A0A061IQD4_CRIGR Loading...

Endoplasmic reticulum transmembrane helix translocase

Endoplasmic reticulum translocase required to remove mitochondrial transmembrane proteins mistargeted to the endoplasmic reticulum. Acts as a dislocase that mediates the ATP-dependent extraction of mislocalized mitochondrial transmembrane proteins from the endoplasmic reticulum membrane. Specifically binds mitochondrial tail-anchored transmembrane proteins: has an atypically large substrate-binding pocket that recognizes and binds moderately hydrophobic transmembranes with short hydrophilic lumenal domains.

AlphaFold DB , UniProt , Accession A0A061IQD4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Atp13a1, Length 1,201 aa.

						>A0A061IQD4_CRIGR|A0A061IQD4|Atp13a1
MAAVGNAVPCGTRPGAAGGNGPPQPGRRPRPLLAAGPALIASGDELVAAVWPYRRLALVRRLTVLPFAGLLYPAWLGAAASGCWGWGSSWTQVPEAALLALATICLAHALTVLSGHWSVHAHCALTCTPEYDPSRATFVKVVPTPNNGSTELVALHRDKGEDGLEVLSFEFQKIKYSYDALEKKQFLPVAFPVGNAFSYYQSNRGFQEDSEIRAAEKKFGSNKAEMVVPDFSELFKERATAPFFVFQVFCVGLWCLDEYWYYSVFTLSMLVAFEASLVQQQMRNMSEIRKMGNKPHMIQVYRSRKWRPVASDEIVPGDIVSIGRSPQENLVPCDVLLLRGRCIVDEAMLTGESVPQMKEPIEDLSPDRVLDLQADARLHVIFGGTKVVQHMPPQKATSGLKSVDNGCVAYVLRTGFNTSQGKLLRTILFGVKRVTANNLETFIFILFLLVFAIAAAAYVWVEGTKDPSRNRYKLFLECTLILTSVVPPELPIELSLAVNTSLIALAKLYMYCTEPFRIPFAGKVEVCCFDKTGTLTSDSLVVRGVAGLRDGKEVTPVSSIPIETHRALASCHSLMQLDDGTLVGDPLEKAMLTAVDWTLTKDEKVFPRSIKTQGLKIHQRFHFASALKRMSVLASYEKLGSTDLCYIAAVKGAPETLHSMFSQCPPDYHHIHTEISREGARVLALGYKELGHLTHQQAREVKREALECSLKFVGFIVVSCPLKADSKAVIREIQNASHRVVMITGDNPLTACHVAQELHFIDKAHTLILHPPSEKGRPCEWRSIDSSIVLPLTLGSPKALALEHALCLTGDGLAHLQAVDPQQLLRLIPHVQVFARVAPKQKEFVITSLKELGYVTLMCGDGTNDVGALKHADVGVALLANAPERIVERRRRPRDNQVLSNSGPRVSSRSTKQRSALLSPEEPPASHRDRLNQVLRDLEDESTPIVKLGDASIAAPFTSKLSSIQCICHVIKQGRCTLVTTLQMFKILALNALILAYSQSVLYLEGVKFSDFQATLQGLLLAGCFLFISRSKPLKTLSRERPLPNIFNLYTILTVMLQFSVHFLSLVYLYQEAQARSPEKQEQFVDLYKEFEPSLVNSTVYIMAMAMQMATFAINYKGPPFMESLPENKPLVWSLVVSLLAIIGLLLGSSPDFNSQFGLVDIPVEFKLVIGQVLALDFCLALLADRVLQFFLGTPKLKVPS
					

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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	31.9	Very low	28.7	Very low	248 Å²	248	121.7 Å²	121.7	100%	1.222	82%	0.817	S	S	*	*				0	124.7	0	-74	-178.1	175	0	0	107.3
2	A	29.5	Very low	28.5	Very low	91 Å²	91	124 Å²	124	75%	0.752	83%	0.825	S	S	*	*			cis	-160.6	125.1	-8	0	0	0	0	0	103.2
3	A	26.3	Very low	28.4	Very low	85 Å²	85	133.1 Å²	133.1	70%	0.702	83%	0.832	S	S	*	*				65.5	114.6	101.5	0	0	0	0	0	113.5
4	V	28.9	Very low	28.9	Very low	145 Å²	145	132.9 Å²	132.9	88%	0.879	83%	0.834	S	S	*	*				67.1	127	101.8	179.4	0	0	0	0	110.8
5	G	26.2	Very low	28.8	Very low	61 Å²	61	129.6 Å²	129.6	63%	0.629	84%	0.835	S	S	*	*			cis	137.7	153	23.9	0	0	0	0	0	107.6
6	N	27.7	Very low	28.8	Very low	163 Å²	163	128.1 Å²	128.1	87%	0.872	84%	0.838	S	S	*	*			trans	69.2	122.4	161.6	-62.7	-14.1	0	0	0	119.7
