å; I477-L538 HydrophobicContact CD1-CB 4.41Å; I477-L538 HydrophobicContact CD1-CD2 4.06Å; I477-Y690 WeakPolarHBondContact O-CE1 3.49Å; I477-Y690 PolarHBondContact O-OH 2.72Å
478	D	91.4	Very high	92.5	Very high	21 Å²	21	22.1 Å²	22.1	11%	0.112	11%	0.11	C	C	.	.			trans	-75.2	178.8	-177.9	76.8	5.8	0	0	0	113.2	R480 S481 L482 Y690	D478-R480 PolarHBondContact O-N 3.07Å; D478-R480 VanDerWaalsContact OD1-CA 3.32Å; D478-R480 WeakPolarHBondContact OD1-CA 3.31Å; D478-R480 WeakPolarHBondContact OD1-CB 3.43Å; D478-R480 PolarHBondContact OD1-N 3.19Å; D478-S481 PolarHBondContact O-N 3.24Å; D478-S481 PolarHBondContact OD1-N 2.92Å; D478-L482 PolarHBondContact N-O 3.05Å; D478-L482 WeakPolarHBondContact OD1-CB 3.48Å; D478-L482 PolarHBondContact OD1-N 3.28Å; D478-Y690 VanDerWaalsContact C-CE1 3.5Å
479	H	87.8	Confident	92.9	Very high	24 Å²	24	26 Å²	26	11%	0.111	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.5	179.4	58.4	-70	0	0	0	113.4	D173 E174 F177 S481 Y690	D173-H479 IonicContact OD1-CE1 3.89Å; D173-H479 PolarHBondContact OD1-CE1 3.05Å; D173-H479 IonicContact OD1-NE2 3.52Å; E174-H479 HydrophobicContact CG-CB 3.9Å; F177-H479 AromaticContact CD1-CD2 3.42Å; F177-H479 VanDerWaalsContact CD1-CD2 3.42Å; F177-H479 WeakPolarHBondContact CD1-CD2 3.39Å; F177-H479 AromaticContact CE1-CD2 3.78Å; F177-H479 AromaticContact CG-CD2 3.6Å; F177-H479 AromaticContact CG-NE2 3.71Å; H479-S481 VanDerWaalsContact C-N 3.26Å; H479-S481 PolarHBondContact O-N 3.23Å; H479-Y690 HydrophobicContact CB-CD1 4.04Å; H479-Y690 HydrophobicContact CB-CE1 4.48Å
480	R	85.1	Confident	93.3	Very high	13 Å²	13	25 Å²	25	5%	0.049	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	0.4	175.5	-64	-174.6	176.5	81.8	4.5	113.5	D113 D173 V334 D478 L482	D113-R480 IonicContact OD1-CZ 3.8Å; D113-R480 IonicContact OD1-NE 3.07Å; D113-R480 PolarHBondContact OD1-NE 3.1Å; D113-R480 IonicContact OD1-NH2 3.93Å; D113-R480 IonicContact OD2-NE 2.71Å; D113-R480 PolarHBondContact OD2-NE 3.32Å; D173-R480 IonicContact OD1-CZ 2.75Å; D173-R480 IonicContact OD1-NH1 3.18Å; D173-R480 PolarHBondContact OD1-NH1 3.06Å; D173-R480 IonicContact OD1-NH2 3.51Å; D173-R480 PolarHBondContact OD1-NH2 3.21Å; D173-R480 IonicContact OD2-CZ 3.44Å; D173-R480 IonicContact OD2-NH1 3.28Å; D173-R480 PolarHBondContact OD2-NH1 3.31Å; D173-R480 IonicContact OD2-NH2 3.47Å; D173-R480 PolarHBondContact OD2-NH2 3.02Å; V334-R480 HydrophobicContact CG2-CB 4.4Å; D478-R480 PolarHBondContact O-N 3.07Å; D478-R480 VanDerWaalsContact OD1-CA 3.32Å; D478-R480 WeakPolarHBondContact OD1-CA 3.31Å; D478-R480 WeakPolarHBondContact OD1-CB 3.43Å; D478-R480 PolarHBondContact OD1-N 3.19Å; R480-L482 VanDerWaalsContact C-N 3.34Å; R480-L482 HydrophobicContact CB-CD1 4.13Å; R480-L482 HydrophobicContact CB-CG 4.2Å
481	S	89.2	Confident	93.5	Very high	13 Å²	13	25.7 Å²	25.7	9%	0.091	13%	0.128	C	C	.	.	S	Bend	trans	68.5	30.3	-175.2	-41.1	0	0	0	0	113.2	K427 D478 H479 L538	K427-S481 PolarHBondContact NZ-OG 3.25Å; D478-S481 PolarHBondContact O-N 3.24Å; D478-S481 PolarHBondContact OD1-N 2.92Å; H479-S481 VanDerWaalsContact C-N 3.26Å; H479-S481 PolarHBondContact O-N 3.23Å; S481-L538 PolarHBondContact O-N 3.19Å
482	L	89.9	Confident	93.6	Very high	26 Å²	26	25.3 Å²	25.3	14%	0.136	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-94.3	139.5	171.5	-61.8	166.7	0	0	0	110.4	V334 I477 D478 R480 R484 P535 V536 V537	V334-L482 HydrophobicContact CB-CD2 4.12Å; V334-L482 HydrophobicContact CG1-CD2 4.35Å; V334-L482 HydrophobicContact CG2-CD1 4.08Å; V334-L482 HydrophobicContact CG2-CD2 4.08Å; V334-L482 HydrophobicContact CG2-CG 4.19Å; I477-L482 CarbonylContact C-O 3.59Å; I477-L482 VanDerWaalsContact CA-O 3.31Å; I477-L482 WeakPolarHBondContact CA-O 3.42Å; D478-L482 PolarHBondContact N-O 3.05Å; D478-L482 WeakPolarHBondContact OD1-CB 3.48Å; D478-L482 PolarHBondContact OD1-N 3.28Å; R480-L482 VanDerWaalsContact C-N 3.34Å; R480-L482 HydrophobicContact CB-CD1 4.13Å; R480-L482 HydrophobicContact CB-CG 4.2Å; L482-R484 PolarHBondContact O-N 3.35Å; L482-P535 HydrophobicContact CD2-CB 4.09Å; L482-V536 WeakPolarHBondContact CA-O 3.29Å; L482-V537 HydrophobicContact CD2-CB 4.46Å; L482-V537 HydrophobicContact CD2-CG2 3.57Å
483	L	93.5	Very high	93.4	Very high	7 Å²	7	26 Å²	26	4%	0.037	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-68.6	127.2	168.1	-177.2	69.6	0	0	0	108.9	I422 L425 Q485 Y532 V536	I422-L483 HydrophobicContact CG2-CD2 3.78Å; L425-L483 HydrophobicContact CD1-CD1 4.13Å; L483-Q485 WeakPolarHBondContact O-CG 3.44Å; L483-Y532 HydrophobicContact CD2-CE2 3.84Å; L483-V536 HydrophobicContact CB-CB 4.03Å; L483-V536 HydrophobicContact CB-CG1 4.22Å; L483-V536 HydrophobicContact CD2-CB 4.22Å; L483-V536 HydrophobicContact CD2-CG1 4.15Å; L483-V536 PolarHBondContact N-O 3.27Å
484	R	93.9	Very high	93.2	Very high	23 Å²	23	31.6 Å²	31.6	9%	0.087	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-67.1	142.3	176.6	-68.1	-162.2	-169.4	-109.5	0.9	111.6	H171 D172 L475 L476 L482 F488 L529	H171-R484 PolarHBondContact CD2-NH1 3.22Å; H171-R484 VanDerWaalsContact CD2-NH1 3.31Å; H171-R484 PolarHBondContact NE2-NH1 3.18Å; D172-R484 IonicContact OD2-CZ 3.64Å; D172-R484 VanDerWaalsContact OD2-CZ 3.23Å; D172-R484 IonicContact OD2-NH1 2.69Å; D172-R484 PolarHBondContact OD2-NH1 3.47Å; D172-R484 IonicContact OD2-NH2 3.44Å; D172-R484 PolarHBondContact OD2-NH2 2.82Å; L475-R484 WeakPolarHBondContact O-CD 3.4Å; L475-R484 PolarHBondContact O-NE 3.41Å; L476-R484 PolarHBondContact O-N 3.01Å; L482-R484 PolarHBondContact O-N 3.35Å; R484-F488 HydrophobicContact CB-CE2 4.49Å; R484-F488 HydrophobicContact CB-CZ 4.06Å; R484-F488 HydrophobicContact CG-CZ 4.5Å; R484-L529 HydrophobicContact CB-CD1 3.8Å; R484-L529 WeakPolarHBondContact O-CD1 3.47Å
485	Q	93.4	Very high	92.6	Very high	48 Å²	48	32.5 Å²	32.5	22%	0.224	16%	0.158	C	C	.	.			trans	-145.3	156.4	-173.5	-57.7	178.1	38	0	0	110.1	L483 D530 Y532	L483-Q485 WeakPolarHBondContact O-CG 3.44Å; Q485-D530 WeakPolarHBondContact CB-O 3.28Å; Q485-D530 WeakPolarHBondContact CG-O 3.35Å; Q485-Y532 VanDerWaalsContact CD-CD2 3.47Å; Q485-Y532 HydrophobicContact CG-CD2 4Å; Q485-Y532 HydrophobicContact CG-CE2 4.36Å
486	G	93.7	Very high	91.4	Very high	16 Å²	16	36.7 Å²	36.7	17%	0.165	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89	-161.8	175.9	0	0	0	0	0	114	F488 L529	G486-F488 WeakPolarHBondContact O-CD2 3.21Å; G486-L529 PolarHBondContact N-O 3.41Å; G486-L529 PolarHBondContact O-N 3.37Å
487	E	95.4	Very high	89.6	Confident	150 Å²	150	43.7 Å²	43.7	70%	0.701	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	140.4	-171.3	-65.8	179.2	179.3	0	0	111.8	I527 L528	E487-I527 WeakPolarHBondContact CA-O 3.41Å; E487-L528 HydrophobicContact CG-CB 4.37Å; E487-L528 HydrophobicContact CG-CD1 3.55Å
488	F	96.3	Very high	87.5	Confident	26 Å²	26	52.4 Å²	52.4	11%	0.114	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133.8	176.7	-64.5	-95.4	0	0	0	110.1	L474 R484 G486 L490 A526 I527 L529	L474-F488 HydrophobicContact CD1-CD1 4.33Å; L474-F488 HydrophobicContact CD1-CE1 4.37Å; L474-F488 HydrophobicContact CD2-CD1 4.28Å; L474-F488 HydrophobicContact CD2-CD2 4.29Å; L474-F488 HydrophobicContact CD2-CE1 4.49Å; L474-F488 HydrophobicContact CD2-CG 4.19Å; R484-F488 HydrophobicContact CB-CE2 4.49Å; R484-F488 HydrophobicContact CB-CZ 4.06Å; R484-F488 HydrophobicContact CG-CZ 4.5Å; G486-F488 WeakPolarHBondContact O-CD2 3.21Å; F488-L490 HydrophobicContact CB-CD2 4.11Å; F488-L490 HydrophobicContact CB-CG 4.11Å; F488-A526 WeakPolarHBondContact O-CA 3.47Å; F488-I527 HydrophobicContact CB-CD1 4.22Å; F488-I527 HydrophobicContact CB-CG1 3.76Å; F488-I527 PolarHBondContact N-O 3.44Å; F488-I527 PolarHBondContact O-N 2.66Å; F488-L529 HydrophobicContact CD2-CD1 4.16Å; F488-L529 HydrophobicContact CD2-CG 4.36Å; F488-L529 HydrophobicContact CE2-CD1 3.71Å; F488-L529 HydrophobicContact CE2-CG 4.24Å; F488-L529 HydrophobicContact CZ-CD1 4.49Å
489	I	95.8	Very high	85.6	Confident	121 Å²	121	53.4 Å²	53.4	62%	0.621	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	111.7	168.2	-59	174.9	0	0	0	106.4	A524	I489-A524 HydrophobicContact CG2-CB 4.09Å
490	L	96.1	Very high	83.4	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	114.6	-172	-56.4	176.6	0	0	0	109.6	L433 V472 L474 F488 T515 A524 I525 I527	L433-L490 HydrophobicContact CD1-CD1 4.22Å; V472-L490 HydrophobicContact CG1-CB 3.96Å; V472-L490 HydrophobicContact CG1-CD1 4.13Å; V472-L490 HydrophobicContact CG2-CB 4.08Å; L474-L490 HydrophobicContact CB-CD1 4.17Å; L474-L490 HydrophobicContact CD2-CD1 4.43Å; F488-L490 HydrophobicContact CB-CD2 4.11Å; F488-L490 HydrophobicContact CB-CG 4.11Å; L490-T515 HydrophobicContact CB-CG2 4.37Å; L490-T515 HydrophobicContact CD2-CG2 3.95Å; L490-A524 WeakPolarHBondContact O-CA 3.27Å; L490-I525 HydrophobicContact CB-CG2 3.95Å; L490-I525 PolarHBondContact N-O 2.89Å; L490-I525 PolarHBondContact O-N 3.07Å; L490-I527 HydrophobicContact CD1-CD1 4.02Å
491	H	95.8	Very high	81.2	Confident	31 Å²	31	67 Å²	67	14%	0.144	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	126.9	173.1	-73	-89.9	0	0	0	110.4	N516 S522	H491-N516 HydrophobicContact CB-CB 4.1Å; H491-N516 WeakPolarHBondContact CB-O 3.23Å; H491-N516 PolarHBondContact O-N 3.41Å; H491-S522 PolarHBondContact ND1-OG 3.27Å
492	M	94.7	Very high	78.8	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.005	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-96.2	153.9	-167	-53.6	-172.9	71.2	0	0	112.4	L433 V435 V472 N516 M523 I525	L433-M492 WeakPolarHBondContact O-CE 3.43Å; V435-M492 HydrophobicContact CG2-CE 3.75Å; V435-M492 HydrophobicContact CG2-SD 3.86Å; V472-M492 HydrophobicContact CB-CB 4.37Å; V472-M492 HydrophobicContact CB-CE 4.42Å; V472-M492 HydrophobicContact CB-CG 4.03Å; V472-M492 HydrophobicContact CG1-CE 4.06Å; V472-M492 HydrophobicContact CG1-CG 3.96Å; M492-N516 WeakPolarHBondContact O-CB 3.18Å; M492-N516 PolarHBondContact O-ND2 2.84Å; M492-M523 WeakPolarHBondContact CB-O 3.37Å; M492-M523 HydrophobicContact CE-CE 4.36Å; M492-M523 PolarHBondContact N-O 3.49Å; M492-M523 HydrophobicContact SD-CE 3.46Å; M492-M523 WeakPolarHBondContact SD-CE 3.18Å; M492-I525 HydrophobicContact CE-CG2 4.46Å; M492-I525 HydrophobicContact CG-CB 4.45Å; M492-I525 HydrophobicContact CG-CG2 3.95Å; M492-I525 HydrophobicContact SD-CB 3.78Å; M492-I525 HydrophobicContact SD-CG2 3.72Å
493	W	92.8	Very high	76.4	Confident	14 Å²	14	73.4 Å²	73.4	5%	0.053	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138	173.5	-57.9	100.7	0	0	0	110.1	Y470 Y471 A514 T515 N516 M725 H726	Y470-W493 CarbonylContact C-O 3.49Å; Y470-W493 WeakPolarHBondContact CA-O 3.19Å; Y471-W493 HydrophobicContact CD1-CB 4.1Å; Y471-W493 HydrophobicContact CD2-CB 4.43Å; Y471-W493 HydrophobicContact CE1-CB 3.59Å; Y471-W493 HydrophobicContact CE2-CB 3.95Å; Y471-W493 AromaticContact CE2-CD1 3.84Å; Y471-W493 HydrophobicContact CE2-CG 4.13Å; Y471-W493 HydrophobicContact CG-CB 4.5Å; Y471-W493 PolarHBondContact N-O 2.97Å; Y471-W493 PolarHBondContact O-N 3.06Å; W493-A514 HydrophobicContact CZ2-CB 4.29Å; W493-A514 PolarHBondContact NE1-O 3.22Å; W493-T515 WeakPolarHBondContact CZ2-O 3.48Å; W493-N516 HydrophobicContact CD2-CB 4.15Å; W493-N516 HydrophobicContact CE3-CB 4.1Å; W493-N516 HydrophobicContact CH2-CB 4.44Å; W493-N516 HydrophobicContact CZ2-CB 4.47Å; W493-N516 HydrophobicContact CZ3-CB 4.25Å; W493-M725 HydrophobicContact CH2-CB 3.97Å; W493-M725 HydrophobicContact CZ3-CB 3.98Å; W493-H726 AromaticContact CD2-CD2 3.41Å; W493-H726 VanDerWaalsContact CD2-CD2 3.41Å; W493-H726 AromaticContact CD2-NE2 3.53Å; W493-H726 AromaticContact CE2-CD2 3.54Å; W493-H726 AromaticContact CE3-CD2 3.58Å; W493-H726 AromaticContact CE3-NE2 3.4Å; W493-H726 AromaticContact CG-CD2 3.94Å; W493-H726 AromaticContact CG-NE2 3.92Å; W493-H726 AromaticContact CH2-CD2 3.99Å; W493-H726 AromaticContact CZ2-CD2 3.84Å; W493-H726 AromaticContact CZ3-CD2 3.87Å; W493-H726 AromaticContact CZ3-NE2 3.94Å
494	K	89.1	Confident	74	Confident	124 Å²	124	76.9 Å²	76.9	54%	0.539	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	134.5	176.7	-175.8	178	175.2	-175.3	0	110.5	Y470 E497	Y470-K494 HydrophobicContact CD1-CB 3.93Å; Y470-K494 HydrophobicContact CD1-CG 4.22Å; Y470-K494 HydrophobicContact CE1-CB 3.76Å; Y470-K494 HydrophobicContact CE1-CD 4.26Å; Y470-K494 HydrophobicContact CE1-CG 3.75Å; K494-E497 IonicContact NZ-OE1 3.74Å
495	M	83.5	Confident	71.8	Confident	20 Å²	20	77 Å²	77	10%	0.099	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-75.5	136.6	171.6	-75	-61.2	-73.1	0	0	111.5	L468 L469 Y471	L468-M495 HydrophobicContact CD2-CE 4.2Å; L468-M495 HydrophobicContact CD2-CG 3.85Å; L468-M495 HydrophobicContact CD2-SD 4.1Å; L468-M495 HydrophobicContact CG-CG 3.77Å; L469-M495 WeakPolarHBondContact O-CB 3.45Å; L469-M495 PolarHBondContact O-N 3.33Å; Y471-M495 HydrophobicContact CD1-CG 4.05Å; Y471-M495 HydrophobicContact CD1-SD 3.62Å; Y471-M495 HydrophobicContact CE1-CG 4.43Å; Y471-M495 HydrophobicContact CE1-SD 3.6Å; Y471-M495 VanDerWaalsContact CE1-SD 3.6Å
496	P	71.3	Confident	70.1	Confident	90 Å²	90	77.9 Å²	77.9	58%	0.584	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-63.4	139.8	174.7	-20	31.3	0	0	0	112.7	K498 S499	P496-K498 PolarHBondContact O-N 3.04Å; P496-S499 WeakPolarHBondContact O-CB 3.42Å; P496-S499 PolarHBondContact O-N 3.46Å
497	E	57.7	Low	68.9	Low	148 Å²	148	79.1 Å²	79.1	69%	0.692	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.7	-175.9	-67.9	174.2	-172.6	0	0	114.3	K494 S499	K494-E497 IonicContact NZ-OE1 3.74Å; E497-S499 VanDerWaalsContact C-N 3.35Å
498	K	52.2	Low	67.9	Low	183 Å²	183	72 Å²	72	80%	0.796	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	1.6	179.4	-66.9	-170.7	175.7	-168.6	0	114.5	P496 E500 E1117	P496-K498 PolarHBondContact O-N 3.04Å; K498-E500 PolarHBondContact O-N 2.95Å; K498-E1117 IonicContact NZ-OE1 3.36Å
499	S	50.3	Low	67.2	Low	43 Å²	43	71.8 Å²	71.8	30%	0.301	38%	0.38	S	S	.	.			trans	-83.8	22.7	-177.1	178.2	0	0	0	0	113.8	P496 E497 E501	P496-S499 WeakPolarHBondContact O-CB 3.42Å; P496-S499 PolarHBondContact O-N 3.46Å; E497-S499 VanDerWaalsContact C-N 3.35Å; S499-E501 VanDerWaalsContact C-N 3.27Å; S499-E501 PolarHBondContact O-N 3.44Å
500	E	40.8	Very low	66.5	Low	126 Å²	126	67.7 Å²	67.7	59%	0.589	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-5.5	-166.9	-67.5	-154	152.3	0	0	115.7	R467 K498	R467-E500 IonicContact NH1-OE1 3.12Å; R467-E500 PolarHBondContact NH1-OE1 3.23Å; R467-E500 VanDerWaalsContact NH1-OE1 3.12Å; K498-E500 PolarHBondContact O-N 2.95Å
501	E	39.1	Very low	66	Low	197 Å²	197	68.7 Å²	68.7	92%	0.921	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-10	-172.9	-74.1	-172.1	160.2	0	0	116.5	S499	S499-E501 VanDerWaalsContact C-N 3.27Å; S499-E501 PolarHBondContact O-N 3.44Å
502	S	39.8	Very low	65.7	Low	37 Å²	37	67.4 Å²	67.4	26%	0.259	36%	0.357	S	S	.	.			trans	-155.1	115.4	172.3	60.3	0	0	0	0	113	S504 S505	S502-S504 WeakPolarHBondContact CB-OG 3.44Å; S502-S504 PolarHBondContact O-N 3.11Å; S502-S505 PolarHBondContact O-N 3.22Å; S502-S505 PolarHBondContact O-OG 2.92Å; S502-S505 PolarHBondContact OG-N 3.12Å
503	S	38.7	Very low	65.4	Low	136 Å²	136	68.2 Å²	68.2	95%	0.951	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-3.3	161.1	48.7	0	0	0	0	112.8
504	S	43.3	Very low	65.3	Low	80 Å²	80	68.1 Å²	68.1	56%	0.559	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	1.2	-179.5	56.8	0	0	0	0	115.7	S502 I506	S502-S504 WeakPolarHBondContact CB-OG 3.44Å; S502-S504 PolarHBondContact O-N 3.11Å; S504-I506 WeakPolarHBondContact O-CG1 3.34Å; S504-I506 PolarHBondContact O-N 3.2Å
505	S	49.3	Very low	65.5	Low	24 Å²	24	62.7 Å²	62.7	17%	0.168	34%	0.342	C	S	.	.			trans	-71	104.5	173.1	60.9	0	0	0	0	110.2	S502 K510	S502-S505 PolarHBondContact O-N 3.22Å; S502-S505 PolarHBondContact O-OG 2.92Å; S502-S505 PolarHBondContact OG-N 3.12Å; S505-K510 PolarHBondContact O-NZ 3.27Å
506	I	56.2	Low	65.9	Low	67 Å²	67	62.8 Å²	62.8	34%	0.344	34%	0.343	S	S	.	.			trans	-85.1	120.7	178.6	-42.3	-178.2	0	0	0	106.5	Q393 S504 M1054	Q393-I506 VanDerWaalsContact OE1-CD1 3.23Å; S504-I506 WeakPolarHBondContact O-CG1 3.34Å; S504-I506 PolarHBondContact O-N 3.2Å; I506-M1054 HydrophobicContact CB-CE 3.89Å; I506-M1054 HydrophobicContact CB-SD 3.88Å; I506-M1054 HydrophobicContact CG2-CE 3.27Å; I506-M1054 HydrophobicContact CG2-SD 3.96Å
507	N	69.8	Low	66.8	Low	43 Å²	43	60.5 Å²	60.5	23%	0.23	33%	0.328	C	S	.	.			trans	-116.5	142	172.1	173.8	-2.5	0	0	0	106.4	D509 K510 M1054	N507-D509 PolarHBondContact ND2-OD2 3.07Å; N507-D509 PolarHBondContact O-N 3.41Å; N507-D509 PolarHBondContact OD1-N 3.48Å; N507-K510 WeakPolarHBondContact O-CB 3.42Å; N507-K510 PolarHBondContact O-N 3.21Å; N507-M1054 PolarHBondContact OD1-O 3.23Å
508	A	73	Confident	68.4	Low	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-54.5	-31.5	174.5	0	0	0	0	0	111	K510 L511 K686 F687 Y727 M1054	A508-K510 PolarHBondContact O-N 3.39Å; A508-K510 VanDerWaalsContact O-N 3.17Å; A508-L511 WeakPolarHBondContact O-CA 3.45Å; A508-L511 WeakPolarHBondContact O-CB 3.41Å; A508-L511 PolarHBondContact O-N 3.16Å; A508-K686 HydrophobicContact CB-CB 4.06Å; A508-K686 HydrophobicContact CB-CD 4.25Å; A508-F687 HydrophobicContact CB-CD1 4.32Å; A508-F687 HydrophobicContact CB-CE1 3.74Å; A508-Y727 PolarHBondContact O-OH 3.28Å; A508-M1054 VanDerWaalsContact CA-O 3.3Å; A508-M1054 WeakPolarHBondContact CA-O 3.47Å; A508-M1054 HydrophobicContact CB-CB 3.89Å; A508-M1054 WeakPolarHBondContact CB-O 3.49Å; A508-M1054 PolarHBondContact N-O 2.9Å
509	D	82.1	Confident	70.2	Confident	22 Å²	22	53.3 Å²	53.3	12%	0.118	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-55.3	-35.7	175.6	-64.5	-28.8	0	0	0	111.8	Y471 N507 L511 T512 H726	Y471-D509 PolarHBondContact OH-O 2.91Å; N507-D509 PolarHBondContact ND2-OD2 3.07Å; N507-D509 PolarHBondContact O-N 3.41Å; N507-D509 PolarHBondContact OD1-N 3.48Å; D509-L511 PolarHBondContact O-N 3.35Å; D509-L511 VanDerWaalsContact O-N 3.11Å; D509-T512 WeakPolarHBondContact O-CG2 3.38Å; D509-T512 PolarHBondContact O-N 3.02Å; D509-H726 IonicContact OD1-CE1 3.77Å; D509-H726 IonicContact OD1-CG 2.6Å; D509-H726 IonicContact OD1-ND1 3.67Å; D509-H726 PolarHBondContact OD1-ND1 2.9Å; D509-H726 IonicContact OD2-CE1 3.26Å; D509-H726 IonicContact OD2-ND1 2.78Å
510	K	82	Confident	72	Confident	34 Å²	34	55.2 Å²	55.2	15%	0.148	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-66.8	-11.6	175.2	-64.2	-177.1	177.1	173.1	0	114	Y471 N473 S505 N507 A508	Y471-K510 HydrophobicContact CE1-CG 4.45Å; Y471-K510 HydrophobicContact CE2-CB 4.37Å; Y471-K510 HydrophobicContact CE2-CG 4.36Å; N473-K510 PolarHBondContact ND2-O 3.28Å; S505-K510 PolarHBondContact O-NZ 3.27Å; N507-K510 WeakPolarHBondContact O-CB 3.42Å; N507-K510 PolarHBondContact O-N 3.21Å; A508-K510 PolarHBondContact O-N 3.39Å; A508-K510 VanDerWaalsContact O-N 3.17Å
511	L	85.4	Confident	74.3	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.12	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-97	-13.1	-177.7	-58.2	-173.6	0	0	0	112.8	R430 A508 D509 C651 F687 M1054	R430-L511 PolarHBondContact NH1-O 3.42Å; A508-L511 WeakPolarHBondContact O-CA 3.45Å; A508-L511 WeakPolarHBondContact O-CB 3.41Å; A508-L511 PolarHBondContact O-N 3.16Å; D509-L511 PolarHBondContact O-N 3.35Å; D509-L511 VanDerWaalsContact O-N 3.11Å; L511-C651 HydrophobicContact CD1-CB 3.58Å; L511-F687 HydrophobicContact CD1-CD1 3.97Å; L511-F687 HydrophobicContact CD1-CE1 4.35Å; L511-M1054 HydrophobicContact CD1-CE 3.83Å; L511-M1054 HydrophobicContact CG-CE 4.48Å
512	T	89.8	Confident	76.8	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.025	27%	0.27	C	S	.	.			trans	-63.4	141.1	-175	-168.4	0	0	0	0	111.9	N473 D509 A514 H726 Y727	N473-T512 WeakPolarHBondContact CB-O 3.38Å; N473-T512 PolarHBondContact ND2-O 2.87Å; D509-T512 WeakPolarHBondContact O-CG2 3.38Å; D509-T512 PolarHBondContact O-N 3.02Å; T512-A514 HydrophobicContact CG2-CB 4.49Å; T512-A514 WeakPolarHBondContact OG1-CB 3.27Å; T512-A514 PolarHBondContact OG1-N 2.83Å; T512-A514 VanDerWaalsContact OG1-N 3.12Å; T512-H726 HydrophobicContact CG2-CB 4.08Å; T512-H726 PolarHBondContact OG1-O 3.39Å; T512-Y727 PolarHBondContact N-OH 2.95Å
513	S	88.4	Confident	79.4	Confident	17 Å²	17	41.7 Å²	41.7	12%	0.119	26%	0.257	C	S	.	.			trans	-88	-5.6	168.1	52.2	0	0	0	0	113
514	A	90.5	Very high	82.1	Confident	13 Å²	13	35.7 Å²	35.7	11%	0.107	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-70.2	142.7	178.1	0	0	0	0	0	111.2	W493 T512 H726	W493-A514 HydrophobicContact CZ2-CB 4.29Å; W493-A514 PolarHBondContact NE1-O 3.22Å; T512-A514 HydrophobicContact CG2-CB 4.49Å; T512-A514 WeakPolarHBondContact OG1-CB 3.27Å; T512-A514 PolarHBondContact OG1-N 2.83Å; T512-A514 VanDerWaalsContact OG1-N 3.12Å; A514-H726 WeakPolarHBondContact CB-O 3.45Å
515	T	92	Very high	84.7	Confident	10 Å²	10	31.9 Å²	31.9	6%	0.061	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-87.6	155.5	169	50.7	0	0	0	0	110.6	N169 V472 L490 W493 P517	N169-T515 PolarHBondContact ND2-O 3.47Å; N169-T515 PolarHBondContact OD1-OG1 2.86Å; N169-T515 VanDerWaalsContact OD1-OG1 3.08Å; V472-T515 HydrophobicContact CG2-CG2 4.34Å; L490-T515 HydrophobicContact CB-CG2 4.37Å; L490-T515 HydrophobicContact CD2-CG2 3.95Å; W493-T515 WeakPolarHBondContact CZ2-O 3.48Å; T515-P517 WeakPolarHBondContact O-CD 3.49Å
516	N	92.6	Very high	87	Confident	22 Å²	22	32 Å²	32	12%	0.118	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-64.6	122.6	177.9	-172.6	-19.4	0	0	0	110.6	N169 H491 M492 W493 D518 S522	N169-N516 PolarHBondContact OD1-O 3.03Å; H491-N516 HydrophobicContact CB-CB 4.1Å; H491-N516 WeakPolarHBondContact CB-O 3.23Å; H491-N516 PolarHBondContact O-N 3.41Å; M492-N516 WeakPolarHBondContact O-CB 3.18Å; M492-N516 PolarHBondContact O-ND2 2.84Å; W493-N516 HydrophobicContact CD2-CB 4.15Å; W493-N516 HydrophobicContact CE3-CB 4.1Å; W493-N516 HydrophobicContact CH2-CB 4.44Å; W493-N516 HydrophobicContact CZ2-CB 4.47Å; W493-N516 HydrophobicContact CZ3-CB 4.25Å; N516-D518 VanDerWaalsContact C-N 3.28Å; N516-D518 PolarHBondContact O-N 3.37Å; N516-D518 PolarHBondContact OD1-N 2.66Å; N516-S522 WeakPolarHBondContact ND2-CB 3.12Å
517	P	90.3	Very high	89	Confident	42 Å²	42	28.9 Å²	28.9	27%	0.273	18%	0.176	S	C	.	.	S	Bend	trans	-68.3	-23.8	-179.4	26	-33.7	0	0	0	113.9	N169 T515 K519 M725	N169-P517 HydrophobicContact CB-CB 4.16Å; N169-P517 VanDerWaalsContact CG-CA 3.42Å; N169-P517 WeakPolarHBondContact ND2-CA 3.41Å; N169-P517 WeakPolarHBondContact ND2-CB 3.49Å; T515-P517 WeakPolarHBondContact O-CD 3.49Å; P517-K519 VanDerWaalsContact C-N 3.33Å; P517-K519 PolarHBondContact O-N 2.86Å; P517-M725 HydrophobicContact CG-SD 4.44Å
518	D	90.4	Very high	90.3	Very high	72 Å²	72	28.6 Å²	28.6	39%	0.385	18%	0.175	S	C	.	.			trans	-80.7	80	179.2	-175.4	0.1	0	0	0	111.2	N516 A520 S521 S522	N516-D518 VanDerWaalsContact C-N 3.28Å; N516-D518 PolarHBondContact O-N 3.37Å; N516-D518 PolarHBondContact OD1-N 2.66Å; D518-A520 PolarHBondContact O-N 3.48Å; D518-A520 PolarHBondContact OD1-N 3.07Å; D518-S521 PolarHBondContact OD1-N 3.37Å; D518-S521 WeakPolarHBondContact OD2-CB 3.26Å; D518-S521 PolarHBondContact OD2-OG 3.07Å; D518-S522 WeakPolarHBondContact O-CB 3.47Å; D518-S522 PolarHBondContact O-N 3.03Å; D518-S522 VanDerWaalsContact O-N 3.1Å; D518-S522 PolarHBondContact O-OG 3.25Å
519	K	89.8	Confident	91.5	Very high	107 Å²	107	28.7 Å²	28.7	47%	0.465	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.1	179.3	-60.7	-175.3	175.2	173.6	0	113.8	S168 P517	S168-K519 WeakPolarHBondContact O-CE 3.46Å; S168-K519 PolarHBondContact O-NZ 2.92Å; P517-K519 VanDerWaalsContact C-N 3.33Å; P517-K519 PolarHBondContact O-N 2.86Å
520	A	88.3	Confident	92.1	Very high	83 Å²	83	28.5 Å²	28.5	69%	0.686	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-26.9	-173.4	0	0	0	0	0	112.9	P373 D518	P373-A520 WeakPolarHBondContact CG-O 3.46Å; D518-A520 PolarHBondContact O-N 3.48Å; D518-A520 PolarHBondContact OD1-N 3.07Å
521	S	88.9	Confident	92.5	Very high	65 Å²	65	35.4 Å²	35.4	46%	0.455	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117	-20.9	-178.1	86.8	0	0	0	0	114.4	D518	D518-S521 PolarHBondContact OD1-N 3.37Å; D518-S521 WeakPolarHBondContact OD2-CB 3.26Å; D518-S521 PolarHBondContact OD2-OG 3.07Å
522	S	92.6	Very high	92.5	Very high	10 Å²	10	36.9 Å²	36.9	7%	0.07	21%	0.208	C	C	.	.	S	Bend	trans	-78	154.9	-176.7	65.8	0	0	0	0	113	P373 H491 N516 D518	P373-S522 WeakPolarHBondContact CD-O 3.43Å; H491-S522 PolarHBondContact ND1-OG 3.27Å; N516-S522 WeakPolarHBondContact ND2-CB 3.12Å; D518-S522 WeakPolarHBondContact O-CB 3.47Å; D518-S522 PolarHBondContact O-N 3.03Å; D518-S522 VanDerWaalsContact O-N 3.1Å; D518-S522 PolarHBondContact O-OG 3.25Å
523	M	94.2	Very high	92.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	25%	0.248	C	C	.	.			trans	-75.5	139.1	169.9	-175.1	169.6	77.3	0	0	110.3	I370 D371 I372 F406 V435 Y470 M492	I370-M523 HydrophobicContact CB-SD 4.43Å; I370-M523 HydrophobicContact CD1-SD 4.12Å; D371-M523 CarbonylContact O-C 3.51Å; D371-M523 VanDerWaalsContact O-CA 3.28Å; D371-M523 WeakPolarHBondContact O-CA 3.27Å; D371-M523 VanDerWaalsContact O-CG 3.31Å; D371-M523 WeakPolarHBondContact O-CG 3.35Å; I372-M523 HydrophobicContact CB-CB 4.05Å; I372-M523 HydrophobicContact CB-CG 3.94Å; I372-M523 HydrophobicContact CB-SD 4.36Å; I372-M523 HydrophobicContact CD1-CB 4.11Å; I372-M523 HydrophobicContact CG1-CB 4.01Å; I372-M523 HydrophobicContact CG1-CG 4.44Å; F406-M523 HydrophobicContact CE2-SD 4.45Å; V435-M523 HydrophobicContact CB-CE 3.78Å; V435-M523 HydrophobicContact CG1-CE 4.18Å; V435-M523 HydrophobicContact CG2-CE 3.21Å; V435-M523 HydrophobicContact CG2-SD 4.42Å; Y470-M523 HydrophobicContact CD1-CB 4.26Å; Y470-M523 HydrophobicContact CD1-CE 4Å; Y470-M523 HydrophobicContact CD2-CE 3.16Å; Y470-M523 HydrophobicContact CD2-SD 3.74Å; Y470-M523 HydrophobicContact CE1-CB 4.29Å; Y470-M523 HydrophobicContact CE2-CE 3.95Å; Y470-M523 HydrophobicContact CE2-SD 3.92Å; Y470-M523 HydrophobicContact CG-CE 3.2Å; Y470-M523 HydrophobicContact CG-SD 4.19Å; M492-M523 WeakPolarHBondContact CB-O 3.37Å; M492-M523 HydrophobicContact CE-CE 4.36Å; M492-M523 PolarHBondContact N-O 3.49Å; M492-M523 HydrophobicContact SD-CE 3.46Å; M492-M523 WeakPolarHBondContact SD-CE 3.18Å
524	A	96	Very high	91.8	Very high	10 Å²	10	46 Å²	46	8%	0.083	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	146.3	173.5	0	0	0	0	0	111.3	I370 D371 I489 L490	I370-A524 CarbonylContact C-O 3.32Å; I370-A524 VanDerWaalsContact CA-O 3.23Å; I370-A524 WeakPolarHBondContact CA-O 3.41Å; D371-A524 PolarHBondContact N-O 3.05Å; D371-A524 PolarHBondContact O-N 3.48Å; I489-A524 HydrophobicContact CG2-CB 4.09Å; L490-A524 WeakPolarHBondContact O-CA 3.27Å
525	I	97.1	Very high	91.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131	168.3	-174.6	168.1	0	0	0	109.9	V367 I370 I385 L433 V472 L490 M492 I527	V367-I525 HydrophobicContact CG1-CD1 4.49Å; I370-I525 HydrophobicContact CG2-CB 3.99Å; I370-I525 HydrophobicContact CG2-CD1 4.16Å; I370-I525 HydrophobicContact CG2-CG1 3.88Å; I385-I525 HydrophobicContact CD1-CD1 4.22Å; I385-I525 HydrophobicContact CG1-CD1 4.45Å; I385-I525 HydrophobicContact CG2-CD1 3.97Å; L433-I525 HydrophobicContact CB-CD1 4.33Å; L433-I525 HydrophobicContact CD1-CD1 4.24Å; L433-I525 HydrophobicContact CD1-CG2 4.28Å; V472-I525 HydrophobicContact CG1-CG2 3.82Å; L490-I525 HydrophobicContact CB-CG2 3.95Å; L490-I525 PolarHBondContact N-O 2.89Å; L490-I525 PolarHBondContact O-N 3.07Å; M492-I525 HydrophobicContact CE-CG2 4.46Å; M492-I525 HydrophobicContact CG-CB 4.45Å; M492-I525 HydrophobicContact CG-CG2 3.95Å; M492-I525 HydrophobicContact SD-CB 3.78Å; M492-I525 HydrophobicContact SD-CG2 3.72Å; I525-I527 HydrophobicContact CD1-CG2 4.25Å; I525-I527 HydrophobicContact CG1-CG2 4.03Å
526	A	97.8	Very high	91.4	Very high	28 Å²	28	47.9 Å²	47.9	23%	0.231	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.7	175	0	0	0	0	0	110.2	L368 G369 F488	L368-A526 HydrophobicContact CB-CB 4.03Å; L368-A526 WeakPolarHBondContact CB-O 3.34Å; L368-A526 HydrophobicContact CD1-CB 4.2Å; L368-A526 PolarHBondContact N-O 3.15Å; G369-A526 PolarHBondContact N-O 2.86Å; G369-A526 PolarHBondContact O-N 3.34Å; F488-A526 WeakPolarHBondContact O-CA 3.47Å
527	I	97.9	Very high	91.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	156.7	178.3	66.6	175.2	0	0	0	111.3	V365 K366 L431 L433 L474 E487 F488 L490 I525	V365-I527 HydrophobicContact CG2-CB 3.99Å; V365-I527 HydrophobicContact CG2-CD1 4.26Å; V365-I527 HydrophobicContact CG2-CG2 4.4Å; K366-I527 CarbonylContact O-C 3.47Å; K366-I527 VanDerWaalsContact O-CA 3.25Å; K366-I527 WeakPolarHBondContact O-CA 3.42Å; L431-I527 HydrophobicContact CD2-CD1 4.29Å; L433-I527 HydrophobicContact CD1-CD1 3.91Å; L433-I527 HydrophobicContact CD1-CG2 3.89Å; L474-I527 HydrophobicContact CD2-CD1 4.03Å; E487-I527 WeakPolarHBondContact CA-O 3.41Å; F488-I527 HydrophobicContact CB-CD1 4.22Å; F488-I527 HydrophobicContact CB-CG1 3.76Å; F488-I527 PolarHBondContact N-O 3.44Å; F488-I527 PolarHBondContact O-N 2.66Å; L490-I527 HydrophobicContact CD1-CD1 4.02Å; I525-I527 HydrophobicContact CD1-CG2 4.25Å; I525-I527 HydrophobicContact CG1-CG2 4.03Å
528	L	97.8	Very high	91.1	Very high	38 Å²	38	45.9 Å²	45.9	20%	0.199	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.1	172.1	167.1	74.3	0	0	0	109.6	K366 W415 E487	K366-L528 HydrophobicContact CB-CB 4.05Å; K366-L528 WeakPolarHBondContact CB-O 3.19Å; K366-L528 HydrophobicContact CD-CD2 3.96Å; K366-L528 PolarHBondContact N-O 2.5Å; K366-L528 PolarHBondContact O-N 3Å; W415-L528 HydrophobicContact CZ2-CD2 4.4Å; E487-L528 HydrophobicContact CG-CB 4.37Å; E487-L528 HydrophobicContact CG-CD1 3.55Å
529	L	97.1	Very high	90.9	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	152.9	169.7	-64.6	178.8	0	0	0	110.4	F363 V365 L474 R484 G486 F488 K531	F363-L529 HydrophobicContact CE2-CD2 4.17Å; F363-L529 HydrophobicContact CZ-CD2 3.75Å; V365-L529 HydrophobicContact CB-CD2 4.06Å; V365-L529 HydrophobicContact CG2-CD2 3.77Å; L474-L529 HydrophobicContact CD2-CD1 4.13Å; R484-L529 HydrophobicContact CB-CD1 3.8Å; R484-L529 WeakPolarHBondContact O-CD1 3.47Å; G486-L529 PolarHBondContact N-O 3.41Å; G486-L529 PolarHBondContact O-N 3.37Å; F488-L529 HydrophobicContact CD2-CD1 4.16Å; F488-L529 HydrophobicContact CD2-CG 4.36Å; F488-L529 HydrophobicContact CE2-CD1 3.71Å; F488-L529 HydrophobicContact CE2-CG 4.24Å; F488-L529 HydrophobicContact CZ-CD1 4.49Å; L529-K531 PolarHBondContact O-N 3.22Å
530	D	94.5	Very high	90.2	Very high	18 Å²	18	42.7 Å²	42.7	10%	0.096	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-55.7	133.6	176.3	-85.9	-38.8	0	0	0	111.2	R361 R364 W415 Q485 Y532	R361-D530 IonicContact CZ-OD2 3.7Å; R361-D530 IonicContact NH1-OD2 3.75Å; R364-D530 WeakPolarHBondContact CG-OD2 3.32Å; R364-D530 IonicContact CZ-OD1 3.31Å; R364-D530 VanDerWaalsContact CZ-OD1 3.31Å; R364-D530 IonicContact CZ-OD2 3.82Å; R364-D530 IonicContact NE-OD1 3.03Å; R364-D530 PolarHBondContact NE-OD1 3.38Å; R364-D530 IonicContact NE-OD2 2.9Å; R364-D530 PolarHBondContact NE-OD2 3.36Å; R364-D530 IonicContact NH2-OD1 2.75Å; R364-D530 PolarHBondContact NH2-OD1 2.86Å; R364-D530 IonicContact NH2-OD2 3.87Å; W415-D530 WeakPolarHBondContact CH2-OD1 2.8Å; Q485-D530 WeakPolarHBondContact CB-O 3.28Å; Q485-D530 WeakPolarHBondContact CG-O 3.35Å; D530-Y532 HydrophobicContact CB-CE2 3.93Å; D530-Y532 WeakPolarHBondContact CB-OH 3.44Å
531	K	90.9	Very high	89.7	Confident	178 Å²	178	41.2 Å²	41.2	77%	0.774	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-101.1	122.1	173.8	-172.1	176.6	-177.3	176.8	0	109	L529	L529-K531 PolarHBondContact O-N 3.22Å
532	Y	86.2	Confident	89.1	Confident	55 Å²	55	44 Å²	44	22%	0.216	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-97.1	161.6	178.8	-58.7	-84.4	0	0	0	110.5	I422 L483 Q485 D530 Y534 V536	I422-Y532 HydrophobicContact CD1-CE1 4.35Å; I422-Y532 WeakPolarHBondContact CD1-OH 3.42Å; L483-Y532 HydrophobicContact CD2-CE2 3.84Å; Q485-Y532 VanDerWaalsContact CD-CD2 3.47Å; Q485-Y532 HydrophobicContact CG-CD2 4Å; Q485-Y532 HydrophobicContact CG-CE2 4.36Å; D530-Y532 HydrophobicContact CB-CE2 3.93Å; D530-Y532 WeakPolarHBondContact CB-OH 3.44Å; Y532-Y534 WeakPolarHBondContact CB-O 3.28Å; Y532-Y534 PolarHBondContact O-N 3.32Å; Y532-V536 HydrophobicContact CD1-CG2 4.43Å; Y532-V536 HydrophobicContact CD2-CG2 3.77Å; Y532-V536 HydrophobicContact CE2-CG2 4.41Å; Y532-V536 HydrophobicContact CG-CG2 3.81Å
533	C	81.7	Confident	87.7	Confident	125 Å²	125	48.2 Å²	48.2	85%	0.845	24%	0.244	S	C	*	.	S	Bend	trans	-64	-31.4	178.2	-59.5	0	0	0	0	112.4
534	Y	81.8	Confident	85.6	Confident	86 Å²	86	55.1 Å²	55.1	34%	0.337	29%	0.285	S	S	.	.	S	Bend	trans	-132.3	152.4	178.3	-54.8	-84.3	0	0	0	109.9	V351 I354 Y532 V536	V351-Y534 WeakPolarHBondContact O-CD1 3.48Å; V351-Y534 WeakPolarHBondContact O-CE1 3.49Å; I354-Y534 HydrophobicContact CD1-CD2 3.73Å; I354-Y534 HydrophobicContact CD1-CG 4.23Å; I354-Y534 HydrophobicContact CG1-CD2 4.34Å; I354-Y534 HydrophobicContact CG1-CG 4.49Å; Y532-Y534 WeakPolarHBondContact CB-O 3.28Å; Y532-Y534 PolarHBondContact O-N 3.32Å; Y534-V536 PolarHBondContact O-N 2.9Å
535	P	84.4	Confident	82.9	Confident	63 Å²	63	56.6 Å²	56.6	41%	0.409	30%	0.301	S	S	.	.			trans	-54.3	133.3	171.7	-24.1	32.6	0	0	0	112	F352 T353 I354 L482	F352-P535 WeakPolarHBondContact O-CD 3.43Å; T353-P535 WeakPolarHBondContact CA-O 3.36Å; T353-P535 HydrophobicContact CG2-CB 4.33Å; I354-P535 PolarHBondContact N-O 3.44Å; L482-P535 HydrophobicContact CD2-CB 4.09Å
536	V	89.3	Confident	80	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.5	179.8	179.2	0	0	0	0	108.5	I354 M356 L482 L483 Y532 Y534	I354-V536 CarbonylContact O-C 3.54Å; I354-V536 WeakPolarHBondContact O-CA 3.43Å; M356-V536 HydrophobicContact CB-CG1 3.75Å; M356-V536 HydrophobicContact CG-CG1 3.85Å; L482-V536 WeakPolarHBondContact CA-O 3.29Å; L483-V536 HydrophobicContact CB-CB 4.03Å; L483-V536 HydrophobicContact CB-CG1 4.22Å; L483-V536 HydrophobicContact CD2-CB 4.22Å; L483-V536 HydrophobicContact CD2-CG1 4.15Å; L483-V536 PolarHBondContact N-O 3.27Å; Y532-V536 HydrophobicContact CD1-CG2 4.43Å; Y532-V536 HydrophobicContact CD2-CG2 3.77Å; Y532-V536 HydrophobicContact CE2-CG2 4.41Å; Y532-V536 HydrophobicContact CG-CG2 3.81Å; Y534-V536 PolarHBondContact O-N 2.9Å
537	V	88	Confident	76.8	Confident	0 Å²	0	75 Å²	75	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.4	-170.7	-177.5	0	0	0	0	109.7	V334 A335 L341 T353 I354 M356 L482 P539	V334-V537 HydrophobicContact CB-CG1 4.44Å; V334-V537 HydrophobicContact CB-CG2 4.2Å; V334-V537 HydrophobicContact CG1-CG2 3.8Å; A335-V537 HydrophobicContact CB-CG1 4.19Å; L341-V537 HydrophobicContact CD1-CB 4.14Å; L341-V537 HydrophobicContact CD1-CG1 3.92Å; T353-V537 HydrophobicContact CG2-CG2 3.98Å; I354-V537 PolarHBondContact O-N 3.38Å; M356-V537 WeakPolarHBondContact CB-O 3.46Å; M356-V537 PolarHBondContact N-O 3.15Å; L482-V537 HydrophobicContact CD2-CB 4.46Å; L482-V537 HydrophobicContact CD2-CG2 3.57Å; V537-P539 VanDerWaalsContact O-CD 3.28Å; V537-P539 WeakPolarHBondContact O-CD 3.07Å
538	L	89.3	Confident	73.6	Confident	22 Å²	22	79.2 Å²	79.2	12%	0.115	41%	0.406	C	S	.	.			trans	-71.4	118.6	167.6	171.8	67.9	0	0	0	109.5	M356 K427 I477 S481	M356-L538 HydrophobicContact CE-CB 4.06Å; M356-L538 HydrophobicContact CE-CD1 3.44Å; M356-L538 VanDerWaalsContact CE-CD1 3.44Å; M356-L538 HydrophobicContact CE-CG 4.24Å; M356-L538 HydrophobicContact SD-CB 4.39Å; K427-L538 HydrophobicContact CB-CD2 3.61Å; K427-L538 HydrophobicContact CD-CD2 4.23Å; K427-L538 HydrophobicContact CG-CD2 4.15Å; I477-L538 HydrophobicContact CD1-CB 4.41Å; I477-L538 HydrophobicContact CD1-CD2 4.06Å; S481-L538 PolarHBondContact O-N 3.19Å
539	P	85	Confident	70.3	Confident	6 Å²	6	79.8 Å²	79.8	4%	0.039	42%	0.421	C	S	.	.			trans	-66.3	149.2	178.7	-20.6	34.3	0	0	0	112.6	H338 L341 S355 W357 V537	H338-P539 HydrophobicContact CB-CB 4.18Å; H338-P539 HydrophobicContact CB-CG 4.32Å; L341-P539 HydrophobicContact CD1-CB 4.3Å; L341-P539 HydrophobicContact CD1-CG 4.28Å; S355-P539 WeakPolarHBondContact OG-CG 3.46Å; W357-P539 HydrophobicContact CD2-CB 4.24Å; W357-P539 HydrophobicContact CD2-CG 3.76Å; W357-P539 HydrophobicContact CE3-CB 4.09Å; W357-P539 HydrophobicContact CE3-CG 3.9Å; W357-P539 HydrophobicContact CG-CG 4.1Å; W357-P539 HydrophobicContact CH2-CB 3.97Å; W357-P539 HydrophobicContact CZ2-CB 4.18Å; W357-P539 HydrophobicContact CZ2-CG 4.46Å; W357-P539 HydrophobicContact CZ3-CB 3.94Å; W357-P539 HydrophobicContact CZ3-CG 4.28Å; V537-P539 VanDerWaalsContact O-CD 3.28Å; V537-P539 WeakPolarHBondContact O-CD 3.07Å
540	K	76	Confident	67.3	Low	105 Å²	105	85.5 Å²	85.5	46%	0.457	47%	0.468	S	S	.	.	S	Bend	trans	-72.5	-42.2	174.9	-68.3	-172.3	176	169.9	0	112.1	A335 G336	A335-K540 HydrophobicContact CB-CD 4.26Å; A335-K540 HydrophobicContact CB-CG 3.63Å; A335-K540 WeakPolarHBondContact O-CD 3.46Å; A335-K540 WeakPolarHBondContact O-CE 3.31Å; A335-K540 PolarHBondContact O-NZ 3.4Å; G336-K540 PolarHBondContact O-N 3.11Å
541	S	76.7	Confident	64.4	Low	52 Å²	52	88 Å²	88	36%	0.364	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-165.3	179	-175.8	65.7	0	0	0	0	110.6	T337 H338	T337-S541 CarbonylContact C-O 3.49Å; T337-S541 VanDerWaalsContact CA-O 3.26Å; T337-S541 WeakPolarHBondContact CA-O 3.48Å; H338-S541 PolarHBondContact N-O 3.1Å
542	R	76.8	Confident	61.6	Low	125 Å²	125	83.7 Å²	83.7	47%	0.472	49%	0.491	S	S	.	.			trans	-91.5	148.4	160.2	-69.9	-171.6	150.8	163.5	-5.1	110.1	H338 E339 W357 V544	H338-R542 HydrophobicContact CB-CG 4.22Å; E339-R542 WeakPolarHBondContact OE1-CB 3.4Å; E339-R542 WeakPolarHBondContact OE1-CG 3.38Å; E339-R542 IonicContact OE1-NE 2.81Å; E339-R542 VanDerWaalsContact OE2-CA 3.32Å; E339-R542 WeakPolarHBondContact OE2-CA 3.28Å; W357-R542 HydrophobicContact CZ3-CG 3.82Å; R542-V544 PolarHBondContact O-N 3.43Å
543	E	62.3	Low	59.5	Low	98 Å²	98	89.4 Å²	89.4	46%	0.458	52%	0.519	S	S	.	.			trans	-61.4	129	168.8	-74.4	-173.2	176.6	0	0	110.1	T337 E339 Q340 G545	T337-E543 HydrophobicContact CG2-CG 3.68Å; T337-E543 WeakPolarHBondContact OG1-CG 3.33Å; T337-E543 PolarHBondContact OG1-OE1 2.94Å; E339-E543 HydrophobicContact CB-CG 4.34Å; E339-E543 HydrophobicContact CG-CB 4.36Å; E339-E543 PolarHBondContact OE2-N 3.46Å; Q340-E543 PolarHBondContact NE2-OE1 3.47Å; E543-G545 PolarHBondContact O-N 2.95Å; E543-G545 VanDerWaalsContact O-N 3.12Å
544	V	51.1	Low	57.3	Low	145 Å²	145	92 Å²	92	88%	0.879	52%	0.519	S	S	*	.			trans	-79.3	91.7	168.3	-176.1	0	0	0	0	106.2	R542 R546	R542-V544 PolarHBondContact O-N 3.43Å; V544-R546 PolarHBondContact O-N 3.26Å
545	G	39.6	Very low	54.9	Low	41 Å²	41	91.5 Å²	91.5	42%	0.423	54%	0.54	S	S	.	.			trans	-58.3	130	178.7	0	0	0	0	0	111.8	E543 D547 C548	E543-G545 PolarHBondContact O-N 2.95Å; E543-G545 VanDerWaalsContact O-N 3.12Å; G545-D547 PolarHBondContact O-N 3.23Å; G545-D547 VanDerWaalsContact O-N 3.15Å; G545-C548 PolarHBondContact O-N 3.35Å
546	R	35.1	Very low	52.7	Low	253 Å²	253	96.5 Å²	96.5	96%	0.955	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-4.5	168.3	-94.1	-178.8	-172.7	171.4	3.2	114.1	V544	V544-R546 PolarHBondContact O-N 3.26Å
547	D	31.1	Very low	50.1	Low	161 Å²	161	98.8 Å²	98.8	86%	0.861	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	18.9	177.9	-72.6	-32.5	0	0	0	113.6	G545 G549	G545-D547 PolarHBondContact O-N 3.23Å; G545-D547 VanDerWaalsContact O-N 3.15Å; D547-G549 PolarHBondContact O-N 2.93Å
548	C	31.5	Very low	47.5	Very low	90 Å²	90	101.8 Å²	101.8	61%	0.608	62%	0.619	S	S	*	*			trans	-84.2	77.7	152.2	-63.8	0	0	0	0	107.2	G545	G545-C548 PolarHBondContact O-N 3.35Å
549	G	29.1	Very low	45.1	Very low	50 Å²	50	108.7 Å²	108.7	52%	0.515	65%	0.65	S	S	.	*			trans	-48.7	148	163.4	0	0	0	0	0	109.4	D547 G551	D547-G549 PolarHBondContact O-N 2.93Å; G549-G551 PolarHBondContact O-N 3.16Å
550	A	34	Very low	43.2	Very low	121 Å²	121	117.4 Å²	117.4	100%	1	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	48.5	-179.1	0	0	0	0	0	114.6
551	G	33.6	Very low	41.7	Very low	72 Å²	72	115.4 Å²	115.4	74%	0.742	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.3	12.8	-173.1	0	0	0	0	0	115.2	G549	G549-G551 PolarHBondContact O-N 3.16Å
552	S	31.7	Very low	40.2	Very low	86 Å²	86	122 Å²	122	60%	0.601	72%	0.716	S	S	*	*			trans	-137.9	33.4	171.7	63.1	0	0	0	0	113.5
553	E	42	Very low	39.3	Very low	176 Å²	176	124.6 Å²	124.6	82%	0.822	73%	0.726	S	S	*	*			trans	-90.4	2.9	166.2	-69.8	-164.8	152.9	0	0	113
554	E	35.5	Very low	39.7	Very low	178 Å²	178	127.3 Å²	127.3	83%	0.832	74%	0.739	S	S	*	*			trans	-91	7	-178.8	-69.6	-172.2	158.6	0	0	114.9
555	G	31.9	Very low	41.1	Very low	76 Å²	76	121 Å²	121	78%	0.784	70%	0.7	S	S	*	*	S	Bend	trans	-88	-15.7	-170.9	0	0	0	0	0	117.7
556	D	37.3	Very low	43.3	Very low	168 Å²	168	121.7 Å²	121.7	90%	0.898	70%	0.697	S	S	*	*	S	Bend	trans	-147.9	81.3	-179.6	-160	22.6	0	0	0	111.1
557	G	35.1	Very low	45.7	Very low	49 Å²	49	115.6 Å²	115.6	51%	0.505	68%	0.683	S	S	.	*	S	Bend	trans	124.1	4	170.9	0	0	0	0	0	117.7	E559 R560	G557-E559 PolarHBondContact O-N 3.03Å; G557-R560 PolarHBondContact O-N 2.71Å; G557-R560 VanDerWaalsContact O-N 3.13Å
558	G	32.3	Very low	48.2	Very low	64 Å²	64	114 Å²	114	66%	0.66	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	4.8	-173	0	0	0	0	0	119.2
559	E	38.6	Very low	50.8	Low	166 Å²	166	111.5 Å²	111.5	78%	0.776	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.4	-5.6	172	-75.1	-169.5	157	0	0	114.4	G557	G557-E559 PolarHBondContact O-N 3.03Å
560	R	45.9	Very low	53.6	Low	189 Å²	189	112.4 Å²	112.4	71%	0.713	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-22	-173.8	-71.9	-176.4	-179.3	-176.7	0.2	114.3	G557 Q562	G557-R560 PolarHBondContact O-N 2.71Å; G557-R560 VanDerWaalsContact O-N 3.13Å; R560-Q562 PolarHBondContact O-N 3.39Å
561	G	44.3	Very low	56.1	Low	63 Å²	63	114.5 Å²	114.5	65%	0.649	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-8.5	-175.3	0	0	0	0	0	116.1
562	Q	46	Very low	58.6	Low	191 Å²	191	114.6 Å²	114.6	89%	0.893	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.6	16.5	-178.8	-75.2	-174.9	-14.3	0	0	113.3	R560 E564	R560-Q562 PolarHBondContact O-N 3.39Å; Q562-E564 PolarHBondContact O-N 3.22Å
563	R	57.1	Low	61.3	Low	180 Å²	180	111.5 Å²	111.5	68%	0.679	58%	0.584	S	S	*	*			trans	-76.3	111.9	169.4	-78.5	-174.9	179.3	-173.1	-1.8	108.7	M565	R563-M565 PolarHBondContact O-N 2.86Å
564	E	70.5	Confident	63.5	Low	154 Å²	154	105.9 Å²	105.9	72%	0.72	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-55.3	127.8	173.3	-148.6	-169	154.8	0	0	109.4	Q562 P566 K570	Q562-E564 PolarHBondContact O-N 3.22Å; E564-P566 WeakPolarHBondContact O-CD 3.39Å; E564-K570 IonicContact OE1-NZ 3.61Å; E564-K570 PolarHBondContact OE1-NZ 2.96Å
565	M	80.9	Confident	66	Low	14 Å²	14	99.9 Å²	99.9	7%	0.069	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-59.7	125	-177.5	-177.6	165.1	43.7	0	0	109.5	R563 L569 K570 F573 F596	R563-M565 PolarHBondContact O-N 2.86Å; M565-L569 HydrophobicContact CG-CB 3.76Å; M565-L569 HydrophobicContact SD-CB 4.23Å; M565-K570 HydrophobicContact CB-CG 3.8Å; M565-K570 HydrophobicContact CE-CB 4.22Å; M565-K570 HydrophobicContact CE-CG 3.64Å; M565-K570 HydrophobicContact CG-CG 3.73Å; M565-K570 WeakPolarHBondContact O-CD 3.41Å; M565-K570 WeakPolarHBondContact O-CE 3.44Å; M565-K570 WeakPolarHBondContact O-CG 3.26Å; M565-K570 HydrophobicContact SD-CG 4.27Å; M565-F573 HydrophobicContact CE-CB 3.95Å; M565-F573 HydrophobicContact CE-CD1 3.93Å; M565-F573 HydrophobicContact CE-CG 3.88Å; M565-F573 HydrophobicContact SD-CB 3.92Å; M565-F573 HydrophobicContact SD-CG 4.26Å; M565-F596 HydrophobicContact CB-CD1 4.2Å; M565-F596 HydrophobicContact CB-CE1 3.93Å; M565-F596 HydrophobicContact CB-CZ 4.32Å; M565-F596 HydrophobicContact CG-CD1 4.41Å; M565-F596 HydrophobicContact CG-CE1 4.15Å; M565-F596 HydrophobicContact CG-CE2 4.27Å; M565-F596 HydrophobicContact CG-CZ 4.08Å; M565-F596 HydrophobicContact SD-CD1 4.44Å; M565-F596 HydrophobicContact SD-CD2 4.1Å; M565-F596 HydrophobicContact SD-CE2 4.38Å; M565-F596 HydrophobicContact SD-CG 4.13Å
566	P	86.3	Confident	68.8	Low	55 Å²	55	96.8 Å²	96.8	36%	0.357	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-53.6	144.3	175.8	-27.6	33.9	0	0	0	112.2	E564 H568 L569 K570	E564-P566 WeakPolarHBondContact O-CD 3.39Å; P566-H568 VanDerWaalsContact C-N 3.26Å; P566-H568 VanDerWaalsContact CB-CE1 3.47Å; P566-H568 WeakPolarHBondContact CB-CE1 3.35Å; P566-H568 PolarHBondContact O-N 2.86Å; P566-H568 VanDerWaalsContact O-N 3.13Å; P566-L569 HydrophobicContact CB-CG 4.42Å; P566-L569 HydrophobicContact CG-CD1 4.14Å; P566-L569 CarbonylContact O-C 3.53Å; P566-L569 WeakPolarHBondContact O-CA 3.46Å; P566-L569 PolarHBondContact O-N 3.39Å; P566-K570 PolarHBondContact O-N 3.12Å
567	N	84.1	Confident	71.2	Confident	124 Å²	124	89.5 Å²	89.5	66%	0.663	48%	0.476	S	S	*	.	H	α-helix	trans	-57.1	-34.2	-173.9	-73.3	-22.9	0	0	0	114.5	K570 K571	N567-K570 PolarHBondContact O-N 2.59Å; N567-K571 PolarHBondContact O-N 3.08Å
568	H	84.7	Confident	73.7	Confident	129 Å²	129	91.9 Å²	91.9	60%	0.597	48%	0.484	S	S	*	.	H	α-helix	trans	-68.6	-40.5	176	65.6	-84.2	0	0	0	111.6	P566 K571 Q572	P566-H568 VanDerWaalsContact C-N 3.26Å; P566-H568 VanDerWaalsContact CB-CE1 3.47Å; P566-H568 WeakPolarHBondContact CB-CE1 3.35Å; P566-H568 PolarHBondContact O-N 2.86Å; P566-H568 VanDerWaalsContact O-N 3.13Å; H568-K571 PolarHBondContact O-N 3.5Å; H568-Q572 PolarHBondContact O-N 2.74Å; H568-Q572 VanDerWaalsContact O-N 3.09Å
569	L	86.8	Confident	76.4	Confident	36 Å²	36	90.2 Å²	90.2	19%	0.188	46%	0.461	C	S	.	.	H	α-helix	trans	-69.5	-33.3	173.9	-63.1	-176.1	0	0	0	112	M565 P566 K571 Q572 F573 L592 F596	M565-L569 HydrophobicContact CG-CB 3.76Å; M565-L569 HydrophobicContact SD-CB 4.23Å; P566-L569 HydrophobicContact CB-CG 4.42Å; P566-L569 HydrophobicContact CG-CD1 4.14Å; P566-L569 CarbonylContact O-C 3.53Å; P566-L569 WeakPolarHBondContact O-CA 3.46Å; P566-L569 PolarHBondContact O-N 3.39Å; L569-K571 VanDerWaalsContact C-N 3.32Å; L569-K571 PolarHBondContact O-N 3.38Å; L569-Q572 PolarHBondContact O-N 3.49Å; L569-F573 WeakPolarHBondContact O-CB 3.41Å; L569-F573 PolarHBondContact O-N 3.48Å; L569-L592 HydrophobicContact CB-CD1 4.44Å; L569-L592 HydrophobicContact CD1-CD1 4.08Å; L569-L592 HydrophobicContact CD2-CD1 4.12Å; L569-L592 HydrophobicContact CG-CD1 4.44Å; L569-F596 HydrophobicContact CD1-CE2 4.06Å; L569-F596 HydrophobicContact CD1-CZ 4.35Å
570	K	86.3	Confident	78.7	Confident	69 Å²	69	82.9 Å²	82.9	30%	0.3	43%	0.428	S	S	.	.	H	α-helix	trans	-59	-42.7	171.8	-74.4	177.7	172.2	166	0	111.6	E564 M565 P566 N567 A574	E564-K570 IonicContact OE1-NZ 3.61Å; E564-K570 PolarHBondContact OE1-NZ 2.96Å; M565-K570 HydrophobicContact CB-CG 3.8Å; M565-K570 HydrophobicContact CE-CB 4.22Å; M565-K570 HydrophobicContact CE-CG 3.64Å; M565-K570 HydrophobicContact CG-CG 3.73Å; M565-K570 WeakPolarHBondContact O-CD 3.41Å; M565-K570 WeakPolarHBondContact O-CE 3.44Å; M565-K570 WeakPolarHBondContact O-CG 3.26Å; M565-K570 HydrophobicContact SD-CG 4.27Å; P566-K570 PolarHBondContact O-N 3.12Å; N567-K570 PolarHBondContact O-N 2.59Å; K570-A574 WeakPolarHBondContact O-CB 3.41Å; K570-A574 PolarHBondContact O-N 3.04Å
571	K	86.4	Confident	80.5	Confident	166 Å²	166	75 Å²	75	72%	0.722	40%	0.401	S	S	*	.	H	α-helix	trans	-66.2	-44.8	176.2	-72	-175.4	179.1	-173.5	0	112	N567 H568 L569 A574 A575	N567-K571 PolarHBondContact O-N 3.08Å; H568-K571 PolarHBondContact O-N 3.5Å; L569-K571 VanDerWaalsContact C-N 3.32Å; L569-K571 PolarHBondContact O-N 3.38Å; K571-A574 PolarHBondContact O-N 2.99Å; K571-A575 WeakPolarHBondContact O-CB 3.45Å; K571-A575 PolarHBondContact O-N 3.22Å
572	Q	87.4	Confident	82.2	Confident	74 Å²	74	73.2 Å²	73.2	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.4	-175.1	179.2	0.6	0	0	111.4	H568 L569 A574 A575 I576 L592	H568-Q572 PolarHBondContact O-N 2.74Å; H568-Q572 VanDerWaalsContact O-N 3.09Å; L569-Q572 PolarHBondContact O-N 3.49Å; Q572-A574 PolarHBondContact O-N 3.08Å; Q572-A575 WeakPolarHBondContact O-CB 3.33Å; Q572-A575 PolarHBondContact O-N 3.43Å; Q572-I576 HydrophobicContact CG-CD1 3.99Å; Q572-I576 VanDerWaalsContact O-CG1 3.31Å; Q572-I576 WeakPolarHBondContact O-CG1 3.43Å; Q572-I576 PolarHBondContact O-N 3.46Å; Q572-L592 HydrophobicContact CG-CD2 4.22Å
573	F	88.1	Confident	84.1	Confident	21 Å²	21	67.4 Å²	67.4	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-56.8	-50.1	175.4	175.5	-96.6	0	0	0	111.9	M565 L569 A575 I576 V577 L593 C600 A606	M565-F573 HydrophobicContact CE-CB 3.95Å; M565-F573 HydrophobicContact CE-CD1 3.93Å; M565-F573 HydrophobicContact CE-CG 3.88Å; M565-F573 HydrophobicContact SD-CB 3.92Å; M565-F573 HydrophobicContact SD-CG 4.26Å; L569-F573 WeakPolarHBondContact O-CB 3.41Å; L569-F573 PolarHBondContact O-N 3.48Å; F573-A575 VanDerWaalsContact C-N 3.29Å; F573-A575 PolarHBondContact O-N 2.67Å; F573-I576 PolarHBondContact O-N 3.25Å; F573-V577 HydrophobicContact CD1-CG2 4.38Å; F573-V577 HydrophobicContact CD2-CG2 4.47Å; F573-V577 HydrophobicContact CE1-CG2 3.92Å; F573-V577 HydrophobicContact CE2-CG2 4Å; F573-V577 HydrophobicContact CZ-CG2 3.71Å; F573-V577 WeakPolarHBondContact O-CG2 3.47Å; F573-V577 PolarHBondContact O-N 3.26Å; F573-L593 HydrophobicContact CD2-CD2 3.94Å; F573-L593 HydrophobicContact CE2-CD2 3.68Å; F573-C600 WeakPolarHBondContact CE2-SG 3.36Å; F573-A606 HydrophobicContact CZ-CB 4.29Å
574	A	88.1	Confident	85.4	Confident	58 Å²	58	63.2 Å²	63.2	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-39.6	177.4	0	0	0	0	0	112	K570 K571 Q572 V577 S578	K570-A574 WeakPolarHBondContact O-CB 3.41Å; K570-A574 PolarHBondContact O-N 3.04Å; K571-A574 PolarHBondContact O-N 2.99Å; Q572-A574 PolarHBondContact O-N 3.08Å; A574-V577 PolarHBondContact O-N 3.15Å; A574-S578 WeakPolarHBondContact O-CB 3.34Å; A574-S578 PolarHBondContact O-N 2.93Å; A574-S578 PolarHBondContact O-OG 3.36Å
575	A	88.9	Confident	86.3	Confident	52 Å²	52	57.2 Å²	57.2	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-47.3	175.4	0	0	0	0	0	111.5	K571 Q572 F573 V577 S578 T579	K571-A575 WeakPolarHBondContact O-CB 3.45Å; K571-A575 PolarHBondContact O-N 3.22Å; Q572-A575 WeakPolarHBondContact O-CB 3.33Å; Q572-A575 PolarHBondContact O-N 3.43Å; F573-A575 VanDerWaalsContact C-N 3.29Å; F573-A575 PolarHBondContact O-N 2.67Å; A575-V577 PolarHBondContact O-N 3.23Å; A575-S578 PolarHBondContact O-N 3.28Å; A575-S578 PolarHBondContact O-OG 3.41Å; A575-T579 WeakPolarHBondContact O-CG2 3.43Å; A575-T579 PolarHBondContact O-N 3.46Å
576	I	89.9	Confident	86.9	Confident	10 Å²	10	58.6 Å²	58.6	5%	0.051	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-47	178	-65.6	160.7	0	0	0	111.1	Q572 F573 S578 T579 L585 D589 L592 L593	Q572-I576 HydrophobicContact CG-CD1 3.99Å; Q572-I576 VanDerWaalsContact O-CG1 3.31Å; Q572-I576 WeakPolarHBondContact O-CG1 3.43Å; Q572-I576 PolarHBondContact O-N 3.46Å; F573-I576 PolarHBondContact O-N 3.25Å; I576-S578 PolarHBondContact O-N 2.83Å; I576-T579 WeakPolarHBondContact O-CB 3.32Å; I576-T579 PolarHBondContact O-N 2.81Å; I576-T579 VanDerWaalsContact O-N 3.14Å; I576-T579 PolarHBondContact O-OG1 2.9Å; I576-L585 HydrophobicContact CG2-CD2 3.69Å; I576-D589 HydrophobicContact CD1-CB 3.96Å; I576-D589 VanDerWaalsContact CD1-OD1 3.27Å; I576-D589 WeakPolarHBondContact CD1-OD1 3.4Å; I576-L592 HydrophobicContact CD1-CD2 4.01Å; I576-L593 HydrophobicContact CG2-CD1 4.11Å; I576-L593 HydrophobicContact CG2-CD2 4.46Å
577	V	88.4	Confident	87.1	Confident	16 Å²	16	60.8 Å²	60.8	10%	0.097	34%	0.343	C	S	.	.	H	α-helix	trans	-63.6	-32.3	-179.7	174.6	0	0	0	0	111.8	F573 A574 A575 T579 R605 A606	F573-V577 HydrophobicContact CD1-CG2 4.38Å; F573-V577 HydrophobicContact CD2-CG2 4.47Å; F573-V577 HydrophobicContact CE1-CG2 3.92Å; F573-V577 HydrophobicContact CE2-CG2 4Å; F573-V577 HydrophobicContact CZ-CG2 3.71Å; F573-V577 WeakPolarHBondContact O-CG2 3.47Å; F573-V577 PolarHBondContact O-N 3.26Å; A574-V577 PolarHBondContact O-N 3.15Å; A575-V577 PolarHBondContact O-N 3.23Å; V577-T579 VanDerWaalsContact C-N 3.27Å; V577-T579 PolarHBondContact O-N 2.85Å; V577-R605 HydrophobicContact CG1-CB 3.97Å; V577-A606 HydrophobicContact CG1-CB 4.2Å; V577-A606 HydrophobicContact CG2-CB 3.7Å
578	S	87.3	Confident	87.5	Confident	98 Å²	98	61.8 Å²	61.8	69%	0.685	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.4	177.5	70.3	0	0	0	0	114.9	A574 A575 I576	A574-S578 WeakPolarHBondContact O-CB 3.34Å; A574-S578 PolarHBondContact O-N 2.93Å; A574-S578 PolarHBondContact O-OG 3.36Å; A575-S578 PolarHBondContact O-N 3.28Å; A575-S578 PolarHBondContact O-OG 3.41Å; I576-S578 PolarHBondContact O-N 2.83Å
579	T	88.6	Confident	87.9	Confident	30 Å²	30	56.7 Å²	56.7	18%	0.184	32%	0.321	C	S	.	.	S	Bend	trans	-71.7	147.5	179.1	62.9	0	0	0	0	112.5	A575 I576 V577 H583 K609	A575-T579 WeakPolarHBondContact O-CG2 3.43Å; A575-T579 PolarHBondContact O-N 3.46Å; I576-T579 WeakPolarHBondContact O-CB 3.32Å; I576-T579 PolarHBondContact O-N 2.81Å; I576-T579 VanDerWaalsContact O-N 3.14Å; I576-T579 PolarHBondContact O-OG1 2.9Å; V577-T579 VanDerWaalsContact C-N 3.27Å; V577-T579 PolarHBondContact O-N 2.85Å; T579-H583 HydrophobicContact CG2-CB 4.43Å; T579-K609 PolarHBondContact O-NZ 3.4Å; T579-K609 VanDerWaalsContact OG1-CE 3.27Å; T579-K609 WeakPolarHBondContact OG1-CE 3.39Å
580	D	86.1	Confident	88.2	Confident	12 Å²	12	58.8 Å²	58.8	6%	0.064	33%	0.329	C	S	.	.			trans	-62.3	162.4	178.2	75.4	-92.2	0	0	0	112.2	L582 H583 K609 I1046 R1070 V1075	D580-L582 VanDerWaalsContact C-N 3.27Å; D580-L582 PolarHBondContact O-N 3.05Å; D580-L582 WeakPolarHBondContact OD2-CA 3.05Å; D580-L582 VanDerWaalsContact OD2-CB 3.3Å; D580-L582 WeakPolarHBondContact OD2-CB 3.39Å; D580-L582 PolarHBondContact OD2-N 3.32Å; D580-H583 WeakPolarHBondContact O-CB 3.38Å; D580-H583 PolarHBondContact O-N 2.73Å; D580-H583 PolarHBondContact OD2-N 3.48Å; D580-K609 PolarHBondContact O-NZ 3.33Å; D580-I1046 HydrophobicContact CB-CD1 4.18Å; D580-R1070 IonicContact OD1-NH1 2.68Å; D580-V1075 HydrophobicContact CB-CG1 4.32Å
581	P	84.6	Confident	88.5	Confident	24 Å²	24	62.4 Å²	62.4	16%	0.156	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.9	-179.6	-31.1	38.3	0	0	0	116.5	N1043 I1046 I1047	P581-N1043 WeakPolarHBondContact CD-OD1 3.4Å; P581-N1043 HydrophobicContact CG-CB 4.36Å; P581-I1046 HydrophobicContact CB-CG2 4.14Å; P581-I1046 HydrophobicContact CG-CG2 4.28Å; P581-I1047 HydrophobicContact CB-CD1 3.48Å; P581-I1047 VanDerWaalsContact CB-CD1 3.48Å; P581-I1047 HydrophobicContact CB-CG1 4.34Å; P581-I1047 HydrophobicContact CG-CD1 3.68Å; P581-I1047 HydrophobicContact CG-CG1 3.98Å
582	L	80.6	Confident	88.8	Confident	24 Å²	24	55.5 Å²	55.5	13%	0.126	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-13.7	-176.8	-56.5	174.7	0	0	0	113	D580 P584 I1046 I1066	D580-L582 VanDerWaalsContact C-N 3.27Å; D580-L582 PolarHBondContact O-N 3.05Å; D580-L582 WeakPolarHBondContact OD2-CA 3.05Å; D580-L582 VanDerWaalsContact OD2-CB 3.3Å; D580-L582 WeakPolarHBondContact OD2-CB 3.39Å; D580-L582 PolarHBondContact OD2-N 3.32Å; L582-P584 WeakPolarHBondContact O-CD 3.46Å; L582-I1046 HydrophobicContact CD1-CG2 3.92Å; L582-I1046 HydrophobicContact CD2-CG2 4.08Å; L582-I1046 HydrophobicContact CG-CG2 3.66Å; L582-I1066 HydrophobicContact CD1-CB 3.92Å; L582-I1066 HydrophobicContact CD1-CG2 3.59Å; L582-I1066 HydrophobicContact CD2-CD1 4.01Å; L582-I1066 HydrophobicContact CD2-CG2 4.48Å
583	H	84.9	Confident	89.1	Confident	69 Å²	69	52 Å²	52	32%	0.319	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-59.2	116.6	-179.9	-173	78.7	0	0	0	110.9	T579 D580 L585	T579-H583 HydrophobicContact CG2-CB 4.43Å; D580-H583 WeakPolarHBondContact O-CB 3.38Å; D580-H583 PolarHBondContact O-N 2.73Å; D580-H583 PolarHBondContact OD2-N 3.48Å; H583-L585 PolarHBondContact O-N 3.36Å
584	P	85.3	Confident	89.3	Confident	92 Å²	92	52.8 Å²	52.8	60%	0.597	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-72.8	128.6	-179.6	29.7	-32.8	0	0	0	110.5	L582	L582-P584 WeakPolarHBondContact O-CD 3.46Å
585	L	88.9	Confident	89.5	Confident	29 Å²	29	54.8 Å²	54.8	15%	0.152	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-78.6	130.3	174.5	-62.9	176.7	0	0	0	111.1	I576 H583 D589 K590 L593 K609	I576-L585 HydrophobicContact CG2-CD2 3.69Å; H583-L585 PolarHBondContact O-N 3.36Å; L585-D589 HydrophobicContact CB-CB 4.36Å; L585-D589 HydrophobicContact CD2-CB 4.26Å; L585-K590 HydrophobicContact CB-CG 3.93Å; L585-K590 HydrophobicContact CD1-CG 4.32Å; L585-L593 HydrophobicContact CD1-CD1 3.89Å; L585-L593 HydrophobicContact CD2-CD1 4.4Å; L585-K609 HydrophobicContact CD1-CB 4.14Å; L585-K609 HydrophobicContact CD1-CD 4.12Å; L585-K609 HydrophobicContact CD2-CD 4.08Å; L585-K609 HydrophobicContact CG-CD 4.25Å
586	S	92.4	Very high	89.6	Confident	42 Å²	42	53.5 Å²	53.5	29%	0.294	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-69	160.8	171.3	74.5	0	0	0	0	111.2	E588 D589 K590	S586-E588 PolarHBondContact O-N 3.4Å; S586-D589 VanDerWaalsContact CB-OD2 3.31Å; S586-D589 WeakPolarHBondContact CB-OD2 3.48Å; S586-D589 PolarHBondContact N-OD2 3.45Å; S586-D589 PolarHBondContact O-N 3.27Å; S586-D589 PolarHBondContact OG-N 3.4Å; S586-D589 VanDerWaalsContact OG-N 3.14Å; S586-D589 PolarHBondContact OG-OD2 2.94Å; S586-K590 WeakPolarHBondContact O-CG 3.47Å; S586-K590 PolarHBondContact O-N 2.93Å; S586-K590 VanDerWaalsContact O-N 3.07Å
587	P	92.4	Very high	89.7	Confident	102 Å²	102	56.3 Å²	56.3	66%	0.662	30%	0.297	S	S	*	.	H	α-helix	trans	-55.6	-37.4	173.7	-25.6	35.4	0	0	0	112.9	K590 E591	P587-K590 PolarHBondContact O-N 2.96Å; P587-E591 WeakPolarHBondContact O-CG 3.47Å; P587-E591 PolarHBondContact O-N 2.77Å
588	E	91.6	Very high	89.7	Confident	145 Å²	145	60.2 Å²	60.2	68%	0.678	31%	0.314	S	S	*	.	H	α-helix	trans	-66.5	-41.8	177.7	-64.8	176.2	-172	0	0	111.7	S586 K590 E591 L592	S586-E588 PolarHBondContact O-N 3.4Å; E588-K590 VanDerWaalsContact C-N 3.31Å; E588-K590 PolarHBondContact O-N 3.42Å; E588-E591 PolarHBondContact O-N 2.88Å; E588-L592 WeakPolarHBondContact O-CB 3.19Å; E588-L592 PolarHBondContact O-N 2.82Å
589	D	93.1	Very high	89.7	Confident	22 Å²	22	58.5 Å²	58.5	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-62	-41.6	175.6	-59.5	-41.1	0	0	0	111.1	I576 L585 S586 L592 L593	I576-D589 HydrophobicContact CD1-CB 3.96Å; I576-D589 VanDerWaalsContact CD1-OD1 3.27Å; I576-D589 WeakPolarHBondContact CD1-OD1 3.4Å; L585-D589 HydrophobicContact CB-CB 4.36Å; L585-D589 HydrophobicContact CD2-CB 4.26Å; S586-D589 VanDerWaalsContact CB-OD2 3.31Å; S586-D589 WeakPolarHBondContact CB-OD2 3.48Å; S586-D589 PolarHBondContact N-OD2 3.45Å; S586-D589 PolarHBondContact O-N 3.27Å; S586-D589 PolarHBondContact OG-N 3.4Å; S586-D589 VanDerWaalsContact OG-N 3.14Å; S586-D589 PolarHBondContact OG-OD2 2.94Å; D589-L592 PolarHBondContact O-N 2.76Å; D589-L593 WeakPolarHBondContact O-CB 3.45Å; D589-L593 VanDerWaalsContact O-CG 3.25Å; D589-L593 WeakPolarHBondContact O-CG 3.39Å; D589-L593 PolarHBondContact O-N 3.44Å
590	K	93.2	Very high	89.7	Confident	80 Å²	80	57.1 Å²	57.1	35%	0.348	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-42.8	177.9	-67.3	-177.5	-177.9	-168.5	0	111.9	L585 S586 P587 E588 W594 S613	L585-K590 HydrophobicContact CB-CG 3.93Å; L585-K590 HydrophobicContact CD1-CG 4.32Å; S586-K590 WeakPolarHBondContact O-CG 3.47Å; S586-K590 PolarHBondContact O-N 2.93Å; S586-K590 VanDerWaalsContact O-N 3.07Å; P587-K590 PolarHBondContact O-N 2.96Å; E588-K590 VanDerWaalsContact C-N 3.31Å; E588-K590 PolarHBondContact O-N 3.42Å; K590-W594 WeakPolarHBondContact O-CB 3.5Å; K590-W594 PolarHBondContact O-N 3.36Å; K590-S613 WeakPolarHBondContact CA-OG 3.48Å
591	E	92.7	Very high	89.8	Confident	145 Å²	145	57.5 Å²	57.5	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-64	-42.1	175.8	-74.5	-173.7	177.9	0	0	111.7	P587 E588 W594 H595	P587-E591 WeakPolarHBondContact O-CG 3.47Å; P587-E591 PolarHBondContact O-N 2.77Å; E588-E591 PolarHBondContact O-N 2.88Å; E591-W594 PolarHBondContact O-N 3.13Å; E591-H595 VanDerWaalsContact O-CB 3.25Å; E591-H595 WeakPolarHBondContact O-CB 3.35Å; E591-H595 PolarHBondContact O-N 2.89Å
592	L	92.3	Very high	90	Very high	20 Å²	20	64.5 Å²	64.5	11%	0.105	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-50.4	176.3	-176.4	69.8	0	0	0	111.5	L569 Q572 I576 E588 D589 W594 H595 F596	L569-L592 HydrophobicContact CB-CD1 4.44Å; L569-L592 HydrophobicContact CD1-CD1 4.08Å; L569-L592 HydrophobicContact CD2-CD1 4.12Å; L569-L592 HydrophobicContact CG-CD1 4.44Å; Q572-L592 HydrophobicContact CG-CD2 4.22Å; I576-L592 HydrophobicContact CD1-CD2 4.01Å; E588-L592 WeakPolarHBondContact O-CB 3.19Å; E588-L592 PolarHBondContact O-N 2.82Å; D589-L592 PolarHBondContact O-N 2.76Å; L592-W594 VanDerWaalsContact C-N 3.34Å; L592-W594 PolarHBondContact O-N 3.08Å; L592-H595 PolarHBondContact O-N 3.22Å; L592-F596 HydrophobicContact CD1-CD2 3.63Å; L592-F596 HydrophobicContact CD1-CE2 3.61Å; L592-F596 HydrophobicContact CG-CD2 4.31Å; L592-F596 WeakPolarHBondContact O-CD2 3.42Å; L592-F596 PolarHBondContact O-N 2.79Å
593	L	93.1	Very high	90.5	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.3	-40.6	178.9	-71.5	171	0	0	0	112	F573 I576 L585 D589 F596 R597 C600 K609 L610 S613	F573-L593 HydrophobicContact CD2-CD2 3.94Å; F573-L593 HydrophobicContact CE2-CD2 3.68Å; I576-L593 HydrophobicContact CG2-CD1 4.11Å; I576-L593 HydrophobicContact CG2-CD2 4.46Å; L585-L593 HydrophobicContact CD1-CD1 3.89Å; L585-L593 HydrophobicContact CD2-CD1 4.4Å; D589-L593 WeakPolarHBondContact O-CB 3.45Å; D589-L593 VanDerWaalsContact O-CG 3.25Å; D589-L593 WeakPolarHBondContact O-CG 3.39Å; D589-L593 PolarHBondContact O-N 3.44Å; L593-F596 CarbonylContact O-C 3.54Å; L593-R597 WeakPolarHBondContact O-CA 3.46Å; L593-R597 PolarHBondContact O-N 2.79Å; L593-R597 VanDerWaalsContact O-N 3.08Å; L593-C600 PolarHBondContact O-SG 2.99Å; L593-C600 VanDerWaalsContact O-SG 3.39Å; L593-K609 HydrophobicContact CD1-CB 3.92Å; L593-L610 WeakPolarHBondContact O-CD1 3.28Å; L593-S613 WeakPolarHBondContact CD1-OG 3.47Å
594	W	93.6	Very high	90.8	Very high	38 Å²	38	62.9 Å²	62.9	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-71.1	-38.1	177.5	-174	-113.8	0	0	0	112.6	K590 E591 L592 R597 L610 V614 D621 A624 T625	K590-W594 WeakPolarHBondContact O-CB 3.5Å; K590-W594 PolarHBondContact O-N 3.36Å; E591-W594 PolarHBondContact O-N 3.13Å; L592-W594 VanDerWaalsContact C-N 3.34Å; L592-W594 PolarHBondContact O-N 3.08Å; W594-R597 WeakPolarHBondContact O-CB 3.33Å; W594-R597 WeakPolarHBondContact O-CD 3.3Å; W594-R597 WeakPolarHBondContact O-CG 3.17Å; W594-R597 PolarHBondContact O-N 3.26Å; W594-R597 PolarHBondContact O-NH1 2.88Å; W594-R597 VanDerWaalsContact O-NH1 3.12Å; W594-L610 HydrophobicContact CE3-CD1 4.34Å; W594-V614 HydrophobicContact CE3-CG2 4.16Å; W594-V614 HydrophobicContact CZ3-CB 4.5Å; W594-V614 HydrophobicContact CZ3-CG1 4.46Å; W594-V614 HydrophobicContact CZ3-CG2 3.74Å; W594-D621 HydrophobicContact CH2-CB 4.1Å; W594-D621 WeakPolarHBondContact CH2-O 3.48Å; W594-D621 HydrophobicContact CZ2-CB 3.68Å; W594-D621 WeakPolarHBondContact CZ2-OD1 3.34Å; W594-A624 HydrophobicContact CH2-CB 4.24Å; W594-A624 HydrophobicContact CZ2-CB 4.4Å; W594-T625 WeakPolarHBondContact CH2-OG1 3.48Å; W594-T625 WeakPolarHBondContact CZ3-OG1 3.49Å
595	H	91.3	Very high	91	Very high	100 Å²	100	66.1 Å²	66.1	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-47.2	176.6	-169.7	86.4	0	0	0	111.2	E591 L592	E591-H595 VanDerWaalsContact O-CB 3.25Å; E591-H595 WeakPolarHBondContact O-CB 3.35Å; E591-H595 PolarHBondContact O-N 2.89Å; L592-H595 PolarHBondContact O-N 3.22Å
596	F	91.7	Very high	91.2	Very high	26 Å²	26	64.8 Å²	64.8	11%	0.114	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	27.3	179.7	-65.3	-74	0	0	0	113.8	M565 L569 L592 L593 H598 E599 C600	M565-F596 HydrophobicContact CB-CD1 4.2Å; M565-F596 HydrophobicContact CB-CE1 3.93Å; M565-F596 HydrophobicContact CB-CZ 4.32Å; M565-F596 HydrophobicContact CG-CD1 4.41Å; M565-F596 HydrophobicContact CG-CE1 4.15Å; M565-F596 HydrophobicContact CG-CE2 4.27Å; M565-F596 HydrophobicContact CG-CZ 4.08Å; M565-F596 HydrophobicContact SD-CD1 4.44Å; M565-F596 HydrophobicContact SD-CD2 4.1Å; M565-F596 HydrophobicContact SD-CE2 4.38Å; M565-F596 HydrophobicContact SD-CG 4.13Å; L569-F596 HydrophobicContact CD1-CE2 4.06Å; L569-F596 HydrophobicContact CD1-CZ 4.35Å; L592-F596 HydrophobicContact CD1-CD2 3.63Å; L592-F596 HydrophobicContact CD1-CE2 3.61Å; L592-F596 HydrophobicContact CG-CD2 4.31Å; L592-F596 WeakPolarHBondContact O-CD2 3.42Å; L592-F596 PolarHBondContact O-N 2.79Å; L593-F596 CarbonylContact O-C 3.54Å; F596-H598 PolarHBondContact O-N 3.23Å; F596-E599 HydrophobicContact CB-CB 4.44Å; F596-E599 WeakPolarHBondContact O-CA 3.48Å; F596-E599 WeakPolarHBondContact O-CB 3.32Å; F596-E599 PolarHBondContact O-N 3.23Å; F596-C600 PolarHBondContact O-N 2.86Å; F596-C600 PolarHBondContact O-SG 2.89Å
597	R	91.7	Very high	91.2	Very high	69 Å²	69	62.8 Å²	62.8	26%	0.26	29%	0.286	S	S	.	.	H	α-helix	trans	-51	-32.8	-176.5	66	-164	177	-79.6	-5.9	115.2	L593 W594 E599 C600 M601 L610 L628	L593-R597 WeakPolarHBondContact O-CA 3.46Å; L593-R597 PolarHBondContact O-N 2.79Å; L593-R597 VanDerWaalsContact O-N 3.08Å; W594-R597 WeakPolarHBondContact O-CB 3.33Å; W594-R597 WeakPolarHBondContact O-CD 3.3Å; W594-R597 WeakPolarHBondContact O-CG 3.17Å; W594-R597 PolarHBondContact O-N 3.26Å; W594-R597 PolarHBondContact O-NH1 2.88Å; W594-R597 VanDerWaalsContact O-NH1 3.12Å; R597-E599 VanDerWaalsContact C-N 3.35Å; R597-C600 WeakPolarHBondContact O-CB 3.38Å; R597-C600 PolarHBondContact O-N 2.82Å; R597-M601 WeakPolarHBondContact O-CG 3.38Å; R597-M601 PolarHBondContact O-N 2.99Å; R597-L610 HydrophobicContact CB-CD1 3.71Å; R597-L610 HydrophobicContact CB-CD2 4.48Å; R597-L628 HydrophobicContact CB-CD1 4.16Å; R597-L628 HydrophobicContact CG-CD1 3.82Å
598	H	88.8	Confident	91.3	Very high	98 Å²	98	58 Å²	58	45%	0.454	26%	0.255	S	S	.	.	H	α-helix	trans	-68	-32.9	176.5	-69.2	-77.3	0	0	0	113.1	F596 L628	F596-H598 PolarHBondContact O-N 3.23Å; H598-L628 VanDerWaalsContact CE1-CD2 3.5Å; H598-L628 WeakPolarHBondContact CE1-CD2 3.49Å
599	E	87.3	Confident	91.4	Very high	62 Å²	62	52 Å²	52	29%	0.29	23%	0.227	S	C	.	.	H	α-helix	trans	-71.1	-40	171.6	-65.2	-62.9	149.7	0	0	110.4	F596 R597 M601 R602	F596-E599 HydrophobicContact CB-CB 4.44Å; F596-E599 WeakPolarHBondContact O-CA 3.48Å; F596-E599 WeakPolarHBondContact O-CB 3.32Å; F596-E599 PolarHBondContact O-N 3.23Å; R597-E599 VanDerWaalsContact C-N 3.35Å; E599-M601 VanDerWaalsContact C-N 3.26Å; E599-M601 PolarHBondContact O-N 3.37Å; E599-R602 WeakPolarHBondContact O-CB 3.41Å; E599-R602 PolarHBondContact O-N 3.4Å; E599-R602 IonicContact OE1-CZ 2.85Å; E599-R602 IonicContact OE1-NH1 3.65Å; E599-R602 PolarHBondContact OE1-NH1 3.46Å; E599-R602 IonicContact OE1-NH2 3.67Å; E599-R602 IonicContact OE2-CZ 3.16Å; E599-R602 IonicContact OE2-NE 3.28Å; E599-R602 IonicContact OE2-NH1 2.68Å; E599-R602 PolarHBondContact OE2-NH1 3.15Å
600	C	88.2	Confident	91.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.4	-40.3	173.5	-54.4	0	0	0	0	112	F573 L593 F596 R597 R602 D603 A606 L610	F573-C600 WeakPolarHBondContact CE2-SG 3.36Å; L593-C600 PolarHBondContact O-SG 2.99Å; L593-C600 VanDerWaalsContact O-SG 3.39Å; F596-C600 PolarHBondContact O-N 2.86Å; F596-C600 PolarHBondContact O-SG 2.89Å; R597-C600 WeakPolarHBondContact O-CB 3.38Å; R597-C600 PolarHBondContact O-N 2.82Å; C600-R602 PolarHBondContact O-N 2.94Å; C600-R602 VanDerWaalsContact O-N 3.11Å; C600-D603 PolarHBondContact O-N 3.15Å; C600-D603 VanDerWaalsContact O-N 3.14Å; C600-A606 HydrophobicContact CB-CB 4.18Å; C600-L610 HydrophobicContact CB-CB 4.21Å; C600-L610 HydrophobicContact CB-CD1 4.27Å; C600-L610 HydrophobicContact CB-CD2 3.83Å; C600-L610 HydrophobicContact CB-CG 4.32Å
601	M	88.8	Confident	91.5	Very high	21 Å²	21	47.5 Å²	47.5	10%	0.103	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.7	179.7	-68.6	-56.8	-68.1	0	0	113.7	R597 E599 Y607 L610 L628 L629 S632 A634	R597-M601 WeakPolarHBondContact O-CG 3.38Å; R597-M601 PolarHBondContact O-N 2.99Å; E599-M601 VanDerWaalsContact C-N 3.26Å; E599-M601 PolarHBondContact O-N 3.37Å; M601-Y607 HydrophobicContact CE-CE1 4.5Å; M601-Y607 HydrophobicContact CE-CE2 3.76Å; M601-Y607 WeakPolarHBondContact CE-OH 3.28Å; M601-Y607 PolarHBondContact O-OH 3.16Å; M601-Y607 HydrophobicContact SD-CE1 4.2Å; M601-Y607 HydrophobicContact SD-CE2 4.13Å; M601-L610 HydrophobicContact CG-CD2 4.49Å; M601-L610 HydrophobicContact SD-CD2 3.89Å; M601-L628 HydrophobicContact CE-CB 4.28Å; M601-L628 WeakPolarHBondContact CE-O 3.33Å; M601-L628 HydrophobicContact CG-CB 4.33Å; M601-L628 HydrophobicContact CG-CD2 4.27Å; M601-L628 HydrophobicContact SD-CB 4.24Å; M601-L629 HydrophobicContact CE-CD2 4.4Å; M601-S632 VanDerWaalsContact CE-CB 3.48Å; M601-A634 VanDerWaalsContact O-CB 3.27Å; M601-A634 WeakPolarHBondContact O-CB 3.21Å
602	R	88.8	Confident	91.4	Very high	171 Å²	171	42.2 Å²	42.2	65%	0.645	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-24.2	175.9	-62.3	179	171.9	160.4	0.8	113.4	E599 C600	E599-R602 WeakPolarHBondContact O-CB 3.41Å; E599-R602 PolarHBondContact O-N 3.4Å; E599-R602 IonicContact OE1-CZ 2.85Å; E599-R602 IonicContact OE1-NH1 3.65Å; E599-R602 PolarHBondContact OE1-NH1 3.46Å; E599-R602 IonicContact OE1-NH2 3.67Å; E599-R602 IonicContact OE2-CZ 3.16Å; E599-R602 IonicContact OE2-NE 3.28Å; E599-R602 IonicContact OE2-NH1 2.68Å; E599-R602 PolarHBondContact OE2-NH1 3.15Å; C600-R602 PolarHBondContact O-N 2.94Å; C600-R602 VanDerWaalsContact O-N 3.11Å
603	D	89.7	Confident	91.5	Very high	37 Å²	37	41.7 Å²	41.7	20%	0.198	19%	0.189	C	C	.	.			trans	-116.6	108.2	178.9	-172.9	-15.7	0	0	0	110.2	C600 R605 A606 Y607	C600-D603 PolarHBondContact O-N 3.15Å; C600-D603 VanDerWaalsContact O-N 3.14Å; D603-R605 PolarHBondContact O-N 2.78Å; D603-R605 WeakPolarHBondContact OD1-CB 3.4Å; D603-R605 IonicContact OD1-CZ 3.85Å; D603-R605 PolarHBondContact OD1-N 3Å; D603-R605 IonicContact OD1-NE 3.84Å; D603-R605 PolarHBondContact OD1-NE 3.08Å; D603-R605 IonicContact OD1-NH2 3.64Å; D603-R605 IonicContact OD2-CZ 3.05Å; D603-R605 IonicContact OD2-NE 2.72Å; D603-R605 PolarHBondContact OD2-NE 2.88Å; D603-R605 IonicContact OD2-NH2 3.75Å; D603-R605 PolarHBondContact OD2-NH2 3.32Å; D603-A606 WeakPolarHBondContact O-CB 3.35Å; D603-A606 PolarHBondContact O-N 2.9Å; D603-Y607 WeakPolarHBondContact O-CD1 3.43Å
604	P	91.3	Very high	91.6	Very high	22 Å²	22	41.8 Å²	41.8	14%	0.143	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-50.5	-32.2	177.5	-29.3	36.3	0	0	0	114.5	A606 Y607 W635 L644	P604-A606 PolarHBondContact O-N 3.26Å; P604-Y607 WeakPolarHBondContact O-CB 3.25Å; P604-Y607 WeakPolarHBondContact O-CD1 3.43Å; P604-Y607 PolarHBondContact O-N 3.26Å; P604-Y607 VanDerWaalsContact O-N 3.09Å; P604-W635 HydrophobicContact CB-CE3 4.01Å; P604-W635 HydrophobicContact CB-CZ3 4.38Å; P604-L644 HydrophobicContact CB-CD2 4.02Å
605	R	90.4	Very high	91.7	Very high	160 Å²	160	45.2 Å²	45.2	60%	0.604	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-65.9	-22.6	-179.6	-59.7	173.2	-63	174.2	5.5	112.8	V577 D603 Y607	V577-R605 HydrophobicContact CG1-CB 3.97Å; D603-R605 PolarHBondContact O-N 2.78Å; D603-R605 WeakPolarHBondContact OD1-CB 3.4Å; D603-R605 IonicContact OD1-CZ 3.85Å; D603-R605 PolarHBondContact OD1-N 3Å; D603-R605 IonicContact OD1-NE 3.84Å; D603-R605 PolarHBondContact OD1-NE 3.08Å; D603-R605 IonicContact OD1-NH2 3.64Å; D603-R605 IonicContact OD2-CZ 3.05Å; D603-R605 IonicContact OD2-NE 2.72Å; D603-R605 PolarHBondContact OD2-NE 2.88Å; D603-R605 IonicContact OD2-NH2 3.75Å; D603-R605 PolarHBondContact OD2-NH2 3.32Å; R605-Y607 VanDerWaalsContact C-N 3.33Å
606	A	92	Very high	91.9	Very high	0 Å²	0	41 Å²	41	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-79.5	-14.3	177.3	0	0	0	0	0	113.1	F573 V577 C600 D603 P604 K609 L610	F573-A606 HydrophobicContact CZ-CB 4.29Å; V577-A606 HydrophobicContact CG1-CB 4.2Å; V577-A606 HydrophobicContact CG2-CB 3.7Å; C600-A606 HydrophobicContact CB-CB 4.18Å; D603-A606 WeakPolarHBondContact O-CB 3.35Å; D603-A606 PolarHBondContact O-N 2.9Å; P604-A606 PolarHBondContact O-N 3.26Å; A606-K609 PolarHBondContact O-N 3.34Å; A606-L610 WeakPolarHBondContact O-CB 3.32Å; A606-L610 PolarHBondContact O-N 2.98Å
607	Y	93.8	Very high	92	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-48.1	-169.7	-78.8	41.6	0	0	0	112.8	M601 D603 P604 R605 K609 L610 L611 W635 M661	M601-Y607 HydrophobicContact CE-CE1 4.5Å; M601-Y607 HydrophobicContact CE-CE2 3.76Å; M601-Y607 WeakPolarHBondContact CE-OH 3.28Å; M601-Y607 PolarHBondContact O-OH 3.16Å; M601-Y607 HydrophobicContact SD-CE1 4.2Å; M601-Y607 HydrophobicContact SD-CE2 4.13Å; D603-Y607 WeakPolarHBondContact O-CD1 3.43Å; P604-Y607 WeakPolarHBondContact O-CB 3.25Å; P604-Y607 WeakPolarHBondContact O-CD1 3.43Å; P604-Y607 PolarHBondContact O-N 3.26Å; P604-Y607 VanDerWaalsContact O-N 3.09Å; R605-Y607 VanDerWaalsContact C-N 3.33Å; Y607-K609 VanDerWaalsContact C-N 3.32Å; Y607-K609 PolarHBondContact O-N 2.83Å; Y607-L610 PolarHBondContact O-N 3.17Å; Y607-L611 WeakPolarHBondContact O-CB 3.48Å; Y607-L611 WeakPolarHBondContact O-CG 3.36Å; Y607-L611 PolarHBondContact O-N 3.04Å; Y607-W635 HydrophobicContact CD2-CD2 4.14Å; Y607-W635 AromaticContact CD2-CE3 3.44Å; Y607-W635 HydrophobicContact CD2-CE3 3.44Å; Y607-W635 VanDerWaalsContact CD2-CE3 3.44Å; Y607-W635 AromaticContact CD2-CZ3 3.97Å; Y607-W635 HydrophobicContact CD2-CZ3 3.97Å; Y607-W635 HydrophobicContact CE2-CB 3.64Å; Y607-W635 HydrophobicContact CE2-CD2 4.08Å; Y607-W635 AromaticContact CE2-CE3 3.69Å; Y607-W635 HydrophobicContact CE2-CE3 3.69Å; Y607-W635 HydrophobicContact CE2-CG 4.1Å; Y607-W635 AromaticContact CG-CE3 3.92Å; Y607-W635 HydrophobicContact CG-CE3 3.92Å; Y607-W635 HydrophobicContact CG-CZ3 4.17Å; Y607-M661 HydrophobicContact CD2-CE 3.96Å; Y607-M661 HydrophobicContact CD2-SD 4.33Å; Y607-M661 HydrophobicContact CE2-SD 4.3Å
608	P	93.4	Very high	92.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.013	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-45	176.8	-25.2	35	0	0	0	112.4	L611 G612 L644 Q647 L648 Y653	P608-L611 PolarHBondContact O-N 3.24Å; P608-G612 PolarHBondContact O-N 2.87Å; P608-L644 HydrophobicContact CG-CD1 3.73Å; P608-Q647 HydrophobicContact CB-CG 4.19Å; P608-Q647 HydrophobicContact CG-CG 4.38Å; P608-L648 HydrophobicContact CB-CD2 4.2Å; P608-L648 HydrophobicContact CG-CD2 4Å; P608-Y653 VanDerWaalsContact CA-OH 3.31Å; P608-Y653 WeakPolarHBondContact CA-OH 3.42Å; P608-Y653 VanDerWaalsContact CB-OH 3.3Å; P608-Y653 WeakPolarHBondContact CB-OH 3.45Å; P608-Y653 PolarHBondContact O-OH 3.39Å
609	K	93.6	Very high	92.4	Very high	17 Å²	17	38.3 Å²	38.3	7%	0.074	18%	0.178	C	C	.	.	H	α-helix	trans	-66.7	-41.1	179.8	-60	-56.9	-152.8	-78.3	0	111.8	T579 D580 L585 L593 A606 Y607 G612 S613	T579-K609 PolarHBondContact O-NZ 3.4Å; T579-K609 VanDerWaalsContact OG1-CE 3.27Å; T579-K609 WeakPolarHBondContact OG1-CE 3.39Å; D580-K609 PolarHBondContact O-NZ 3.33Å; L585-K609 HydrophobicContact CD1-CB 4.14Å; L585-K609 HydrophobicContact CD1-CD 4.12Å; L585-K609 HydrophobicContact CD2-CD 4.08Å; L585-K609 HydrophobicContact CG-CD 4.25Å; L593-K609 HydrophobicContact CD1-CB 3.92Å; A606-K609 PolarHBondContact O-N 3.34Å; Y607-K609 VanDerWaalsContact C-N 3.32Å; Y607-K609 PolarHBondContact O-N 2.83Å; K609-G612 PolarHBondContact O-N 3.49Å; K609-S613 PolarHBondContact O-N 2.85Å; K609-S613 PolarHBondContact O-OG 3.45Å
610	L	94.4	Very high	92.6	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-50	173.8	173.1	66.1	0	0	0	111.2	L593 W594 R597 C600 M601 A606 Y607 G612 S613 V614	L593-L610 WeakPolarHBondContact O-CD1 3.28Å; W594-L610 HydrophobicContact CE3-CD1 4.34Å; R597-L610 HydrophobicContact CB-CD1 3.71Å; R597-L610 HydrophobicContact CB-CD2 4.48Å; C600-L610 HydrophobicContact CB-CB 4.21Å; C600-L610 HydrophobicContact CB-CD1 4.27Å; C600-L610 HydrophobicContact CB-CD2 3.83Å; C600-L610 HydrophobicContact CB-CG 4.32Å; M601-L610 HydrophobicContact CG-CD2 4.49Å; M601-L610 HydrophobicContact SD-CD2 3.89Å; A606-L610 WeakPolarHBondContact O-CB 3.32Å; A606-L610 PolarHBondContact O-N 2.98Å; Y607-L610 PolarHBondContact O-N 3.17Å; L610-G612 VanDerWaalsContact C-N 3.31Å; L610-G612 PolarHBondContact O-N 3.4Å; L610-S613 WeakPolarHBondContact O-CA 3.44Å; L610-S613 VanDerWaalsContact O-CB 3.26Å; L610-S613 WeakPolarHBondContact O-CB 3.39Å; L610-S613 PolarHBondContact O-N 3.15Å; L610-V614 PolarHBondContact O-N 3.42Å
611	L	94.4	Very high	92.8	Very high	2 Å²	2	43 Å²	43	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-33.5	-177.9	-69.1	170.1	0	0	0	112.1	Y607 P608 S613 V614 W616 T625 L629 L648 Y653 V658	Y607-L611 WeakPolarHBondContact O-CB 3.48Å; Y607-L611 WeakPolarHBondContact O-CG 3.36Å; Y607-L611 PolarHBondContact O-N 3.04Å; P608-L611 PolarHBondContact O-N 3.24Å; L611-S613 PolarHBondContact O-N 3.28Å; L611-V614 PolarHBondContact O-N 3.49Å; L611-W616 HydrophobicContact CD2-CZ2 4.43Å; L611-W616 PolarHBondContact O-NE1 3.18Å; L611-T625 HydrophobicContact CD2-CG2 3.78Å; L611-L629 HydrophobicContact CD2-CD2 4.48Å; L611-L648 HydrophobicContact CD1-CD2 3.76Å; L611-Y653 HydrophobicContact CB-CD1 4.13Å; L611-Y653 HydrophobicContact CB-CE1 3.69Å; L611-V658 HydrophobicContact CD1-CB 4.49Å; L611-V658 HydrophobicContact CD1-CG1 3.71Å; L611-V658 HydrophobicContact CD1-CG2 3.97Å; L611-V658 HydrophobicContact CD2-CG2 3.8Å; L611-V658 HydrophobicContact CG-CG2 4.47Å
612	G	92.1	Very high	93.1	Very high	35 Å²	35	42.8 Å²	42.8	36%	0.361	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-11.2	169.7	0	0	0	0	0	114.7	P608 K609 L610	P608-G612 PolarHBondContact O-N 2.87Å; K609-G612 PolarHBondContact O-N 3.49Å; L610-G612 VanDerWaalsContact C-N 3.31Å; L610-G612 PolarHBondContact O-N 3.4Å
613	S	94.1	Very high	93.1	Very high	9 Å²	9	35.6 Å²	35.6	6%	0.063	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-10.8	176.9	-55	0	0	0	0	113.2	K590 L593 K609 L610 L611	K590-S613 WeakPolarHBondContact CA-OG 3.48Å; L593-S613 WeakPolarHBondContact CD1-OG 3.47Å; K609-S613 PolarHBondContact O-N 2.85Å; K609-S613 PolarHBondContact O-OG 3.45Å; L610-S613 WeakPolarHBondContact O-CA 3.44Å; L610-S613 VanDerWaalsContact O-CB 3.26Å; L610-S613 WeakPolarHBondContact O-CB 3.39Å; L610-S613 PolarHBondContact O-N 3.15Å; L611-S613 PolarHBondContact O-N 3.28Å
614	V	95.1	Very high	93.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	18%	0.175	C	C	.	.	S	Bend	trans	-67	136	178.8	-179.1	0	0	0	0	110.3	W594 L610 L611 W616 T625	W594-V614 HydrophobicContact CE3-CG2 4.16Å; W594-V614 HydrophobicContact CZ3-CB 4.5Å; W594-V614 HydrophobicContact CZ3-CG1 4.46Å; W594-V614 HydrophobicContact CZ3-CG2 3.74Å; L610-V614 PolarHBondContact O-N 3.42Å; L611-V614 PolarHBondContact O-N 3.49Å; V614-W616 HydrophobicContact CB-CD2 4.31Å; V614-W616 HydrophobicContact CB-CZ2 4.06Å; V614-W616 HydrophobicContact CG1-CD2 3.93Å; V614-W616 HydrophobicContact CG1-CE3 4.32Å; V614-W616 HydrophobicContact CG1-CG 4.29Å; V614-W616 HydrophobicContact CG1-CZ2 4.19Å; V614-W616 HydrophobicContact CG2-CZ2 4.3Å; V614-W616 VanDerWaalsContact O-CD1 3.31Å; V614-W616 PolarHBondContact O-N 2.73Å; V614-T625 HydrophobicContact CG2-CG2 4.21Å
615	R	94.8	Very high	93.3	Very high	111 Å²	111	34.3 Å²	34.3	42%	0.419	17%	0.17	S	C	.	.			trans	-85.6	84.3	171.7	-59.5	177.4	-60.7	-162.8	-2.6	108.9	G617 K618 D621	R615-G617 PolarHBondContact O-N 3.44Å; R615-G617 VanDerWaalsContact O-N 3.12Å; R615-K618 HydrophobicContact CB-CD 4.4Å; R615-K618 HydrophobicContact CB-CG 4.43Å; R615-K618 PolarHBondContact O-N 3.01Å; R615-D621 WeakPolarHBondContact CB-OD2 3.43Å; R615-D621 IonicContact CZ-OD2 3.34Å; R615-D621 IonicContact NE-OD2 2.73Å; R615-D621 PolarHBondContact NE-OD2 2.66Å; R615-D621 IonicContact NH2-OD1 2.84Å; R615-D621 PolarHBondContact NH2-OD1 3.38Å; R615-D621 IonicContact NH2-OD2 3.38Å; R615-D621 PolarHBondContact NH2-OD2 3.01Å
616	W	95.3	Very high	93.4	Very high	12 Å²	12	28.1 Å²	28.1	5%	0.045	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.2	-175.4	-65.3	99.7	0	0	0	114.2	H391 Q394 P426 L611 V614 K618 V622 T625 D655 V658	H391-W616 HydrophobicContact CB-CB 4.36Å; H391-W616 AromaticContact CE1-CD2 3.46Å; H391-W616 VanDerWaalsContact CE1-CD2 3.46Å; H391-W616 AromaticContact CE1-CE3 3.55Å; H391-W616 AromaticContact CE1-CG 3.7Å; H391-W616 AromaticContact ND1-CD1 3.81Å; H391-W616 AromaticContact ND1-CD2 3.65Å; H391-W616 AromaticContact ND1-CG 3.35Å; H391-W616 VanDerWaalsContact ND1-CG 3.35Å; Q394-W616 VanDerWaalsContact OE1-CD1 3.23Å; P426-W616 HydrophobicContact CG-CB 4.44Å; P426-W616 WeakPolarHBondContact CG-O 3.46Å; L611-W616 HydrophobicContact CD2-CZ2 4.43Å; L611-W616 PolarHBondContact O-NE1 3.18Å; V614-W616 HydrophobicContact CB-CD2 4.31Å; V614-W616 HydrophobicContact CB-CZ2 4.06Å; V614-W616 HydrophobicContact CG1-CD2 3.93Å; V614-W616 HydrophobicContact CG1-CE3 4.32Å; V614-W616 HydrophobicContact CG1-CG 4.29Å; V614-W616 HydrophobicContact CG1-CZ2 4.19Å; V614-W616 HydrophobicContact CG2-CZ2 4.3Å; V614-W616 VanDerWaalsContact O-CD1 3.31Å; V614-W616 PolarHBondContact O-N 2.73Å; W616-K618 PolarHBondContact O-N 3.3Å; W616-V622 HydrophobicContact CE3-CG1 4.49Å; W616-V622 HydrophobicContact CE3-CG2 3.86Å; W616-V622 HydrophobicContact CZ3-CG1 4.36Å; W616-V622 HydrophobicContact CZ3-CG2 4.43Å; W616-V622 WeakPolarHBondContact O-CG2 3.23Å; W616-T625 HydrophobicContact CH2-CG2 4.24Å; W616-D655 HydrophobicContact CE3-CB 4.44Å; W616-D655 HydrophobicContact CH2-CB 3.64Å; W616-D655 HydrophobicContact CZ2-CB 4.44Å; W616-D655 HydrophobicContact CZ3-CB 3.64Å; W616-V658 HydrophobicContact CH2-CG2 4.11Å
617	G	94.8	Very high	93.3	Very high	20 Å²	20	34.5 Å²	34.5	21%	0.206	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	21.9	171.4	0	0	0	0	0	115	D424 R615	D424-G617 WeakPolarHBondContact CB-O 3.33Å; R615-G617 PolarHBondContact O-N 3.44Å; R615-G617 VanDerWaalsContact O-N 3.12Å
618	K	94.9	Very high	93.1	Very high	92 Å²	92	35.4 Å²	35.4	40%	0.4	18%	0.176	S	C	.	.			trans	-134.1	116.8	172.5	-69.6	-171	179.7	-173.7	0	109.9	R615 W616 E620 D621 V622	R615-K618 HydrophobicContact CB-CD 4.4Å; R615-K618 HydrophobicContact CB-CG 4.43Å; R615-K618 PolarHBondContact O-N 3.01Å; W616-K618 PolarHBondContact O-N 3.3Å; K618-E620 VanDerWaalsContact C-N 3.3Å; K618-E620 PolarHBondContact O-N 2.86Å; K618-D621 HydrophobicContact CB-CB 4.28Å; K618-D621 PolarHBondContact O-N 3.19Å; K618-V622 WeakPolarHBondContact O-CG2 3.35Å; K618-V622 PolarHBondContact O-N 3.2Å
619	Q	93.1	Very high	92.9	Very high	24 Å²	24	35.7 Å²	35.7	11%	0.112	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-36	-174.8	176.8	-101.7	-21.4	0	0	113.9	W357 K423 D424 V622 L623	W357-Q619 HydrophobicContact CD2-CG 4.35Å; W357-Q619 VanDerWaalsContact CD2-NE2 3.34Å; W357-Q619 HydrophobicContact CG-CG 4.15Å; K423-Q619 WeakPolarHBondContact O-CB 3.21Å; D424-Q619 WeakPolarHBondContact OD1-CB 3.26Å; D424-Q619 PolarHBondContact OD1-N 3.04Å; Q619-V622 PolarHBondContact O-N 3.47Å; Q619-L623 PolarHBondContact O-N 3.34Å
620	E	91.3	Very high	92.4	Very high	143 Å²	143	40.9 Å²	40.9	67%	0.668	21%	0.206	S	C	*	.	H	α-helix	trans	-64.6	-42.3	178.4	-66.2	170.2	-171.2	0	0	112.4	K618 L623 A624	K618-E620 VanDerWaalsContact C-N 3.3Å; K618-E620 PolarHBondContact O-N 2.86Å; E620-L623 PolarHBondContact O-N 3.49Å; E620-A624 WeakPolarHBondContact O-CB 3.45Å; E620-A624 PolarHBondContact O-N 3.05Å
621	D	94.2	Very high	91.8	Very high	16 Å²	16	49.9 Å²	49.9	9%	0.086	24%	0.24	C	C	.	.	H	α-helix	trans	-69.4	-37.1	179.1	-70	-17.4	0	0	0	111	W594 R615 K618 A624 T625	W594-D621 HydrophobicContact CH2-CB 4.1Å; W594-D621 WeakPolarHBondContact CH2-O 3.48Å; W594-D621 HydrophobicContact CZ2-CB 3.68Å; W594-D621 WeakPolarHBondContact CZ2-OD1 3.34Å; R615-D621 WeakPolarHBondContact CB-OD2 3.43Å; R615-D621 IonicContact CZ-OD2 3.34Å; R615-D621 IonicContact NE-OD2 2.73Å; R615-D621 PolarHBondContact NE-OD2 2.66Å; R615-D621 IonicContact NH2-OD1 2.84Å; R615-D621 PolarHBondContact NH2-OD1 3.38Å; R615-D621 IonicContact NH2-OD2 3.38Å; R615-D621 PolarHBondContact NH2-OD2 3.01Å; K618-D621 HydrophobicContact CB-CB 4.28Å; K618-D621 PolarHBondContact O-N 3.19Å; D621-A624 PolarHBondContact O-N 2.9Å; D621-T625 WeakPolarHBondContact O-CB 3.41Å; D621-T625 PolarHBondContact O-N 3.24Å; D621-T625 PolarHBondContact O-OG1 3.21Å
622	V	93.1	Very high	91.1	Very high	17 Å²	17	49.9 Å²	49.9	10%	0.103	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-47.4	174.6	176.5	0	0	0	0	110.7	W616 K618 Q619 A624 T625 H626	W616-V622 HydrophobicContact CE3-CG1 4.49Å; W616-V622 HydrophobicContact CE3-CG2 3.86Å; W616-V622 HydrophobicContact CZ3-CG1 4.36Å; W616-V622 HydrophobicContact CZ3-CG2 4.43Å; W616-V622 WeakPolarHBondContact O-CG2 3.23Å; K618-V622 WeakPolarHBondContact O-CG2 3.35Å; K618-V622 PolarHBondContact O-N 3.2Å; Q619-V622 PolarHBondContact O-N 3.47Å; V622-A624 PolarHBondContact O-N 3.43Å; V622-T625 WeakPolarHBondContact O-CB 3.39Å; V622-T625 PolarHBondContact O-N 3.39Å; V622-T625 VanDerWaalsContact O-N 3.15Å; V622-H626 PolarHBondContact O-N 3.06Å
623	L	90.6	Very high	90.5	Very high	20 Å²	20	54 Å²	54	11%	0.105	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-40.4	176.4	-76.5	-176.4	0	0	0	113	W357 Q619 E620 T625 H626 R627	W357-L623 HydrophobicContact CH2-CD1 3.98Å; W357-L623 HydrophobicContact CH2-CD2 3.64Å; W357-L623 HydrophobicContact CH2-CG 4.29Å; W357-L623 HydrophobicContact CZ2-CD1 4.23Å; W357-L623 HydrophobicContact CZ2-CD2 3.78Å; W357-L623 HydrophobicContact CZ2-CG 4.25Å; W357-L623 HydrophobicContact CZ3-CD1 4.24Å; Q619-L623 PolarHBondContact O-N 3.34Å; E620-L623 PolarHBondContact O-N 3.49Å; L623-T625 VanDerWaalsContact C-N 3.28Å; L623-T625 PolarHBondContact O-N 3.48Å; L623-H626 PolarHBondContact O-N 2.71Å; L623-R627 VanDerWaalsContact O-CG 3.31Å; L623-R627 WeakPolarHBondContact O-CG 3.47Å; L623-R627 PolarHBondContact O-N 3.29Å; L623-R627 VanDerWaalsContact O-N 3.09Å
624	A	91.4	Very high	89.9	Confident	27 Å²	27	54.9 Å²	54.9	22%	0.223	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-40.6	174.5	0	0	0	0	0	111.1	W594 E620 D621 V622 R627 L628	W594-A624 HydrophobicContact CH2-CB 4.24Å; W594-A624 HydrophobicContact CZ2-CB 4.4Å; E620-A624 WeakPolarHBondContact O-CB 3.45Å; E620-A624 PolarHBondContact O-N 3.05Å; D621-A624 PolarHBondContact O-N 2.9Å; V622-A624 PolarHBondContact O-N 3.43Å; A624-R627 PolarHBondContact O-N 3.22Å; A624-L628 WeakPolarHBondContact O-CG 3.25Å; A624-L628 PolarHBondContact O-N 3.34Å; A624-L628 VanDerWaalsContact O-N 3.12Å
625	T	93.2	Very high	89.6	Confident	5 Å²	5	55 Å²	55	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-50.5	177	-56.4	0	0	0	0	111.4	W594 L611 V614 W616 D621 V622 L623 R627 L628 L629	W594-T625 WeakPolarHBondContact CH2-OG1 3.48Å; W594-T625 WeakPolarHBondContact CZ3-OG1 3.49Å; L611-T625 HydrophobicContact CD2-CG2 3.78Å; V614-T625 HydrophobicContact CG2-CG2 4.21Å; W616-T625 HydrophobicContact CH2-CG2 4.24Å; D621-T625 WeakPolarHBondContact O-CB 3.41Å; D621-T625 PolarHBondContact O-N 3.24Å; D621-T625 PolarHBondContact O-OG1 3.21Å; V622-T625 WeakPolarHBondContact O-CB 3.39Å; V622-T625 PolarHBondContact O-N 3.39Å; V622-T625 VanDerWaalsContact O-N 3.15Å; L623-T625 VanDerWaalsContact C-N 3.28Å; L623-T625 PolarHBondContact O-N 3.48Å; T625-R627 VanDerWaalsContact C-N 3.3Å; T625-R627 PolarHBondContact O-N 3.4Å; T625-L628 WeakPolarHBondContact O-CB 3.38Å; T625-L628 PolarHBondContact O-N 2.99Å; T625-L629 HydrophobicContact CG2-CD1 4.24Å; T625-L629 HydrophobicContact CG2-CG 4.4Å; T625-L629 WeakPolarHBondContact O-CG 3.47Å; T625-L629 PolarHBondContact O-N 3.44Å
626	H	91.5	Very high	89.1	Confident	30 Å²	30	53.9 Å²	53.9	14%	0.139	27%	0.265	C	S	.	.	H	α-helix	trans	-57	-42.5	177.9	-67	168.3	0	0	0	112.1	V622 L623 L628 L629 D630 D655 Q657	V622-H626 PolarHBondContact O-N 3.06Å; L623-H626 PolarHBondContact O-N 2.71Å; H626-L628 VanDerWaalsContact C-N 3.3Å; H626-L628 PolarHBondContact O-N 3.1Å; H626-L629 PolarHBondContact O-N 2.97Å; H626-D630 PolarHBondContact O-N 3.32Å; H626-D655 IonicContact CD2-OD2 2.68Å; H626-D655 IonicContact CE1-OD2 3.61Å; H626-D655 IonicContact NE2-OD1 3.26Å; H626-D655 IonicContact NE2-OD2 3.6Å; H626-D655 PolarHBondContact NE2-OD2 3.03Å; H626-Q657 VanDerWaalsContact CD2-CD 3.44Å; H626-Q657 PolarHBondContact CD2-OE1 3.48Å; H626-Q657 VanDerWaalsContact CG-CD 3.49Å
627	R	89.5	Confident	88.7	Confident	135 Å²	135	59 Å²	59	51%	0.509	30%	0.297	S	S	.	.	H	α-helix	trans	-62.9	-32.9	174.7	-70.1	172.7	-172.2	164.2	1.8	113.8	L623 A624 T625 R631	L623-R627 VanDerWaalsContact O-CG 3.31Å; L623-R627 WeakPolarHBondContact O-CG 3.47Å; L623-R627 PolarHBondContact O-N 3.29Å; L623-R627 VanDerWaalsContact O-N 3.09Å; A624-R627 PolarHBondContact O-N 3.22Å; T625-R627 VanDerWaalsContact C-N 3.3Å; T625-R627 PolarHBondContact O-N 3.4Å; R627-R631 WeakPolarHBondContact O-CG 3.18Å
628	L	89.7	Confident	88.4	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-69.9	-45.7	174.7	-70.3	168	0	0	0	110.4	R597 H598 M601 A624 T625 H626 D630 R631 S632	R597-L628 HydrophobicContact CB-CD1 4.16Å; R597-L628 HydrophobicContact CG-CD1 3.82Å; H598-L628 VanDerWaalsContact CE1-CD2 3.5Å; H598-L628 WeakPolarHBondContact CE1-CD2 3.49Å; M601-L628 HydrophobicContact CE-CB 4.28Å; M601-L628 WeakPolarHBondContact CE-O 3.33Å; M601-L628 HydrophobicContact CG-CB 4.33Å; M601-L628 HydrophobicContact CG-CD2 4.27Å; M601-L628 HydrophobicContact SD-CB 4.24Å; A624-L628 WeakPolarHBondContact O-CG 3.25Å; A624-L628 PolarHBondContact O-N 3.34Å; A624-L628 VanDerWaalsContact O-N 3.12Å; T625-L628 WeakPolarHBondContact O-CB 3.38Å; T625-L628 PolarHBondContact O-N 2.99Å; H626-L628 VanDerWaalsContact C-N 3.3Å; H626-L628 PolarHBondContact O-N 3.1Å; L628-D630 VanDerWaalsContact C-N 3.34Å; L628-D630 PolarHBondContact O-N 3.16Å; L628-R631 CarbonylContact O-C 3.49Å; L628-R631 PolarHBondContact O-N 3.37Å; L628-R631 VanDerWaalsContact O-N 3.07Å; L628-S632 PolarHBondContact O-N 3.05Å
629	L	89.4	Confident	88.1	Confident	9 Å²	9	58.3 Å²	58.3	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-37.7	179.8	-63	-179.3	0	0	0	112.2	M601 L611 T625 H626 R631 S632 Q657 V658 M661	M601-L629 HydrophobicContact CE-CD2 4.4Å; L611-L629 HydrophobicContact CD2-CD2 4.48Å; T625-L629 HydrophobicContact CG2-CD1 4.24Å; T625-L629 HydrophobicContact CG2-CG 4.4Å; T625-L629 WeakPolarHBondContact O-CG 3.47Å; T625-L629 PolarHBondContact O-N 3.44Å; H626-L629 PolarHBondContact O-N 2.97Å; L629-R631 PolarHBondContact O-N 2.92Å; L629-S632 VanDerWaalsContact O-CB 3.25Å; L629-S632 WeakPolarHBondContact O-CB 3.23Å; L629-S632 PolarHBondContact O-N 2.91Å; L629-S632 PolarHBondContact O-OG 3.15Å; L629-Q657 HydrophobicContact CD1-CB 4.45Å; L629-V658 HydrophobicContact CD1-CG2 3.8Å; L629-M661 HydrophobicContact CD2-CE 4.22Å; L629-M661 HydrophobicContact CD2-SD 3.86Å
630	D	84.3	Confident	87.8	Confident	125 Å²	125	60.2 Å²	60.2	67%	0.668	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.4	174.6	-73.6	-20.9	0	0	0	113.1	H626 L628	H626-D630 PolarHBondContact O-N 3.32Å; L628-D630 VanDerWaalsContact C-N 3.34Å; L628-D630 PolarHBondContact O-N 3.16Å
631	R	81.3	Confident	87.8	Confident	195 Å²	195	57.3 Å²	57.3	74%	0.736	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	17.7	-179.5	-61.6	179.3	-178.5	-175	-0.1	112.7	R627 L628 L629 N633	R627-R631 WeakPolarHBondContact O-CG 3.18Å; L628-R631 CarbonylContact O-C 3.49Å; L628-R631 PolarHBondContact O-N 3.37Å; L628-R631 VanDerWaalsContact O-N 3.07Å; L629-R631 PolarHBondContact O-N 2.92Å; R631-N633 PolarHBondContact O-N 3.38Å
632	S	79	Confident	87.7	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.021	31%	0.313	C	S	.	.			trans	-76.9	55.4	-171.3	61.8	0	0	0	0	114.5	M601 L628 L629 A634 W635 D636	M601-S632 VanDerWaalsContact CE-CB 3.48Å; L628-S632 PolarHBondContact O-N 3.05Å; L629-S632 VanDerWaalsContact O-CB 3.25Å; L629-S632 WeakPolarHBondContact O-CB 3.23Å; L629-S632 PolarHBondContact O-N 2.91Å; L629-S632 PolarHBondContact O-OG 3.15Å; S632-A634 PolarHBondContact O-N 3.12Å; S632-A634 VanDerWaalsContact O-N 3.16Å; S632-W635 WeakPolarHBondContact O-CB 3.39Å; S632-W635 PolarHBondContact O-N 3.22Å; S632-D636 PolarHBondContact O-N 3.39Å; S632-D636 VanDerWaalsContact O-N 3.1Å
633	N	79.9	Confident	87.5	Confident	120 Å²	120	57 Å²	57	64%	0.642	31%	0.311	S	S	*	.	H	α-helix	trans	-55.3	-37.9	-179.4	-65.4	-10.9	0	0	0	112.9	R631 D636 T637	R631-N633 PolarHBondContact O-N 3.38Å; N633-D636 PolarHBondContact O-N 3.12Å; N633-T637 WeakPolarHBondContact O-CB 3.39Å; N633-T637 VanDerWaalsContact O-CG2 3.3Å; N633-T637 WeakPolarHBondContact O-CG2 3.29Å; N633-T637 PolarHBondContact O-N 3.09Å; N633-T637 PolarHBondContact O-OG1 2.97Å
634	A	82.4	Confident	87.6	Confident	29 Å²	29	56.9 Å²	56.9	24%	0.24	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-40.4	179.3	0	0	0	0	0	112.1	M601 S632 T637 S638	M601-A634 VanDerWaalsContact O-CB 3.27Å; M601-A634 WeakPolarHBondContact O-CB 3.21Å; S632-A634 PolarHBondContact O-N 3.12Å; S632-A634 VanDerWaalsContact O-N 3.16Å; A634-T637 PolarHBondContact O-OG1 3.22Å; A634-S638 WeakPolarHBondContact O-CB 3.37Å; A634-S638 PolarHBondContact O-N 3.35Å; A634-S638 VanDerWaalsContact O-N 3.11Å
635	W	88	Confident	87.8	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.011	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-54.5	172.4	-178.7	-92.2	0	0	0	110.1	P604 Y607 S632 T637 S638 L644 L648 M661 K665	P604-W635 HydrophobicContact CB-CE3 4.01Å; P604-W635 HydrophobicContact CB-CZ3 4.38Å; Y607-W635 HydrophobicContact CD2-CD2 4.14Å; Y607-W635 AromaticContact CD2-CE3 3.44Å; Y607-W635 HydrophobicContact CD2-CE3 3.44Å; Y607-W635 VanDerWaalsContact CD2-CE3 3.44Å; Y607-W635 AromaticContact CD2-CZ3 3.97Å; Y607-W635 HydrophobicContact CD2-CZ3 3.97Å; Y607-W635 HydrophobicContact CE2-CB 3.64Å; Y607-W635 HydrophobicContact CE2-CD2 4.08Å; Y607-W635 AromaticContact CE2-CE3 3.69Å; Y607-W635 HydrophobicContact CE2-CE3 3.69Å; Y607-W635 HydrophobicContact CE2-CG 4.1Å; Y607-W635 AromaticContact CG-CE3 3.92Å; Y607-W635 HydrophobicContact CG-CE3 3.92Å; Y607-W635 HydrophobicContact CG-CZ3 4.17Å; S632-W635 WeakPolarHBondContact O-CB 3.39Å; S632-W635 PolarHBondContact O-N 3.22Å; W635-T637 VanDerWaalsContact C-N 3.29Å; W635-T637 PolarHBondContact O-N 3.32Å; W635-S638 PolarHBondContact O-N 3.46Å; W635-S638 VanDerWaalsContact O-N 3.07Å; W635-S638 PolarHBondContact O-OG 3.09Å; W635-L644 HydrophobicContact CE3-CD2 4.23Å; W635-L644 HydrophobicContact CH2-CD2 3.61Å; W635-L644 HydrophobicContact CH2-CG 3.93Å; W635-L644 HydrophobicContact CZ3-CD2 3.28Å; W635-L644 HydrophobicContact CZ3-CG 3.9Å; W635-L648 HydrophobicContact CH2-CD1 3.49Å; W635-L648 VanDerWaalsContact CH2-CD1 3.49Å; W635-L648 HydrophobicContact CZ2-CD1 4.01Å; W635-L648 HydrophobicContact CZ3-CD1 4.05Å; W635-M661 HydrophobicContact CD2-CE 4.26Å; W635-M661 HydrophobicContact CD2-CG 4.35Å; W635-M661 HydrophobicContact CD2-SD 4.13Å; W635-M661 HydrophobicContact CE3-CE 4.47Å; W635-M661 HydrophobicContact CG-CG 4.24Å; W635-M661 HydrophobicContact CG-SD 4.05Å; W635-M661 HydrophobicContact CZ2-CE 4.28Å; W635-M661 HydrophobicContact CZ2-CG 4.47Å; W635-M661 VanDerWaalsContact NE1-CG 3.29Å; W635-K665 HydrophobicContact CZ2-CB 4.48Å; W635-K665 HydrophobicContact CZ2-CG 3.83Å; W635-K665 WeakPolarHBondContact O-CE 3.48Å; W635-K665 PolarHBondContact O-NZ 3.01Å
636	D	85.3	Confident	87.7	Confident	88 Å²	88	55.4 Å²	55.4	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-36.9	-174.7	-70.4	-28	0	0	0	113.2	S632 N633 K665	S632-D636 PolarHBondContact O-N 3.39Å; S632-D636 VanDerWaalsContact O-N 3.1Å; N633-D636 PolarHBondContact O-N 3.12Å; D636-K665 VanDerWaalsContact C-NZ 3.32Å; D636-K665 PolarHBondContact O-NZ 3.48Å
637	T	86.4	Confident	87.8	Confident	119 Å²	119	54.8 Å²	54.8	73%	0.73	30%	0.296	S	S	*	.	H	α-helix	trans	-79.8	-16.7	176.8	59.9	0	0	0	0	115	N633 A634 W635	N633-T637 WeakPolarHBondContact O-CB 3.39Å; N633-T637 VanDerWaalsContact O-CG2 3.3Å; N633-T637 WeakPolarHBondContact O-CG2 3.29Å; N633-T637 PolarHBondContact O-N 3.09Å; N633-T637 PolarHBondContact O-OG1 2.97Å; A634-T637 PolarHBondContact O-OG1 3.22Å; W635-T637 VanDerWaalsContact C-N 3.29Å; W635-T637 PolarHBondContact O-N 3.32Å
638	S	88.4	Confident	88	Confident	34 Å²	34	48.4 Å²	48.4	24%	0.238	27%	0.271	C	S	.	.	S	Bend	trans	-67.3	150.8	-179.6	79.7	0	0	0	0	112.1	A634 W635 K665	A634-S638 WeakPolarHBondContact O-CB 3.37Å; A634-S638 PolarHBondContact O-N 3.35Å; A634-S638 VanDerWaalsContact O-N 3.11Å; W635-S638 PolarHBondContact O-N 3.46Å; W635-S638 VanDerWaalsContact O-N 3.07Å; W635-S638 PolarHBondContact O-OG 3.09Å; S638-K665 PolarHBondContact O-NZ 3.38Å
639	G	87.3	Confident	88.3	Confident	64 Å²	64	47.5 Å²	47.5	66%	0.66	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-55.5	156.8	164.5	0	0	0	0	0	111.4	D641	G639-D641 PolarHBondContact O-N 2.86Å
640	L	87.3	Confident	88.3	Confident	63 Å²	63	47.4 Å²	47.4	33%	0.33	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-72.5	117.2	176.7	175.3	65.8	0	0	0	110.2	V642 K665 L669	L640-V642 HydrophobicContact CD2-CG2 4.16Å; L640-V642 HydrophobicContact CG-CG2 4.19Å; L640-K665 HydrophobicContact CD1-CB 3.96Å; L640-L669 HydrophobicContact CD2-CD2 3.35Å; L640-L669 HydrophobicContact CD2-CG 3.59Å
641	D	91.4	Very high	88.4	Confident	82 Å²	82	41.9 Å²	41.9	44%	0.439	24%	0.238	S	C	.	.			trans	-106.3	109	163.1	-178	-26	0	0	0	108.1	G639 G643 L644 A645	G639-D641 PolarHBondContact O-N 2.86Å; D641-G643 PolarHBondContact OD1-N 3.25Å; D641-L644 HydrophobicContact CB-CB 3.81Å; D641-L644 HydrophobicContact CB-CD2 4.47Å; D641-L644 PolarHBondContact O-N 2.97Å; D641-L644 PolarHBondContact OD1-N 3.41Å; D641-A645 PolarHBondContact O-N 3.05Å; D641-A645 VanDerWaalsContact O-N 3.07Å
642	V	91.5	Very high	88.7	Confident	22 Å²	22	37 Å²	37	13%	0.133	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-40.6	-177.5	-177.9	0	0	0	0	111.1	L640 L644 A645 M646 L669 Y677	L640-V642 HydrophobicContact CD2-CG2 4.16Å; L640-V642 HydrophobicContact CG-CG2 4.19Å; V642-L644 VanDerWaalsContact C-N 3.33Å; V642-L644 PolarHBondContact O-N 2.91Å; V642-A645 PolarHBondContact O-N 3.36Å; V642-M646 HydrophobicContact CG1-CG 4.03Å; V642-M646 HydrophobicContact CG1-SD 3.65Å; V642-M646 WeakPolarHBondContact O-CB 3.35Å; V642-M646 WeakPolarHBondContact O-CG 3.39Å; V642-M646 PolarHBondContact O-N 3.18Å; V642-L669 HydrophobicContact CG2-CD2 3.84Å; V642-Y677 HydrophobicContact CB-CE2 4.4Å; V642-Y677 HydrophobicContact CG1-CD1 4.34Å; V642-Y677 HydrophobicContact CG1-CD2 3.88Å; V642-Y677 HydrophobicContact CG1-CE1 4.19Å; V642-Y677 HydrophobicContact CG1-CE2 3.75Å; V642-Y677 HydrophobicContact CG1-CG 4.19Å; V642-Y677 HydrophobicContact CG2-CE2 4.24Å
643	G	90.6	Very high	89.3	Confident	5 Å²	5	37.8 Å²	37.8	5%	0.052	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-43.3	179.9	0	0	0	0	0	111.4	D641 M646 Q647	D641-G643 PolarHBondContact OD1-N 3.25Å; G643-M646 PolarHBondContact O-N 2.78Å; G643-Q647 WeakPolarHBondContact O-CB 3.4Å; G643-Q647 PolarHBondContact O-N 3.24Å
644	L	92.1	Very high	89.9	Confident	17 Å²	17	32.3 Å²	32.3	9%	0.089	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-45.9	176.5	-168.6	80.5	0	0	0	112.2	P604 P608 W635 D641 V642 Q647 L648	P604-L644 HydrophobicContact CB-CD2 4.02Å; P608-L644 HydrophobicContact CG-CD1 3.73Å; W635-L644 HydrophobicContact CE3-CD2 4.23Å; W635-L644 HydrophobicContact CH2-CD2 3.61Å; W635-L644 HydrophobicContact CH2-CG 3.93Å; W635-L644 HydrophobicContact CZ3-CD2 3.28Å; W635-L644 HydrophobicContact CZ3-CG 3.9Å; D641-L644 HydrophobicContact CB-CB 3.81Å; D641-L644 HydrophobicContact CB-CD2 4.47Å; D641-L644 PolarHBondContact O-N 2.97Å; D641-L644 PolarHBondContact OD1-N 3.41Å; V642-L644 VanDerWaalsContact C-N 3.33Å; V642-L644 PolarHBondContact O-N 2.91Å; L644-Q647 PolarHBondContact O-N 2.63Å; L644-L648 PolarHBondContact O-N 3.41Å
645	A	94.3	Very high	90.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-42.1	178.4	0	0	0	0	0	111.8	D641 V642 Q647 L648 A662 L666	D641-A645 PolarHBondContact O-N 3.05Å; D641-A645 VanDerWaalsContact O-N 3.07Å; V642-A645 PolarHBondContact O-N 3.36Å; A645-Q647 VanDerWaalsContact C-N 3.35Å; A645-L648 PolarHBondContact O-N 3.47Å; A645-A662 WeakPolarHBondContact O-CB 3.43Å; A645-L666 HydrophobicContact CB-CD2 3.8Å; A645-L666 HydrophobicContact CB-CG 4.13Å
646	M	92.8	Very high	90.7	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-35.8	176.8	-71.4	-176	79.8	0	0	112.4	V642 G643 L648 L649 D650 Y677 Q680 I1047 L1048 M1051	V642-M646 HydrophobicContact CG1-CG 4.03Å; V642-M646 HydrophobicContact CG1-SD 3.65Å; V642-M646 WeakPolarHBondContact O-CB 3.35Å; V642-M646 WeakPolarHBondContact O-CG 3.39Å; V642-M646 PolarHBondContact O-N 3.18Å; G643-M646 PolarHBondContact O-N 2.78Å; M646-L648 VanDerWaalsContact C-N 3.28Å; M646-L648 PolarHBondContact O-N 2.98Å; M646-L649 WeakPolarHBondContact O-CA 3.33Å; M646-L649 WeakPolarHBondContact O-CB 3.31Å; M646-L649 PolarHBondContact O-N 3.09Å; M646-D650 PolarHBondContact O-N 3.25Å; M646-Y677 HydrophobicContact SD-CD1 4.02Å; M646-Y677 HydrophobicContact SD-CG 4.29Å; M646-Q680 HydrophobicContact CE-CB 3.28Å; M646-Q680 HydrophobicContact CE-CG 3.94Å; M646-I1047 HydrophobicContact CB-CG2 3.76Å; M646-L1048 HydrophobicContact CE-CD2 3.58Å; M646-L1048 HydrophobicContact SD-CD2 3.83Å; M646-M1051 HydrophobicContact CB-SD 3.93Å; M646-M1051 HydrophobicContact CE-CE 4.18Å; M646-M1051 HydrophobicContact CE-SD 3.82Å
647	Q	92.8	Very high	91	Very high	17 Å²	17	32.3 Å²	32.3	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-42.6	174.9	-174	173.9	11.4	0	0	111.5	P608 G643 L644 A645 L649 D650 Y653 I1047	P608-Q647 HydrophobicContact CB-CG 4.19Å; P608-Q647 HydrophobicContact CG-CG 4.38Å; G643-Q647 WeakPolarHBondContact O-CB 3.4Å; G643-Q647 PolarHBondContact O-N 3.24Å; L644-Q647 PolarHBondContact O-N 2.63Å; A645-Q647 VanDerWaalsContact C-N 3.35Å; Q647-L649 PolarHBondContact O-N 2.96Å; Q647-D650 WeakPolarHBondContact O-CB 3.32Å; Q647-D650 PolarHBondContact O-N 3.32Å; Q647-D650 VanDerWaalsContact O-N 3.15Å; Q647-Y653 HydrophobicContact CG-CE2 4.35Å; Q647-Y653 VanDerWaalsContact O-CD2 3.26Å; Q647-Y653 WeakPolarHBondContact O-CD2 3.29Å; Q647-Y653 WeakPolarHBondContact O-CE2 3.45Å; Q647-I1047 HydrophobicContact CB-CD1 3.94Å; Q647-I1047 HydrophobicContact CB-CG1 4.04Å; Q647-I1047 HydrophobicContact CB-CG2 4.5Å; Q647-I1047 HydrophobicContact CG-CD1 3.78Å; Q647-I1047 HydrophobicContact CG-CG1 4.4Å
648	L	94.6	Very high	91.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.6	178.2	-63.7	-176.9	0	0	0	113.9	P608 L611 W635 L644 A645 M646 Y653 V658 M661 A662	P608-L648 HydrophobicContact CB-CD2 4.2Å; P608-L648 HydrophobicContact CG-CD2 4Å; L611-L648 HydrophobicContact CD1-CD2 3.76Å; W635-L648 HydrophobicContact CH2-CD1 3.49Å; W635-L648 VanDerWaalsContact CH2-CD1 3.49Å; W635-L648 HydrophobicContact CZ2-CD1 4.01Å; W635-L648 HydrophobicContact CZ3-CD1 4.05Å; L644-L648 PolarHBondContact O-N 3.41Å; A645-L648 PolarHBondContact O-N 3.47Å; M646-L648 VanDerWaalsContact C-N 3.28Å; M646-L648 PolarHBondContact O-N 2.98Å; L648-Y653 HydrophobicContact CD2-CD1 4.36Å; L648-Y653 HydrophobicContact CD2-CD2 4.4Å; L648-Y653 HydrophobicContact CD2-CE1 4.08Å; L648-Y653 HydrophobicContact CD2-CE2 4.14Å; L648-V658 HydrophobicContact CB-CG1 4.34Å; L648-V658 HydrophobicContact CD2-CG1 4.23Å; L648-M661 HydrophobicContact CD1-CE 3.55Å; L648-A662 HydrophobicContact CB-CB 3.78Å; L648-A662 HydrophobicContact CD1-CB 4.43Å
649	L	94.5	Very high	91.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	0.2	174	-64.2	179.8	0	0	0	113.4	M646 Q647 R659 A662 V663 L666 L681 A684 F687 L695	M646-L649 WeakPolarHBondContact O-CA 3.33Å; M646-L649 WeakPolarHBondContact O-CB 3.31Å; M646-L649 PolarHBondContact O-N 3.09Å; Q647-L649 PolarHBondContact O-N 2.96Å; L649-R659 HydrophobicContact CD2-CB 4.08Å; L649-R659 HydrophobicContact CD2-CG 4.45Å; L649-R659 PolarHBondContact O-NH1 3.27Å; L649-R659 PolarHBondContact O-NH2 3.17Å; L649-A662 HydrophobicContact CD2-CB 3.96Å; L649-A662 HydrophobicContact CG-CB 4.01Å; L649-V663 HydrophobicContact CD2-CG2 4.11Å; L649-L666 HydrophobicContact CD1-CD1 3.5Å; L649-L666 VanDerWaalsContact CD1-CD1 3.5Å; L649-L681 HydrophobicContact CD1-CD2 4.34Å; L649-A684 HydrophobicContact CB-CB 4.45Å; L649-F687 WeakPolarHBondContact O-CD2 3.26Å; L649-L695 HydrophobicContact CD1-CD1 4.2Å
650	D	89.4	Confident	92.2	Very high	7 Å²	7	24 Å²	24	4%	0.037	13%	0.134	C	C	.	.	S	Bend	trans	-72	-175.2	177.2	83.6	6	0	0	0	112.7	M646 Q647 H652 Y653 R659 M1051	M646-D650 PolarHBondContact O-N 3.25Å; Q647-D650 WeakPolarHBondContact O-CB 3.32Å; Q647-D650 PolarHBondContact O-N 3.32Å; Q647-D650 VanDerWaalsContact O-N 3.15Å; D650-H652 VanDerWaalsContact C-N 3.32Å; D650-H652 VanDerWaalsContact CG-ND1 3.31Å; D650-H652 PolarHBondContact O-N 3.42Å; D650-H652 WeakPolarHBondContact OD1-CA 3.29Å; D650-H652 VanDerWaalsContact OD1-CB 3.28Å; D650-H652 WeakPolarHBondContact OD1-CB 3.29Å; D650-H652 IonicContact OD1-CG 3.9Å; D650-H652 PolarHBondContact OD1-N 3.42Å; D650-H652 IonicContact OD1-ND1 2.69Å; D650-H652 PolarHBondContact OD1-ND1 3.16Å; D650-H652 IonicContact OD2-CE1 3.55Å; D650-H652 IonicContact OD2-CG 2.7Å; D650-H652 IonicContact OD2-ND1 3.46Å; D650-H652 PolarHBondContact OD2-ND1 3.37Å; D650-Y653 WeakPolarHBondContact OD1-CD2 3.49Å; D650-Y653 WeakPolarHBondContact OD1-CE2 3.47Å; D650-R659 PolarHBondContact O-NH1 3.03Å; D650-M1051 HydrophobicContact CB-CG 4.29Å
651	C	86.3	Confident	92.5	Very high	10 Å²	10	21 Å²	21	7%	0.068	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-9.2	-177.6	53.3	0	0	0	0	115.5	G392 Q393 L511 Y653 F687 M1054	G392-C651 CarbonylContact C-O 3.57Å; G392-C651 WeakPolarHBondContact CA-O 3.48Å; Q393-C651 PolarHBondContact NE2-SG 2.9Å; L511-C651 HydrophobicContact CD1-CB 3.58Å; C651-Y653 VanDerWaalsContact C-N 3.34Å; C651-F687 HydrophobicContact CB-CD1 3.63Å; C651-F687 HydrophobicContact CB-CE1 3.83Å; C651-F687 HydrophobicContact CB-CG 4.05Å; C651-F687 HydrophobicContact CB-CZ 4.43Å; C651-M1054 HydrophobicContact CB-CE 4.12Å
652	H	87.4	Confident	92.7	Very high	93 Å²	93	17.1 Å²	17.1	43%	0.431	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-26.1	176.2	-59.2	95.3	0	0	0	111.8	Q393 D650	Q393-H652 PolarHBondContact OE1-NE2 2.81Å; D650-H652 VanDerWaalsContact C-N 3.32Å; D650-H652 VanDerWaalsContact CG-ND1 3.31Å; D650-H652 PolarHBondContact O-N 3.42Å; D650-H652 WeakPolarHBondContact OD1-CA 3.29Å; D650-H652 VanDerWaalsContact OD1-CB 3.28Å; D650-H652 WeakPolarHBondContact OD1-CB 3.29Å; D650-H652 IonicContact OD1-CG 3.9Å; D650-H652 PolarHBondContact OD1-N 3.42Å; D650-H652 IonicContact OD1-ND1 2.69Å; D650-H652 PolarHBondContact OD1-ND1 3.16Å; D650-H652 IonicContact OD2-CE1 3.55Å; D650-H652 IonicContact OD2-CG 2.7Å; D650-H652 IonicContact OD2-ND1 3.46Å; D650-H652 PolarHBondContact OD2-ND1 3.37Å
653	Y	91.8	Very high	92.9	Very high	18 Å²	18	16.3 Å²	16.3	7%	0.071	9%	0.093	C	C	.	.			trans	-110.7	107.2	-175.3	-49.6	-81.4	0	0	0	111.5	P608 L611 Q647 L648 D650 C651 V658 R659	P608-Y653 VanDerWaalsContact CA-OH 3.31Å; P608-Y653 WeakPolarHBondContact CA-OH 3.42Å; P608-Y653 VanDerWaalsContact CB-OH 3.3Å; P608-Y653 WeakPolarHBondContact CB-OH 3.45Å; P608-Y653 PolarHBondContact O-OH 3.39Å; L611-Y653 HydrophobicContact CB-CD1 4.13Å; L611-Y653 HydrophobicContact CB-CE1 3.69Å; Q647-Y653 HydrophobicContact CG-CE2 4.35Å; Q647-Y653 VanDerWaalsContact O-CD2 3.26Å; Q647-Y653 WeakPolarHBondContact O-CD2 3.29Å; Q647-Y653 WeakPolarHBondContact O-CE2 3.45Å; L648-Y653 HydrophobicContact CD2-CD1 4.36Å; L648-Y653 HydrophobicContact CD2-CD2 4.4Å; L648-Y653 HydrophobicContact CD2-CE1 4.08Å; L648-Y653 HydrophobicContact CD2-CE2 4.14Å; D650-Y653 WeakPolarHBondContact OD1-CD2 3.49Å; D650-Y653 WeakPolarHBondContact OD1-CE2 3.47Å; C651-Y653 VanDerWaalsContact C-N 3.34Å; Y653-V658 HydrophobicContact CD1-CG1 4.19Å; Y653-V658 HydrophobicContact CG-CG1 4.3Å; Y653-R659 WeakPolarHBondContact O-CD 3.43Å; Y653-R659 PolarHBondContact O-NH1 3.45Å
654	S	93.1	Very high	93.1	Very high	6 Å²	6	22.3 Å²	22.3	4%	0.042	11%	0.114	C	C	.	.			trans	-101.1	-11.1	174.3	-65.1	0	0	0	0	114.3	G392 A656 P689	G392-S654 WeakPolarHBondContact CA-OG 3.37Å; G392-S654 PolarHBondContact N-OG 2.77Å; S654-A656 PolarHBondContact O-N 2.93Å; S654-P689 WeakPolarHBondContact O-CG 3.13Å
655	D	95.1	Very high	93.1	Very high	8 Å²	8	22.4 Å²	22.4	4%	0.043	11%	0.114	C	C	.	.			trans	-69.3	128.9	-177.7	179.4	-88.1	0	0	0	111.6	W616 H626 Q657 V658 R659	W616-D655 HydrophobicContact CE3-CB 4.44Å; W616-D655 HydrophobicContact CH2-CB 3.64Å; W616-D655 HydrophobicContact CZ2-CB 4.44Å; W616-D655 HydrophobicContact CZ3-CB 3.64Å; H626-D655 IonicContact CD2-OD2 2.68Å; H626-D655 IonicContact CE1-OD2 3.61Å; H626-D655 IonicContact NE2-OD1 3.26Å; H626-D655 IonicContact NE2-OD2 3.6Å; H626-D655 PolarHBondContact NE2-OD2 3.03Å; D655-Q657 VanDerWaalsContact C-N 3.33Å; D655-Q657 PolarHBondContact O-N 3.4Å; D655-Q657 WeakPolarHBondContact OD1-CA 3.49Å; D655-Q657 WeakPolarHBondContact OD1-CB 3.43Å; D655-Q657 PolarHBondContact OD1-N 2.93Å; D655-V658 HydrophobicContact CB-CB 4.28Å; D655-V658 HydrophobicContact CB-CG2 4.04Å; D655-V658 PolarHBondContact O-N 3.04Å; D655-V658 PolarHBondContact OD1-N 2.92Å; D655-R659 WeakPolarHBondContact O-CG 3.37Å; D655-R659 PolarHBondContact O-N 3.42Å; D655-R659 VanDerWaalsContact O-N 3.11Å
656	A	92.1	Very high	93.2	Very high	50 Å²	50	22.4 Å²	22.4	41%	0.413	11%	0.113	S	C	.	.	H	α-helix	trans	-66.4	-29.9	-174.2	0	0	0	0	0	113.7	S654 S660	S654-A656 PolarHBondContact O-N 2.93Å; A656-S660 VanDerWaalsContact O-CB 3.23Å; A656-S660 WeakPolarHBondContact O-CB 3.47Å; A656-S660 PolarHBondContact O-N 3.07Å; A656-S660 PolarHBondContact O-OG 3.39Å
657	Q	92.3	Very high	93.2	Very high	61 Å²	61	25.6 Å²	25.6	29%	0.285	13%	0.128	S	C	.	.	H	α-helix	trans	-74.5	-42.4	178.4	-63	-169.4	1.5	0	0	111.2	H626 L629 D655 R659 S660 M661	H626-Q657 VanDerWaalsContact CD2-CD 3.44Å; H626-Q657 PolarHBondContact CD2-OE1 3.48Å; H626-Q657 VanDerWaalsContact CG-CD 3.49Å; L629-Q657 HydrophobicContact CD1-CB 4.45Å; D655-Q657 VanDerWaalsContact C-N 3.33Å; D655-Q657 PolarHBondContact O-N 3.4Å; D655-Q657 WeakPolarHBondContact OD1-CA 3.49Å; D655-Q657 WeakPolarHBondContact OD1-CB 3.43Å; D655-Q657 PolarHBondContact OD1-N 2.93Å; Q657-R659 PolarHBondContact O-N 3.38Å; Q657-S660 PolarHBondContact O-N 3.31Å; Q657-M661 WeakPolarHBondContact O-CB 2.72Å; Q657-M661 PolarHBondContact O-N 3.49Å
658	V	95.2	Very high	93.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-56.3	-50.9	173.7	172.9	0	0	0	0	110.5	L611 W616 L629 L648 Y653 D655 S660 M661 A662	L611-V658 HydrophobicContact CD1-CB 4.49Å; L611-V658 HydrophobicContact CD1-CG1 3.71Å; L611-V658 HydrophobicContact CD1-CG2 3.97Å; L611-V658 HydrophobicContact CD2-CG2 3.8Å; L611-V658 HydrophobicContact CG-CG2 4.47Å; W616-V658 HydrophobicContact CH2-CG2 4.11Å; L629-V658 HydrophobicContact CD1-CG2 3.8Å; L648-V658 HydrophobicContact CB-CG1 4.34Å; L648-V658 HydrophobicContact CD2-CG1 4.23Å; Y653-V658 HydrophobicContact CD1-CG1 4.19Å; Y653-V658 HydrophobicContact CG-CG1 4.3Å; D655-V658 HydrophobicContact CB-CB 4.28Å; D655-V658 HydrophobicContact CB-CG2 4.04Å; D655-V658 PolarHBondContact O-N 3.04Å; D655-V658 PolarHBondContact OD1-N 2.92Å; V658-S660 PolarHBondContact O-N 3.09Å; V658-M661 WeakPolarHBondContact O-CB 3.1Å; V658-M661 PolarHBondContact O-N 3.44Å; V658-A662 PolarHBondContact O-N 3.22Å; V658-A662 VanDerWaalsContact O-N 3.16Å
659	R	96.1	Very high	93.2	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.011	15%	0.154	C	C	.	.	H	α-helix	trans	-66.1	-39.1	-178.9	-62.3	-177.6	75	76.7	8.1	112	L649 D650 Y653 D655 Q657 M661 A662 V663 E688	L649-R659 HydrophobicContact CD2-CB 4.08Å; L649-R659 HydrophobicContact CD2-CG 4.45Å; L649-R659 PolarHBondContact O-NH1 3.27Å; L649-R659 PolarHBondContact O-NH2 3.17Å; D650-R659 PolarHBondContact O-NH1 3.03Å; Y653-R659 WeakPolarHBondContact O-CD 3.43Å; Y653-R659 PolarHBondContact O-NH1 3.45Å; D655-R659 WeakPolarHBondContact O-CG 3.37Å; D655-R659 PolarHBondContact O-N 3.42Å; D655-R659 VanDerWaalsContact O-N 3.11Å; Q657-R659 PolarHBondContact O-N 3.38Å; R659-M661 VanDerWaalsContact C-N 3.34Å; R659-M661 PolarHBondContact O-N 2.82Å; R659-A662 WeakPolarHBondContact O-CB 3.35Å; R659-A662 PolarHBondContact O-N 3.42Å; R659-V663 WeakPolarHBondContact O-CG2 3.34Å; R659-V663 PolarHBondContact O-N 2.68Å; R659-E688 IonicContact CZ-OE1 2.75Å; R659-E688 VanDerWaalsContact CZ-OE1 3.23Å; R659-E688 IonicContact NE-OE1 2.74Å; R659-E688 PolarHBondContact NE-OE1 3.08Å; R659-E688 IonicContact NE-OE2 3.33Å; R659-E688 PolarHBondContact NE-OE2 3.24Å; R659-E688 IonicContact NH2-OE1 3.14Å; R659-E688 PolarHBondContact NH2-OE1 3.43Å
660	S	94.7	Very high	93.1	Very high	39 Å²	39	31.8 Å²	31.8	27%	0.273	16%	0.164	S	C	.	.	H	α-helix	trans	-64.3	-37.9	175.9	-62.2	0	0	0	0	112.4	A656 Q657 V658 A662 V663 R664	A656-S660 VanDerWaalsContact O-CB 3.23Å; A656-S660 WeakPolarHBondContact O-CB 3.47Å; A656-S660 PolarHBondContact O-N 3.07Å; A656-S660 PolarHBondContact O-OG 3.39Å; Q657-S660 PolarHBondContact O-N 3.31Å; V658-S660 PolarHBondContact O-N 3.09Å; S660-A662 VanDerWaalsContact C-N 3.34Å; S660-V663 PolarHBondContact O-N 3.02Å; S660-R664 WeakPolarHBondContact O-CG 3.45Å; S660-R664 PolarHBondContact O-N 2.99Å
661	M	93.9	Very high	93.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.8	-40.4	175	176.1	-172.6	73.8	0	0	111.9	Y607 L629 W635 L648 Q657 V658 R659 R664 K665	Y607-M661 HydrophobicContact CD2-CE 3.96Å; Y607-M661 HydrophobicContact CD2-SD 4.33Å; Y607-M661 HydrophobicContact CE2-SD 4.3Å; L629-M661 HydrophobicContact CD2-CE 4.22Å; L629-M661 HydrophobicContact CD2-SD 3.86Å; W635-M661 HydrophobicContact CD2-CE 4.26Å; W635-M661 HydrophobicContact CD2-CG 4.35Å; W635-M661 HydrophobicContact CD2-SD 4.13Å; W635-M661 HydrophobicContact CE3-CE 4.47Å; W635-M661 HydrophobicContact CG-CG 4.24Å; W635-M661 HydrophobicContact CG-SD 4.05Å; W635-M661 HydrophobicContact CZ2-CE 4.28Å; W635-M661 HydrophobicContact CZ2-CG 4.47Å; W635-M661 VanDerWaalsContact NE1-CG 3.29Å; L648-M661 HydrophobicContact CD1-CE 3.55Å; Q657-M661 WeakPolarHBondContact O-CB 2.72Å; Q657-M661 PolarHBondContact O-N 3.49Å; V658-M661 WeakPolarHBondContact O-CB 3.1Å; V658-M661 PolarHBondContact O-N 3.44Å; R659-M661 VanDerWaalsContact C-N 3.34Å; R659-M661 PolarHBondContact O-N 2.82Å; M661-R664 PolarHBondContact O-N 3.47Å; M661-K665 PolarHBondContact O-N 2.92Å
662	A	95.6	Very high	93.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-47.1	173.6	0	0	0	0	0	111.8	A645 L648 L649 V658 R659 S660 R664 K665 L666	A645-A662 WeakPolarHBondContact O-CB 3.43Å; L648-A662 HydrophobicContact CB-CB 3.78Å; L648-A662 HydrophobicContact CD1-CB 4.43Å; L649-A662 HydrophobicContact CD2-CB 3.96Å; L649-A662 HydrophobicContact CG-CB 4.01Å; V658-A662 PolarHBondContact O-N 3.22Å; V658-A662 VanDerWaalsContact O-N 3.16Å; R659-A662 WeakPolarHBondContact O-CB 3.35Å; R659-A662 PolarHBondContact O-N 3.42Å; S660-A662 VanDerWaalsContact C-N 3.34Å; A662-R664 VanDerWaalsContact C-N 3.33Å; A662-R664 PolarHBondContact O-N 3.27Å; A662-K665 WeakPolarHBondContact O-CB 3.18Å; A662-K665 PolarHBondContact O-N 3.47Å; A662-K665 VanDerWaalsContact O-N 3.07Å; A662-L666 PolarHBondContact O-N 3.05Å; A662-L666 VanDerWaalsContact O-N 3.12Å