7	A	26.2	Very low	28.7	Very low	99 Å²	99	127 Å²	127	82%	0.818	84%	0.841	S	S	*	*				176.3	139.1	94.5	0	0	0	0	0	111.5
8	V	29.8	Very low	28.7	Very low	137 Å²	137	124.6 Å²	124.6	83%	0.83	84%	0.843	S	S	*	*			trans	-101.4	146.9	169.1	174.4	0	0	0	0	106.1
9	P	39	Very low	28.6	Very low	116 Å²	116	122.3 Å²	122.3	75%	0.753	84%	0.842	S	S	*	*				-152.3	150.7	98.2	33.9	-12	0	0	0	118
10	C	25.6	Very low	28.6	Very low	131 Å²	131	125.1 Å²	125.1	89%	0.885	85%	0.847	S	S	*	*			trans	44.6	130.5	139.5	-70.1	0	0	0	0	122.7
11	G	24.9	Very low	28.6	Very low	63 Å²	63	122.3 Å²	122.3	65%	0.649	84%	0.84	S	S	*	*			trans	146.8	95.4	133	0	0	0	0	0	118.5
12	T	26.6	Very low	28.7	Very low	149 Å²	149	116.4 Å²	116.4	91%	0.914	82%	0.82	S	S	*	*			trans	71.3	121.9	139.3	53	0	0	0	0	122.3
13	R	27	Very low	28.9	Very low	242 Å²	242	118 Å²	118	91%	0.913	82%	0.823	S	S	*	*			trans	-64.7	162.6	163.1	-75.9	178.4	167.8	178.4	-2.5	112.6
14	P	35.4	Very low	29	Very low	131 Å²	131	123 Å²	123	85%	0.851	83%	0.832	S	S	*	*				-149.2	167.1	85.6	36.8	-17.4	0	0	0	116.5
15	G	26.4	Very low	29.2	Very low	83 Å²	83	122.3 Å²	122.3	86%	0.856	83%	0.83	S	S	*	*			trans	109.1	131.1	144.4	0	0	0	0	0	117.7
16	A	28.8	Very low	29.2	Very low	106 Å²	106	123 Å²	123	88%	0.876	84%	0.837	S	S	*	*			trans	-112.3	157	-165	0	0	0	0	0	114.9
17	A	28.3	Very low	29.2	Very low	109 Å²	109	127.1 Å²	127.1	90%	0.901	84%	0.84	S	S	*	*			trans	155	134.3	145	0	0	0	0	0	107.6
18	G	27.9	Very low	29.3	Very low	84 Å²	84	133.2 Å²	133.2	87%	0.866	84%	0.842	S	S	*	*			cis	148.3	118.4	9	0	0	0	0	0	106.4
19	G	26.6	Very low	29.2	Very low	80 Å²	80	132.6 Å²	132.6	83%	0.825	84%	0.841	S	S	*	*			trans	-174.4	120.4	179.5	0	0	0	0	0	113.1
20	N	30.1	Very low	28.6	Very low	178 Å²	178	138.2 Å²	138.2	95%	0.952	85%	0.847	S	S	*	*			trans	-75	141.8	-160.2	-69.2	-39.4	0	0	0	116.4
21	G	27.8	Very low	29	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	84%	0.843	S	S	*	*			trans	-124.1	153.7	162.6	0	0	0	0	0	111.5
22	P	33.5	Very low	29.4	Very low	123 Å²	123	142.9 Å²	142.9	80%	0.799	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-75.6	162.5	-169	31.8	-34.5	0	0	0	113.4
23	P	33.4	Very low	29.9	Very low	125 Å²	125	143.9 Å²	143.9	81%	0.812	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-78.7	131.7	-162.9	31.6	-33.4	0	0	0	112.7
24	Q	29.8	Very low	30.3	Very low	191 Å²	191	135.7 Å²	135.7	89%	0.893	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-73.2	129.5	166.5	-69.6	-174.9	-9	0	0	110.4
25	P	33.1	Very low	30.5	Very low	130 Å²	130	132.2 Å²	132.2	84%	0.844	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-86.3	133.8	169.5	31.4	-28.4	0	0	0	111.5
26	G	26.3	Very low	31.7	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	79%	0.792	S	S	*	*			trans	86.5	80.6	155.4	0	0	0	0	0	117.1	R28	G26-R28 PolarHBondContact O-N 3.07Å; G26-R28 VanDerWaalsContact O-N 3.13Å