663	V	96.9	Very high	93.8	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.036	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-39.7	177.5	175.1	0	0	0	0	111.9	L649 R659 S660 K665 L666 E667 A694 L695 F698	L649-V663 HydrophobicContact CD2-CG2 4.11Å; R659-V663 WeakPolarHBondContact O-CG2 3.34Å; R659-V663 PolarHBondContact O-N 2.68Å; S660-V663 PolarHBondContact O-N 3.02Å; V663-K665 PolarHBondContact O-N 3.35Å; V663-L666 CarbonylContact O-C 3.55Å; V663-L666 WeakPolarHBondContact O-CA 3.48Å; V663-L666 PolarHBondContact O-N 3.18Å; V663-E667 WeakPolarHBondContact O-CG 3.49Å; V663-E667 PolarHBondContact O-N 2.98Å; V663-A694 HydrophobicContact CB-CB 4.06Å; V663-A694 HydrophobicContact CG1-CB 4.15Å; V663-A694 HydrophobicContact CG2-CB 4.04Å; V663-L695 HydrophobicContact CG2-CB 3.98Å; V663-L695 HydrophobicContact CG2-CD1 4.46Å; V663-F698 HydrophobicContact CG1-CB 3.64Å; V663-F698 HydrophobicContact CG1-CD2 4.48Å; V663-F698 HydrophobicContact CG1-CG 4.11Å
664	R	93.9	Very high	94	Very high	130 Å²	130	30.3 Å²	30.3	49%	0.491	16%	0.16	S	C	.	.	H	α-helix	trans	-57.5	-32.5	175.1	-76.5	-166.6	-58.5	-105.2	6.5	112.8	S660 M661 A662	S660-R664 WeakPolarHBondContact O-CG 3.45Å; S660-R664 PolarHBondContact O-N 2.99Å; M661-R664 PolarHBondContact O-N 3.47Å; A662-R664 VanDerWaalsContact C-N 3.33Å; A662-R664 PolarHBondContact O-N 3.27Å
665	K	93.2	Very high	94	Very high	20 Å²	20	31.6 Å²	31.6	9%	0.087	17%	0.166	C	C	.	.	H	α-helix	trans	-73.2	-42.5	172.1	-77.3	-65.5	-173.1	176.5	0	112.2	W635 D636 S638 L640 M661 A662 V663 E667 T668	W635-K665 HydrophobicContact CZ2-CB 4.48Å; W635-K665 HydrophobicContact CZ2-CG 3.83Å; W635-K665 WeakPolarHBondContact O-CE 3.48Å; W635-K665 PolarHBondContact O-NZ 3.01Å; D636-K665 VanDerWaalsContact C-NZ 3.32Å; D636-K665 PolarHBondContact O-NZ 3.48Å; S638-K665 PolarHBondContact O-NZ 3.38Å; L640-K665 HydrophobicContact CD1-CB 3.96Å; M661-K665 PolarHBondContact O-N 2.92Å; A662-K665 WeakPolarHBondContact O-CB 3.18Å; A662-K665 PolarHBondContact O-N 3.47Å; A662-K665 VanDerWaalsContact O-N 3.07Å; V663-K665 PolarHBondContact O-N 3.35Å; K665-E667 PolarHBondContact O-N 3.49Å; K665-T668 WeakPolarHBondContact O-CB 3.11Å; K665-T668 PolarHBondContact O-N 3.11Å; K665-T668 PolarHBondContact O-OG1 3.35Å
666	L	95.3	Very high	93.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-24.5	177.1	-61.3	175.8	0	0	0	113.3	A645 L649 A662 V663 T668 L669 L681 F698	A645-L666 HydrophobicContact CB-CD2 3.8Å; A645-L666 HydrophobicContact CB-CG 4.13Å; L649-L666 HydrophobicContact CD1-CD1 3.5Å; L649-L666 VanDerWaalsContact CD1-CD1 3.5Å; A662-L666 PolarHBondContact O-N 3.05Å; A662-L666 VanDerWaalsContact O-N 3.12Å; V663-L666 CarbonylContact O-C 3.55Å; V663-L666 WeakPolarHBondContact O-CA 3.48Å; V663-L666 PolarHBondContact O-N 3.18Å; L666-T668 PolarHBondContact O-N 3.32Å; L666-T668 VanDerWaalsContact O-N 3.11Å; L666-L669 HydrophobicContact CB-CD1 4.18Å; L666-L669 HydrophobicContact CD2-CD1 3.57Å; L666-L669 HydrophobicContact CD2-CG 4.45Å; L666-L669 HydrophobicContact CG-CD1 4.46Å; L666-L669 VanDerWaalsContact O-CB 3.24Å; L666-L669 WeakPolarHBondContact O-CB 3.26Å; L666-L669 PolarHBondContact O-N 3.42Å; L666-L681 HydrophobicContact CD1-CD2 3.78Å; L666-F698 HydrophobicContact CB-CE1 4.46Å; L666-F698 HydrophobicContact CB-CE2 4.41Å; L666-F698 HydrophobicContact CB-CZ 4.12Å
667	E	94	Very high	93.9	Very high	67 Å²	67	32 Å²	32	31%	0.313	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-21.4	171	-72.9	-81.7	-174.5	0	0	113.2	V663 K665 F698 K701	V663-E667 WeakPolarHBondContact O-CG 3.49Å; V663-E667 PolarHBondContact O-N 2.98Å; K665-E667 PolarHBondContact O-N 3.49Å; E667-F698 HydrophobicContact CG-CD2 4.01Å; E667-F698 HydrophobicContact CG-CE2 4.42Å; E667-K701 IonicContact OE1-NZ 2.79Å; E667-K701 IonicContact OE2-NZ 3.81Å; E667-K701 PolarHBondContact OE2-NZ 2.97Å
668	T	93	Very high	94.1	Very high	93 Å²	93	29.1 Å²	29.1	57%	0.571	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.3	175.6	69.5	0	0	0	0	114	K665 L666	K665-T668 WeakPolarHBondContact O-CB 3.11Å; K665-T668 PolarHBondContact O-N 3.11Å; K665-T668 PolarHBondContact O-OG1 3.35Å; L666-T668 PolarHBondContact O-N 3.32Å; L666-T668 VanDerWaalsContact O-N 3.11Å
669	L	93.3	Very high	94	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.047	15%	0.145	C	C	.	.	S	Bend	trans	-64.1	142.4	176.9	-78.8	170.1	0	0	0	111.7	L640 V642 L666 D673 V674 R702	L640-L669 HydrophobicContact CD2-CD2 3.35Å; L640-L669 HydrophobicContact CD2-CG 3.59Å; V642-L669 HydrophobicContact CG2-CD2 3.84Å; L666-L669 HydrophobicContact CB-CD1 4.18Å; L666-L669 HydrophobicContact CD2-CD1 3.57Å; L666-L669 HydrophobicContact CD2-CG 4.45Å; L666-L669 HydrophobicContact CG-CD1 4.46Å; L666-L669 VanDerWaalsContact O-CB 3.24Å; L666-L669 WeakPolarHBondContact O-CB 3.26Å; L666-L669 PolarHBondContact O-N 3.42Å; L669-D673 HydrophobicContact CD2-CB 3.85Å; L669-V674 HydrophobicContact CB-CG2 3.7Å; L669-V674 HydrophobicContact CD1-CG2 4.18Å; L669-R702 PolarHBondContact O-NH1 3.35Å; L669-R702 PolarHBondContact O-NH2 2.93Å
670	E	92.8	Very high	93.8	Very high	46 Å²	46	29.4 Å²	29.4	22%	0.215	14%	0.144	C	C	.	.			trans	-75.4	158.3	170.7	-60.9	-174.5	178.6	0	0	111.5	R206 D672 D673 V674 R702	R206-E670 WeakPolarHBondContact CB-OE1 3.23Å; R206-E670 WeakPolarHBondContact CB-OE2 3.46Å; R206-E670 WeakPolarHBondContact CD-OE1 3.46Å; R206-E670 WeakPolarHBondContact CG-OE1 3.42Å; R206-E670 WeakPolarHBondContact CG-OE2 3.32Å; R206-E670 IonicContact CZ-OE1 3.6Å; R206-E670 PolarHBondContact N-OE2 3.35Å; R206-E670 VanDerWaalsContact N-OE2 3.1Å; R206-E670 IonicContact NE-OE1 2.84Å; R206-E670 PolarHBondContact NE-OE1 3.32Å; R206-E670 IonicContact NH1-OE1 3.68Å; E670-D672 VanDerWaalsContact C-N 3.27Å; E670-D672 PolarHBondContact O-N 3.39Å; E670-D673 PolarHBondContact O-N 3.19Å; E670-V674 WeakPolarHBondContact O-CG2 3.43Å; E670-V674 PolarHBondContact O-N 3.12Å; E670-R702 PolarHBondContact O-NH2 2.92Å
671	D	93.6	Very high	93.9	Very high	60 Å²	60	27.6 Å²	27.6	32%	0.321	13%	0.132	S	C	.	.	H	α-helix	trans	-61.9	-37.4	-176	-68.1	-35	0	0	0	112.2	D673 V674 L675 R702 I709	D671-D673 PolarHBondContact O-N 2.97Å; D671-V674 PolarHBondContact O-N 2.93Å; D671-L675 WeakPolarHBondContact O-CG 3.41Å; D671-L675 PolarHBondContact O-N 3.4Å; D671-R702 VanDerWaalsContact N-NH2 3.18Å; D671-R702 IonicContact OD1-CZ 3.07Å; D671-R702 VanDerWaalsContact OD1-CZ 3.28Å; D671-R702 IonicContact OD1-NE 3.17Å; D671-R702 PolarHBondContact OD1-NE 3.4Å; D671-R702 IonicContact OD1-NH2 2.98Å; D671-R702 PolarHBondContact OD1-NH2 2.94Å; D671-I709 HydrophobicContact CB-CD1 3.75Å; D671-I709 WeakPolarHBondContact OD1-CD1 3.23Å
672	D	91.1	Very high	94	Very high	9 Å²	9	27.6 Å²	27.6	5%	0.048	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-39.5	176.3	-168.9	58.4	0	0	0	112.4	W203 N293 E670 R676	W203-D672 PolarHBondContact NE1-OD1 3.05Å; N293-D672 PolarHBondContact ND2-OD1 3.46Å; E670-D672 VanDerWaalsContact C-N 3.27Å; E670-D672 PolarHBondContact O-N 3.39Å; D672-R676 VanDerWaalsContact CG-NH1 3.33Å; D672-R676 WeakPolarHBondContact O-CG 3.14Å; D672-R676 PolarHBondContact O-N 3.19Å; D672-R676 PolarHBondContact O-NH1 3.22Å; D672-R676 IonicContact OD1-NH2 3.67Å; D672-R676 IonicContact OD2-CZ 3.57Å; D672-R676 IonicContact OD2-NH1 2.65Å; D672-R676 PolarHBondContact OD2-NH1 3.27Å; D672-R676 IonicContact OD2-NH2 3.82Å; D672-R676 PolarHBondContact OD2-NH2 3.33Å
673	D	92.4	Very high	93.8	Very high	28 Å²	28	27.8 Å²	27.8	15%	0.15	13%	0.133	C	C	.	.	H	α-helix	trans	-76.1	-34.2	174	-70.8	-39.2	0	0	0	112.2	K207 L669 E670 D671 L675 R676 Y677	K207-D673 IonicContact NZ-OD1 2.87Å; K207-D673 PolarHBondContact NZ-OD1 3.46Å; K207-D673 IonicContact NZ-OD2 3.47Å; L669-D673 HydrophobicContact CD2-CB 3.85Å; E670-D673 PolarHBondContact O-N 3.19Å; D671-D673 PolarHBondContact O-N 2.97Å; D673-L675 VanDerWaalsContact C-N 3.3Å; D673-L675 PolarHBondContact O-N 2.93Å; D673-R676 WeakPolarHBondContact O-CB 3.27Å; D673-R676 PolarHBondContact O-N 3.29Å; D673-R676 VanDerWaalsContact O-N 3.15Å; D673-R676 IonicContact OD1-CZ 2.74Å; D673-R676 IonicContact OD1-NH1 3.56Å; D673-R676 PolarHBondContact OD1-NH1 3.29Å; D673-Y677 WeakPolarHBondContact O-CD2 3.35Å; D673-Y677 PolarHBondContact O-N 2.73Å
674	V	95.6	Very high	93.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-43.2	172.2	169.3	0	0	0	0	110.8	L669 E670 D671 R676 Y677 L678 F698 R702 I709	L669-V674 HydrophobicContact CB-CG2 3.7Å; L669-V674 HydrophobicContact CD1-CG2 4.18Å; E670-V674 WeakPolarHBondContact O-CG2 3.43Å; E670-V674 PolarHBondContact O-N 3.12Å; D671-V674 PolarHBondContact O-N 2.93Å; V674-R676 VanDerWaalsContact C-N 3.27Å; V674-R676 PolarHBondContact O-N 2.99Å; V674-Y677 CarbonylContact O-C 3.48Å; V674-Y677 PolarHBondContact O-N 3.41Å; V674-Y677 VanDerWaalsContact O-N 3.16Å; V674-L678 WeakPolarHBondContact O-CA 3.4Å; V674-L678 VanDerWaalsContact O-CB 3.31Å; V674-L678 WeakPolarHBondContact O-CB 3.21Å; V674-L678 PolarHBondContact O-N 2.93Å; V674-F698 HydrophobicContact CG2-CZ 4.01Å; V674-R702 VanDerWaalsContact CG2-CZ 3.41Å; V674-R702 VanDerWaalsContact CG2-NH2 3.26Å; V674-I709 HydrophobicContact CB-CD1 4.13Å; V674-I709 HydrophobicContact CG1-CD1 3.91Å; V674-I709 HydrophobicContact CG1-CG2 4.44Å
675	L	93.6	Very high	93.7	Very high	33 Å²	33	21.3 Å²	21.3	17%	0.173	11%	0.108	C	C	.	.	H	α-helix	trans	-56.3	-41.4	174.7	-75.3	170.6	0	0	0	112	D671 D673 Y677 L678 R708 I709 F712	D671-L675 WeakPolarHBondContact O-CG 3.41Å; D671-L675 PolarHBondContact O-N 3.4Å; D673-L675 VanDerWaalsContact C-N 3.3Å; D673-L675 PolarHBondContact O-N 2.93Å; L675-Y677 VanDerWaalsContact C-N 3.31Å; L675-Y677 PolarHBondContact O-N 3.35Å; L675-L678 HydrophobicContact CD2-CD2 4.46Å; L675-L678 PolarHBondContact O-N 2.88Å; L675-R708 HydrophobicContact CD1-CB 4.39Å; L675-R708 HydrophobicContact CD1-CG 3.9Å; L675-R708 HydrophobicContact CD2-CG 4.34Å; L675-I709 HydrophobicContact CD2-CB 4.35Å; L675-I709 HydrophobicContact CD2-CG1 3.74Å; L675-I709 HydrophobicContact CG-CG1 3.82Å; L675-F712 HydrophobicContact CD2-CD2 3.77Å; L675-F712 HydrophobicContact CD2-CE2 4.45Å
676	R	92.3	Very high	93.7	Very high	44 Å²	44	20.5 Å²	20.5	17%	0.166	10%	0.104	C	C	.	.	H	α-helix	trans	-62.1	-34.6	177.9	-69.4	179.8	-177.2	88	15.3	113.3	D672 D673 V674 Q864	D672-R676 VanDerWaalsContact CG-NH1 3.33Å; D672-R676 WeakPolarHBondContact O-CG 3.14Å; D672-R676 PolarHBondContact O-N 3.19Å; D672-R676 PolarHBondContact O-NH1 3.22Å; D672-R676 IonicContact OD1-NH2 3.67Å; D672-R676 IonicContact OD2-CZ 3.57Å; D672-R676 IonicContact OD2-NH1 2.65Å; D672-R676 PolarHBondContact OD2-NH1 3.27Å; D672-R676 IonicContact OD2-NH2 3.82Å; D672-R676 PolarHBondContact OD2-NH2 3.33Å; D673-R676 WeakPolarHBondContact O-CB 3.27Å; D673-R676 PolarHBondContact O-N 3.29Å; D673-R676 VanDerWaalsContact O-N 3.15Å; D673-R676 IonicContact OD1-CZ 2.74Å; D673-R676 IonicContact OD1-NH1 3.56Å; D673-R676 PolarHBondContact OD1-NH1 3.29Å; V674-R676 VanDerWaalsContact C-N 3.27Å; V674-R676 PolarHBondContact O-N 2.99Å; R676-Q864 WeakPolarHBondContact O-CG 3.04Å; R676-Q864 PolarHBondContact O-NE2 2.89Å
677	Y	94.5	Very high	93.6	Very high	22 Å²	22	20.8 Å²	20.8	9%	0.086	11%	0.105	C	C	.	.	H	α-helix	trans	-105.5	3.1	-177.8	-56.4	-67.8	0	0	0	114	V642 M646 D673 V674 L675 L679 Q680 L681 I868 L1044 L1048	V642-Y677 HydrophobicContact CB-CE2 4.4Å; V642-Y677 HydrophobicContact CG1-CD1 4.34Å; V642-Y677 HydrophobicContact CG1-CD2 3.88Å; V642-Y677 HydrophobicContact CG1-CE1 4.19Å; V642-Y677 HydrophobicContact CG1-CE2 3.75Å; V642-Y677 HydrophobicContact CG1-CG 4.19Å; V642-Y677 HydrophobicContact CG2-CE2 4.24Å; M646-Y677 HydrophobicContact SD-CD1 4.02Å; M646-Y677 HydrophobicContact SD-CG 4.29Å; D673-Y677 WeakPolarHBondContact O-CD2 3.35Å; D673-Y677 PolarHBondContact O-N 2.73Å; V674-Y677 CarbonylContact O-C 3.48Å; V674-Y677 PolarHBondContact O-N 3.41Å; V674-Y677 VanDerWaalsContact O-N 3.16Å; L675-Y677 VanDerWaalsContact C-N 3.31Å; L675-Y677 PolarHBondContact O-N 3.35Å; Y677-L679 VanDerWaalsContact C-N 3.29Å; Y677-L679 PolarHBondContact O-N 3.39Å; Y677-Q680 PolarHBondContact O-N 3.39Å; Y677-Q680 VanDerWaalsContact O-N 3.16Å; Y677-Q680 PolarHBondContact O-OE1 3.27Å; Y677-L681 WeakPolarHBondContact O-CG 3.46Å; Y677-L681 PolarHBondContact O-N 3.22Å; Y677-I868 HydrophobicContact CD1-CD1 3.94Å; Y677-I868 HydrophobicContact CE1-CD1 3.79Å; Y677-I868 HydrophobicContact CE1-CG1 4.2Å; Y677-L1044 HydrophobicContact CE1-CD1 4.15Å; Y677-L1044 HydrophobicContact CE1-CD2 4.48Å; Y677-L1048 HydrophobicContact CD1-CD2 3.92Å; Y677-L1048 HydrophobicContact CE1-CD1 4.44Å; Y677-L1048 HydrophobicContact CE1-CD2 4.26Å
678	L	96.1	Very high	93.6	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-39.1	-170	-176.8	60.8	0	0	0	112.3	V674 L675 L681 V682 L699 I709 F712 L713 F716	V674-L678 WeakPolarHBondContact O-CA 3.4Å; V674-L678 VanDerWaalsContact O-CB 3.31Å; V674-L678 WeakPolarHBondContact O-CB 3.21Å; V674-L678 PolarHBondContact O-N 2.93Å; L675-L678 HydrophobicContact CD2-CD2 4.46Å; L675-L678 PolarHBondContact O-N 2.88Å; L678-L681 PolarHBondContact O-N 3.03Å; L678-V682 HydrophobicContact CD1-CG2 4.32Å; L678-V682 HydrophobicContact CG-CG2 4.5Å; L678-V682 VanDerWaalsContact O-CG2 3.31Å; L678-V682 WeakPolarHBondContact O-CG2 3.33Å; L678-V682 PolarHBondContact O-N 2.88Å; L678-L699 HydrophobicContact CD1-CD2 3.82Å; L678-I709 HydrophobicContact CD1-CG2 4.44Å; L678-I709 HydrophobicContact CD2-CG2 4.35Å; L678-F712 HydrophobicContact CD2-CB 3.7Å; L678-L713 HydrophobicContact CD1-CD1 4.41Å; L678-F716 HydrophobicContact CB-CE2 4.03Å; L678-F716 HydrophobicContact CD2-CD2 4.12Å; L678-F716 HydrophobicContact CD2-CE2 3.89Å; L678-F716 HydrophobicContact CG-CD2 3.92Å; L678-F716 HydrophobicContact CG-CE2 3.83Å
679	L	93.4	Very high	93.6	Very high	9 Å²	9	14.3 Å²	14.3	5%	0.047	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-49.6	178.4	-173.8	62.5	0	0	0	111.1	Y677 L681 V682 Q683 F716 M860 L861 Q864 M1052	Y677-L679 VanDerWaalsContact C-N 3.29Å; Y677-L679 PolarHBondContact O-N 3.39Å; L679-L681 VanDerWaalsContact C-N 3.33Å; L679-L681 PolarHBondContact O-N 2.69Å; L679-V682 PolarHBondContact O-N 3.26Å; L679-Q683 VanDerWaalsContact O-CG 3.29Å; L679-Q683 WeakPolarHBondContact O-CG 3.41Å; L679-Q683 PolarHBondContact O-N 3.34Å; L679-F716 HydrophobicContact CB-CD2 4.5Å; L679-F716 HydrophobicContact CB-CE2 4.13Å; L679-F716 HydrophobicContact CD1-CD1 4.4Å; L679-F716 HydrophobicContact CD1-CD2 4.22Å; L679-F716 HydrophobicContact CD1-CE2 4.41Å; L679-F716 HydrophobicContact CD1-CG 4.22Å; L679-M860 HydrophobicContact CD1-CE 4.36Å; L679-M860 HydrophobicContact CD2-CB 4.46Å; L679-L861 HydrophobicContact CD2-CB 4.35Å; L679-Q864 VanDerWaalsContact CB-OE1 3.31Å; L679-M1052 HydrophobicContact CD2-CE 4.25Å; L679-M1052 HydrophobicContact CG-CE 4.4Å
680	Q	91.9	Very high	93.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.1	-37.5	179.3	-71.1	75.9	16	0	0	111.8	M646 Y677 Q683 A684 Q864 L1048 M1052	M646-Q680 HydrophobicContact CE-CB 3.28Å; M646-Q680 HydrophobicContact CE-CG 3.94Å; Y677-Q680 PolarHBondContact O-N 3.39Å; Y677-Q680 VanDerWaalsContact O-N 3.16Å; Y677-Q680 PolarHBondContact O-OE1 3.27Å; Q680-Q683 PolarHBondContact O-N 3.25Å; Q680-A684 WeakPolarHBondContact O-CB 3.48Å; Q680-A684 PolarHBondContact O-N 3.49Å; Q680-Q864 VanDerWaalsContact CD-OE1 3.28Å; Q680-Q864 VanDerWaalsContact OE1-CD 3.24Å; Q680-Q864 VanDerWaalsContact OE1-OE1 3.09Å; Q680-L1048 HydrophobicContact CB-CD2 4.44Å; Q680-L1048 HydrophobicContact CG-CD2 3.71Å; Q680-M1052 HydrophobicContact CG-CG 4.3Å; Q680-M1052 HydrophobicContact CG-SD 4.15Å
681	L	95.9	Very high	93.6	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-64.6	-40.3	176.4	-66.8	167	0	0	0	111.5	L649 L666 Y677 L678 L679 Q683 A684 V685 L695 F698 L699	L649-L681 HydrophobicContact CD1-CD2 4.34Å; L666-L681 HydrophobicContact CD1-CD2 3.78Å; Y677-L681 WeakPolarHBondContact O-CG 3.46Å; Y677-L681 PolarHBondContact O-N 3.22Å; L678-L681 PolarHBondContact O-N 3.03Å; L679-L681 VanDerWaalsContact C-N 3.33Å; L679-L681 PolarHBondContact O-N 2.69Å; L681-Q683 VanDerWaalsContact C-N 3.34Å; L681-A684 WeakPolarHBondContact O-CB 3.18Å; L681-A684 PolarHBondContact O-N 3.26Å; L681-V685 PolarHBondContact O-N 2.78Å; L681-L695 HydrophobicContact CD2-CD1 4.14Å; L681-F698 HydrophobicContact CD1-CE1 4.13Å; L681-L699 HydrophobicContact CB-CD2 3.98Å
682	V	95.4	Very high	93.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.3	-40.5	173	170	0	0	0	0	111.2	L678 L679 V685 L699 L713 F716 L717 Y731	L678-V682 HydrophobicContact CD1-CG2 4.32Å; L678-V682 HydrophobicContact CG-CG2 4.5Å; L678-V682 VanDerWaalsContact O-CG2 3.31Å; L678-V682 WeakPolarHBondContact O-CG2 3.33Å; L678-V682 PolarHBondContact O-N 2.88Å; L679-V682 PolarHBondContact O-N 3.26Å; V682-V685 WeakPolarHBondContact O-CB 3.45Å; V682-V685 PolarHBondContact O-N 3.48Å; V682-L699 HydrophobicContact CG2-CD1 4.45Å; V682-L713 HydrophobicContact CG2-CD1 3.54Å; V682-F716 HydrophobicContact CG1-CB 4.22Å; V682-F716 HydrophobicContact CG2-CB 4.28Å; V682-F716 HydrophobicContact CG2-CD2 4.31Å; V682-L717 HydrophobicContact CG1-CD2 4.02Å; V682-Y731 HydrophobicContact CG1-CE1 4.06Å; V682-Y731 WeakPolarHBondContact O-CE1 3.49Å; V682-Y731 PolarHBondContact O-OH 3.32Å
683	Q	92.1	Very high	93.8	Very high	4 Å²	4	12.6 Å²	12.6	2%	0.019	6%	0.061	C	C	.	.	H	α-helix	trans	-69.8	-33.6	177.2	-64.8	-60.2	-31.4	0	0	112.4	L679 Q680 L681 V685 K686 E720 M1052 T1055	L679-Q683 VanDerWaalsContact O-CG 3.29Å; L679-Q683 WeakPolarHBondContact O-CG 3.41Å; L679-Q683 PolarHBondContact O-N 3.34Å; Q680-Q683 PolarHBondContact O-N 3.25Å; L681-Q683 VanDerWaalsContact C-N 3.34Å; Q683-V685 PolarHBondContact O-N 3.33Å; Q683-K686 VanDerWaalsContact O-CB 3.27Å; Q683-K686 WeakPolarHBondContact O-CB 3.43Å; Q683-K686 WeakPolarHBondContact O-CG 3.47Å; Q683-K686 PolarHBondContact O-N 3.45Å; Q683-E720 PolarHBondContact NE2-OE1 3.22Å; Q683-M1052 HydrophobicContact CB-SD 4.16Å; Q683-M1052 HydrophobicContact CG-CE 4.09Å; Q683-M1052 HydrophobicContact CG-SD 3.78Å; Q683-T1055 HydrophobicContact CB-CG2 3.62Å; Q683-T1055 HydrophobicContact CG-CG2 3.73Å; Q683-T1055 VanDerWaalsContact OE1-CB 3.26Å
684	A	93.8	Very high	94	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62	-23.3	176.4	0	0	0	0	0	113.3	L649 Q680 L681 K686 F687 L695 M1051	L649-A684 HydrophobicContact CB-CB 4.45Å; Q680-A684 WeakPolarHBondContact O-CB 3.48Å; Q680-A684 PolarHBondContact O-N 3.49Å; L681-A684 WeakPolarHBondContact O-CB 3.18Å; L681-A684 PolarHBondContact O-N 3.26Å; A684-K686 PolarHBondContact O-N 2.99Å; A684-F687 HydrophobicContact CB-CD2 4.4Å; A684-F687 WeakPolarHBondContact O-CB 3.35Å; A684-F687 PolarHBondContact O-N 3.26Å; A684-L695 HydrophobicContact CB-CD2 3.7Å; A684-M1051 HydrophobicContact CB-CE 3.44Å; A684-M1051 VanDerWaalsContact CB-CE 3.44Å
685	V	95.3	Very high	94.1	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.006	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-60.1	-24.9	172.4	176.9	0	0	0	0	111.8	L681 V682 Q683 F687 E688 L695 V696 L699 R730 Y731	L681-V685 PolarHBondContact O-N 2.78Å; V682-V685 WeakPolarHBondContact O-CB 3.45Å; V682-V685 PolarHBondContact O-N 3.48Å; Q683-V685 PolarHBondContact O-N 3.33Å; V685-F687 PolarHBondContact O-N 3.43Å; V685-E688 WeakPolarHBondContact O-CB 3.49Å; V685-E688 PolarHBondContact O-N 3.25Å; V685-L695 HydrophobicContact CG2-CD2 3.94Å; V685-L695 HydrophobicContact CG2-CG 4.18Å; V685-V696 HydrophobicContact CG1-CG2 3.85Å; V685-V696 HydrophobicContact CG2-CG2 4.25Å; V685-L699 HydrophobicContact CG2-CD1 3.64Å; V685-R730 HydrophobicContact CG1-CG 4.14Å; V685-R730 PolarHBondContact O-NH1 2.82Å; V685-Y731 HydrophobicContact CB-CE1 3.94Å; V685-Y731 HydrophobicContact CG1-CD1 4.4Å; V685-Y731 HydrophobicContact CG1-CE1 3.94Å
686	K	92.5	Very high	94.3	Very high	3 Å²	3	11.2 Å²	11.2	1%	0.013	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-65.1	-25.5	173.3	-62.6	179.6	173.3	169.7	0	112.4	A508 Q683 A684 E720 Y727 Y731	A508-K686 HydrophobicContact CB-CB 4.06Å; A508-K686 HydrophobicContact CB-CD 4.25Å; Q683-K686 VanDerWaalsContact O-CB 3.27Å; Q683-K686 WeakPolarHBondContact O-CB 3.43Å; Q683-K686 WeakPolarHBondContact O-CG 3.47Å; Q683-K686 PolarHBondContact O-N 3.45Å; A684-K686 PolarHBondContact O-N 2.99Å; K686-E720 WeakPolarHBondContact CE-OE2 3.45Å; K686-E720 IonicContact NZ-OE1 3.88Å; K686-E720 IonicContact NZ-OE2 3.86Å; K686-E720 PolarHBondContact NZ-OE2 2.83Å; K686-Y727 HydrophobicContact CB-CD1 4.24Å; K686-Y727 HydrophobicContact CB-CD2 4.39Å; K686-Y727 HydrophobicContact CB-CE1 3.83Å; K686-Y727 HydrophobicContact CB-CE2 4Å; K686-Y727 HydrophobicContact CD-CD2 3.94Å; K686-Y727 HydrophobicContact CD-CE2 4.01Å; K686-Y727 HydrophobicContact CD-CG 4.46Å; K686-Y727 HydrophobicContact CG-CD1 4.07Å; K686-Y727 HydrophobicContact CG-CD2 3.84Å; K686-Y727 HydrophobicContact CG-CE1 4.14Å; K686-Y727 HydrophobicContact CG-CE2 3.93Å; K686-Y727 HydrophobicContact CG-CG 3.92Å; K686-Y727 WeakPolarHBondContact O-CE1 3.45Å; K686-Y727 PolarHBondContact O-OH 2.94Å; K686-Y731 WeakPolarHBondContact CE-OH 3.31Å; K686-Y731 HydrophobicContact CG-CE2 4.43Å; K686-Y731 VanDerWaalsContact CG-OH 3.31Å; K686-Y731 WeakPolarHBondContact CG-OH 3.42Å
687	F	92.5	Very high	94.6	Very high	6 Å²	6	13.4 Å²	13.4	3%	0.026	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-87.6	-10.3	179.5	-50.4	-43.3	0	0	0	113.7	A508 L511 L649 C651 A684 V685 M1051 M1054	A508-F687 HydrophobicContact CB-CD1 4.32Å; A508-F687 HydrophobicContact CB-CE1 3.74Å; L511-F687 HydrophobicContact CD1-CD1 3.97Å; L511-F687 HydrophobicContact CD1-CE1 4.35Å; L649-F687 WeakPolarHBondContact O-CD2 3.26Å; C651-F687 HydrophobicContact CB-CD1 3.63Å; C651-F687 HydrophobicContact CB-CE1 3.83Å; C651-F687 HydrophobicContact CB-CG 4.05Å; C651-F687 HydrophobicContact CB-CZ 4.43Å; A684-F687 HydrophobicContact CB-CD2 4.4Å; A684-F687 WeakPolarHBondContact O-CB 3.35Å; A684-F687 PolarHBondContact O-N 3.26Å; V685-F687 PolarHBondContact O-N 3.43Å; F687-M1051 HydrophobicContact CE2-CB 4.43Å; F687-M1054 HydrophobicContact CE1-CB 3.61Å; F687-M1054 HydrophobicContact CE1-CE 4.39Å; F687-M1054 HydrophobicContact CE1-CG 4.04Å; F687-M1054 HydrophobicContact CZ-CB 3.63Å; F687-M1054 HydrophobicContact CZ-CG 3.96Å
688	E	94.4	Very high	94.7	Very high	14 Å²	14	12.4 Å²	12.4	7%	0.065	6%	0.062	C	C	.	.			trans	-64.7	130.2	175.2	-66.9	-63.8	154.9	0	0	110.1	R659 V685 Y690 S693 R730	R659-E688 IonicContact CZ-OE1 2.75Å; R659-E688 VanDerWaalsContact CZ-OE1 3.23Å; R659-E688 IonicContact NE-OE1 2.74Å; R659-E688 PolarHBondContact NE-OE1 3.08Å; R659-E688 IonicContact NE-OE2 3.33Å; R659-E688 PolarHBondContact NE-OE2 3.24Å; R659-E688 IonicContact NH2-OE1 3.14Å; R659-E688 PolarHBondContact NH2-OE1 3.43Å; V685-E688 WeakPolarHBondContact O-CB 3.49Å; V685-E688 PolarHBondContact O-N 3.25Å; E688-Y690 VanDerWaalsContact C-N 3.34Å; E688-S693 WeakPolarHBondContact CG-OG 3.47Å; E688-S693 VanDerWaalsContact OE2-CB 3.23Å; E688-S693 WeakPolarHBondContact OE2-CB 3.4Å; E688-R730 VanDerWaalsContact O-CZ 3.26Å; E688-R730 PolarHBondContact O-NH1 3.3Å; E688-R730 PolarHBondContact O-NH2 3Å
689	P	92.9	Very high	94.9	Very high	10 Å²	10	12.5 Å²	12.5	7%	0.065	6%	0.063	C	C	.	.	S	Bend	trans	-63.4	-42.4	175.2	-21.9	32.7	0	0	0	111.6	L475 S654 R730	L475-P689 WeakPolarHBondContact CD1-O 3.28Å; L475-P689 HydrophobicContact CD2-CB 4.14Å; S654-P689 WeakPolarHBondContact O-CG 3.13Å; P689-R730 PolarHBondContact O-NH2 2.93Å
690	Y	93.5	Very high	95.1	Very high	20 Å²	20	12 Å²	12	8%	0.078	6%	0.06	C	C	.	.	S	Bend	trans	-110.4	158.5	-174.1	-56	-76.2	0	0	0	111.9	E174 K427 G428 L475 I477 D478 H479 E688	E174-Y690 WeakPolarHBondContact OE1-CA 3.36Å; E174-Y690 VanDerWaalsContact OE1-CB 3.29Å; E174-Y690 WeakPolarHBondContact OE1-CB 3.34Å; K427-Y690 HydrophobicContact CD-CE2 4.45Å; K427-Y690 HydrophobicContact CG-CE2 4.06Å; K427-Y690 WeakPolarHBondContact CG-OH 3.44Å; G428-Y690 PolarHBondContact N-OH 3Å; L475-Y690 HydrophobicContact CD1-CD1 4.03Å; L475-Y690 HydrophobicContact CD1-CE1 3.88Å; I477-Y690 WeakPolarHBondContact O-CE1 3.49Å; I477-Y690 PolarHBondContact O-OH 2.72Å; D478-Y690 VanDerWaalsContact C-CE1 3.5Å; H479-Y690 HydrophobicContact CB-CD1 4.04Å; H479-Y690 HydrophobicContact CB-CE1 4.48Å; E688-Y690 VanDerWaalsContact C-N 3.34Å
691	H	93.6	Very high	95.4	Very high	20 Å²	20	14.8 Å²	14.8	9%	0.093	7%	0.072	C	C	.	.	S	Bend	trans	-68.5	-39.5	177.1	-67	-68.4	0	0	0	112.6	E174 T178 R730	E174-H691 VanDerWaalsContact CD-CD2 3.46Å; E174-H691 HydrophobicContact CG-CB 4.5Å; E174-H691 IonicContact OE1-CD2 3.62Å; E174-H691 PolarHBondContact OE1-CD2 2.84Å; E174-H691 IonicContact OE1-CG 3.71Å; E174-H691 PolarHBondContact OE1-N 2.94Å; E174-H691 IonicContact OE2-CD2 3.26Å; T178-H691 HydrophobicContact CG2-CB 3.96Å; T178-H691 WeakPolarHBondContact OG1-CB 3.3Å; H691-R730 VanDerWaalsContact ND1-CB 3.32Å; H691-R730 WeakPolarHBondContact ND1-CB 3.46Å; H691-R730 WeakPolarHBondContact ND1-CG 3.39Å; H691-R730 PolarHBondContact ND1-NE 3.43Å
692	D	93.6	Very high	95.4	Very high	35 Å²	35	15.1 Å²	15.1	19%	0.187	7%	0.073	C	C	.	.	S	Bend	trans	-89	118.8	170.3	-177.9	20.8	0	0	0	110.3	T178 R697	T178-D692 HydrophobicContact CG2-CB 4.07Å; D692-R697 IonicContact OD1-CZ 3.62Å; D692-R697 IonicContact OD1-NE 2.72Å; D692-R697 PolarHBondContact OD1-NE 3.49Å; D692-R697 IonicContact OD1-NH2 3.01Å; D692-R697 PolarHBondContact OD1-NH2 3.36Å; D692-R697 IonicContact OD2-CZ 2.86Å; D692-R697 IonicContact OD2-NE 2.73Å; D692-R697 IonicContact OD2-NH2 3.47Å; D692-R697 PolarHBondContact OD2-NH2 2.99Å
693	S	95.3	Very high	95.6	Very high	13 Å²	13	15.1 Å²	15.1	9%	0.091	7%	0.073	C	C	.	.			trans	-148	163.8	179.5	66.3	0	0	0	0	111.4	E688 L695 V696 R697	E688-S693 WeakPolarHBondContact CG-OG 3.47Å; E688-S693 VanDerWaalsContact OE2-CB 3.23Å; E688-S693 WeakPolarHBondContact OE2-CB 3.4Å; S693-L695 PolarHBondContact O-N 3.39Å; S693-V696 PolarHBondContact O-N 2.84Å; S693-V696 VanDerWaalsContact OG-CG2 3.29Å; S693-V696 WeakPolarHBondContact OG-CG2 3.32Å; S693-V696 PolarHBondContact OG-N 3.12Å; S693-R697 WeakPolarHBondContact O-CG 3.14Å; S693-R697 PolarHBondContact O-N 3.18Å; S693-R697 VanDerWaalsContact O-N 3.1Å
694	A	96.3	Very high	95.8	Very high	30 Å²	30	14.9 Å²	14.9	25%	0.248	7%	0.073	C	C	.	.	H	α-helix	trans	-57.6	-40	175.8	0	0	0	0	0	111.8	V663 R697 F698	V663-A694 HydrophobicContact CB-CB 4.06Å; V663-A694 HydrophobicContact CG1-CB 4.15Å; V663-A694 HydrophobicContact CG2-CB 4.04Å; A694-R697 PolarHBondContact O-N 3.13Å; A694-F698 WeakPolarHBondContact O-CB 3.47Å; A694-F698 PolarHBondContact O-N 2.91Å
695	L	97.9	Very high	95.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-66.2	-43.7	-180	177.6	62.2	0	0	0	112	L649 V663 L681 A684 V685 S693 R697 F698 L699	L649-L695 HydrophobicContact CD1-CD1 4.2Å; V663-L695 HydrophobicContact CG2-CB 3.98Å; V663-L695 HydrophobicContact CG2-CD1 4.46Å; L681-L695 HydrophobicContact CD2-CD1 4.14Å; A684-L695 HydrophobicContact CB-CD2 3.7Å; V685-L695 HydrophobicContact CG2-CD2 3.94Å; V685-L695 HydrophobicContact CG2-CG 4.18Å; S693-L695 PolarHBondContact O-N 3.39Å; L695-R697 VanDerWaalsContact C-N 3.32Å; L695-R697 PolarHBondContact O-N 3.16Å; L695-F698 HydrophobicContact CD1-CD1 4.26Å; L695-F698 WeakPolarHBondContact O-CB 3.47Å; L695-F698 PolarHBondContact O-N 2.7Å; L695-L699 HydrophobicContact CD1-CD1 4.5Å; L695-L699 HydrophobicContact CD1-CG 4.39Å; L695-L699 HydrophobicContact CG-CD1 4.41Å; L695-L699 WeakPolarHBondContact O-CG 3.49Å; L695-L699 PolarHBondContact O-N 3.09Å
696	V	97.8	Very high	95.9	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.018	9%	0.091	C	C	.	.	H	α-helix	trans	-61.5	-42.8	177	169	0	0	0	0	110.7	L182 V685 S693 L699 L700 L734	L182-V696 HydrophobicContact CD1-CG1 4.26Å; L182-V696 HydrophobicContact CD2-CG1 4.09Å; V685-V696 HydrophobicContact CG1-CG2 3.85Å; V685-V696 HydrophobicContact CG2-CG2 4.25Å; S693-V696 PolarHBondContact O-N 2.84Å; S693-V696 VanDerWaalsContact OG-CG2 3.29Å; S693-V696 WeakPolarHBondContact OG-CG2 3.32Å; S693-V696 PolarHBondContact OG-N 3.12Å; V696-L699 PolarHBondContact O-N 2.92Å; V696-L700 WeakPolarHBondContact O-CB 3.36Å; V696-L700 PolarHBondContact O-N 2.83Å; V696-L734 HydrophobicContact CG1-CB 4.48Å; V696-L734 HydrophobicContact CG1-CD1 3.94Å; V696-L734 HydrophobicContact CG1-CD2 4.35Å; V696-L734 HydrophobicContact CG1-CG 4.48Å
697	R	97.4	Very high	96.1	Very high	90 Å²	90	20.4 Å²	20.4	34%	0.34	10%	0.095	S	C	.	.	H	α-helix	trans	-66	-39.7	176.3	-66.3	179.2	-175.8	-152.8	4.8	112.5	L182 P185 D692 S693 A694 L695 L700 K701	L182-R697 HydrophobicContact CD2-CG 4.12Å; P185-R697 HydrophobicContact CG-CG 4.11Å; D692-R697 IonicContact OD1-CZ 3.62Å; D692-R697 IonicContact OD1-NE 2.72Å; D692-R697 PolarHBondContact OD1-NE 3.49Å; D692-R697 IonicContact OD1-NH2 3.01Å; D692-R697 PolarHBondContact OD1-NH2 3.36Å; D692-R697 IonicContact OD2-CZ 2.86Å; D692-R697 IonicContact OD2-NE 2.73Å; D692-R697 IonicContact OD2-NH2 3.47Å; D692-R697 PolarHBondContact OD2-NH2 2.99Å; S693-R697 WeakPolarHBondContact O-CG 3.14Å; S693-R697 PolarHBondContact O-N 3.18Å; S693-R697 VanDerWaalsContact O-N 3.1Å; A694-R697 PolarHBondContact O-N 3.13Å; L695-R697 VanDerWaalsContact C-N 3.32Å; L695-R697 PolarHBondContact O-N 3.16Å; R697-L700 PolarHBondContact O-N 3.14Å; R697-K701 VanDerWaalsContact O-CB 3.23Å; R697-K701 WeakPolarHBondContact O-CB 3.46Å; R697-K701 PolarHBondContact O-N 3.28Å
698	F	98.1	Very high	96.3	Very high	1 Å²	1	21.7 Å²	21.7	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-60.2	-50.1	174.5	166.4	-102.5	0	0	0	111.5	V663 L666 E667 V674 L681 A694 L695 L700 K701 R702	V663-F698 HydrophobicContact CG1-CB 3.64Å; V663-F698 HydrophobicContact CG1-CD2 4.48Å; V663-F698 HydrophobicContact CG1-CG 4.11Å; L666-F698 HydrophobicContact CB-CE1 4.46Å; L666-F698 HydrophobicContact CB-CE2 4.41Å; L666-F698 HydrophobicContact CB-CZ 4.12Å; E667-F698 HydrophobicContact CG-CD2 4.01Å; E667-F698 HydrophobicContact CG-CE2 4.42Å; V674-F698 HydrophobicContact CG2-CZ 4.01Å; L681-F698 HydrophobicContact CD1-CE1 4.13Å; A694-F698 WeakPolarHBondContact O-CB 3.47Å; A694-F698 PolarHBondContact O-N 2.91Å; L695-F698 HydrophobicContact CD1-CD1 4.26Å; L695-F698 WeakPolarHBondContact O-CB 3.47Å; L695-F698 PolarHBondContact O-N 2.7Å; F698-L700 PolarHBondContact O-N 2.85Å; F698-K701 PolarHBondContact O-N 3.46Å; F698-R702 HydrophobicContact CD2-CG 3.93Å; F698-R702 HydrophobicContact CE1-CG 4.39Å; F698-R702 HydrophobicContact CE2-CG 3.58Å; F698-R702 HydrophobicContact CG-CG 4.49Å; F698-R702 HydrophobicContact CZ-CG 3.85Å; F698-R702 WeakPolarHBondContact O-CG 3.37Å; F698-R702 PolarHBondContact O-N 3.16Å
699	L	98.6	Very high	96.5	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-59.7	-45.4	178.4	-71.5	174.7	0	0	0	111.9	L678 L681 V682 V685 L695 V696 R702 A703	L678-L699 HydrophobicContact CD1-CD2 3.82Å; L681-L699 HydrophobicContact CB-CD2 3.98Å; V682-L699 HydrophobicContact CG2-CD1 4.45Å; V685-L699 HydrophobicContact CG2-CD1 3.64Å; L695-L699 HydrophobicContact CD1-CD1 4.5Å; L695-L699 HydrophobicContact CD1-CG 4.39Å; L695-L699 HydrophobicContact CG-CD1 4.41Å; L695-L699 WeakPolarHBondContact O-CG 3.49Å; L695-L699 PolarHBondContact O-N 3.09Å; V696-L699 PolarHBondContact O-N 2.92Å; L699-R702 PolarHBondContact O-N 3.44Å; L699-A703 VanDerWaalsContact O-CB 3.26Å; L699-A703 WeakPolarHBondContact O-CB 3.28Å; L699-A703 PolarHBondContact O-N 2.75Å
700	L	98.3	Very high	96.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-48.3	176.4	179.1	60.6	0	0	0	111.6	L182 P185 V696 R697 F698 A703 L704 L734 A737	L182-L700 HydrophobicContact CB-CD2 4.16Å; L182-L700 HydrophobicContact CD2-CD2 4.23Å; P185-L700 HydrophobicContact CB-CD2 4.48Å; V696-L700 WeakPolarHBondContact O-CB 3.36Å; V696-L700 PolarHBondContact O-N 2.83Å; R697-L700 PolarHBondContact O-N 3.14Å; F698-L700 PolarHBondContact O-N 2.85Å; L700-A703 PolarHBondContact O-N 3.16Å; L700-L704 HydrophobicContact CD1-CD1 3.76Å; L700-L704 HydrophobicContact CD1-CG 4.1Å; L700-L704 HydrophobicContact CG-CD1 3.9Å; L700-L704 WeakPolarHBondContact O-CB 3.41Å; L700-L704 VanDerWaalsContact O-CG 3.29Å; L700-L704 WeakPolarHBondContact O-CG 3.43Å; L700-L704 PolarHBondContact O-N 3.23Å; L700-L734 HydrophobicContact CB-CD1 3.88Å; L700-L734 HydrophobicContact CD1-CD1 4.41Å; L700-A737 HydrophobicContact CD1-CB 4.04Å; L700-A737 HydrophobicContact CD2-CB 3.97Å
701	K	97.7	Very high	97	Very high	58 Å²	58	19.8 Å²	19.8	25%	0.252	9%	0.09	S	C	.	.	H	α-helix	trans	-58.9	-50.2	179.7	-175.5	-170.3	170.9	-168.6	0	111.7	E189 E667 R697 F698 A703 L704 R705	E189-K701 HydrophobicContact CG-CG 4.29Å; E189-K701 WeakPolarHBondContact OE2-CG 3.31Å; E667-K701 IonicContact OE1-NZ 2.79Å; E667-K701 IonicContact OE2-NZ 3.81Å; E667-K701 PolarHBondContact OE2-NZ 2.97Å; R697-K701 VanDerWaalsContact O-CB 3.23Å; R697-K701 WeakPolarHBondContact O-CB 3.46Å; R697-K701 PolarHBondContact O-N 3.28Å; F698-K701 PolarHBondContact O-N 3.46Å; K701-A703 PolarHBondContact O-N 2.93Å; K701-L704 PolarHBondContact O-N 3.46Å; K701-R705 WeakPolarHBondContact O-CB 3.48Å; K701-R705 PolarHBondContact O-N 3.47Å
702	R	97.4	Very high	97.2	Very high	7 Å²	7	20.5 Å²	20.5	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-64.9	-38.8	-179.7	-62.3	-59.6	-70.4	-94.8	-0.5	112.5	L669 E670 D671 V674 F698 L699 R705 S706 I709	L669-R702 PolarHBondContact O-NH1 3.35Å; L669-R702 PolarHBondContact O-NH2 2.93Å; E670-R702 PolarHBondContact O-NH2 2.92Å; D671-R702 VanDerWaalsContact N-NH2 3.18Å; D671-R702 IonicContact OD1-CZ 3.07Å; D671-R702 VanDerWaalsContact OD1-CZ 3.28Å; D671-R702 IonicContact OD1-NE 3.17Å; D671-R702 PolarHBondContact OD1-NE 3.4Å; D671-R702 IonicContact OD1-NH2 2.98Å; D671-R702 PolarHBondContact OD1-NH2 2.94Å; V674-R702 VanDerWaalsContact CG2-CZ 3.41Å; V674-R702 VanDerWaalsContact CG2-NH2 3.26Å; F698-R702 HydrophobicContact CD2-CG 3.93Å; F698-R702 HydrophobicContact CE1-CG 4.39Å; F698-R702 HydrophobicContact CE2-CG 3.58Å; F698-R702 HydrophobicContact CG-CG 4.49Å; F698-R702 HydrophobicContact CZ-CG 3.85Å; F698-R702 WeakPolarHBondContact O-CG 3.37Å; F698-R702 PolarHBondContact O-N 3.16Å; L699-R702 PolarHBondContact O-N 3.44Å; R702-R705 PolarHBondContact O-N 3Å; R702-S706 PolarHBondContact O-N 3.01Å; R702-S706 VanDerWaalsContact O-N 3.12Å; R702-I709 HydrophobicContact CB-CD1 4.28Å; R702-I709 HydrophobicContact CB-CG2 4.28Å
703	A	97.9	Very high	97.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-68.2	-34.1	176.9	0	0	0	0	0	114	L699 L700 K701 R705 S706 I709 L713 Y738	L699-A703 VanDerWaalsContact O-CB 3.26Å; L699-A703 WeakPolarHBondContact O-CB 3.28Å; L699-A703 PolarHBondContact O-N 2.75Å; L700-A703 PolarHBondContact O-N 3.16Å; K701-A703 PolarHBondContact O-N 2.93Å; A703-R705 VanDerWaalsContact C-N 3.29Å; A703-S706 VanDerWaalsContact O-O 3.04Å; A703-I709 HydrophobicContact CB-CG2 4.28Å; A703-L713 HydrophobicContact CB-CB 4.36Å; A703-L713 HydrophobicContact CB-CD2 3.38Å; A703-L713 HydrophobicContact CB-CG 4.48Å; A703-Y738 HydrophobicContact CB-CD2 3.76Å; A703-Y738 HydrophobicContact CB-CE2 3.89Å
704	L	97.1	Very high	97.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-76.4	-18.9	175.9	-70.6	172.5	0	0	0	113.1	R186 E189 R193 Y198 L700 K701 Y738 G741	R186-L704 HydrophobicContact CB-CD1 4.07Å; R186-L704 HydrophobicContact CG-CD1 3.78Å; E189-L704 HydrophobicContact CB-CB 4.36Å; E189-L704 HydrophobicContact CB-CD1 4.42Å; E189-L704 HydrophobicContact CG-CB 3.77Å; R193-L704 VanDerWaalsContact CD-O 3.22Å; R193-L704 WeakPolarHBondContact CD-O 3.45Å; Y198-L704 VanDerWaalsContact CE2-O 3.26Å; Y198-L704 WeakPolarHBondContact CE2-O 3.43Å; L700-L704 HydrophobicContact CD1-CD1 3.76Å; L700-L704 HydrophobicContact CD1-CG 4.1Å; L700-L704 HydrophobicContact CG-CD1 3.9Å; L700-L704 WeakPolarHBondContact O-CB 3.41Å; L700-L704 VanDerWaalsContact O-CG 3.29Å; L700-L704 WeakPolarHBondContact O-CG 3.43Å; L700-L704 PolarHBondContact O-N 3.23Å; K701-L704 PolarHBondContact O-N 3.46Å; L704-Y738 HydrophobicContact CD2-CD2 4.01Å; L704-Y738 HydrophobicContact CD2-CE2 4.48Å; L704-Y738 HydrophobicContact CG-CD2 4.39Å; L704-G741 WeakPolarHBondContact CD2-O 3.39Å
705	R	95.6	Very high	97.7	Very high	96 Å²	96	16.8 Å²	16.8	36%	0.362	7%	0.068	S	C	.	.	H	α-helix	trans	-85.6	-36.8	177.5	-169.5	174.6	-63.8	-176.1	-6.5	113.9	E189 Y198 K701 R702 A703	E189-R705 WeakPolarHBondContact OE1-CB 3.44Å; E189-R705 IonicContact OE1-CZ 3.84Å; E189-R705 IonicContact OE1-NE 3.67Å; E189-R705 PolarHBondContact OE1-NE 3.47Å; E189-R705 IonicContact OE1-NH2 3.76Å; E189-R705 PolarHBondContact OE1-NH2 3.41Å; E189-R705 VanDerWaalsContact OE1-NH2 3.16Å; E189-R705 IonicContact OE2-CZ 3.35Å; E189-R705 IonicContact OE2-NE 2.77Å; E189-R705 IonicContact OE2-NH2 3.7Å; E189-R705 PolarHBondContact OE2-NH2 3.05Å; Y198-R705 WeakPolarHBondContact CD2-O 3.46Å; K701-R705 WeakPolarHBondContact O-CB 3.48Å; K701-R705 PolarHBondContact O-N 3.47Å; R702-R705 PolarHBondContact O-N 3Å; A703-R705 VanDerWaalsContact C-N 3.29Å
706	S	96.1	Very high	97.7	Very high	5 Å²	5	17.9 Å²	17.9	4%	0.035	7%	0.073	C	C	.	.			trans	-126.7	125	-179	171.4	0	0	0	0	110.9	D201 R702 A703 R708 I709 G710	D201-S706 WeakPolarHBondContact OD1-CA 3.32Å; D201-S706 WeakPolarHBondContact OD1-CB 3.35Å; D201-S706 PolarHBondContact OD1-OG 3.41Å; D201-S706 PolarHBondContact OD2-OG 3.23Å; R702-S706 PolarHBondContact O-N 3.01Å; R702-S706 VanDerWaalsContact O-N 3.12Å; A703-S706 VanDerWaalsContact O-O 3.04Å; S706-R708 VanDerWaalsContact C-N 3.3Å; S706-R708 PolarHBondContact O-N 2.93Å; S706-I709 PolarHBondContact O-N 2.92Å; S706-G710 PolarHBondContact O-N 3.06Å
707	K	96.1	Very high	97.7	Very high	19 Å²	19	17.8 Å²	17.8	8%	0.083	7%	0.072	C	C	.	.	H	α-helix	trans	-61.9	-38	178.9	-72.3	-175.4	175.8	175.6	0	111.5	Y198 S199 D201 D318 G710 H711 M746	Y198-K707 HydrophobicContact CD1-CG 4.45Å; Y198-K707 HydrophobicContact CD2-CG 4.03Å; Y198-K707 HydrophobicContact CE1-CD 4.37Å; Y198-K707 VanDerWaalsContact CE1-CE 3.43Å; Y198-K707 HydrophobicContact CE1-CG 4.01Å; Y198-K707 HydrophobicContact CE2-CG 3.56Å; Y198-K707 HydrophobicContact CG-CG 4.47Å; Y198-K707 VanDerWaalsContact O-CD 3.26Å; Y198-K707 WeakPolarHBondContact O-CD 3.5Å; Y198-K707 WeakPolarHBondContact O-CE 3.18Å; S199-K707 PolarHBondContact O-NZ 2.86Å; D201-K707 HydrophobicContact CB-CB 4.11Å; D201-K707 HydrophobicContact CB-CG 4.47Å; D201-K707 PolarHBondContact OD1-N 3.28Å; D201-K707 WeakPolarHBondContact OD2-CB 3.45Å; D201-K707 PolarHBondContact OD2-N 2.9Å; D201-K707 VanDerWaalsContact OD2-N 3.12Å; D318-K707 VanDerWaalsContact OD1-CE 3.28Å; D318-K707 WeakPolarHBondContact OD1-CE 3.45Å; D318-K707 IonicContact OD1-NZ 3.39Å; D318-K707 PolarHBondContact OD1-NZ 3.11Å; D318-K707 IonicContact OD2-NZ 2.78Å; D318-K707 PolarHBondContact OD2-NZ 3.23Å; K707-G710 PolarHBondContact O-N 2.89Å; K707-H711 VanDerWaalsContact O-CB 3.3Å; K707-H711 WeakPolarHBondContact O-CB 3.36Å; K707-H711 PolarHBondContact O-N 3.32Å; K707-M746 HydrophobicContact CB-CE 4.23Å; K707-M746 HydrophobicContact CB-SD 4.09Å; K707-M746 HydrophobicContact CD-CG 4.22Å; K707-M746 HydrophobicContact CD-SD 3.99Å; K707-M746 HydrophobicContact CG-CG 4.24Å; K707-M746 HydrophobicContact CG-SD 4.02Å
708	R	97.3	Very high	97.6	Very high	33 Å²	33	14.5 Å²	14.5	13%	0.125	6%	0.06	C	C	.	.	H	α-helix	trans	-63.7	-45.2	178.3	-162.5	170.4	-168.9	118.4	0.3	111.3	D201 E281 L675 S706 H711 F712 D806 P807	D201-R708 WeakPolarHBondContact OD2-CB 3.42Å; D201-R708 PolarHBondContact OD2-N 3.08Å; E281-R708 IonicContact OE1-CZ 2.84Å; E281-R708 IonicContact OE1-NH1 3.34Å; E281-R708 PolarHBondContact OE1-NH1 3.06Å; E281-R708 IonicContact OE1-NH2 3.58Å; L675-R708 HydrophobicContact CD1-CB 4.39Å; L675-R708 HydrophobicContact CD1-CG 3.9Å; L675-R708 HydrophobicContact CD2-CG 4.34Å; S706-R708 VanDerWaalsContact C-N 3.3Å; S706-R708 PolarHBondContact O-N 2.93Å; R708-H711 PolarHBondContact O-N 3.27Å; R708-F712 HydrophobicContact CG-CD2 4.35Å; R708-F712 HydrophobicContact CG-CE2 4.06Å; R708-F712 VanDerWaalsContact O-CD2 3.23Å; R708-F712 WeakPolarHBondContact O-CD2 3.2Å; R708-F712 PolarHBondContact O-N 2.88Å; R708-D806 IonicContact NH2-OD1 3.64Å; R708-P807 HydrophobicContact CG-CG 4.27Å
709	I	98.3	Very high	97.4	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-63.1	-46.9	174	-65	176.6	0	0	0	110.3	D671 V674 L675 L678 R702 A703 S706 H711 F712 L713	D671-I709 HydrophobicContact CB-CD1 3.75Å; D671-I709 WeakPolarHBondContact OD1-CD1 3.23Å; V674-I709 HydrophobicContact CB-CD1 4.13Å; V674-I709 HydrophobicContact CG1-CD1 3.91Å; V674-I709 HydrophobicContact CG1-CG2 4.44Å; L675-I709 HydrophobicContact CD2-CB 4.35Å; L675-I709 HydrophobicContact CD2-CG1 3.74Å; L675-I709 HydrophobicContact CG-CG1 3.82Å; L678-I709 HydrophobicContact CD1-CG2 4.44Å; L678-I709 HydrophobicContact CD2-CG2 4.35Å; R702-I709 HydrophobicContact CB-CD1 4.28Å; R702-I709 HydrophobicContact CB-CG2 4.28Å; A703-I709 HydrophobicContact CB-CG2 4.28Å; S706-I709 PolarHBondContact O-N 2.92Å; I709-H711 VanDerWaalsContact C-N 3.31Å; I709-H711 PolarHBondContact O-N 3.26Å; I709-F712 PolarHBondContact O-N 3.13Å; I709-L713 VanDerWaalsContact O-CB 3.3Å; I709-L713 WeakPolarHBondContact O-CB 3.47Å; I709-L713 PolarHBondContact O-N 3.37Å
710	G	98.3	Very high	97.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.4	-38.1	179.2	0	0	0	0	0	113.8	S706 K707 F714 Y738	S706-G710 PolarHBondContact O-N 3.06Å; K707-G710 PolarHBondContact O-N 2.89Å; G710-F714 WeakPolarHBondContact O-CB 3.47Å; G710-F714 PolarHBondContact O-N 2.98Å; G710-Y738 VanDerWaalsContact CA-CZ 3.48Å; G710-Y738 VanDerWaalsContact CA-OH 3.22Å; G710-Y738 WeakPolarHBondContact CA-OH 3.43Å; G710-Y738 WeakPolarHBondContact O-CE1 3.41Å; G710-Y738 PolarHBondContact O-OH 2.98Å
711	H	98.6	Very high	96.9	Very high	3 Å²	3	14.9 Å²	14.9	1%	0.014	6%	0.062	C	C	.	.	H	α-helix	trans	-61.5	-50.8	175.5	177.1	86.3	0	0	0	112.5	K707 R708 I709 F714 W715 M746 F750 Q753 P804 P807	K707-H711 VanDerWaalsContact O-CB 3.3Å; K707-H711 WeakPolarHBondContact O-CB 3.36Å; K707-H711 PolarHBondContact O-N 3.32Å; R708-H711 PolarHBondContact O-N 3.27Å; I709-H711 VanDerWaalsContact C-N 3.31Å; I709-H711 PolarHBondContact O-N 3.26Å; H711-F714 WeakPolarHBondContact O-CB 3.5Å; H711-F714 PolarHBondContact O-N 3.45Å; H711-W715 AromaticContact CE1-CD1 3.85Å; H711-W715 AromaticContact CE1-NE1 3.59Å; H711-W715 AromaticContact NE2-CD1 3.72Å; H711-W715 AromaticContact NE2-NE1 3.87Å; H711-W715 PolarHBondContact O-N 2.85Å; H711-M746 HydrophobicContact CB-CE 4.32Å; H711-F750 AromaticContact ND1-CE1 3.85Å; H711-Q753 PolarHBondContact CE1-OE1 3.37Å; H711-P804 PolarHBondContact NE2-O 3.3Å; H711-P807 HydrophobicContact CB-CB 4.39Å; H711-P807 HydrophobicContact CB-CG 4.43Å
712	F	98.4	Very high	96.5	Very high	35 Å²	35	14.3 Å²	14.3	15%	0.154	7%	0.068	C	C	.	.	H	α-helix	trans	-70.4	-36.4	178.2	-72.4	-68.5	0	0	0	112.1	L675 L678 R708 I709 F714 W715 F716 Y805 P807 I888	L675-F712 HydrophobicContact CD2-CD2 3.77Å; L675-F712 HydrophobicContact CD2-CE2 4.45Å; L678-F712 HydrophobicContact CD2-CB 3.7Å; R708-F712 HydrophobicContact CG-CD2 4.35Å; R708-F712 HydrophobicContact CG-CE2 4.06Å; R708-F712 VanDerWaalsContact O-CD2 3.23Å; R708-F712 WeakPolarHBondContact O-CD2 3.2Å; R708-F712 PolarHBondContact O-N 2.88Å; I709-F712 PolarHBondContact O-N 3.13Å; F712-F714 VanDerWaalsContact C-N 3.3Å; F712-F714 PolarHBondContact O-N 3.36Å; F712-W715 PolarHBondContact O-N 3.24Å; F712-F716 HydrophobicContact CB-CE2 4.18Å; F712-F716 HydrophobicContact CB-CZ 4.1Å; F712-F716 HydrophobicContact CD1-CE1 4.39Å; F712-F716 HydrophobicContact CD1-CZ 4.28Å; F712-F716 WeakPolarHBondContact O-CB 3.38Å; F712-F716 WeakPolarHBondContact O-CD1 3.4Å; F712-F716 WeakPolarHBondContact O-CG 3.43Å; F712-F716 PolarHBondContact O-N 3.5Å; F712-Y805 WeakPolarHBondContact CZ-O 3.49Å; F712-P807 HydrophobicContact CE2-CG 4.32Å; F712-I888 HydrophobicContact CD1-CD1 4.18Å; F712-I888 HydrophobicContact CE1-CD1 4.39Å
713	L	98.6	Very high	95.9	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.6	-43.5	174.5	-177.7	66.9	0	0	0	111	L678 V682 A703 I709 W715 F716 L717	L678-L713 HydrophobicContact CD1-CD1 4.41Å; V682-L713 HydrophobicContact CG2-CD1 3.54Å; A703-L713 HydrophobicContact CB-CB 4.36Å; A703-L713 HydrophobicContact CB-CD2 3.38Å; A703-L713 HydrophobicContact CB-CG 4.48Å; I709-L713 VanDerWaalsContact O-CB 3.3Å; I709-L713 WeakPolarHBondContact O-CB 3.47Å; I709-L713 PolarHBondContact O-N 3.37Å; L713-W715 PolarHBondContact O-N 2.96Å; L713-F716 PolarHBondContact O-N 3.5Å; L713-L717 HydrophobicContact CD1-CD1 3.85Å; L713-L717 HydrophobicContact CD1-CD2 4.47Å; L713-L717 HydrophobicContact CD1-CG 3.96Å; L713-L717 HydrophobicContact CD2-CD1 4.29Å; L713-L717 HydrophobicContact CG-CD1 3.74Å; L713-L717 HydrophobicContact CG-CG 4.22Å; L713-L717 WeakPolarHBondContact O-CB 3.39Å; L713-L717 VanDerWaalsContact O-CG 3.23Å; L713-L717 WeakPolarHBondContact O-CG 3.49Å; L713-L717 PolarHBondContact O-N 2.81Å
714	F	98.7	Very high	95.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-53.7	-52.9	175.8	171.5	-90.3	0	0	0	111.8	L159 G710 H711 F712 L717 R718 L735 Y738 L739 F750 V754	L159-F714 HydrophobicContact CB-CE2 4.43Å; G710-F714 WeakPolarHBondContact O-CB 3.47Å; G710-F714 PolarHBondContact O-N 2.98Å; H711-F714 WeakPolarHBondContact O-CB 3.5Å; H711-F714 PolarHBondContact O-N 3.45Å; F712-F714 VanDerWaalsContact C-N 3.3Å; F712-F714 PolarHBondContact O-N 3.36Å; F714-L717 PolarHBondContact O-N 3Å; F714-R718 WeakPolarHBondContact O-CB 3.27Å; F714-R718 PolarHBondContact O-N 2.77Å; F714-L735 HydrophobicContact CB-CD1 4.35Å; F714-L735 HydrophobicContact CD2-CD1 3.71Å; F714-L735 HydrophobicContact CE2-CD1 4.44Å; F714-L735 HydrophobicContact CG-CD1 4.37Å; F714-Y738 HydrophobicContact CB-CE1 4.17Å; F714-L739 HydrophobicContact CD2-CD2 3.84Å; F714-L739 HydrophobicContact CE2-CD1 4.42Å; F714-L739 HydrophobicContact CE2-CD2 3.98Å; F714-F750 HydrophobicContact CB-CD1 4.19Å; F714-F750 HydrophobicContact CB-CE1 3.48Å; F714-F750 VanDerWaalsContact CB-CE1 3.48Å; F714-F750 HydrophobicContact CB-CE2 4.27Å; F714-F750 HydrophobicContact CB-CZ 3.52Å; F714-F750 AromaticContact CD1-CD1 3.35Å; F714-F750 HydrophobicContact CD1-CD1 3.35Å; F714-F750 AromaticContact CD1-CE1 3.44Å; F714-F750 HydrophobicContact CD1-CE1 3.44Å; F714-F750 VanDerWaalsContact CD1-CE1 3.44Å; F714-F750 HydrophobicContact CD1-CG 4.15Å; F714-F750 HydrophobicContact CD1-CZ 4.29Å; F714-F750 AromaticContact CD2-CD1 3.89Å; F714-F750 HydrophobicContact CD2-CD1 3.89Å; F714-F750 HydrophobicContact CD2-CD2 4.05Å; F714-F750 HydrophobicContact CD2-CE1 4.01Å; F714-F750 HydrophobicContact CD2-CE2 4.15Å; F714-F750 AromaticContact CD2-CG 3.92Å; F714-F750 HydrophobicContact CD2-CG 3.92Å; F714-F750 HydrophobicContact CD2-CZ 4.13Å; F714-F750 HydrophobicContact CE1-CB 4.34Å; F714-F750 AromaticContact CE1-CD1 3.58Å; F714-F750 HydrophobicContact CE1-CD1 3.58Å; F714-F750 HydrophobicContact CE1-CE1 4.17Å; F714-F750 HydrophobicContact CE1-CG 4.14Å; F714-F750 HydrophobicContact CE2-CB 4.1Å; F714-F750 HydrophobicContact CE2-CD1 4.11Å; F714-F750 HydrophobicContact CE2-CD2 4.31Å; F714-F750 AromaticContact CE2-CG 3.93Å; F714-F750 HydrophobicContact CE2-CG 3.93Å; F714-F750 AromaticContact CG-CD1 3.53Å; F714-F750 HydrophobicContact CG-CD1 3.53Å; F714-F750 HydrophobicContact CG-CD2 4.38Å; F714-F750 AromaticContact CG-CE1 3.36Å; F714-F750 HydrophobicContact CG-CE1 3.36Å; F714-F750 HydrophobicContact CG-CE2 4.23Å; F714-F750 HydrophobicContact CG-CG 4.06Å; F714-F750 AromaticContact CG-CZ 3.73Å; F714-F750 HydrophobicContact CG-CZ 3.73Å; F714-F750 HydrophobicContact CZ-CB 3.96Å; F714-F750 AromaticContact CZ-CD1 3.96Å; F714-F750 HydrophobicContact CZ-CD1 3.96Å; F714-F750 HydrophobicContact CZ-CG 4.03Å; F714-V754 HydrophobicContact CE1-CG2 4.36Å; F714-V754 HydrophobicContact CZ-CG2 3.98Å
715	W	98.2	Very high	95	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.7	-38.3	-176.6	-76.4	114	0	0	0	113.2	H711 F712 L713 R718 S719 Q753 V754 P804 I888 T890	H711-W715 AromaticContact CE1-CD1 3.85Å; H711-W715 AromaticContact CE1-NE1 3.59Å; H711-W715 AromaticContact NE2-CD1 3.72Å; H711-W715 AromaticContact NE2-NE1 3.87Å; H711-W715 PolarHBondContact O-N 2.85Å; F712-W715 PolarHBondContact O-N 3.24Å; L713-W715 PolarHBondContact O-N 2.96Å; W715-R718 PolarHBondContact O-N 3.36Å; W715-S719 VanDerWaalsContact O-CB 3.27Å; W715-S719 WeakPolarHBondContact O-CB 3.31Å; W715-S719 PolarHBondContact O-N 2.89Å; W715-S719 PolarHBondContact O-OG 2.77Å; W715-Q753 HydrophobicContact CH2-CB 4.28Å; W715-Q753 HydrophobicContact CZ2-CB 3.61Å; W715-Q753 HydrophobicContact CZ2-CG 4.46Å; W715-Q753 VanDerWaalsContact CZ2-OE1 3.25Å; W715-V754 HydrophobicContact CH2-CG2 4.19Å; W715-P804 HydrophobicContact CZ2-CB 4.34Å; W715-P804 HydrophobicContact CZ2-CG 4.2Å; W715-I888 HydrophobicContact CB-CD1 3.49Å; W715-I888 VanDerWaalsContact CB-CD1 3.49Å; W715-I888 HydrophobicContact CB-CG1 4.08Å; W715-I888 HydrophobicContact CG-CD1 3.7Å; W715-I888 HydrophobicContact CG-CG1 4.49Å; W715-T890 HydrophobicContact CD2-CG2 4.44Å; W715-T890 HydrophobicContact CE3-CG2 3.9Å; W715-T890 HydrophobicContact CH2-CG2 4.31Å; W715-T890 HydrophobicContact CZ3-CG2 3.82Å
716	F	97.1	Very high	94.7	Very high	23 Å²	23	18.7 Å²	18.7	10%	0.101	10%	0.095	C	C	.	.	H	α-helix	trans	-63.4	-46.8	176.6	-63.1	-10	0	0	0	110.9	L678 L679 V682 F712 L713 S719 E720 M860	L678-F716 HydrophobicContact CB-CE2 4.03Å; L678-F716 HydrophobicContact CD2-CD2 4.12Å; L678-F716 HydrophobicContact CD2-CE2 3.89Å; L678-F716 HydrophobicContact CG-CD2 3.92Å; L678-F716 HydrophobicContact CG-CE2 3.83Å; L679-F716 HydrophobicContact CB-CD2 4.5Å; L679-F716 HydrophobicContact CB-CE2 4.13Å; L679-F716 HydrophobicContact CD1-CD1 4.4Å; L679-F716 HydrophobicContact CD1-CD2 4.22Å; L679-F716 HydrophobicContact CD1-CE2 4.41Å; L679-F716 HydrophobicContact CD1-CG 4.22Å; V682-F716 HydrophobicContact CG1-CB 4.22Å; V682-F716 HydrophobicContact CG2-CB 4.28Å; V682-F716 HydrophobicContact CG2-CD2 4.31Å; F712-F716 HydrophobicContact CB-CE2 4.18Å; F712-F716 HydrophobicContact CB-CZ 4.1Å; F712-F716 HydrophobicContact CD1-CE1 4.39Å; F712-F716 HydrophobicContact CD1-CZ 4.28Å; F712-F716 WeakPolarHBondContact O-CB 3.38Å; F712-F716 WeakPolarHBondContact O-CD1 3.4Å; F712-F716 WeakPolarHBondContact O-CG 3.43Å; F712-F716 PolarHBondContact O-N 3.5Å; L713-F716 PolarHBondContact O-N 3.5Å; F716-S719 PolarHBondContact O-OG 2.81Å; F716-E720 PolarHBondContact O-N 2.79Å; F716-M860 HydrophobicContact CD1-CE 3.6Å; F716-M860 HydrophobicContact CE1-CE 3.35Å; F716-M860 HydrophobicContact CZ-CE 4.33Å
717	L	97.6	Very high	94.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64	-48.4	175.9	-66.1	175.8	0	0	0	112.2	V682 L713 F714 S719 E720 I721 Y731 L734 L735	V682-L717 HydrophobicContact CG1-CD2 4.02Å; L713-L717 HydrophobicContact CD1-CD1 3.85Å; L713-L717 HydrophobicContact CD1-CD2 4.47Å; L713-L717 HydrophobicContact CD1-CG 3.96Å; L713-L717 HydrophobicContact CD2-CD1 4.29Å; L713-L717 HydrophobicContact CG-CD1 3.74Å; L713-L717 HydrophobicContact CG-CG 4.22Å; L713-L717 WeakPolarHBondContact O-CB 3.39Å; L713-L717 VanDerWaalsContact O-CG 3.23Å; L713-L717 WeakPolarHBondContact O-CG 3.49Å; L713-L717 PolarHBondContact O-N 2.81Å; F714-L717 PolarHBondContact O-N 3Å; L717-S719 VanDerWaalsContact C-N 3.32Å; L717-S719 PolarHBondContact O-N 2.6Å; L717-E720 PolarHBondContact O-N 3.49Å; L717-I721 VanDerWaalsContact O-CG1 3.23Å; L717-I721 WeakPolarHBondContact O-CG1 3.27Å; L717-I721 PolarHBondContact O-N 3.05Å; L717-Y731 HydrophobicContact CD2-CD1 3.19Å; L717-Y731 HydrophobicContact CD2-CE1 3.76Å; L717-Y731 HydrophobicContact CD2-CG 3.85Å; L717-L734 HydrophobicContact CD1-CB 4.43Å; L717-L734 HydrophobicContact CD1-CD2 3.99Å; L717-L734 HydrophobicContact CD1-CG 3.86Å; L717-L734 HydrophobicContact CD2-CD2 4.08Å; L717-L735 HydrophobicContact CB-CB 4.46Å; L717-L735 HydrophobicContact CB-CD1 4.34Å; L717-L735 HydrophobicContact CB-CD2 4.38Å; L717-L735 HydrophobicContact CD1-CB 4.12Å; L717-L735 HydrophobicContact CD1-CD1 4.1Å
718	R	96.6	Very high	94.4	Very high	21 Å²	21	19 Å²	19	8%	0.079	10%	0.096	C	C	.	.	H	α-helix	trans	-61	-40	-177.8	-170.3	179.4	-170.2	-79.4	-1.6	112.6	L159 F714 W715 I721 A722 L735 T890	L159-R718 WeakPolarHBondContact O-CD 3.44Å; L159-R718 PolarHBondContact O-NE 2.98Å; F714-R718 WeakPolarHBondContact O-CB 3.27Å; F714-R718 PolarHBondContact O-N 2.77Å; W715-R718 PolarHBondContact O-N 3.36Å; R718-I721 PolarHBondContact O-N 2.94Å; R718-A722 PolarHBondContact O-N 3.02Å; R718-A722 VanDerWaalsContact O-N 3.13Å; R718-L735 HydrophobicContact CB-CD2 4.33Å; R718-T890 PolarHBondContact NH1-O 3.22Å
719	S	93.3	Very high	94.1	Very high	4 Å²	4	18 Å²	18	3%	0.028	9%	0.093	C	C	.	.	H	α-helix	trans	-61.4	-43.1	176.7	73.3	0	0	0	0	112.2	W715 F716 L717 A722 Q723	W715-S719 VanDerWaalsContact O-CB 3.27Å; W715-S719 WeakPolarHBondContact O-CB 3.31Å; W715-S719 PolarHBondContact O-N 2.89Å; W715-S719 PolarHBondContact O-OG 2.77Å; F716-S719 PolarHBondContact O-OG 2.81Å; L717-S719 VanDerWaalsContact C-N 3.32Å; L717-S719 PolarHBondContact O-N 2.6Å; S719-A722 PolarHBondContact O-N 3.4Å; S719-Q723 WeakPolarHBondContact O-CB 3.44Å; S719-Q723 VanDerWaalsContact O-CG 3.26Å; S719-Q723 WeakPolarHBondContact O-CG 3.35Å; S719-Q723 PolarHBondContact O-N 3.11Å
720	E	91.8	Very high	93.9	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-71.6	-38.3	178	-72.5	-70.8	155.9	0	0	112.5	Q683 K686 F716 L717 A722 Q723 S724 Y731 R857	Q683-E720 PolarHBondContact NE2-OE1 3.22Å; K686-E720 WeakPolarHBondContact CE-OE2 3.45Å; K686-E720 IonicContact NZ-OE1 3.88Å; K686-E720 IonicContact NZ-OE2 3.86Å; K686-E720 PolarHBondContact NZ-OE2 2.83Å; F716-E720 PolarHBondContact O-N 2.79Å; L717-E720 PolarHBondContact O-N 3.49Å; E720-A722 VanDerWaalsContact C-N 3.27Å; E720-A722 PolarHBondContact O-N 3.09Å; E720-Q723 PolarHBondContact O-N 2.91Å; E720-Q723 VanDerWaalsContact O-N 3.14Å; E720-S724 PolarHBondContact O-N 2.77Å; E720-Y731 HydrophobicContact CB-CD2 3.71Å; E720-Y731 HydrophobicContact CB-CE2 3.66Å; E720-Y731 HydrophobicContact CG-CE2 4.08Å; E720-R857 VanDerWaalsContact OE1-CD 3.28Å; E720-R857 WeakPolarHBondContact OE1-CD 3.41Å; E720-R857 IonicContact OE1-CZ 2.79Å; E720-R857 IonicContact OE1-NE 3.23Å; E720-R857 IonicContact OE1-NH1 3.5Å; E720-R857 PolarHBondContact OE1-NH1 2.84Å; E720-R857 IonicContact OE2-NH1 3.2Å; E720-R857 PolarHBondContact OE2-NH1 2.95Å
721	I	94.4	Very high	93.8	Very high	6 Å²	6	18.6 Å²	18.6	3%	0.031	10%	0.095	C	C	.	.	H	α-helix	trans	-57.6	-42.6	173.7	-68.8	163.6	0	0	0	110.5	I160 Y162 L717 R718 Q723 Q728 A732 L735	I160-I721 HydrophobicContact CG2-CD1 3.97Å; Y162-I721 HydrophobicContact CG-CG2 4.48Å; L717-I721 VanDerWaalsContact O-CG1 3.23Å; L717-I721 WeakPolarHBondContact O-CG1 3.27Å; L717-I721 PolarHBondContact O-N 3.05Å; R718-I721 PolarHBondContact O-N 2.94Å; I721-Q723 VanDerWaalsContact C-N 3.31Å; I721-Q723 PolarHBondContact O-N 2.85Å; I721-Q728 HydrophobicContact CG2-CB 4.34Å; I721-A732 HydrophobicContact CD1-CB 4.06Å; I721-A732 HydrophobicContact CG1-CB 4.45Å; I721-L735 HydrophobicContact CD1-CB 4.34Å; I721-L735 HydrophobicContact CD1-CD2 3.74Å
722	A	89.9	Confident	93.7	Very high	46 Å²	46	18.4 Å²	18.4	38%	0.38	10%	0.095	S	C	.	.	H	α-helix	trans	-72.5	-21.6	179.7	0	0	0	0	0	113.9	R718 S719 E720 N892	R718-A722 PolarHBondContact O-N 3.02Å; R718-A722 VanDerWaalsContact O-N 3.13Å; S719-A722 PolarHBondContact O-N 3.4Å; E720-A722 VanDerWaalsContact C-N 3.27Å; E720-A722 PolarHBondContact O-N 3.09Å; A722-N892 HydrophobicContact CB-CB 4.19Å; A722-N892 WeakPolarHBondContact O-CB 3.31Å
723	Q	84.6	Confident	93.6	Very high	39 Å²	39	17 Å²	17	18%	0.182	9%	0.089	C	C	.	.	H	α-helix	trans	-108.9	-34.8	-170.6	-71.8	-176.7	15.9	0	0	114.4	S719 E720 I721 S889 G891 N892	S719-Q723 WeakPolarHBondContact O-CB 3.44Å; S719-Q723 VanDerWaalsContact O-CG 3.26Å; S719-Q723 WeakPolarHBondContact O-CG 3.35Å; S719-Q723 PolarHBondContact O-N 3.11Å; E720-Q723 PolarHBondContact O-N 2.91Å; E720-Q723 VanDerWaalsContact O-N 3.14Å; I721-Q723 VanDerWaalsContact C-N 3.31Å; I721-Q723 PolarHBondContact O-N 2.85Å; Q723-S889 PolarHBondContact NE2-OG 2.86Å; Q723-G891 PolarHBondContact NE2-O 2.76Å; Q723-N892 HydrophobicContact CG-CB 4.03Å
724	S	86.4	Confident	93.6	Very high	11 Å²	11	17.1 Å²	17.1	8%	0.077	9%	0.09	C	C	.	.			trans	-116.7	99.2	-169.8	-174.8	0	0	0	0	112.3	E720 H726 Y727 Q728	E720-S724 PolarHBondContact O-N 2.77Å; S724-H726 PolarHBondContact O-N 2.95Å; S724-Y727 PolarHBondContact O-N 3.13Å; S724-Q728 WeakPolarHBondContact O-CB 3.5Å; S724-Q728 PolarHBondContact O-N 3.47Å
725	M	89	Confident	93.5	Very high	111 Å²	111	17.1 Å²	17.1	55%	0.547	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.5	174.1	-67.3	-178.2	173.5	0	0	113.1	W493 P517 Y727	W493-M725 HydrophobicContact CH2-CB 3.97Å; W493-M725 HydrophobicContact CZ3-CB 3.98Å; P517-M725 HydrophobicContact CG-SD 4.44Å; M725-Y727 VanDerWaalsContact C-N 3.27Å; M725-Y727 PolarHBondContact O-N 3.3Å
726	H	90.3	Very high	93.5	Very high	34 Å²	34	17.3 Å²	17.3	16%	0.157	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-26.8	179.5	-56.1	96.6	0	0	0	113.2	Y471 W493 D509 T512 A514 S724	Y471-H726 PolarHBondContact OH-NE2 2.92Å; W493-H726 AromaticContact CD2-CD2 3.41Å; W493-H726 VanDerWaalsContact CD2-CD2 3.41Å; W493-H726 AromaticContact CD2-NE2 3.53Å; W493-H726 AromaticContact CE2-CD2 3.54Å; W493-H726 AromaticContact CE3-CD2 3.58Å; W493-H726 AromaticContact CE3-NE2 3.4Å; W493-H726 AromaticContact CG-CD2 3.94Å; W493-H726 AromaticContact CG-NE2 3.92Å; W493-H726 AromaticContact CH2-CD2 3.99Å; W493-H726 AromaticContact CZ2-CD2 3.84Å; W493-H726 AromaticContact CZ3-CD2 3.87Å; W493-H726 AromaticContact CZ3-NE2 3.94Å; D509-H726 IonicContact OD1-CE1 3.77Å; D509-H726 IonicContact OD1-CG 2.6Å; D509-H726 IonicContact OD1-ND1 3.67Å; D509-H726 PolarHBondContact OD1-ND1 2.9Å; D509-H726 IonicContact OD2-CE1 3.26Å; D509-H726 IonicContact OD2-ND1 2.78Å; T512-H726 HydrophobicContact CG2-CB 4.08Å; T512-H726 PolarHBondContact OG1-O 3.39Å; A514-H726 WeakPolarHBondContact CB-O 3.45Å; S724-H726 PolarHBondContact O-N 2.95Å
727	Y	91.6	Very high	93.4	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.016	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-3.5	-171.5	-66.6	-75.8	0	0	0	114.4	A508 T512 K686 S724 M725 Q729 R730 Y731	A508-Y727 PolarHBondContact O-OH 3.28Å; T512-Y727 PolarHBondContact N-OH 2.95Å; K686-Y727 HydrophobicContact CB-CD1 4.24Å; K686-Y727 HydrophobicContact CB-CD2 4.39Å; K686-Y727 HydrophobicContact CB-CE1 3.83Å; K686-Y727 HydrophobicContact CB-CE2 4Å; K686-Y727 HydrophobicContact CD-CD2 3.94Å; K686-Y727 HydrophobicContact CD-CE2 4.01Å; K686-Y727 HydrophobicContact CD-CG 4.46Å; K686-Y727 HydrophobicContact CG-CD1 4.07Å; K686-Y727 HydrophobicContact CG-CD2 3.84Å; K686-Y727 HydrophobicContact CG-CE1 4.14Å; K686-Y727 HydrophobicContact CG-CE2 3.93Å; K686-Y727 HydrophobicContact CG-CG 3.92Å; K686-Y727 WeakPolarHBondContact O-CE1 3.45Å; K686-Y727 PolarHBondContact O-OH 2.94Å; S724-Y727 PolarHBondContact O-N 3.13Å; M725-Y727 VanDerWaalsContact C-N 3.27Å; M725-Y727 PolarHBondContact O-N 3.3Å; Y727-Q729 VanDerWaalsContact C-N 3.28Å; Y727-Q729 PolarHBondContact O-N 3.2Å; Y727-R730 PolarHBondContact O-N 3.32Å; Y727-R730 VanDerWaalsContact O-N 3.1Å; Y727-Y731 PolarHBondContact O-N 3.49Å; Y727-Y731 VanDerWaalsContact O-N 3.1Å
728	Q	92.5	Very high	93.4	Very high	27 Å²	27	16.5 Å²	16.5	13%	0.126	9%	0.088	C	C	.	.	H	α-helix	trans	-51.4	-42.8	-177.9	67.8	-173.7	17	0	0	113.3	Y162 I721 S724 R730 Y731 A732	Y162-Q728 HydrophobicContact CD2-CG 4.36Å; Y162-Q728 HydrophobicContact CE2-CG 4.12Å; I721-Q728 HydrophobicContact CG2-CB 4.34Å; S724-Q728 WeakPolarHBondContact O-CB 3.5Å; S724-Q728 PolarHBondContact O-N 3.47Å; Q728-R730 PolarHBondContact O-N 2.89Å; Q728-Y731 PolarHBondContact O-N 3.12Å; Q728-A732 WeakPolarHBondContact O-CB 3.39Å; Q728-A732 PolarHBondContact O-N 3.48Å
729	Q	92.6	Very high	93.4	Very high	13 Å²	13	15.5 Å²	15.5	6%	0.061	8%	0.084	C	C	.	.	H	α-helix	trans	-62	-45.8	-179.8	-73.2	170.7	-37.7	0	0	111.7	Y162 N169 L175 Y727 A732 V733	Y162-Q729 HydrophobicContact CE1-CG 4.1Å; Y162-Q729 WeakPolarHBondContact OH-CG 3.41Å; N169-Q729 PolarHBondContact O-NE2 2.77Å; L175-Q729 HydrophobicContact CD1-CB 3.86Å; L175-Q729 HydrophobicContact CD1-CG 4.11Å; L175-Q729 HydrophobicContact CD2-CB 4.01Å; Y727-Q729 VanDerWaalsContact C-N 3.28Å; Y727-Q729 PolarHBondContact O-N 3.2Å; Q729-A732 PolarHBondContact O-N 2.92Å; Q729-V733 WeakPolarHBondContact O-CG2 3.34Å; Q729-V733 PolarHBondContact O-N 2.81Å; Q729-V733 VanDerWaalsContact O-N 3.17Å
730	R	94.1	Very high	93.5	Very high	11 Å²	11	16.6 Å²	16.6	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-62.6	-49.7	179.6	-177.5	174.8	-68.5	-179.2	-5.6	111.2	V685 E688 P689 H691 Y727 Q728 A732 V733 L734	V685-R730 HydrophobicContact CG1-CG 4.14Å; V685-R730 PolarHBondContact O-NH1 2.82Å; E688-R730 VanDerWaalsContact O-CZ 3.26Å; E688-R730 PolarHBondContact O-NH1 3.3Å; E688-R730 PolarHBondContact O-NH2 3Å; P689-R730 PolarHBondContact O-NH2 2.93Å; H691-R730 VanDerWaalsContact ND1-CB 3.32Å; H691-R730 WeakPolarHBondContact ND1-CB 3.46Å; H691-R730 WeakPolarHBondContact ND1-CG 3.39Å; H691-R730 PolarHBondContact ND1-NE 3.43Å; Y727-R730 PolarHBondContact O-N 3.32Å; Y727-R730 VanDerWaalsContact O-N 3.1Å; Q728-R730 PolarHBondContact O-N 2.89Å; R730-A732 VanDerWaalsContact C-N 3.33Å; R730-A732 PolarHBondContact O-N 3.39Å; R730-V733 PolarHBondContact O-N 2.95Å; R730-L734 PolarHBondContact O-N 3.37Å
731	Y	96.3	Very high	93.6	Very high	1 Å²	1	16.5 Å²	16.5	0%	0.004	9%	0.087	C	C	.	.	H	α-helix	trans	-67.2	-35.2	-179.1	-71.7	-45.4	0	0	0	112.3	V682 V685 K686 L717 E720 Y727 Q728 L734 L735	V682-Y731 HydrophobicContact CG1-CE1 4.06Å; V682-Y731 WeakPolarHBondContact O-CE1 3.49Å; V682-Y731 PolarHBondContact O-OH 3.32Å; V685-Y731 HydrophobicContact CB-CE1 3.94Å; V685-Y731 HydrophobicContact CG1-CD1 4.4Å; V685-Y731 HydrophobicContact CG1-CE1 3.94Å; K686-Y731 WeakPolarHBondContact CE-OH 3.31Å; K686-Y731 HydrophobicContact CG-CE2 4.43Å; K686-Y731 VanDerWaalsContact CG-OH 3.31Å; K686-Y731 WeakPolarHBondContact CG-OH 3.42Å; L717-Y731 HydrophobicContact CD2-CD1 3.19Å; L717-Y731 HydrophobicContact CD2-CE1 3.76Å; L717-Y731 HydrophobicContact CD2-CG 3.85Å; E720-Y731 HydrophobicContact CB-CD2 3.71Å; E720-Y731 HydrophobicContact CB-CE2 3.66Å; E720-Y731 HydrophobicContact CG-CE2 4.08Å; Y727-Y731 PolarHBondContact O-N 3.49Å; Y727-Y731 VanDerWaalsContact O-N 3.1Å; Q728-Y731 PolarHBondContact O-N 3.12Å; Y731-L734 PolarHBondContact O-N 3.35Å; Y731-L735 WeakPolarHBondContact O-CB 3.4Å; Y731-L735 PolarHBondContact O-N 3.05Å
732	A	96.3	Very high	93.7	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.1	-39.2	177.4	0	0	0	0	0	112.3	I160 Y162 V164 I721 Q728 Q729 R730 L735 E736	I160-A732 HydrophobicContact CG2-CB 3.77Å; Y162-A732 HydrophobicContact CD1-CB 3.58Å; Y162-A732 HydrophobicContact CE1-CB 4.41Å; Y162-A732 HydrophobicContact CG-CB 4.22Å; V164-A732 HydrophobicContact CG1-CB 3.55Å; V164-A732 WeakPolarHBondContact CG1-O 3.22Å; I721-A732 HydrophobicContact CD1-CB 4.06Å; I721-A732 HydrophobicContact CG1-CB 4.45Å; Q728-A732 WeakPolarHBondContact O-CB 3.39Å; Q728-A732 PolarHBondContact O-N 3.48Å; Q729-A732 PolarHBondContact O-N 2.92Å; R730-A732 VanDerWaalsContact C-N 3.33Å; R730-A732 PolarHBondContact O-N 3.39Å; A732-L735 PolarHBondContact O-N 3.38Å; A732-E736 WeakPolarHBondContact O-CB 3.3Å; A732-E736 PolarHBondContact O-N 2.95Å
733	V	95.9	Very high	93.9	Very high	5 Å²	5	14.2 Å²	14.2	3%	0.03	7%	0.069	C	C	.	.	H	α-helix	trans	-64.4	-42.6	174.9	169.4	0	0	0	0	112.1	L175 T178 R179 L182 Q729 R730 A737	L175-V733 HydrophobicContact CD2-CG2 3.79Å; T178-V733 HydrophobicContact CG2-CG1 3.83Å; R179-V733 HydrophobicContact CG-CB 4.33Å; R179-V733 HydrophobicContact CG-CG1 3.7Å; R179-V733 HydrophobicContact CG-CG2 3.79Å; L182-V733 HydrophobicContact CD1-CG1 4.05Å; Q729-V733 WeakPolarHBondContact O-CG2 3.34Å; Q729-V733 PolarHBondContact O-N 2.81Å; Q729-V733 VanDerWaalsContact O-N 3.17Å; R730-V733 PolarHBondContact O-N 2.95Å; V733-A737 PolarHBondContact O-N 2.8Å
734	L	97.6	Very high	94.3	Very high	3 Å²	3	15.2 Å²	15.2	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-63.8	-42.7	174.5	174.1	55	0	0	0	111.3	V696 L700 L717 R730 Y731 A737 Y738	V696-L734 HydrophobicContact CG1-CB 4.48Å; V696-L734 HydrophobicContact CG1-CD1 3.94Å; V696-L734 HydrophobicContact CG1-CD2 4.35Å; V696-L734 HydrophobicContact CG1-CG 4.48Å; L700-L734 HydrophobicContact CB-CD1 3.88Å; L700-L734 HydrophobicContact CD1-CD1 4.41Å; L717-L734 HydrophobicContact CD1-CB 4.43Å; L717-L734 HydrophobicContact CD1-CD2 3.99Å; L717-L734 HydrophobicContact CD1-CG 3.86Å; L717-L734 HydrophobicContact CD2-CD2 4.08Å; R730-L734 PolarHBondContact O-N 3.37Å; Y731-L734 PolarHBondContact O-N 3.35Å; L734-A737 PolarHBondContact O-N 3.33Å; L734-Y738 PolarHBondContact O-N 3Å
735	L	98.2	Very high	94.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.8	-40.8	179.4	-170.7	56.8	0	0	0	111.8	I160 F714 L717 R718 I721 Y731 A732 A737 Y738 L739	I160-L735 HydrophobicContact CB-CD2 4.24Å; I160-L735 HydrophobicContact CG1-CB 4.39Å; I160-L735 HydrophobicContact CG1-CD2 3.96Å; I160-L735 HydrophobicContact CG1-CG 3.99Å; I160-L735 HydrophobicContact CG2-CD2 4.23Å; F714-L735 HydrophobicContact CB-CD1 4.35Å; F714-L735 HydrophobicContact CD2-CD1 3.71Å; F714-L735 HydrophobicContact CE2-CD1 4.44Å; F714-L735 HydrophobicContact CG-CD1 4.37Å; L717-L735 HydrophobicContact CB-CB 4.46Å; L717-L735 HydrophobicContact CB-CD1 4.34Å; L717-L735 HydrophobicContact CB-CD2 4.38Å; L717-L735 HydrophobicContact CD1-CB 4.12Å; L717-L735 HydrophobicContact CD1-CD1 4.1Å; R718-L735 HydrophobicContact CB-CD2 4.33Å; I721-L735 HydrophobicContact CD1-CB 4.34Å; I721-L735 HydrophobicContact CD1-CD2 3.74Å; Y731-L735 WeakPolarHBondContact O-CB 3.4Å; Y731-L735 PolarHBondContact O-N 3.05Å; A732-L735 PolarHBondContact O-N 3.38Å; L735-A737 VanDerWaalsContact C-N 3.35Å; L735-A737 PolarHBondContact O-N 3.44Å; L735-Y738 HydrophobicContact CD1-CD1 4.19Å; L735-Y738 PolarHBondContact O-N 3.43Å; L735-L739 HydrophobicContact CD1-CG 4.32Å; L735-L739 HydrophobicContact CG-CD1 4.11Å; L735-L739 HydrophobicContact CG-CG 4.37Å; L735-L739 WeakPolarHBondContact O-CB 3.5Å; L735-L739 VanDerWaalsContact O-CG 3.29Å; L735-L739 WeakPolarHBondContact O-CG 3.49Å; L735-L739 PolarHBondContact O-N 3.05Å
736	E	96.8	Very high	95	Very high	4 Å²	4	11.9 Å²	11.9	2%	0.019	6%	0.057	C	C	.	.	H	α-helix	trans	-58.6	-46.9	172.2	-178	-170.1	-159.1	0	0	111.1	Q153 L156 I160 V164 R179 A732 Y738 L739 R740	Q153-E736 PolarHBondContact NE2-OE1 3.21Å; Q153-E736 PolarHBondContact OE1-OE1 3.01Å; Q153-E736 VanDerWaalsContact OE1-OE1 3.09Å; L156-E736 HydrophobicContact CD1-CG 4.45Å; I160-E736 HydrophobicContact CD1-CB 3.87Å; V164-E736 HydrophobicContact CG1-CB 4.27Å; V164-E736 HydrophobicContact CG2-CB 4.43Å; V164-E736 HydrophobicContact CG2-CG 4.26Å; V164-E736 WeakPolarHBondContact CG2-OE2 3.38Å; R179-E736 IonicContact CZ-OE1 3.9Å; R179-E736 IonicContact CZ-OE2 3.4Å; R179-E736 IonicContact NE-OE1 3.38Å; R179-E736 IonicContact NE-OE2 2.7Å; R179-E736 PolarHBondContact NE-OE2 2.88Å; R179-E736 IonicContact NH2-OE1 2.73Å; R179-E736 PolarHBondContact NH2-OE1 3.48Å; R179-E736 IonicContact NH2-OE2 3.53Å; R179-E736 PolarHBondContact NH2-OE2 2.94Å; A732-E736 WeakPolarHBondContact O-CB 3.3Å; A732-E736 PolarHBondContact O-N 2.95Å; E736-Y738 VanDerWaalsContact C-N 3.28Å; E736-Y738 PolarHBondContact O-N 3.44Å; E736-L739 PolarHBondContact O-N 3.43Å; E736-R740 HydrophobicContact CG-CG 4.44Å; E736-R740 WeakPolarHBondContact O-CB 3.39Å; E736-R740 WeakPolarHBondContact O-CG 3.45Å; E736-R740 PolarHBondContact O-N 3.27Å; E736-R740 VanDerWaalsContact O-N 3.08Å; E736-R740 IonicContact OE1-CZ 3.33Å; E736-R740 IonicContact OE1-NE 3.49Å; E736-R740 PolarHBondContact OE1-NE 3.38Å; E736-R740 VanDerWaalsContact OE1-NE 3.11Å; E736-R740 IonicContact OE1-NH2 3.91Å; E736-R740 PolarHBondContact OE1-NH2 3.2Å
737	A	95.9	Very high	95.3	Very high	6 Å²	6	10.3 Å²	10.3	5%	0.05	5%	0.05	C	C	.	.	H	α-helix	trans	-59.3	-41.4	179.9	0	0	0	0	0	111.7	L182 R186 L700 V733 L734 L735	L182-A737 HydrophobicContact CB-CB 3.92Å; L182-A737 HydrophobicContact CD1-CB 3.87Å; R186-A737 VanDerWaalsContact CD-O 3.28Å; R186-A737 WeakPolarHBondContact CD-O 3.3Å; R186-A737 PolarHBondContact NH1-O 2.73Å; L700-A737 HydrophobicContact CD1-CB 4.04Å; L700-A737 HydrophobicContact CD2-CB 3.97Å; V733-A737 PolarHBondContact O-N 2.8Å; L734-A737 PolarHBondContact O-N 3.33Å; L735-A737 VanDerWaalsContact C-N 3.35Å; L735-A737 PolarHBondContact O-N 3.44Å
738	Y	98	Very high	95.5	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-67.1	-50.3	175.6	167.5	-108.3	0	0	0	112.7	A703 L704 G710 F714 L734 L735 E736 R740 G741 C742 M746 F750	A703-Y738 HydrophobicContact CB-CD2 3.76Å; A703-Y738 HydrophobicContact CB-CE2 3.89Å; L704-Y738 HydrophobicContact CD2-CD2 4.01Å; L704-Y738 HydrophobicContact CD2-CE2 4.48Å; L704-Y738 HydrophobicContact CG-CD2 4.39Å; G710-Y738 VanDerWaalsContact CA-CZ 3.48Å; G710-Y738 VanDerWaalsContact CA-OH 3.22Å; G710-Y738 WeakPolarHBondContact CA-OH 3.43Å; G710-Y738 WeakPolarHBondContact O-CE1 3.41Å; G710-Y738 PolarHBondContact O-OH 2.98Å; F714-Y738 HydrophobicContact CB-CE1 4.17Å; L734-Y738 PolarHBondContact O-N 3Å; L735-Y738 HydrophobicContact CD1-CD1 4.19Å; L735-Y738 PolarHBondContact O-N 3.43Å; E736-Y738 VanDerWaalsContact C-N 3.28Å; E736-Y738 PolarHBondContact O-N 3.44Å; Y738-R740 PolarHBondContact O-N 3.46Å; Y738-G741 CarbonylContact O-C 3.59Å; Y738-G741 WeakPolarHBondContact O-CA 3.32Å; Y738-G741 PolarHBondContact O-N 2.92Å; Y738-C742 HydrophobicContact CD2-CB 4.28Å; Y738-C742 HydrophobicContact CE1-CB 4.1Å; Y738-C742 HydrophobicContact CE2-CB 3.66Å; Y738-C742 PolarHBondContact O-N 2.94Å; Y738-M746 WeakPolarHBondContact OH-CE 3.34Å; Y738-F750 AromaticContact CE1-CE2 3.71Å; Y738-F750 HydrophobicContact CE1-CE2 3.71Å; Y738-F750 AromaticContact CE1-CZ 3.95Å; Y738-F750 HydrophobicContact CE1-CZ 3.95Å
739	L	96.9	Very high	95.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62	-30.9	-177.1	-71.2	175.9	0	0	0	112.8	L156 L159 I160 F714 L735 E736 G741 C742 L747 F750	L156-L739 HydrophobicContact CD2-CB 3.75Å; L156-L739 HydrophobicContact CD2-CD1 4.31Å; L159-L739 HydrophobicContact CB-CD1 4.01Å; L159-L739 HydrophobicContact CD1-CD1 4.43Å; L159-L739 HydrophobicContact CD1-CD2 4.47Å; I160-L739 HydrophobicContact CD1-CD1 4.32Å; I160-L739 HydrophobicContact CG1-CD1 3.71Å; F714-L739 HydrophobicContact CD2-CD2 3.84Å; F714-L739 HydrophobicContact CE2-CD1 4.42Å; F714-L739 HydrophobicContact CE2-CD2 3.98Å; L735-L739 HydrophobicContact CD1-CG 4.32Å; L735-L739 HydrophobicContact CG-CD1 4.11Å; L735-L739 HydrophobicContact CG-CG 4.37Å; L735-L739 WeakPolarHBondContact O-CB 3.5Å; L735-L739 VanDerWaalsContact O-CG 3.29Å; L735-L739 WeakPolarHBondContact O-CG 3.49Å; L735-L739 PolarHBondContact O-N 3.05Å; E736-L739 PolarHBondContact O-N 3.43Å; L739-G741 PolarHBondContact O-N 2.91Å; L739-C742 PolarHBondContact O-SG 3.08Å; L739-C742 VanDerWaalsContact O-SG 3.41Å; L739-L747 HydrophobicContact CB-CD2 4.08Å; L739-L747 HydrophobicContact CD2-CD2 3.91Å; L739-F750 HydrophobicContact CD2-CD2 3.9Å; L739-F750 HydrophobicContact CD2-CE2 4.22Å
740	R	94.4	Very high	95.9	Very high	26 Å²	26	12.3 Å²	12.3	10%	0.098	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4.2	173.3	-72.8	176.7	172.4	-75.8	1.7	114.1	Y152 L156 V320 E736 Y738	Y152-R740 HydrophobicContact CE1-CG 4.3Å; L156-R740 HydrophobicContact CD1-CG 3.48Å; L156-R740 VanDerWaalsContact CD1-CG 3.48Å; V320-R740 WeakPolarHBondContact CG1-O 3.43Å; E736-R740 HydrophobicContact CG-CG 4.44Å; E736-R740 WeakPolarHBondContact O-CB 3.39Å; E736-R740 WeakPolarHBondContact O-CG 3.45Å; E736-R740 PolarHBondContact O-N 3.27Å; E736-R740 VanDerWaalsContact O-N 3.08Å; E736-R740 IonicContact OE1-CZ 3.33Å; E736-R740 IonicContact OE1-NE 3.49Å; E736-R740 PolarHBondContact OE1-NE 3.38Å; E736-R740 VanDerWaalsContact OE1-NE 3.11Å; E736-R740 IonicContact OE1-NH2 3.91Å; E736-R740 PolarHBondContact OE1-NH2 3.2Å; Y738-R740 PolarHBondContact O-N 3.46Å
741	G	94.6	Very high	96.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-8.8	179.5	0	0	0	0	0	115.1	L190 R193 L704 Y738 L739 G743	L190-G741 WeakPolarHBondContact CD2-O 3.44Å; R193-G741 PolarHBondContact NH1-O 2.82Å; L704-G741 WeakPolarHBondContact CD2-O 3.39Å; Y738-G741 CarbonylContact O-C 3.59Å; Y738-G741 WeakPolarHBondContact O-CA 3.32Å; Y738-G741 PolarHBondContact O-N 2.92Å; L739-G741 PolarHBondContact O-N 2.91Å; G741-G743 PolarHBondContact O-N 3.35Å
742	C	95.4	Very high	96.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-72.6	-14.6	-176.5	65	0	0	0	0	114.1	Y198 Y738 L739 M746	Y198-C742 WeakPolarHBondContact CE1-O 3.42Å; Y198-C742 WeakPolarHBondContact OH-CA 3.46Å; Y198-C742 PolarHBondContact OH-O 3.22Å; Y738-C742 HydrophobicContact CD2-CB 4.28Å; Y738-C742 HydrophobicContact CE1-CB 4.1Å; Y738-C742 HydrophobicContact CE2-CB 3.66Å; Y738-C742 PolarHBondContact O-N 2.94Å; L739-C742 PolarHBondContact O-SG 3.08Å; L739-C742 VanDerWaalsContact O-SG 3.41Å; C742-M746 HydrophobicContact CB-CB 4.04Å
743	G	94.3	Very high	96.2	Very high	3 Å²	3	20.4 Å²	20.4	3%	0.031	9%	0.092	C	C	.	.			trans	92.5	158.2	-178.6	0	0	0	0	0	113.1	D318 G741 N745 M746 L747	D318-G743 WeakPolarHBondContact O-CA 3.19Å; G741-G743 PolarHBondContact O-N 3.35Å; G743-N745 PolarHBondContact O-N 3.22Å; G743-M746 PolarHBondContact O-N 3.35Å; G743-L747 PolarHBondContact O-N 3.47Å; G743-L747 VanDerWaalsContact O-N 3.14Å
744	E	93.3	Very high	96.3	Very high	61 Å²	61	20.1 Å²	20.1	29%	0.285	9%	0.09	S	C	.	.	H	α-helix	trans	-64.1	-40.9	-173	-176.4	58	-151.7	0	0	112.9	M746 L747 Q748	E744-M746 PolarHBondContact O-N 3.47Å; E744-L747 WeakPolarHBondContact O-CB 3.29Å; E744-L747 PolarHBondContact O-N 3.01Å; E744-Q748 WeakPolarHBondContact O-CG 3.46Å; E744-Q748 PolarHBondContact O-N 2.86Å; E744-Q748 PolarHBondContact OE1-NE2 3.33Å
745	N	93.9	Very high	96.2	Very high	42 Å²	42	22.7 Å²	22.7	23%	0.225	10%	0.102	C	C	.	.	H	α-helix	trans	-57.7	-47.3	177.9	-169.2	25.1	0	0	0	112.4	L317 G743 L747 Q748 D749	L317-N745 HydrophobicContact CB-CB 4.35Å; L317-N745 WeakPolarHBondContact O-CB 3.4Å; L317-N745 PolarHBondContact O-N 2.98Å; G743-N745 PolarHBondContact O-N 3.22Å; N745-L747 PolarHBondContact O-N 3.01Å; N745-Q748 PolarHBondContact O-N 2.89Å; N745-D749 PolarHBondContact O-N 3.49Å
746	M	95.9	Very high	96.1	Very high	9 Å²	9	22.8 Å²	22.8	4%	0.044	10%	0.103	C	C	.	.	H	α-helix	trans	-63.9	-39.7	176	-74.8	-69.5	-72.8	0	0	112.1	K707 H711 Y738 C742 G743 E744 Q748 D749 F750	K707-M746 HydrophobicContact CB-CE 4.23Å; K707-M746 HydrophobicContact CB-SD 4.09Å; K707-M746 HydrophobicContact CD-CG 4.22Å; K707-M746 HydrophobicContact CD-SD 3.99Å; K707-M746 HydrophobicContact CG-CG 4.24Å; K707-M746 HydrophobicContact CG-SD 4.02Å; H711-M746 HydrophobicContact CB-CE 4.32Å; Y738-M746 WeakPolarHBondContact OH-CE 3.34Å; C742-M746 HydrophobicContact CB-CB 4.04Å; G743-M746 PolarHBondContact O-N 3.35Å; E744-M746 PolarHBondContact O-N 3.47Å; M746-Q748 VanDerWaalsContact C-N 3.34Å; M746-Q748 PolarHBondContact O-N 3.13Å; M746-D749 PolarHBondContact O-N 2.94Å; M746-F750 HydrophobicContact CB-CE2 4.29Å; M746-F750 HydrophobicContact CE-CE2 3.91Å; M746-F750 HydrophobicContact CE-CZ 3.69Å; M746-F750 WeakPolarHBondContact O-CD2 3.34Å; M746-F750 WeakPolarHBondContact O-CG 3.48Å; M746-F750 PolarHBondContact O-N 3.36Å
747	L	96.4	Very high	96.1	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-59.6	-44.1	175.7	-77.1	170.6	0	0	0	112	Y152 Y155 L156 L159 L739 G743 E744 N745 F750 R751	Y152-L747 HydrophobicContact CE2-CD1 4.25Å; Y155-L747 HydrophobicContact CE1-CB 4.38Å; Y155-L747 HydrophobicContact CE1-CD2 4.46Å; Y155-L747 PolarHBondContact OH-O 3.45Å; L156-L747 HydrophobicContact CD2-CD2 4.08Å; L159-L747 HydrophobicContact CD1-CD2 3.82Å; L739-L747 HydrophobicContact CB-CD2 4.08Å; L739-L747 HydrophobicContact CD2-CD2 3.91Å; G743-L747 PolarHBondContact O-N 3.47Å; G743-L747 VanDerWaalsContact O-N 3.14Å; E744-L747 WeakPolarHBondContact O-CB 3.29Å; E744-L747 PolarHBondContact O-N 3.01Å; N745-L747 PolarHBondContact O-N 3.01Å; L747-F750 PolarHBondContact O-N 2.88Å; L747-R751 WeakPolarHBondContact O-CB 3.42Å; L747-R751 PolarHBondContact O-N 2.96Å
748	Q	95.3	Very high	96	Very high	82 Å²	82	26.1 Å²	26.1	38%	0.383	12%	0.117	S	C	.	.	H	α-helix	trans	-66.3	-38.9	177.9	-68.5	-179.8	11.9	0	0	112.1	E744 N745 M746 R751 K752	E744-Q748 WeakPolarHBondContact O-CG 3.46Å; E744-Q748 PolarHBondContact O-N 2.86Å; E744-Q748 PolarHBondContact OE1-NE2 3.33Å; N745-Q748 PolarHBondContact O-N 2.89Å; M746-Q748 VanDerWaalsContact C-N 3.34Å; M746-Q748 PolarHBondContact O-N 3.13Å; Q748-R751 PolarHBondContact O-N 2.99Å; Q748-K752 WeakPolarHBondContact O-CG 3.39Å; Q748-K752 PolarHBondContact O-N 3.09Å; Q748-K752 VanDerWaalsContact O-N 3.08Å
749	D	96.8	Very high	95.9	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-43.8	175.4	-78.7	-27.9	0	0	0	111.6	N745 M746 R751 K752 Q753 R802 R810	N745-D749 PolarHBondContact O-N 3.49Å; M746-D749 PolarHBondContact O-N 2.94Å; D749-R751 PolarHBondContact O-N 2.87Å; D749-K752 PolarHBondContact O-N 3.13Å; D749-Q753 WeakPolarHBondContact O-CG 3.14Å; D749-Q753 PolarHBondContact O-N 2.79Å; D749-Q753 VanDerWaalsContact O-N 3.08Å; D749-Q753 PolarHBondContact O-NE2 3.44Å; D749-R802 WeakPolarHBondContact OD2-CD 3.26Å; D749-R802 IonicContact OD2-CZ 2.78Å; D749-R802 IonicContact OD2-NE 3.99Å; D749-R802 PolarHBondContact OD2-NE 3.27Å; D749-R802 IonicContact OD2-NH2 2.8Å; D749-R810 IonicContact OD1-NH2 2.84Å; D749-R810 PolarHBondContact OD1-NH2 2.87Å
750	F	98.4	Very high	95.8	Very high	1 Å²	1	26.9 Å²	26.9	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-62.4	-42	174.8	-70.2	-50.3	0	0	0	112.3	H711 F714 Y738 L739 M746 L747 K752 Q753 V754	H711-F750 AromaticContact ND1-CE1 3.85Å; F714-F750 HydrophobicContact CB-CD1 4.19Å; F714-F750 HydrophobicContact CB-CE1 3.48Å; F714-F750 VanDerWaalsContact CB-CE1 3.48Å; F714-F750 HydrophobicContact CB-CE2 4.27Å; F714-F750 HydrophobicContact CB-CZ 3.52Å; F714-F750 AromaticContact CD1-CD1 3.35Å; F714-F750 HydrophobicContact CD1-CD1 3.35Å; F714-F750 AromaticContact CD1-CE1 3.44Å; F714-F750 HydrophobicContact CD1-CE1 3.44Å; F714-F750 VanDerWaalsContact CD1-CE1 3.44Å; F714-F750 HydrophobicContact CD1-CG 4.15Å; F714-F750 HydrophobicContact CD1-CZ 4.29Å; F714-F750 AromaticContact CD2-CD1 3.89Å; F714-F750 HydrophobicContact CD2-CD1 3.89Å; F714-F750 HydrophobicContact CD2-CD2 4.05Å; F714-F750 HydrophobicContact CD2-CE1 4.01Å; F714-F750 HydrophobicContact CD2-CE2 4.15Å; F714-F750 AromaticContact CD2-CG 3.92Å; F714-F750 HydrophobicContact CD2-CG 3.92Å; F714-F750 HydrophobicContact CD2-CZ 4.13Å; F714-F750 HydrophobicContact CE1-CB 4.34Å; F714-F750 AromaticContact CE1-CD1 3.58Å; F714-F750 HydrophobicContact CE1-CD1 3.58Å; F714-F750 HydrophobicContact CE1-CE1 4.17Å; F714-F750 HydrophobicContact CE1-CG 4.14Å; F714-F750 HydrophobicContact CE2-CB 4.1Å; F714-F750 HydrophobicContact CE2-CD1 4.11Å; F714-F750 HydrophobicContact CE2-CD2 4.31Å; F714-F750 AromaticContact CE2-CG 3.93Å; F714-F750 HydrophobicContact CE2-CG 3.93Å; F714-F750 AromaticContact CG-CD1 3.53Å; F714-F750 HydrophobicContact CG-CD1 3.53Å; F714-F750 HydrophobicContact CG-CD2 4.38Å; F714-F750 AromaticContact CG-CE1 3.36Å; F714-F750 HydrophobicContact CG-CE1 3.36Å; F714-F750 HydrophobicContact CG-CE2 4.23Å; F714-F750 HydrophobicContact CG-CG 4.06Å; F714-F750 AromaticContact CG-CZ 3.73Å; F714-F750 HydrophobicContact CG-CZ 3.73Å; F714-F750 HydrophobicContact CZ-CB 3.96Å; F714-F750 AromaticContact CZ-CD1 3.96Å; F714-F750 HydrophobicContact CZ-CD1 3.96Å; F714-F750 HydrophobicContact CZ-CG 4.03Å; Y738-F750 AromaticContact CE1-CE2 3.71Å; Y738-F750 HydrophobicContact CE1-CE2 3.71Å; Y738-F750 AromaticContact CE1-CZ 3.95Å; Y738-F750 HydrophobicContact CE1-CZ 3.95Å; L739-F750 HydrophobicContact CD2-CD2 3.9Å; L739-F750 HydrophobicContact CD2-CE2 4.22Å; M746-F750 HydrophobicContact CB-CE2 4.29Å; M746-F750 HydrophobicContact CE-CE2 3.91Å; M746-F750 HydrophobicContact CE-CZ 3.69Å; M746-F750 WeakPolarHBondContact O-CD2 3.34Å; M746-F750 WeakPolarHBondContact O-CG 3.48Å; M746-F750 PolarHBondContact O-N 3.36Å; L747-F750 PolarHBondContact O-N 2.88Å; F750-K752 PolarHBondContact O-N 3.32Å; F750-Q753 PolarHBondContact O-N 3.08Å; F750-V754 WeakPolarHBondContact O-CG2 3.26Å; F750-V754 PolarHBondContact O-N 3.23Å
751	R	97.6	Very high	95.8	Very high	119 Å²	119	27.4 Å²	27.4	45%	0.449	13%	0.127	S	C	.	.	H	α-helix	trans	-55.5	-51.4	175.9	-179.4	-172.2	170.9	172.8	-4.3	111.6	Y155 L159 L747 Q748 D749 Q753 V754 E755	Y155-R751 HydrophobicContact CE2-CB 4.34Å; Y155-R751 HydrophobicContact CE2-CG 4.16Å; Y155-R751 WeakPolarHBondContact OH-CB 3.14Å; L159-R751 HydrophobicContact CD2-CB 4Å; L747-R751 WeakPolarHBondContact O-CB 3.42Å; L747-R751 PolarHBondContact O-N 2.96Å; Q748-R751 PolarHBondContact O-N 2.99Å; D749-R751 PolarHBondContact O-N 2.87Å; R751-Q753 VanDerWaalsContact C-N 3.3Å; R751-Q753 PolarHBondContact O-N 3.45Å; R751-V754 PolarHBondContact O-N 2.92Å; R751-E755 HydrophobicContact CG-CG 4.42Å; R751-E755 WeakPolarHBondContact CG-OE1 3.26Å; R751-E755 IonicContact CZ-OE1 3.02Å; R751-E755 IonicContact NE-OE1 3.95Å; R751-E755 PolarHBondContact NE-OE1 3.41Å; R751-E755 IonicContact NH2-OE1 2.87Å; R751-E755 PolarHBondContact NH2-OE1 3.12Å; R751-E755 WeakPolarHBondContact O-CB 3.31Å; R751-E755 WeakPolarHBondContact O-CG 3.43Å; R751-E755 PolarHBondContact O-N 3.21Å
752	K	97.4	Very high	95.7	Very high	61 Å²	61	33.9 Å²	33.9	27%	0.265	16%	0.155	S	C	.	.	H	α-helix	trans	-59.8	-41.2	179	-68.8	170.4	-174.8	170.2	0	111.7	Q748 D749 F750 M756 P798 F801	Q748-K752 WeakPolarHBondContact O-CG 3.39Å; Q748-K752 PolarHBondContact O-N 3.09Å; Q748-K752 VanDerWaalsContact O-N 3.08Å; D749-K752 PolarHBondContact O-N 3.13Å; F750-K752 PolarHBondContact O-N 3.32Å; K752-M756 WeakPolarHBondContact O-CB 3.18Å; K752-M756 PolarHBondContact O-N 3.46Å; K752-P798 HydrophobicContact CB-CB 4.01Å; K752-P798 HydrophobicContact CB-CG 3.88Å; K752-P798 HydrophobicContact CD-CB 4.48Å; K752-P798 HydrophobicContact CG-CB 4Å; K752-P798 HydrophobicContact CG-CG 4.13Å; K752-F801 HydrophobicContact CB-CB 4.16Å
753	Q	97.9	Very high	95.6	Very high	1 Å²	1	34 Å²	34	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-38.6	178.6	-63.3	166	37.5	0	0	112.7	H711 W715 D749 F750 R751 T757 F801 R802	H711-Q753 PolarHBondContact CE1-OE1 3.37Å; W715-Q753 HydrophobicContact CH2-CB 4.28Å; W715-Q753 HydrophobicContact CZ2-CB 3.61Å; W715-Q753 HydrophobicContact CZ2-CG 4.46Å; W715-Q753 VanDerWaalsContact CZ2-OE1 3.25Å; D749-Q753 WeakPolarHBondContact O-CG 3.14Å; D749-Q753 PolarHBondContact O-N 2.79Å; D749-Q753 VanDerWaalsContact O-N 3.08Å; D749-Q753 PolarHBondContact O-NE2 3.44Å; F750-Q753 PolarHBondContact O-N 3.08Å; R751-Q753 VanDerWaalsContact C-N 3.3Å; R751-Q753 PolarHBondContact O-N 3.45Å; Q753-T757 WeakPolarHBondContact O-CB 3.49Å; Q753-T757 PolarHBondContact O-N 3.01Å; Q753-T757 PolarHBondContact O-OG1 3.3Å; Q753-F801 HydrophobicContact CG-CB 4.46Å; Q753-F801 HydrophobicContact CG-CD2 4.23Å; Q753-R802 WeakPolarHBondContact CG-O 3.5Å
754	V	97.4	Very high	95.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.3	-47.9	175.7	171.4	0	0	0	0	110.5	Y158 L159 F714 W715 F750 R751 M756 T757 E758	Y158-V754 HydrophobicContact CE1-CG1 4.17Å; L159-V754 HydrophobicContact CD2-CG2 4.36Å; F714-V754 HydrophobicContact CE1-CG2 4.36Å; F714-V754 HydrophobicContact CZ-CG2 3.98Å; W715-V754 HydrophobicContact CH2-CG2 4.19Å; F750-V754 WeakPolarHBondContact O-CG2 3.26Å; F750-V754 PolarHBondContact O-N 3.23Å; R751-V754 PolarHBondContact O-N 2.92Å; V754-M756 VanDerWaalsContact C-N 3.34Å; V754-M756 PolarHBondContact O-N 2.98Å; V754-T757 WeakPolarHBondContact O-CB 3.42Å; V754-T757 PolarHBondContact O-N 3.39Å; V754-T757 VanDerWaalsContact O-N 3.12Å; V754-E758 HydrophobicContact CG1-CG 4.37Å; V754-E758 WeakPolarHBondContact O-CG 3.43Å; V754-E758 PolarHBondContact O-N 3.38Å
755	E	96	Very high	95.4	Very high	56 Å²	56	37.5 Å²	37.5	26%	0.262	17%	0.166	S	C	.	.	H	α-helix	trans	-56.2	-46.5	176.1	-73.4	172	175.4	0	0	111.3	R751 T757 E758 A759 P798	R751-E755 HydrophobicContact CG-CG 4.42Å; R751-E755 WeakPolarHBondContact CG-OE1 3.26Å; R751-E755 IonicContact CZ-OE1 3.02Å; R751-E755 IonicContact NE-OE1 3.95Å; R751-E755 PolarHBondContact NE-OE1 3.41Å; R751-E755 IonicContact NH2-OE1 2.87Å; R751-E755 PolarHBondContact NH2-OE1 3.12Å; R751-E755 WeakPolarHBondContact O-CB 3.31Å; R751-E755 WeakPolarHBondContact O-CG 3.43Å; R751-E755 PolarHBondContact O-N 3.21Å; E755-T757 PolarHBondContact O-N 2.65Å; E755-E758 PolarHBondContact O-N 2.95Å; E755-A759 WeakPolarHBondContact O-CB 3.28Å; E755-A759 PolarHBondContact O-N 3.47Å; E755-P798 HydrophobicContact CB-CG 4.35Å
756	M	95.8	Very high	95.2	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-45.3	175.2	179.7	60.4	69.8	0	0	111.8	K752 V754 A759 L760 L797 F801 F833	K752-M756 WeakPolarHBondContact O-CB 3.18Å; K752-M756 PolarHBondContact O-N 3.46Å; V754-M756 VanDerWaalsContact C-N 3.34Å; V754-M756 PolarHBondContact O-N 2.98Å; M756-A759 PolarHBondContact O-N 2.79Å; M756-L760 HydrophobicContact CG-CD1 4.07Å; M756-L760 HydrophobicContact CG-CG 4.5Å; M756-L760 WeakPolarHBondContact O-CB 3.28Å; M756-L760 VanDerWaalsContact O-CG 3.28Å; M756-L760 WeakPolarHBondContact O-CG 3.11Å; M756-L760 PolarHBondContact O-N 2.93Å; M756-L760 HydrophobicContact SD-CD1 3.99Å; M756-L760 HydrophobicContact SD-CG 4.03Å; M756-L797 HydrophobicContact CE-CB 4.18Å; M756-L797 HydrophobicContact CE-CD1 4.18Å; M756-L797 HydrophobicContact CE-CD2 3.79Å; M756-L797 HydrophobicContact CE-CG 4.26Å; M756-L797 HydrophobicContact SD-CD1 4.36Å; M756-L797 HydrophobicContact SD-CD2 3.66Å; M756-F801 HydrophobicContact CE-CD1 3.75Å; M756-F801 HydrophobicContact CE-CE1 3.6Å; M756-F801 HydrophobicContact CE-CZ 4.38Å; M756-F801 HydrophobicContact CG-CD1 4.3Å; M756-F801 HydrophobicContact CG-CD2 4.35Å; M756-F801 HydrophobicContact CG-CE1 3.96Å; M756-F801 HydrophobicContact CG-CE2 4.02Å; M756-F801 HydrophobicContact CG-CZ 3.82Å; M756-F801 HydrophobicContact SD-CE1 4.29Å; M756-F833 HydrophobicContact CE-CE1 4.32Å
757	T	95.6	Very high	94.7	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-44.6	-179.8	-62.5	0	0	0	0	111.9	Q753 V754 E755 L760 Q761 F850 T890 I894	Q753-T757 WeakPolarHBondContact O-CB 3.49Å; Q753-T757 PolarHBondContact O-N 3.01Å; Q753-T757 PolarHBondContact O-OG1 3.3Å; V754-T757 WeakPolarHBondContact O-CB 3.42Å; V754-T757 PolarHBondContact O-N 3.39Å; V754-T757 VanDerWaalsContact O-N 3.12Å; E755-T757 PolarHBondContact O-N 2.65Å; T757-L760 PolarHBondContact O-N 3.14Å; T757-Q761 WeakPolarHBondContact O-CB 2.94Å; T757-Q761 PolarHBondContact O-N 3.06Å; T757-F850 HydrophobicContact CG2-CE2 4.23Å; T757-T890 WeakPolarHBondContact CG2-OG1 3.47Å; T757-I894 HydrophobicContact CG2-CD1 3.72Å
758	E	95.3	Very high	94.2	Very high	78 Å²	78	40.6 Å²	40.6	36%	0.364	18%	0.178	S	C	.	.	H	α-helix	trans	-65.6	-41.8	178.6	-71	-179.6	162.8	0	0	111.7	Y158 V754 E755 Q761 K762	Y158-E758 WeakPolarHBondContact CE2-OE2 3.49Å; Y158-E758 PolarHBondContact OH-OE2 3.48Å; V754-E758 HydrophobicContact CG1-CG 4.37Å; V754-E758 WeakPolarHBondContact O-CG 3.43Å; V754-E758 PolarHBondContact O-N 3.38Å; E755-E758 PolarHBondContact O-N 2.95Å; E758-Q761 PolarHBondContact O-N 3.46Å; E758-K762 PolarHBondContact O-N 3.41Å
759	A	94.8	Very high	93.6	Very high	15 Å²	15	40.5 Å²	40.5	12%	0.124	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-47.9	175.9	0	0	0	0	0	111.9	E755 M756 Q761 K762 V763 L797	E755-A759 WeakPolarHBondContact O-CB 3.28Å; E755-A759 PolarHBondContact O-N 3.47Å; M756-A759 PolarHBondContact O-N 2.79Å; A759-Q761 VanDerWaalsContact C-N 3.34Å; A759-Q761 PolarHBondContact O-N 2.94Å; A759-K762 PolarHBondContact O-N 3.15Å; A759-V763 WeakPolarHBondContact O-CG2 3.38Å; A759-V763 PolarHBondContact O-N 3.35Å; A759-L797 HydrophobicContact CB-CD2 3.53Å
760	L	94.4	Very high	92.7	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-64.8	-36.9	177.4	-68.7	178	0	0	0	112.3	M756 T757 V763 T764 L789 L831 F850 M896	M756-L760 HydrophobicContact CG-CD1 4.07Å; M756-L760 HydrophobicContact CG-CG 4.5Å; M756-L760 WeakPolarHBondContact O-CB 3.28Å; M756-L760 VanDerWaalsContact O-CG 3.28Å; M756-L760 WeakPolarHBondContact O-CG 3.11Å; M756-L760 PolarHBondContact O-N 2.93Å; M756-L760 HydrophobicContact SD-CD1 3.99Å; M756-L760 HydrophobicContact SD-CG 4.03Å; T757-L760 PolarHBondContact O-N 3.14Å; L760-V763 PolarHBondContact O-N 3.36Å; L760-T764 WeakPolarHBondContact O-CB 3.43Å; L760-T764 PolarHBondContact O-N 3.42Å; L760-T764 PolarHBondContact O-OG1 3.23Å; L760-L789 HydrophobicContact CD2-CD2 4.47Å; L760-L831 HydrophobicContact CD1-CD1 3.61Å; L760-L831 HydrophobicContact CD2-CD1 3.61Å; L760-L831 HydrophobicContact CG-CD1 4.24Å; L760-F850 HydrophobicContact CB-CD1 4.1Å; L760-F850 HydrophobicContact CB-CD2 3.88Å; L760-F850 HydrophobicContact CB-CE1 4.08Å; L760-F850 HydrophobicContact CB-CE2 3.85Å; L760-F850 HydrophobicContact CB-CG 4Å; L760-F850 HydrophobicContact CB-CZ 3.95Å; L760-F850 HydrophobicContact CD1-CB 4.45Å; L760-F850 HydrophobicContact CD1-CD2 3.87Å; L760-F850 HydrophobicContact CD1-CE2 4.41Å; L760-F850 HydrophobicContact CD1-CG 4.24Å; L760-M896 HydrophobicContact CD1-CE 4.18Å
761	Q	94.7	Very high	91.2	Very high	38 Å²	38	45.6 Å²	45.6	18%	0.178	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-47	174.3	-173.2	-178.6	51.4	0	0	111.1	T757 E758 A759 T764 R765 F850 I894	T757-Q761 WeakPolarHBondContact O-CB 2.94Å; T757-Q761 PolarHBondContact O-N 3.06Å; E758-Q761 PolarHBondContact O-N 3.46Å; A759-Q761 VanDerWaalsContact C-N 3.34Å; A759-Q761 PolarHBondContact O-N 2.94Å; Q761-T764 PolarHBondContact O-N 3.39Å; Q761-R765 WeakPolarHBondContact O-CG 3.42Å; Q761-R765 PolarHBondContact O-N 2.87Å; Q761-F850 HydrophobicContact CB-CE1 4.38Å; Q761-F850 HydrophobicContact CB-CZ 4.02Å; Q761-I894 HydrophobicContact CG-CG2 4.27Å
762	K	93.7	Very high	89.4	Confident	135 Å²	135	44.3 Å²	44.3	59%	0.587	23%	0.233	S	C	*	.	H	α-helix	trans	-58	-50.3	177.3	-176.8	-179.5	175.9	-175.7	0	111.4	E758 A759 T764 R765 E766	E758-K762 PolarHBondContact O-N 3.41Å; A759-K762 PolarHBondContact O-N 3.15Å; K762-T764 VanDerWaalsContact C-N 3.33Å; K762-T764 PolarHBondContact O-N 3.29Å; K762-R765 PolarHBondContact O-N 3.22Å; K762-E766 VanDerWaalsContact CE-OE1 3.25Å; K762-E766 WeakPolarHBondContact CE-OE1 3.43Å; K762-E766 WeakPolarHBondContact O-CG 3.23Å; K762-E766 PolarHBondContact O-N 3.49Å; K762-E766 VanDerWaalsContact O-N 3.08Å
763	V	92.6	Very high	87.5	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-46.8	177.3	173.8	0	0	0	0	111.1	A759 L760 R765 E766 M767 L785 L792 L829	A759-V763 WeakPolarHBondContact O-CG2 3.38Å; A759-V763 PolarHBondContact O-N 3.35Å; L760-V763 PolarHBondContact O-N 3.36Å; V763-R765 PolarHBondContact O-N 2.83Å; V763-E766 PolarHBondContact O-N 2.9Å; V763-M767 HydrophobicContact CG1-CG 4.3Å; V763-M767 WeakPolarHBondContact O-CG 3.42Å; V763-M767 PolarHBondContact O-N 3.03Å; V763-L785 HydrophobicContact CG1-CD1 3.58Å; V763-L792 HydrophobicContact CG2-CD1 3.28Å; V763-L829 HydrophobicContact CG1-CD1 4.19Å
764	T	91.7	Very high	85.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-43.6	-178	-55.1	0	0	0	0	111.7	L760 Q761 K762 M767 K768 L829 F850 D852	L760-T764 WeakPolarHBondContact O-CB 3.43Å; L760-T764 PolarHBondContact O-N 3.42Å; L760-T764 PolarHBondContact O-OG1 3.23Å; Q761-T764 PolarHBondContact O-N 3.39Å; K762-T764 VanDerWaalsContact C-N 3.33Å; K762-T764 PolarHBondContact O-N 3.29Å; T764-M767 PolarHBondContact O-N 2.83Å; T764-K768 HydrophobicContact CG2-CD 4.35Å; T764-K768 WeakPolarHBondContact O-CG 3.13Å; T764-K768 PolarHBondContact O-N 3.05Å; T764-L829 HydrophobicContact CG2-CG 4.44Å; T764-L829 WeakPolarHBondContact OG1-CD1 3.29Å; T764-L829 WeakPolarHBondContact OG1-CG 3.28Å; T764-F850 VanDerWaalsContact OG1-CD1 3.32Å; T764-F850 WeakPolarHBondContact OG1-CD1 3.45Å; T764-F850 WeakPolarHBondContact OG1-CE1 3.4Å; T764-D852 HydrophobicContact CG2-CB 3.76Å
765	R	91.4	Very high	83.4	Confident	137 Å²	137	60.6 Å²	60.6	52%	0.517	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-39.3	177.9	-71.5	176.1	178.2	-171.4	-2.3	112.2	Q761 K762 V763 K768 A769 D852	Q761-R765 WeakPolarHBondContact O-CG 3.42Å; Q761-R765 PolarHBondContact O-N 2.87Å; K762-R765 PolarHBondContact O-N 3.22Å; V763-R765 PolarHBondContact O-N 2.83Å; R765-K768 PolarHBondContact O-N 3.26Å; R765-A769 PolarHBondContact O-N 3.34Å; R765-D852 IonicContact NE-OD2 3.63Å; R765-D852 PolarHBondContact NE-OD2 3.1Å
766	E	89.3	Confident	81.6	Confident	61 Å²	61	64.1 Å²	64.1	29%	0.285	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-41.3	173.6	-68.9	173.6	-172.6	0	0	111.7	K762 V763 K768 A769 M770 K788	K762-E766 VanDerWaalsContact CE-OE1 3.25Å; K762-E766 WeakPolarHBondContact CE-OE1 3.43Å; K762-E766 WeakPolarHBondContact O-CG 3.23Å; K762-E766 PolarHBondContact O-N 3.49Å; K762-E766 VanDerWaalsContact O-N 3.08Å; V763-E766 PolarHBondContact O-N 2.9Å; E766-K768 VanDerWaalsContact C-N 3.33Å; E766-K768 PolarHBondContact O-N 3.09Å; E766-A769 PolarHBondContact O-N 2.98Å; E766-M770 PolarHBondContact O-N 3.25Å; E766-M770 VanDerWaalsContact O-N 3.14Å; E766-K788 WeakPolarHBondContact OE2-CD 3.17Å; E766-K788 WeakPolarHBondContact OE2-CE 3.27Å; E766-K788 IonicContact OE2-NZ 3.21Å; E766-K788 PolarHBondContact OE2-NZ 2.88Å
767	M	86.8	Confident	80.4	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-64.5	-39.3	177.5	-68.4	-48.3	91.7	0	0	111.9	V763 T764 M770 S771 V781 L785 K788	V763-M767 HydrophobicContact CG1-CG 4.3Å; V763-M767 WeakPolarHBondContact O-CG 3.42Å; V763-M767 PolarHBondContact O-N 3.03Å; T764-M767 PolarHBondContact O-N 2.83Å; M767-M770 HydrophobicContact CE-CE 3.02Å; M767-M770 PolarHBondContact O-N 3.27Å; M767-M770 HydrophobicContact SD-CE 3.83Å; M767-S771 PolarHBondContact O-N 2.96Å; M767-S771 PolarHBondContact O-OG 3.48Å; M767-V781 HydrophobicContact SD-CG1 4.3Å; M767-L785 HydrophobicContact CG-CD1 4.2Å; M767-L785 HydrophobicContact SD-CB 3.97Å; M767-L785 HydrophobicContact SD-CD1 4.44Å; M767-K788 HydrophobicContact CE-CD 3.52Å
768	K	85.3	Confident	79.5	Confident	55 Å²	55	69 Å²	69	24%	0.239	36%	0.358	C	S	.	.	H	α-helix	trans	-64.9	-39.3	175.1	-73.5	172.4	176.3	-174.9	0	112.2	T764 R765 E766 M770 S771 K826 D852	T764-K768 HydrophobicContact CG2-CD 4.35Å; T764-K768 WeakPolarHBondContact O-CG 3.13Å; T764-K768 PolarHBondContact O-N 3.05Å; R765-K768 PolarHBondContact O-N 3.26Å; E766-K768 VanDerWaalsContact C-N 3.33Å; E766-K768 PolarHBondContact O-N 3.09Å; K768-M770 VanDerWaalsContact C-N 3.35Å; K768-S771 PolarHBondContact O-N 2.88Å; K768-K826 WeakPolarHBondContact CE-O 3.37Å; K768-D852 PolarHBondContact NZ-O 3.39Å; K768-D852 IonicContact NZ-OD1 3.88Å; K768-D852 PolarHBondContact NZ-OD1 3.29Å
769	A	83.9	Confident	78.7	Confident	80 Å²	80	73.2 Å²	73.2	66%	0.661	38%	0.377	S	S	*	.	H	α-helix	trans	-65.9	-36.5	178.3	0	0	0	0	0	112.5	R765 E766	R765-A769 PolarHBondContact O-N 3.34Å; E766-A769 PolarHBondContact O-N 2.98Å
770	M	76.8	Confident	78.1	Confident	95 Å²	95	79.7 Å²	79.7	47%	0.468	41%	0.405	S	S	.	.	H	α-helix	trans	-76.4	-24	179.3	-73.2	-167.8	-74.1	0	0	114.2	E766 M767 K768 Q784	E766-M770 PolarHBondContact O-N 3.25Å; E766-M770 VanDerWaalsContact O-N 3.14Å; M767-M770 HydrophobicContact CE-CE 3.02Å; M767-M770 PolarHBondContact O-N 3.27Å; M767-M770 HydrophobicContact SD-CE 3.83Å; K768-M770 VanDerWaalsContact C-N 3.35Å; M770-Q784 HydrophobicContact CE-CB 4.2Å
771	S	67.8	Low	77.6	Confident	16 Å²	16	80.2 Å²	80.2	11%	0.112	41%	0.408	C	S	.	.			trans	-109.6	76.2	-178.6	60.9	0	0	0	0	109.3	M767 K768 D773 K827	M767-S771 PolarHBondContact O-N 2.96Å; M767-S771 PolarHBondContact O-OG 3.48Å; K768-S771 PolarHBondContact O-N 2.88Å; S771-D773 VanDerWaalsContact C-N 3.3Å; S771-D773 PolarHBondContact O-N 3.27Å; S771-K827 PolarHBondContact O-NZ 3.31Å; S771-K827 VanDerWaalsContact OG-CD 3.24Å; S771-K827 WeakPolarHBondContact OG-CD 3.39Å; S771-K827 PolarHBondContact OG-NZ 3.32Å
772	A	58.7	Low	77.2	Confident	92 Å²	92	79.8 Å²	79.8	76%	0.76	41%	0.409	S	S	*	.			trans	-69.8	-25.9	-178.5	0	0	0	0	0	113.2
773	D	57.4	Low	76.9	Confident	135 Å²	135	77.8 Å²	77.8	72%	0.722	40%	0.403	S	S	*	.	S	Bend	trans	-77	138.5	176.1	-74.9	-36.2	0	0	0	112.2	S771 Y775 K827	S771-D773 VanDerWaalsContact C-N 3.3Å; S771-D773 PolarHBondContact O-N 3.27Å; D773-Y775 VanDerWaalsContact C-N 3.32Å; D773-Y775 PolarHBondContact O-N 2.74Å; D773-K827 PolarHBondContact O-NZ 3.08Å
774	K	56.1	Low	76.8	Confident	143 Å²	143	81.2 Å²	81.2	62%	0.622	42%	0.419	S	S	*	.	S	Bend	trans	-69.7	-18	-161	-77.1	178.6	177.1	172	0	115.3
775	Y	53.7	Low	76.7	Confident	126 Å²	126	81.2 Å²	81.2	49%	0.494	42%	0.419	S	S	.	.	S	Bend	trans	-140.8	-14.6	-164.4	-57.5	-69.6	0	0	0	117.6	D773	D773-Y775 VanDerWaalsContact C-N 3.32Å; D773-Y775 PolarHBondContact O-N 2.74Å
776	D	57.8	Low	76.8	Confident	130 Å²	130	78 Å²	78	70%	0.695	41%	0.407	S	S	*	.			trans	-104.3	117.7	179	-79.5	-31.9	0	0	0	112.7	T778	D776-T778 PolarHBondContact O-N 2.94Å
777	V	69.9	Low	76.9	Confident	39 Å²	39	79.5 Å²	79.5	24%	0.236	41%	0.414	C	S	.	.			trans	-83.9	99.5	165	178.6	0	0	0	0	107	V781 V782 V821 A823	V777-V781 HydrophobicContact CG1-CB 4.49Å; V777-V781 HydrophobicContact CG1-CG1 4.46Å; V777-V782 HydrophobicContact CG1-CG2 3.88Å; V777-V821 HydrophobicContact CG1-CB 3.92Å; V777-V821 HydrophobicContact CG1-CG1 4.46Å; V777-V821 HydrophobicContact CG2-CB 4.33Å; V777-V821 HydrophobicContact CG2-CG1 4.04Å; V777-A823 HydrophobicContact CG2-CB 4.47Å
778	T	76.6	Confident	77.2	Confident	67 Å²	67	82.3 Å²	82.3	41%	0.411	43%	0.426	S	S	.	.			trans	-70.9	153.8	177.3	64.1	0	0	0	0	110.8	D776 Q780 V781 V782	D776-T778 PolarHBondContact O-N 2.94Å; T778-Q780 PolarHBondContact O-N 2.84Å; T778-Q780 VanDerWaalsContact O-N 3.14Å; T778-V781 WeakPolarHBondContact O-CB 3.47Å; T778-V781 PolarHBondContact O-N 3.44Å; T778-V781 WeakPolarHBondContact OG1-CG2 3.34Å; T778-V782 PolarHBondContact O-N 3.38Å
779	Q	79.8	Confident	77.5	Confident	166 Å²	166	79.7 Å²	79.7	78%	0.776	41%	0.414	S	S	*	.	H	α-helix	trans	-56.4	-30.7	174.9	-71.8	-173.5	-27.7	0	0	112.4	V781 V782 I783	Q779-V781 VanDerWaalsContact C-N 3.34Å; Q779-V781 PolarHBondContact O-N 3.03Å; Q779-V782 PolarHBondContact O-N 3.46Å; Q779-I783 WeakPolarHBondContact O-CG1 3.44Å; Q779-I783 PolarHBondContact O-N 3.28Å
780	Q	82.6	Confident	78	Confident	151 Å²	151	80 Å²	80	71%	0.706	40%	0.403	S	S	*	.	H	α-helix	trans	-61.6	-39.3	175	-69.2	-179.8	-16.2	0	0	112.7	T778 V782 I783 Q784	T778-Q780 PolarHBondContact O-N 2.84Å; T778-Q780 VanDerWaalsContact O-N 3.14Å; Q780-V782 VanDerWaalsContact C-N 3.32Å; Q780-V782 PolarHBondContact O-N 2.96Å; Q780-I783 PolarHBondContact O-N 3.2Å; Q780-Q784 WeakPolarHBondContact O-CB 3.49Å; Q780-Q784 VanDerWaalsContact O-CG 3.31Å; Q780-Q784 WeakPolarHBondContact O-CG 3.49Å; Q780-Q784 PolarHBondContact O-N 2.81Å
781	V	84.1	Confident	78.7	Confident	12 Å²	12	79.8 Å²	79.8	7%	0.073	41%	0.407	C	S	.	.	H	α-helix	trans	-64.9	-39	177	173.7	0	0	0	0	110.8	M767 V777 T778 Q779 Q784 L785 V821	M767-V781 HydrophobicContact SD-CG1 4.3Å; V777-V781 HydrophobicContact CG1-CB 4.49Å; V777-V781 HydrophobicContact CG1-CG1 4.46Å; T778-V781 WeakPolarHBondContact O-CB 3.47Å; T778-V781 PolarHBondContact O-N 3.44Å; T778-V781 WeakPolarHBondContact OG1-CG2 3.34Å; Q779-V781 VanDerWaalsContact C-N 3.34Å; Q779-V781 PolarHBondContact O-N 3.03Å; V781-Q784 PolarHBondContact O-N 3.04Å; V781-L785 WeakPolarHBondContact O-CB 3.37Å; V781-L785 PolarHBondContact O-N 3.48Å; V781-V821 HydrophobicContact CG1-CG2 4.01Å
782	V	85.9	Confident	79.8	Confident	30 Å²	30	81 Å²	81	18%	0.182	41%	0.412	C	S	.	.	H	α-helix	trans	-66.5	-43.2	176.8	-178.8	0	0	0	0	111.1	V777 T778 Q779 Q780 L785 R786	V777-V782 HydrophobicContact CG1-CG2 3.88Å; T778-V782 PolarHBondContact O-N 3.38Å; Q779-V782 PolarHBondContact O-N 3.46Å; Q780-V782 VanDerWaalsContact C-N 3.32Å; Q780-V782 PolarHBondContact O-N 2.96Å; V782-L785 WeakPolarHBondContact O-CB 3.5Å; V782-L785 PolarHBondContact O-N 2.77Å; V782-R786 WeakPolarHBondContact O-CG 3.18Å; V782-R786 PolarHBondContact O-N 2.94Å
783	I	87.7	Confident	81.3	Confident	92 Å²	92	80 Å²	80	47%	0.472	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-45.9	176.3	-66.9	165.4	0	0	0	110.7	Q779 Q780 L785 R786 Q787	Q779-I783 WeakPolarHBondContact O-CG1 3.44Å; Q779-I783 PolarHBondContact O-N 3.28Å; Q780-I783 PolarHBondContact O-N 3.2Å; I783-L785 PolarHBondContact O-N 3.44Å; I783-R786 PolarHBondContact O-N 3.21Å; I783-Q787 WeakPolarHBondContact O-CG 2.9Å; I783-Q787 PolarHBondContact O-N 3.41Å
784	Q	88.9	Confident	82.8	Confident	77 Å²	77	80.9 Å²	80.9	36%	0.36	40%	0.395	S	S	.	.	H	α-helix	trans	-63.4	-40.1	177.6	-75.6	-68.5	-25.8	0	0	112.6	M770 Q780 V781 K788	M770-Q784 HydrophobicContact CE-CB 4.2Å; Q780-Q784 WeakPolarHBondContact O-CB 3.49Å; Q780-Q784 VanDerWaalsContact O-CG 3.31Å; Q780-Q784 WeakPolarHBondContact O-CG 3.49Å; Q780-Q784 PolarHBondContact O-N 2.81Å; V781-Q784 PolarHBondContact O-N 3.04Å; Q784-K788 WeakPolarHBondContact O-CG 3.44Å; Q784-K788 PolarHBondContact O-N 2.89Å; Q784-K788 VanDerWaalsContact O-N 3.08Å
785	L	91.2	Very high	83.9	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-56.6	-51.8	172.2	173.3	67.7	0	0	0	110.1	V763 M767 V781 V782 I783 Q787 K788 L789 V821 L829	V763-L785 HydrophobicContact CG1-CD1 3.58Å; M767-L785 HydrophobicContact CG-CD1 4.2Å; M767-L785 HydrophobicContact SD-CB 3.97Å; M767-L785 HydrophobicContact SD-CD1 4.44Å; V781-L785 WeakPolarHBondContact O-CB 3.37Å; V781-L785 PolarHBondContact O-N 3.48Å; V782-L785 WeakPolarHBondContact O-CB 3.5Å; V782-L785 PolarHBondContact O-N 2.77Å; I783-L785 PolarHBondContact O-N 3.44Å; L785-Q787 PolarHBondContact O-N 3.43Å; L785-K788 PolarHBondContact O-N 2.87Å; L785-L789 HydrophobicContact CD1-CD1 3.97Å; L785-L789 HydrophobicContact CD1-CD2 4.49Å; L785-L789 HydrophobicContact CD1-CG 4.04Å; L785-L789 HydrophobicContact CD2-CD1 4.47Å; L785-L789 HydrophobicContact CG-CD1 3.93Å; L785-L789 HydrophobicContact CG-CG 4.32Å; L785-L789 WeakPolarHBondContact O-CG 3.5Å; L785-L789 PolarHBondContact O-N 2.98Å; L785-V821 HydrophobicContact CD2-CG2 3.76Å; L785-L829 HydrophobicContact CD1-CD1 4.35Å; L785-L829 HydrophobicContact CD1-CD2 4.04Å; L785-L829 HydrophobicContact CD2-CD2 4.38Å
786	R	92.3	Very high	84.9	Confident	70 Å²	70	75.4 Å²	75.4	26%	0.264	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-46.7	-178.1	-70.6	-177.2	-176.6	174.9	2.6	112.1	V782 I783 K788 L789 E790 I816 E817	V782-R786 WeakPolarHBondContact O-CG 3.18Å; V782-R786 PolarHBondContact O-N 2.94Å; I783-R786 PolarHBondContact O-N 3.21Å; R786-K788 VanDerWaalsContact C-N 3.31Å; R786-K788 PolarHBondContact O-N 3.38Å; R786-L789 PolarHBondContact O-N 2.89Å; R786-L789 VanDerWaalsContact O-N 3.17Å; R786-E790 WeakPolarHBondContact O-CG 3.3Å; R786-E790 PolarHBondContact O-N 2.78Å; R786-I816 HydrophobicContact CB-CG2 3.68Å; R786-I816 HydrophobicContact CG-CG2 3.75Å; R786-E817 IonicContact CZ-OE2 3.02Å; R786-E817 IonicContact NH1-OE2 3.82Å; R786-E817 PolarHBondContact NH1-OE2 3.3Å; R786-E817 PolarHBondContact NH2-O 2.86Å
787	Q	92.1	Very high	86.3	Confident	91 Å²	91	70.5 Å²	70.5	43%	0.425	37%	0.373	S	S	.	.	H	α-helix	trans	-58.2	-40.8	176.4	-73	176.6	-18.2	0	0	112.8	I783 L785 E790 T791	I783-Q787 WeakPolarHBondContact O-CG 2.9Å; I783-Q787 PolarHBondContact O-N 3.41Å; L785-Q787 PolarHBondContact O-N 3.43Å; Q787-E790 PolarHBondContact O-N 3.24Å; Q787-T791 PolarHBondContact O-N 2.79Å; Q787-T791 PolarHBondContact O-OG1 3.15Å
788	K	92.1	Very high	87.3	Confident	61 Å²	61	69.7 Å²	69.7	27%	0.265	37%	0.369	S	S	.	.	H	α-helix	trans	-69	-41.6	176.7	-76.4	177.9	179.3	-73	0	112.2	E766 M767 Q784 L785 R786 E790 T791 L792	E766-K788 WeakPolarHBondContact OE2-CD 3.17Å; E766-K788 WeakPolarHBondContact OE2-CE 3.27Å; E766-K788 IonicContact OE2-NZ 3.21Å; E766-K788 PolarHBondContact OE2-NZ 2.88Å; M767-K788 HydrophobicContact CE-CD 3.52Å; Q784-K788 WeakPolarHBondContact O-CG 3.44Å; Q784-K788 PolarHBondContact O-N 2.89Å; Q784-K788 VanDerWaalsContact O-N 3.08Å; L785-K788 PolarHBondContact O-N 2.87Å; R786-K788 VanDerWaalsContact C-N 3.31Å; R786-K788 PolarHBondContact O-N 3.38Å; K788-E790 VanDerWaalsContact C-N 3.33Å; K788-T791 PolarHBondContact O-N 3.35Å; K788-L792 WeakPolarHBondContact O-CB 3.43Å; K788-L792 WeakPolarHBondContact O-CG 3.48Å; K788-L792 PolarHBondContact O-N 3.44Å
789	L	93.1	Very high	88	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-64.2	-38.1	175.5	-67.7	179.6	0	0	0	111.5	L760 L785 R786 L792 Q793 L814 I816 C819 L831	L760-L789 HydrophobicContact CD2-CD2 4.47Å; L785-L789 HydrophobicContact CD1-CD1 3.97Å; L785-L789 HydrophobicContact CD1-CD2 4.49Å; L785-L789 HydrophobicContact CD1-CG 4.04Å; L785-L789 HydrophobicContact CD2-CD1 4.47Å; L785-L789 HydrophobicContact CG-CD1 3.93Å; L785-L789 HydrophobicContact CG-CG 4.32Å; L785-L789 WeakPolarHBondContact O-CG 3.5Å; L785-L789 PolarHBondContact O-N 2.98Å; R786-L789 PolarHBondContact O-N 2.89Å; R786-L789 VanDerWaalsContact O-N 3.17Å; L789-L792 PolarHBondContact O-N 3.43Å; L789-Q793 WeakPolarHBondContact O-CB 3.34Å; L789-Q793 PolarHBondContact O-N 3.26Å; L789-L814 HydrophobicContact CB-CD1 4.44Å; L789-L814 HydrophobicContact CD2-CD1 4.12Å; L789-I816 HydrophobicContact CB-CD1 4.49Å; L789-I816 HydrophobicContact CB-CG1 4.44Å; L789-I816 HydrophobicContact CB-CG2 4.45Å; L789-C819 HydrophobicContact CD1-CB 3.86Å; L789-L831 HydrophobicContact CD1-CD2 4.17Å
790	E	93.6	Very high	88.7	Confident	88 Å²	88	67.8 Å²	67.8	41%	0.411	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-48.2	173.2	-75.7	170	-162.4	0	0	111.4	R786 Q787 K788 L792 Q793 L794 I816	R786-E790 WeakPolarHBondContact O-CG 3.3Å; R786-E790 PolarHBondContact O-N 2.78Å; Q787-E790 PolarHBondContact O-N 3.24Å; K788-E790 VanDerWaalsContact C-N 3.33Å; E790-L792 VanDerWaalsContact C-N 3.32Å; E790-L792 PolarHBondContact O-N 3.04Å; E790-Q793 PolarHBondContact O-N 3.39Å; E790-L794 WeakPolarHBondContact O-CG 3.41Å; E790-L794 PolarHBondContact O-N 2.84Å; E790-L794 VanDerWaalsContact O-N 3.15Å; E790-I816 HydrophobicContact CB-CD1 4.13Å; E790-I816 HydrophobicContact CG-CD1 3.41Å; E790-I816 VanDerWaalsContact CG-CD1 3.41Å; E790-I816 HydrophobicContact CG-CG2 4.2Å
791	T	91.7	Very high	89.4	Confident	90 Å²	90	60.7 Å²	60.7	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-59.9	-44.3	178.1	-55.8	0	0	0	0	111.2	Q787 K788 L794	Q787-T791 PolarHBondContact O-N 2.79Å; Q787-T791 PolarHBondContact O-OG1 3.15Å; K788-T791 PolarHBondContact O-N 3.35Å; T791-L794 PolarHBondContact O-N 3.44Å
792	L	89.8	Confident	90	Very high	42 Å²	42	61.7 Å²	61.7	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-38.5	178.5	-76.6	177.4	0	0	0	112.4	V763 K788 L789 E790 L794 G796 L797	V763-L792 HydrophobicContact CG2-CD1 3.28Å; K788-L792 WeakPolarHBondContact O-CB 3.43Å; K788-L792 WeakPolarHBondContact O-CG 3.48Å; K788-L792 PolarHBondContact O-N 3.44Å; L789-L792 PolarHBondContact O-N 3.43Å; E790-L792 VanDerWaalsContact C-N 3.32Å; E790-L792 PolarHBondContact O-N 3.04Å; L792-L794 VanDerWaalsContact C-N 3.27Å; L792-L794 PolarHBondContact O-N 3.38Å; L792-G796 CarbonylContact O-C 3.57Å; L792-G796 VanDerWaalsContact O-CA 3.32Å; L792-G796 WeakPolarHBondContact O-CA 3.27Å; L792-G796 PolarHBondContact O-N 2.99Å; L792-L797 HydrophobicContact CB-CD1 3.86Å; L792-L797 HydrophobicContact CB-CG 3.95Å; L792-L797 PolarHBondContact O-N 3.21Å
793	Q	91.1	Very high	90.6	Very high	69 Å²	69	60.2 Å²	60.2	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-66.9	-27.5	178	-175.9	157.9	-83.5	0	0	113	L789 E790 L814	L789-Q793 WeakPolarHBondContact O-CB 3.34Å; L789-Q793 PolarHBondContact O-N 3.26Å; E790-Q793 PolarHBondContact O-N 3.39Å; Q793-L814 VanDerWaalsContact OE1-CB 3.31Å
794	L	87.9	Confident	91	Very high	154 Å²	154	55.9 Å²	55.9	81%	0.806	30%	0.296	S	S	*	.	H	α-helix	trans	-76.2	-30.7	179.9	-73.6	169.9	0	0	0	114.3	E790 T791 L792	E790-L794 WeakPolarHBondContact O-CG 3.41Å; E790-L794 PolarHBondContact O-N 2.84Å; E790-L794 VanDerWaalsContact O-N 3.15Å; T791-L794 PolarHBondContact O-N 3.44Å; L792-L794 VanDerWaalsContact C-N 3.27Å; L792-L794 PolarHBondContact O-N 3.38Å
795	S	79.8	Confident	91.4	Very high	112 Å²	112	53.1 Å²	53.1	78%	0.783	28%	0.282	S	S	*	.	H	α-helix	trans	-152.6	0.5	-172.8	62.6	0	0	0	0	116.5
796	G	75.1	Confident	91.7	Very high	42 Å²	42	54.2 Å²	54.2	43%	0.433	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-4.3	-169.9	0	0	0	0	0	116.4	L792	L792-G796 CarbonylContact O-C 3.57Å; L792-G796 VanDerWaalsContact O-CA 3.32Å; L792-G796 WeakPolarHBondContact O-CA 3.27Å; L792-G796 PolarHBondContact O-N 2.99Å
797	L	87.4	Confident	91.8	Very high	27 Å²	27	51.4 Å²	51.4	14%	0.141	28%	0.279	C	S	.	.	S	Bend	trans	-121.4	147.3	-179.3	-70.2	175.1	0	0	0	111.9	M756 A759 L792 L814	M756-L797 HydrophobicContact CE-CB 4.18Å; M756-L797 HydrophobicContact CE-CD1 4.18Å; M756-L797 HydrophobicContact CE-CD2 3.79Å; M756-L797 HydrophobicContact CE-CG 4.26Å; M756-L797 HydrophobicContact SD-CD1 4.36Å; M756-L797 HydrophobicContact SD-CD2 3.66Å; A759-L797 HydrophobicContact CB-CD2 3.53Å; L792-L797 HydrophobicContact CB-CD1 3.86Å; L792-L797 HydrophobicContact CB-CG 3.95Å; L792-L797 PolarHBondContact O-N 3.21Å; L797-L814 HydrophobicContact CD1-CD1 3.97Å
798	P	91.2	Very high	91.9	Very high	22 Å²	22	47.2 Å²	47.2	14%	0.143	26%	0.26	C	S	.	.			trans	-56.7	140.1	165.6	-22.5	32.4	0	0	0	111.5	K752 E755 S800	K752-P798 HydrophobicContact CB-CB 4.01Å; K752-P798 HydrophobicContact CB-CG 3.88Å; K752-P798 HydrophobicContact CD-CB 4.48Å; K752-P798 HydrophobicContact CG-CB 4Å; K752-P798 HydrophobicContact CG-CG 4.13Å; E755-P798 HydrophobicContact CB-CG 4.35Å; P798-S800 PolarHBondContact O-N 2.86Å
799	E	90	Very high	92.1	Very high	172 Å²	172	45 Å²	45	80%	0.804	25%	0.251	S	S	*	.	S	Bend	trans	-60.6	-30.9	175.9	-64.5	-176.6	168.4	0	0	112.7	G812	E799-G812 CarbonylContact O-C 3.53Å; E799-G812 WeakPolarHBondContact O-CA 3.42Å
800	S	95.3	Very high	92.2	Very high	22 Å²	22	47.4 Å²	47.4	15%	0.154	26%	0.26	C	S	.	.			trans	-157.4	154.2	174.9	51.7	0	0	0	0	111.5	P798 R810 A811	P798-S800 PolarHBondContact O-N 2.86Å; S800-R810 PolarHBondContact OG-NH1 2.78Å; S800-A811 CarbonylContact C-O 3.46Å; S800-A811 WeakPolarHBondContact CA-O 3.29Å; S800-A811 VanDerWaalsContact CB-O 3.26Å; S800-A811 WeakPolarHBondContact CB-O 3.28Å
801	F	96.5	Very high	92.3	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	153.1	177.6	69.2	-72.2	0	0	0	110.4	K752 Q753 M756 A811 F833 I848	K752-F801 HydrophobicContact CB-CB 4.16Å; Q753-F801 HydrophobicContact CG-CB 4.46Å; Q753-F801 HydrophobicContact CG-CD2 4.23Å; M756-F801 HydrophobicContact CE-CD1 3.75Å; M756-F801 HydrophobicContact CE-CE1 3.6Å; M756-F801 HydrophobicContact CE-CZ 4.38Å; M756-F801 HydrophobicContact CG-CD1 4.3Å; M756-F801 HydrophobicContact CG-CD2 4.35Å; M756-F801 HydrophobicContact CG-CE1 3.96Å; M756-F801 HydrophobicContact CG-CE2 4.02Å; M756-F801 HydrophobicContact CG-CZ 3.82Å; M756-F801 HydrophobicContact SD-CE1 4.29Å; F801-A811 HydrophobicContact CD1-CB 4.07Å; F801-A811 HydrophobicContact CE1-CB 3.54Å; F801-A811 HydrophobicContact CZ-CB 3.8Å; F801-A811 PolarHBondContact N-O 3.42Å; F801-A811 PolarHBondContact O-N 2.92Å; F801-F833 HydrophobicContact CE1-CD1 4.16Å; F801-F833 AromaticContact CE1-CE1 3.76Å; F801-F833 HydrophobicContact CE1-CE1 3.76Å; F801-F833 HydrophobicContact CE1-CZ 4.16Å; F801-F833 HydrophobicContact CZ-CE1 4.17Å; F801-F833 HydrophobicContact CZ-CZ 4.1Å; F801-I848 HydrophobicContact CZ-CD1 4.23Å
802	R	97.1	Very high	92.4	Very high	33 Å²	33	39.2 Å²	39.2	13%	0.125	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	140	170.5	-66.7	-179	-175.4	-87.7	-11.2	110.1	E280 D749 Q753 P804 P807 L809 R810	E280-R802 IonicContact OE1-NH2 3.42Å; E280-R802 PolarHBondContact OE1-NH2 3.16Å; E280-R802 IonicContact OE2-CZ 2.92Å; E280-R802 IonicContact OE2-NE 3.71Å; E280-R802 IonicContact OE2-NH1 2.67Å; E280-R802 PolarHBondContact OE2-NH1 3.05Å; E280-R802 IonicContact OE2-NH2 2.71Å; E280-R802 PolarHBondContact OE2-NH2 3.46Å; D749-R802 WeakPolarHBondContact OD2-CD 3.26Å; D749-R802 IonicContact OD2-CZ 2.78Å; D749-R802 IonicContact OD2-NE 3.99Å; D749-R802 PolarHBondContact OD2-NE 3.27Å; D749-R802 IonicContact OD2-NH2 2.8Å; Q753-R802 WeakPolarHBondContact CG-O 3.5Å; R802-P804 WeakPolarHBondContact O-CD 3.45Å; R802-P807 PolarHBondContact NH1-O 3.42Å; R802-L809 WeakPolarHBondContact CA-O 3.49Å; R802-R810 HydrophobicContact CG-CG 4.44Å
803	V	97.8	Very high	92.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.6	179.7	179.9	0	0	0	0	109.5	Y805 D806 L809 A811 V846 I848	V803-Y805 VanDerWaalsContact C-N 3.3Å; V803-Y805 HydrophobicContact CG1-CD1 3.76Å; V803-Y805 HydrophobicContact CG1-CD2 3.86Å; V803-Y805 HydrophobicContact CG1-CE1 3.41Å; V803-Y805 VanDerWaalsContact CG1-CE1 3.41Å; V803-Y805 HydrophobicContact CG1-CE2 3.52Å; V803-Y805 HydrophobicContact CG1-CG 3.97Å; V803-Y805 PolarHBondContact O-N 3.37Å; V803-Y805 VanDerWaalsContact O-N 3.17Å; V803-D806 CarbonylContact O-C 3.17Å; V803-D806 PolarHBondContact O-N 2.89Å; V803-D806 VanDerWaalsContact O-O 3.07Å; V803-L809 HydrophobicContact CB-CB 4.3Å; V803-L809 HydrophobicContact CG2-CB 3.95Å; V803-L809 PolarHBondContact N-O 2.81Å; V803-A811 HydrophobicContact CG2-CB 4.07Å; V803-V846 HydrophobicContact CG2-CG1 3.92Å; V803-I848 HydrophobicContact CG1-CD1 4.17Å; V803-I848 HydrophobicContact CG2-CD1 4.42Å
804	P	97.8	Very high	92.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.4	-173.6	-33.3	40.2	0	0	0	115.8	H711 W715 R802 I888 T890 M896	H711-P804 PolarHBondContact NE2-O 3.3Å; W715-P804 HydrophobicContact CZ2-CB 4.34Å; W715-P804 HydrophobicContact CZ2-CG 4.2Å; R802-P804 WeakPolarHBondContact O-CD 3.45Å; P804-I888 HydrophobicContact CB-CD1 4.48Å; P804-I888 HydrophobicContact CB-CG2 3.77Å; P804-I888 VanDerWaalsContact O-CD1 3.26Å; P804-I888 WeakPolarHBondContact O-CD1 3.35Å; P804-T890 HydrophobicContact CB-CG2 4.49Å; P804-M896 HydrophobicContact CB-SD 4.43Å; P804-M896 HydrophobicContact CG-CE 4.41Å; P804-M896 HydrophobicContact CG-SD 3.71Å
805	Y	96.8	Very high	93.1	Very high	19 Å²	19	32.9 Å²	32.9	8%	0.075	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-12	177.4	58	-104.9	0	0	0	114.1	F712 V803 G847 I848 I888 M896 E898	F712-Y805 WeakPolarHBondContact CZ-O 3.49Å; V803-Y805 VanDerWaalsContact C-N 3.3Å; V803-Y805 HydrophobicContact CG1-CD1 3.76Å; V803-Y805 HydrophobicContact CG1-CD2 3.86Å; V803-Y805 HydrophobicContact CG1-CE1 3.41Å; V803-Y805 VanDerWaalsContact CG1-CE1 3.41Å; V803-Y805 HydrophobicContact CG1-CE2 3.52Å; V803-Y805 HydrophobicContact CG1-CG 3.97Å; V803-Y805 PolarHBondContact O-N 3.37Å; V803-Y805 VanDerWaalsContact O-N 3.17Å; Y805-G847 PolarHBondContact OH-O 3.01Å; Y805-I848 HydrophobicContact CE1-CG1 4.21Å; Y805-I848 HydrophobicContact CE1-CG2 4.47Å; Y805-I888 HydrophobicContact CD1-CG2 4.5Å; Y805-M896 HydrophobicContact CD1-CB 4.25Å; Y805-M896 HydrophobicContact CE1-CB 4.47Å; Y805-E898 HydrophobicContact CD2-CB 4.28Å; Y805-E898 HydrophobicContact CE1-CB 4.29Å; Y805-E898 HydrophobicContact CE2-CB 3.68Å; Y805-E898 HydrophobicContact CE2-CG 3.92Å