27	R	26.5	Very low	33.1	Very low	251 Å²	251	129.8 Å²	129.8	95%	0.947	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-54.5	116.2	161.1	-82	178.5	172.4	173.9	-1.5	109.6
28	R	28.7	Very low	34.7	Very low	227 Å²	227	126.6 Å²	126.6	86%	0.857	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-51.8	135.2	155.6	-69.6	-179.4	178.1	-179.2	-1.2	107.8	G26 R30	G26-R28 PolarHBondContact O-N 3.07Å; G26-R28 VanDerWaalsContact O-N 3.13Å; R28-R30 PolarHBondContact O-N 2.97Å
29	P	27.7	Very low	36.7	Very low	123 Å²	123	124 Å²	124	80%	0.799	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60	118.2	172.6	24.2	-30	0	0	0	107.8
30	R	26.3	Very low	38.9	Very low	235 Å²	235	120.9 Å²	120.9	89%	0.887	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-56.6	124.6	168.2	-79.4	-179.9	170.7	177.9	-3.9	106.9	R28 L32	R28-R30 PolarHBondContact O-N 2.97Å; R30-L32 PolarHBondContact O-N 3.33Å
31	P	34.6	Very low	40.3	Very low	123 Å²	123	113.7 Å²	113.7	80%	0.799	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-64.7	126.2	171.2	26.3	-28.9	0	0	0	107.5	L33	P31-L33 PolarHBondContact O-N 3.39Å
32	L	33	Very low	41.7	Very low	169 Å²	169	116.5 Å²	116.5	89%	0.885	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-50	137.4	166.9	-86.4	149.2	0	0	0	109.2	R30	R30-L32 PolarHBondContact O-N 3.33Å
33	L	37.3	Very low	42.9	Very low	169 Å²	169	114.4 Å²	114.4	89%	0.885	66%	0.663	S	S	*	*	S	Bend	trans	-49.8	150.8	-168.6	-73.5	102.5	0	0	0	115.2	P31	P31-L33 PolarHBondContact O-N 3.39Å
34	A	34.2	Very low	44.7	Very low	71 Å²	71	110.2 Å²	110.2	59%	0.587	63%	0.634	S	S	*	*			trans	83.2	58.8	161.1	0	0	0	0	0	118.7
35	A	40.6	Very low	46.7	Very low	57 Å²	57	106.4 Å²	106.4	47%	0.471	62%	0.616	S	S	.	*			trans	-127.6	131.6	157.3	0	0	0	0	0	109.5
36	G	51.5	Low	48.9	Very low	27 Å²	27	100.7 Å²	100.7	28%	0.278	58%	0.578	S	S	.	*			trans	-64.1	-173.8	178.2	0	0	0	0	0	114.5
37	P	57.4	Low	51.6	Low	112 Å²	112	97.3 Å²	97.3	73%	0.727	54%	0.543	S	S	*	.			trans	-59.6	140.5	178.6	25.4	-32.7	0	0	0	111
38	A	63.3	Low	54.3	Low	41 Å²	41	87.9 Å²	87.9	34%	0.339	52%	0.519	S	S	.	.			trans	-62.1	135.3	176.9	0	0	0	0	0	110.4	I40 A49	A38-I40 VanDerWaalsContact C-N 3.29Å; A38-I40 PolarHBondContact O-N 2.91Å; A38-A49 HydrophobicContact CB-CB 4.02Å
39	L	69.6	Low	57	Low	29 Å²	29	77.7 Å²	77.7	15%	0.152	48%	0.483	C	S	.	.			trans	-92.3	35.6	-173	-64	176.6	0	0	0	113.4	V50 P52 P133 Q185 F186	L39-V50 PolarHBondContact N-O 3.28Å; L39-P52 HydrophobicContact CD1-CG 3.46Å; L39-P52 VanDerWaalsContact CD1-CG 3.46Å; L39-P133 HydrophobicContact CD1-CG 3.66Å; L39-Q185 WeakPolarHBondContact O-CA 3.4Å; L39-F186 HydrophobicContact CB-CD2 4.25Å; L39-F186 PolarHBondContact O-N 2.84Å