806	D	96.4	Very high	93.8	Very high	23 Å²	23	28.5 Å²	28.5	12%	0.123	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	90.9	175.9	-177.7	4.7	0	0	0	109.8	R279 R708 V803 G808 L809	R279-D806 IonicContact CZ-OD2 3.29Å; R279-D806 IonicContact NH1-OD2 3.93Å; R279-D806 PolarHBondContact NH1-OD2 3.22Å; R279-D806 IonicContact NH2-OD1 2.71Å; R279-D806 PolarHBondContact NH2-OD1 3.13Å; R279-D806 IonicContact NH2-OD2 3.73Å; R279-D806 PolarHBondContact NH2-OD2 3.33Å; R708-D806 IonicContact NH2-OD1 3.64Å; V803-D806 CarbonylContact O-C 3.17Å; V803-D806 PolarHBondContact O-N 2.89Å; V803-D806 VanDerWaalsContact O-O 3.07Å; D806-G808 PolarHBondContact O-N 2.76Å; D806-G808 VanDerWaalsContact O-N 3.1Å; D806-G808 PolarHBondContact OD1-N 3.47Å; D806-L809 HydrophobicContact CB-CD1 4.28Å; D806-L809 PolarHBondContact O-N 3.19Å; D806-L809 WeakPolarHBondContact OD2-CD1 3.22Å; D806-L809 VanDerWaalsContact OD2-CG 3.3Å; D806-L809 WeakPolarHBondContact OD2-CG 3.41Å
807	P	95.1	Very high	94.7	Very high	11 Å²	11	32.6 Å²	32.6	7%	0.071	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	-12.5	-176	26.1	-34	0	0	0	114.1	R708 H711 F712 R802 L809	R708-P807 HydrophobicContact CG-CG 4.27Å; H711-P807 HydrophobicContact CB-CB 4.39Å; H711-P807 HydrophobicContact CB-CG 4.43Å; F712-P807 HydrophobicContact CE2-CG 4.32Å; R802-P807 PolarHBondContact NH1-O 3.42Å; P807-L809 VanDerWaalsContact C-N 3.28Å
808	G	94.8	Very high	94.9	Very high	3 Å²	3	36 Å²	36	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-16.7	173	0	0	0	0	0	113.2	R279 E280 D806	R279-G808 CarbonylContact C-O 3.53Å; R279-G808 VanDerWaalsContact CA-O 3.3Å; R279-G808 WeakPolarHBondContact CA-O 3.34Å; E280-G808 PolarHBondContact N-O 3Å; D806-G808 PolarHBondContact O-N 2.76Å; D806-G808 VanDerWaalsContact O-N 3.1Å; D806-G808 PolarHBondContact OD1-N 3.47Å
809	L	95.4	Very high	95.1	Very high	15 Å²	15	34.9 Å²	34.9	8%	0.079	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	137.8	177.1	-72.7	174	0	0	0	112	R279 R802 V803 D806 P807	R279-L809 HydrophobicContact CG-CD2 4.05Å; R279-L809 VanDerWaalsContact NH1-CG 3.32Å; R802-L809 WeakPolarHBondContact CA-O 3.49Å; V803-L809 HydrophobicContact CB-CB 4.3Å; V803-L809 HydrophobicContact CG2-CB 3.95Å; V803-L809 PolarHBondContact N-O 2.81Å; D806-L809 HydrophobicContact CB-CD1 4.28Å; D806-L809 PolarHBondContact O-N 3.19Å; D806-L809 WeakPolarHBondContact OD2-CD1 3.22Å; D806-L809 VanDerWaalsContact OD2-CG 3.3Å; D806-L809 WeakPolarHBondContact OD2-CG 3.41Å; P807-L809 VanDerWaalsContact C-N 3.28Å
810	R	95.4	Very high	95.2	Very high	50 Å²	50	31.4 Å²	31.4	19%	0.189	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	111.6	177.5	-131.6	172.9	-168	-90.1	-6.2	110.7	E280 D749 S800 R802 A836	E280-R810 IonicContact OE1-NE 3.44Å; E280-R810 PolarHBondContact OE1-NE 3.26Å; E280-R810 WeakPolarHBondContact OE2-CD 3.4Å; E280-R810 IonicContact OE2-NE 3.33Å; D749-R810 IonicContact OD1-NH2 2.84Å; D749-R810 PolarHBondContact OD1-NH2 2.87Å; S800-R810 PolarHBondContact OG-NH1 2.78Å; R802-R810 HydrophobicContact CG-CG 4.44Å; R810-A836 HydrophobicContact CB-CB 4.18Å; R810-A836 PolarHBondContact O-N 3.28Å
811	A	96.3	Very high	94.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.4	173.8	0	0	0	0	0	109.3	S800 F801 V803 F833	S800-A811 CarbonylContact C-O 3.46Å; S800-A811 WeakPolarHBondContact CA-O 3.29Å; S800-A811 VanDerWaalsContact CB-O 3.26Å; S800-A811 WeakPolarHBondContact CB-O 3.28Å; F801-A811 HydrophobicContact CD1-CB 4.07Å; F801-A811 HydrophobicContact CE1-CB 3.54Å; F801-A811 HydrophobicContact CZ-CB 3.8Å; F801-A811 PolarHBondContact N-O 3.42Å; F801-A811 PolarHBondContact O-N 2.92Å; V803-A811 HydrophobicContact CG2-CB 4.07Å; A811-F833 HydrophobicContact CB-CB 3.91Å; A811-F833 HydrophobicContact CB-CD1 4.22Å; A811-F833 HydrophobicContact CB-CG 4Å
812	G	94.4	Very high	94.4	Very high	7 Å²	7	33.6 Å²	33.6	7%	0.072	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-133	177.3	0	0	0	0	0	111.7	E799 F833 K834	E799-G812 CarbonylContact O-C 3.53Å; E799-G812 WeakPolarHBondContact O-CA 3.42Å; G812-F833 WeakPolarHBondContact O-CD1 3.35Å; G812-K834 WeakPolarHBondContact CA-O 3.36Å; G812-K834 PolarHBondContact N-O 3.05Å
813	T	93.6	Very high	93.5	Very high	68 Å²	68	36.1 Å²	36.1	42%	0.417	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	148.2	-179.8	56.4	0	0	0	0	112.8	F833 K834	T813-F833 CarbonylContact O-C 3.53Å; T813-F833 WeakPolarHBondContact O-CA 3.28Å; T813-K834 PolarHBondContact O-N 2.9Å
814	L	95.1	Very high	92.5	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.042	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	135.2	173.7	-76	159.6	0	0	0	111	L789 Q793 L797 I816 L831 F833	L789-L814 HydrophobicContact CB-CD1 4.44Å; L789-L814 HydrophobicContact CD2-CD1 4.12Å; Q793-L814 VanDerWaalsContact OE1-CB 3.31Å; L797-L814 HydrophobicContact CD1-CD1 3.97Å; L814-I816 VanDerWaalsContact C-N 3.32Å; L814-I816 HydrophobicContact CB-CG1 3.96Å; L814-I816 PolarHBondContact O-N 3.5Å; L814-L831 HydrophobicContact CD2-CB 4.28Å; L814-L831 HydrophobicContact CD2-CD2 4.39Å; L814-F833 HydrophobicContact CD1-CE1 4.36Å; L814-F833 HydrophobicContact CD2-CD1 3.63Å; L814-F833 HydrophobicContact CD2-CD2 4.24Å; L814-F833 HydrophobicContact CD2-CE1 3.23Å; L814-F833 HydrophobicContact CD2-CE2 3.88Å; L814-F833 HydrophobicContact CD2-CG 4.13Å; L814-F833 HydrophobicContact CD2-CZ 3.37Å; L814-F833 HydrophobicContact CG-CD1 3.82Å; L814-F833 HydrophobicContact CG-CE1 3.5Å; L814-F833 VanDerWaalsContact CG-CE1 3.5Å; L814-F833 HydrophobicContact CG-CZ 4.13Å
815	L	94.9	Very high	91.4	Very high	56 Å²	56	45.1 Å²	45.1	29%	0.293	24%	0.238	S	C	.	.			trans	-87.4	76.3	165.7	-58.7	-178	0	0	0	108.6	E817 Q818 C819 Q832 K834 P845	L815-E817 PolarHBondContact O-N 3.08Å; L815-E817 VanDerWaalsContact O-N 3.1Å; L815-Q818 HydrophobicContact CB-CB 4.41Å; L815-Q818 HydrophobicContact CB-CG 4.31Å; L815-Q818 PolarHBondContact O-N 3.41Å; L815-C819 PolarHBondContact O-N 2.9Å; L815-Q832 HydrophobicContact CB-CB 4.19Å; L815-Q832 PolarHBondContact N-O 3.45Å; L815-K834 HydrophobicContact CD2-CB 4.37Å; L815-P845 HydrophobicContact CD1-CB 3.8Å; L815-P845 HydrophobicContact CD1-CG 4.46Å
816	I	93.7	Very high	90.6	Very high	20 Å²	20	47.2 Å²	47.2	10%	0.103	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-54.2	-36.9	-168.1	-59.6	177.3	0	0	0	112.7	R786 L789 E790 L814 Q818 C819	R786-I816 HydrophobicContact CB-CG2 3.68Å; R786-I816 HydrophobicContact CG-CG2 3.75Å; L789-I816 HydrophobicContact CB-CD1 4.49Å; L789-I816 HydrophobicContact CB-CG1 4.44Å; L789-I816 HydrophobicContact CB-CG2 4.45Å; E790-I816 HydrophobicContact CB-CD1 4.13Å; E790-I816 HydrophobicContact CG-CD1 3.41Å; E790-I816 VanDerWaalsContact CG-CD1 3.41Å; E790-I816 HydrophobicContact CG-CG2 4.2Å; L814-I816 VanDerWaalsContact C-N 3.32Å; L814-I816 HydrophobicContact CB-CG1 3.96Å; L814-I816 PolarHBondContact O-N 3.5Å; I816-Q818 PolarHBondContact O-N 2.78Å; I816-C819 WeakPolarHBondContact O-CB 3.43Å; I816-C819 PolarHBondContact O-N 3.39Å; I816-C819 VanDerWaalsContact O-N 3.08Å
817	E	93.5	Very high	90.1	Very high	127 Å²	127	46.8 Å²	46.8	59%	0.593	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-62.6	-24.9	177.4	-64	-56.1	155.6	0	0	113.9	R786 L815	R786-E817 IonicContact CZ-OE2 3.02Å; R786-E817 IonicContact NH1-OE2 3.82Å; R786-E817 PolarHBondContact NH1-OE2 3.3Å; R786-E817 PolarHBondContact NH2-O 2.86Å; L815-E817 PolarHBondContact O-N 3.08Å; L815-E817 VanDerWaalsContact O-N 3.1Å
818	Q	93.1	Very high	89.9	Confident	98 Å²	98	46.6 Å²	46.6	46%	0.458	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-95.4	-6.2	178.7	-54.2	-177	12.6	0	0	112.8	L815 I816 Q832	L815-Q818 HydrophobicContact CB-CB 4.41Å; L815-Q818 HydrophobicContact CB-CG 4.31Å; L815-Q818 PolarHBondContact O-N 3.41Å; I816-Q818 PolarHBondContact O-N 2.78Å; Q818-Q832 HydrophobicContact CB-CB 3.93Å; Q818-Q832 HydrophobicContact CB-CG 3.78Å
819	C	94.1	Very high	89.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.			trans	-78.9	141	176.8	-63.7	0	0	0	0	111.3	L789 L815 I816 W830 L831	L789-C819 HydrophobicContact CD1-CB 3.86Å; L815-C819 PolarHBondContact O-N 2.9Å; I816-C819 WeakPolarHBondContact O-CB 3.43Å; I816-C819 PolarHBondContact O-N 3.39Å; I816-C819 VanDerWaalsContact O-N 3.08Å; C819-W830 VanDerWaalsContact CA-O 3.26Å; C819-W830 WeakPolarHBondContact CA-O 3.28Å; C819-L831 HydrophobicContact CB-CD2 4.39Å
820	K	91.7	Very high	89.9	Confident	99 Å²	99	48.4 Å²	48.4	43%	0.43	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160.8	179.9	62.6	-176.6	178	-175.8	0	112.5	W830	K820-W830 HydrophobicContact CD-CG 4.47Å; K820-W830 HydrophobicContact CG-CB 3.64Å; K820-W830 HydrophobicContact CG-CG 3.9Å; K820-W830 PolarHBondContact N-O 3.47Å; K820-W830 WeakPolarHBondContact O-CB 3.35Å; K820-W830 PolarHBondContact O-N 3.02Å
821	V	89.7	Confident	90	Very high	10 Å²	10	46 Å²	46	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.9	166.1	-175.8	0	0	0	0	108.1	V777 V781 L785 K827 L829	V777-V821 HydrophobicContact CG1-CB 3.92Å; V777-V821 HydrophobicContact CG1-CG1 4.46Å; V777-V821 HydrophobicContact CG2-CB 4.33Å; V777-V821 HydrophobicContact CG2-CG1 4.04Å; V781-V821 HydrophobicContact CG1-CG2 4.01Å; L785-V821 HydrophobicContact CD2-CG2 3.76Å; V821-K827 HydrophobicContact CG1-CB 3.79Å; V821-K827 HydrophobicContact CG1-CG 4.5Å; V821-L829 HydrophobicContact CG2-CD2 3.97Å
822	M	86.1	Confident	90	Very high	59 Å²	59	47.3 Å²	47.3	29%	0.291	25%	0.245	S	C	.	.			trans	-77.1	142.5	178.7	-59	178.5	69.8	0	0	111.1	S824 P828 W830 I849	M822-S824 PolarHBondContact O-N 3.04Å; M822-P828 HydrophobicContact CB-CG 3.92Å; M822-P828 HydrophobicContact CG-CG 4.25Å; M822-P828 PolarHBondContact N-O 2.86Å; M822-P828 HydrophobicContact SD-CB 4.46Å; M822-P828 HydrophobicContact SD-CG 3.85Å; M822-W830 HydrophobicContact CE-CE3 4.26Å; M822-W830 HydrophobicContact CG-CB 4.08Å; M822-W830 HydrophobicContact CG-CE3 4.5Å; M822-W830 HydrophobicContact SD-CE3 4.01Å; M822-I849 HydrophobicContact CE-CD1 4.41Å; M822-I849 HydrophobicContact SD-CD1 4.01Å; M822-I849 HydrophobicContact SD-CG1 4.25Å; M822-I849 HydrophobicContact SD-CG2 4.18Å
823	A	78.3	Confident	90.1	Very high	86 Å²	86	47 Å²	47	71%	0.711	24%	0.242	S	C	*	.	S	Bend	trans	-75.1	70.9	176.3	0	0	0	0	0	111.2	V777	V777-A823 HydrophobicContact CG2-CB 4.47Å
824	S	76.2	Confident	90.1	Very high	56 Å²	56	49.9 Å²	49.9	39%	0.392	25%	0.249	S	C	.	.	S	Bend	trans	-134.8	158.2	177.3	172.3	0	0	0	0	110.3	M822 K826 K827	M822-S824 PolarHBondContact O-N 3.04Å; S824-K826 PolarHBondContact O-N 3.45Å; S824-K827 VanDerWaalsContact O-CG 3.29Å; S824-K827 WeakPolarHBondContact O-CG 3.32Å; S824-K827 PolarHBondContact O-N 2.84Å
825	K	74.1	Confident	90	Very high	133 Å²	133	52 Å²	52	58%	0.578	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-34.2	180	-176.8	179.5	179.2	-177.3	0	113
826	K	80.9	Confident	89.9	Confident	63 Å²	63	51.3 Å²	51.3	27%	0.274	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-3.7	-177	-60.4	-71.3	179.5	123.3	0	113.7	K768 S824 G853 D854	K768-K826 WeakPolarHBondContact CE-O 3.37Å; S824-K826 PolarHBondContact O-N 3.45Å; K826-G853 PolarHBondContact NZ-O 3.44Å; K826-D854 WeakPolarHBondContact CE-OD1 2.84Å; K826-D854 WeakPolarHBondContact CG-OD2 3.48Å; K826-D854 IonicContact NZ-OD1 3.79Å; K826-D854 PolarHBondContact NZ-OD1 3.31Å
827	K	85.9	Confident	89.8	Confident	13 Å²	13	51.2 Å²	51.2	6%	0.057	26%	0.258	C	S	.	.			trans	48.1	55.5	175.9	-57.6	-178.3	-177.2	-175.7	0	113	S771 D773 V821 S824	S771-K827 PolarHBondContact O-NZ 3.31Å; S771-K827 VanDerWaalsContact OG-CD 3.24Å; S771-K827 WeakPolarHBondContact OG-CD 3.39Å; S771-K827 PolarHBondContact OG-NZ 3.32Å; D773-K827 PolarHBondContact O-NZ 3.08Å; V821-K827 HydrophobicContact CG1-CB 3.79Å; V821-K827 HydrophobicContact CG1-CG 4.5Å; S824-K827 VanDerWaalsContact O-CG 3.29Å; S824-K827 WeakPolarHBondContact O-CG 3.32Å; S824-K827 PolarHBondContact O-N 2.84Å
828	P	91.3	Very high	89.6	Confident	7 Å²	7	51.2 Å²	51.2	5%	0.045	27%	0.269	C	S	.	.			trans	-63.9	151	177.3	26.3	-29	0	0	0	110.9	M822 I849 F850 K851	M822-P828 HydrophobicContact CB-CG 3.92Å; M822-P828 HydrophobicContact CG-CG 4.25Å; M822-P828 PolarHBondContact N-O 2.86Å; M822-P828 HydrophobicContact SD-CB 4.46Å; M822-P828 HydrophobicContact SD-CG 3.85Å; P828-I849 HydrophobicContact CB-CG2 3.75Å; P828-I849 HydrophobicContact CG-CG2 4.42Å; P828-F850 WeakPolarHBondContact CA-O 3.5Å; P828-F850 WeakPolarHBondContact CB-O 3.42Å; P828-K851 HydrophobicContact CB-CB 4.48Å; P828-K851 HydrophobicContact CB-CG 4.23Å
829	L	94.9	Very high	89.5	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.6	175.9	-54.5	-175.3	0	0	0	109.2	V763 T764 L785 V821 L831 I849 F850	V763-L829 HydrophobicContact CG1-CD1 4.19Å; T764-L829 HydrophobicContact CG2-CG 4.44Å; T764-L829 WeakPolarHBondContact OG1-CD1 3.29Å; T764-L829 WeakPolarHBondContact OG1-CG 3.28Å; L785-L829 HydrophobicContact CD1-CD1 4.35Å; L785-L829 HydrophobicContact CD1-CD2 4.04Å; L785-L829 HydrophobicContact CD2-CD2 4.38Å; V821-L829 HydrophobicContact CG2-CD2 3.97Å; L829-L831 HydrophobicContact CB-CD2 4.1Å; L829-L831 HydrophobicContact CB-CG 4.13Å; L829-I849 CarbonylContact O-C 3.59Å; L829-I849 VanDerWaalsContact O-CA 3.28Å; L829-I849 WeakPolarHBondContact O-CA 2.92Å; L829-F850 HydrophobicContact CB-CB 4.29Å; L829-F850 PolarHBondContact N-O 3.27Å; L829-F850 PolarHBondContact O-N 2.85Å
830	W	95.3	Very high	89.3	Confident	57 Å²	57	49.6 Å²	49.6	22%	0.216	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	114.4	167.7	178.2	-70	0	0	0	107.9	C819 K820 M822 I849 I899	C819-W830 VanDerWaalsContact CA-O 3.26Å; C819-W830 WeakPolarHBondContact CA-O 3.28Å; K820-W830 HydrophobicContact CD-CG 4.47Å; K820-W830 HydrophobicContact CG-CB 3.64Å; K820-W830 HydrophobicContact CG-CG 3.9Å; K820-W830 PolarHBondContact N-O 3.47Å; K820-W830 WeakPolarHBondContact O-CB 3.35Å; K820-W830 PolarHBondContact O-N 3.02Å; M822-W830 HydrophobicContact CE-CE3 4.26Å; M822-W830 HydrophobicContact CG-CB 4.08Å; M822-W830 HydrophobicContact CG-CE3 4.5Å; M822-W830 HydrophobicContact SD-CE3 4.01Å; W830-I849 HydrophobicContact CE3-CD1 4.31Å; W830-I849 HydrophobicContact CE3-CG1 4.24Å; W830-I849 HydrophobicContact CZ3-CD1 4.41Å; W830-I899 HydrophobicContact CD2-CD1 3.53Å; W830-I899 VanDerWaalsContact CE2-CD1 3.47Å; W830-I899 HydrophobicContact CE3-CD1 3.78Å; W830-I899 HydrophobicContact CE3-CG1 4.41Å; W830-I899 HydrophobicContact CG-CD1 4.07Å; W830-I899 HydrophobicContact CH2-CD1 3.97Å; W830-I899 HydrophobicContact CH2-CG1 4.28Å; W830-I899 HydrophobicContact CH2-CG2 3.46Å; W830-I899 VanDerWaalsContact CH2-CG2 3.46Å; W830-I899 HydrophobicContact CZ2-CD1 3.72Å; W830-I899 HydrophobicContact CZ2-CG1 4.45Å; W830-I899 HydrophobicContact CZ2-CG2 3.68Å; W830-I899 HydrophobicContact CZ3-CD1 3.99Å; W830-I899 HydrophobicContact CZ3-CG1 4.25Å; W830-I899 HydrophobicContact CZ3-CG2 4.18Å
831	L	96.7	Very high	89.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.1	-174.8	-55.4	172.1	0	0	0	109.7	L760 L789 L814 C819 L829 F833 G847 I848 F850	L760-L831 HydrophobicContact CD1-CD1 3.61Å; L760-L831 HydrophobicContact CD2-CD1 3.61Å; L760-L831 HydrophobicContact CG-CD1 4.24Å; L789-L831 HydrophobicContact CD1-CD2 4.17Å; L814-L831 HydrophobicContact CD2-CB 4.28Å; L814-L831 HydrophobicContact CD2-CD2 4.39Å; C819-L831 HydrophobicContact CB-CD2 4.39Å; L829-L831 HydrophobicContact CB-CD2 4.1Å; L829-L831 HydrophobicContact CB-CG 4.13Å; L831-F833 HydrophobicContact CB-CD2 4.37Å; L831-F833 HydrophobicContact CB-CE2 3.62Å; L831-F833 HydrophobicContact CB-CZ 4.22Å; L831-F833 HydrophobicContact CD1-CE2 4.28Å; L831-F833 HydrophobicContact CD1-CZ 4.27Å; L831-G847 WeakPolarHBondContact O-CA 3.26Å; L831-I848 WeakPolarHBondContact CB-O 3.2Å; L831-I848 PolarHBondContact N-O 3.04Å; L831-I848 PolarHBondContact O-N 2.7Å; L831-F850 HydrophobicContact CD1-CB 4.08Å
832	Q	96.4	Very high	88.8	Confident	26 Å²	26	50.5 Å²	50.5	12%	0.121	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.7	175.3	-67.6	-74.9	23.2	0	0	108.5	L815 Q818 P845	L815-Q832 HydrophobicContact CB-CB 4.19Å; L815-Q832 PolarHBondContact N-O 3.45Å; Q818-Q832 HydrophobicContact CB-CB 3.93Å; Q818-Q832 HydrophobicContact CB-CG 3.78Å; Q832-P845 HydrophobicContact CB-CB 4.17Å; Q832-P845 HydrophobicContact CB-CG 4.46Å; Q832-P845 HydrophobicContact CG-CG 4.48Å; Q832-P845 VanDerWaalsContact OE1-CG 3.3Å
833	F	95.8	Very high	88.7	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.7	179.6	-61.8	-97.9	0	0	0	110.4	M756 F801 A811 G812 T813 L814 L831 P845 V846 I848	M756-F833 HydrophobicContact CE-CE1 4.32Å; F801-F833 HydrophobicContact CE1-CD1 4.16Å; F801-F833 AromaticContact CE1-CE1 3.76Å; F801-F833 HydrophobicContact CE1-CE1 3.76Å; F801-F833 HydrophobicContact CE1-CZ 4.16Å; F801-F833 HydrophobicContact CZ-CE1 4.17Å; F801-F833 HydrophobicContact CZ-CZ 4.1Å; A811-F833 HydrophobicContact CB-CB 3.91Å; A811-F833 HydrophobicContact CB-CD1 4.22Å; A811-F833 HydrophobicContact CB-CG 4Å; G812-F833 WeakPolarHBondContact O-CD1 3.35Å; T813-F833 CarbonylContact O-C 3.53Å; T813-F833 WeakPolarHBondContact O-CA 3.28Å; L814-F833 HydrophobicContact CD1-CE1 4.36Å; L814-F833 HydrophobicContact CD2-CD1 3.63Å; L814-F833 HydrophobicContact CD2-CD2 4.24Å; L814-F833 HydrophobicContact CD2-CE1 3.23Å; L814-F833 HydrophobicContact CD2-CE2 3.88Å; L814-F833 HydrophobicContact CD2-CG 4.13Å; L814-F833 HydrophobicContact CD2-CZ 3.37Å; L814-F833 HydrophobicContact CG-CD1 3.82Å; L814-F833 HydrophobicContact CG-CE1 3.5Å; L814-F833 VanDerWaalsContact CG-CE1 3.5Å; L814-F833 HydrophobicContact CG-CZ 4.13Å; L831-F833 HydrophobicContact CB-CD2 4.37Å; L831-F833 HydrophobicContact CB-CE2 3.62Å; L831-F833 HydrophobicContact CB-CZ 4.22Å; L831-F833 HydrophobicContact CD1-CE2 4.28Å; L831-F833 HydrophobicContact CD1-CZ 4.27Å; F833-P845 CarbonylContact O-C 3.57Å; F833-P845 VanDerWaalsContact O-CA 3.23Å; F833-P845 WeakPolarHBondContact O-CA 3.25Å; F833-P845 VanDerWaalsContact O-CB 3.25Å; F833-P845 WeakPolarHBondContact O-CB 3.47Å; F833-V846 HydrophobicContact CB-CB 4.34Å; F833-V846 PolarHBondContact N-O 2.99Å; F833-V846 PolarHBondContact O-N 3.14Å; F833-I848 HydrophobicContact CD2-CD1 4.09Å; F833-I848 HydrophobicContact CD2-CG1 4.33Å; F833-I848 HydrophobicContact CE2-CB 4.22Å; F833-I848 HydrophobicContact CE2-CD1 3.87Å; F833-I848 HydrophobicContact CE2-CG1 4.24Å
834	K	94.8	Very high	89.2	Confident	128 Å²	128	57.1 Å²	57.1	56%	0.557	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	144.3	164.5	-168.3	-176.8	173.9	-174.9	0	108.6	G812 T813 L815 A836	G812-K834 WeakPolarHBondContact CA-O 3.36Å; G812-K834 PolarHBondContact N-O 3.05Å; T813-K834 PolarHBondContact O-N 2.9Å; L815-K834 HydrophobicContact CD2-CB 4.37Å; K834-A836 PolarHBondContact O-N 2.85Å
835	R	92.3	Very high	90	Very high	54 Å²	54	55.8 Å²	55.8	20%	0.204	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.8	167.7	-71.7	-178.1	173	-157.1	-5.1	109.4	T840 V846	R835-T840 HydrophobicContact CB-CG2 4Å; R835-T840 WeakPolarHBondContact CD-OG1 3.23Å; R835-T840 PolarHBondContact NH1-OG1 2.97Å; R835-V846 HydrophobicContact CG-CG2 3.66Å
836	A	93.6	Very high	91	Very high	40 Å²	40	49.9 Å²	49.9	33%	0.331	26%	0.257	S	S	.	.	S	Bend	trans	-76.2	-29.2	-178.1	0	0	0	0	0	112.4	R810 K834 P838	R810-A836 HydrophobicContact CB-CB 4.18Å; R810-A836 PolarHBondContact O-N 3.28Å; K834-A836 PolarHBondContact O-N 2.85Å; A836-P838 WeakPolarHBondContact O-CD 3.39Å
837	D	91.3	Very high	91.8	Very high	19 Å²	19	47.3 Å²	47.3	10%	0.102	25%	0.248	C	C	.	.			trans	-71.1	119.9	-179.4	-174.7	-19.5	0	0	0	111.3	R275 G278 R279 T839 T840	R275-D837 IonicContact CZ-OD2 3.37Å; R275-D837 IonicContact NH1-OD2 2.73Å; R275-D837 PolarHBondContact NH1-OD2 3.48Å; R275-D837 IonicContact NH2-OD1 2.69Å; R275-D837 IonicContact NH2-OD2 3.48Å; R275-D837 PolarHBondContact NH2-OD2 3.04Å; G278-D837 WeakPolarHBondContact CA-OD2 3.27Å; G278-D837 PolarHBondContact N-OD2 2.83Å; R279-D837 PolarHBondContact N-OD2 2.77Å; D837-T839 PolarHBondContact O-N 3.32Å; D837-T839 WeakPolarHBondContact OD1-CA 3.48Å; D837-T839 VanDerWaalsContact OD1-CB 3.3Å; D837-T839 WeakPolarHBondContact OD1-CB 3.32Å; D837-T839 WeakPolarHBondContact OD1-CG2 3.14Å; D837-T839 PolarHBondContact OD1-N 3.12Å; D837-T839 PolarHBondContact OD1-OG1 2.75Å; D837-T839 PolarHBondContact OD2-OG1 3.34Å; D837-T839 VanDerWaalsContact OD2-OG1 3.08Å; D837-T840 WeakPolarHBondContact O-CG2 3.29Å; D837-T840 PolarHBondContact O-N 2.95Å
838	P	89.5	Confident	92.4	Very high	126 Å²	126	46.8 Å²	46.8	82%	0.818	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.6	-179.8	29.8	-35.9	0	0	0	113.6	A836 T840	A836-P838 WeakPolarHBondContact O-CD 3.39Å; P838-T840 PolarHBondContact O-N 3.21Å
839	T	91.1	Very high	92.7	Very high	31 Å²	31	47.6 Å²	47.6	19%	0.19	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-3.1	179.1	71.1	0	0	0	0	113	R275 G278 V308 D837 L841	R275-T839 PolarHBondContact NH2-OG1 3.26Å; G278-T839 PolarHBondContact N-OG1 2.97Å; V308-T839 HydrophobicContact CB-CG2 4.47Å; V308-T839 HydrophobicContact CG1-CG2 4.4Å; V308-T839 HydrophobicContact CG2-CG2 4.07Å; D837-T839 PolarHBondContact O-N 3.32Å; D837-T839 WeakPolarHBondContact OD1-CA 3.48Å; D837-T839 VanDerWaalsContact OD1-CB 3.3Å; D837-T839 WeakPolarHBondContact OD1-CB 3.32Å; D837-T839 WeakPolarHBondContact OD1-CG2 3.14Å; D837-T839 PolarHBondContact OD1-N 3.12Å; D837-T839 PolarHBondContact OD1-OG1 2.75Å; D837-T839 PolarHBondContact OD2-OG1 3.34Å; D837-T839 VanDerWaalsContact OD2-OG1 3.08Å; T839-L841 PolarHBondContact O-N 3.28Å
840	T	89.1	Confident	92.8	Very high	34 Å²	34	47.6 Å²	47.6	21%	0.209	25%	0.25	C	S	.	.			trans	-60.5	126.3	177.6	-175.1	0	0	0	0	111.5	R835 D837 P838 S842	R835-T840 HydrophobicContact CB-CG2 4Å; R835-T840 WeakPolarHBondContact CD-OG1 3.23Å; R835-T840 PolarHBondContact NH1-OG1 2.97Å; D837-T840 WeakPolarHBondContact O-CG2 3.29Å; D837-T840 PolarHBondContact O-N 2.95Å; P838-T840 PolarHBondContact O-N 3.21Å; T840-S842 PolarHBondContact OG1-N 3.38Å; T840-S842 PolarHBondContact OG1-O 3.17Å
841	L	87.4	Confident	92.7	Very high	94 Å²	94	46 Å²	46	49%	0.492	25%	0.245	S	C	.	.			trans	-84.7	-20.6	172.2	-59.5	173	0	0	0	112.1	C277 H306 T839	C277-L841 HydrophobicContact CB-CD1 4.46Å; C277-L841 HydrophobicContact CB-CG 4.49Å; H306-L841 HydrophobicContact CB-CD1 3.58Å; T839-L841 PolarHBondContact O-N 3.28Å
842	S	84.1	Confident	92.6	Very high	34 Å²	34	46.8 Å²	46.8	24%	0.238	25%	0.249	C	C	.	.			trans	-79	130.3	177.1	167.6	0	0	0	0	110.7	T840 D844	T840-S842 PolarHBondContact OG1-N 3.38Å; T840-S842 PolarHBondContact OG1-O 3.17Å; S842-D844 VanDerWaalsContact C-N 3.32Å; S842-D844 WeakPolarHBondContact OG-CB 3.44Å; S842-D844 PolarHBondContact OG-N 2.77Å; S842-D844 VanDerWaalsContact OG-N 3.13Å
843	K	83.8	Confident	92.2	Very high	211 Å²	211	46.5 Å²	46.5	92%	0.917	25%	0.253	S	S	*	.			trans	-82.3	-13.5	169.1	-66.8	-179.2	-179.4	175.6	0	112.9
844	D	88.6	Confident	91.7	Very high	73 Å²	73	48.3 Å²	48.3	39%	0.39	26%	0.262	S	S	.	.			trans	-69.7	144.1	-175.7	-53.1	-23.2	0	0	0	111.8	S842 K901	S842-D844 VanDerWaalsContact C-N 3.32Å; S842-D844 WeakPolarHBondContact OG-CB 3.44Å; S842-D844 PolarHBondContact OG-N 2.77Å; S842-D844 VanDerWaalsContact OG-N 3.13Å; D844-K901 HydrophobicContact CB-CD 4.15Å; D844-K901 VanDerWaalsContact CB-CE 3.49Å; D844-K901 IonicContact OD2-NZ 3.73Å; D844-K901 PolarHBondContact OD2-NZ 3.44Å
845	P	93.6	Very high	91.3	Very high	28 Å²	28	44 Å²	44	18%	0.182	25%	0.245	C	C	.	.			trans	-70.3	164.2	174.6	30.5	-35.4	0	0	0	113	L815 Q832 F833	L815-P845 HydrophobicContact CD1-CB 3.8Å; L815-P845 HydrophobicContact CD1-CG 4.46Å; Q832-P845 HydrophobicContact CB-CB 4.17Å; Q832-P845 HydrophobicContact CB-CG 4.46Å; Q832-P845 HydrophobicContact CG-CG 4.48Å; Q832-P845 VanDerWaalsContact OE1-CG 3.3Å; F833-P845 CarbonylContact O-C 3.57Å; F833-P845 VanDerWaalsContact O-CA 3.23Å; F833-P845 WeakPolarHBondContact O-CA 3.25Å; F833-P845 VanDerWaalsContact O-CB 3.25Å; F833-P845 WeakPolarHBondContact O-CB 3.47Å
846	V	95.5	Very high	91.2	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	110.6	163.9	-179.3	0	0	0	0	107.5	V803 F833 R835 I848	V803-V846 HydrophobicContact CG2-CG1 3.92Å; F833-V846 HydrophobicContact CB-CB 4.34Å; F833-V846 PolarHBondContact N-O 2.99Å; F833-V846 PolarHBondContact O-N 3.14Å; R835-V846 HydrophobicContact CG-CG2 3.66Å; V846-I848 HydrophobicContact CG1-CD1 4.46Å; V846-I848 HydrophobicContact CG1-CG1 4.31Å
847	G	96.7	Very high	90.9	Very high	9 Å²	9	40.7 Å²	40.7	9%	0.093	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.5	-179.9	0	0	0	0	0	112.2	Y805 L831 I899	Y805-G847 PolarHBondContact OH-O 3.01Å; L831-G847 WeakPolarHBondContact O-CA 3.26Å; G847-I899 PolarHBondContact O-N 2.91Å; G847-I899 VanDerWaalsContact O-N 3.1Å
848	I	97.9	Very high	90.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.3	179	-57.3	178.7	0	0	0	109.4	F801 V803 Y805 L831 F833 V846 M896	F801-I848 HydrophobicContact CZ-CD1 4.23Å; V803-I848 HydrophobicContact CG1-CD1 4.17Å; V803-I848 HydrophobicContact CG2-CD1 4.42Å; Y805-I848 HydrophobicContact CE1-CG1 4.21Å; Y805-I848 HydrophobicContact CE1-CG2 4.47Å; L831-I848 WeakPolarHBondContact CB-O 3.2Å; L831-I848 PolarHBondContact N-O 3.04Å; L831-I848 PolarHBondContact O-N 2.7Å; F833-I848 HydrophobicContact CD2-CD1 4.09Å; F833-I848 HydrophobicContact CD2-CG1 4.33Å; F833-I848 HydrophobicContact CE2-CB 4.22Å; F833-I848 HydrophobicContact CE2-CD1 3.87Å; F833-I848 HydrophobicContact CE2-CG1 4.24Å; V846-I848 HydrophobicContact CG1-CD1 4.46Å; V846-I848 HydrophobicContact CG1-CG1 4.31Å; I848-M896 HydrophobicContact CG2-CB 3.91Å; I848-M896 HydrophobicContact CG2-CG 4.01Å; I848-M896 HydrophobicContact CG2-SD 4.14Å
849	I	97.6	Very high	90.6	Very high	25 Å²	25	35 Å²	35	13%	0.128	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	118.5	164.9	-60.6	173.4	0	0	0	108.2	M822 P828 L829 W830 M896 I897 I899	M822-I849 HydrophobicContact CE-CD1 4.41Å; M822-I849 HydrophobicContact SD-CD1 4.01Å; M822-I849 HydrophobicContact SD-CG1 4.25Å; M822-I849 HydrophobicContact SD-CG2 4.18Å; P828-I849 HydrophobicContact CB-CG2 3.75Å; P828-I849 HydrophobicContact CG-CG2 4.42Å; L829-I849 CarbonylContact O-C 3.59Å; L829-I849 VanDerWaalsContact O-CA 3.28Å; L829-I849 WeakPolarHBondContact O-CA 2.92Å; W830-I849 HydrophobicContact CE3-CD1 4.31Å; W830-I849 HydrophobicContact CE3-CG1 4.24Å; W830-I849 HydrophobicContact CZ3-CD1 4.41Å; I849-M896 CarbonylContact O-C 3.58Å; I849-M896 WeakPolarHBondContact O-CA 3.44Å; I849-I897 HydrophobicContact CB-CB 4.19Å; I849-I897 PolarHBondContact N-O 2.65Å; I849-I897 PolarHBondContact O-N 3.08Å; I849-I899 HydrophobicContact CD1-CG1 4.1Å; I849-I899 HydrophobicContact CG1-CD1 3.89Å; I849-I899 HydrophobicContact CG1-CG1 3.61Å
850	F	97.2	Very high	90.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	118.9	171.3	-174.6	-90.3	0	0	0	109.9	T757 L760 Q761 T764 P828 L829 L831 D852 I894 M896	T757-F850 HydrophobicContact CG2-CE2 4.23Å; L760-F850 HydrophobicContact CB-CD1 4.1Å; L760-F850 HydrophobicContact CB-CD2 3.88Å; L760-F850 HydrophobicContact CB-CE1 4.08Å; L760-F850 HydrophobicContact CB-CE2 3.85Å; L760-F850 HydrophobicContact CB-CG 4Å; L760-F850 HydrophobicContact CB-CZ 3.95Å; L760-F850 HydrophobicContact CD1-CB 4.45Å; L760-F850 HydrophobicContact CD1-CD2 3.87Å; L760-F850 HydrophobicContact CD1-CE2 4.41Å; L760-F850 HydrophobicContact CD1-CG 4.24Å; Q761-F850 HydrophobicContact CB-CE1 4.38Å; Q761-F850 HydrophobicContact CB-CZ 4.02Å; T764-F850 VanDerWaalsContact OG1-CD1 3.32Å; T764-F850 WeakPolarHBondContact OG1-CD1 3.45Å; T764-F850 WeakPolarHBondContact OG1-CE1 3.4Å; P828-F850 WeakPolarHBondContact CA-O 3.5Å; P828-F850 WeakPolarHBondContact CB-O 3.42Å; L829-F850 HydrophobicContact CB-CB 4.29Å; L829-F850 PolarHBondContact N-O 3.27Å; L829-F850 PolarHBondContact O-N 2.85Å; L831-F850 HydrophobicContact CD1-CB 4.08Å; F850-D852 HydrophobicContact CE1-CB 4.31Å; F850-I894 HydrophobicContact CZ-CB 4.44Å; F850-M896 HydrophobicContact CD2-CE 4.05Å; F850-M896 HydrophobicContact CD2-CG 4.07Å; F850-M896 HydrophobicContact CE2-CE 4.29Å
851	K	94.6	Very high	90.7	Very high	24 Å²	24	32.4 Å²	32.4	10%	0.104	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.7	-177.7	-153.8	178.3	-156.5	-162	0	109.5	P828 D854 L856 I894 G895 I897	P828-K851 HydrophobicContact CB-CB 4.48Å; P828-K851 HydrophobicContact CB-CG 4.23Å; K851-D854 HydrophobicContact CD-CB 4.06Å; K851-D854 WeakPolarHBondContact CE-OD2 3.25Å; K851-D854 IonicContact NZ-OD2 2.66Å; K851-D854 PolarHBondContact NZ-OD2 3.21Å; K851-L856 HydrophobicContact CB-CD1 4.47Å; K851-L856 HydrophobicContact CD-CD2 3.86Å; K851-I894 CarbonylContact O-C 3.51Å; K851-I894 VanDerWaalsContact O-CA 3.25Å; K851-I894 WeakPolarHBondContact O-CA 3.43Å; K851-G895 PolarHBondContact N-O 2.94Å; K851-G895 PolarHBondContact O-N 2.73Å; K851-I897 HydrophobicContact CD-CD1 4.35Å
852	D	93.2	Very high	90.8	Very high	15 Å²	15	28 Å²	28	8%	0.08	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.5	169.3	173	-49	0	0	0	107.7	T764 R765 K768 F850 K893 I894	T764-D852 HydrophobicContact CG2-CB 3.76Å; R765-D852 IonicContact NE-OD2 3.63Å; R765-D852 PolarHBondContact NE-OD2 3.1Å; K768-D852 PolarHBondContact NZ-O 3.39Å; K768-D852 IonicContact NZ-OD1 3.88Å; K768-D852 PolarHBondContact NZ-OD1 3.29Å; F850-D852 HydrophobicContact CE1-CB 4.31Å; D852-K893 CarbonylContact C-O 3.34Å; D852-K893 WeakPolarHBondContact CA-O 3.26Å; D852-I894 HydrophobicContact CB-CG2 3.92Å
853	G	87.8	Confident	91.3	Very high	20 Å²	20	26.7 Å²	26.7	21%	0.206	14%	0.137	C	C	.	.	S	Bend	trans	101.2	-1.1	173.6	0	0	0	0	0	115.6	K826 K893	K826-G853 PolarHBondContact NZ-O 3.44Å; G853-K893 PolarHBondContact N-O 3.19Å
854	D	85.9	Confident	91.8	Very high	39 Å²	39	17.6 Å²	17.6	21%	0.209	10%	0.098	C	C	.	.	S	Bend	trans	-123.9	147.4	173.2	-69.2	-20.1	0	0	0	110.6	K826 K851 K893	K826-D854 WeakPolarHBondContact CE-OD1 2.84Å; K826-D854 WeakPolarHBondContact CG-OD2 3.48Å; K826-D854 IonicContact NZ-OD1 3.79Å; K826-D854 PolarHBondContact NZ-OD1 3.31Å; K851-D854 HydrophobicContact CD-CB 4.06Å; K851-D854 WeakPolarHBondContact CE-OD2 3.25Å; K851-D854 IonicContact NZ-OD2 2.66Å; K851-D854 PolarHBondContact NZ-OD2 3.21Å; D854-K893 CarbonylContact O-C 3.39Å; D854-K893 WeakPolarHBondContact O-CA 3.16Å
855	D	86	Confident	92	Very high	37 Å²	37	14.1 Å²	14.1	20%	0.198	8%	0.079	C	C	.	.			trans	-87.1	108.9	175.2	-174.4	-7.1	0	0	0	109.6	R857	D855-R857 VanDerWaalsContact C-N 3.33Å; D855-R857 WeakPolarHBondContact OD1-CB 3.48Å; D855-R857 VanDerWaalsContact OD1-CG 3.29Å; D855-R857 WeakPolarHBondContact OD1-CG 3.12Å; D855-R857 PolarHBondContact OD1-N 3.48Å; D855-R857 IonicContact OD1-NE 3.51Å; D855-R857 PolarHBondContact OD1-NE 3.35Å; D855-R857 IonicContact OD2-CZ 3.74Å; D855-R857 IonicContact OD2-NE 2.54Å; D855-R857 PolarHBondContact OD2-NE 2.79Å; D855-R857 VanDerWaalsContact OD2-NE 3.17Å; D855-R857 IonicContact OD2-NH2 2.78Å; D855-R857 PolarHBondContact OD2-NH2 3.47Å
856	L	90.4	Very high	92	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-0.8	-177.6	-65.1	-172.9	0	0	0	113.9	K851 Q858 D859 M860 I897	K851-L856 HydrophobicContact CB-CD1 4.47Å; K851-L856 HydrophobicContact CD-CD2 3.86Å; L856-Q858 PolarHBondContact O-N 2.88Å; L856-D859 PolarHBondContact O-N 3.48Å; L856-M860 VanDerWaalsContact O-CG 3.26Å; L856-M860 WeakPolarHBondContact O-CG 3.49Å; L856-M860 PolarHBondContact O-N 2.74Å; L856-I897 HydrophobicContact CD1-CD1 4.14Å; L856-I897 HydrophobicContact CD1-CG1 3.9Å; L856-I897 HydrophobicContact CD2-CD1 4.08Å
857	R	87	Confident	91.9	Very high	26 Å²	26	16.4 Å²	16.4	10%	0.098	9%	0.089	C	C	.	.	H	α-helix	trans	-62.2	-31.3	179.1	-66.2	179.3	-60.3	166.4	-2.5	112.4	E720 D855 L861	E720-R857 VanDerWaalsContact OE1-CD 3.28Å; E720-R857 WeakPolarHBondContact OE1-CD 3.41Å; E720-R857 IonicContact OE1-CZ 2.79Å; E720-R857 IonicContact OE1-NE 3.23Å; E720-R857 IonicContact OE1-NH1 3.5Å; E720-R857 PolarHBondContact OE1-NH1 2.84Å; E720-R857 IonicContact OE2-NH1 3.2Å; E720-R857 PolarHBondContact OE2-NH1 2.95Å; D855-R857 VanDerWaalsContact C-N 3.33Å; D855-R857 WeakPolarHBondContact OD1-CB 3.48Å; D855-R857 VanDerWaalsContact OD1-CG 3.29Å; D855-R857 WeakPolarHBondContact OD1-CG 3.12Å; D855-R857 PolarHBondContact OD1-N 3.48Å; D855-R857 IonicContact OD1-NE 3.51Å; D855-R857 PolarHBondContact OD1-NE 3.35Å; D855-R857 IonicContact OD2-CZ 3.74Å; D855-R857 IonicContact OD2-NE 2.54Å; D855-R857 PolarHBondContact OD2-NE 2.79Å; D855-R857 VanDerWaalsContact OD2-NE 3.17Å; D855-R857 IonicContact OD2-NH2 2.78Å; D855-R857 PolarHBondContact OD2-NH2 3.47Å; R857-L861 PolarHBondContact O-N 3.47Å
858	Q	85.8	Confident	91.8	Very high	16 Å²	16	16 Å²	16	8%	0.075	9%	0.085	C	C	.	.	H	α-helix	trans	-66.1	-49.5	174.9	-179.3	171.4	-14.4	0	0	111.3	L856 M860 L861 I862 F983 I986	L856-Q858 PolarHBondContact O-N 2.88Å; Q858-M860 VanDerWaalsContact C-N 3.33Å; Q858-M860 PolarHBondContact O-N 2.96Å; Q858-L861 PolarHBondContact O-N 2.74Å; Q858-I862 WeakPolarHBondContact O-CG1 3.44Å; Q858-I862 PolarHBondContact O-N 2.87Å; Q858-I862 VanDerWaalsContact O-N 3.08Å; Q858-F983 PolarHBondContact NE2-O 2.91Å; Q858-I986 HydrophobicContact CG-CD1 4.24Å
859	D	89.8	Confident	91.7	Very high	9 Å²	9	15.9 Å²	15.9	5%	0.048	9%	0.085	C	C	.	.	H	α-helix	trans	-59.9	-42.9	175	-65.9	-101.7	0	0	0	111.7	L856 L861 I862 L863 F983	L856-D859 PolarHBondContact O-N 3.48Å; D859-L861 VanDerWaalsContact C-N 3.34Å; D859-L861 PolarHBondContact O-N 2.94Å; D859-I862 PolarHBondContact O-N 3.07Å; D859-L863 WeakPolarHBondContact O-CB 3.38Å; D859-L863 WeakPolarHBondContact O-CD1 3.36Å; D859-L863 WeakPolarHBondContact O-CG 3.45Å; D859-L863 PolarHBondContact O-N 3.17Å; D859-F983 PolarHBondContact OD1-N 3.44Å
860	M	91.8	Very high	91.4	Very high	11 Å²	11	16.4 Å²	16.4	5%	0.054	9%	0.086	C	C	.	.	H	α-helix	trans	-57.1	-45.5	175.4	-70.9	169.4	66.1	0	0	112.1	L679 F716 L856 Q858 Q864 C887 I888 S889	L679-M860 HydrophobicContact CD1-CE 4.36Å; L679-M860 HydrophobicContact CD2-CB 4.46Å; F716-M860 HydrophobicContact CD1-CE 3.6Å; F716-M860 HydrophobicContact CE1-CE 3.35Å; F716-M860 HydrophobicContact CZ-CE 4.33Å; L856-M860 VanDerWaalsContact O-CG 3.26Å; L856-M860 WeakPolarHBondContact O-CG 3.49Å; L856-M860 PolarHBondContact O-N 2.74Å; Q858-M860 VanDerWaalsContact C-N 3.33Å; Q858-M860 PolarHBondContact O-N 2.96Å; M860-Q864 VanDerWaalsContact O-CB 3.28Å; M860-Q864 WeakPolarHBondContact O-CB 3.48Å; M860-Q864 PolarHBondContact O-N 3.19Å; M860-C887 WeakPolarHBondContact CG-O 3.31Å; M860-I888 HydrophobicContact CE-CG1 4.34Å; M860-S889 PolarHBondContact SD-N 2.81Å
861	L	89.4	Confident	91.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.2	-49.7	177	172.4	61.8	0	0	0	110.6	L679 R857 Q858 D859 L863 Q864 I865 F1049 M1052 M1057 L1060	L679-L861 HydrophobicContact CD2-CB 4.35Å; R857-L861 PolarHBondContact O-N 3.47Å; Q858-L861 PolarHBondContact O-N 2.74Å; D859-L861 VanDerWaalsContact C-N 3.34Å; D859-L861 PolarHBondContact O-N 2.94Å; L861-L863 PolarHBondContact O-N 3.07Å; L861-Q864 WeakPolarHBondContact O-CB 3.36Å; L861-Q864 PolarHBondContact O-N 3.14Å; L861-I865 HydrophobicContact CD1-CD1 4.18Å; L861-I865 HydrophobicContact CD1-CG1 3.83Å; L861-I865 HydrophobicContact CG-CG1 4.28Å; L861-I865 VanDerWaalsContact O-CG1 3.29Å; L861-I865 WeakPolarHBondContact O-CG1 3.47Å; L861-I865 PolarHBondContact O-N 3.45Å; L861-F1049 HydrophobicContact CD2-CD1 4.48Å; L861-F1049 HydrophobicContact CD2-CE1 4.22Å; L861-M1052 HydrophobicContact CB-CE 4.26Å; L861-M1052 HydrophobicContact CD1-CE 4.03Å; L861-M1052 HydrophobicContact CD1-CG 3.74Å; L861-M1052 HydrophobicContact CD1-SD 4.29Å; L861-M1052 HydrophobicContact CD2-CB 3.75Å; L861-M1052 HydrophobicContact CD2-CE 3.99Å; L861-M1052 HydrophobicContact CD2-CG 3.83Å; L861-M1052 HydrophobicContact CG-CE 4.32Å; L861-M1052 HydrophobicContact CG-CG 4.45Å; L861-M1057 HydrophobicContact CD2-CE 3.67Å; L861-M1057 HydrophobicContact CD2-SD 4.36Å; L861-L1060 HydrophobicContact CD2-CD1 3.7Å
862	I	90.8	Very high	91	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63	-44.8	-176.6	-63.5	-61.4	0	0	0	111	Q858 D859 Q864 I865 L866 L960 I962 F983 I986 F1049	Q858-I862 WeakPolarHBondContact O-CG1 3.44Å; Q858-I862 PolarHBondContact O-N 2.87Å; Q858-I862 VanDerWaalsContact O-N 3.08Å; D859-I862 PolarHBondContact O-N 3.07Å; I862-Q864 VanDerWaalsContact C-N 3.3Å; I862-Q864 PolarHBondContact O-N 3.2Å; I862-I865 PolarHBondContact O-N 2.91Å; I862-I865 VanDerWaalsContact O-N 3.15Å; I862-L866 HydrophobicContact CG2-CD1 4.47Å; I862-L866 WeakPolarHBondContact O-CG 3.38Å; I862-L866 PolarHBondContact O-N 3.34Å; I862-L960 HydrophobicContact CD1-CD1 4.38Å; I862-L960 HydrophobicContact CG2-CD1 4.45Å; I862-I962 HydrophobicContact CG2-CD1 3.8Å; I862-F983 HydrophobicContact CB-CB 4.02Å; I862-F983 HydrophobicContact CB-CD1 4.45Å; I862-F983 HydrophobicContact CB-CD2 4.19Å; I862-F983 HydrophobicContact CB-CG 3.97Å; I862-F983 HydrophobicContact CG1-CB 4Å; I862-F983 HydrophobicContact CG1-CG 4.45Å; I862-F983 HydrophobicContact CG2-CB 4.06Å; I862-F983 HydrophobicContact CG2-CD1 3.59Å; I862-F983 HydrophobicContact CG2-CD2 3.96Å; I862-F983 HydrophobicContact CG2-CE1 3.93Å; I862-F983 HydrophobicContact CG2-CE2 4.28Å; I862-F983 HydrophobicContact CG2-CG 3.59Å; I862-F983 HydrophobicContact CG2-CZ 4.25Å; I862-I986 HydrophobicContact CD1-CB 4.41Å; I862-I986 HydrophobicContact CD1-CD1 4.21Å; I862-I986 HydrophobicContact CD1-CG2 3.76Å; I862-I986 HydrophobicContact CG1-CG2 3.92Å; I862-F1049 HydrophobicContact CD1-CE1 4.41Å; I862-F1049 HydrophobicContact CD1-CZ 4.46Å
863	L	94.3	Very high	91	Very high	8 Å²	8	15.6 Å²	15.6	4%	0.042	8%	0.084	C	C	.	.	H	α-helix	trans	-61.3	-39.1	176.3	-72.1	161.7	0	0	0	112.3	D859 L861 L866 L867 P884 Y885 C887 F983	D859-L863 WeakPolarHBondContact O-CB 3.38Å; D859-L863 WeakPolarHBondContact O-CD1 3.36Å; D859-L863 WeakPolarHBondContact O-CG 3.45Å; D859-L863 PolarHBondContact O-N 3.17Å; L861-L863 PolarHBondContact O-N 3.07Å; L863-L866 HydrophobicContact CD2-CD1 4.5Å; L863-L866 PolarHBondContact O-N 3.44Å; L863-L867 PolarHBondContact O-N 3.39Å; L863-P884 HydrophobicContact CD2-CB 4.1Å; L863-Y885 HydrophobicContact CD1-CD2 4.11Å; L863-Y885 HydrophobicContact CD1-CE2 3.73Å; L863-Y885 WeakPolarHBondContact CD1-O 3.43Å; L863-Y885 HydrophobicContact CD2-CD1 4.03Å; L863-Y885 HydrophobicContact CD2-CD2 4.44Å; L863-Y885 HydrophobicContact CD2-CE1 3.91Å; L863-Y885 HydrophobicContact CD2-CE2 4.33Å; L863-Y885 HydrophobicContact CD2-CG 4.29Å; L863-C887 HydrophobicContact CD1-CB 3.27Å; L863-F983 HydrophobicContact CD2-CE2 3.86Å; L863-F983 HydrophobicContact CG-CD2 4.42Å; L863-F983 HydrophobicContact CG-CE2 3.96Å
864	Q	93.4	Very high	91	Very high	19 Å²	19	17.3 Å²	17.3	9%	0.089	9%	0.087	C	C	.	.	H	α-helix	trans	-65.8	-40.8	174.2	-171.7	-163.2	25.5	0	0	112.2	R676 L679 Q680 M860 L861 I862 L866 L867 I868	R676-Q864 WeakPolarHBondContact O-CG 3.04Å; R676-Q864 PolarHBondContact O-NE2 2.89Å; L679-Q864 VanDerWaalsContact CB-OE1 3.31Å; Q680-Q864 VanDerWaalsContact CD-OE1 3.28Å; Q680-Q864 VanDerWaalsContact OE1-CD 3.24Å; Q680-Q864 VanDerWaalsContact OE1-OE1 3.09Å; M860-Q864 VanDerWaalsContact O-CB 3.28Å; M860-Q864 WeakPolarHBondContact O-CB 3.48Å; M860-Q864 PolarHBondContact O-N 3.19Å; L861-Q864 WeakPolarHBondContact O-CB 3.36Å; L861-Q864 PolarHBondContact O-N 3.14Å; I862-Q864 VanDerWaalsContact C-N 3.3Å; I862-Q864 PolarHBondContact O-N 3.2Å; Q864-L866 VanDerWaalsContact C-N 3.31Å; Q864-L866 PolarHBondContact O-N 3.19Å; Q864-L867 WeakPolarHBondContact O-CB 3.11Å; Q864-L867 PolarHBondContact O-N 3.22Å; Q864-I868 HydrophobicContact CG-CD1 4.45Å; Q864-I868 WeakPolarHBondContact O-CG1 3.37Å; Q864-I868 PolarHBondContact O-N 3.28Å
865	I	93.1	Very high	90.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.6	-38.2	175.3	-64.8	-66	0	0	0	110.6	L861 I862 L867 I868 M869 L960 L1048 F1049	L861-I865 HydrophobicContact CD1-CD1 4.18Å; L861-I865 HydrophobicContact CD1-CG1 3.83Å; L861-I865 HydrophobicContact CG-CG1 4.28Å; L861-I865 VanDerWaalsContact O-CG1 3.29Å; L861-I865 WeakPolarHBondContact O-CG1 3.47Å; L861-I865 PolarHBondContact O-N 3.45Å; I862-I865 PolarHBondContact O-N 2.91Å; I862-I865 VanDerWaalsContact O-N 3.15Å; I865-L867 VanDerWaalsContact C-N 3.34Å; I865-L867 PolarHBondContact O-N 3.12Å; I865-I868 HydrophobicContact CD1-CD1 4.35Å; I865-I868 PolarHBondContact O-N 2.96Å; I865-I868 VanDerWaalsContact O-N 3.13Å; I865-M869 HydrophobicContact CG2-CE 3.94Å; I865-M869 HydrophobicContact CG2-CG 4.36Å; I865-M869 HydrophobicContact CG2-SD 4.47Å; I865-M869 WeakPolarHBondContact O-CG 3.49Å; I865-M869 PolarHBondContact O-N 3.47Å; I865-L960 HydrophobicContact CG2-CD1 3.97Å; I865-L960 HydrophobicContact CG2-CD2 4.01Å; I865-L1048 HydrophobicContact CD1-CB 3.88Å; I865-L1048 HydrophobicContact CD1-CD1 3.85Å; I865-L1048 HydrophobicContact CD1-CG 4.46Å; I865-F1049 HydrophobicContact CB-CZ 4.39Å; I865-F1049 HydrophobicContact CD1-CE2 4.04Å; I865-F1049 HydrophobicContact CD1-CZ 4.28Å; I865-F1049 HydrophobicContact CG1-CE2 4.02Å; I865-F1049 HydrophobicContact CG1-CZ 3.79Å; I865-F1049 HydrophobicContact CG2-CE2 3.98Å; I865-F1049 HydrophobicContact CG2-CZ 4.1Å
866	L	94.9	Very high	90.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-60.3	-42.8	173.2	-66.6	176.2	0	0	0	111.6	I862 L863 Q864 I868 M869 E870 L882 P884 Y953 A956 F983	I862-L866 HydrophobicContact CG2-CD1 4.47Å; I862-L866 WeakPolarHBondContact O-CG 3.38Å; I862-L866 PolarHBondContact O-N 3.34Å; L863-L866 HydrophobicContact CD2-CD1 4.5Å; L863-L866 PolarHBondContact O-N 3.44Å; Q864-L866 VanDerWaalsContact C-N 3.31Å; Q864-L866 PolarHBondContact O-N 3.19Å; L866-I868 VanDerWaalsContact C-N 3.28Å; L866-I868 PolarHBondContact O-N 3.34Å; L866-M869 HydrophobicContact CD2-SD 4.4Å; L866-M869 WeakPolarHBondContact O-CB 3.36Å; L866-M869 PolarHBondContact O-N 3.48Å; L866-E870 WeakPolarHBondContact O-CG 3.43Å; L866-E870 PolarHBondContact O-N 3.42Å; L866-L882 HydrophobicContact CB-CD1 4.15Å; L866-L882 HydrophobicContact CD2-CD1 3.93Å; L866-P884 HydrophobicContact CB-CB 4.32Å; L866-Y953 HydrophobicContact CD1-CE1 3.94Å; L866-A956 HydrophobicContact CD2-CB 3.6Å; L866-F983 HydrophobicContact CD1-CZ 4.1Å
867	L	93.3	Very high	90.5	Very high	83 Å²	83	24.7 Å²	24.7	44%	0.435	13%	0.131	S	C	.	.	H	α-helix	trans	-61	-35.8	173.4	-73.9	167	0	0	0	112.7	L863 Q864 I865 S871 P884	L863-L867 PolarHBondContact O-N 3.39Å; Q864-L867 WeakPolarHBondContact O-CB 3.11Å; Q864-L867 PolarHBondContact O-N 3.22Å; I865-L867 VanDerWaalsContact C-N 3.34Å; I865-L867 PolarHBondContact O-N 3.12Å; L867-S871 PolarHBondContact O-N 3.45Å; L867-S871 VanDerWaalsContact O-N 3.09Å; L867-P884 HydrophobicContact CD2-CB 4.1Å; L867-P884 HydrophobicContact CD2-CG 3.37Å; L867-P884 HydrophobicContact CG-CB 3.91Å; L867-P884 HydrophobicContact CG-CG 3.73Å
868	I	93.3	Very high	90.6	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-70.6	-42.3	175.4	-67.5	166.6	0	0	0	110.6	Y677 Q864 I865 L866 E870 S871 I872 L1044 L1048	Y677-I868 HydrophobicContact CD1-CD1 3.94Å; Y677-I868 HydrophobicContact CE1-CD1 3.79Å; Y677-I868 HydrophobicContact CE1-CG1 4.2Å; Q864-I868 HydrophobicContact CG-CD1 4.45Å; Q864-I868 WeakPolarHBondContact O-CG1 3.37Å; Q864-I868 PolarHBondContact O-N 3.28Å; I865-I868 HydrophobicContact CD1-CD1 4.35Å; I865-I868 PolarHBondContact O-N 2.96Å; I865-I868 VanDerWaalsContact O-N 3.13Å; L866-I868 VanDerWaalsContact C-N 3.28Å; L866-I868 PolarHBondContact O-N 3.34Å; I868-E870 VanDerWaalsContact C-N 3.33Å; I868-E870 PolarHBondContact O-N 3.14Å; I868-S871 PolarHBondContact O-N 2.88Å; I868-S871 VanDerWaalsContact O-N 3.16Å; I868-I872 HydrophobicContact CG2-CD1 4.09Å; I868-I872 WeakPolarHBondContact O-CG1 3.49Å; I868-I872 PolarHBondContact O-N 3.1Å; I868-L1044 HydrophobicContact CG2-CD2 4.32Å; I868-L1048 HydrophobicContact CD1-CD1 3.68Å; I868-L1048 HydrophobicContact CG2-CD1 4.18Å
869	M	95.4	Very high	90.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.8	-43.2	174.2	-69.6	-176	170.8	0	0	111.3	I865 L866 S871 I872 W873 A956 V959 L960 L1038 L1045	I865-M869 HydrophobicContact CG2-CE 3.94Å; I865-M869 HydrophobicContact CG2-CG 4.36Å; I865-M869 HydrophobicContact CG2-SD 4.47Å; I865-M869 WeakPolarHBondContact O-CG 3.49Å; I865-M869 PolarHBondContact O-N 3.47Å; L866-M869 HydrophobicContact CD2-SD 4.4Å; L866-M869 WeakPolarHBondContact O-CB 3.36Å; L866-M869 PolarHBondContact O-N 3.48Å; M869-S871 VanDerWaalsContact C-N 3.33Å; M869-S871 PolarHBondContact O-N 2.88Å; M869-I872 PolarHBondContact O-N 3.47Å; M869-W873 HydrophobicContact CB-CE3 4.24Å; M869-W873 HydrophobicContact CB-CH2 3.92Å; M869-W873 HydrophobicContact CB-CZ2 4.21Å; M869-W873 HydrophobicContact CB-CZ3 3.92Å; M869-W873 VanDerWaalsContact O-CD2 3.22Å; M869-W873 PolarHBondContact O-N 3.2Å; M869-W873 HydrophobicContact SD-CH2 4.36Å; M869-A956 HydrophobicContact SD-CB 3.73Å; M869-V959 HydrophobicContact CE-CB 4.46Å; M869-V959 HydrophobicContact CE-CG1 4.11Å; M869-L960 HydrophobicContact CE-CD1 4Å; M869-L960 HydrophobicContact CE-CD2 3.66Å; M869-L960 HydrophobicContact CE-CG 3.73Å; M869-L960 HydrophobicContact SD-CD1 4.49Å; M869-L1038 HydrophobicContact CB-CD2 4.03Å; M869-L1038 HydrophobicContact CE-CD1 3.85Å; M869-L1038 HydrophobicContact CG-CD1 4.29Å; M869-L1038 HydrophobicContact CG-CD2 3.73Å; M869-L1038 HydrophobicContact SD-CD1 3.92Å; M869-L1038 HydrophobicContact SD-CD2 4.45Å; M869-L1045 HydrophobicContact CE-CD2 4.35Å
870	E	92.6	Very high	91	Very high	35 Å²	35	25.5 Å²	25.5	16%	0.164	14%	0.137	C	C	.	.	H	α-helix	trans	-58.4	-43.9	172.7	-73.7	-167.8	116.7	0	0	112.1	K300 L866 I868 I872 W873 E874 L882 P884	K300-E870 IonicContact NZ-OE1 3.74Å; L866-E870 WeakPolarHBondContact O-CG 3.43Å; L866-E870 PolarHBondContact O-N 3.42Å; I868-E870 VanDerWaalsContact C-N 3.33Å; I868-E870 PolarHBondContact O-N 3.14Å; E870-I872 VanDerWaalsContact C-N 3.31Å; E870-I872 PolarHBondContact O-N 3.17Å; E870-W873 PolarHBondContact O-N 3.5Å; E870-E874 WeakPolarHBondContact O-CB 3.2Å; E870-E874 PolarHBondContact O-N 3.44Å; E870-L882 HydrophobicContact CG-CB 3.88Å; E870-L882 HydrophobicContact CG-CD1 3.91Å; E870-L882 HydrophobicContact CG-CG 3.93Å; E870-L882 WeakPolarHBondContact OE1-CB 3.25Å; E870-L882 PolarHBondContact OE1-N 2.66Å; E870-P884 WeakPolarHBondContact OE2-CG 3.48Å
871	S	89.9	Confident	91	Very high	13 Å²	13	25.9 Å²	25.9	9%	0.091	14%	0.14	C	C	.	.	H	α-helix	trans	-65.1	-33.9	177	-175.6	0	0	0	0	112.8	K207 L867 I868 M869 T875	K207-S871 PolarHBondContact NZ-OG 3.46Å; L867-S871 PolarHBondContact O-N 3.45Å; L867-S871 VanDerWaalsContact O-N 3.09Å; I868-S871 PolarHBondContact O-N 2.88Å; I868-S871 VanDerWaalsContact O-N 3.16Å; M869-S871 VanDerWaalsContact C-N 3.33Å; M869-S871 PolarHBondContact O-N 2.88Å; S871-T875 WeakPolarHBondContact O-CG2 3.5Å; S871-T875 PolarHBondContact O-N 2.88Å; S871-T875 VanDerWaalsContact O-N 3.17Å; S871-T875 PolarHBondContact O-OG1 3.43Å
872	I	92.3	Very high	91.2	Very high	8 Å²	8	26.5 Å²	26.5	4%	0.041	14%	0.144	C	C	.	.	H	α-helix	trans	-67.9	-44.9	175	-70.7	163.2	0	0	0	110	I868 M869 E870 E874 T875 E876 A1037 L1038 H1041	I868-I872 HydrophobicContact CG2-CD1 4.09Å; I868-I872 WeakPolarHBondContact O-CG1 3.49Å; I868-I872 PolarHBondContact O-N 3.1Å; M869-I872 PolarHBondContact O-N 3.47Å; E870-I872 VanDerWaalsContact C-N 3.31Å; E870-I872 PolarHBondContact O-N 3.17Å; I872-E874 VanDerWaalsContact C-N 3.31Å; I872-E874 PolarHBondContact O-N 2.91Å; I872-T875 PolarHBondContact O-N 3.46Å; I872-T875 PolarHBondContact O-OG1 3.27Å; I872-E876 PolarHBondContact O-N 3.19Å; I872-A1037 HydrophobicContact CG2-CB 4.38Å; I872-L1038 HydrophobicContact CB-CD2 4.45Å; I872-L1038 HydrophobicContact CD1-CD2 4.18Å; I872-L1038 HydrophobicContact CG2-CD2 4.19Å; I872-H1041 HydrophobicContact CD1-CB 3.81Å; I872-H1041 HydrophobicContact CG1-CB 4.35Å; I872-H1041 HydrophobicContact CG2-CB 4.47Å; I872-H1041 WeakPolarHBondContact CG2-CD2 3.36Å
873	W	93.3	Very high	91.4	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-36.3	177	-65.8	-35.8	0	0	0	112.1	M869 E870 T875 E876 S877 L878 L880 L882 V955 A956 A1034 L1038	M869-W873 HydrophobicContact CB-CE3 4.24Å; M869-W873 HydrophobicContact CB-CH2 3.92Å; M869-W873 HydrophobicContact CB-CZ2 4.21Å; M869-W873 HydrophobicContact CB-CZ3 3.92Å; M869-W873 VanDerWaalsContact O-CD2 3.22Å; M869-W873 PolarHBondContact O-N 3.2Å; M869-W873 HydrophobicContact SD-CH2 4.36Å; E870-W873 PolarHBondContact O-N 3.5Å; W873-T875 VanDerWaalsContact C-N 3.33Å; W873-T875 PolarHBondContact O-N 3.37Å; W873-E876 CarbonylContact O-C 3.59Å; W873-E876 VanDerWaalsContact O-C 3.3Å; W873-E876 WeakPolarHBondContact O-CA 3.42Å; W873-E876 PolarHBondContact O-N 2.81Å; W873-S877 PolarHBondContact O-N 3.31Å; W873-S877 VanDerWaalsContact O-N 3.11Å; W873-L878 CarbonylContact C-O 3.51Å; W873-L878 VanDerWaalsContact C-O 3.3Å; W873-L878 HydrophobicContact CB-CB 3.97Å; W873-L878 WeakPolarHBondContact CB-O 3.31Å; W873-L878 WeakPolarHBondContact O-CB 3.25Å; W873-L878 PolarHBondContact O-N 3.28Å; W873-L880 HydrophobicContact CD2-CD1 3.36Å; W873-L880 HydrophobicContact CD2-CG 4.03Å; W873-L880 HydrophobicContact CE3-CB 4.05Å; W873-L880 HydrophobicContact CE3-CD1 3.41Å; W873-L880 VanDerWaalsContact CE3-CD1 3.41Å; W873-L880 HydrophobicContact CE3-CG 3.87Å; W873-L880 HydrophobicContact CG-CD1 3.95Å; W873-L880 HydrophobicContact CG-CG 4.34Å; W873-L880 HydrophobicContact CH2-CD1 3.78Å; W873-L880 HydrophobicContact CZ2-CD1 3.74Å; W873-L880 HydrophobicContact CZ3-CB 4.22Å; W873-L880 HydrophobicContact CZ3-CD1 3.62Å; W873-L880 HydrophobicContact CZ3-CG 4.33Å; W873-L882 HydrophobicContact CH2-CD1 4.17Å; W873-L882 HydrophobicContact CZ3-CD1 3.52Å; W873-L882 HydrophobicContact CZ3-CD2 4.29Å; W873-L882 HydrophobicContact CZ3-CG 3.86Å; W873-V955 HydrophobicContact CZ2-CG1 4.29Å; W873-A956 HydrophobicContact CH2-CB 4.35Å; W873-A1034 HydrophobicContact CZ2-CB 4.16Å; W873-A1034 PolarHBondContact NE1-O 3Å; W873-L1038 HydrophobicContact CZ2-CD1 3.81Å; W873-L1038 HydrophobicContact CZ2-CD2 4.2Å; W873-L1038 HydrophobicContact CZ2-CG 4.05Å
874	E	88.1	Confident	91.4	Very high	56 Å²	56	29.3 Å²	29.3	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-62	-39.1	174.4	-170.9	-179.5	-167.5	0	0	111.8	P210 E870 I872 E876 S877	P210-E874 HydrophobicContact CB-CG 4.39Å; P210-E874 HydrophobicContact CG-CG 3.57Å; P210-E874 WeakPolarHBondContact CG-OE1 3.48Å; E870-E874 WeakPolarHBondContact O-CB 3.2Å; E870-E874 PolarHBondContact O-N 3.44Å; I872-E874 VanDerWaalsContact C-N 3.31Å; I872-E874 PolarHBondContact O-N 2.91Å; E874-E876 PolarHBondContact O-N 2.77Å; E874-S877 PolarHBondContact O-N 3.47Å
875	T	84.6	Confident	91.5	Very high	84 Å²	84	29 Å²	29	52%	0.515	16%	0.159	S	C	.	.	H	α-helix	trans	-64.1	-28	174.3	48.6	0	0	0	0	113	S871 I872 W873 S877	S871-T875 WeakPolarHBondContact O-CG2 3.5Å; S871-T875 PolarHBondContact O-N 2.88Å; S871-T875 VanDerWaalsContact O-N 3.17Å; S871-T875 PolarHBondContact O-OG1 3.43Å; I872-T875 PolarHBondContact O-N 3.46Å; I872-T875 PolarHBondContact O-OG1 3.27Å; W873-T875 VanDerWaalsContact C-N 3.33Å; W873-T875 PolarHBondContact O-N 3.37Å; T875-S877 VanDerWaalsContact C-N 3.31Å
876	E	82.9	Confident	91.6	Very high	94 Å²	94	29.8 Å²	29.8	44%	0.439	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	13.9	174.1	-62.2	-61.3	152.2	0	0	112.6	I872 W873 E874 L878 A1037	I872-E876 PolarHBondContact O-N 3.19Å; W873-E876 CarbonylContact O-C 3.59Å; W873-E876 VanDerWaalsContact O-C 3.3Å; W873-E876 WeakPolarHBondContact O-CA 3.42Å; W873-E876 PolarHBondContact O-N 2.81Å; E874-E876 PolarHBondContact O-N 2.77Å; E876-L878 VanDerWaalsContact C-N 3.28Å; E876-L878 HydrophobicContact CB-CD1 4.39Å; E876-L878 PolarHBondContact O-N 2.97Å; E876-A1037 HydrophobicContact CB-CB 4.36Å; E876-A1037 HydrophobicContact CG-CB 3.87Å
877	S	85.2	Confident	91.7	Very high	54 Å²	54	30.5 Å²	30.5	38%	0.378	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	31.3	-179.9	-59.2	0	0	0	0	115.1	W873 E874 T875	W873-S877 PolarHBondContact O-N 3.31Å; W873-S877 VanDerWaalsContact O-N 3.11Å; E874-S877 PolarHBondContact O-N 3.47Å; T875-S877 VanDerWaalsContact C-N 3.31Å
878	L	88.8	Confident	91.9	Very high	29 Å²	29	26.6 Å²	26.6	15%	0.152	15%	0.151	C	C	.	.			trans	-107.6	120.1	176.3	-64.1	170.4	0	0	0	110.6	W873 E876 L880 K1033	W873-L878 CarbonylContact C-O 3.51Å; W873-L878 VanDerWaalsContact C-O 3.3Å; W873-L878 HydrophobicContact CB-CB 3.97Å; W873-L878 WeakPolarHBondContact CB-O 3.31Å; W873-L878 WeakPolarHBondContact O-CB 3.25Å; W873-L878 PolarHBondContact O-N 3.28Å; E876-L878 VanDerWaalsContact C-N 3.28Å; E876-L878 HydrophobicContact CB-CD1 4.39Å; E876-L878 PolarHBondContact O-N 2.97Å; L878-L880 HydrophobicContact CB-CD2 4.36Å; L878-K1033 HydrophobicContact CD1-CB 3.83Å; L878-K1033 HydrophobicContact CD2-CB 4.3Å; L878-K1033 HydrophobicContact CD2-CD 4.14Å
879	D	90.1	Very high	92	Very high	35 Å²	35	26.6 Å²	26.6	19%	0.187	15%	0.151	C	C	.	.			trans	-101.6	104	168	-174.2	11.4	0	0	0	109.5	K300 C881	K300-D879 VanDerWaalsContact CE-CG 3.48Å; K300-D879 WeakPolarHBondContact CE-OD1 3.25Å; K300-D879 WeakPolarHBondContact CE-OD2 3.41Å; K300-D879 IonicContact NZ-OD1 3.97Å; K300-D879 PolarHBondContact NZ-OD1 3.47Å; K300-D879 IonicContact NZ-OD2 3.53Å; D879-C881 VanDerWaalsContact C-N 3.34Å; D879-C881 PolarHBondContact OD1-N 2.99Å; D879-C881 VanDerWaalsContact OD1-N 3.15Å
880	L	93.4	Very high	92	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	15%	0.151	C	C	.	.			trans	-92.9	7.2	-179.6	-56.1	-168.6	0	0	0	113.1	W873 L878 L882 Y948 S949 V1030 A1034	W873-L880 HydrophobicContact CD2-CD1 3.36Å; W873-L880 HydrophobicContact CD2-CG 4.03Å; W873-L880 HydrophobicContact CE3-CB 4.05Å; W873-L880 HydrophobicContact CE3-CD1 3.41Å; W873-L880 VanDerWaalsContact CE3-CD1 3.41Å; W873-L880 HydrophobicContact CE3-CG 3.87Å; W873-L880 HydrophobicContact CG-CD1 3.95Å; W873-L880 HydrophobicContact CG-CG 4.34Å; W873-L880 HydrophobicContact CH2-CD1 3.78Å; W873-L880 HydrophobicContact CZ2-CD1 3.74Å; W873-L880 HydrophobicContact CZ3-CB 4.22Å; W873-L880 HydrophobicContact CZ3-CD1 3.62Å; W873-L880 HydrophobicContact CZ3-CG 4.33Å; L878-L880 HydrophobicContact CB-CD2 4.36Å; L880-L882 VanDerWaalsContact C-N 3.27Å; L880-L882 PolarHBondContact O-N 2.73Å; L880-Y948 HydrophobicContact CD2-CD1 4.25Å; L880-Y948 CarbonylContact O-C 3.58Å; L880-Y948 VanDerWaalsContact O-C 3.24Å; L880-S949 WeakPolarHBondContact O-CA 3.04Å; L880-S949 PolarHBondContact O-N 3.49Å; L880-V1030 HydrophobicContact CD2-CG1 3.58Å; L880-A1034 HydrophobicContact CD1-CB 3.41Å; L880-A1034 VanDerWaalsContact CD1-CB 3.41Å
881	C	92.6	Very high	91.9	Very high	18 Å²	18	25 Å²	25	12%	0.122	14%	0.144	C	C	.	.			trans	51.6	41.1	175.1	-56.3	0	0	0	0	113.6	D879 S949	D879-C881 VanDerWaalsContact C-N 3.34Å; D879-C881 PolarHBondContact OD1-N 2.99Å; D879-C881 VanDerWaalsContact OD1-N 3.15Å; C881-S949 WeakPolarHBondContact O-CB 3.28Å
882	L	93.9	Very high	92	Very high	13 Å²	13	28.4 Å²	28.4	7%	0.068	16%	0.161	C	C	.	.			trans	-69	160.2	173.4	-57.4	-165.1	0	0	0	110.1	L866 E870 W873 L880 P884 Y953	L866-L882 HydrophobicContact CB-CD1 4.15Å; L866-L882 HydrophobicContact CD2-CD1 3.93Å; E870-L882 HydrophobicContact CG-CB 3.88Å; E870-L882 HydrophobicContact CG-CD1 3.91Å; E870-L882 HydrophobicContact CG-CG 3.93Å; E870-L882 WeakPolarHBondContact OE1-CB 3.25Å; E870-L882 PolarHBondContact OE1-N 2.66Å; W873-L882 HydrophobicContact CH2-CD1 4.17Å; W873-L882 HydrophobicContact CZ3-CD1 3.52Å; W873-L882 HydrophobicContact CZ3-CD2 4.29Å; W873-L882 HydrophobicContact CZ3-CG 3.86Å; L880-L882 VanDerWaalsContact C-N 3.27Å; L880-L882 PolarHBondContact O-N 2.73Å; L882-P884 VanDerWaalsContact C-CD 3.46Å; L882-Y953 HydrophobicContact CB-CE2 4.17Å; L882-Y953 HydrophobicContact CD2-CD2 3.58Å; L882-Y953 HydrophobicContact CD2-CE2 3.59Å; L882-Y953 HydrophobicContact CD2-CG 4.1Å; L882-Y953 HydrophobicContact CG-CE2 4.42Å
883	L	93.4	Very high	91.9	Very high	39 Å²	39	33.5 Å²	33.5	20%	0.204	18%	0.183	C	C	.	.			trans	-129.2	74.2	177	-156.2	163.3	0	0	0	109.7	Y885 V900 Y953 T973 F979	L883-Y885 PolarHBondContact O-N 3.13Å; L883-V900 HydrophobicContact CD1-CG1 3.76Å; L883-V900 HydrophobicContact CD2-CB 4.47Å; L883-V900 HydrophobicContact CD2-CG1 3.98Å; L883-V900 HydrophobicContact CD2-CG2 3.59Å; L883-Y953 PolarHBondContact N-OH 2.71Å; L883-Y953 VanDerWaalsContact N-OH 3.1Å; L883-Y953 PolarHBondContact O-OH 3.06Å; L883-T973 HydrophobicContact CD1-CG2 4.04Å; L883-F979 HydrophobicContact CB-CB 3.93Å; L883-F979 HydrophobicContact CB-CD1 4.47Å; L883-F979 HydrophobicContact CB-CG 4.19Å; L883-F979 HydrophobicContact CD1-CD1 4.17Å; L883-F979 HydrophobicContact CD1-CE1 4.4Å
884	P	94.3	Very high	92	Very high	29 Å²	29	33.8 Å²	33.8	19%	0.188	18%	0.184	C	C	.	.			trans	-73.3	89.8	171.4	30	-32.5	0	0	0	110	L863 L866 L867 E870 L882	L863-P884 HydrophobicContact CD2-CB 4.1Å; L866-P884 HydrophobicContact CB-CB 4.32Å; L867-P884 HydrophobicContact CD2-CB 4.1Å; L867-P884 HydrophobicContact CD2-CG 3.37Å; L867-P884 HydrophobicContact CG-CB 3.91Å; L867-P884 HydrophobicContact CG-CG 3.73Å; E870-P884 WeakPolarHBondContact OE2-CG 3.48Å; L882-P884 VanDerWaalsContact C-CD 3.46Å
885	Y	95.8	Very high	92.4	Very high	13 Å²	13	31.1 Å²	31.1	5%	0.051	17%	0.172	C	C	.	.			trans	-64.3	155.2	178.2	58.6	-93.5	0	0	0	112.5	L863 L883 C887 I897 V900 F979 I981 D982 F983	L863-Y885 HydrophobicContact CD1-CD2 4.11Å; L863-Y885 HydrophobicContact CD1-CE2 3.73Å; L863-Y885 WeakPolarHBondContact CD1-O 3.43Å; L863-Y885 HydrophobicContact CD2-CD1 4.03Å; L863-Y885 HydrophobicContact CD2-CD2 4.44Å; L863-Y885 HydrophobicContact CD2-CE1 3.91Å; L863-Y885 HydrophobicContact CD2-CE2 4.33Å; L863-Y885 HydrophobicContact CD2-CG 4.29Å; L883-Y885 PolarHBondContact O-N 3.13Å; Y885-C887 HydrophobicContact CE2-CB 4.43Å; Y885-C887 PolarHBondContact O-N 2.72Å; Y885-I897 HydrophobicContact CD2-CG2 3.68Å; Y885-I897 HydrophobicContact CE2-CG2 3.51Å; Y885-V900 HydrophobicContact CG-CG2 4.44Å; Y885-F979 HydrophobicContact CD1-CD2 4.31Å; Y885-F979 HydrophobicContact CD1-CE2 4.49Å; Y885-I981 HydrophobicContact CD1-CG2 4.4Å; Y885-I981 HydrophobicContact CE1-CB 4.29Å; Y885-I981 HydrophobicContact CE1-CG2 3.68Å; Y885-D982 PolarHBondContact OH-N 3.41Å; Y885-F983 HydrophobicContact CE1-CE2 4.18Å; Y885-F983 WeakPolarHBondContact OH-CE2 3.48Å
886	G	96.1	Very high	93	Very high	15 Å²	15	27.1 Å²	27.1	16%	0.155	15%	0.147	C	C	.	.			trans	-61.9	127.4	177.9	0	0	0	0	0	112.6	I897 E898	G886-I897 CarbonylContact O-C 3.57Å; G886-I897 WeakPolarHBondContact O-CA 3.48Å; G886-E898 PolarHBondContact N-OE2 3.18Å; G886-E898 WeakPolarHBondContact O-CB 3.28Å; G886-E898 PolarHBondContact O-N 3.49Å
887	C	96.8	Very high	93.7	Very high	17 Å²	17	23.7 Å²	23.7	12%	0.115	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130.3	173.6	-178.6	0	0	0	0	108.7	M860 L863 Y885 M896	M860-C887 WeakPolarHBondContact CG-O 3.31Å; L863-C887 HydrophobicContact CD1-CB 3.27Å; Y885-C887 HydrophobicContact CE2-CB 4.43Å; Y885-C887 PolarHBondContact O-N 2.72Å; C887-M896 WeakPolarHBondContact CA-O 3.37Å
888	I	96.6	Very high	94.3	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	131.2	180	-161.9	166.3	0	0	0	111.8	F712 W715 P804 Y805 M860 T890 G895 M896	F712-I888 HydrophobicContact CD1-CD1 4.18Å; F712-I888 HydrophobicContact CE1-CD1 4.39Å; W715-I888 HydrophobicContact CB-CD1 3.49Å; W715-I888 VanDerWaalsContact CB-CD1 3.49Å; W715-I888 HydrophobicContact CB-CG1 4.08Å; W715-I888 HydrophobicContact CG-CD1 3.7Å; W715-I888 HydrophobicContact CG-CG1 4.49Å; P804-I888 HydrophobicContact CB-CD1 4.48Å; P804-I888 HydrophobicContact CB-CG2 3.77Å; P804-I888 VanDerWaalsContact O-CD1 3.26Å; P804-I888 WeakPolarHBondContact O-CD1 3.35Å; Y805-I888 HydrophobicContact CD1-CG2 4.5Å; M860-I888 HydrophobicContact CE-CG1 4.34Å; I888-T890 HydrophobicContact CG2-CG2 4.15Å; I888-G895 CarbonylContact O-C 3.53Å; I888-G895 WeakPolarHBondContact O-CA 3.47Å; I888-M896 HydrophobicContact CG2-CB 4.26Å; I888-M896 PolarHBondContact N-O 3.34Å; I888-M896 PolarHBondContact O-N 2.93Å
889	S	95.2	Very high	94.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	128.2	169.3	-173.5	0	0	0	0	109.1	Q723 M860 G891 I894	Q723-S889 PolarHBondContact NE2-OG 2.86Å; M860-S889 PolarHBondContact SD-N 2.81Å; S889-G891 PolarHBondContact OG-O 3.32Å; S889-I894 PolarHBondContact OG-O 3.41Å
890	T	95.4	Very high	94.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-0.7	-176.9	56.9	0	0	0	0	112.9	W715 R718 T757 P804 I888 I894 M896	W715-T890 HydrophobicContact CD2-CG2 4.44Å; W715-T890 HydrophobicContact CE3-CG2 3.9Å; W715-T890 HydrophobicContact CH2-CG2 4.31Å; W715-T890 HydrophobicContact CZ3-CG2 3.82Å; R718-T890 PolarHBondContact NH1-O 3.22Å; T757-T890 WeakPolarHBondContact CG2-OG1 3.47Å; P804-T890 HydrophobicContact CB-CG2 4.49Å; I888-T890 HydrophobicContact CG2-CG2 4.15Å; T890-I894 PolarHBondContact N-O 2.99Å; T890-M896 HydrophobicContact CG2-CG 4.46Å
891	G	91.9	Very high	94.7	Very high	2 Å²	2	27 Å²	27	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.4	-161.6	-178.5	0	0	0	0	0	112.5	Q723 S889 K893 I894	Q723-G891 PolarHBondContact NE2-O 2.76Å; S889-G891 PolarHBondContact OG-O 3.32Å; G891-K893 PolarHBondContact O-N 3.32Å; G891-I894 PolarHBondContact O-N 3.24Å
892	N	90.9	Very high	94.7	Very high	84 Å²	84	31 Å²	31	45%	0.449	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	106.9	-175.7	-169.3	-2.3	0	0	0	113.4	A722 Q723 I894	A722-N892 HydrophobicContact CB-CB 4.19Å; A722-N892 WeakPolarHBondContact O-CB 3.31Å; Q723-N892 HydrophobicContact CG-CB 4.03Å; N892-I894 PolarHBondContact O-N 3.42Å
893	K	91.3	Very high	94.7	Very high	115 Å²	115	31.3 Å²	31.3	50%	0.5	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	33.8	-177	-61.9	177.5	-177	178.8	0	112.9	D852 G853 D854 G891	D852-K893 CarbonylContact C-O 3.34Å; D852-K893 WeakPolarHBondContact CA-O 3.26Å; G853-K893 PolarHBondContact N-O 3.19Å; D854-K893 CarbonylContact O-C 3.39Å; D854-K893 WeakPolarHBondContact O-CA 3.16Å; G891-K893 PolarHBondContact O-N 3.32Å
894	I	94.6	Very high	94.7	Very high	7 Å²	7	31.3 Å²	31.3	4%	0.036	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.3	173.1	62.1	168.5	0	0	0	110.3	T757 Q761 F850 K851 D852 S889 T890 G891 N892	T757-I894 HydrophobicContact CG2-CD1 3.72Å; Q761-I894 HydrophobicContact CG-CG2 4.27Å; F850-I894 HydrophobicContact CZ-CB 4.44Å; K851-I894 CarbonylContact O-C 3.51Å; K851-I894 VanDerWaalsContact O-CA 3.25Å; K851-I894 WeakPolarHBondContact O-CA 3.43Å; D852-I894 HydrophobicContact CB-CG2 3.92Å; S889-I894 PolarHBondContact OG-O 3.41Å; T890-I894 PolarHBondContact N-O 2.99Å; G891-I894 PolarHBondContact O-N 3.24Å; N892-I894 PolarHBondContact O-N 3.42Å
895	G	96.3	Very high	94.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.2	-177.4	171.6	0	0	0	0	0	114	K851 I888	K851-G895 PolarHBondContact N-O 2.94Å; K851-G895 PolarHBondContact O-N 2.73Å; I888-G895 CarbonylContact O-C 3.53Å; I888-G895 WeakPolarHBondContact O-CA 3.47Å
896	M	97.8	Very high	94.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.2	-174.6	-65.3	-176.3	-176.4	0	0	110.3	L760 P804 Y805 I848 I849 F850 C887 I888 T890	L760-M896 HydrophobicContact CD1-CE 4.18Å; P804-M896 HydrophobicContact CB-SD 4.43Å; P804-M896 HydrophobicContact CG-CE 4.41Å; P804-M896 HydrophobicContact CG-SD 3.71Å; Y805-M896 HydrophobicContact CD1-CB 4.25Å; Y805-M896 HydrophobicContact CE1-CB 4.47Å; I848-M896 HydrophobicContact CG2-CB 3.91Å; I848-M896 HydrophobicContact CG2-CG 4.01Å; I848-M896 HydrophobicContact CG2-SD 4.14Å; I849-M896 CarbonylContact O-C 3.58Å; I849-M896 WeakPolarHBondContact O-CA 3.44Å; F850-M896 HydrophobicContact CD2-CE 4.05Å; F850-M896 HydrophobicContact CD2-CG 4.07Å; F850-M896 HydrophobicContact CE2-CE 4.29Å; C887-M896 WeakPolarHBondContact CA-O 3.37Å; I888-M896 HydrophobicContact CG2-CB 4.26Å; I888-M896 PolarHBondContact N-O 3.34Å; I888-M896 PolarHBondContact O-N 2.93Å; T890-M896 HydrophobicContact CG2-CG 4.46Å
897	I	97.4	Very high	94	Very high	22 Å²	22	29.7 Å²	29.7	11%	0.113	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.3	178.5	-54.3	170.9	0	0	0	108.4	I849 K851 L856 Y885 G886	I849-I897 HydrophobicContact CB-CB 4.19Å; I849-I897 PolarHBondContact N-O 2.65Å; I849-I897 PolarHBondContact O-N 3.08Å; K851-I897 HydrophobicContact CD-CD1 4.35Å; L856-I897 HydrophobicContact CD1-CD1 4.14Å; L856-I897 HydrophobicContact CD1-CG1 3.9Å; L856-I897 HydrophobicContact CD2-CD1 4.08Å; Y885-I897 HydrophobicContact CD2-CG2 3.68Å; Y885-I897 HydrophobicContact CE2-CG2 3.51Å; G886-I897 CarbonylContact O-C 3.57Å; G886-I897 WeakPolarHBondContact O-CA 3.48Å
898	E	97.6	Very high	93.6	Very high	69 Å²	69	32.3 Å²	32.3	32%	0.322	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	138.5	175.5	-178	-179	-170.2	0	0	111.3	Y805 G886	Y805-E898 HydrophobicContact CD2-CB 4.28Å; Y805-E898 HydrophobicContact CE1-CB 4.29Å; Y805-E898 HydrophobicContact CE2-CB 3.68Å; Y805-E898 HydrophobicContact CE2-CG 3.92Å; G886-E898 PolarHBondContact N-OE2 3.18Å; G886-E898 WeakPolarHBondContact O-CB 3.28Å; G886-E898 PolarHBondContact O-N 3.49Å
899	I	95.9	Very high	93.2	Very high	20 Å²	20	32.4 Å²	32.4	10%	0.103	17%	0.171	C	C	.	.			trans	-90.5	111	168.3	-62.6	174.1	0	0	0	108.7	W830 G847 I849 K901	W830-I899 HydrophobicContact CD2-CD1 3.53Å; W830-I899 VanDerWaalsContact CE2-CD1 3.47Å; W830-I899 HydrophobicContact CE3-CD1 3.78Å; W830-I899 HydrophobicContact CE3-CG1 4.41Å; W830-I899 HydrophobicContact CG-CD1 4.07Å; W830-I899 HydrophobicContact CH2-CD1 3.97Å; W830-I899 HydrophobicContact CH2-CG1 4.28Å; W830-I899 HydrophobicContact CH2-CG2 3.46Å; W830-I899 VanDerWaalsContact CH2-CG2 3.46Å; W830-I899 HydrophobicContact CZ2-CD1 3.72Å; W830-I899 HydrophobicContact CZ2-CG1 4.45Å; W830-I899 HydrophobicContact CZ2-CG2 3.68Å; W830-I899 HydrophobicContact CZ3-CD1 3.99Å; W830-I899 HydrophobicContact CZ3-CG1 4.25Å; W830-I899 HydrophobicContact CZ3-CG2 4.18Å; G847-I899 PolarHBondContact O-N 2.91Å; G847-I899 VanDerWaalsContact O-N 3.1Å; I849-I899 HydrophobicContact CD1-CG1 4.1Å; I849-I899 HydrophobicContact CG1-CD1 3.89Å; I849-I899 HydrophobicContact CG1-CG1 3.61Å; I899-K901 PolarHBondContact O-N 3.22Å
900	V	94.4	Very high	92.8	Very high	25 Å²	25	32.5 Å²	32.5	15%	0.152	17%	0.171	C	C	.	.			trans	-68.2	124.6	171.8	-173.7	0	0	0	0	109.2	L883 Y885 A903 T973 F979	L883-V900 HydrophobicContact CD1-CG1 3.76Å; L883-V900 HydrophobicContact CD2-CB 4.47Å; L883-V900 HydrophobicContact CD2-CG1 3.98Å; L883-V900 HydrophobicContact CD2-CG2 3.59Å; Y885-V900 HydrophobicContact CG-CG2 4.44Å; V900-A903 HydrophobicContact CB-CB 4.17Å; V900-A903 HydrophobicContact CG1-CB 3.98Å; V900-T973 HydrophobicContact CG1-CG2 4.24Å; V900-F979 HydrophobicContact CB-CE1 4.49Å; V900-F979 HydrophobicContact CB-CE2 4.23Å; V900-F979 HydrophobicContact CB-CZ 3.74Å; V900-F979 HydrophobicContact CG1-CE1 4.04Å; V900-F979 HydrophobicContact CG1-CZ 3.79Å; V900-F979 HydrophobicContact CG2-CE2 3.83Å; V900-F979 HydrophobicContact CG2-CZ 3.86Å
901	K	90.8	Very high	92.2	Very high	76 Å²	76	36.4 Å²	36.4	33%	0.33	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	156.6	-179.6	-64.4	-179.2	-174.5	173	0	111.8	D844 I899 A903	D844-K901 HydrophobicContact CB-CD 4.15Å; D844-K901 VanDerWaalsContact CB-CE 3.49Å; D844-K901 IonicContact OD2-NZ 3.73Å; D844-K901 PolarHBondContact OD2-NZ 3.44Å; I899-K901 PolarHBondContact O-N 3.22Å; K901-A903 PolarHBondContact O-N 2.86Å
902	D	91.8	Very high	91.5	Very high	102 Å²	102	40.4 Å²	40.4	55%	0.545	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	31.3	175.8	-49	-37.6	0	0	0	112.7	T973 E974	D902-T973 CarbonylContact O-C 3.41Å; D902-T973 VanDerWaalsContact O-CA 3.24Å; D902-T973 WeakPolarHBondContact O-CA 3.35Å; D902-E974 HydrophobicContact CB-CB 4.23Å; D902-E974 HydrophobicContact CB-CG 4Å; D902-E974 WeakPolarHBondContact O-CG 3.41Å; D902-E974 PolarHBondContact O-N 3.4Å
903	A	94.3	Very high	90.5	Very high	21 Å²	21	40.9 Å²	40.9	17%	0.174	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140	-176.7	0	0	0	0	0	110.4	V900 K901 M971 I972 T973 F979	V900-A903 HydrophobicContact CB-CB 4.17Å; V900-A903 HydrophobicContact CG1-CB 3.98Å; K901-A903 PolarHBondContact O-N 2.86Å; A903-M971 HydrophobicContact CB-CE 3.82Å; A903-I972 WeakPolarHBondContact CA-O 3.24Å; A903-T973 HydrophobicContact CB-CG2 4.25Å; A903-F979 HydrophobicContact CB-CE1 3.8Å; A903-F979 HydrophobicContact CB-CZ 3.72Å
904	T	92.9	Very high	89.4	Confident	38 Å²	38	38.3 Å²	38.3	23%	0.233	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.4	179.8	-56.1	0	0	0	0	109.7	T908 I909 M971 I972	T904-T908 HydrophobicContact CG2-CG2 3.76Å; T904-I909 HydrophobicContact CG2-CD1 4.33Å; T904-I909 HydrophobicContact CG2-CG1 3.84Å; T904-M971 WeakPolarHBondContact O-CA 3.32Å; T904-I972 PolarHBondContact N-O 3.12Å; T904-I972 PolarHBondContact O-N 3.07Å
905	T	92.5	Very high	88.4	Confident	23 Å²	23	39.5 Å²	39.5	14%	0.141	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	145.8	174.4	67.6	0	0	0	0	110.5	A907 T908 I909 D968 I970 M971	T905-A907 PolarHBondContact O-N 3.21Å; T905-T908 PolarHBondContact O-N 3.46Å; T905-T908 VanDerWaalsContact O-N 3.08Å; T905-T908 WeakPolarHBondContact OG1-CB 3.4Å; T905-T908 PolarHBondContact OG1-N 2.71Å; T905-T908 VanDerWaalsContact OG1-N 3.16Å; T905-T908 PolarHBondContact OG1-OG1 3.33Å; T905-I909 PolarHBondContact O-N 2.89Å; T905-I909 VanDerWaalsContact O-N 3.15Å; T905-D968 WeakPolarHBondContact CG2-O 3.4Å; T905-I970 WeakPolarHBondContact CA-O 3.29Å; T905-M971 HydrophobicContact CG2-CE 4.32Å; T905-M971 HydrophobicContact CG2-CG 3.92Å; T905-M971 HydrophobicContact CG2-SD 4.38Å
906	I	91.4	Very high	86.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-37.2	175.7	-58.7	-59.4	0	0	0	110.5	T908 I909 Q910 L925 N967 I970 I972 L978 F1009 W1104	I906-T908 PolarHBondContact O-N 3.26Å; I906-I909 PolarHBondContact O-N 3.05Å; I906-Q910 HydrophobicContact CG2-CG 4.27Å; I906-Q910 WeakPolarHBondContact O-CB 3.44Å; I906-Q910 WeakPolarHBondContact O-CG 3.38Å; I906-Q910 PolarHBondContact O-N 3.44Å; I906-L925 HydrophobicContact CD1-CD1 3.76Å; I906-L925 HydrophobicContact CD1-CD2 4.19Å; I906-N967 HydrophobicContact CB-CB 4.01Å; I906-N967 HydrophobicContact CG2-CB 4.01Å; I906-N967 PolarHBondContact N-O 3.03Å; I906-I970 HydrophobicContact CG1-CB 4.1Å; I906-I970 HydrophobicContact CG1-CG2 3.88Å; I906-I970 PolarHBondContact N-O 3.29Å; I906-I972 HydrophobicContact CD1-CB 4.17Å; I906-I972 HydrophobicContact CD1-CG2 3.87Å; I906-L978 HydrophobicContact CD1-CD1 4.33Å; I906-F1009 HydrophobicContact CD1-CE1 4.32Å; I906-F1009 HydrophobicContact CG1-CE1 4.35Å; I906-F1009 HydrophobicContact CG1-CZ 4.47Å; I906-W1104 HydrophobicContact CG2-CH2 4.39Å; I906-W1104 HydrophobicContact CG2-CZ3 4.03Å
907	A	87.9	Confident	85.8	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57	-47	174.2	0	0	0	0	0	112.7	T905 I909 Q910 Q911 N967 D968 L1108	T905-A907 PolarHBondContact O-N 3.21Å; A907-I909 VanDerWaalsContact C-N 3.33Å; A907-I909 PolarHBondContact O-N 3.15Å; A907-Q910 PolarHBondContact O-N 3.08Å; A907-Q911 WeakPolarHBondContact O-CB 3.3Å; A907-Q911 VanDerWaalsContact O-CG 3.23Å; A907-Q911 WeakPolarHBondContact O-CG 3.44Å; A907-Q911 PolarHBondContact O-N 3.4Å; A907-N967 HydrophobicContact CB-CB 4.1Å; A907-N967 PolarHBondContact N-O 2.89Å; A907-D968 HydrophobicContact CB-CB 4.36Å; A907-D968 WeakPolarHBondContact CB-OD1 3.41Å; A907-L1108 HydrophobicContact CB-CD2 3.76Å
908	T	88.4	Confident	84.4	Confident	72 Å²	72	44 Å²	44	44%	0.442	26%	0.261	S	S	.	.	H	α-helix	trans	-64.1	-40.5	179.4	-57.8	0	0	0	0	111	T904 T905 I906 Q911 S912	T904-T908 HydrophobicContact CG2-CG2 3.76Å; T905-T908 PolarHBondContact O-N 3.46Å; T905-T908 VanDerWaalsContact O-N 3.08Å; T905-T908 WeakPolarHBondContact OG1-CB 3.4Å; T905-T908 PolarHBondContact OG1-N 2.71Å; T905-T908 VanDerWaalsContact OG1-N 3.16Å; T905-T908 PolarHBondContact OG1-OG1 3.33Å; I906-T908 PolarHBondContact O-N 3.26Å; T908-Q911 PolarHBondContact O-N 2.99Å; T908-S912 PolarHBondContact O-N 3.41Å; T908-S912 VanDerWaalsContact O-N 3.13Å
909	I	88.8	Confident	83.2	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-49.6	176.6	-68.1	162.7	0	0	0	110.4	T904 T905 I906 A907 Q911 S912 I924 L925 W928 I972	T904-I909 HydrophobicContact CG2-CD1 4.33Å; T904-I909 HydrophobicContact CG2-CG1 3.84Å; T905-I909 PolarHBondContact O-N 2.89Å; T905-I909 VanDerWaalsContact O-N 3.15Å; I906-I909 PolarHBondContact O-N 3.05Å; A907-I909 VanDerWaalsContact C-N 3.33Å; A907-I909 PolarHBondContact O-N 3.15Å; I909-Q911 PolarHBondContact O-N 3.36Å; I909-S912 PolarHBondContact O-N 3Å; I909-S912 PolarHBondContact O-OG 3.38Å; I909-I924 HydrophobicContact CG2-CG2 3.9Å; I909-L925 HydrophobicContact CD1-CD1 4.16Å; I909-L925 HydrophobicContact CG2-CD1 4.47Å; I909-W928 HydrophobicContact CD1-CD2 3.75Å; I909-W928 HydrophobicContact CD1-CE3 3.93Å; I909-W928 HydrophobicContact CD1-CG 4.24Å; I909-W928 HydrophobicContact CD1-CH2 4.29Å; I909-W928 HydrophobicContact CD1-CZ2 4.11Å; I909-W928 HydrophobicContact CD1-CZ3 4.21Å; I909-W928 HydrophobicContact CG1-CD2 4.01Å; I909-W928 HydrophobicContact CG1-CG 4.07Å; I909-W928 HydrophobicContact CG1-CZ2 4.44Å; I909-W928 HydrophobicContact CG2-CB 3.75Å; I909-W928 HydrophobicContact CG2-CD2 4.41Å; I909-W928 HydrophobicContact CG2-CG 3.77Å; I909-I972 HydrophobicContact CD1-CG2 3.45Å; I909-I972 VanDerWaalsContact CD1-CG2 3.45Å
910	Q	85.8	Confident	82.3	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.009	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-41.2	179.2	-72.5	171.2	-14.1	0	0	112.4	I906 A907 S912 N967 D1008	I906-Q910 HydrophobicContact CG2-CG 4.27Å; I906-Q910 WeakPolarHBondContact O-CB 3.44Å; I906-Q910 WeakPolarHBondContact O-CG 3.38Å; I906-Q910 PolarHBondContact O-N 3.44Å; A907-Q910 PolarHBondContact O-N 3.08Å; Q910-S912 VanDerWaalsContact C-N 3.3Å; Q910-S912 PolarHBondContact O-N 3.32Å; Q910-N967 PolarHBondContact OE1-ND2 3.4Å; Q910-D1008 PolarHBondContact NE2-OD2 3.42Å
911	Q	83.1	Confident	81.7	Confident	82 Å²	82	46.9 Å²	46.9	38%	0.383	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-30.7	178.1	-72.8	174.4	10.6	0	0	113.1	A907 T908 I909 V913 G915 L1108	A907-Q911 WeakPolarHBondContact O-CB 3.3Å; A907-Q911 VanDerWaalsContact O-CG 3.23Å; A907-Q911 WeakPolarHBondContact O-CG 3.44Å; A907-Q911 PolarHBondContact O-N 3.4Å; T908-Q911 PolarHBondContact O-N 2.99Å; I909-Q911 PolarHBondContact O-N 3.36Å; Q911-V913 VanDerWaalsContact C-N 3.28Å; Q911-V913 PolarHBondContact O-N 3.29Å; Q911-G915 WeakPolarHBondContact O-CA 3.28Å; Q911-G915 PolarHBondContact O-N 2.9Å; Q911-L1108 HydrophobicContact CG-CD2 3.9Å
912	S	78.8	Confident	81.4	Confident	85 Å²	85	45.5 Å²	45.5	59%	0.594	27%	0.266	S	S	*	.	H	α-helix	trans	-64.6	-25.5	-172.2	71.7	0	0	0	0	114.8	T908 I909 Q910	T908-S912 PolarHBondContact O-N 3.41Å; T908-S912 VanDerWaalsContact O-N 3.13Å; I909-S912 PolarHBondContact O-N 3Å; I909-S912 PolarHBondContact O-OG 3.38Å; Q910-S912 VanDerWaalsContact C-N 3.3Å; Q910-S912 PolarHBondContact O-N 3.32Å
913	V	69.5	Low	81.3	Confident	95 Å²	95	44.8 Å²	44.8	58%	0.576	26%	0.26	S	S	*	.	H	α-helix	trans	-99.2	-38.4	-173.4	-173.2	0	0	0	0	112.9	Q911 I924	Q911-V913 VanDerWaalsContact C-N 3.28Å; Q911-V913 PolarHBondContact O-N 3.29Å; V913-I924 HydrophobicContact CB-CD1 4.13Å; V913-I924 HydrophobicContact CB-CG1 4.48Å; V913-I924 HydrophobicContact CG2-CD1 4.49Å; V913-I924 HydrophobicContact CG2-CG1 4.49Å; V913-I924 HydrophobicContact CG2-CG2 3.86Å
914	V	68.4	Low	81.1	Confident	61 Å²	61	44.2 Å²	44.2	37%	0.37	25%	0.254	S	S	.	.	H	α-helix	trans	-142.1	11.5	-172	-149	0	0	0	0	113.3	T917 K921 I924	V914-T917 PolarHBondContact O-OG1 3.27Å; V914-K921 HydrophobicContact CG2-CD 3.91Å; V914-I924 HydrophobicContact CG2-CD1 4.37Å
915	G	72.3	Confident	81	Confident	32 Å²	32	42.6 Å²	42.6	33%	0.33	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	70.1	-153.3	-171.4	0	0	0	0	0	112.3	Q911 T917 G918	Q911-G915 WeakPolarHBondContact O-CA 3.28Å; Q911-G915 PolarHBondContact O-N 2.9Å; G915-T917 PolarHBondContact O-N 3.41Å; G915-G918 PolarHBondContact O-N 2.98Å
916	S	65.4	Low	81	Confident	45 Å²	45	45 Å²	45	32%	0.315	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-62.3	-19.2	-170.8	-48.6	0	0	0	0	115	G918 F1105 V1109	S916-G918 PolarHBondContact O-N 2.92Å; S916-F1105 WeakPolarHBondContact O-CD2 3.33Å; S916-V1109 VanDerWaalsContact CB-CG2 3.48Å
917	T	74.3	Confident	81	Confident	72 Å²	72	49.5 Å²	49.5	44%	0.442	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-75.9	-8.5	175.6	55.9	0	0	0	0	113.5	V914 G915 A919 F920 F1105	V914-T917 PolarHBondContact O-OG1 3.27Å; G915-T917 PolarHBondContact O-N 3.41Å; T917-A919 PolarHBondContact O-N 3.25Å; T917-A919 VanDerWaalsContact O-N 3.14Å; T917-F920 PolarHBondContact O-N 3.49Å; T917-F920 VanDerWaalsContact O-N 3.16Å; T917-F1105 HydrophobicContact CG2-CE2 3.98Å
918	G	68.6	Low	81.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-59.6	-21.3	177.7	0	0	0	0	0	114.4	G915 S916 F920 K921	G915-G918 PolarHBondContact O-N 2.98Å; S916-G918 PolarHBondContact O-N 2.92Å; G918-F920 PolarHBondContact O-N 3.25Å; G918-F920 VanDerWaalsContact O-N 3.13Å; G918-K921 PolarHBondContact O-N 3.43Å
919	A	72.9	Confident	81.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-62.4	-16.4	174.8	0	0	0	0	0	114.8	T917 Q1101 W1104 F1105 L1108	T917-A919 PolarHBondContact O-N 3.25Å; T917-A919 VanDerWaalsContact O-N 3.14Å; A919-Q1101 WeakPolarHBondContact O-CG 3.13Å; A919-Q1101 PolarHBondContact O-NE2 3.1Å; A919-W1104 HydrophobicContact CB-CB 4.28Å; A919-F1105 HydrophobicContact CB-CB 4.28Å; A919-L1108 HydrophobicContact CB-CD1 3.65Å
920	F	75.5	Confident	81.7	Confident	91 Å²	91	51.1 Å²	51.1	40%	0.399	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-100.9	5.1	178.6	-61.9	-63.8	0	0	0	114.1	T917 G918 Q1101 I1102 F1105	T917-F920 PolarHBondContact O-N 3.49Å; T917-F920 VanDerWaalsContact O-N 3.16Å; G918-F920 PolarHBondContact O-N 3.25Å; G918-F920 VanDerWaalsContact O-N 3.13Å; F920-Q1101 HydrophobicContact CD1-CB 4.14Å; F920-Q1101 HydrophobicContact CE1-CB 4.26Å; F920-I1102 HydrophobicContact CE1-CB 4.5Å; F920-I1102 HydrophobicContact CE1-CG1 3.75Å; F920-I1102 HydrophobicContact CZ-CG1 4.11Å; F920-F1105 HydrophobicContact CD2-CB 4.45Å; F920-F1105 HydrophobicContact CD2-CD2 4.02Å; F920-F1105 HydrophobicContact CD2-CG 4.31Å; F920-F1105 HydrophobicContact CE1-CB 4.33Å; F920-F1105 HydrophobicContact CE2-CB 3.55Å; F920-F1105 AromaticContact CE2-CD1 3.84Å; F920-F1105 HydrophobicContact CE2-CD1 3.84Å; F920-F1105 AromaticContact CE2-CD2 3.35Å; F920-F1105 HydrophobicContact CE2-CD2 3.35Å; F920-F1105 HydrophobicContact CE2-CE1 4.34Å; F920-F1105 AromaticContact CE2-CE2 3.93Å; F920-F1105 HydrophobicContact CE2-CE2 3.93Å; F920-F1105 AromaticContact CE2-CG 3.29Å; F920-F1105 HydrophobicContact CE2-CG 3.29Å; F920-F1105 HydrophobicContact CE2-CZ 4.37Å; F920-F1105 HydrophobicContact CZ-CB 3.46Å; F920-F1105 VanDerWaalsContact CZ-CB 3.46Å; F920-F1105 AromaticContact CZ-CD1 3.99Å; F920-F1105 HydrophobicContact CZ-CD1 3.99Å; F920-F1105 HydrophobicContact CZ-CD2 4.16Å; F920-F1105 AromaticContact CZ-CG 3.62Å; F920-F1105 HydrophobicContact CZ-CG 3.62Å
921	K	82.8	Confident	82.1	Confident	83 Å²	83	56.4 Å²	56.4	36%	0.361	30%	0.298	S	S	.	.			trans	-105.7	110.7	177.7	-69	-161.5	178	-174.6	0	110.4	V914 G918 E923 I924	V914-K921 HydrophobicContact CG2-CD 3.91Å; G918-K921 PolarHBondContact O-N 3.43Å; K921-E923 VanDerWaalsContact C-N 3.28Å; K921-E923 PolarHBondContact O-N 3.14Å; K921-I924 HydrophobicContact CB-CD1 3.61Å; K921-I924 HydrophobicContact CB-CG1 3.69Å; K921-I924 HydrophobicContact CD-CD1 4.09Å; K921-I924 HydrophobicContact CD-CG1 4.32Å; K921-I924 HydrophobicContact CG-CD1 4.29Å
922	D	84.6	Confident	82.5	Confident	48 Å²	48	56.5 Å²	56.5	26%	0.257	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-28.9	-173.4	-57.8	-15.4	0	0	0	111.9	P1007 D1008 Y1011 Q1101	D922-P1007 WeakPolarHBondContact OD1-CB 3.29Å; D922-D1008 WeakPolarHBondContact O-CA 3.16Å; D922-Y1011 HydrophobicContact CB-CD2 4.06Å; D922-Y1011 HydrophobicContact CB-CG 4.29Å; D922-Q1101 PolarHBondContact OD1-NE2 3.23Å
923	E	88.6	Confident	83.1	Confident	87 Å²	87	53.1 Å²	53.1	41%	0.407	27%	0.273	S	S	.	.	H	α-helix	trans	-79.5	-15.3	-175.6	65.6	-85.8	-173	0	0	115.6	K921 L925 Y926 Q927 Y1011	K921-E923 VanDerWaalsContact C-N 3.28Å; K921-E923 PolarHBondContact O-N 3.14Å; E923-L925 PolarHBondContact O-N 3Å; E923-Y926 PolarHBondContact O-N 3.36Å; E923-Q927 PolarHBondContact O-N 2.65Å; E923-Y1011 HydrophobicContact CB-CD1 4.41Å; E923-Y1011 HydrophobicContact CB-CE1 3.88Å; E923-Y1011 HydrophobicContact CB-CE2 4.45Å
924	I	89.9	Confident	84.1	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.046	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-46.1	-171.2	-67.7	178.4	0	0	0	111.6	I909 V913 V914 K921 Y926 Q927 W928	I909-I924 HydrophobicContact CG2-CG2 3.9Å; V913-I924 HydrophobicContact CB-CD1 4.13Å; V913-I924 HydrophobicContact CB-CG1 4.48Å; V913-I924 HydrophobicContact CG2-CD1 4.49Å; V913-I924 HydrophobicContact CG2-CG1 4.49Å; V913-I924 HydrophobicContact CG2-CG2 3.86Å; V914-I924 HydrophobicContact CG2-CD1 4.37Å; K921-I924 HydrophobicContact CB-CD1 3.61Å; K921-I924 HydrophobicContact CB-CG1 3.69Å; K921-I924 HydrophobicContact CD-CD1 4.09Å; K921-I924 HydrophobicContact CD-CG1 4.32Å; K921-I924 HydrophobicContact CG-CD1 4.29Å; I924-Y926 VanDerWaalsContact C-N 3.34Å; I924-Y926 PolarHBondContact O-N 3.07Å; I924-Q927 PolarHBondContact O-N 2.86Å; I924-W928 WeakPolarHBondContact O-CB 3.43Å; I924-W928 PolarHBondContact O-N 3.34Å
925	L	91.4	Very high	85.2	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-41.8	-177.1	-178	60.8	0	0	0	111.4	I906 I909 E923 W928 L929 F946 I972 D1008 F1009 V1012	I906-L925 HydrophobicContact CD1-CD1 3.76Å; I906-L925 HydrophobicContact CD1-CD2 4.19Å; I909-L925 HydrophobicContact CD1-CD1 4.16Å; I909-L925 HydrophobicContact CG2-CD1 4.47Å; E923-L925 PolarHBondContact O-N 3Å; L925-W928 PolarHBondContact O-N 3.06Å; L925-L929 WeakPolarHBondContact O-CB 3.18Å; L925-L929 PolarHBondContact O-N 2.91Å; L925-F946 HydrophobicContact CD2-CE2 4.04Å; L925-F946 HydrophobicContact CD2-CZ 4.19Å; L925-I972 HydrophobicContact CD1-CD1 4.19Å; L925-I972 HydrophobicContact CD1-CG2 4.2Å; L925-D1008 HydrophobicContact CB-CB 4.5Å; L925-F1009 HydrophobicContact CD2-CD1 3.61Å; L925-F1009 HydrophobicContact CD2-CE1 3.81Å; L925-V1012 HydrophobicContact CB-CG2 4.22Å; L925-V1012 HydrophobicContact CD2-CG2 3.92Å; L925-V1012 HydrophobicContact CG-CG2 3.87Å
926	Y	92.8	Very high	86.1	Confident	74 Å²	74	56.6 Å²	56.6	29%	0.29	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-47.1	175	175	-84.1	0	0	0	111.4	E923 I924 L929 R930 F939 Y1011	E923-Y926 PolarHBondContact O-N 3.36Å; I924-Y926 VanDerWaalsContact C-N 3.34Å; I924-Y926 PolarHBondContact O-N 3.07Å; Y926-L929 PolarHBondContact O-N 3.31Å; Y926-R930 WeakPolarHBondContact O-CB 3.5Å; Y926-R930 PolarHBondContact O-N 3.43Å; Y926-F939 AromaticContact CD2-CZ 3.94Å; Y926-F939 HydrophobicContact CD2-CZ 3.94Å; Y926-F939 HydrophobicContact CE1-CZ 4.21Å; Y926-F939 AromaticContact CE2-CE1 3.85Å; Y926-F939 HydrophobicContact CE2-CE1 3.85Å; Y926-F939 AromaticContact CE2-CZ 3.43Å; Y926-F939 HydrophobicContact CE2-CZ 3.43Å; Y926-F939 VanDerWaalsContact CE2-CZ 3.43Å; Y926-F939 AromaticContact CZ-CE1 3.78Å; Y926-F939 AromaticContact CZ-CZ 3.56Å; Y926-F939 WeakPolarHBondContact OH-CE1 3.47Å; Y926-Y1011 HydrophobicContact CD1-CE1 4.19Å; Y926-Y1011 HydrophobicContact CD2-CD1 4.38Å; Y926-Y1011 HydrophobicContact CD2-CE1 4.45Å; Y926-Y1011 HydrophobicContact CG-CD1 4.04Å; Y926-Y1011 AromaticContact CG-CE1 3.96Å; Y926-Y1011 HydrophobicContact CG-CE1 3.96Å
927	Q	91.8	Very high	87.3	Confident	96 Å²	96	61 Å²	61	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-44.3	179.6	-171.7	60.9	46.7	0	0	111.3	E923 I924 L929 R930 D931	E923-Q927 PolarHBondContact O-N 2.65Å; I924-Q927 PolarHBondContact O-N 2.86Å; Q927-L929 VanDerWaalsContact C-N 3.34Å; Q927-L929 PolarHBondContact O-N 3.02Å; Q927-R930 PolarHBondContact O-N 2.64Å; Q927-D931 PolarHBondContact NE2-OD1 2.92Å; Q927-D931 WeakPolarHBondContact O-CB 3.45Å; Q927-D931 PolarHBondContact O-N 3.42Å
928	W	93.6	Very high	88.1	Confident	35 Å²	35	63.1 Å²	63.1	13%	0.133	30%	0.302	C	S	.	.	H	α-helix	trans	-57.6	-47.3	176	-179.7	90.8	0	0	0	111.5	I909 I924 L925 R930 D931 K932 I972 E974	I909-W928 HydrophobicContact CD1-CD2 3.75Å; I909-W928 HydrophobicContact CD1-CE3 3.93Å; I909-W928 HydrophobicContact CD1-CG 4.24Å; I909-W928 HydrophobicContact CD1-CH2 4.29Å; I909-W928 HydrophobicContact CD1-CZ2 4.11Å; I909-W928 HydrophobicContact CD1-CZ3 4.21Å; I909-W928 HydrophobicContact CG1-CD2 4.01Å; I909-W928 HydrophobicContact CG1-CG 4.07Å; I909-W928 HydrophobicContact CG1-CZ2 4.44Å; I909-W928 HydrophobicContact CG2-CB 3.75Å; I909-W928 HydrophobicContact CG2-CD2 4.41Å; I909-W928 HydrophobicContact CG2-CG 3.77Å; I924-W928 WeakPolarHBondContact O-CB 3.43Å; I924-W928 PolarHBondContact O-N 3.34Å; L925-W928 PolarHBondContact O-N 3.06Å; W928-R930 VanDerWaalsContact C-N 3.3Å; W928-R930 PolarHBondContact O-N 3.01Å; W928-D931 PolarHBondContact O-N 3.07Å; W928-K932 HydrophobicContact CD2-CG 4.26Å; W928-K932 HydrophobicContact CE3-CG 4.38Å; W928-K932 HydrophobicContact CH2-CG 4.18Å; W928-K932 HydrophobicContact CZ2-CD 4.46Å; W928-K932 HydrophobicContact CZ2-CG 4.05Å; W928-K932 HydrophobicContact CZ3-CG 4.33Å; W928-K932 WeakPolarHBondContact O-CG 3.39Å; W928-K932 PolarHBondContact O-N 3.46Å; W928-K932 VanDerWaalsContact O-N 3.17Å; W928-I972 HydrophobicContact CE3-CG2 4.3Å; W928-I972 HydrophobicContact CH2-CG2 4.07Å; W928-I972 HydrophobicContact CZ3-CG2 3.7Å; W928-E974 HydrophobicContact CH2-CG 4.08Å; W928-E974 HydrophobicContact CZ2-CG 4.33Å
929	L	93.1	Very high	89.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.4	-37.5	179.1	-169.5	63.5	0	0	0	111.5	L925 Y926 Q927 K932 C933 F939 A942 V943 I972 V1012	L925-L929 WeakPolarHBondContact O-CB 3.18Å; L925-L929 PolarHBondContact O-N 2.91Å; Y926-L929 PolarHBondContact O-N 3.31Å; Q927-L929 VanDerWaalsContact C-N 3.34Å; Q927-L929 PolarHBondContact O-N 3.02Å; L929-K932 PolarHBondContact O-N 3.14Å; L929-C933 PolarHBondContact O-N 3.2Å; L929-C933 PolarHBondContact O-SG 3.21Å; L929-F939 HydrophobicContact CB-CE2 4.29Å; L929-F939 HydrophobicContact CD2-CE2 4.43Å; L929-F939 HydrophobicContact CG-CE2 4.22Å; L929-A942 HydrophobicContact CD1-CB 4.1Å; L929-A942 HydrophobicContact CD2-CB 4.21Å; L929-A942 HydrophobicContact CG-CB 4.19Å; L929-V943 HydrophobicContact CD2-CG2 4.32Å; L929-I972 HydrophobicContact CD1-CD1 4.34Å; L929-V1012 HydrophobicContact CD2-CG1 4.33Å
930	R	93.4	Very high	90.2	Very high	73 Å²	73	67 Å²	67	28%	0.275	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-40.8	176.1	-173.8	64.2	-176.4	91.3	-11.4	112.3	Y926 Q927 W928 K932 C933 E936 F939	Y926-R930 WeakPolarHBondContact O-CB 3.5Å; Y926-R930 PolarHBondContact O-N 3.43Å; Q927-R930 PolarHBondContact O-N 2.64Å; W928-R930 VanDerWaalsContact C-N 3.3Å; W928-R930 PolarHBondContact O-N 3.01Å; R930-K932 VanDerWaalsContact C-N 3.28Å; R930-K932 PolarHBondContact O-N 3.33Å; R930-C933 PolarHBondContact NH1-O 2.74Å; R930-C933 PolarHBondContact O-N 2.99Å; R930-C933 VanDerWaalsContact O-N 3.16Å; R930-E936 IonicContact CZ-OE2 3.75Å; R930-E936 IonicContact NE-OE2 3.77Å; R930-E936 PolarHBondContact NE-OE2 3.38Å; R930-E936 IonicContact NH2-OE2 2.84Å; R930-E936 PolarHBondContact NH2-OE2 3.25Å; R930-F939 VanDerWaalsContact CA-CE2 3.5Å; R930-F939 HydrophobicContact CB-CD2 4.09Å; R930-F939 HydrophobicContact CB-CE2 3.7Å; R930-F939 HydrophobicContact CB-CZ 4.09Å; R930-F939 VanDerWaalsContact CD-CG 3.41Å; R930-F939 HydrophobicContact CG-CD2 4.46Å; R930-F939 HydrophobicContact CG-CE2 4.37Å
931	D	93.1	Very high	90.9	Very high	114 Å²	114	66.2 Å²	66.2	61%	0.61	32%	0.318	S	S	*	.	H	α-helix	trans	-67.6	-28.2	-179.8	-67.6	-15.3	0	0	0	112.2	Q927 W928 C933	Q927-D931 PolarHBondContact NE2-OD1 2.92Å; Q927-D931 WeakPolarHBondContact O-CB 3.45Å; Q927-D931 PolarHBondContact O-N 3.42Å; W928-D931 PolarHBondContact O-N 3.07Å; D931-C933 VanDerWaalsContact C-N 3.34Å
932	K	92.6	Very high	91.5	Very high	83 Å²	83	62.3 Å²	62.3	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-77.6	-18.1	174	-64.1	-59	-173.6	162.1	0	113.7	W928 L929 R930 E974	W928-K932 HydrophobicContact CD2-CG 4.26Å; W928-K932 HydrophobicContact CE3-CG 4.38Å; W928-K932 HydrophobicContact CH2-CG 4.18Å; W928-K932 HydrophobicContact CZ2-CD 4.46Å; W928-K932 HydrophobicContact CZ2-CG 4.05Å; W928-K932 HydrophobicContact CZ3-CG 4.33Å; W928-K932 WeakPolarHBondContact O-CG 3.39Å; W928-K932 PolarHBondContact O-N 3.46Å; W928-K932 VanDerWaalsContact O-N 3.17Å; L929-K932 PolarHBondContact O-N 3.14Å; R930-K932 VanDerWaalsContact C-N 3.28Å; R930-K932 PolarHBondContact O-N 3.33Å; K932-E974 HydrophobicContact CB-CB 4.24Å; K932-E974 HydrophobicContact CB-CG 4.43Å; K932-E974 HydrophobicContact CD-CG 3.86Å; K932-E974 WeakPolarHBondContact CE-OE1 3.26Å; K932-E974 HydrophobicContact CG-CB 4.34Å; K932-E974 HydrophobicContact CG-CG 4.01Å; K932-E974 IonicContact NZ-OE1 2.65Å; K932-E974 PolarHBondContact NZ-OE1 3.23Å
933	C	90.8	Very high	91.9	Very high	14 Å²	14	60.3 Å²	60.3	10%	0.095	29%	0.29	C	S	.	.			trans	-96.5	114.4	-175.2	-67.6	0	0	0	0	112.4	L929 R930 D931 S935 F939	L929-C933 PolarHBondContact O-N 3.2Å; L929-C933 PolarHBondContact O-SG 3.21Å; R930-C933 PolarHBondContact NH1-O 2.74Å; R930-C933 PolarHBondContact O-N 2.99Å; R930-C933 VanDerWaalsContact O-N 3.16Å; D931-C933 VanDerWaalsContact C-N 3.34Å; C933-S935 VanDerWaalsContact C-N 3.27Å; C933-S935 PolarHBondContact O-N 3.43Å; C933-F939 HydrophobicContact CB-CB 3.72Å; C933-F939 HydrophobicContact CB-CD2 4.17Å; C933-F939 HydrophobicContact CB-CG 4.43Å
934	V	89.7	Confident	92.2	Very high	125 Å²	125	59.8 Å²	59.8	76%	0.758	29%	0.288	S	S	*	.	S	Bend	trans	-67.7	-20.2	-179.1	-63.5	0	0	0	0	114.8	K938	V934-K938 HydrophobicContact CG2-CD 3.67Å
935	S	92.3	Very high	92.4	Very high	44 Å²	44	63 Å²	63	31%	0.308	30%	0.299	S	S	.	.	S	Bend	trans	-139.9	158.4	179.1	71	0	0	0	0	111.2	C933 E937 K938 F939	C933-S935 VanDerWaalsContact C-N 3.27Å; C933-S935 PolarHBondContact O-N 3.43Å; S935-E937 VanDerWaalsContact C-N 3.29Å; S935-E937 PolarHBondContact O-N 3.35Å; S935-K938 PolarHBondContact O-N 2.66Å; S935-K938 PolarHBondContact OG-N 2.83Å; S935-F939 PolarHBondContact O-N 3.19Å
936	E	91.6	Very high	92.6	Very high	92 Å²	92	62.8 Å²	62.8	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-37.7	175.9	-170.2	58	-145.7	0	0	111.6	R930 F939 Q940	R930-E936 IonicContact CZ-OE2 3.75Å; R930-E936 IonicContact NE-OE2 3.77Å; R930-E936 PolarHBondContact NE-OE2 3.38Å; R930-E936 IonicContact NH2-OE2 2.84Å; R930-E936 PolarHBondContact NH2-OE2 3.25Å; E936-F939 WeakPolarHBondContact O-CB 3.14Å; E936-F939 PolarHBondContact O-N 3.44Å; E936-Q940 WeakPolarHBondContact O-CG 3.34Å; E936-Q940 PolarHBondContact O-N 3.17Å; E936-Q940 PolarHBondContact OE1-NE2 3.35Å
937	E	90.8	Very high	92.7	Very high	139 Å²	139	59.4 Å²	59.4	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-61.2	-46.5	175.8	-173.7	-176	177.7	0	0	112.1	S935 F939 Q940 Q941	S935-E937 VanDerWaalsContact C-N 3.29Å; S935-E937 PolarHBondContact O-N 3.35Å; E937-F939 VanDerWaalsContact C-N 3.26Å; E937-F939 PolarHBondContact O-N 2.79Å; E937-Q940 PolarHBondContact O-N 2.6Å; E937-Q941 WeakPolarHBondContact O-CG 3.41Å; E937-Q941 PolarHBondContact O-N 3.18Å
938	K	89.6	Confident	92.9	Very high	115 Å²	115	57.6 Å²	57.6	50%	0.5	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-34.6	175.6	-76.6	-169.3	-178.6	-173.9	0	111.9	V934 S935 Q941 A942	V934-K938 HydrophobicContact CG2-CD 3.67Å; S935-K938 PolarHBondContact O-N 2.66Å; S935-K938 PolarHBondContact OG-N 2.83Å; K938-Q941 PolarHBondContact O-N 3.21Å; K938-A942 WeakPolarHBondContact O-CB 3.48Å; K938-A942 PolarHBondContact O-N 2.76Å
939	F	93.8	Very high	93.1	Very high	1 Å²	1	56 Å²	56	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-46.9	175.4	-179	-115.9	0	0	0	111.9	Y926 L929 R930 C933 S935 E936 E937 Q941 A942 V943	Y926-F939 AromaticContact CD2-CZ 3.94Å; Y926-F939 HydrophobicContact CD2-CZ 3.94Å; Y926-F939 HydrophobicContact CE1-CZ 4.21Å; Y926-F939 AromaticContact CE2-CE1 3.85Å; Y926-F939 HydrophobicContact CE2-CE1 3.85Å; Y926-F939 AromaticContact CE2-CZ 3.43Å; Y926-F939 HydrophobicContact CE2-CZ 3.43Å; Y926-F939 VanDerWaalsContact CE2-CZ 3.43Å; Y926-F939 AromaticContact CZ-CE1 3.78Å; Y926-F939 AromaticContact CZ-CZ 3.56Å; Y926-F939 WeakPolarHBondContact OH-CE1 3.47Å; L929-F939 HydrophobicContact CB-CE2 4.29Å; L929-F939 HydrophobicContact CD2-CE2 4.43Å; L929-F939 HydrophobicContact CG-CE2 4.22Å; R930-F939 VanDerWaalsContact CA-CE2 3.5Å; R930-F939 HydrophobicContact CB-CD2 4.09Å; R930-F939 HydrophobicContact CB-CE2 3.7Å; R930-F939 HydrophobicContact CB-CZ 4.09Å; R930-F939 VanDerWaalsContact CD-CG 3.41Å; R930-F939 HydrophobicContact CG-CD2 4.46Å; R930-F939 HydrophobicContact CG-CE2 4.37Å; C933-F939 HydrophobicContact CB-CB 3.72Å; C933-F939 HydrophobicContact CB-CD2 4.17Å; C933-F939 HydrophobicContact CB-CG 4.43Å; S935-F939 PolarHBondContact O-N 3.19Å; E936-F939 WeakPolarHBondContact O-CB 3.14Å; E936-F939 PolarHBondContact O-N 3.44Å; E937-F939 VanDerWaalsContact C-N 3.26Å; E937-F939 PolarHBondContact O-N 2.79Å; F939-Q941 VanDerWaalsContact C-N 3.32Å; F939-Q941 PolarHBondContact O-N 3.37Å; F939-A942 WeakPolarHBondContact O-CB 3.37Å; F939-A942 PolarHBondContact O-N 2.91Å; F939-A942 VanDerWaalsContact O-N 3.08Å; F939-V943 HydrophobicContact CD1-CG2 4.45Å; F939-V943 HydrophobicContact CD2-CG2 4.34Å; F939-V943 HydrophobicContact CE1-CG2 4.01Å; F939-V943 HydrophobicContact CE2-CG2 3.89Å; F939-V943 HydrophobicContact CZ-CG2 3.71Å; F939-V943 WeakPolarHBondContact O-CG2 3.46Å; F939-V943 PolarHBondContact O-N 3.05Å
940	Q	92.5	Very high	93.3	Very high	80 Å²	80	56 Å²	56	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-61.2	-40.5	175.5	-65.5	-57.5	-39.1	0	0	111.9	E936 E937 A942 V943 E944	E936-Q940 WeakPolarHBondContact O-CG 3.34Å; E936-Q940 PolarHBondContact O-N 3.17Å; E936-Q940 PolarHBondContact OE1-NE2 3.35Å; E937-Q940 PolarHBondContact O-N 2.6Å; Q940-A942 VanDerWaalsContact C-N 3.33Å; Q940-A942 PolarHBondContact O-N 2.78Å; Q940-V943 PolarHBondContact O-N 3.38Å; Q940-E944 WeakPolarHBondContact O-CB 3.34Å; Q940-E944 PolarHBondContact O-N 3.16Å
941	Q	91	Very high	93.4	Very high	75 Å²	75	52.5 Å²	52.5	35%	0.35	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-39	172.7	-69.7	175.1	14	0	0	112.4	E937 K938 F939 E944 R945	E937-Q941 WeakPolarHBondContact O-CG 3.41Å; E937-Q941 PolarHBondContact O-N 3.18Å; K938-Q941 PolarHBondContact O-N 3.21Å; F939-Q941 VanDerWaalsContact C-N 3.32Å; F939-Q941 PolarHBondContact O-N 3.37Å; Q941-E944 PolarHBondContact O-N 3.25Å; Q941-R945 WeakPolarHBondContact O-CG 3.46Å; Q941-R945 PolarHBondContact O-N 3.42Å
942	A	93.9	Very high	93.6	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-68.6	-40.6	178	0	0	0	0	0	112.1	L929 K938 F939 Q940 E944 R945 F946 S975	L929-A942 HydrophobicContact CD1-CB 4.1Å; L929-A942 HydrophobicContact CD2-CB 4.21Å; L929-A942 HydrophobicContact CG-CB 4.19Å; K938-A942 WeakPolarHBondContact O-CB 3.48Å; K938-A942 PolarHBondContact O-N 2.76Å; F939-A942 WeakPolarHBondContact O-CB 3.37Å; F939-A942 PolarHBondContact O-N 2.91Å; F939-A942 VanDerWaalsContact O-N 3.08Å; Q940-A942 VanDerWaalsContact C-N 3.33Å; Q940-A942 PolarHBondContact O-N 2.78Å; A942-E944 VanDerWaalsContact C-N 3.33Å; A942-R945 PolarHBondContact O-N 3.06Å; A942-F946 WeakPolarHBondContact O-CB 3.18Å; A942-F946 PolarHBondContact O-N 3.23Å; A942-S975 WeakPolarHBondContact CA-O 3.48Å; A942-S975 WeakPolarHBondContact CB-O 3.39Å
943	V	94.7	Very high	93.7	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.036	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-39.7	172.8	172.6	0	0	0	0	111	L929 F939 Q940 F946 L947 V1012	L929-V943 HydrophobicContact CD2-CG2 4.32Å; F939-V943 HydrophobicContact CD1-CG2 4.45Å; F939-V943 HydrophobicContact CD2-CG2 4.34Å; F939-V943 HydrophobicContact CE1-CG2 4.01Å; F939-V943 HydrophobicContact CE2-CG2 3.89Å; F939-V943 HydrophobicContact CZ-CG2 3.71Å; F939-V943 WeakPolarHBondContact O-CG2 3.46Å; F939-V943 PolarHBondContact O-N 3.05Å; Q940-V943 PolarHBondContact O-N 3.38Å; V943-F946 WeakPolarHBondContact O-CB 3.38Å; V943-F946 PolarHBondContact O-N 3.37Å; V943-L947 PolarHBondContact O-N 3.44Å; V943-V1012 HydrophobicContact CG2-CG1 4.43Å
944	E	93.3	Very high	93.9	Very high	76 Å²	76	42.8 Å²	42.8	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-65.9	-44.9	175.5	-177.3	167.1	-142.7	0	0	112	Q940 Q941 A942 F946 L947 Y948 K1026	Q940-E944 WeakPolarHBondContact O-CB 3.34Å; Q940-E944 PolarHBondContact O-N 3.16Å; Q941-E944 PolarHBondContact O-N 3.25Å; A942-E944 VanDerWaalsContact C-N 3.33Å; E944-F946 VanDerWaalsContact C-N 3.28Å; E944-F946 PolarHBondContact O-N 2.78Å; E944-L947 WeakPolarHBondContact O-CB 3.31Å; E944-L947 PolarHBondContact O-N 3.02Å; E944-Y948 HydrophobicContact CG-CD2 3.72Å; E944-Y948 HydrophobicContact CG-CE2 3.42Å; E944-Y948 VanDerWaalsContact CG-CE2 3.42Å; E944-Y948 WeakPolarHBondContact O-CD2 2.86Å; E944-Y948 PolarHBondContact O-N 3.17Å; E944-K1026 IonicContact OE1-NZ 2.71Å; E944-K1026 PolarHBondContact OE1-NZ 3.2Å
945	R	94	Very high	94.3	Very high	76 Å²	76	36.9 Å²	36.9	29%	0.287	17%	0.171	S	C	.	.	H	α-helix	trans	-59.2	-40.7	172.5	-74.5	-172.1	-170.8	102.1	0.2	111.8	Q941 A942 L947 Y948 S949 S975 G976	Q941-R945 WeakPolarHBondContact O-CG 3.46Å; Q941-R945 PolarHBondContact O-N 3.42Å; A942-R945 PolarHBondContact O-N 3.06Å; R945-L947 VanDerWaalsContact C-N 3.34Å; R945-L947 PolarHBondContact O-N 3.34Å; R945-Y948 PolarHBondContact O-N 2.82Å; R945-S949 VanDerWaalsContact O-CB 3.31Å; R945-S949 WeakPolarHBondContact O-CB 3.32Å; R945-S949 PolarHBondContact O-N 3.19Å; R945-S949 PolarHBondContact O-OG 3.36Å; R945-S975 WeakPolarHBondContact CD-O 3.43Å; R945-G976 CarbonylContact C-O 3.57Å
946	F	96.4	Very high	94.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.4	-44.9	175.2	178.2	-91	0	0	0	111.3	L925 A942 V943 E944 S949 C950 I972 G976 L978 F1009 V1012 M1013	L925-F946 HydrophobicContact CD2-CE2 4.04Å; L925-F946 HydrophobicContact CD2-CZ 4.19Å; A942-F946 WeakPolarHBondContact O-CB 3.18Å; A942-F946 PolarHBondContact O-N 3.23Å; V943-F946 WeakPolarHBondContact O-CB 3.38Å; V943-F946 PolarHBondContact O-N 3.37Å; E944-F946 VanDerWaalsContact C-N 3.28Å; E944-F946 PolarHBondContact O-N 2.78Å; F946-S949 PolarHBondContact O-OG 3.32Å; F946-C950 HydrophobicContact CE1-CB 4.39Å; F946-C950 WeakPolarHBondContact O-CA 3.29Å; F946-C950 WeakPolarHBondContact O-CB 3.49Å; F946-C950 PolarHBondContact O-N 3.44Å; F946-I972 HydrophobicContact CD2-CD1 3.62Å; F946-I972 HydrophobicContact CE2-CD1 4Å; F946-G976 WeakPolarHBondContact CA-O 3.29Å; F946-G976 WeakPolarHBondContact CB-O 3.41Å; F946-G976 PolarHBondContact N-O 3.35Å; F946-L978 HydrophobicContact CD2-CB 4.32Å; F946-L978 HydrophobicContact CE2-CB 4.42Å; F946-L978 HydrophobicContact CE2-CD1 3.98Å; F946-F1009 HydrophobicContact CE1-CB 4.27Å; F946-F1009 HydrophobicContact CZ-CB 3.88Å; F946-F1009 AromaticContact CZ-CD1 3.92Å; F946-F1009 HydrophobicContact CZ-CD1 3.92Å; F946-F1009 AromaticContact CZ-CG 3.87Å; F946-F1009 HydrophobicContact CZ-CG 3.87Å; F946-V1012 HydrophobicContact CB-CG1 4.36Å; F946-V1012 HydrophobicContact CD1-CB 3.97Å; F946-V1012 HydrophobicContact CD1-CG1 3.42Å; F946-V1012 VanDerWaalsContact CD1-CG1 3.42Å; F946-V1012 HydrophobicContact CD2-CG1 4.43Å; F946-V1012 HydrophobicContact CE1-CB 3.71Å; F946-V1012 HydrophobicContact CE1-CG1 3.73Å; F946-V1012 HydrophobicContact CE1-CG2 4.37Å; F946-V1012 HydrophobicContact CG-CG1 3.82Å; F946-V1012 HydrophobicContact CZ-CB 4.18Å; F946-V1012 HydrophobicContact CZ-CG1 4.34Å; F946-V1012 HydrophobicContact CZ-CG2 4.35Å; F946-M1013 HydrophobicContact CD1-CE 4.33Å; F946-M1013 HydrophobicContact CE1-CE 3.77Å; F946-M1013 HydrophobicContact CE1-CG 4.38Å
947	L	95.9	Very high	94.4	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-50.5	177.5	-178.5	161.1	0	0	0	111.8	V943 E944 R945 G951 H1023 K1026 F1027 V1030	V943-L947 PolarHBondContact O-N 3.44Å; E944-L947 WeakPolarHBondContact O-CB 3.31Å; E944-L947 PolarHBondContact O-N 3.02Å; R945-L947 VanDerWaalsContact C-N 3.34Å; R945-L947 PolarHBondContact O-N 3.34Å; L947-G951 PolarHBondContact O-N 2.83Å; L947-H1023 HydrophobicContact CD1-CB 4.15Å; L947-H1023 WeakPolarHBondContact CD1-O 3.34Å; L947-K1026 HydrophobicContact CD1-CB 4.26Å; L947-K1026 HydrophobicContact CD1-CD 4.42Å; L947-K1026 HydrophobicContact CD1-CG 4.31Å; L947-K1026 HydrophobicContact CD2-CG 4.32Å; L947-F1027 HydrophobicContact CD1-CB 4.34Å; L947-F1027 HydrophobicContact CD2-CB 4.34Å; L947-F1027 HydrophobicContact CG-CB 4.01Å; L947-V1030 HydrophobicContact CD2-CG2 4.12Å
948	Y	95.8	Very high	94.5	Very high	59 Å²	59	24.8 Å²	24.8	23%	0.231	11%	0.109	C	C	.	.	H	α-helix	trans	-66.1	-49.2	-178.7	-76.5	-69.8	0	0	0	112.3	L880 E944 R945 C950 G951 G952 K1026 V1030	L880-Y948 HydrophobicContact CD2-CD1 4.25Å; L880-Y948 CarbonylContact O-C 3.58Å; L880-Y948 VanDerWaalsContact O-C 3.24Å; E944-Y948 HydrophobicContact CG-CD2 3.72Å; E944-Y948 HydrophobicContact CG-CE2 3.42Å; E944-Y948 VanDerWaalsContact CG-CE2 3.42Å; E944-Y948 WeakPolarHBondContact O-CD2 2.86Å; E944-Y948 PolarHBondContact O-N 3.17Å; R945-Y948 PolarHBondContact O-N 2.82Å; Y948-C950 PolarHBondContact O-N 3.24Å; Y948-G951 PolarHBondContact O-N 3.14Å; Y948-G952 PolarHBondContact O-N 3.43Å; Y948-K1026 WeakPolarHBondContact OH-CE 3.3Å; Y948-K1026 PolarHBondContact OH-NZ 3.37Å; Y948-V1030 HydrophobicContact CD1-CG1 4Å; Y948-V1030 HydrophobicContact CD1-CG2 3.87Å; Y948-V1030 HydrophobicContact CE1-CG1 4.48Å; Y948-V1030 HydrophobicContact CE1-CG2 3.56Å
949	S	96.9	Very high	94.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.6	-41.7	178.8	58.4	0	0	0	0	112.1	L880 C881 R945 F946 G952 Y953 L978	L880-S949 WeakPolarHBondContact O-CA 3.04Å; L880-S949 PolarHBondContact O-N 3.49Å; C881-S949 WeakPolarHBondContact O-CB 3.28Å; R945-S949 VanDerWaalsContact O-CB 3.31Å; R945-S949 WeakPolarHBondContact O-CB 3.32Å; R945-S949 PolarHBondContact O-N 3.19Å; R945-S949 PolarHBondContact O-OG 3.36Å; F946-S949 PolarHBondContact O-OG 3.32Å; S949-G952 PolarHBondContact O-N 2.7Å; S949-Y953 VanDerWaalsContact O-CD2 3.32Å; S949-Y953 WeakPolarHBondContact O-CD2 3.43Å; S949-Y953 PolarHBondContact O-N 3.1Å; S949-L978 WeakPolarHBondContact CB-O 3.43Å; S949-L978 PolarHBondContact OG-N 3.45Å
950	C	96.6	Very high	94.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.007	9%	0.086	C	C	.	.	H	α-helix	trans	-61.2	-45.7	173.4	-174	0	0	0	0	111.4	F946 Y948 Y953 C954 L978 M1013 F1027	F946-C950 HydrophobicContact CE1-CB 4.39Å; F946-C950 WeakPolarHBondContact O-CA 3.29Å; F946-C950 WeakPolarHBondContact O-CB 3.49Å; F946-C950 PolarHBondContact O-N 3.44Å; Y948-C950 PolarHBondContact O-N 3.24Å; C950-Y953 PolarHBondContact O-N 3.41Å; C950-C954 VanDerWaalsContact O-CB 3.28Å; C950-C954 WeakPolarHBondContact O-CB 3.38Å; C950-C954 PolarHBondContact O-N 3.23Å; C950-C954 PolarHBondContact O-SG 3.14Å; C950-L978 HydrophobicContact CB-CD2 3.87Å; C950-M1013 HydrophobicContact CB-CE 4.15Å; C950-F1027 HydrophobicContact CB-CE2 4.36Å
951	G	96.4	Very high	94.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.7	-45.8	177.4	0	0	0	0	0	112.8	L947 Y948 C954 V955 C1031	L947-G951 PolarHBondContact O-N 2.83Å; Y948-G951 PolarHBondContact O-N 3.14Å; G951-C954 PolarHBondContact O-N 2.99Å; G951-V955 WeakPolarHBondContact O-CG2 3.42Å; G951-V955 PolarHBondContact O-N 3.4Å; G951-C1031 VanDerWaalsContact CA-SG 3.54Å
952	G	96.3	Very high	93.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60.5	-49	176.3	0	0	0	0	0	112.9	Y948 S949 V955 A956	Y948-G952 PolarHBondContact O-N 3.43Å; S949-G952 PolarHBondContact O-N 2.7Å; G952-V955 PolarHBondContact O-N 3.13Å; G952-A956 VanDerWaalsContact O-CB 3.28Å; G952-A956 WeakPolarHBondContact O-CB 3.26Å; G952-A956 PolarHBondContact O-N 2.85Å
953	Y	96.2	Very high	93	Very high	1 Å²	1	12.2 Å²	12.2	0%	0.004	5%	0.053	C	C	.	.	H	α-helix	trans	-68.6	-33.2	177	-83.3	-76.9	0	0	0	112.9	L866 L882 L883 S949 C950 T957 L978 F979 H980	L866-Y953 HydrophobicContact CD1-CE1 3.94Å; L882-Y953 HydrophobicContact CB-CE2 4.17Å; L882-Y953 HydrophobicContact CD2-CD2 3.58Å; L882-Y953 HydrophobicContact CD2-CE2 3.59Å; L882-Y953 HydrophobicContact CD2-CG 4.1Å; L882-Y953 HydrophobicContact CG-CE2 4.42Å; L883-Y953 PolarHBondContact N-OH 2.71Å; L883-Y953 VanDerWaalsContact N-OH 3.1Å; L883-Y953 PolarHBondContact O-OH 3.06Å; S949-Y953 VanDerWaalsContact O-CD2 3.32Å; S949-Y953 WeakPolarHBondContact O-CD2 3.43Å; S949-Y953 PolarHBondContact O-N 3.1Å; C950-Y953 PolarHBondContact O-N 3.41Å; Y953-T957 VanDerWaalsContact O-CB 3.26Å; Y953-T957 WeakPolarHBondContact O-CB 3.37Å; Y953-T957 WeakPolarHBondContact O-CG2 3.26Å; Y953-T957 PolarHBondContact O-N 3.08Å; Y953-T957 PolarHBondContact O-OG1 2.99Å; Y953-L978 WeakPolarHBondContact CD2-O 3.47Å; Y953-L978 WeakPolarHBondContact CE2-O 3.37Å; Y953-F979 VanDerWaalsContact CE2-CA 3.43Å; Y953-F979 HydrophobicContact CE2-CB 3.63Å; Y953-F979 WeakPolarHBondContact OH-CB 3.49Å; Y953-H980 HydrophobicContact CD1-CB 3.92Å; Y953-H980 AromaticContact CD1-CD2 3.63Å; Y953-H980 AromaticContact CD1-CG 3.83Å; Y953-H980 HydrophobicContact CE1-CB 4.01Å; Y953-H980 AromaticContact CG-CD2 3.69Å
954	C	95.1	Very high	92	Very high	5 Å²	5	13.4 Å²	13.4	3%	0.034	6%	0.059	C	C	.	.	H	α-helix	trans	-59.8	-50.3	172.7	-75.1	0	0	0	0	110.8	C950 G951 T957 Y958 F1003	C950-C954 VanDerWaalsContact O-CB 3.28Å; C950-C954 WeakPolarHBondContact O-CB 3.38Å; C950-C954 PolarHBondContact O-N 3.23Å; C950-C954 PolarHBondContact O-SG 3.14Å; G951-C954 PolarHBondContact O-N 2.99Å; C954-T957 PolarHBondContact O-OG1 2.89Å; C954-Y958 WeakPolarHBondContact O-CB 3.45Å; C954-Y958 PolarHBondContact O-N 3.25Å; C954-F1003 HydrophobicContact CB-CD2 3.6Å; C954-F1003 HydrophobicContact CB-CE2 3.73Å; C954-F1003 HydrophobicContact CB-CG 4.23Å; C954-F1003 HydrophobicContact CB-CZ 4.45Å; C954-F1003 VanDerWaalsContact SG-CD2 3.54Å
955	V	96.7	Very high	91.7	Very high	2 Å²	2	10.7 Å²	10.7	1%	0.012	5%	0.046	C	C	.	.	H	α-helix	trans	-65.9	-46.4	178.6	173.5	0	0	0	0	111.3	W873 G951 G952 Y958 V959 C1031 A1034 L1038	W873-V955 HydrophobicContact CZ2-CG1 4.29Å; G951-V955 WeakPolarHBondContact O-CG2 3.42Å; G951-V955 PolarHBondContact O-N 3.4Å; G952-V955 PolarHBondContact O-N 3.13Å; V955-Y958 PolarHBondContact O-N 3.05Å; V955-V959 HydrophobicContact CG1-CG2 4.38Å; V955-V959 WeakPolarHBondContact O-CG2 3.36Å; V955-V959 PolarHBondContact O-N 3.24Å; V955-C1031 HydrophobicContact CG2-CB 4.01Å; V955-C1031 WeakPolarHBondContact CG2-O 3.4Å; V955-A1034 HydrophobicContact CB-CB 4.44Å; V955-A1034 HydrophobicContact CG1-CB 4.32Å; V955-A1034 HydrophobicContact CG2-CB 4.17Å; V955-L1038 HydrophobicContact CG1-CD1 3.91Å
956	A	94.8	Very high	91.1	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62.1	-49.4	-179.7	0	0	0	0	0	111.8	L866 M869 W873 G952 Y958 V959 L960	L866-A956 HydrophobicContact CD2-CB 3.6Å; M869-A956 HydrophobicContact SD-CB 3.73Å; W873-A956 HydrophobicContact CH2-CB 4.35Å; G952-A956 VanDerWaalsContact O-CB 3.28Å; G952-A956 WeakPolarHBondContact O-CB 3.26Å; G952-A956 PolarHBondContact O-N 2.85Å; A956-Y958 VanDerWaalsContact C-N 3.3Å; A956-Y958 PolarHBondContact O-N 3.48Å; A956-V959 PolarHBondContact O-N 3Å; A956-L960 VanDerWaalsContact O-CB 3.23Å; A956-L960 WeakPolarHBondContact O-CB 3.36Å; A956-L960 WeakPolarHBondContact O-CG 3.14Å; A956-L960 PolarHBondContact O-N 2.7Å
957	T	92.3	Very high	90.5	Very high	3 Å²	3	8.1 Å²	8.1	2%	0.018	4%	0.037	C	C	.	.	H	α-helix	trans	-66.6	-32.6	-179.5	57.1	0	0	0	0	112.6	Y953 C954 G961 I962	Y953-T957 VanDerWaalsContact O-CB 3.26Å; Y953-T957 WeakPolarHBondContact O-CB 3.37Å; Y953-T957 WeakPolarHBondContact O-CG2 3.26Å; Y953-T957 PolarHBondContact O-N 3.08Å; Y953-T957 PolarHBondContact O-OG1 2.99Å; C954-T957 PolarHBondContact O-OG1 2.89Å; T957-G961 WeakPolarHBondContact O-CA 3.47Å; T957-G961 PolarHBondContact O-N 3Å; T957-I962 HydrophobicContact CG2-CB 4.14Å; T957-I962 HydrophobicContact CG2-CD1 4.04Å; T957-I962 PolarHBondContact O-N 3Å
958	Y	92.4	Very high	89.9	Confident	17 Å²	17	11 Å²	11	7%	0.067	5%	0.052	C	C	.	.	H	α-helix	trans	-64.6	-53.6	171.7	177.2	-114	0	0	0	112	C954 V955 A956 L960 G961 P1002 F1003 Y1035 Y1068 A1072 H1085 L1086 Q1089	C954-Y958 WeakPolarHBondContact O-CB 3.45Å; C954-Y958 PolarHBondContact O-N 3.25Å; V955-Y958 PolarHBondContact O-N 3.05Å; A956-Y958 VanDerWaalsContact C-N 3.3Å; A956-Y958 PolarHBondContact O-N 3.48Å; Y958-L960 VanDerWaalsContact C-N 3.26Å; Y958-L960 PolarHBondContact O-N 3.22Å; Y958-G961 PolarHBondContact O-N 3.29Å; Y958-P1002 HydrophobicContact CD2-CB 3.91Å; Y958-P1002 HydrophobicContact CE2-CB 4Å; Y958-F1003 HydrophobicContact CD2-CD1 4.1Å; Y958-F1003 HydrophobicContact CG-CD1 4.11Å; Y958-Y1035 HydrophobicContact CD1-CE2 4.47Å; Y958-Y1035 HydrophobicContact CE1-CE2 4.17Å; Y958-Y1068 WeakPolarHBondContact O-CE1 3.44Å; Y958-Y1068 PolarHBondContact O-OH 2.81Å; Y958-Y1068 VanDerWaalsContact O-OH 3.05Å; Y958-A1072 HydrophobicContact CE1-CB 4.35Å; Y958-H1085 PolarHBondContact OH-NE2 3.31Å; Y958-L1086 HydrophobicContact CD1-CD1 4.19Å; Y958-L1086 HydrophobicContact CE1-CD1 4.34Å; Y958-Q1089 HydrophobicContact CE2-CG 4.13Å
959	V	91.8	Very high	89.6	Confident	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-62.7	-35.9	-178.8	170.7	0	0	0	0	111.5	M869 V955 A956 Y1035 L1038 L1073	M869-V959 HydrophobicContact CE-CB 4.46Å; M869-V959 HydrophobicContact CE-CG1 4.11Å; V955-V959 HydrophobicContact CG1-CG2 4.38Å; V955-V959 WeakPolarHBondContact O-CG2 3.36Å; V955-V959 PolarHBondContact O-N 3.24Å; A956-V959 PolarHBondContact O-N 3Å; V959-Y1035 HydrophobicContact CG2-CD2 4.14Å; V959-Y1035 HydrophobicContact CG2-CE2 4.29Å; V959-L1038 HydrophobicContact CB-CD1 4.49Å; V959-L1038 HydrophobicContact CG2-CD1 4.12Å; V959-L1073 HydrophobicContact CG1-CD1 4.35Å; V959-L1073 HydrophobicContact CG1-CD2 3.94Å; V959-L1073 HydrophobicContact CG1-CG 4.08Å; V959-L1073 HydrophobicContact CG2-CD2 3.8Å
960	L	88.8	Confident	89.5	Confident	1 Å²	1	8.9 Å²	8.9	1%	0.005	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.7	-178.9	-61	-174.3	0	0	0	114	I862 I865 M869 A956 Y958 I962 L987 F1049	I862-L960 HydrophobicContact CD1-CD1 4.38Å; I862-L960 HydrophobicContact CG2-CD1 4.45Å; I865-L960 HydrophobicContact CG2-CD1 3.97Å; I865-L960 HydrophobicContact CG2-CD2 4.01Å; M869-L960 HydrophobicContact CE-CD1 4Å; M869-L960 HydrophobicContact CE-CD2 3.66Å; M869-L960 HydrophobicContact CE-CG 3.73Å; M869-L960 HydrophobicContact SD-CD1 4.49Å; A956-L960 VanDerWaalsContact O-CB 3.23Å; A956-L960 WeakPolarHBondContact O-CB 3.36Å; A956-L960 WeakPolarHBondContact O-CG 3.14Å; A956-L960 PolarHBondContact O-N 2.7Å; Y958-L960 VanDerWaalsContact C-N 3.26Å; Y958-L960 PolarHBondContact O-N 3.22Å; L960-I962 HydrophobicContact CB-CD1 3.9Å; L960-I962 HydrophobicContact CB-CG1 3.7Å; L960-I962 HydrophobicContact CD1-CD1 3.98Å; L960-I962 PolarHBondContact O-N 2.58Å; L960-L987 WeakPolarHBondContact O-CA 3.41Å; L960-L987 PolarHBondContact O-N 3.3Å; L960-F1049 HydrophobicContact CD2-CE1 4.47Å; L960-F1049 HydrophobicContact CD2-CE2 3.39Å; L960-F1049 HydrophobicContact CD2-CZ 3.34Å; L960-F1049 HydrophobicContact CG-CZ 4.49Å
961	G	87.2	Confident	89.4	Confident	1 Å²	1	10.4 Å²	10.4	1%	0.01	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	39.6	-178.2	0	0	0	0	0	113.3	T957 Y958 G963 I986 L987 G988 Y1068	T957-G961 WeakPolarHBondContact O-CA 3.47Å; T957-G961 PolarHBondContact O-N 3Å; Y958-G961 PolarHBondContact O-N 3.29Å; G961-G963 PolarHBondContact O-N 2.71Å; G961-I986 CarbonylContact O-C 3.39Å; G961-L987 PolarHBondContact O-N 3.02Å; G961-L987 VanDerWaalsContact O-N 3.08Å; G961-G988 PolarHBondContact O-N 3.19Å; G961-G988 VanDerWaalsContact O-N 3.14Å; G961-Y1068 WeakPolarHBondContact CA-OH 3.39Å; G961-Y1068 VanDerWaalsContact N-CE1 3.28Å
962	I	85.2	Confident	89.5	Confident	6 Å²	6	10.4 Å²	10.4	3%	0.031	5%	0.052	C	C	.	.			trans	-74.9	114.7	-176.8	-61.2	172.5	0	0	0	108.9	I862 T957 L960 R965 F983 H985 I986	I862-I962 HydrophobicContact CG2-CD1 3.8Å; T957-I962 HydrophobicContact CG2-CB 4.14Å; T957-I962 HydrophobicContact CG2-CD1 4.04Å; T957-I962 PolarHBondContact O-N 3Å; L960-I962 HydrophobicContact CB-CD1 3.9Å; L960-I962 HydrophobicContact CB-CG1 3.7Å; L960-I962 HydrophobicContact CD1-CD1 3.98Å; L960-I962 PolarHBondContact O-N 2.58Å; I962-R965 WeakPolarHBondContact O-CG 3.45Å; I962-F983 HydrophobicContact CD1-CD1 3.94Å; I962-F983 HydrophobicContact CD1-CE1 4.18Å; I962-F983 HydrophobicContact CG2-CD1 4Å; I962-H985 CarbonylContact C-O 3.58Å; I962-H985 WeakPolarHBondContact CA-O 3.27Å; I962-I986 HydrophobicContact CG1-CG2 4.29Å
963	G	75.6	Confident	89.4	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.054	C	C	.	.			trans	-101	-174.2	-177.1	0	0	0	0	0	115.5	G961 R965 H985 E999	G961-G963 PolarHBondContact O-N 2.71Å; G963-R965 PolarHBondContact O-N 2.82Å; G963-R965 PolarHBondContact O-NE 3.39Å; G963-R965 PolarHBondContact O-NH2 2.95Å; G963-H985 PolarHBondContact N-O 3.46Å; G963-E999 VanDerWaalsContact C-OE1 3.26Å; G963-E999 WeakPolarHBondContact CA-OE1 3.42Å
964	D	75.4	Confident	89.3	Confident	32 Å²	32	14 Å²	14	17%	0.171	7%	0.07	C	C	.	.			trans	56.1	36.7	-178.7	-148.3	13.4	0	0	0	111.7	H966 N969 H985 K991 E999	D964-H966 PolarHBondContact O-CD2 3.23Å; D964-H966 PolarHBondContact O-N 3.5Å; D964-H966 IonicContact OD1-CD2 3.75Å; D964-N969 PolarHBondContact O-ND2 3.03Å; D964-N969 VanDerWaalsContact O-ND2 3.1Å; D964-H985 HydrophobicContact CB-CB 4.25Å; D964-H985 IonicContact OD2-CD2 3.85Å; D964-H985 PolarHBondContact OD2-CD2 3.37Å; D964-H985 IonicContact OD2-NE2 3.91Å; D964-K991 IonicContact OD2-NZ 3.76Å; D964-K991 PolarHBondContact OD2-NZ 2.64Å; D964-E999 PolarHBondContact N-OE1 2.94Å
965	R	85.7	Confident	89.2	Confident	18 Å²	18	16.2 Å²	16.2	7%	0.068	9%	0.085	C	C	.	.			trans	-83.6	98.8	180	-61.2	-58.1	86	-171.4	3	110	I962 G963 H980 I981 D982 V1004	I962-R965 WeakPolarHBondContact O-CG 3.45Å; G963-R965 PolarHBondContact O-N 2.82Å; G963-R965 PolarHBondContact O-NE 3.39Å; G963-R965 PolarHBondContact O-NH2 2.95Å; R965-H980 VanDerWaalsContact CD-ND1 3.35Å; R965-H980 WeakPolarHBondContact CD-ND1 3.42Å; R965-I981 PolarHBondContact NH1-O 2.92Å; R965-D982 PolarHBondContact NH1-O 3.16Å; R965-D982 PolarHBondContact NH2-O 3.29Å; R965-V1004 HydrophobicContact CB-CG2 3.4Å; R965-V1004 VanDerWaalsContact CB-CG2 3.4Å; R965-V1004 HydrophobicContact CG-CG2 4.31Å
966	H	82.6	Confident	89	Confident	23 Å²	23	16.1 Å²	16.1	11%	0.106	8%	0.084	C	C	.	.			trans	-120.6	167.4	173.9	53.5	68.8	0	0	0	111.3	D964 D968 N969 I970 H1107	D964-H966 PolarHBondContact O-CD2 3.23Å; D964-H966 PolarHBondContact O-N 3.5Å; D964-H966 IonicContact OD1-CD2 3.75Å; H966-D968 PolarHBondContact ND1-N 3.2Å; H966-D968 PolarHBondContact O-N 2.72Å; H966-D968 VanDerWaalsContact O-N 3.12Å; H966-N969 PolarHBondContact CE1-ND2 2.91Å; H966-N969 PolarHBondContact CE1-OD1 2.95Å; H966-N969 PolarHBondContact NE2-ND2 3.24Å; H966-N969 VanDerWaalsContact NE2-ND2 3.14Å; H966-N969 WeakPolarHBondContact O-CA 3.29Å; H966-N969 PolarHBondContact O-N 3.27Å; H966-I970 PolarHBondContact O-N 3.11Å; H966-H1107 AromaticContact CD2-CE1 3.76Å