40	I	72.9	Confident	59.7	Low	16 Å²	16	71.9 Å²	71.9	8%	0.082	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-122.7	149.4	-179.7	-162.6	164.9	0	0	0	111.6	A38 D44 V47 V50	A38-I40 VanDerWaalsContact C-N 3.29Å; A38-I40 PolarHBondContact O-N 2.91Å; I40-D44 HydrophobicContact CD1-CB 4.31Å; I40-V47 HydrophobicContact CD1-CB 3.4Å; I40-V47 HydrophobicContact CD1-CG1 3.36Å; I40-V47 HydrophobicContact CD1-CG2 4.44Å; I40-V50 HydrophobicContact CB-CB 4.36Å; I40-V50 HydrophobicContact CB-CG2 3.96Å; I40-V50 HydrophobicContact CD1-CG2 3.77Å; I40-V50 HydrophobicContact CG1-CG2 4.34Å
41	A	60	Low	62.6	Low	27 Å²	27	63.9 Å²	63.9	22%	0.223	42%	0.415	C	S	.	.			trans	-62.9	137	174.8	0	0	0	0	0	112	G43 L187	A41-G43 PolarHBondContact O-N 2.64Å; A41-L187 HydrophobicContact CB-CD2 3.58Å
42	S	55.6	Low	65.1	Low	127 Å²	127	58.6 Å²	58.6	89%	0.888	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	119.6	171.7	54.5	0	0	0	0	110
43	G	58.8	Low	67.8	Low	79 Å²	79	51.9 Å²	51.9	81%	0.814	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.7	11	174.3	0	0	0	0	0	116.4	A41	A41-G43 PolarHBondContact O-N 2.64Å
44	D	72.1	Confident	70.2	Confident	37 Å²	37	49 Å²	49	20%	0.198	32%	0.321	C	S	.	.			trans	-63.8	134.2	168.3	-171.6	-2.9	0	0	0	110.9	I40 L46 Y176	I40-D44 HydrophobicContact CD1-CB 4.31Å; D44-L46 VanDerWaalsContact C-N 3.31Å; D44-L46 PolarHBondContact OD1-N 3.11Å; D44-Y176 WeakPolarHBondContact OD2-CE1 3.48Å; D44-Y176 PolarHBondContact OD2-OH 3.21Å
45	E	71.1	Confident	72.7	Confident	111 Å²	111	51.7 Å²	51.7	52%	0.519	32%	0.317	S	S	.	.	S	Bend	trans	-68.8	-31.4	177.4	-66.9	-167.5	146.4	0	0	111.2	T144 N147 K422 K840	E45-T144 PolarHBondContact O-OG1 2.93Å; E45-N147 PolarHBondContact O-ND2 3.33Å; E45-K422 IonicContact OE2-NZ 3.73Å; E45-K422 PolarHBondContact OE2-NZ 3.45Å; E45-K840 IonicContact OE1-NZ 2.81Å; E45-K840 PolarHBondContact OE1-NZ 3.38Å
46	L	79.3	Confident	74.8	Confident	9 Å²	9	50.7 Å²	50.7	5%	0.047	30%	0.303	C	S	.	.	S	Bend	trans	-99.8	-43.2	-169.4	-170	73.1	0	0	0	114.1	D44 P143 T144 N147 F171 Q172 I174	D44-L46 VanDerWaalsContact C-N 3.31Å; D44-L46 PolarHBondContact OD1-N 3.11Å; L46-P143 CarbonylContact O-C 3.56Å; L46-P143 VanDerWaalsContact O-CA 3.29Å; L46-P143 WeakPolarHBondContact O-CA 3.43Å; L46-T144 PolarHBondContact O-N 3.21Å; L46-T144 PolarHBondContact O-OG1 3.48Å; L46-N147 HydrophobicContact CD1-CB 3.92Å; L46-F171 HydrophobicContact CD2-CD1 3.75Å; L46-F171 HydrophobicContact CD2-CE1 3.95Å; L46-F171 HydrophobicContact CG-CD1 4.37Å; L46-F171 HydrophobicContact CG-CE1 4.14Å; L46-Q172 HydrophobicContact CD2-CB 4.39Å; L46-I174 HydrophobicContact CD2-CD1 3.57Å; L46-I174 HydrophobicContact CD2-CG1 4.33Å
47	V	83.5	Confident	76.5	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.024	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.5	-170.3	-179.2	0	0	0	0	111	I40 V50 V141 F171 Y176	I40-V47 HydrophobicContact CD1-CB 3.4Å; I40-V47 HydrophobicContact CD1-CG1 3.36Å; I40-V47 HydrophobicContact CD1-CG2 4.44Å; V47-V50 HydrophobicContact CG1-CG2 3.51Å; V47-V141 HydrophobicContact CB-CG1 4.35Å; V47-V141 HydrophobicContact CG1-CG1 3.59Å; V47-V141 HydrophobicContact CG2-CG1 3.76Å; V47-F171 HydrophobicContact CG2-CD1 3.69Å; V47-F171 HydrophobicContact CG2-CE1 3.97Å; V47-Y176 HydrophobicContact CG2-CE2 4.39Å