967	N	82.6	Confident	89	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.7	-177.4	56.3	-12.7	0	0	0	115.6	I906 A907 Q910 W1104 L1108	I906-N967 HydrophobicContact CB-CB 4.01Å; I906-N967 HydrophobicContact CG2-CB 4.01Å; I906-N967 PolarHBondContact N-O 3.03Å; A907-N967 HydrophobicContact CB-CB 4.1Å; A907-N967 PolarHBondContact N-O 2.89Å; Q910-N967 PolarHBondContact OE1-ND2 3.4Å; N967-W1104 HydrophobicContact CB-CD2 3.66Å; N967-W1104 HydrophobicContact CB-CE3 3.7Å; N967-W1104 HydrophobicContact CB-CG 4.07Å; N967-W1104 HydrophobicContact CB-CH2 4.37Å; N967-W1104 HydrophobicContact CB-CZ2 4.34Å; N967-W1104 HydrophobicContact CB-CZ3 4.08Å; N967-L1108 WeakPolarHBondContact ND2-CD1 3.43Å
968	D	84.1	Confident	89.2	Confident	61 Å²	61	17.3 Å²	17.3	33%	0.326	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.1	168.2	-72.5	-66.2	0	0	0	114.3	T905 A907 H966	T905-D968 WeakPolarHBondContact CG2-O 3.4Å; A907-D968 HydrophobicContact CB-CB 4.36Å; A907-D968 WeakPolarHBondContact CB-OD1 3.41Å; H966-D968 PolarHBondContact ND1-N 3.2Å; H966-D968 PolarHBondContact O-N 2.72Å; H966-D968 VanDerWaalsContact O-N 3.12Å
969	N	89.5	Confident	89.4	Confident	16 Å²	16	16.6 Å²	16.6	9%	0.086	9%	0.088	C	C	.	.	S	Bend	trans	-99.2	7.1	-179	-70.9	-7	0	0	0	112.9	D964 H966 I981	D964-N969 PolarHBondContact O-ND2 3.03Å; D964-N969 VanDerWaalsContact O-ND2 3.1Å; H966-N969 PolarHBondContact CE1-ND2 2.91Å; H966-N969 PolarHBondContact CE1-OD1 2.95Å; H966-N969 PolarHBondContact NE2-ND2 3.24Å; H966-N969 VanDerWaalsContact NE2-ND2 3.14Å; H966-N969 WeakPolarHBondContact O-CA 3.29Å; H966-N969 PolarHBondContact O-N 3.27Å; N969-I981 WeakPolarHBondContact O-CG1 3.29Å; N969-I981 PolarHBondContact O-N 3.15Å
970	I	93.8	Very high	89.6	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.7	176	-57.2	174.7	0	0	0	107.2	T905 I906 H966 L978 V1004 F1009 W1104	T905-I970 WeakPolarHBondContact CA-O 3.29Å; I906-I970 HydrophobicContact CG1-CB 4.1Å; I906-I970 HydrophobicContact CG1-CG2 3.88Å; I906-I970 PolarHBondContact N-O 3.29Å; H966-I970 PolarHBondContact O-N 3.11Å; I970-L978 HydrophobicContact CG2-CD1 3.52Å; I970-L978 HydrophobicContact CG2-CD2 4.42Å; I970-L978 HydrophobicContact CG2-CG 4Å; I970-V1004 HydrophobicContact CD1-CB 4.23Å; I970-V1004 HydrophobicContact CD1-CG1 3.8Å; I970-V1004 HydrophobicContact CD1-CG2 4.38Å; I970-F1009 HydrophobicContact CD1-CZ 4.4Å; I970-F1009 HydrophobicContact CG2-CZ 4.23Å; I970-W1104 HydrophobicContact CD1-CZ2 4.19Å
971	M	96.1	Very high	89.7	Confident	32 Å²	32	18.6 Å²	18.6	16%	0.158	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	155	-178.8	-64.7	-170.3	76.4	0	0	110.2	A903 T904 T905 L978 F979 I981	A903-M971 HydrophobicContact CB-CE 3.82Å; T904-M971 WeakPolarHBondContact O-CA 3.32Å; T905-M971 HydrophobicContact CG2-CE 4.32Å; T905-M971 HydrophobicContact CG2-CG 3.92Å; T905-M971 HydrophobicContact CG2-SD 4.38Å; M971-L978 WeakPolarHBondContact O-CA 3.46Å; M971-F979 HydrophobicContact CB-CD1 4.09Å; M971-F979 HydrophobicContact CB-CD2 4.26Å; M971-F979 HydrophobicContact CB-CE1 3.54Å; M971-F979 HydrophobicContact CB-CE2 3.74Å; M971-F979 HydrophobicContact CB-CG 4.42Å; M971-F979 HydrophobicContact CB-CZ 3.34Å; M971-F979 HydrophobicContact CE-CZ 4.33Å; M971-F979 HydrophobicContact CG-CE2 4.23Å; M971-F979 HydrophobicContact CG-CZ 4.1Å; M971-F979 PolarHBondContact N-O 2.85Å; M971-F979 PolarHBondContact O-N 3.06Å; M971-F979 HydrophobicContact SD-CE2 3.88Å; M971-F979 HydrophobicContact SD-CZ 3.79Å; M971-I981 HydrophobicContact CG-CD1 4.1Å; M971-I981 HydrophobicContact CG-CG1 4.41Å; M971-I981 HydrophobicContact CG-CG2 4.34Å; M971-I981 HydrophobicContact SD-CD1 3.79Å; M971-I981 HydrophobicContact SD-CG1 4.49Å; M971-I981 HydrophobicContact SD-CG2 3.96Å
972	I	96.6	Very high	89.7	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.6	173.2	-169.6	175.3	0	0	0	109.5	A903 T904 I906 I909 L925 W928 L929 F946 N977 L978	A903-I972 WeakPolarHBondContact CA-O 3.24Å; T904-I972 PolarHBondContact N-O 3.12Å; T904-I972 PolarHBondContact O-N 3.07Å; I906-I972 HydrophobicContact CD1-CB 4.17Å; I906-I972 HydrophobicContact CD1-CG2 3.87Å; I909-I972 HydrophobicContact CD1-CG2 3.45Å; I909-I972 VanDerWaalsContact CD1-CG2 3.45Å; L925-I972 HydrophobicContact CD1-CD1 4.19Å; L925-I972 HydrophobicContact CD1-CG2 4.2Å; W928-I972 HydrophobicContact CE3-CG2 4.3Å; W928-I972 HydrophobicContact CH2-CG2 4.07Å; W928-I972 HydrophobicContact CZ3-CG2 3.7Å; L929-I972 HydrophobicContact CD1-CD1 4.34Å; F946-I972 HydrophobicContact CD2-CD1 3.62Å; F946-I972 HydrophobicContact CE2-CD1 4Å; I972-N977 CarbonylContact C-O 3.59Å; I972-N977 VanDerWaalsContact CA-O 3.31Å; I972-N977 WeakPolarHBondContact CA-O 3.46Å; I972-L978 HydrophobicContact CB-CD1 4.4Å
973	T	96	Very high	89.7	Confident	7 Å²	7	21.6 Å²	21.6	4%	0.043	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	158.1	171.9	68.3	0	0	0	0	111.4	L883 V900 D902 A903 S975 G976 N977 F979	L883-T973 HydrophobicContact CD1-CG2 4.04Å; V900-T973 HydrophobicContact CG1-CG2 4.24Å; D902-T973 CarbonylContact O-C 3.41Å; D902-T973 VanDerWaalsContact O-CA 3.24Å; D902-T973 WeakPolarHBondContact O-CA 3.35Å; A903-T973 HydrophobicContact CB-CG2 4.25Å; T973-S975 PolarHBondContact O-N 2.85Å; T973-S975 VanDerWaalsContact O-N 3.12Å; T973-S975 PolarHBondContact OG1-N 3.4Å; T973-S975 PolarHBondContact OG1-OG 2.7Å; T973-G976 PolarHBondContact O-N 3.33Å; T973-G976 PolarHBondContact OG1-N 3.49Å; T973-N977 HydrophobicContact CG2-CB 4.13Å; T973-N977 PolarHBondContact N-O 3.25Å; T973-N977 WeakPolarHBondContact OG1-CB 3.43Å; T973-N977 PolarHBondContact OG1-N 3.38Å; T973-N977 PolarHBondContact OG1-ND2 2.73Å; T973-F979 HydrophobicContact CG2-CD1 4.42Å; T973-F979 HydrophobicContact CG2-CE1 3.95Å
974	E	93.8	Very high	89.4	Confident	70 Å²	70	22.7 Å²	22.7	33%	0.327	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.5	171.9	-66.6	-172.4	174.6	0	0	112.9	D902 W928 K932 G976	D902-E974 HydrophobicContact CB-CB 4.23Å; D902-E974 HydrophobicContact CB-CG 4Å; D902-E974 WeakPolarHBondContact O-CG 3.41Å; D902-E974 PolarHBondContact O-N 3.4Å; W928-E974 HydrophobicContact CH2-CG 4.08Å; W928-E974 HydrophobicContact CZ2-CG 4.33Å; K932-E974 HydrophobicContact CB-CB 4.24Å; K932-E974 HydrophobicContact CB-CG 4.43Å; K932-E974 HydrophobicContact CD-CG 3.86Å; K932-E974 WeakPolarHBondContact CE-OE1 3.26Å; K932-E974 HydrophobicContact CG-CB 4.34Å; K932-E974 HydrophobicContact CG-CG 4.01Å; K932-E974 IonicContact NZ-OE1 2.65Å; K932-E974 PolarHBondContact NZ-OE1 3.23Å; E974-G976 VanDerWaalsContact C-N 3.34Å
975	S	91.3	Very high	89.3	Confident	51 Å²	51	22.6 Å²	22.6	36%	0.357	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.4	173.3	54.7	0	0	0	0	114.7	A942 R945 T973 N977	A942-S975 WeakPolarHBondContact CA-O 3.48Å; A942-S975 WeakPolarHBondContact CB-O 3.39Å; R945-S975 WeakPolarHBondContact CD-O 3.43Å; T973-S975 PolarHBondContact O-N 2.85Å; T973-S975 VanDerWaalsContact O-N 3.12Å; T973-S975 PolarHBondContact OG1-N 3.4Å; T973-S975 PolarHBondContact OG1-OG 2.7Å; S975-N977 PolarHBondContact OG-ND2 2.93Å
976	G	93.9	Very high	88.8	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.121	C	C	.	.			trans	93.1	6.5	176	0	0	0	0	0	115.9	R945 F946 T973 E974 L978	R945-G976 CarbonylContact C-O 3.57Å; F946-G976 WeakPolarHBondContact CA-O 3.29Å; F946-G976 WeakPolarHBondContact CB-O 3.41Å; F946-G976 PolarHBondContact N-O 3.35Å; T973-G976 PolarHBondContact O-N 3.33Å; T973-G976 PolarHBondContact OG1-N 3.49Å; E974-G976 VanDerWaalsContact C-N 3.34Å; G976-L978 PolarHBondContact O-N 3.26Å
977	N	94.8	Very high	88.2	Confident	28 Å²	28	21 Å²	21	15%	0.15	12%	0.117	C	C	.	.			trans	-76.1	116.4	175.6	-62.6	-69.4	0	0	0	110	I972 T973 S975	I972-N977 CarbonylContact C-O 3.59Å; I972-N977 VanDerWaalsContact CA-O 3.31Å; I972-N977 WeakPolarHBondContact CA-O 3.46Å; T973-N977 HydrophobicContact CG2-CB 4.13Å; T973-N977 PolarHBondContact N-O 3.25Å; T973-N977 WeakPolarHBondContact OG1-CB 3.43Å; T973-N977 PolarHBondContact OG1-N 3.38Å; T973-N977 PolarHBondContact OG1-ND2 2.73Å; S975-N977 PolarHBondContact OG-ND2 2.93Å
978	L	96.7	Very high	87.2	Confident	1 Å²	1	22 Å²	22	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135.8	170	-169.9	79.8	0	0	0	109.3	I906 F946 S949 C950 Y953 I970 M971 I972 G976 F1009	I906-L978 HydrophobicContact CD1-CD1 4.33Å; F946-L978 HydrophobicContact CD2-CB 4.32Å; F946-L978 HydrophobicContact CE2-CB 4.42Å; F946-L978 HydrophobicContact CE2-CD1 3.98Å; S949-L978 WeakPolarHBondContact CB-O 3.43Å; S949-L978 PolarHBondContact OG-N 3.45Å; C950-L978 HydrophobicContact CB-CD2 3.87Å; Y953-L978 WeakPolarHBondContact CD2-O 3.47Å; Y953-L978 WeakPolarHBondContact CE2-O 3.37Å; I970-L978 HydrophobicContact CG2-CD1 3.52Å; I970-L978 HydrophobicContact CG2-CD2 4.42Å; I970-L978 HydrophobicContact CG2-CG 4Å; M971-L978 WeakPolarHBondContact O-CA 3.46Å; I972-L978 HydrophobicContact CB-CD1 4.4Å; G976-L978 PolarHBondContact O-N 3.26Å; L978-F1009 HydrophobicContact CD1-CZ 4.23Å; L978-F1009 HydrophobicContact CD2-CE2 4.13Å; L978-F1009 HydrophobicContact CD2-CZ 4.48Å
979	F	96.9	Very high	86.2	Confident	1 Å²	1	22 Å²	22	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	154.3	173.2	66.2	-79.5	0	0	0	112.7	L883 Y885 V900 A903 Y953 M971 T973 I981	L883-F979 HydrophobicContact CB-CB 3.93Å; L883-F979 HydrophobicContact CB-CD1 4.47Å; L883-F979 HydrophobicContact CB-CG 4.19Å; L883-F979 HydrophobicContact CD1-CD1 4.17Å; L883-F979 HydrophobicContact CD1-CE1 4.4Å; Y885-F979 HydrophobicContact CD1-CD2 4.31Å; Y885-F979 HydrophobicContact CD1-CE2 4.49Å; V900-F979 HydrophobicContact CB-CE1 4.49Å; V900-F979 HydrophobicContact CB-CE2 4.23Å; V900-F979 HydrophobicContact CB-CZ 3.74Å; V900-F979 HydrophobicContact CG1-CE1 4.04Å; V900-F979 HydrophobicContact CG1-CZ 3.79Å; V900-F979 HydrophobicContact CG2-CE2 3.83Å; V900-F979 HydrophobicContact CG2-CZ 3.86Å; A903-F979 HydrophobicContact CB-CE1 3.8Å; A903-F979 HydrophobicContact CB-CZ 3.72Å; Y953-F979 VanDerWaalsContact CE2-CA 3.43Å; Y953-F979 HydrophobicContact CE2-CB 3.63Å; Y953-F979 WeakPolarHBondContact OH-CB 3.49Å; M971-F979 HydrophobicContact CB-CD1 4.09Å; M971-F979 HydrophobicContact CB-CD2 4.26Å; M971-F979 HydrophobicContact CB-CE1 3.54Å; M971-F979 HydrophobicContact CB-CE2 3.74Å; M971-F979 HydrophobicContact CB-CG 4.42Å; M971-F979 HydrophobicContact CB-CZ 3.34Å; M971-F979 HydrophobicContact CE-CZ 4.33Å; M971-F979 HydrophobicContact CG-CE2 4.23Å; M971-F979 HydrophobicContact CG-CZ 4.1Å; M971-F979 PolarHBondContact N-O 2.85Å; M971-F979 PolarHBondContact O-N 3.06Å; M971-F979 HydrophobicContact SD-CE2 3.88Å; M971-F979 HydrophobicContact SD-CZ 3.79Å; T973-F979 HydrophobicContact CG2-CD1 4.42Å; T973-F979 HydrophobicContact CG2-CE1 3.95Å; F979-I981 HydrophobicContact CD2-CG2 3.84Å; F979-I981 HydrophobicContact CE2-CG2 3.62Å
980	H	94.4	Very high	85.1	Confident	5 Å²	5	24.4 Å²	24.4	2%	0.023	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	145.5	-178.9	-71.2	-139.4	0	0	0	109.8	Y953 R965 F983	Y953-H980 HydrophobicContact CD1-CB 3.92Å; Y953-H980 AromaticContact CD1-CD2 3.63Å; Y953-H980 AromaticContact CD1-CG 3.83Å; Y953-H980 HydrophobicContact CE1-CB 4.01Å; Y953-H980 AromaticContact CG-CD2 3.69Å; R965-H980 VanDerWaalsContact CD-ND1 3.35Å; R965-H980 WeakPolarHBondContact CD-ND1 3.42Å; H980-F983 HydrophobicContact CB-CE1 3.87Å; H980-F983 HydrophobicContact CB-CZ 4.19Å; H980-F983 WeakPolarHBondContact O-CZ 3.49Å
981	I	92.4	Very high	83.3	Confident	39 Å²	39	28.7 Å²	28.7	20%	0.2	16%	0.155	C	C	.	.			trans	-128.2	166.2	176.6	62.1	165	0	0	0	110.9	Y885 R965 N969 M971 F979	Y885-I981 HydrophobicContact CD1-CG2 4.4Å; Y885-I981 HydrophobicContact CE1-CB 4.29Å; Y885-I981 HydrophobicContact CE1-CG2 3.68Å; R965-I981 PolarHBondContact NH1-O 2.92Å; N969-I981 WeakPolarHBondContact O-CG1 3.29Å; N969-I981 PolarHBondContact O-N 3.15Å; M971-I981 HydrophobicContact CG-CD1 4.1Å; M971-I981 HydrophobicContact CG-CG1 4.41Å; M971-I981 HydrophobicContact CG-CG2 4.34Å; M971-I981 HydrophobicContact SD-CD1 3.79Å; M971-I981 HydrophobicContact SD-CG1 4.49Å; M971-I981 HydrophobicContact SD-CG2 3.96Å; F979-I981 HydrophobicContact CD2-CG2 3.84Å; F979-I981 HydrophobicContact CE2-CG2 3.62Å
982	D	86	Confident	81.2	Confident	70 Å²	70	31.3 Å²	31.3	37%	0.374	18%	0.176	S	C	.	.			trans	56.9	81.8	176.4	-165.2	-11.6	0	0	0	112.7	Y885 R965 G984	Y885-D982 PolarHBondContact OH-N 3.41Å; R965-D982 PolarHBondContact NH1-O 3.16Å; R965-D982 PolarHBondContact NH2-O 3.29Å; D982-G984 PolarHBondContact O-N 2.68Å; D982-G984 VanDerWaalsContact O-N 3.14Å
983	F	84.6	Confident	78.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.			trans	-89.1	34.8	-171.9	-59.6	-73.7	0	0	0	113.6	Q858 D859 I862 L863 L866 Y885 I962 H980 H985 I986	Q858-F983 PolarHBondContact NE2-O 2.91Å; D859-F983 PolarHBondContact OD1-N 3.44Å; I862-F983 HydrophobicContact CB-CB 4.02Å; I862-F983 HydrophobicContact CB-CD1 4.45Å; I862-F983 HydrophobicContact CB-CD2 4.19Å; I862-F983 HydrophobicContact CB-CG 3.97Å; I862-F983 HydrophobicContact CG1-CB 4Å; I862-F983 HydrophobicContact CG1-CG 4.45Å; I862-F983 HydrophobicContact CG2-CB 4.06Å; I862-F983 HydrophobicContact CG2-CD1 3.59Å; I862-F983 HydrophobicContact CG2-CD2 3.96Å; I862-F983 HydrophobicContact CG2-CE1 3.93Å; I862-F983 HydrophobicContact CG2-CE2 4.28Å; I862-F983 HydrophobicContact CG2-CG 3.59Å; I862-F983 HydrophobicContact CG2-CZ 4.25Å; L863-F983 HydrophobicContact CD2-CE2 3.86Å; L863-F983 HydrophobicContact CG-CD2 4.42Å; L863-F983 HydrophobicContact CG-CE2 3.96Å; L866-F983 HydrophobicContact CD1-CZ 4.1Å; Y885-F983 HydrophobicContact CE1-CE2 4.18Å; Y885-F983 WeakPolarHBondContact OH-CE2 3.48Å; I962-F983 HydrophobicContact CD1-CD1 3.94Å; I962-F983 HydrophobicContact CD1-CE1 4.18Å; I962-F983 HydrophobicContact CG2-CD1 4Å; H980-F983 HydrophobicContact CB-CE1 3.87Å; H980-F983 HydrophobicContact CB-CZ 4.19Å; H980-F983 WeakPolarHBondContact O-CZ 3.49Å; F983-H985 PolarHBondContact O-N 2.9Å; F983-I986 WeakPolarHBondContact O-CG2 3.31Å
984	G	70.4	Confident	76.1	Confident	22 Å²	22	44.5 Å²	44.5	23%	0.227	24%	0.238	C	C	.	.			trans	-69.5	3.5	-172.8	0	0	0	0	0	116.5	D982 Q1059	D982-G984 PolarHBondContact O-N 2.68Å; D982-G984 VanDerWaalsContact O-N 3.14Å; G984-Q1059 PolarHBondContact O-NE2 2.86Å; G984-Q1059 PolarHBondContact O-OE1 3.03Å
985	H	72.4	Confident	73.5	Confident	31 Å²	31	44.6 Å²	44.6	14%	0.144	26%	0.258	C	S	.	.	S	Bend	trans	-141.5	114.6	177.8	-73.7	-71	0	0	0	110.5	I962 G963 D964 F983 N989 K991 Q1059	I962-H985 CarbonylContact C-O 3.58Å; I962-H985 WeakPolarHBondContact CA-O 3.27Å; G963-H985 PolarHBondContact N-O 3.46Å; D964-H985 HydrophobicContact CB-CB 4.25Å; D964-H985 IonicContact OD2-CD2 3.85Å; D964-H985 PolarHBondContact OD2-CD2 3.37Å; D964-H985 IonicContact OD2-NE2 3.91Å; F983-H985 PolarHBondContact O-N 2.9Å; H985-N989 PolarHBondContact ND1-O 3.14Å; H985-K991 WeakPolarHBondContact NE2-CE 3.4Å; H985-K991 PolarHBondContact NE2-NZ 3.35Å; H985-Q1059 PolarHBondContact CE1-NE2 2.99Å; H985-Q1059 PolarHBondContact ND1-NE2 3.46Å; H985-Q1059 VanDerWaalsContact ND1-NE2 3.16Å
986	I	77	Confident	71.5	Confident	1 Å²	1	47 Å²	47	1%	0.005	27%	0.266	C	S	.	.			trans	-135.5	164.1	-174	66.7	175.1	0	0	0	113.2	Q858 I862 G961 I962 F983 G988 N989 Q1059 L1060	Q858-I986 HydrophobicContact CG-CD1 4.24Å; I862-I986 HydrophobicContact CD1-CB 4.41Å; I862-I986 HydrophobicContact CD1-CD1 4.21Å; I862-I986 HydrophobicContact CD1-CG2 3.76Å; I862-I986 HydrophobicContact CG1-CG2 3.92Å; G961-I986 CarbonylContact O-C 3.39Å; I962-I986 HydrophobicContact CG1-CG2 4.29Å; F983-I986 WeakPolarHBondContact O-CG2 3.31Å; I986-G988 VanDerWaalsContact C-N 3.28Å; I986-G988 PolarHBondContact O-N 2.97Å; I986-N989 WeakPolarHBondContact O-CB 3.34Å; I986-N989 PolarHBondContact O-N 2.79Å; I986-N989 VanDerWaalsContact O-N 3.14Å; I986-Q1059 HydrophobicContact CG1-CB 4.23Å; I986-Q1059 VanDerWaalsContact N-OE1 3.13Å; I986-L1060 HydrophobicContact CD1-CD1 3.52Å; I986-L1060 HydrophobicContact CD1-CG 3.87Å
987	L	69.8	Low	69.7	Low	5 Å²	5	49.6 Å²	49.6	3%	0.026	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	36	173.6	-58.3	176.8	0	0	0	115	L960 G961 N989 F1049 L1060 D1065 Y1068 I1069	L960-L987 WeakPolarHBondContact O-CA 3.41Å; L960-L987 PolarHBondContact O-N 3.3Å; G961-L987 PolarHBondContact O-N 3.02Å; G961-L987 VanDerWaalsContact O-N 3.08Å; L987-N989 VanDerWaalsContact C-N 3.28Å; L987-N989 PolarHBondContact O-N 3.1Å; L987-F1049 HydrophobicContact CD1-CD1 4.08Å; L987-F1049 HydrophobicContact CD1-CE1 4.5Å; L987-F1049 HydrophobicContact CD2-CD1 4.47Å; L987-F1049 HydrophobicContact CD2-CE1 4.45Å; L987-L1060 HydrophobicContact CD1-CD2 3.26Å; L987-L1060 HydrophobicContact CD1-CG 3.94Å; L987-D1065 HydrophobicContact CB-CB 4.36Å; L987-D1065 HydrophobicContact CD1-CB 4.06Å; L987-Y1068 HydrophobicContact CD2-CD1 4.32Å; L987-I1069 HydrophobicContact CD2-CD1 3.76Å; L987-I1069 HydrophobicContact CD2-CG1 3.61Å
988	G	60.9	Low	68	Low	22 Å²	22	50 Å²	50	23%	0.227	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	4	177.2	0	0	0	0	0	115	G961 I986 Y990	G961-G988 PolarHBondContact O-N 3.19Å; G961-G988 VanDerWaalsContact O-N 3.14Å; I986-G988 VanDerWaalsContact C-N 3.28Å; I986-G988 PolarHBondContact O-N 2.97Å; G988-Y990 WeakPolarHBondContact O-CD2 3.31Å; G988-Y990 PolarHBondContact O-N 3.22Å
989	N	63.2	Low	66.5	Low	62 Å²	62	52.3 Å²	52.3	33%	0.332	30%	0.295	S	S	.	.			trans	-75.2	65.5	173.7	-76.4	-48.9	0	0	0	111.8	H985 I986 L987 Q1059 D1065	H985-N989 PolarHBondContact ND1-O 3.14Å; I986-N989 WeakPolarHBondContact O-CB 3.34Å; I986-N989 PolarHBondContact O-N 2.79Å; I986-N989 VanDerWaalsContact O-N 3.14Å; L987-N989 VanDerWaalsContact C-N 3.28Å; L987-N989 PolarHBondContact O-N 3.1Å; N989-Q1059 PolarHBondContact ND2-O 3.03Å; N989-D1065 PolarHBondContact ND2-OD1 2.99Å
990	Y	65.9	Low	64.7	Low	65 Å²	65	57.8 Å²	57.8	26%	0.255	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-78.9	145.3	-175.6	-54.3	-54.9	0	0	0	112.4	G988 S992 E999	G988-Y990 WeakPolarHBondContact O-CD2 3.31Å; G988-Y990 PolarHBondContact O-N 3.22Å; Y990-S992 PolarHBondContact O-N 3.43Å; Y990-E999 HydrophobicContact CD1-CB 4.32Å; Y990-E999 HydrophobicContact CD1-CG 3.43Å; Y990-E999 VanDerWaalsContact CD1-CG 3.43Å; Y990-E999 WeakPolarHBondContact CD1-OE2 3.32Å; Y990-E999 HydrophobicContact CD2-CB 4.39Å; Y990-E999 HydrophobicContact CD2-CG 4.28Å; Y990-E999 HydrophobicContact CE1-CB 4.44Å; Y990-E999 HydrophobicContact CE1-CG 3.81Å; Y990-E999 WeakPolarHBondContact CE1-OE2 3.13Å; Y990-E999 HydrophobicContact CE2-CB 4.49Å; Y990-E999 HydrophobicContact CG-CB 4.29Å; Y990-E999 HydrophobicContact CG-CG 3.69Å
991	K	57	Low	63.6	Low	91 Å²	91	58.3 Å²	58.3	40%	0.396	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-68.2	118.9	170.1	-73.7	176.2	177.8	137.8	0	109.7	D964 H985 K998	D964-K991 IonicContact OD2-NZ 3.76Å; D964-K991 PolarHBondContact OD2-NZ 2.64Å; H985-K991 WeakPolarHBondContact NE2-CE 3.4Å; H985-K991 PolarHBondContact NE2-NZ 3.35Å; K991-K998 HydrophobicContact CB-CD 4.18Å; K991-K998 WeakPolarHBondContact O-CB 3.15Å; K991-K998 WeakPolarHBondContact O-CD 3.36Å; K991-K998 VanDerWaalsContact O-CG 3.27Å; K991-K998 WeakPolarHBondContact O-CG 3.39Å
992	S	51.9	Low	62.6	Low	87 Å²	87	57.7 Å²	57.7	61%	0.608	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	139.3	167.1	63.3	0	0	0	0	111.1	Y990 I996	Y990-S992 PolarHBondContact O-N 3.43Å; S992-I996 WeakPolarHBondContact CA-O 3.15Å
993	F	43.2	Very low	62.5	Low	114 Å²	114	54.8 Å²	54.8	50%	0.5	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.2	166.8	-177	-100.7	0	0	0	109	G995 I996 K998	F993-G995 PolarHBondContact O-N 3.38Å; F993-G995 VanDerWaalsContact O-N 3.16Å; F993-I996 PolarHBondContact N-O 2.83Å; F993-I996 PolarHBondContact O-N 2.69Å; F993-K998 HydrophobicContact CB-CG 4.42Å
994	M	41.2	Very low	62.5	Low	169 Å²	169	55.2 Å²	55.2	83%	0.833	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	33.7	-177.6	-63.2	177	127.6	0	0	114.3	I996	M994-I996 VanDerWaalsContact C-N 3.32Å; M994-I996 PolarHBondContact O-N 2.74Å
995	G	40	Very low	63.4	Low	73 Å²	73	54.2 Å²	54.2	75%	0.753	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	2.1	179.7	0	0	0	0	0	115.5	F993	F993-G995 PolarHBondContact O-N 3.38Å; F993-G995 VanDerWaalsContact O-N 3.16Å
996	I	48.7	Very low	64.1	Low	101 Å²	101	52.8 Å²	52.8	52%	0.518	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132	174.1	-57.3	174	0	0	0	108.7	S992 F993 M994 W1000	S992-I996 WeakPolarHBondContact CA-O 3.15Å; F993-I996 PolarHBondContact N-O 2.83Å; F993-I996 PolarHBondContact O-N 2.69Å; M994-I996 VanDerWaalsContact C-N 3.32Å; M994-I996 PolarHBondContact O-N 2.74Å; I996-W1000 HydrophobicContact CG2-CH2 3.68Å; I996-W1000 HydrophobicContact CG2-CZ2 4Å; I996-W1000 HydrophobicContact CG2-CZ3 4.45Å
997	S	56.5	Low	64.7	Low	55 Å²	55	54 Å²	54	39%	0.385	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	134.4	172.9	-178.5	0	0	0	0	109.8	E999	S997-E999 PolarHBondContact O-N 2.97Å; S997-E999 PolarHBondContact OG-N 3.45Å
998	K	59.2	Low	65.6	Low	36 Å²	36	53.8 Å²	53.8	16%	0.157	29%	0.294	C	S	.	.	S	Bend	trans	-74.8	-13.4	175.8	-76.2	-177	175	-171.9	0	113.8	K991 F993 W1000	K991-K998 HydrophobicContact CB-CD 4.18Å; K991-K998 WeakPolarHBondContact O-CB 3.15Å; K991-K998 WeakPolarHBondContact O-CD 3.36Å; K991-K998 VanDerWaalsContact O-CG 3.27Å; K991-K998 WeakPolarHBondContact O-CG 3.39Å; F993-K998 HydrophobicContact CB-CG 4.42Å; K998-W1000 PolarHBondContact O-NE1 3.42Å
999	E	64.4	Low	67.2	Low	49 Å²	49	52.7 Å²	52.7	23%	0.229	28%	0.283	C	S	.	.			trans	-95.7	101.6	-177	-58.9	-126.7	156.5	0	0	109.5	G963 D964 Y990 S997	G963-E999 VanDerWaalsContact C-OE1 3.26Å; G963-E999 WeakPolarHBondContact CA-OE1 3.42Å; D964-E999 PolarHBondContact N-OE1 2.94Å; Y990-E999 HydrophobicContact CD1-CB 4.32Å; Y990-E999 HydrophobicContact CD1-CG 3.43Å; Y990-E999 VanDerWaalsContact CD1-CG 3.43Å; Y990-E999 WeakPolarHBondContact CD1-OE2 3.32Å; Y990-E999 HydrophobicContact CD2-CB 4.39Å; Y990-E999 HydrophobicContact CD2-CG 4.28Å; Y990-E999 HydrophobicContact CE1-CB 4.44Å; Y990-E999 HydrophobicContact CE1-CG 3.81Å; Y990-E999 WeakPolarHBondContact CE1-OE2 3.13Å; Y990-E999 HydrophobicContact CE2-CB 4.49Å; Y990-E999 HydrophobicContact CG-CB 4.29Å; Y990-E999 HydrophobicContact CG-CG 3.69Å; S997-E999 PolarHBondContact O-N 2.97Å; S997-E999 PolarHBondContact OG-N 3.45Å
1000	W	60.8	Low	68.6	Low	116 Å²	116	50.2 Å²	50.2	44%	0.439	27%	0.27	S	S	.	.			trans	-87	-15.2	-177.3	-57.8	93.4	0	0	0	113.1	I996 K998 K1096 M1099	I996-W1000 HydrophobicContact CG2-CH2 3.68Å; I996-W1000 HydrophobicContact CG2-CZ2 4Å; I996-W1000 HydrophobicContact CG2-CZ3 4.45Å; K998-W1000 PolarHBondContact O-NE1 3.42Å; W1000-K1096 WeakPolarHBondContact O-CD 3.39Å; W1000-M1099 HydrophobicContact CD2-CE 4.01Å; W1000-M1099 HydrophobicContact CE3-CE 3.77Å; W1000-M1099 HydrophobicContact CG-CE 4.43Å; W1000-M1099 HydrophobicContact CZ3-CE 4.21Å
1001	V	71.2	Confident	69.8	Low	17 Å²	17	50.9 Å²	50.9	10%	0.103	27%	0.272	C	S	.	.	S	Bend	trans	-132.3	150.3	-175.4	-66.9	0	0	0	0	110.7	F1003 K1096 V1100	V1001-F1003 VanDerWaalsContact C-N 3.33Å; V1001-F1003 WeakPolarHBondContact CG2-O 3.41Å; V1001-F1003 PolarHBondContact O-N 2.88Å; V1001-K1096 HydrophobicContact CG1-CB 3.63Å; V1001-K1096 HydrophobicContact CG1-CD 4.46Å; V1001-V1100 HydrophobicContact CB-CG2 4.41Å; V1001-V1100 HydrophobicContact CG1-CG2 3.97Å; V1001-V1100 HydrophobicContact CG2-CG2 3.51Å
1002	P	71.2	Confident	71.5	Confident	25 Å²	25	46.7 Å²	46.7	16%	0.162	26%	0.255	C	S	.	.	S	Bend	trans	-60.2	-34.6	177.5	-25.7	32.5	0	0	0	115.2	Y958 Q1089 I1092	Y958-P1002 HydrophobicContact CD2-CB 3.91Å; Y958-P1002 HydrophobicContact CE2-CB 4Å; P1002-Q1089 HydrophobicContact CB-CB 4.19Å; P1002-Q1089 HydrophobicContact CB-CG 4.44Å; P1002-Q1089 HydrophobicContact CG-CB 4.05Å; P1002-Q1089 HydrophobicContact CG-CG 4.33Å; P1002-I1092 HydrophobicContact CG-CG2 4.33Å
1003	F	83	Confident	73.5	Confident	10 Å²	10	42.6 Å²	42.6	4%	0.044	23%	0.226	C	C	.	.	S	Bend	trans	-158.4	170.5	174.5	52.9	-94.1	0	0	0	109.6	C954 Y958 V1001 L1005 Q1089 I1090 C1093	C954-F1003 HydrophobicContact CB-CD2 3.6Å; C954-F1003 HydrophobicContact CB-CE2 3.73Å; C954-F1003 HydrophobicContact CB-CG 4.23Å; C954-F1003 HydrophobicContact CB-CZ 4.45Å; C954-F1003 VanDerWaalsContact SG-CD2 3.54Å; Y958-F1003 HydrophobicContact CD2-CD1 4.1Å; Y958-F1003 HydrophobicContact CG-CD1 4.11Å; V1001-F1003 VanDerWaalsContact C-N 3.33Å; V1001-F1003 WeakPolarHBondContact CG2-O 3.41Å; V1001-F1003 PolarHBondContact O-N 2.88Å; F1003-L1005 HydrophobicContact CD2-CB 4.35Å; F1003-L1005 HydrophobicContact CE2-CB 4.11Å; F1003-L1005 PolarHBondContact O-N 2.65Å; F1003-Q1089 HydrophobicContact CE1-CB 4.09Å; F1003-I1090 HydrophobicContact CZ-CB 4.44Å; F1003-I1090 HydrophobicContact CZ-CG1 3.7Å; F1003-C1093 HydrophobicContact CE2-CB 4.45Å; F1003-C1093 PolarHBondContact O-SG 2.86Å
1004	V	84.3	Confident	75.5	Confident	9 Å²	9	40 Å²	40	6%	0.055	23%	0.231	C	C	.	.			trans	-82.7	107.1	-176.1	178.2	0	0	0	0	111	R965 I970 T1006 F1009 W1104	R965-V1004 HydrophobicContact CB-CG2 3.4Å; R965-V1004 VanDerWaalsContact CB-CG2 3.4Å; R965-V1004 HydrophobicContact CG-CG2 4.31Å; I970-V1004 HydrophobicContact CD1-CB 4.23Å; I970-V1004 HydrophobicContact CD1-CG1 3.8Å; I970-V1004 HydrophobicContact CD1-CG2 4.38Å; V1004-T1006 HydrophobicContact CG1-CG2 4.14Å; V1004-F1009 HydrophobicContact CG1-CE2 3.92Å; V1004-W1104 HydrophobicContact CG1-CH2 4.18Å; V1004-W1104 HydrophobicContact CG1-CZ2 3.59Å
1005	L	89.3	Confident	77.5	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	19%	0.192	C	C	.	.			trans	-135	94	166.1	-179.3	65.2	0	0	0	108.6	F1003 F1009 L1010 M1013 F1024 F1027 I1090 C1093	F1003-L1005 HydrophobicContact CD2-CB 4.35Å; F1003-L1005 HydrophobicContact CE2-CB 4.11Å; F1003-L1005 PolarHBondContact O-N 2.65Å; L1005-F1009 HydrophobicContact CD1-CB 4.3Å; L1005-L1010 HydrophobicContact CD1-CD2 3.97Å; L1005-L1010 HydrophobicContact CD1-CG 4.37Å; L1005-L1010 HydrophobicContact CD2-CD2 4.08Å; L1005-L1010 HydrophobicContact CG-CD2 4.02Å; L1005-L1010 HydrophobicContact CG-CG 4.31Å; L1005-M1013 HydrophobicContact CD1-CE 4.22Å; L1005-F1024 HydrophobicContact CD2-CE2 4.45Å; L1005-F1027 HydrophobicContact CD1-CE1 4.35Å; L1005-F1027 HydrophobicContact CD1-CZ 4Å; L1005-F1027 HydrophobicContact CD2-CE1 3.96Å; L1005-F1027 HydrophobicContact CD2-CZ 4.22Å; L1005-I1090 HydrophobicContact CD2-CG2 4.12Å; L1005-C1093 HydrophobicContact CB-CB 3.9Å; L1005-C1093 HydrophobicContact CD2-CB 4.44Å
1006	T	88.1	Confident	79.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.182	C	C	.	.			trans	-93.6	161	-172.6	40.4	0	0	0	0	112.5	V1004 D1008 F1009 L1010 V1100 W1104	V1004-T1006 HydrophobicContact CG1-CG2 4.14Å; T1006-D1008 VanDerWaalsContact C-N 3.26Å; T1006-D1008 WeakPolarHBondContact CB-OD1 3.45Å; T1006-D1008 PolarHBondContact O-N 3.04Å; T1006-D1008 PolarHBondContact OG1-OD1 2.91Å; T1006-F1009 WeakPolarHBondContact O-CB 3.17Å; T1006-F1009 PolarHBondContact O-N 3.5Å; T1006-F1009 WeakPolarHBondContact OG1-CG 3.37Å; T1006-L1010 PolarHBondContact O-N 3.49Å; T1006-V1100 HydrophobicContact CG2-CB 3.87Å; T1006-V1100 HydrophobicContact CG2-CG1 3.6Å; T1006-W1104 HydrophobicContact CG2-CE3 4.43Å; T1006-W1104 HydrophobicContact CG2-CH2 3.65Å; T1006-W1104 HydrophobicContact CG2-CZ2 3.81Å; T1006-W1104 HydrophobicContact CG2-CZ3 3.97Å; T1006-W1104 WeakPolarHBondContact OG1-CH2 3.48Å
1007	P	88.8	Confident	80.2	Confident	26 Å²	26	30.3 Å²	30.3	17%	0.169	19%	0.186	C	C	.	.	H	α-helix	trans	-56.6	-34	178.5	-28.7	37.5	0	0	0	114.6	D922 L1010 Y1011	D922-P1007 WeakPolarHBondContact OD1-CB 3.29Å; P1007-L1010 PolarHBondContact O-N 3.02Å; P1007-Y1011 WeakPolarHBondContact O-CB 3.47Å; P1007-Y1011 PolarHBondContact O-N 3.1Å
1008	D	89.1	Confident	80.7	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-65	-36.7	173.5	59.4	-17.6	0	0	0	112.6	Q910 D922 L925 T1006 Y1011 V1012	Q910-D1008 PolarHBondContact NE2-OD2 3.42Å; D922-D1008 WeakPolarHBondContact O-CA 3.16Å; L925-D1008 HydrophobicContact CB-CB 4.5Å; T1006-D1008 VanDerWaalsContact C-N 3.26Å; T1006-D1008 WeakPolarHBondContact CB-OD1 3.45Å; T1006-D1008 PolarHBondContact O-N 3.04Å; T1006-D1008 PolarHBondContact OG1-OD1 2.91Å; D1008-Y1011 PolarHBondContact O-N 3.48Å; D1008-V1012 WeakPolarHBondContact O-CG2 3.31Å; D1008-V1012 PolarHBondContact O-N 3.21Å
1009	F	93.9	Very high	81.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.9	-41.7	174.8	-65.2	1.7	0	0	0	111.2	I906 L925 F946 I970 L978 V1004 L1005 T1006 Y1011 V1012 M1013 W1104	I906-F1009 HydrophobicContact CD1-CE1 4.32Å; I906-F1009 HydrophobicContact CG1-CE1 4.35Å; I906-F1009 HydrophobicContact CG1-CZ 4.47Å; L925-F1009 HydrophobicContact CD2-CD1 3.61Å; L925-F1009 HydrophobicContact CD2-CE1 3.81Å; F946-F1009 HydrophobicContact CE1-CB 4.27Å; F946-F1009 HydrophobicContact CZ-CB 3.88Å; F946-F1009 AromaticContact CZ-CD1 3.92Å; F946-F1009 HydrophobicContact CZ-CD1 3.92Å; F946-F1009 AromaticContact CZ-CG 3.87Å; F946-F1009 HydrophobicContact CZ-CG 3.87Å; I970-F1009 HydrophobicContact CD1-CZ 4.4Å; I970-F1009 HydrophobicContact CG2-CZ 4.23Å; L978-F1009 HydrophobicContact CD1-CZ 4.23Å; L978-F1009 HydrophobicContact CD2-CE2 4.13Å; L978-F1009 HydrophobicContact CD2-CZ 4.48Å; V1004-F1009 HydrophobicContact CG1-CE2 3.92Å; L1005-F1009 HydrophobicContact CD1-CB 4.3Å; T1006-F1009 WeakPolarHBondContact O-CB 3.17Å; T1006-F1009 PolarHBondContact O-N 3.5Å; T1006-F1009 WeakPolarHBondContact OG1-CG 3.37Å; F1009-Y1011 VanDerWaalsContact C-N 3.28Å; F1009-Y1011 PolarHBondContact O-N 3.07Å; F1009-V1012 PolarHBondContact O-N 3.01Å; F1009-M1013 PolarHBondContact O-N 2.75Å; F1009-W1104 HydrophobicContact CE1-CH2 4.08Å; F1009-W1104 AromaticContact CZ-CH2 3.86Å; F1009-W1104 HydrophobicContact CZ-CH2 3.86Å
1010	L	92.3	Very high	82.1	Confident	10 Å²	10	41.6 Å²	41.6	5%	0.052	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-36.9	174.9	-67.1	174.4	0	0	0	111.7	L1005 T1006 P1007 M1013 G1014 T1015 F1024 R1094	L1005-L1010 HydrophobicContact CD1-CD2 3.97Å; L1005-L1010 HydrophobicContact CD1-CG 4.37Å; L1005-L1010 HydrophobicContact CD2-CD2 4.08Å; L1005-L1010 HydrophobicContact CG-CD2 4.02Å; L1005-L1010 HydrophobicContact CG-CG 4.31Å; T1006-L1010 PolarHBondContact O-N 3.49Å; P1007-L1010 PolarHBondContact O-N 3.02Å; L1010-M1013 CarbonylContact O-C 3.55Å; L1010-M1013 WeakPolarHBondContact O-CA 3.19Å; L1010-M1013 PolarHBondContact O-N 2.86Å; L1010-M1013 VanDerWaalsContact O-N 3.1Å; L1010-G1014 PolarHBondContact O-N 3.21Å; L1010-T1015 CarbonylContact C-O 3.33Å; L1010-T1015 HydrophobicContact CB-CG2 4.25Å; L1010-T1015 WeakPolarHBondContact O-CA 3.27Å; L1010-T1015 WeakPolarHBondContact O-CB 3.44Å; L1010-T1015 PolarHBondContact O-N 3.16Å; L1010-F1024 HydrophobicContact CD2-CD2 3.72Å; L1010-F1024 HydrophobicContact CD2-CE2 3.47Å; L1010-F1024 VanDerWaalsContact CD2-CE2 3.47Å; L1010-F1024 HydrophobicContact CD2-CZ 4.41Å; L1010-R1094 HydrophobicContact CD1-CG 3.9Å
1011	Y	93	Very high	83.5	Confident	78 Å²	78	36.6 Å²	36.6	31%	0.306	22%	0.219	S	C	.	.	H	α-helix	trans	-63.8	-40.1	176.8	-165	-81.3	0	0	0	111.8	D922 E923 Y926 P1007 D1008 F1009 M1013 G1014 T1015	D922-Y1011 HydrophobicContact CB-CD2 4.06Å; D922-Y1011 HydrophobicContact CB-CG 4.29Å; E923-Y1011 HydrophobicContact CB-CD1 4.41Å; E923-Y1011 HydrophobicContact CB-CE1 3.88Å; E923-Y1011 HydrophobicContact CB-CE2 4.45Å; Y926-Y1011 HydrophobicContact CD1-CE1 4.19Å; Y926-Y1011 HydrophobicContact CD2-CD1 4.38Å; Y926-Y1011 HydrophobicContact CD2-CE1 4.45Å; Y926-Y1011 HydrophobicContact CG-CD1 4.04Å; Y926-Y1011 AromaticContact CG-CE1 3.96Å; Y926-Y1011 HydrophobicContact CG-CE1 3.96Å; P1007-Y1011 WeakPolarHBondContact O-CB 3.47Å; P1007-Y1011 PolarHBondContact O-N 3.1Å; D1008-Y1011 PolarHBondContact O-N 3.48Å; F1009-Y1011 VanDerWaalsContact C-N 3.28Å; F1009-Y1011 PolarHBondContact O-N 3.07Å; Y1011-M1013 PolarHBondContact O-N 2.63Å; Y1011-G1014 WeakPolarHBondContact O-CA 3.33Å; Y1011-G1014 PolarHBondContact O-N 3.41Å; Y1011-T1015 WeakPolarHBondContact CA-O 3.41Å; Y1011-T1015 PolarHBondContact N-O 3.17Å
1012	V	92.6	Very high	84.4	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-58.1	-35.8	172.6	177.3	0	0	0	0	111.6	L925 L929 V943 F946 D1008 F1009 G1014	L925-V1012 HydrophobicContact CB-CG2 4.22Å; L925-V1012 HydrophobicContact CD2-CG2 3.92Å; L925-V1012 HydrophobicContact CG-CG2 3.87Å; L929-V1012 HydrophobicContact CD2-CG1 4.33Å; V943-V1012 HydrophobicContact CG2-CG1 4.43Å; F946-V1012 HydrophobicContact CB-CG1 4.36Å; F946-V1012 HydrophobicContact CD1-CB 3.97Å; F946-V1012 HydrophobicContact CD1-CG1 3.42Å; F946-V1012 VanDerWaalsContact CD1-CG1 3.42Å; F946-V1012 HydrophobicContact CD2-CG1 4.43Å; F946-V1012 HydrophobicContact CE1-CB 3.71Å; F946-V1012 HydrophobicContact CE1-CG1 3.73Å; F946-V1012 HydrophobicContact CE1-CG2 4.37Å; F946-V1012 HydrophobicContact CG-CG1 3.82Å; F946-V1012 HydrophobicContact CZ-CB 4.18Å; F946-V1012 HydrophobicContact CZ-CG1 4.34Å; F946-V1012 HydrophobicContact CZ-CG2 4.35Å; D1008-V1012 WeakPolarHBondContact O-CG2 3.31Å; D1008-V1012 PolarHBondContact O-N 3.21Å; F1009-V1012 PolarHBondContact O-N 3.01Å; V1012-G1014 PolarHBondContact O-N 3.33Å
1013	M	92.4	Very high	85.3	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	15.7	174.8	-54.3	178	-150.9	0	0	113.3	F946 C950 L1005 F1009 L1010 Y1011 T1015 S1021 H1023 F1024 F1027	F946-M1013 HydrophobicContact CD1-CE 4.33Å; F946-M1013 HydrophobicContact CE1-CE 3.77Å; F946-M1013 HydrophobicContact CE1-CG 4.38Å; C950-M1013 HydrophobicContact CB-CE 4.15Å; L1005-M1013 HydrophobicContact CD1-CE 4.22Å; F1009-M1013 PolarHBondContact O-N 2.75Å; L1010-M1013 CarbonylContact O-C 3.55Å; L1010-M1013 WeakPolarHBondContact O-CA 3.19Å; L1010-M1013 PolarHBondContact O-N 2.86Å; L1010-M1013 VanDerWaalsContact O-N 3.1Å; Y1011-M1013 PolarHBondContact O-N 2.63Å; M1013-T1015 VanDerWaalsContact C-N 3.27Å; M1013-T1015 PolarHBondContact O-N 2.83Å; M1013-S1021 PolarHBondContact O-OG 3.45Å; M1013-H1023 HydrophobicContact CB-CB 4.26Å; M1013-H1023 WeakPolarHBondContact O-CB 2.96Å; M1013-F1024 HydrophobicContact SD-CD2 4.5Å; M1013-F1027 HydrophobicContact CE-CD2 3.74Å; M1013-F1027 HydrophobicContact CE-CE2 3.89Å; M1013-F1027 HydrophobicContact CE-CG 4.27Å; M1013-F1027 HydrophobicContact SD-CB 3.86Å; M1013-F1027 HydrophobicContact SD-CD1 4.37Å; M1013-F1027 HydrophobicContact SD-CD2 3.8Å; M1013-F1027 HydrophobicContact SD-CE2 4.44Å; M1013-F1027 HydrophobicContact SD-CG 3.75Å
1014	G	86.6	Confident	85.7	Confident	58 Å²	58	42.5 Å²	42.5	60%	0.598	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	22.8	178.1	0	0	0	0	0	114.3	L1010 Y1011 V1012 S1021	L1010-G1014 PolarHBondContact O-N 3.21Å; Y1011-G1014 WeakPolarHBondContact O-CA 3.33Å; Y1011-G1014 PolarHBondContact O-N 3.41Å; V1012-G1014 PolarHBondContact O-N 3.33Å; G1014-S1021 WeakPolarHBondContact O-CB 3.49Å
1015	T	81.9	Confident	86.1	Confident	4 Å²	4	47 Å²	47	3%	0.025	27%	0.272	C	S	.	.			trans	-106.9	123.2	177.7	-67.7	0	0	0	0	110.5	L1010 Y1011 M1013 K1019 S1021 F1024	L1010-T1015 CarbonylContact C-O 3.33Å; L1010-T1015 HydrophobicContact CB-CG2 4.25Å; L1010-T1015 WeakPolarHBondContact O-CA 3.27Å; L1010-T1015 WeakPolarHBondContact O-CB 3.44Å; L1010-T1015 PolarHBondContact O-N 3.16Å; Y1011-T1015 WeakPolarHBondContact CA-O 3.41Å; Y1011-T1015 PolarHBondContact N-O 3.17Å; M1013-T1015 VanDerWaalsContact C-N 3.27Å; M1013-T1015 PolarHBondContact O-N 2.83Å; T1015-K1019 WeakPolarHBondContact CG2-O 3.46Å; T1015-S1021 PolarHBondContact OG1-OG 3.24Å; T1015-F1024 WeakPolarHBondContact OG1-CB 3.41Å
1016	S	76.7	Confident	86.4	Confident	78 Å²	78	50.5 Å²	50.5	55%	0.545	29%	0.288	S	S	.	.			trans	-123.2	124.4	170.8	-177.7	0	0	0	0	109.9
1017	G	68.2	Low	86.7	Confident	58 Å²	58	50.5 Å²	50.5	60%	0.598	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	-142.3	-173.9	0	0	0	0	0	113.5	K1019 R1094	G1017-K1019 VanDerWaalsContact C-N 3.32Å; G1017-K1019 PolarHBondContact O-N 3.26Å; G1017-R1094 PolarHBondContact O-NH2 2.82Å
1018	K	68.2	Low	87	Confident	146 Å²	146	51.1 Å²	51.1	64%	0.635	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	6.5	-178.9	-69.1	-160.5	171.8	-154.4	0	114.8	R1094 E1095	K1018-R1094 PolarHBondContact O-NH2 3.12Å; K1018-E1095 IonicContact NZ-OE1 2.89Å; K1018-E1095 PolarHBondContact NZ-OE1 3.14Å
1019	K	75.6	Confident	87.3	Confident	166 Å²	166	56 Å²	56	72%	0.722	31%	0.314	S	S	*	.			trans	-74.7	137.5	176.6	-64.8	-177.4	-179	178.3	0	110.3	T1015 G1017 R1094	T1015-K1019 WeakPolarHBondContact CG2-O 3.46Å; G1017-K1019 VanDerWaalsContact C-N 3.32Å; G1017-K1019 PolarHBondContact O-N 3.26Å; K1019-R1094 PolarHBondContact O-NH2 3.46Å; K1019-R1094 VanDerWaalsContact O-NH2 3.1Å
1020	S	77.3	Confident	87.3	Confident	66 Å²	66	56.4 Å²	56.4	46%	0.462	32%	0.317	S	S	.	.			trans	-86.2	146	173.5	-177.8	0	0	0	0	109.6	Q1025	S1020-Q1025 WeakPolarHBondContact OG-CG 3.05Å; S1020-Q1025 PolarHBondContact OG-NE2 3.26Å
1021	S	89.1	Confident	87.5	Confident	11 Å²	11	56 Å²	56	8%	0.077	32%	0.315	C	S	.	.			trans	-119.7	157.2	172.4	81.7	0	0	0	0	110.3	M1013 G1014 T1015 H1023 F1024 Q1025	M1013-S1021 PolarHBondContact O-OG 3.45Å; G1014-S1021 WeakPolarHBondContact O-CB 3.49Å; T1015-S1021 PolarHBondContact OG1-OG 3.24Å; S1021-H1023 PolarHBondContact O-N 3.04Å; S1021-H1023 PolarHBondContact OG-N 3.45Å; S1021-F1024 PolarHBondContact O-N 3.43Å; S1021-F1024 VanDerWaalsContact O-N 3.09Å; S1021-F1024 WeakPolarHBondContact OG-CB 3.49Å; S1021-F1024 PolarHBondContact OG-N 3.29Å; S1021-Q1025 PolarHBondContact O-N 2.78Å
1022	P	90.5	Very high	87.7	Confident	104 Å²	104	52.9 Å²	52.9	68%	0.675	30%	0.304	S	S	*	.	H	α-helix	trans	-57.5	-37.4	173.8	-25.5	34.8	0	0	0	113.1	Q1025 K1026	P1022-Q1025 PolarHBondContact O-N 3.36Å; P1022-K1026 WeakPolarHBondContact O-CB 3.32Å; P1022-K1026 PolarHBondContact O-N 3.02Å
1023	H	90.8	Very high	87.9	Confident	69 Å²	69	58.8 Å²	58.8	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-40.1	174.7	-71	99	0	0	0	111.7	L947 M1013 S1021 K1026 F1027	L947-H1023 HydrophobicContact CD1-CB 4.15Å; L947-H1023 WeakPolarHBondContact CD1-O 3.34Å; M1013-H1023 HydrophobicContact CB-CB 4.26Å; M1013-H1023 WeakPolarHBondContact O-CB 2.96Å; S1021-H1023 PolarHBondContact O-N 3.04Å; S1021-H1023 PolarHBondContact OG-N 3.45Å; H1023-K1026 PolarHBondContact O-N 3.12Å; H1023-F1027 WeakPolarHBondContact O-CB 3.37Å; H1023-F1027 PolarHBondContact O-N 3.04Å
1024	F	91.6	Very high	88.1	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.009	33%	0.329	C	S	.	.	H	α-helix	trans	-68.5	-37.1	177	-175.9	-109.8	0	0	0	112.6	L1005 L1010 M1013 T1015 S1021 F1027 Q1028 I1090	L1005-F1024 HydrophobicContact CD2-CE2 4.45Å; L1010-F1024 HydrophobicContact CD2-CD2 3.72Å; L1010-F1024 HydrophobicContact CD2-CE2 3.47Å; L1010-F1024 VanDerWaalsContact CD2-CE2 3.47Å; L1010-F1024 HydrophobicContact CD2-CZ 4.41Å; M1013-F1024 HydrophobicContact SD-CD2 4.5Å; T1015-F1024 WeakPolarHBondContact OG1-CB 3.41Å; S1021-F1024 PolarHBondContact O-N 3.43Å; S1021-F1024 VanDerWaalsContact O-N 3.09Å; S1021-F1024 WeakPolarHBondContact OG-CB 3.49Å; S1021-F1024 PolarHBondContact OG-N 3.29Å; F1024-F1027 HydrophobicContact CD2-CD1 4.06Å; F1024-F1027 AromaticContact CE2-CD1 3.94Å; F1024-F1027 HydrophobicContact CE2-CD1 3.94Å; F1024-F1027 HydrophobicContact CE2-CE1 4.28Å; F1024-F1027 WeakPolarHBondContact O-CB 3.22Å; F1024-F1027 PolarHBondContact O-N 3.4Å; F1024-Q1028 HydrophobicContact CD1-CG 4.46Å; F1024-Q1028 HydrophobicContact CE1-CG 4.09Å; F1024-Q1028 HydrophobicContact CZ-CG 4.14Å; F1024-Q1028 WeakPolarHBondContact O-CG 3.3Å; F1024-Q1028 PolarHBondContact O-N 3.27Å; F1024-I1090 HydrophobicContact CE2-CG2 4.44Å; F1024-I1090 HydrophobicContact CZ-CG2 4.01Å
1025	Q	92.9	Very high	88.6	Confident	105 Å²	105	56 Å²	56	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-45.1	172.8	-68.7	174	5.7	0	0	111.1	S1020 S1021 P1022 F1027 Q1028 D1029	S1020-Q1025 WeakPolarHBondContact OG-CG 3.05Å; S1020-Q1025 PolarHBondContact OG-NE2 3.26Å; S1021-Q1025 PolarHBondContact O-N 2.78Å; P1022-Q1025 PolarHBondContact O-N 3.36Å; Q1025-F1027 VanDerWaalsContact C-N 3.3Å; Q1025-F1027 PolarHBondContact O-N 2.74Å; Q1025-Q1028 WeakPolarHBondContact O-CB 3.43Å; Q1025-Q1028 PolarHBondContact O-N 2.71Å; Q1025-Q1028 VanDerWaalsContact O-N 3.15Å; Q1025-D1029 PolarHBondContact O-N 3.39Å
1026	K	94.1	Very high	89.3	Confident	74 Å²	74	57.1 Å²	57.1	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-59.8	-40	173.5	-176.2	174.1	174.7	-179.1	0	111.9	E944 L947 Y948 P1022 H1023 D1029 V1030	E944-K1026 IonicContact OE1-NZ 2.71Å; E944-K1026 PolarHBondContact OE1-NZ 3.2Å; L947-K1026 HydrophobicContact CD1-CB 4.26Å; L947-K1026 HydrophobicContact CD1-CD 4.42Å; L947-K1026 HydrophobicContact CD1-CG 4.31Å; L947-K1026 HydrophobicContact CD2-CG 4.32Å; Y948-K1026 WeakPolarHBondContact OH-CE 3.3Å; Y948-K1026 PolarHBondContact OH-NZ 3.37Å; P1022-K1026 WeakPolarHBondContact O-CB 3.32Å; P1022-K1026 PolarHBondContact O-N 3.02Å; H1023-K1026 PolarHBondContact O-N 3.12Å; K1026-D1029 PolarHBondContact O-N 3.13Å; K1026-V1030 WeakPolarHBondContact O-CB 3.41Å; K1026-V1030 VanDerWaalsContact O-CG2 3.24Å; K1026-V1030 WeakPolarHBondContact O-CG2 3.32Å; K1026-V1030 PolarHBondContact O-N 3.31Å
1027	F	95.1	Very high	90.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-46.8	173.1	168.6	-94.7	0	0	0	111.9	L947 C950 L1005 M1013 H1023 F1024 Q1025 D1029 V1030 C1031 I1090	L947-F1027 HydrophobicContact CD1-CB 4.34Å; L947-F1027 HydrophobicContact CD2-CB 4.34Å; L947-F1027 HydrophobicContact CG-CB 4.01Å; C950-F1027 HydrophobicContact CB-CE2 4.36Å; L1005-F1027 HydrophobicContact CD1-CE1 4.35Å; L1005-F1027 HydrophobicContact CD1-CZ 4Å; L1005-F1027 HydrophobicContact CD2-CE1 3.96Å; L1005-F1027 HydrophobicContact CD2-CZ 4.22Å; M1013-F1027 HydrophobicContact CE-CD2 3.74Å; M1013-F1027 HydrophobicContact CE-CE2 3.89Å; M1013-F1027 HydrophobicContact CE-CG 4.27Å; M1013-F1027 HydrophobicContact SD-CB 3.86Å; M1013-F1027 HydrophobicContact SD-CD1 4.37Å; M1013-F1027 HydrophobicContact SD-CD2 3.8Å; M1013-F1027 HydrophobicContact SD-CE2 4.44Å; M1013-F1027 HydrophobicContact SD-CG 3.75Å; H1023-F1027 WeakPolarHBondContact O-CB 3.37Å; H1023-F1027 PolarHBondContact O-N 3.04Å; F1024-F1027 HydrophobicContact CD2-CD1 4.06Å; F1024-F1027 AromaticContact CE2-CD1 3.94Å; F1024-F1027 HydrophobicContact CE2-CD1 3.94Å; F1024-F1027 HydrophobicContact CE2-CE1 4.28Å; F1024-F1027 WeakPolarHBondContact O-CB 3.22Å; F1024-F1027 PolarHBondContact O-N 3.4Å; Q1025-F1027 VanDerWaalsContact C-N 3.3Å; Q1025-F1027 PolarHBondContact O-N 2.74Å; F1027-D1029 PolarHBondContact O-N 3.16Å; F1027-V1030 PolarHBondContact O-N 3.28Å; F1027-C1031 VanDerWaalsContact CZ-SG 3.57Å; F1027-C1031 PolarHBondContact O-N 2.72Å; F1027-C1031 PolarHBondContact O-SG 3Å; F1027-C1031 VanDerWaalsContact O-SG 3.33Å; F1027-I1090 HydrophobicContact CE1-CG2 4.39Å
1028	Q	95.1	Very high	91.5	Very high	39 Å²	39	50.8 Å²	50.8	18%	0.182	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-45.2	177.1	-69.3	179.3	-68.5	0	0	111.4	F1024 Q1025 V1030 C1031 V1032 L1087 I1090	F1024-Q1028 HydrophobicContact CD1-CG 4.46Å; F1024-Q1028 HydrophobicContact CE1-CG 4.09Å; F1024-Q1028 HydrophobicContact CZ-CG 4.14Å; F1024-Q1028 WeakPolarHBondContact O-CG 3.3Å; F1024-Q1028 PolarHBondContact O-N 3.27Å; Q1025-Q1028 WeakPolarHBondContact O-CB 3.43Å; Q1025-Q1028 PolarHBondContact O-N 2.71Å; Q1025-Q1028 VanDerWaalsContact O-N 3.15Å; Q1028-V1030 PolarHBondContact O-N 2.95Å; Q1028-C1031 PolarHBondContact O-N 3.39Å; Q1028-V1032 WeakPolarHBondContact O-CG2 3.42Å; Q1028-V1032 PolarHBondContact O-N 3.07Å; Q1028-L1087 HydrophobicContact CB-CD2 4.14Å; Q1028-L1087 HydrophobicContact CG-CD2 4.45Å; Q1028-I1090 HydrophobicContact CG-CD1 4.47Å; Q1028-I1090 HydrophobicContact CG-CG2 4.47Å
1029	D	95.1	Very high	92.7	Very high	102 Å²	102	45.3 Å²	45.3	55%	0.545	23%	0.228	S	C	.	.	H	α-helix	trans	-61.5	-43.1	177.4	-72.3	-9.5	0	0	0	112	Q1025 K1026 F1027 V1032 K1033	Q1025-D1029 PolarHBondContact O-N 3.39Å; K1026-D1029 PolarHBondContact O-N 3.13Å; F1027-D1029 PolarHBondContact O-N 3.16Å; D1029-V1032 PolarHBondContact O-N 3.09Å; D1029-K1033 WeakPolarHBondContact O-CB 3.46Å; D1029-K1033 WeakPolarHBondContact O-CG 3.06Å; D1029-K1033 PolarHBondContact O-N 2.85Å
1030	V	95	Very high	93.5	Very high	10 Å²	10	42.3 Å²	42.3	6%	0.061	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-48	175.9	167.1	0	0	0	0	110.7	L880 L947 Y948 K1026 F1027 Q1028 V1032 K1033 A1034	L880-V1030 HydrophobicContact CD2-CG1 3.58Å; L947-V1030 HydrophobicContact CD2-CG2 4.12Å; Y948-V1030 HydrophobicContact CD1-CG1 4Å; Y948-V1030 HydrophobicContact CD1-CG2 3.87Å; Y948-V1030 HydrophobicContact CE1-CG1 4.48Å; Y948-V1030 HydrophobicContact CE1-CG2 3.56Å; K1026-V1030 WeakPolarHBondContact O-CB 3.41Å; K1026-V1030 VanDerWaalsContact O-CG2 3.24Å; K1026-V1030 WeakPolarHBondContact O-CG2 3.32Å; K1026-V1030 PolarHBondContact O-N 3.31Å; F1027-V1030 PolarHBondContact O-N 3.28Å; Q1028-V1030 PolarHBondContact O-N 2.95Å; V1030-V1032 PolarHBondContact O-N 3.28Å; V1030-K1033 PolarHBondContact O-N 3.34Å; V1030-A1034 VanDerWaalsContact O-CB 3.23Å; V1030-A1034 WeakPolarHBondContact O-CB 3.32Å; V1030-A1034 PolarHBondContact O-N 2.98Å
1031	C	96.8	Very high	94.2	Very high	2 Å²	2	42 Å²	42	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-44.7	177.7	-72.9	0	0	0	0	112.1	G951 V955 F1027 Q1028 A1034 Y1035 L1086 I1090	G951-C1031 VanDerWaalsContact CA-SG 3.54Å; V955-C1031 HydrophobicContact CG2-CB 4.01Å; V955-C1031 WeakPolarHBondContact CG2-O 3.4Å; F1027-C1031 VanDerWaalsContact CZ-SG 3.57Å; F1027-C1031 PolarHBondContact O-N 2.72Å; F1027-C1031 PolarHBondContact O-SG 3Å; F1027-C1031 VanDerWaalsContact O-SG 3.33Å; Q1028-C1031 PolarHBondContact O-N 3.39Å; C1031-A1034 PolarHBondContact O-N 3.33Å; C1031-Y1035 VanDerWaalsContact O-CB 3.25Å; C1031-Y1035 WeakPolarHBondContact O-CB 3.37Å; C1031-Y1035 PolarHBondContact O-N 2.81Å; C1031-L1086 HydrophobicContact CB-CD2 4.28Å; C1031-L1086 WeakPolarHBondContact O-CD2 3.37Å; C1031-I1090 HydrophobicContact CB-CD1 3.98Å
1032	V	96.6	Very high	94.2	Very high	12 Å²	12	42.1 Å²	42.1	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-49	178.4	168.9	0	0	0	0	110.9	Q1028 D1029 V1030 A1034 Y1035 L1036 Q1083 L1086 L1087	Q1028-V1032 WeakPolarHBondContact O-CG2 3.42Å; Q1028-V1032 PolarHBondContact O-N 3.07Å; D1029-V1032 PolarHBondContact O-N 3.09Å; V1030-V1032 PolarHBondContact O-N 3.28Å; V1032-A1034 PolarHBondContact O-N 3.24Å; V1032-Y1035 PolarHBondContact O-N 3.17Å; V1032-L1036 HydrophobicContact CG1-CD1 3.93Å; V1032-L1036 HydrophobicContact CG1-CG 4.35Å; V1032-L1036 WeakPolarHBondContact O-CG 3.44Å; V1032-L1036 PolarHBondContact O-N 3.1Å; V1032-Q1083 HydrophobicContact CG1-CB 4.3Å; V1032-Q1083 HydrophobicContact CG1-CG 3.7Å; V1032-Q1083 HydrophobicContact CG2-CG 4.12Å; V1032-L1086 HydrophobicContact CG2-CD2 4.14Å; V1032-L1087 HydrophobicContact CG2-CD2 3.88Å; V1032-L1087 HydrophobicContact CG2-CG 4.05Å
1033	K	95.8	Very high	94.2	Very high	127 Å²	127	41.1 Å²	41.1	55%	0.552	20%	0.197	S	C	*	.	H	α-helix	trans	-60.2	-46.3	178.4	-73.4	-179.5	-179.2	-176.9	0	111.8	L878 D1029 V1030 Y1035 L1036 A1037	L878-K1033 HydrophobicContact CD1-CB 3.83Å; L878-K1033 HydrophobicContact CD2-CB 4.3Å; L878-K1033 HydrophobicContact CD2-CD 4.14Å; D1029-K1033 WeakPolarHBondContact O-CB 3.46Å; D1029-K1033 WeakPolarHBondContact O-CG 3.06Å; D1029-K1033 PolarHBondContact O-N 2.85Å; V1030-K1033 PolarHBondContact O-N 3.34Å; K1033-Y1035 PolarHBondContact O-N 3.17Å; K1033-L1036 PolarHBondContact O-N 3.08Å; K1033-A1037 WeakPolarHBondContact O-CB 3.46Å; K1033-A1037 PolarHBondContact O-N 3.44Å
1034	A	96.7	Very high	94.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-43.8	177.8	0	0	0	0	0	112.2	W873 L880 V955 V1030 C1031 V1032 L1038	W873-A1034 HydrophobicContact CZ2-CB 4.16Å; W873-A1034 PolarHBondContact NE1-O 3Å; L880-A1034 HydrophobicContact CD1-CB 3.41Å; L880-A1034 VanDerWaalsContact CD1-CB 3.41Å; V955-A1034 HydrophobicContact CB-CB 4.44Å; V955-A1034 HydrophobicContact CG1-CB 4.32Å; V955-A1034 HydrophobicContact CG2-CB 4.17Å; V1030-A1034 VanDerWaalsContact O-CB 3.23Å; V1030-A1034 WeakPolarHBondContact O-CB 3.32Å; V1030-A1034 PolarHBondContact O-N 2.98Å; C1031-A1034 PolarHBondContact O-N 3.33Å; V1032-A1034 PolarHBondContact O-N 3.24Å; A1034-L1038 WeakPolarHBondContact O-CG 3.38Å; A1034-L1038 PolarHBondContact O-N 2.86Å; A1034-L1038 VanDerWaalsContact O-N 3.15Å
1035	Y	97.4	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-45.9	179	176.1	-112.7	0	0	0	112.4	Y958 V959 C1031 V1032 K1033 A1037 L1038 R1039 A1072 L1073 T1074 A1082 L1086	Y958-Y1035 HydrophobicContact CD1-CE2 4.47Å; Y958-Y1035 HydrophobicContact CE1-CE2 4.17Å; V959-Y1035 HydrophobicContact CG2-CD2 4.14Å; V959-Y1035 HydrophobicContact CG2-CE2 4.29Å; C1031-Y1035 VanDerWaalsContact O-CB 3.25Å; C1031-Y1035 WeakPolarHBondContact O-CB 3.37Å; C1031-Y1035 PolarHBondContact O-N 2.81Å; V1032-Y1035 PolarHBondContact O-N 3.17Å; K1033-Y1035 PolarHBondContact O-N 3.17Å; Y1035-A1037 VanDerWaalsContact C-N 3.34Å; Y1035-A1037 PolarHBondContact O-N 2.83Å; Y1035-L1038 PolarHBondContact O-N 3.38Å; Y1035-R1039 VanDerWaalsContact CE1-CD 3.47Å; Y1035-R1039 HydrophobicContact CE1-CG 4.3Å; Y1035-R1039 HydrophobicContact CE2-CG 4.42Å; Y1035-R1039 WeakPolarHBondContact O-CG 3.44Å; Y1035-R1039 PolarHBondContact O-N 2.91Å; Y1035-A1072 VanDerWaalsContact CE2-O 3.25Å; Y1035-A1072 WeakPolarHBondContact CE2-O 3.38Å; Y1035-A1072 PolarHBondContact OH-O 3.03Å; Y1035-L1073 HydrophobicContact CD2-CD2 4.47Å; Y1035-L1073 HydrophobicContact CE2-CD2 4.1Å; Y1035-T1074 WeakPolarHBondContact OH-CG2 3.28Å; Y1035-T1074 PolarHBondContact OH-OG1 3.34Å; Y1035-A1082 HydrophobicContact CE1-CB 4.05Å; Y1035-A1082 WeakPolarHBondContact CE1-O 3.15Å; Y1035-L1086 VanDerWaalsContact CB-CD2 3.45Å; Y1035-L1086 HydrophobicContact CD1-CB 4Å; Y1035-L1086 HydrophobicContact CD1-CD1 4.46Å; Y1035-L1086 HydrophobicContact CD1-CD2 3.89Å; Y1035-L1086 HydrophobicContact CD1-CG 4.34Å; Y1035-L1086 HydrophobicContact CD2-CD1 4.2Å; Y1035-L1086 HydrophobicContact CE1-CB 4.17Å; Y1035-L1086 HydrophobicContact CG-CB 4.48Å; Y1035-L1086 HydrophobicContact CG-CD1 4.13Å; Y1035-L1086 HydrophobicContact CG-CD2 3.76Å; Y1035-L1086 HydrophobicContact CG-CG 4.34Å
1036	L	96.1	Very high	94	Very high	28 Å²	28	33.6 Å²	33.6	15%	0.147	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-40.9	177.6	-68.3	179.1	0	0	0	111.6	V1032 K1033 L1038 R1039 H1040 E1079 A1082	V1032-L1036 HydrophobicContact CG1-CD1 3.93Å; V1032-L1036 HydrophobicContact CG1-CG 4.35Å; V1032-L1036 WeakPolarHBondContact O-CG 3.44Å; V1032-L1036 PolarHBondContact O-N 3.1Å; K1033-L1036 PolarHBondContact O-N 3.08Å; L1036-L1038 VanDerWaalsContact C-N 3.34Å; L1036-L1038 PolarHBondContact O-N 3.37Å; L1036-R1039 WeakPolarHBondContact O-CA 3.49Å; L1036-R1039 WeakPolarHBondContact O-CB 3.47Å; L1036-R1039 PolarHBondContact O-N 2.79Å; L1036-H1040 PolarHBondContact O-N 2.87Å; L1036-E1079 HydrophobicContact CD2-CB 4.42Å; L1036-A1082 HydrophobicContact CD2-CB 4.45Å
1037	A	95.4	Very high	93.7	Very high	3 Å²	3	30.2 Å²	30.2	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-56.8	-46.3	173.3	0	0	0	0	0	111.6	I872 E876 K1033 Y1035 R1039 H1040 H1041	I872-A1037 HydrophobicContact CG2-CB 4.38Å; E876-A1037 HydrophobicContact CB-CB 4.36Å; E876-A1037 HydrophobicContact CG-CB 3.87Å; K1033-A1037 WeakPolarHBondContact O-CB 3.46Å; K1033-A1037 PolarHBondContact O-N 3.44Å; Y1035-A1037 VanDerWaalsContact C-N 3.34Å; Y1035-A1037 PolarHBondContact O-N 2.83Å; A1037-R1039 VanDerWaalsContact C-N 3.3Å; A1037-R1039 PolarHBondContact O-N 3.04Å; A1037-H1040 PolarHBondContact O-N 3.48Å; A1037-H1041 PolarHBondContact O-CD2 2.95Å
1038	L	95.5	Very high	93.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-33.9	175.3	-65.5	-174.5	0	0	0	112.9	M869 I872 W873 V955 V959 A1034 Y1035 L1036 H1041 T1042 L1045 L1073	M869-L1038 HydrophobicContact CB-CD2 4.03Å; M869-L1038 HydrophobicContact CE-CD1 3.85Å; M869-L1038 HydrophobicContact CG-CD1 4.29Å; M869-L1038 HydrophobicContact CG-CD2 3.73Å; M869-L1038 HydrophobicContact SD-CD1 3.92Å; M869-L1038 HydrophobicContact SD-CD2 4.45Å; I872-L1038 HydrophobicContact CB-CD2 4.45Å; I872-L1038 HydrophobicContact CD1-CD2 4.18Å; I872-L1038 HydrophobicContact CG2-CD2 4.19Å; W873-L1038 HydrophobicContact CZ2-CD1 3.81Å; W873-L1038 HydrophobicContact CZ2-CD2 4.2Å; W873-L1038 HydrophobicContact CZ2-CG 4.05Å; V955-L1038 HydrophobicContact CG1-CD1 3.91Å; V959-L1038 HydrophobicContact CB-CD1 4.49Å; V959-L1038 HydrophobicContact CG2-CD1 4.12Å; A1034-L1038 WeakPolarHBondContact O-CG 3.38Å; A1034-L1038 PolarHBondContact O-N 2.86Å; A1034-L1038 VanDerWaalsContact O-N 3.15Å; Y1035-L1038 PolarHBondContact O-N 3.38Å; L1036-L1038 VanDerWaalsContact C-N 3.34Å; L1036-L1038 PolarHBondContact O-N 3.37Å; L1038-H1041 CarbonylContact O-C 3.53Å; L1038-H1041 PolarHBondContact O-N 2.94Å; L1038-H1041 VanDerWaalsContact O-N 3.12Å; L1038-T1042 PolarHBondContact O-N 3.17Å; L1038-L1045 HydrophobicContact CB-CD1 4.15Å; L1038-L1045 HydrophobicContact CD2-CD1 4.43Å; L1038-L1073 HydrophobicContact CB-CD2 4.17Å
1039	R	94.1	Very high	92.9	Very high	32 Å²	32	28.4 Å²	28.4	12%	0.121	14%	0.139	C	C	.	.	H	α-helix	trans	-66.5	-34.2	175.7	-69.4	180	77.2	-110.6	5.5	112.9	Y1035 L1036 A1037 H1041 T1042 L1073 T1074 R1077	Y1035-R1039 VanDerWaalsContact CE1-CD 3.47Å; Y1035-R1039 HydrophobicContact CE1-CG 4.3Å; Y1035-R1039 HydrophobicContact CE2-CG 4.42Å; Y1035-R1039 WeakPolarHBondContact O-CG 3.44Å; Y1035-R1039 PolarHBondContact O-N 2.91Å; L1036-R1039 WeakPolarHBondContact O-CA 3.49Å; L1036-R1039 WeakPolarHBondContact O-CB 3.47Å; L1036-R1039 PolarHBondContact O-N 2.79Å; A1037-R1039 VanDerWaalsContact C-N 3.3Å; A1037-R1039 PolarHBondContact O-N 3.04Å; R1039-H1041 PolarHBondContact O-N 3.29Å; R1039-T1042 PolarHBondContact O-N 2.82Å; R1039-T1042 PolarHBondContact O-OG1 2.91Å; R1039-L1073 WeakPolarHBondContact CD-O 3.44Å; R1039-L1073 HydrophobicContact CG-CB 4.21Å; R1039-L1073 HydrophobicContact CG-CD2 3.79Å; R1039-L1073 PolarHBondContact NE-O 3.01Å; R1039-T1074 PolarHBondContact NE-OG1 2.86Å; R1039-T1074 PolarHBondContact NH2-O 2.7Å; R1039-T1074 VanDerWaalsContact NH2-O 3.16Å; R1039-R1077 PolarHBondContact NH2-O 2.79Å
1040	H	91.7	Very high	92.2	Very high	103 Å²	103	24.3 Å²	24.3	48%	0.477	12%	0.119	S	C	.	.	H	α-helix	trans	-63	-21.3	172.8	-62	149.3	0	0	0	112.5	L1036 A1037 E1079	L1036-H1040 PolarHBondContact O-N 2.87Å; A1037-H1040 PolarHBondContact O-N 3.48Å; H1040-E1079 IonicContact CD2-OE1 2.79Å; H1040-E1079 IonicContact CE1-OE1 3.01Å; H1040-E1079 IonicContact NE2-OE1 3.21Å; H1040-E1079 PolarHBondContact NE2-OE1 2.77Å
1041	H	92.1	Very high	91.6	Very high	59 Å²	59	23.9 Å²	23.9	27%	0.273	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	22.6	178.5	-65.8	-86	0	0	0	113.7	I872 A1037 L1038 R1039 N1043 L1044 L1045	I872-H1041 HydrophobicContact CD1-CB 3.81Å; I872-H1041 HydrophobicContact CG1-CB 4.35Å; I872-H1041 HydrophobicContact CG2-CB 4.47Å; I872-H1041 WeakPolarHBondContact CG2-CD2 3.36Å; A1037-H1041 PolarHBondContact O-CD2 2.95Å; L1038-H1041 CarbonylContact O-C 3.53Å; L1038-H1041 PolarHBondContact O-N 2.94Å; L1038-H1041 VanDerWaalsContact O-N 3.12Å; R1039-H1041 PolarHBondContact O-N 3.29Å; H1041-N1043 VanDerWaalsContact C-N 3.29Å; H1041-N1043 PolarHBondContact O-N 3.39Å; H1041-L1044 PolarHBondContact O-N 3.47Å; H1041-L1044 VanDerWaalsContact O-N 3.11Å; H1041-L1045 PolarHBondContact O-N 3.01Å
1042	T	90.7	Very high	90.8	Very high	14 Å²	14	23.9 Å²	23.9	9%	0.086	12%	0.116	C	C	.	.	H	α-helix	trans	-49.6	-45.8	-179.7	-72.9	0	0	0	0	113.3	L1038 R1039 L1044 L1045 I1046 L1073 V1075	L1038-T1042 PolarHBondContact O-N 3.17Å; R1039-T1042 PolarHBondContact O-N 2.82Å; R1039-T1042 PolarHBondContact O-OG1 2.91Å; T1042-L1044 VanDerWaalsContact C-N 3.32Å; T1042-L1044 PolarHBondContact O-N 3.26Å; T1042-L1045 PolarHBondContact O-N 2.83Å; T1042-I1046 HydrophobicContact CG2-CD1 3.57Å; T1042-I1046 HydrophobicContact CG2-CG1 4.16Å; T1042-I1046 WeakPolarHBondContact O-CB 3.4Å; T1042-I1046 WeakPolarHBondContact O-CG1 3.48Å; T1042-I1046 PolarHBondContact O-N 3.4Å; T1042-L1073 HydrophobicContact CG2-CD1 4.28Å; T1042-V1075 HydrophobicContact CG2-CG2 3.53Å
1043	N	89.9	Confident	89.6	Confident	83 Å²	83	24.1 Å²	24.1	44%	0.444	12%	0.117	S	C	.	.	H	α-helix	trans	-61.5	-41.7	-176.9	-72.6	-0.4	0	0	0	111.6	P581 H1041 I1047	P581-N1043 WeakPolarHBondContact CD-OD1 3.4Å; P581-N1043 HydrophobicContact CG-CB 4.36Å; H1041-N1043 VanDerWaalsContact C-N 3.29Å; H1041-N1043 PolarHBondContact O-N 3.39Å; N1043-I1047 VanDerWaalsContact O-CG1 3.28Å; N1043-I1047 WeakPolarHBondContact O-CG1 3.38Å; N1043-I1047 PolarHBondContact O-N 2.87Å
1044	L	91.1	Very high	88.2	Confident	17 Å²	17	18.5 Å²	18.5	9%	0.089	9%	0.093	C	C	.	.	H	α-helix	trans	-61.5	-50.7	176.8	176.5	62	0	0	0	110.6	Y677 I868 H1041 T1042 I1046 I1047 L1048	Y677-L1044 HydrophobicContact CE1-CD1 4.15Å; Y677-L1044 HydrophobicContact CE1-CD2 4.48Å; I868-L1044 HydrophobicContact CG2-CD2 4.32Å; H1041-L1044 PolarHBondContact O-N 3.47Å; H1041-L1044 VanDerWaalsContact O-N 3.11Å; T1042-L1044 VanDerWaalsContact C-N 3.32Å; T1042-L1044 PolarHBondContact O-N 3.26Å; L1044-I1046 PolarHBondContact O-N 2.9Å; L1044-I1047 PolarHBondContact O-N 3.47Å; L1044-L1048 HydrophobicContact CD1-CD1 4Å; L1044-L1048 HydrophobicContact CD1-CD2 4.33Å; L1044-L1048 HydrophobicContact CD1-CG 4.02Å; L1044-L1048 HydrophobicContact CG-CD1 3.91Å; L1044-L1048 HydrophobicContact CG-CG 4.34Å; L1044-L1048 VanDerWaalsContact O-CG 3.25Å; L1044-L1048 WeakPolarHBondContact O-CG 3.33Å; L1044-L1048 PolarHBondContact O-N 2.83Å
1045	L	90.6	Very high	86.8	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-46.3	179.9	-66	175.1	0	0	0	111.8	M869 L1038 H1041 T1042 I1047 L1048 F1049 L1073	M869-L1045 HydrophobicContact CE-CD2 4.35Å; L1038-L1045 HydrophobicContact CB-CD1 4.15Å; L1038-L1045 HydrophobicContact CD2-CD1 4.43Å; H1041-L1045 PolarHBondContact O-N 3.01Å; T1042-L1045 PolarHBondContact O-N 2.83Å; L1045-I1047 VanDerWaalsContact C-N 3.33Å; L1045-I1047 PolarHBondContact O-N 2.86Å; L1045-L1048 PolarHBondContact O-N 3.17Å; L1045-F1049 WeakPolarHBondContact O-CD2 3.47Å; L1045-F1049 PolarHBondContact O-N 2.99Å; L1045-F1049 VanDerWaalsContact O-N 3.12Å; L1045-L1073 HydrophobicContact CD1-CD1 3.96Å
1046	I	88.8	Confident	85.2	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57	-46.3	176.6	-74.2	178.3	0	0	0	111.2	D580 P581 L582 T1042 L1044 F1049 S1050 I1066 I1069	D580-I1046 HydrophobicContact CB-CD1 4.18Å; P581-I1046 HydrophobicContact CB-CG2 4.14Å; P581-I1046 HydrophobicContact CG-CG2 4.28Å; L582-I1046 HydrophobicContact CD1-CG2 3.92Å; L582-I1046 HydrophobicContact CD2-CG2 4.08Å; L582-I1046 HydrophobicContact CG-CG2 3.66Å; T1042-I1046 HydrophobicContact CG2-CD1 3.57Å; T1042-I1046 HydrophobicContact CG2-CG1 4.16Å; T1042-I1046 WeakPolarHBondContact O-CB 3.4Å; T1042-I1046 WeakPolarHBondContact O-CG1 3.48Å; T1042-I1046 PolarHBondContact O-N 3.4Å; L1044-I1046 PolarHBondContact O-N 2.9Å; I1046-F1049 PolarHBondContact O-N 3.36Å; I1046-S1050 VanDerWaalsContact O-CB 3.31Å; I1046-S1050 WeakPolarHBondContact O-CB 3.35Å; I1046-S1050 PolarHBondContact O-N 2.93Å; I1046-S1050 PolarHBondContact O-OG 2.66Å; I1046-I1066 HydrophobicContact CG2-CG2 4.27Å; I1046-I1069 HydrophobicContact CG1-CG2 4.42Å
1047	I	89	Confident	84	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-67.7	-41.6	-178.7	-68.6	-47.4	0	0	0	112.4	P581 M646 Q647 N1043 L1044 L1045 F1049 S1050 M1051	P581-I1047 HydrophobicContact CB-CD1 3.48Å; P581-I1047 VanDerWaalsContact CB-CD1 3.48Å; P581-I1047 HydrophobicContact CB-CG1 4.34Å; P581-I1047 HydrophobicContact CG-CD1 3.68Å; P581-I1047 HydrophobicContact CG-CG1 3.98Å; M646-I1047 HydrophobicContact CB-CG2 3.76Å; Q647-I1047 HydrophobicContact CB-CD1 3.94Å; Q647-I1047 HydrophobicContact CB-CG1 4.04Å; Q647-I1047 HydrophobicContact CB-CG2 4.5Å; Q647-I1047 HydrophobicContact CG-CD1 3.78Å; Q647-I1047 HydrophobicContact CG-CG1 4.4Å; N1043-I1047 VanDerWaalsContact O-CG1 3.28Å; N1043-I1047 WeakPolarHBondContact O-CG1 3.38Å; N1043-I1047 PolarHBondContact O-N 2.87Å; L1044-I1047 PolarHBondContact O-N 3.47Å; L1045-I1047 VanDerWaalsContact C-N 3.33Å; L1045-I1047 PolarHBondContact O-N 2.86Å; I1047-F1049 VanDerWaalsContact C-N 3.29Å; I1047-F1049 PolarHBondContact O-N 2.82Å; I1047-S1050 WeakPolarHBondContact CA-OG 3.47Å; I1047-S1050 PolarHBondContact O-N 3.25Å; I1047-S1050 PolarHBondContact O-OG 2.84Å; I1047-S1050 VanDerWaalsContact O-OG 3.04Å; I1047-M1051 HydrophobicContact CG2-CG 4.32Å; I1047-M1051 HydrophobicContact CG2-SD 3.81Å; I1047-M1051 VanDerWaalsContact O-CG 3.28Å; I1047-M1051 WeakPolarHBondContact O-CG 3.44Å; I1047-M1051 PolarHBondContact O-N 3.11Å
1048	L	88.7	Confident	82.3	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.3	-43.3	177.5	-67	172	0	0	0	110.9	M646 Y677 Q680 I865 I868 L1044 L1045 M1052	M646-L1048 HydrophobicContact CE-CD2 3.58Å; M646-L1048 HydrophobicContact SD-CD2 3.83Å; Y677-L1048 HydrophobicContact CD1-CD2 3.92Å; Y677-L1048 HydrophobicContact CE1-CD1 4.44Å; Y677-L1048 HydrophobicContact CE1-CD2 4.26Å; Q680-L1048 HydrophobicContact CB-CD2 4.44Å; Q680-L1048 HydrophobicContact CG-CD2 3.71Å; I865-L1048 HydrophobicContact CD1-CB 3.88Å; I865-L1048 HydrophobicContact CD1-CD1 3.85Å; I865-L1048 HydrophobicContact CD1-CG 4.46Å; I868-L1048 HydrophobicContact CD1-CD1 3.68Å; I868-L1048 HydrophobicContact CG2-CD1 4.18Å; L1044-L1048 HydrophobicContact CD1-CD1 4Å; L1044-L1048 HydrophobicContact CD1-CD2 4.33Å; L1044-L1048 HydrophobicContact CD1-CG 4.02Å; L1044-L1048 HydrophobicContact CG-CD1 3.91Å; L1044-L1048 HydrophobicContact CG-CG 4.34Å; L1044-L1048 VanDerWaalsContact O-CG 3.25Å; L1044-L1048 WeakPolarHBondContact O-CG 3.33Å; L1044-L1048 PolarHBondContact O-N 2.83Å; L1045-L1048 PolarHBondContact O-N 3.17Å; L1048-M1052 WeakPolarHBondContact O-CG 3.41Å; L1048-M1052 PolarHBondContact O-N 3.31Å
1049	F	83.9	Confident	80.8	Confident	1 Å²	1	24.7 Å²	24.7	0%	0.004	14%	0.137	C	C	.	.	H	α-helix	trans	-74.4	-35.9	176.4	-80.2	-77.7	0	0	0	113.2	L861 I862 I865 L960 L987 L1045 I1046 I1047 M1051 M1052 L1053 L1060 I1069	L861-F1049 HydrophobicContact CD2-CD1 4.48Å; L861-F1049 HydrophobicContact CD2-CE1 4.22Å; I862-F1049 HydrophobicContact CD1-CE1 4.41Å; I862-F1049 HydrophobicContact CD1-CZ 4.46Å; I865-F1049 HydrophobicContact CB-CZ 4.39Å; I865-F1049 HydrophobicContact CD1-CE2 4.04Å; I865-F1049 HydrophobicContact CD1-CZ 4.28Å; I865-F1049 HydrophobicContact CG1-CE2 4.02Å; I865-F1049 HydrophobicContact CG1-CZ 3.79Å; I865-F1049 HydrophobicContact CG2-CE2 3.98Å; I865-F1049 HydrophobicContact CG2-CZ 4.1Å; L960-F1049 HydrophobicContact CD2-CE1 4.47Å; L960-F1049 HydrophobicContact CD2-CE2 3.39Å; L960-F1049 HydrophobicContact CD2-CZ 3.34Å; L960-F1049 HydrophobicContact CG-CZ 4.49Å; L987-F1049 HydrophobicContact CD1-CD1 4.08Å; L987-F1049 HydrophobicContact CD1-CE1 4.5Å; L987-F1049 HydrophobicContact CD2-CD1 4.47Å; L987-F1049 HydrophobicContact CD2-CE1 4.45Å; L1045-F1049 WeakPolarHBondContact O-CD2 3.47Å; L1045-F1049 PolarHBondContact O-N 2.99Å; L1045-F1049 VanDerWaalsContact O-N 3.12Å; I1046-F1049 PolarHBondContact O-N 3.36Å; I1047-F1049 VanDerWaalsContact C-N 3.29Å; I1047-F1049 PolarHBondContact O-N 2.82Å; F1049-M1051 VanDerWaalsContact C-N 3.32Å; F1049-M1051 PolarHBondContact O-N 3.31Å; F1049-M1052 CarbonylContact O-C 3.58Å; F1049-M1052 PolarHBondContact O-N 2.83Å; F1049-L1053 PolarHBondContact O-N 3.01Å; F1049-L1060 HydrophobicContact CD1-CD2 4.16Å; F1049-I1069 HydrophobicContact CB-CD1 3.66Å; F1049-I1069 HydrophobicContact CD1-CD1 4.19Å; F1049-I1069 HydrophobicContact CD2-CD1 3.21Å; F1049-I1069 HydrophobicContact CE2-CD1 3.89Å; F1049-I1069 HydrophobicContact CG-CD1 3.4Å; F1049-I1069 VanDerWaalsContact CG-CD1 3.4Å
1050	S	81.4	Confident	79.5	Confident	17 Å²	17	23.2 Å²	23.2	12%	0.119	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-36.2	179.2	73.2	0	0	0	0	112.8	I1046 I1047 M1052	I1046-S1050 VanDerWaalsContact O-CB 3.31Å; I1046-S1050 WeakPolarHBondContact O-CB 3.35Å; I1046-S1050 PolarHBondContact O-N 2.93Å; I1046-S1050 PolarHBondContact O-OG 2.66Å; I1047-S1050 WeakPolarHBondContact CA-OG 3.47Å; I1047-S1050 PolarHBondContact O-N 3.25Å; I1047-S1050 PolarHBondContact O-OG 2.84Å; I1047-S1050 VanDerWaalsContact O-OG 3.04Å; S1050-M1052 PolarHBondContact O-N 3.12Å
1051	M	81.5	Confident	78	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67	-28.4	173.8	-68.5	175.4	72.7	0	0	112	M646 D650 A684 F687 I1047 F1049 T1055	M646-M1051 HydrophobicContact CB-SD 3.93Å; M646-M1051 HydrophobicContact CE-CE 4.18Å; M646-M1051 HydrophobicContact CE-SD 3.82Å; D650-M1051 HydrophobicContact CB-CG 4.29Å; A684-M1051 HydrophobicContact CB-CE 3.44Å; A684-M1051 VanDerWaalsContact CB-CE 3.44Å; F687-M1051 HydrophobicContact CE2-CB 4.43Å; I1047-M1051 HydrophobicContact CG2-CG 4.32Å; I1047-M1051 HydrophobicContact CG2-SD 3.81Å; I1047-M1051 VanDerWaalsContact O-CG 3.28Å; I1047-M1051 WeakPolarHBondContact O-CG 3.44Å; I1047-M1051 PolarHBondContact O-N 3.11Å; F1049-M1051 VanDerWaalsContact C-N 3.32Å; F1049-M1051 PolarHBondContact O-N 3.31Å; M1051-T1055 WeakPolarHBondContact O-CG2 3.42Å
1052	M	79.2	Confident	76.7	Confident	3 Å²	3	20 Å²	20	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-89.4	-24.5	-177.6	-64	-61.1	-62.5	0	0	114	L679 Q680 Q683 L861 L1048 F1049 S1050 M1054 T1055 M1057	L679-M1052 HydrophobicContact CD2-CE 4.25Å; L679-M1052 HydrophobicContact CG-CE 4.4Å; Q680-M1052 HydrophobicContact CG-CG 4.3Å; Q680-M1052 HydrophobicContact CG-SD 4.15Å; Q683-M1052 HydrophobicContact CB-SD 4.16Å; Q683-M1052 HydrophobicContact CG-CE 4.09Å; Q683-M1052 HydrophobicContact CG-SD 3.78Å; L861-M1052 HydrophobicContact CB-CE 4.26Å; L861-M1052 HydrophobicContact CD1-CE 4.03Å; L861-M1052 HydrophobicContact CD1-CG 3.74Å; L861-M1052 HydrophobicContact CD1-SD 4.29Å; L861-M1052 HydrophobicContact CD2-CB 3.75Å; L861-M1052 HydrophobicContact CD2-CE 3.99Å; L861-M1052 HydrophobicContact CD2-CG 3.83Å; L861-M1052 HydrophobicContact CG-CE 4.32Å; L861-M1052 HydrophobicContact CG-CG 4.45Å; L1048-M1052 WeakPolarHBondContact O-CG 3.41Å; L1048-M1052 PolarHBondContact O-N 3.31Å; F1049-M1052 CarbonylContact O-C 3.58Å; F1049-M1052 PolarHBondContact O-N 2.83Å; S1050-M1052 PolarHBondContact O-N 3.12Å; M1052-M1054 PolarHBondContact O-N 2.69Å; M1052-M1054 VanDerWaalsContact O-N 3.1Å; M1052-T1055 PolarHBondContact O-N 3.28Å; M1052-T1055 VanDerWaalsContact O-N 3.08Å; M1052-T1055 PolarHBondContact O-OG1 3.26Å; M1052-T1055 HydrophobicContact SD-CG2 4.29Å; M1052-M1057 HydrophobicContact CB-CE 3.7Å; M1052-M1057 HydrophobicContact CE-CE 3.57Å; M1052-M1057 HydrophobicContact CE-SD 4.13Å; M1052-M1057 WeakPolarHBondContact O-CE 3.39Å
1053	L	71.8	Confident	75.7	Confident	16 Å²	16	24.6 Å²	24.6	8%	0.084	14%	0.143	C	C	.	.	H	α-helix	trans	-48.9	-38	169.4	-84.3	-164.5	0	0	0	112.6	F1049 T1055 L1060 S1062 D1065 I1066	F1049-L1053 PolarHBondContact O-N 3.01Å; L1053-T1055 VanDerWaalsContact C-N 3.27Å; L1053-T1055 PolarHBondContact O-N 3.42Å; L1053-L1060 HydrophobicContact CD2-CB 4.06Å; L1053-L1060 HydrophobicContact CD2-CD2 3.38Å; L1053-L1060 HydrophobicContact CD2-CG 4.31Å; L1053-L1060 HydrophobicContact CG-CD2 4.16Å; L1053-S1062 WeakPolarHBondContact CD1-O 3.4Å; L1053-S1062 VanDerWaalsContact CD2-O 3.29Å; L1053-S1062 WeakPolarHBondContact CD2-O 3.33Å; L1053-D1065 HydrophobicContact CD2-CB 3.92Å; L1053-I1066 HydrophobicContact CD1-CD1 3.14Å; L1053-I1066 HydrophobicContact CD1-CG1 3.42Å; L1053-I1066 VanDerWaalsContact CD1-CG1 3.42Å; L1053-I1066 HydrophobicContact CD2-CG1 4.05Å; L1053-I1066 HydrophobicContact CG-CD1 3.69Å; L1053-I1066 HydrophobicContact CG-CG1 3.58Å
1054	M	66.1	Low	74.7	Confident	9 Å²	9	26.9 Å²	26.9	4%	0.044	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.8	-169.8	-55.7	-73.7	-66.2	0	0	111.1	I506 N507 A508 L511 C651 F687 M1052 G1056	I506-M1054 HydrophobicContact CB-CE 3.89Å; I506-M1054 HydrophobicContact CB-SD 3.88Å; I506-M1054 HydrophobicContact CG2-CE 3.27Å; I506-M1054 HydrophobicContact CG2-SD 3.96Å; N507-M1054 PolarHBondContact OD1-O 3.23Å; A508-M1054 VanDerWaalsContact CA-O 3.3Å; A508-M1054 WeakPolarHBondContact CA-O 3.47Å; A508-M1054 HydrophobicContact CB-CB 3.89Å; A508-M1054 WeakPolarHBondContact CB-O 3.49Å; A508-M1054 PolarHBondContact N-O 2.9Å; L511-M1054 HydrophobicContact CD1-CE 3.83Å; L511-M1054 HydrophobicContact CG-CE 4.48Å; C651-M1054 HydrophobicContact CB-CE 4.12Å; F687-M1054 HydrophobicContact CE1-CB 3.61Å; F687-M1054 HydrophobicContact CE1-CE 4.39Å; F687-M1054 HydrophobicContact CE1-CG 4.04Å; F687-M1054 HydrophobicContact CZ-CB 3.63Å; F687-M1054 HydrophobicContact CZ-CG 3.96Å; M1052-M1054 PolarHBondContact O-N 2.69Å; M1052-M1054 VanDerWaalsContact O-N 3.1Å; M1054-G1056 VanDerWaalsContact C-N 3.28Å; M1054-G1056 PolarHBondContact O-N 3.34Å
1055	T	68	Low	73.7	Confident	4 Å²	4	26.5 Å²	26.5	3%	0.025	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	8.2	-167.7	67.7	0	0	0	0	114.2	Q683 M1051 M1052 L1053 M1057	Q683-T1055 HydrophobicContact CB-CG2 3.62Å; Q683-T1055 HydrophobicContact CG-CG2 3.73Å; Q683-T1055 VanDerWaalsContact OE1-CB 3.26Å; M1051-T1055 WeakPolarHBondContact O-CG2 3.42Å; M1052-T1055 PolarHBondContact O-N 3.28Å; M1052-T1055 VanDerWaalsContact O-N 3.08Å; M1052-T1055 PolarHBondContact O-OG1 3.26Å; M1052-T1055 HydrophobicContact SD-CG2 4.29Å; L1053-T1055 VanDerWaalsContact C-N 3.27Å; L1053-T1055 PolarHBondContact O-N 3.42Å; T1055-M1057 WeakPolarHBondContact OG1-CE 3.31Å
1056	G	64.6	Low	73	Confident	31 Å²	31	26.6 Å²	26.6	32%	0.32	15%	0.15	S	C	.	.			trans	77.2	26.5	177.8	0	0	0	0	0	113.8	M1054	M1054-G1056 VanDerWaalsContact C-N 3.28Å; M1054-G1056 PolarHBondContact O-N 3.34Å
1057	M	69.8	Low	72.6	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.159	C	C	.	.			trans	-77.7	135.5	173.5	-72.6	-175.1	-66.3	0	0	110.6	L861 M1052 T1055 Q1059 L1060	L861-M1057 HydrophobicContact CD2-CE 3.67Å; L861-M1057 HydrophobicContact CD2-SD 4.36Å; M1052-M1057 HydrophobicContact CB-CE 3.7Å; M1052-M1057 HydrophobicContact CE-CE 3.57Å; M1052-M1057 HydrophobicContact CE-SD 4.13Å; M1052-M1057 WeakPolarHBondContact O-CE 3.39Å; T1055-M1057 WeakPolarHBondContact OG1-CE 3.31Å; M1057-Q1059 PolarHBondContact O-N 2.69Å; M1057-L1060 HydrophobicContact CB-CB 4.25Å; M1057-L1060 HydrophobicContact CE-CB 4.3Å; M1057-L1060 HydrophobicContact CE-CD1 3.32Å; M1057-L1060 HydrophobicContact CE-CG 4.43Å; M1057-L1060 PolarHBondContact O-N 3.13Å; M1057-L1060 HydrophobicContact SD-CD1 4.4Å
1058	P	60.1	Low	72.5	Confident	92 Å²	92	30.7 Å²	30.7	60%	0.597	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-19.7	-169	-28.2	35.2	0	0	0	117.2
1059	Q	63.7	Low	72.4	Confident	32 Å²	32	30.7 Å²	30.7	15%	0.15	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	8.3	-174	-62	-167.7	-15.2	0	0	114.6	G984 H985 I986 N989 M1057	G984-Q1059 PolarHBondContact O-NE2 2.86Å; G984-Q1059 PolarHBondContact O-OE1 3.03Å; H985-Q1059 PolarHBondContact CE1-NE2 2.99Å; H985-Q1059 PolarHBondContact ND1-NE2 3.46Å; H985-Q1059 VanDerWaalsContact ND1-NE2 3.16Å; I986-Q1059 HydrophobicContact CG1-CB 4.23Å; I986-Q1059 VanDerWaalsContact N-OE1 3.13Å; N989-Q1059 PolarHBondContact ND2-O 3.03Å; M1057-Q1059 PolarHBondContact O-N 2.69Å
1060	L	66	Low	72.6	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	18%	0.179	C	C	.	.			trans	-125.6	81.7	178.3	-97.7	159.2	0	0	0	104.3	L861 I986 L987 F1049 L1053 M1057	L861-L1060 HydrophobicContact CD2-CD1 3.7Å; I986-L1060 HydrophobicContact CD1-CD1 3.52Å; I986-L1060 HydrophobicContact CD1-CG 3.87Å; L987-L1060 HydrophobicContact CD1-CD2 3.26Å; L987-L1060 HydrophobicContact CD1-CG 3.94Å; F1049-L1060 HydrophobicContact CD1-CD2 4.16Å; L1053-L1060 HydrophobicContact CD2-CB 4.06Å; L1053-L1060 HydrophobicContact CD2-CD2 3.38Å; L1053-L1060 HydrophobicContact CD2-CG 4.31Å; L1053-L1060 HydrophobicContact CG-CD2 4.16Å; M1057-L1060 HydrophobicContact CB-CB 4.25Å; M1057-L1060 HydrophobicContact CE-CB 4.3Å; M1057-L1060 HydrophobicContact CE-CD1 3.32Å; M1057-L1060 HydrophobicContact CE-CG 4.43Å; M1057-L1060 PolarHBondContact O-N 3.13Å; M1057-L1060 HydrophobicContact SD-CD1 4.4Å
1061	T	60.2	Low	72.9	Confident	73 Å²	73	39.3 Å²	39.3	45%	0.448	20%	0.203	S	C	.	.			trans	-127.2	-15.4	-163.7	63.2	0	0	0	0	114.2	D1065	T1061-D1065 PolarHBondContact N-OD2 3.04Å
1062	S	66.4	Low	73.3	Confident	22 Å²	22	39.4 Å²	39.4	15%	0.154	20%	0.204	C	C	.	.	S	Bend	trans	-142	156.7	-166.9	77.4	0	0	0	0	111.9	L1053 E1064 D1065	L1053-S1062 WeakPolarHBondContact CD1-O 3.4Å; L1053-S1062 VanDerWaalsContact CD2-O 3.29Å; L1053-S1062 WeakPolarHBondContact CD2-O 3.33Å; S1062-E1064 WeakPolarHBondContact CB-OE2 3.01Å; S1062-E1064 PolarHBondContact O-N 2.9Å; S1062-E1064 PolarHBondContact OG-OE2 3.34Å; S1062-D1065 PolarHBondContact N-OD2 2.79Å; S1062-D1065 WeakPolarHBondContact O-CB 3.35Å; S1062-D1065 PolarHBondContact O-N 3.47Å; S1062-D1065 PolarHBondContact OG-N 3.04Å; S1062-D1065 PolarHBondContact OG-OD1 3.48Å; S1062-D1065 PolarHBondContact OG-OD2 3.49Å
1063	K	68.3	Low	74	Confident	111 Å²	111	39.3 Å²	39.3	48%	0.483	20%	0.203	S	C	.	.	H	α-helix	trans	-66.4	-30	178.2	-174.5	177.5	177.2	179.6	0	110.7	D1065 I1066 E1067	K1063-D1065 PolarHBondContact O-N 3.39Å; K1063-I1066 PolarHBondContact O-N 3.15Å; K1063-I1066 VanDerWaalsContact O-N 3.16Å; K1063-E1067 PolarHBondContact O-N 3.35Å
1064	E	69.4	Low	74.9	Confident	130 Å²	130	38.8 Å²	38.8	61%	0.607	20%	0.201	S	C	*	.	H	α-helix	trans	-58.7	-32.5	174.9	-62.2	73.4	-164.9	0	0	111.6	S1062 I1066 E1067 Y1068	S1062-E1064 WeakPolarHBondContact CB-OE2 3.01Å; S1062-E1064 PolarHBondContact O-N 2.9Å; S1062-E1064 PolarHBondContact OG-OE2 3.34Å; E1064-I1066 VanDerWaalsContact C-N 3.35Å; E1064-I1066 PolarHBondContact O-N 2.9Å; E1064-E1067 WeakPolarHBondContact O-CB 3.43Å; E1064-E1067 PolarHBondContact O-N 3.15Å; E1064-Y1068 PolarHBondContact O-N 3.4Å
1065	D	70.4	Confident	76	Confident	9 Å²	9	40.7 Å²	40.7	5%	0.048	21%	0.213	C	C	.	.	H	α-helix	trans	-65.3	-34.2	176.7	-59.9	-45.9	0	0	0	112.2	L987 N989 L1053 T1061 S1062 K1063 Y1068	L987-D1065 HydrophobicContact CB-CB 4.36Å; L987-D1065 HydrophobicContact CD1-CB 4.06Å; N989-D1065 PolarHBondContact ND2-OD1 2.99Å; L1053-D1065 HydrophobicContact CD2-CB 3.92Å; T1061-D1065 PolarHBondContact N-OD2 3.04Å; S1062-D1065 PolarHBondContact N-OD2 2.79Å; S1062-D1065 WeakPolarHBondContact O-CB 3.35Å; S1062-D1065 PolarHBondContact O-N 3.47Å; S1062-D1065 PolarHBondContact OG-N 3.04Å; S1062-D1065 PolarHBondContact OG-OD1 3.48Å; S1062-D1065 PolarHBondContact OG-OD2 3.49Å; K1063-D1065 PolarHBondContact O-N 3.39Å; D1065-Y1068 WeakPolarHBondContact O-CB 3.49Å
1066	I	75.8	Confident	76.9	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-80.8	-29.3	175.9	-44.6	157.3	0	0	0	111	L582 I1046 L1053 K1063 E1064 Y1068 I1069 R1070	L582-I1066 HydrophobicContact CD1-CB 3.92Å; L582-I1066 HydrophobicContact CD1-CG2 3.59Å; L582-I1066 HydrophobicContact CD2-CD1 4.01Å; L582-I1066 HydrophobicContact CD2-CG2 4.48Å; I1046-I1066 HydrophobicContact CG2-CG2 4.27Å; L1053-I1066 HydrophobicContact CD1-CD1 3.14Å; L1053-I1066 HydrophobicContact CD1-CG1 3.42Å; L1053-I1066 VanDerWaalsContact CD1-CG1 3.42Å; L1053-I1066 HydrophobicContact CD2-CG1 4.05Å; L1053-I1066 HydrophobicContact CG-CD1 3.69Å; L1053-I1066 HydrophobicContact CG-CG1 3.58Å; K1063-I1066 PolarHBondContact O-N 3.15Å; K1063-I1066 VanDerWaalsContact O-N 3.16Å; E1064-I1066 VanDerWaalsContact C-N 3.35Å; E1064-I1066 PolarHBondContact O-N 2.9Å; I1066-Y1068 PolarHBondContact O-N 3.05Å; I1066-I1069 HydrophobicContact CG2-CD1 4.41Å; I1066-I1069 WeakPolarHBondContact O-CB 3.48Å; I1066-I1069 PolarHBondContact O-N 3.2Å; I1066-R1070 PolarHBondContact O-N 2.73Å
1067	E	81.3	Confident	78.1	Confident	44 Å²	44	49.5 Å²	49.5	21%	0.206	26%	0.262	C	S	.	.	H	α-helix	trans	-56.5	-33.9	176.3	-172.5	57.7	-132.7	0	0	111	K1063 E1064 I1069 R1070 E1071	K1063-E1067 PolarHBondContact O-N 3.35Å; E1064-E1067 WeakPolarHBondContact O-CB 3.43Å; E1064-E1067 PolarHBondContact O-N 3.15Å; E1067-I1069 VanDerWaalsContact C-N 3.3Å; E1067-I1069 PolarHBondContact O-N 2.78Å; E1067-R1070 VanDerWaalsContact CD-NE 3.29Å; E1067-R1070 WeakPolarHBondContact O-CA 3.29Å; E1067-R1070 WeakPolarHBondContact O-CB 3.41Å; E1067-R1070 PolarHBondContact O-N 2.75Å; E1067-R1070 IonicContact OE1-CZ 2.97Å; E1067-R1070 IonicContact OE1-NE 3.3Å; E1067-R1070 PolarHBondContact OE1-NE 3.38Å; E1067-R1070 IonicContact OE1-NH2 3.39Å; E1067-R1070 PolarHBondContact OE1-NH2 2.87Å; E1067-R1070 IonicContact OE2-CZ 2.7Å; E1067-R1070 IonicContact OE2-NE 2.67Å; E1067-R1070 PolarHBondContact OE2-NE 2.88Å; E1067-R1070 IonicContact OE2-NH2 3.65Å; E1067-R1070 PolarHBondContact OE2-NH2 2.75Å; E1067-E1071 PolarHBondContact O-N 2.87Å
1068	Y	85.1	Confident	79.2	Confident	43 Å²	43	52 Å²	52	17%	0.169	28%	0.28	C	S	.	.	H	α-helix	trans	-49.9	-47.3	170.6	-178.4	-87.1	0	0	0	113.1	Y958 G961 L987 E1064 D1065 I1066 R1070 E1071 A1072	Y958-Y1068 WeakPolarHBondContact O-CE1 3.44Å; Y958-Y1068 PolarHBondContact O-OH 2.81Å; Y958-Y1068 VanDerWaalsContact O-OH 3.05Å; G961-Y1068 WeakPolarHBondContact CA-OH 3.39Å; G961-Y1068 VanDerWaalsContact N-CE1 3.28Å; L987-Y1068 HydrophobicContact CD2-CD1 4.32Å; E1064-Y1068 PolarHBondContact O-N 3.4Å; D1065-Y1068 WeakPolarHBondContact O-CB 3.49Å; I1066-Y1068 PolarHBondContact O-N 3.05Å; Y1068-R1070 VanDerWaalsContact C-N 3.27Å; Y1068-R1070 PolarHBondContact O-N 3.48Å; Y1068-E1071 PolarHBondContact O-N 2.85Å; Y1068-A1072 HydrophobicContact CD1-CB 4.38Å; Y1068-A1072 HydrophobicContact CE1-CB 4.01Å; Y1068-A1072 VanDerWaalsContact O-CB 3.29Å; Y1068-A1072 WeakPolarHBondContact O-CB 3.42Å; Y1068-A1072 PolarHBondContact O-N 3.1Å
1069	I	86.5	Confident	80.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-38.3	-178.9	-59	178.2	0	0	0	110.2	L987 I1046 F1049 I1066 E1067 A1072 L1073	L987-I1069 HydrophobicContact CD2-CD1 3.76Å; L987-I1069 HydrophobicContact CD2-CG1 3.61Å; I1046-I1069 HydrophobicContact CG1-CG2 4.42Å; F1049-I1069 HydrophobicContact CB-CD1 3.66Å; F1049-I1069 HydrophobicContact CD1-CD1 4.19Å; F1049-I1069 HydrophobicContact CD2-CD1 3.21Å; F1049-I1069 HydrophobicContact CE2-CD1 3.89Å; F1049-I1069 HydrophobicContact CG-CD1 3.4Å; F1049-I1069 VanDerWaalsContact CG-CD1 3.4Å; I1066-I1069 HydrophobicContact CG2-CD1 4.41Å; I1066-I1069 WeakPolarHBondContact O-CB 3.48Å; I1066-I1069 PolarHBondContact O-N 3.2Å; E1067-I1069 VanDerWaalsContact C-N 3.3Å; E1067-I1069 PolarHBondContact O-N 2.78Å; I1069-A1072 PolarHBondContact O-N 2.79Å; I1069-L1073 HydrophobicContact CG2-CD1 3.72Å; I1069-L1073 HydrophobicContact CG2-CG 4.34Å; I1069-L1073 WeakPolarHBondContact O-CB 3.28Å; I1069-L1073 WeakPolarHBondContact O-CG 3.4Å; I1069-L1073 PolarHBondContact O-N 3.39Å
1070	R	88.2	Confident	82.3	Confident	67 Å²	67	55.9 Å²	55.9	25%	0.253	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-41.5	178.4	-166.3	173.9	70	152.6	-4.6	111.3	D580 I1066 E1067 Y1068 T1074 V1075	D580-R1070 IonicContact OD1-NH1 2.68Å; I1066-R1070 PolarHBondContact O-N 2.73Å; E1067-R1070 VanDerWaalsContact CD-NE 3.29Å; E1067-R1070 WeakPolarHBondContact O-CA 3.29Å; E1067-R1070 WeakPolarHBondContact O-CB 3.41Å; E1067-R1070 PolarHBondContact O-N 2.75Å; E1067-R1070 IonicContact OE1-CZ 2.97Å; E1067-R1070 IonicContact OE1-NE 3.3Å; E1067-R1070 PolarHBondContact OE1-NE 3.38Å; E1067-R1070 IonicContact OE1-NH2 3.39Å; E1067-R1070 PolarHBondContact OE1-NH2 2.87Å; E1067-R1070 IonicContact OE2-CZ 2.7Å; E1067-R1070 IonicContact OE2-NE 2.67Å; E1067-R1070 PolarHBondContact OE2-NE 2.88Å; E1067-R1070 IonicContact OE2-NH2 3.65Å; E1067-R1070 PolarHBondContact OE2-NH2 2.75Å; Y1068-R1070 VanDerWaalsContact C-N 3.27Å; Y1068-R1070 PolarHBondContact O-N 3.48Å; R1070-T1074 PolarHBondContact O-N 3.16Å; R1070-V1075 HydrophobicContact CB-CG2 4.42Å; R1070-V1075 HydrophobicContact CG-CB 3.56Å; R1070-V1075 HydrophobicContact CG-CG1 4.11Å; R1070-V1075 HydrophobicContact CG-CG2 3.69Å; R1070-V1075 WeakPolarHBondContact O-CG2 3.45Å; R1070-V1075 PolarHBondContact O-N 2.88Å; R1070-V1075 VanDerWaalsContact O-N 3.09Å
1071	E	89.3	Confident	83.7	Confident	132 Å²	132	59.7 Å²	59.7	62%	0.617	31%	0.311	S	S	*	.	H	α-helix	trans	-67.9	-47.3	174.7	-67.6	-175.6	175.6	0	0	111.9	E1067 Y1068 L1073 T1074	E1067-E1071 PolarHBondContact O-N 2.87Å; Y1068-E1071 PolarHBondContact O-N 2.85Å; E1071-L1073 VanDerWaalsContact C-N 3.34Å; E1071-L1073 PolarHBondContact O-N 3.42Å; E1071-T1074 WeakPolarHBondContact O-CA 3.48Å; E1071-T1074 PolarHBondContact O-N 3.06Å
1072	A	90	Very high	85.3	Confident	3 Å²	3	56.2 Å²	56.2	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-39.4	-179.5	0	0	0	0	0	112.1	Y958 Y1035 Y1068 I1069 T1074	Y958-A1072 HydrophobicContact CE1-CB 4.35Å; Y1035-A1072 VanDerWaalsContact CE2-O 3.25Å; Y1035-A1072 WeakPolarHBondContact CE2-O 3.38Å; Y1035-A1072 PolarHBondContact OH-O 3.03Å; Y1068-A1072 HydrophobicContact CD1-CB 4.38Å; Y1068-A1072 HydrophobicContact CE1-CB 4.01Å; Y1068-A1072 VanDerWaalsContact O-CB 3.29Å; Y1068-A1072 WeakPolarHBondContact O-CB 3.42Å; Y1068-A1072 PolarHBondContact O-N 3.1Å; I1069-A1072 PolarHBondContact O-N 2.79Å; A1072-T1074 PolarHBondContact O-N 3.08Å
1073	L	92.5	Very high	86.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	5.5	174.3	-68.1	173.8	0	0	0	113.5	V959 Y1035 L1038 R1039 T1042 L1045 I1069 E1071 V1075	V959-L1073 HydrophobicContact CG1-CD1 4.35Å; V959-L1073 HydrophobicContact CG1-CD2 3.94Å; V959-L1073 HydrophobicContact CG1-CG 4.08Å; V959-L1073 HydrophobicContact CG2-CD2 3.8Å; Y1035-L1073 HydrophobicContact CD2-CD2 4.47Å; Y1035-L1073 HydrophobicContact CE2-CD2 4.1Å; L1038-L1073 HydrophobicContact CB-CD2 4.17Å; R1039-L1073 WeakPolarHBondContact CD-O 3.44Å; R1039-L1073 HydrophobicContact CG-CB 4.21Å; R1039-L1073 HydrophobicContact CG-CD2 3.79Å; R1039-L1073 PolarHBondContact NE-O 3.01Å; T1042-L1073 HydrophobicContact CG2-CD1 4.28Å; L1045-L1073 HydrophobicContact CD1-CD1 3.96Å; I1069-L1073 HydrophobicContact CG2-CD1 3.72Å; I1069-L1073 HydrophobicContact CG2-CG 4.34Å; I1069-L1073 WeakPolarHBondContact O-CB 3.28Å; I1069-L1073 WeakPolarHBondContact O-CG 3.4Å; I1069-L1073 PolarHBondContact O-N 3.39Å; E1071-L1073 VanDerWaalsContact C-N 3.34Å; E1071-L1073 PolarHBondContact O-N 3.42Å; L1073-V1075 HydrophobicContact CB-CG2 4.16Å; L1073-V1075 PolarHBondContact O-N 3.02Å
1074	T	92.4	Very high	88	Confident	6 Å²	6	59.8 Å²	59.8	4%	0.037	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	46.4	177.7	55.5	0	0	0	0	113	Y1035 R1039 R1070 E1071 A1072 G1076 R1077 A1082 H1085	Y1035-T1074 WeakPolarHBondContact OH-CG2 3.28Å; Y1035-T1074 PolarHBondContact OH-OG1 3.34Å; R1039-T1074 PolarHBondContact NE-OG1 2.86Å; R1039-T1074 PolarHBondContact NH2-O 2.7Å; R1039-T1074 VanDerWaalsContact NH2-O 3.16Å; R1070-T1074 PolarHBondContact O-N 3.16Å; E1071-T1074 WeakPolarHBondContact O-CA 3.48Å; E1071-T1074 PolarHBondContact O-N 3.06Å; A1072-T1074 PolarHBondContact O-N 3.08Å; T1074-G1076 PolarHBondContact O-N 2.97Å; T1074-R1077 WeakPolarHBondContact O-CB 3.42Å; T1074-R1077 PolarHBondContact O-N 2.86Å; T1074-R1077 VanDerWaalsContact O-N 3.1Å; T1074-A1082 WeakPolarHBondContact OG1-CB 3.1Å; T1074-H1085 HydrophobicContact CG2-CB 4.27Å
1075	V	88.6	Confident	89.1	Confident	49 Å²	49	55.5 Å²	55.5	30%	0.297	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	135.2	-177.9	179.4	0	0	0	0	110.1	D580 T1042 R1070 L1073 R1077	D580-V1075 HydrophobicContact CB-CG1 4.32Å; T1042-V1075 HydrophobicContact CG2-CG2 3.53Å; R1070-V1075 HydrophobicContact CB-CG2 4.42Å; R1070-V1075 HydrophobicContact CG-CB 3.56Å; R1070-V1075 HydrophobicContact CG-CG1 4.11Å; R1070-V1075 HydrophobicContact CG-CG2 3.69Å; R1070-V1075 WeakPolarHBondContact O-CG2 3.45Å; R1070-V1075 PolarHBondContact O-N 2.88Å; R1070-V1075 VanDerWaalsContact O-N 3.09Å; L1073-V1075 HydrophobicContact CB-CG2 4.16Å; L1073-V1075 PolarHBondContact O-N 3.02Å; V1075-R1077 VanDerWaalsContact C-N 3.32Å
1076	G	85.9	Confident	90.3	Very high	84 Å²	84	55.1 Å²	55.1	87%	0.866	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-7.5	-175.4	0	0	0	0	0	115	T1074	T1074-G1076 PolarHBondContact O-N 2.97Å
1077	R	90.6	Very high	91.2	Very high	136 Å²	136	57.2 Å²	57.2	51%	0.513	29%	0.289	S	S	.	.	S	Bend	trans	-91.7	154.2	170.3	-58	-166.7	-175.2	176.7	1.1	111.9	R1039 T1074 V1075 E1081	R1039-R1077 PolarHBondContact NH2-O 2.79Å; T1074-R1077 WeakPolarHBondContact O-CB 3.42Å; T1074-R1077 PolarHBondContact O-N 2.86Å; T1074-R1077 VanDerWaalsContact O-N 3.1Å; V1075-R1077 VanDerWaalsContact C-N 3.32Å; R1077-E1081 HydrophobicContact CB-CB 4.16Å
1078	S	93.6	Very high	91.8	Very high	55 Å²	55	59.8 Å²	59.8	39%	0.385	30%	0.304	S	S	.	.			trans	-65	158.8	173.6	61.4	0	0	0	0	111.8	D1080 E1081 A1082	S1078-D1080 VanDerWaalsContact C-N 3.3Å; S1078-D1080 PolarHBondContact O-N 3.24Å; S1078-E1081 PolarHBondContact N-OE2 2.85Å; S1078-E1081 PolarHBondContact O-N 3.31Å; S1078-E1081 WeakPolarHBondContact OG-CB 3.45Å; S1078-E1081 WeakPolarHBondContact OG-CG 3.19Å; S1078-E1081 PolarHBondContact OG-N 2.83Å; S1078-E1081 PolarHBondContact OG-OE2 3Å; S1078-A1082 WeakPolarHBondContact O-CB 3.41Å; S1078-A1082 PolarHBondContact O-N 2.89Å
1079	E	93.6	Very high	92.2	Very high	95 Å²	95	59.1 Å²	59.1	44%	0.444	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-39.2	177.8	-64	-165.8	153.8	0	0	112.5	L1036 H1040 E1081 A1082 Q1083	L1036-E1079 HydrophobicContact CD2-CB 4.42Å; H1040-E1079 IonicContact CD2-OE1 2.79Å; H1040-E1079 IonicContact CE1-OE1 3.01Å; H1040-E1079 IonicContact NE2-OE1 3.21Å; H1040-E1079 PolarHBondContact NE2-OE1 2.77Å; E1079-E1081 VanDerWaalsContact C-N 3.31Å; E1079-E1081 PolarHBondContact O-N 2.94Å; E1079-A1082 WeakPolarHBondContact O-CB 3.46Å; E1079-A1082 PolarHBondContact O-N 3.36Å; E1079-Q1083 WeakPolarHBondContact O-CB 3.44Å; E1079-Q1083 PolarHBondContact O-N 2.88Å
1080	D	94.8	Very high	92.5	Very high	110 Å²	110	59.1 Å²	59.1	59%	0.588	30%	0.303	S	S	*	.	H	α-helix	trans	-61.9	-38.7	176.9	-67.6	-26.5	0	0	0	112.3	S1078 R1084	S1078-D1080 VanDerWaalsContact C-N 3.3Å; S1078-D1080 PolarHBondContact O-N 3.24Å; D1080-R1084 WeakPolarHBondContact O-CB 3.39Å; D1080-R1084 WeakPolarHBondContact O-CG 3.26Å; D1080-R1084 PolarHBondContact O-N 3.19Å; D1080-R1084 VanDerWaalsContact O-N 3.13Å; D1080-R1084 PolarHBondContact O-NE 3.38Å; D1080-R1084 VanDerWaalsContact O-NE 3.15Å
1081	E	94.8	Very high	92.7	Very high	81 Å²	81	58.6 Å²	58.6	38%	0.379	30%	0.303	S	S	.	.	H	α-helix	trans	-71	-38.7	175.6	-72.3	168.9	152	0	0	111.8	R1077 S1078 E1079 R1084 H1085	R1077-E1081 HydrophobicContact CB-CB 4.16Å; S1078-E1081 PolarHBondContact N-OE2 2.85Å; S1078-E1081 PolarHBondContact O-N 3.31Å; S1078-E1081 WeakPolarHBondContact OG-CB 3.45Å; S1078-E1081 WeakPolarHBondContact OG-CG 3.19Å; S1078-E1081 PolarHBondContact OG-N 2.83Å; S1078-E1081 PolarHBondContact OG-OE2 3Å; E1079-E1081 VanDerWaalsContact C-N 3.31Å; E1079-E1081 PolarHBondContact O-N 2.94Å; E1081-R1084 PolarHBondContact O-N 2.91Å; E1081-H1085 VanDerWaalsContact O-CB 3.3Å; E1081-H1085 WeakPolarHBondContact O-CB 3.11Å; E1081-H1085 PolarHBondContact O-N 2.77Å
1082	A	93.9	Very high	92.7	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-43.2	177.1	0	0	0	0	0	111.7	Y1035 L1036 T1074 S1078 E1079 H1085 L1086	Y1035-A1082 HydrophobicContact CE1-CB 4.05Å; Y1035-A1082 WeakPolarHBondContact CE1-O 3.15Å; L1036-A1082 HydrophobicContact CD2-CB 4.45Å; T1074-A1082 WeakPolarHBondContact OG1-CB 3.1Å; S1078-A1082 WeakPolarHBondContact O-CB 3.41Å; S1078-A1082 PolarHBondContact O-N 2.89Å; E1079-A1082 WeakPolarHBondContact O-CB 3.46Å; E1079-A1082 PolarHBondContact O-N 3.36Å; A1082-H1085 PolarHBondContact O-N 3.06Å; A1082-L1086 PolarHBondContact O-N 3.28Å
1083	Q	95.7	Very high	92.7	Very high	74 Å²	74	54.9 Å²	54.9	35%	0.346	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-49.6	174.1	172.4	175.7	-14.5	0	0	111.2	V1032 E1079 H1085 L1086 L1087	V1032-Q1083 HydrophobicContact CG1-CB 4.3Å; V1032-Q1083 HydrophobicContact CG1-CG 3.7Å; V1032-Q1083 HydrophobicContact CG2-CG 4.12Å; E1079-Q1083 WeakPolarHBondContact O-CB 3.44Å; E1079-Q1083 PolarHBondContact O-N 2.88Å; Q1083-H1085 VanDerWaalsContact C-N 3.31Å; Q1083-H1085 PolarHBondContact O-N 3.19Å; Q1083-L1086 PolarHBondContact O-N 2.91Å; Q1083-L1087 HydrophobicContact CG-CD1 4.11Å; Q1083-L1087 WeakPolarHBondContact O-CG 3.39Å; Q1083-L1087 PolarHBondContact O-N 2.9Å
1084	R	95.1	Very high	92.4	Very high	134 Å²	134	56.8 Å²	56.8	51%	0.506	29%	0.294	S	S	.	.	H	α-helix	trans	-58.2	-45.3	177.1	-80.9	-179.1	-83.5	117.4	-7.6	111.6	D1080 E1081 L1086 L1087 D1088	D1080-R1084 WeakPolarHBondContact O-CB 3.39Å; D1080-R1084 WeakPolarHBondContact O-CG 3.26Å; D1080-R1084 PolarHBondContact O-N 3.19Å; D1080-R1084 VanDerWaalsContact O-N 3.13Å; D1080-R1084 PolarHBondContact O-NE 3.38Å; D1080-R1084 VanDerWaalsContact O-NE 3.15Å; E1081-R1084 PolarHBondContact O-N 2.91Å; R1084-L1086 PolarHBondContact O-N 2.85Å; R1084-L1087 PolarHBondContact O-N 2.85Å; R1084-D1088 VanDerWaalsContact O-CG 3.25Å; R1084-D1088 PolarHBondContact O-N 2.79Å
1085	H	93.8	Very high	92.1	Very high	39 Å²	39	61.5 Å²	61.5	18%	0.181	32%	0.315	C	S	.	.	H	α-helix	trans	-57.5	-44.7	177.6	175.6	84.8	0	0	0	112.6	Y958 T1074 E1081 A1082 Q1083 D1088 Q1089	Y958-H1085 PolarHBondContact OH-NE2 3.31Å; T1074-H1085 HydrophobicContact CG2-CB 4.27Å; E1081-H1085 VanDerWaalsContact O-CB 3.3Å; E1081-H1085 WeakPolarHBondContact O-CB 3.11Å; E1081-H1085 PolarHBondContact O-N 2.77Å; A1082-H1085 PolarHBondContact O-N 3.06Å; Q1083-H1085 VanDerWaalsContact C-N 3.31Å; Q1083-H1085 PolarHBondContact O-N 3.19Å; H1085-D1088 WeakPolarHBondContact O-CB 3.46Å; H1085-D1088 PolarHBondContact O-N 2.6Å; H1085-Q1089 PolarHBondContact CE1-NE2 3.25Å; H1085-Q1089 WeakPolarHBondContact O-CG 3.35Å; H1085-Q1089 PolarHBondContact O-N 2.95Å
1086	L	94.9	Very high	91.9	Very high	2 Å²	2	63.3 Å²	63.3	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-65.3	-42.5	177.1	-175.2	74.3	0	0	0	112.2	Y958 C1031 V1032 Y1035 A1082 Q1083 R1084 D1088 Q1089 I1090	Y958-L1086 HydrophobicContact CD1-CD1 4.19Å; Y958-L1086 HydrophobicContact CE1-CD1 4.34Å; C1031-L1086 HydrophobicContact CB-CD2 4.28Å; C1031-L1086 WeakPolarHBondContact O-CD2 3.37Å; V1032-L1086 HydrophobicContact CG2-CD2 4.14Å; Y1035-L1086 VanDerWaalsContact CB-CD2 3.45Å; Y1035-L1086 HydrophobicContact CD1-CB 4Å; Y1035-L1086 HydrophobicContact CD1-CD1 4.46Å; Y1035-L1086 HydrophobicContact CD1-CD2 3.89Å; Y1035-L1086 HydrophobicContact CD1-CG 4.34Å; Y1035-L1086 HydrophobicContact CD2-CD1 4.2Å; Y1035-L1086 HydrophobicContact CE1-CB 4.17Å; Y1035-L1086 HydrophobicContact CG-CB 4.48Å; Y1035-L1086 HydrophobicContact CG-CD1 4.13Å; Y1035-L1086 HydrophobicContact CG-CD2 3.76Å; Y1035-L1086 HydrophobicContact CG-CG 4.34Å; A1082-L1086 PolarHBondContact O-N 3.28Å; Q1083-L1086 PolarHBondContact O-N 2.91Å; R1084-L1086 PolarHBondContact O-N 2.85Å; L1086-D1088 VanDerWaalsContact C-N 3.27Å; L1086-D1088 PolarHBondContact O-N 2.54Å; L1086-Q1089 WeakPolarHBondContact O-CB 3.28Å; L1086-Q1089 PolarHBondContact O-N 2.71Å; L1086-Q1089 VanDerWaalsContact O-N 3.09Å; L1086-I1090 HydrophobicContact CG-CD1 4.46Å; L1086-I1090 PolarHBondContact O-N 2.73Å
1087	L	95	Very high	91.6	Very high	48 Å²	48	59.4 Å²	59.4	25%	0.251	28%	0.278	S	S	.	.	H	α-helix	trans	-61.5	-38.4	176.6	-70.4	171.9	0	0	0	111.5	Q1028 V1032 Q1083 R1084 Q1089 I1090 E1091	Q1028-L1087 HydrophobicContact CB-CD2 4.14Å; Q1028-L1087 HydrophobicContact CG-CD2 4.45Å; V1032-L1087 HydrophobicContact CG2-CD2 3.88Å; V1032-L1087 HydrophobicContact CG2-CG 4.05Å; Q1083-L1087 HydrophobicContact CG-CD1 4.11Å; Q1083-L1087 WeakPolarHBondContact O-CG 3.39Å; Q1083-L1087 PolarHBondContact O-N 2.9Å; R1084-L1087 PolarHBondContact O-N 2.85Å; L1087-Q1089 VanDerWaalsContact C-N 3.34Å; L1087-I1090 HydrophobicContact CD2-CD1 4.32Å; L1087-I1090 PolarHBondContact O-N 2.9Å; L1087-E1091 PolarHBondContact O-N 3.1Å
1088	D	94.1	Very high	91	Very high	97 Å²	97	59.7 Å²	59.7	52%	0.519	28%	0.28	S	S	.	.	H	α-helix	trans	-62.5	-40.9	172.9	-66.5	-22.7	0	0	0	111.2	R1084 H1085 L1086 I1090 E1091 I1092	R1084-D1088 VanDerWaalsContact O-CG 3.25Å; R1084-D1088 PolarHBondContact O-N 2.79Å; H1085-D1088 WeakPolarHBondContact O-CB 3.46Å; H1085-D1088 PolarHBondContact O-N 2.6Å; L1086-D1088 VanDerWaalsContact C-N 3.27Å; L1086-D1088 PolarHBondContact O-N 2.54Å; D1088-I1090 VanDerWaalsContact C-N 3.35Å; D1088-I1090 PolarHBondContact O-N 2.75Å; D1088-E1091 PolarHBondContact O-N 3.2Å; D1088-I1092 VanDerWaalsContact O-CG1 3.28Å; D1088-I1092 WeakPolarHBondContact O-CG1 3.25Å; D1088-I1092 PolarHBondContact O-N 2.89Å
1089	Q	93.7	Very high	90.4	Very high	30 Å²	30	59.5 Å²	59.5	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-40	174.6	-60	-41.3	-65.8	0	0	112.3	Y958 P1002 F1003 H1085 L1086 L1087 I1092 C1093	Y958-Q1089 HydrophobicContact CE2-CG 4.13Å; P1002-Q1089 HydrophobicContact CB-CB 4.19Å; P1002-Q1089 HydrophobicContact CB-CG 4.44Å; P1002-Q1089 HydrophobicContact CG-CB 4.05Å; P1002-Q1089 HydrophobicContact CG-CG 4.33Å; F1003-Q1089 HydrophobicContact CE1-CB 4.09Å; H1085-Q1089 PolarHBondContact CE1-NE2 3.25Å; H1085-Q1089 WeakPolarHBondContact O-CG 3.35Å; H1085-Q1089 PolarHBondContact O-N 2.95Å; L1086-Q1089 WeakPolarHBondContact O-CB 3.28Å; L1086-Q1089 PolarHBondContact O-N 2.71Å; L1086-Q1089 VanDerWaalsContact O-N 3.09Å; L1087-Q1089 VanDerWaalsContact C-N 3.34Å; Q1089-I1092 PolarHBondContact O-N 2.9Å; Q1089-C1093 PolarHBondContact O-N 2.78Å; Q1089-C1093 VanDerWaalsContact O-N 3.09Å; Q1089-C1093 PolarHBondContact O-SG 3.49Å
1090	I	92.6	Very high	89.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-45.3	176.1	-68.7	164.7	0	0	0	110.5	F1003 L1005 F1024 F1027 Q1028 C1031 L1086 L1087 D1088 C1093 R1094	F1003-I1090 HydrophobicContact CZ-CB 4.44Å; F1003-I1090 HydrophobicContact CZ-CG1 3.7Å; L1005-I1090 HydrophobicContact CD2-CG2 4.12Å; F1024-I1090 HydrophobicContact CE2-CG2 4.44Å; F1024-I1090 HydrophobicContact CZ-CG2 4.01Å; F1027-I1090 HydrophobicContact CE1-CG2 4.39Å; Q1028-I1090 HydrophobicContact CG-CD1 4.47Å; Q1028-I1090 HydrophobicContact CG-CG2 4.47Å; C1031-I1090 HydrophobicContact CB-CD1 3.98Å; L1086-I1090 HydrophobicContact CG-CD1 4.46Å; L1086-I1090 PolarHBondContact O-N 2.73Å; L1087-I1090 HydrophobicContact CD2-CD1 4.32Å; L1087-I1090 PolarHBondContact O-N 2.9Å; D1088-I1090 VanDerWaalsContact C-N 3.35Å; D1088-I1090 PolarHBondContact O-N 2.75Å; I1090-C1093 WeakPolarHBondContact O-CB 3.4Å; I1090-C1093 PolarHBondContact O-N 2.85Å; I1090-R1094 PolarHBondContact O-N 3Å
1091	E	90.9	Very high	88.9	Confident	56 Å²	56	50.8 Å²	50.8	26%	0.262	23%	0.229	S	C	.	.	H	α-helix	trans	-68	-37.2	-179.8	-167.1	62.2	-155.1	0	0	111.4	L1087 D1088 C1093 R1094 E1095	L1087-E1091 PolarHBondContact O-N 3.1Å; D1088-E1091 PolarHBondContact O-N 3.2Å; E1091-C1093 VanDerWaalsContact C-N 3.3Å; E1091-C1093 PolarHBondContact O-N 3.03Å; E1091-R1094 WeakPolarHBondContact O-CB 3.46Å; E1091-R1094 PolarHBondContact O-N 2.93Å; E1091-R1094 VanDerWaalsContact O-N 3.16Å; E1091-R1094 IonicContact OE1-NH1 3.96Å; E1091-R1094 WeakPolarHBondContact OE2-CD 3.28Å; E1091-R1094 IonicContact OE2-NH1 3.5Å; E1091-R1094 PolarHBondContact OE2-NH1 2.87Å; E1091-E1095 WeakPolarHBondContact O-CG 3.31Å; E1091-E1095 PolarHBondContact O-N 2.8Å
1092	I	90.1	Very high	88.1	Confident	56 Å²	56	50.3 Å²	50.3	29%	0.287	23%	0.229	S	C	.	.	H	α-helix	trans	-56.5	-45	171.2	-69.9	165.2	0	0	0	111	P1002 D1088 Q1089 R1094 E1095 K1096	P1002-I1092 HydrophobicContact CG-CG2 4.33Å; D1088-I1092 VanDerWaalsContact O-CG1 3.28Å; D1088-I1092 WeakPolarHBondContact O-CG1 3.25Å; D1088-I1092 PolarHBondContact O-N 2.89Å; Q1089-I1092 PolarHBondContact O-N 2.9Å; I1092-R1094 VanDerWaalsContact C-N 3.33Å; I1092-R1094 PolarHBondContact O-N 2.89Å; I1092-E1095 PolarHBondContact O-N 2.93Å; I1092-K1096 HydrophobicContact CG2-CD 4.11Å; I1092-K1096 WeakPolarHBondContact O-CB 3.33Å; I1092-K1096 PolarHBondContact O-N 2.92Å
1093	C	89.2	Confident	87.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-41.6	178.3	-62	0	0	0	0	111.3	F1003 L1005 Q1089 I1090 E1091 K1096 G1097	F1003-C1093 HydrophobicContact CE2-CB 4.45Å; F1003-C1093 PolarHBondContact O-SG 2.86Å; L1005-C1093 HydrophobicContact CB-CB 3.9Å; L1005-C1093 HydrophobicContact CD2-CB 4.44Å; Q1089-C1093 PolarHBondContact O-N 2.78Å; Q1089-C1093 VanDerWaalsContact O-N 3.09Å; Q1089-C1093 PolarHBondContact O-SG 3.49Å; I1090-C1093 WeakPolarHBondContact O-CB 3.4Å; I1090-C1093 PolarHBondContact O-N 2.85Å; E1091-C1093 VanDerWaalsContact C-N 3.3Å; E1091-C1093 PolarHBondContact O-N 3.03Å; C1093-K1096 CarbonylContact O-C 3.3Å; C1093-K1096 PolarHBondContact O-N 2.84Å; C1093-G1097 VanDerWaalsContact O-CA 3.26Å; C1093-G1097 WeakPolarHBondContact O-CA 3.24Å; C1093-G1097 PolarHBondContact O-N 2.88Å
1094	R	87.4	Confident	86.4	Confident	41 Å²	41	48.9 Å²	48.9	16%	0.155	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-42.2	177.6	-174.1	-176.3	-177.9	-164.8	10.5	112.8	L1010 G1017 K1018 K1019 I1090 E1091 I1092	L1010-R1094 HydrophobicContact CD1-CG 3.9Å; G1017-R1094 PolarHBondContact O-NH2 2.82Å; K1018-R1094 PolarHBondContact O-NH2 3.12Å; K1019-R1094 PolarHBondContact O-NH2 3.46Å; K1019-R1094 VanDerWaalsContact O-NH2 3.1Å; I1090-R1094 PolarHBondContact O-N 3Å; E1091-R1094 WeakPolarHBondContact O-CB 3.46Å; E1091-R1094 PolarHBondContact O-N 2.93Å; E1091-R1094 VanDerWaalsContact O-N 3.16Å; E1091-R1094 IonicContact OE1-NH1 3.96Å; E1091-R1094 WeakPolarHBondContact OE2-CD 3.28Å; E1091-R1094 IonicContact OE2-NH1 3.5Å; E1091-R1094 PolarHBondContact OE2-NH1 2.87Å; I1092-R1094 VanDerWaalsContact C-N 3.33Å; I1092-R1094 PolarHBondContact O-N 2.89Å
1095	E	85.9	Confident	85.4	Confident	104 Å²	104	45.2 Å²	45.2	49%	0.486	21%	0.212	S	C	.	.	H	α-helix	trans	-70.4	-34.4	179.1	-68.4	-161.5	140.9	0	0	112.9	K1018 E1091 I1092 W1098	K1018-E1095 IonicContact NZ-OE1 2.89Å; K1018-E1095 PolarHBondContact NZ-OE1 3.14Å; E1091-E1095 WeakPolarHBondContact O-CG 3.31Å; E1091-E1095 PolarHBondContact O-N 2.8Å; I1092-E1095 PolarHBondContact O-N 2.93Å; E1095-W1098 PolarHBondContact O-NE1 3.48Å
1096	K	84.4	Confident	84.4	Confident	88 Å²	88	45.7 Å²	45.7	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-101.2	3.9	-177.4	-63.5	-177	-177	177.3	0	114.3	W1000 V1001 I1092 C1093 W1098 M1099	W1000-K1096 WeakPolarHBondContact O-CD 3.39Å; V1001-K1096 HydrophobicContact CG1-CB 3.63Å; V1001-K1096 HydrophobicContact CG1-CD 4.46Å; I1092-K1096 HydrophobicContact CG2-CD 4.11Å; I1092-K1096 WeakPolarHBondContact O-CB 3.33Å; I1092-K1096 PolarHBondContact O-N 2.92Å; C1093-K1096 CarbonylContact O-C 3.3Å; C1093-K1096 PolarHBondContact O-N 2.84Å; K1096-W1098 PolarHBondContact O-N 2.9Å; K1096-W1098 VanDerWaalsContact O-N 3.13Å; K1096-M1099 HydrophobicContact CB-SD 4.21Å; K1096-M1099 HydrophobicContact CD-SD 4.45Å; K1096-M1099 HydrophobicContact CG-SD 4.23Å; K1096-M1099 VanDerWaalsContact O-CB 3.28Å; K1096-M1099 WeakPolarHBondContact O-CB 3.35Å; K1096-M1099 PolarHBondContact O-N 2.93Å
1097	G	78.6	Confident	83.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-57.4	-32.3	-173.4	0	0	0	0	0	114.3	C1093 M1099 V1100 Q1101	C1093-G1097 VanDerWaalsContact O-CA 3.26Å; C1093-G1097 WeakPolarHBondContact O-CA 3.24Å; C1093-G1097 PolarHBondContact O-N 2.88Å; G1097-M1099 VanDerWaalsContact C-N 3.29Å; G1097-M1099 PolarHBondContact O-N 2.8Å; G1097-V1100 WeakPolarHBondContact O-CB 3.35Å; G1097-V1100 PolarHBondContact O-N 3.22Å; G1097-V1100 VanDerWaalsContact O-N 3.16Å; G1097-Q1101 PolarHBondContact O-N 2.9Å
1098	W	78.9	Confident	82	Confident	143 Å²	143	45.8 Å²	45.8	54%	0.542	22%	0.216	S	C	.	.	H	α-helix	trans	-64.9	-29.4	174.9	69.3	-87.5	0	0	0	113.1	E1095 K1096 V1100 Q1101 I1102	E1095-W1098 PolarHBondContact O-NE1 3.48Å; K1096-W1098 PolarHBondContact O-N 2.9Å; K1096-W1098 VanDerWaalsContact O-N 3.13Å; W1098-V1100 VanDerWaalsContact C-N 3.27Å; W1098-V1100 PolarHBondContact O-N 3.01Å; W1098-Q1101 PolarHBondContact O-N 3.2Å; W1098-I1102 HydrophobicContact CE3-CD1 3.46Å; W1098-I1102 VanDerWaalsContact CE3-CD1 3.46Å; W1098-I1102 HydrophobicContact CE3-CG1 4.31Å; W1098-I1102 HydrophobicContact CZ3-CD1 3.3Å; W1098-I1102 WeakPolarHBondContact O-CG1 3.38Å; W1098-I1102 PolarHBondContact O-N 2.96Å
1099	M	80.7	Confident	80.5	Confident	51 Å²	51	44.5 Å²	44.5	25%	0.251	21%	0.212	S	C	.	.	H	α-helix	trans	-67.2	-33	175.5	-57.8	-178.4	76.6	0	0	110.9	W1000 K1096 G1097 I1102 N1103	W1000-M1099 HydrophobicContact CD2-CE 4.01Å; W1000-M1099 HydrophobicContact CE3-CE 3.77Å; W1000-M1099 HydrophobicContact CG-CE 4.43Å; W1000-M1099 HydrophobicContact CZ3-CE 4.21Å; K1096-M1099 HydrophobicContact CB-SD 4.21Å; K1096-M1099 HydrophobicContact CD-SD 4.45Å; K1096-M1099 HydrophobicContact CG-SD 4.23Å; K1096-M1099 VanDerWaalsContact O-CB 3.28Å; K1096-M1099 WeakPolarHBondContact O-CB 3.35Å; K1096-M1099 PolarHBondContact O-N 2.93Å; G1097-M1099 VanDerWaalsContact C-N 3.29Å; G1097-M1099 PolarHBondContact O-N 2.8Å; M1099-I1102 PolarHBondContact O-N 2.99Å; M1099-N1103 PolarHBondContact O-N 2.84Å; M1099-N1103 VanDerWaalsContact O-N 3.13Å
1100	V	78.1	Confident	78.8	Confident	10 Å²	10	48.1 Å²	48.1	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-69.1	-42.6	174.6	-177	0	0	0	0	110.5	V1001 T1006 G1097 W1098 I1102 N1103 W1104	V1001-V1100 HydrophobicContact CB-CG2 4.41Å; V1001-V1100 HydrophobicContact CG1-CG2 3.97Å; V1001-V1100 HydrophobicContact CG2-CG2 3.51Å; T1006-V1100 HydrophobicContact CG2-CB 3.87Å; T1006-V1100 HydrophobicContact CG2-CG1 3.6Å; G1097-V1100 WeakPolarHBondContact O-CB 3.35Å; G1097-V1100 PolarHBondContact O-N 3.22Å; G1097-V1100 VanDerWaalsContact O-N 3.16Å; W1098-V1100 VanDerWaalsContact C-N 3.27Å; W1098-V1100 PolarHBondContact O-N 3.01Å; V1100-I1102 VanDerWaalsContact C-N 3.31Å; V1100-I1102 PolarHBondContact O-N 2.88Å; V1100-N1103 WeakPolarHBondContact O-CA 2.9Å; V1100-N1103 WeakPolarHBondContact O-CB 3.43Å; V1100-N1103 PolarHBondContact O-N 3.21Å; V1100-N1103 VanDerWaalsContact O-N 3.08Å; V1100-W1104 HydrophobicContact CG1-CD2 4.45Å; V1100-W1104 HydrophobicContact CG1-CZ2 4.28Å; V1100-W1104 VanDerWaalsContact O-CD1 3.29Å; V1100-W1104 PolarHBondContact O-N 2.92Å
1101	Q	79.7	Confident	76.9	Confident	11 Å²	11	51 Å²	51	5%	0.051	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-37.3	173.4	-75	178.4	-35.9	0	0	112.6	A919 F920 D922 G1097 W1098 N1103 W1104 F1105	A919-Q1101 WeakPolarHBondContact O-CG 3.13Å; A919-Q1101 PolarHBondContact O-NE2 3.1Å; F920-Q1101 HydrophobicContact CD1-CB 4.14Å; F920-Q1101 HydrophobicContact CE1-CB 4.26Å; D922-Q1101 PolarHBondContact OD1-NE2 3.23Å; G1097-Q1101 PolarHBondContact O-N 2.9Å; W1098-Q1101 PolarHBondContact O-N 3.2Å; Q1101-N1103 VanDerWaalsContact C-N 3.34Å; Q1101-W1104 WeakPolarHBondContact O-CB 3.26Å; Q1101-W1104 PolarHBondContact O-N 2.84Å; Q1101-F1105 WeakPolarHBondContact O-CB 3.27Å; Q1101-F1105 PolarHBondContact O-N 2.72Å
1102	I	78.2	Confident	74.6	Confident	72 Å²	72	51 Å²	51	37%	0.369	26%	0.263	S	S	.	.	H	α-helix	trans	-61.6	-44.8	172.2	-70.1	176.1	0	0	0	110.7	F920 W1098 M1099 V1100 W1104 F1105 V1106	F920-I1102 HydrophobicContact CE1-CB 4.5Å; F920-I1102 HydrophobicContact CE1-CG1 3.75Å; F920-I1102 HydrophobicContact CZ-CG1 4.11Å; W1098-I1102 HydrophobicContact CE3-CD1 3.46Å; W1098-I1102 VanDerWaalsContact CE3-CD1 3.46Å; W1098-I1102 HydrophobicContact CE3-CG1 4.31Å; W1098-I1102 HydrophobicContact CZ3-CD1 3.3Å; W1098-I1102 WeakPolarHBondContact O-CG1 3.38Å; W1098-I1102 PolarHBondContact O-N 2.96Å; M1099-I1102 PolarHBondContact O-N 2.99Å; V1100-I1102 VanDerWaalsContact C-N 3.31Å; V1100-I1102 PolarHBondContact O-N 2.88Å; I1102-W1104 VanDerWaalsContact C-N 3.33Å; I1102-W1104 PolarHBondContact O-N 2.87Å; I1102-F1105 PolarHBondContact O-N 3.19Å; I1102-V1106 HydrophobicContact CG2-CG2 4.4Å; I1102-V1106 WeakPolarHBondContact O-CB 3.46Å; I1102-V1106 VanDerWaalsContact O-CG2 3.28Å; I1102-V1106 WeakPolarHBondContact O-CG2 3.34Å; I1102-V1106 PolarHBondContact O-N 3.21Å
1103	N	74.9	Confident	72.2	Confident	44 Å²	44	56.3 Å²	56.3	24%	0.235	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-45	176.6	-165.9	15.2	0	0	0	110.7	M1099 V1100 Q1101 F1105 V1106 H1107	M1099-N1103 PolarHBondContact O-N 2.84Å; M1099-N1103 VanDerWaalsContact O-N 3.13Å; V1100-N1103 WeakPolarHBondContact O-CA 2.9Å; V1100-N1103 WeakPolarHBondContact O-CB 3.43Å; V1100-N1103 PolarHBondContact O-N 3.21Å; V1100-N1103 VanDerWaalsContact O-N 3.08Å; Q1101-N1103 VanDerWaalsContact C-N 3.34Å; N1103-F1105 PolarHBondContact O-N 3.02Å; N1103-V1106 WeakPolarHBondContact O-CB 3.38Å; N1103-V1106 PolarHBondContact O-N 2.95Å; N1103-H1107 VanDerWaalsContact OD1-CD2 3.27Å; N1103-H1107 PolarHBondContact OD1-CD2 2.66Å; N1103-H1107 PolarHBondContact O-N 2.71Å; N1103-H1107 VanDerWaalsContact O-CD2 3.23Å; N1103-H1107 PolarHBondContact O-CD2 2.83Å
1104	W	77.8	Confident	69.6	Low	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-45	175.2	-69.7	6.5	0	0	0	112.5	I906 A919 N967 I970 V1004 T1006 F1009 V1100 Q1101 I1102 V1106 H1107 L1108	I906-W1104 HydrophobicContact CG2-CH2 4.39Å; I906-W1104 HydrophobicContact CG2-CZ3 4.03Å; A919-W1104 HydrophobicContact CB-CB 4.28Å; N967-W1104 HydrophobicContact CB-CD2 3.66Å; N967-W1104 HydrophobicContact CB-CE3 3.7Å; N967-W1104 HydrophobicContact CB-CG 4.07Å; N967-W1104 HydrophobicContact CB-CH2 4.37Å; N967-W1104 HydrophobicContact CB-CZ2 4.34Å; N967-W1104 HydrophobicContact CB-CZ3 4.08Å; I970-W1104 HydrophobicContact CD1-CZ2 4.19Å; V1004-W1104 HydrophobicContact CG1-CH2 4.18Å; V1004-W1104 HydrophobicContact CG1-CZ2 3.59Å; T1006-W1104 HydrophobicContact CG2-CE3 4.43Å; T1006-W1104 HydrophobicContact CG2-CH2 3.65Å; T1006-W1104 HydrophobicContact CG2-CZ2 3.81Å; T1006-W1104 HydrophobicContact CG2-CZ3 3.97Å; T1006-W1104 WeakPolarHBondContact OG1-CH2 3.48Å; F1009-W1104 HydrophobicContact CE1-CH2 4.08Å; F1009-W1104 AromaticContact CZ-CH2 3.86Å; F1009-W1104 HydrophobicContact CZ-CH2 3.86Å; V1100-W1104 HydrophobicContact CG1-CD2 4.45Å; V1100-W1104 HydrophobicContact CG1-CZ2 4.28Å; V1100-W1104 VanDerWaalsContact O-CD1 3.29Å; V1100-W1104 PolarHBondContact O-N 2.92Å; Q1101-W1104 WeakPolarHBondContact O-CB 3.26Å; Q1101-W1104 PolarHBondContact O-N 2.84Å; I1102-W1104 VanDerWaalsContact C-N 3.33Å; I1102-W1104 PolarHBondContact O-N 2.87Å; W1104-V1106 PolarHBondContact O-N 3.21Å; W1104-H1107 WeakPolarHBondContact O-CB 3.29Å; W1104-H1107 PolarHBondContact O-N 3.21Å; W1104-L1108 VanDerWaalsContact O-CG 3.26Å; W1104-L1108 WeakPolarHBondContact O-CG 3.37Å; W1104-L1108 PolarHBondContact O-N 2.93Å
1105	F	75.2	Confident	66.9	Low	57 Å²	57	61.1 Å²	61.1	25%	0.25	32%	0.322	C	S	.	.	H	α-helix	trans	-59.7	-45.3	174.2	174.3	-100.6	0	0	0	112.3	S916 T917 A919 F920 Q1101 I1102 N1103 H1107 L1108 V1109	S916-F1105 WeakPolarHBondContact O-CD2 3.33Å; T917-F1105 HydrophobicContact CG2-CE2 3.98Å; A919-F1105 HydrophobicContact CB-CB 4.28Å; F920-F1105 HydrophobicContact CD2-CB 4.45Å; F920-F1105 HydrophobicContact CD2-CD2 4.02Å; F920-F1105 HydrophobicContact CD2-CG 4.31Å; F920-F1105 HydrophobicContact CE1-CB 4.33Å; F920-F1105 HydrophobicContact CE2-CB 3.55Å; F920-F1105 AromaticContact CE2-CD1 3.84Å; F920-F1105 HydrophobicContact CE2-CD1 3.84Å; F920-F1105 AromaticContact CE2-CD2 3.35Å; F920-F1105 HydrophobicContact CE2-CD2 3.35Å; F920-F1105 HydrophobicContact CE2-CE1 4.34Å; F920-F1105 AromaticContact CE2-CE2 3.93Å; F920-F1105 HydrophobicContact CE2-CE2 3.93Å; F920-F1105 AromaticContact CE2-CG 3.29Å; F920-F1105 HydrophobicContact CE2-CG 3.29Å; F920-F1105 HydrophobicContact CE2-CZ 4.37Å; F920-F1105 HydrophobicContact CZ-CB 3.46Å; F920-F1105 VanDerWaalsContact CZ-CB 3.46Å; F920-F1105 AromaticContact CZ-CD1 3.99Å; F920-F1105 HydrophobicContact CZ-CD1 3.99Å; F920-F1105 HydrophobicContact CZ-CD2 4.16Å; F920-F1105 AromaticContact CZ-CG 3.62Å; F920-F1105 HydrophobicContact CZ-CG 3.62Å; Q1101-F1105 WeakPolarHBondContact O-CB 3.27Å; Q1101-F1105 PolarHBondContact O-N 2.72Å; I1102-F1105 PolarHBondContact O-N 3.19Å; N1103-F1105 PolarHBondContact O-N 3.02Å; F1105-H1107 VanDerWaalsContact C-N 3.28Å; F1105-H1107 PolarHBondContact O-N 3.31Å; F1105-L1108 PolarHBondContact O-N 2.85Å; F1105-V1109 PolarHBondContact O-N 2.77Å; F1105-V1109 WeakPolarHBondContact O-CG2 3.23Å; F1105-V1109 WeakPolarHBondContact O-CB 3.01Å; F1105-V1109 VanDerWaalsContact CZ-CG2 3.45Å; F1105-V1109 HydrophobicContact CZ-CG2 3.45Å; F1105-V1109 VanDerWaalsContact CE2-CG2 3.4Å; F1105-V1109 HydrophobicContact CE2-CG2 3.4Å; F1105-V1109 HydrophobicContact CE1-CG2 3.86Å; F1105-V1109 HydrophobicContact CD2-CG2 3.82Å; F1105-V1109 HydrophobicContact CD1-CG2 4.23Å; F1105-V1109 HydrophobicContact CG-CG2 4.23Å
1106	V	72.1	Confident	64.1	Low	48 Å²	48	61.4 Å²	61.4	29%	0.291	33%	0.331	S	S	.	.	H	α-helix	trans	-59.2	-41.4	176	164	0	0	0	0	110.8	I1102 N1103 W1104 L1110 I1112	I1102-V1106 HydrophobicContact CG2-CG2 4.4Å; I1102-V1106 WeakPolarHBondContact O-CB 3.46Å; I1102-V1106 VanDerWaalsContact O-CG2 3.28Å; I1102-V1106 WeakPolarHBondContact O-CG2 3.34Å; I1102-V1106 PolarHBondContact O-N 3.21Å; N1103-V1106 WeakPolarHBondContact O-CB 3.38Å; N1103-V1106 PolarHBondContact O-N 2.95Å; W1104-V1106 PolarHBondContact O-N 3.21Å; V1106-L1110 HydrophobicContact CG1-CD1 4.15Å; V1106-L1110 WeakPolarHBondContact O-CB 3.41Å; V1106-L1110 PolarHBondContact O-N 3.47Å; V1106-I1112 HydrophobicContact CG1-CD1 3.64Å
1107	H	69.1	Low	61.4	Low	34 Å²	34	64.6 Å²	64.6	16%	0.157	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-48.2	173.1	-87.3	-87.1	0	0	0	112.1	H966 N1103 W1104 F1105 G1111	H966-H1107 AromaticContact CD2-CE1 3.76Å; N1103-H1107 VanDerWaalsContact OD1-CD2 3.27Å; N1103-H1107 PolarHBondContact OD1-CD2 2.66Å; N1103-H1107 PolarHBondContact O-N 2.71Å; N1103-H1107 VanDerWaalsContact O-CD2 3.23Å; N1103-H1107 PolarHBondContact O-CD2 2.83Å; W1104-H1107 WeakPolarHBondContact O-CB 3.29Å; W1104-H1107 PolarHBondContact O-N 3.21Å; F1105-H1107 VanDerWaalsContact C-N 3.28Å; F1105-H1107 PolarHBondContact O-N 3.31Å; H1107-G1111 WeakPolarHBondContact O-CA 3.29Å; H1107-G1111 PolarHBondContact O-N 3.02Å; H1107-G1111 VanDerWaalsContact O-N 3.15Å
1108	L	69.5	Low	58.9	Low	18 Å²	18	73.4 Å²	73.4	9%	0.094	39%	0.385	C	S	.	.	H	α-helix	trans	-64.4	-39.6	179.7	-68.6	170.6	0	0	0	113.8	A907 Q911 A919 N967 W1104 F1105	A907-L1108 HydrophobicContact CB-CD2 3.76Å; Q911-L1108 HydrophobicContact CG-CD2 3.9Å; A919-L1108 HydrophobicContact CB-CD1 3.65Å; N967-L1108 WeakPolarHBondContact ND2-CD1 3.43Å; W1104-L1108 VanDerWaalsContact O-CG 3.26Å; W1104-L1108 WeakPolarHBondContact O-CG 3.37Å; W1104-L1108 PolarHBondContact O-N 2.93Å; F1105-L1108 PolarHBondContact O-N 2.85Å
1109	V	63.3	Low	56.4	Low	70 Å²	70	77.9 Å²	77.9	42%	0.424	40%	0.402	S	S	.	.	H	α-helix	trans	-83.4	-46.2	-173.9	170.2	0	0	0	0	112	S916 F1105	S916-V1109 VanDerWaalsContact CB-CG2 3.48Å; F1105-V1109 PolarHBondContact O-N 2.77Å; F1105-V1109 WeakPolarHBondContact O-CG2 3.23Å; F1105-V1109 WeakPolarHBondContact O-CB 3.01Å; F1105-V1109 VanDerWaalsContact CZ-CG2 3.45Å; F1105-V1109 HydrophobicContact CZ-CG2 3.45Å; F1105-V1109 VanDerWaalsContact CE2-CG2 3.4Å; F1105-V1109 HydrophobicContact CE2-CG2 3.4Å; F1105-V1109 HydrophobicContact CE1-CG2 3.86Å; F1105-V1109 HydrophobicContact CD2-CG2 3.82Å; F1105-V1109 HydrophobicContact CD1-CG2 4.23Å; F1105-V1109 HydrophobicContact CG-CG2 4.23Å
1110	L	58	Low	53.8	Low	106 Å²	106	80.7 Å²	80.7	56%	0.555	43%	0.427	S	S	*	.	H	α-helix	trans	-93.4	-7.6	-170.7	-64.1	172.7	0	0	0	112.4	V1106 I1112	V1106-L1110 HydrophobicContact CG1-CD1 4.15Å; V1106-L1110 WeakPolarHBondContact O-CB 3.41Å; V1106-L1110 PolarHBondContact O-N 3.47Å; L1110-I1112 PolarHBondContact O-N 2.94Å; L1110-I1112 WeakPolarHBondContact O-CA 3.49Å; L1110-I1112 VanDerWaalsContact O-CA 3.3Å; L1110-I1112 HydrophobicContact CG-CG1 4.26Å; L1110-I1112 HydrophobicContact CG-CD1 4.4Å; L1110-I1112 HydrophobicContact CD1-CD1 3.67Å; L1110-I1112 HydrophobicContact CB-CG1 3.2Å; L1110-I1112 HydrophobicContact CB-CD1 3.82Å; L1110-I1112 HydrophobicContact CB-CB 4.47Å; L1110-I1112 HydrophobicContact CD1-CG1 4.05Å
1111	G	52.7	Low	51.5	Low	61 Å²	61	89.7 Å²	89.7	63%	0.629	48%	0.482	S	S	*	.			trans	42.8	38.6	-177.2	0	0	0	0	0	111.6	H1107 K1113	H1107-G1111 WeakPolarHBondContact O-CA 3.29Å; H1107-G1111 PolarHBondContact O-N 3.02Å; H1107-G1111 VanDerWaalsContact O-N 3.15Å; G1111-K1113 PolarHBondContact O-N 2.9Å
1112	I	42.8	Very low	50.1	Low	55 Å²	55	93.6 Å²	93.6	28%	0.282	50%	0.503	S	S	.	.			trans	-60.6	105.4	-149	-53.6	-176.4	0	0	0	110.4	V1106 L1110 Q1114	V1106-I1112 HydrophobicContact CG1-CD1 3.64Å; L1110-I1112 PolarHBondContact O-N 2.94Å; L1110-I1112 WeakPolarHBondContact O-CA 3.49Å; L1110-I1112 VanDerWaalsContact O-CA 3.3Å; L1110-I1112 HydrophobicContact CG-CG1 4.26Å; L1110-I1112 HydrophobicContact CG-CD1 4.4Å; L1110-I1112 HydrophobicContact CD1-CD1 3.67Å; L1110-I1112 HydrophobicContact CB-CG1 3.2Å; L1110-I1112 HydrophobicContact CB-CD1 3.82Å; L1110-I1112 HydrophobicContact CB-CB 4.47Å; L1110-I1112 HydrophobicContact CD1-CG1 4.05Å; I1112-Q1114 HydrophobicContact CB-CG 4.41Å; I1112-Q1114 HydrophobicContact CG2-CB 4.18Å; I1112-Q1114 HydrophobicContact CG2-CG 3.58Å; I1112-Q1114 PolarHBondContact O-N 3.25Å
1113	K	39.3	Very low	48.6	Very low	168 Å²	168	94.7 Å²	94.7	73%	0.73	51%	0.51	S	S	*	.				29.8	20.5	101.4	-68.1	-176	177.3	175.4	0	118.6	G1111 G1115	G1111-K1113 PolarHBondContact O-N 2.9Å; K1113-G1115 PolarHBondContact O-N 3.36Å
1114	Q	35	Very low	47.2	Very low	89 Å²	89	97.6 Å²	97.6	42%	0.416	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	72.5	-178.3	-92.4	168.4	14.5	0	0	110.9	I1112	I1112-Q1114 HydrophobicContact CB-CG 4.41Å; I1112-Q1114 HydrophobicContact CG2-CB 4.18Å; I1112-Q1114 HydrophobicContact CG2-CG 3.58Å; I1112-Q1114 PolarHBondContact O-N 3.25Å
1115	G	31.4	Very low	45.4	Very low	53 Å²	53	103.3 Å²	103.3	55%	0.546	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-149.3	17.1	162.4	0	0	0	0	0	111.8	K1113 E1117	K1113-G1115 PolarHBondContact O-N 3.36Å; G1115-E1117 VanDerWaalsContact C-N 3.28Å; G1115-E1117 PolarHBondContact O-N 3.22Å; G1115-E1117 VanDerWaalsContact O-N 3.1Å
1116	V	26.8	Very low	43.5	Very low	111 Å²	111	106.2 Å²	106.2	67%	0.673	58%	0.576	S	S	*	*			trans	-82.6	82.1	173.1	-173	0	0	0	0	107	K1118	V1116-K1118 HydrophobicContact CG1-CG 3.94Å; V1116-K1118 PolarHBondContact O-N 3.13Å
1117	E	27.7	Very low	41.6	Very low	155 Å²	155	110.1 Å²	110.1	72%	0.724	60%	0.595	S	S	*	*			trans	-58.2	101.5	138	-84.3	-179.3	166	0	0	104.3	K498 G1115 R1119	K498-E1117 IonicContact NZ-OE1 3.36Å; G1115-E1117 VanDerWaalsContact C-N 3.28Å; G1115-E1117 PolarHBondContact O-N 3.22Å; G1115-E1117 VanDerWaalsContact O-N 3.1Å; E1117-R1119 VanDerWaalsContact C-N 3.28Å; E1117-R1119 PolarHBondContact O-N 3.1Å
1118	K	25	Very low	39.6	Very low	185 Å²	185	115.5 Å²	115.5	80%	0.804	63%	0.626	S	S	*	*			trans	-58.3	108.8	155.7	-89.8	-173.8	176.5	-179.9	0	103.4	V1116 S1120	V1116-K1118 HydrophobicContact CG1-CG 3.94Å; V1116-K1118 PolarHBondContact O-N 3.13Å; K1118-S1120 PolarHBondContact O-N 2.94Å
1119	R	27.6	Very low	37.3	Very low	237 Å²	237	123 Å²	123	89%	0.894	67%	0.667	S	S	*	*			trans	-53.2	97.8	154.5	-79.1	-178.6	174.4	175.8	-3.2	105	E1117 T1121	E1117-R1119 VanDerWaalsContact C-N 3.28Å; E1117-R1119 PolarHBondContact O-N 3.1Å; R1119-T1121 PolarHBondContact O-N 3.13Å
1120	S	25.5	Very low	35.2	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	69%	0.687	S	S	*	*			trans	-60.1	117	152.7	-180	0	0	0	0	104	K1118	K1118-S1120 PolarHBondContact O-N 2.94Å
1121	T	30.2	Very low	33.1	Very low	199 Å²	199	129.4 Å²	129.4	100%	1.221	70%	0.699	S	S	*	*			trans	-42.2	0	170.2	43.4	0	0	0	0	112.6	R1119	R1119-T1121 PolarHBondContact O-N 3.13Å

Retrieved 1,121 of 1,121 residues in 1160.8 ms (Link to these results)

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