48	A	83.4	Confident	77.7	Confident	53 Å²	53	52.2 Å²	52.2	44%	0.438	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-39.2	179	0	0	0	0	0	112.6	V142 T144	A48-V142 PolarHBondContact N-O 3.44Å; A48-T144 HydrophobicContact CB-CG2 4.11Å
49	A	84.1	Confident	78.6	Confident	13 Å²	13	55.3 Å²	55.3	11%	0.107	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	147.8	-179.5	0	0	0	0	0	112.4	A38 W51 V142	A38-A49 HydrophobicContact CB-CB 4.02Å; A49-W51 HydrophobicContact CB-CH2 4.14Å; A49-W51 HydrophobicContact CB-CZ2 3.93Å; A49-V142 HydrophobicContact CB-CB 4.31Å; A49-V142 PolarHBondContact N-O 3.01Å; A49-V142 VanDerWaalsContact N-O 3.17Å; A49-V142 PolarHBondContact O-N 3.28Å
50	V	85.7	Confident	79.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.8	-178.5	-179.6	0	0	0	0	108.9	L39 I40 V47 V139 F169 F186	L39-V50 PolarHBondContact N-O 3.28Å; I40-V50 HydrophobicContact CB-CB 4.36Å; I40-V50 HydrophobicContact CB-CG2 3.96Å; I40-V50 HydrophobicContact CD1-CG2 3.77Å; I40-V50 HydrophobicContact CG1-CG2 4.34Å; V47-V50 HydrophobicContact CG1-CG2 3.51Å; V50-V139 HydrophobicContact CB-CG1 4.43Å; V50-V139 HydrophobicContact CG1-CG1 3.11Å; V50-F169 HydrophobicContact CG1-CE1 4.26Å; V50-F169 HydrophobicContact CG1-CZ 4.35Å; V50-F169 HydrophobicContact CG2-CZ 4.36Å; V50-F186 HydrophobicContact CG1-CD2 4.02Å; V50-F186 HydrophobicContact CG1-CE2 4.38Å
51	W	86.6	Confident	79.9	Confident	67 Å²	67	64 Å²	64	25%	0.254	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.2	178.8	-63.1	-61.6	0	0	0	111.9	A49 Y53 V139 K140 V142	A49-W51 HydrophobicContact CB-CH2 4.14Å; A49-W51 HydrophobicContact CB-CZ2 3.93Å; W51-Y53 HydrophobicContact CB-CD2 4.47Å; W51-Y53 HydrophobicContact CB-CE2 3.91Å; W51-Y53 WeakPolarHBondContact O-CD2 3.48Å; W51-V139 WeakPolarHBondContact O-CA 3.48Å; W51-K140 HydrophobicContact CE3-CD 3.87Å; W51-K140 HydrophobicContact CE3-CG 4.25Å; W51-K140 HydrophobicContact CZ3-CD 4.32Å; W51-K140 PolarHBondContact N-O 3Å; W51-K140 PolarHBondContact O-N 2.89Å; W51-V142 HydrophobicContact CE3-CG2 3.98Å; W51-V142 HydrophobicContact CH2-CG2 3.91Å; W51-V142 HydrophobicContact CZ3-CB 4.46Å; W51-V142 HydrophobicContact CZ3-CG2 3.26Å
52	P	87.7	Confident	81	Confident	13 Å²	13	67 Å²	67	8%	0.084	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	141.2	175.6	-5.2	20.6	0	0	0	111.9	L39 E130 A136	L39-P52 HydrophobicContact CD1-CG 3.46Å; L39-P52 VanDerWaalsContact CD1-CG 3.46Å; P52-E130 WeakPolarHBondContact CB-O 3.4Å; P52-E130 WeakPolarHBondContact CG-O 3.46Å; P52-E130 PolarHBondContact O-N 3.24Å; P52-E130 VanDerWaalsContact O-N 3.09Å; P52-A136 HydrophobicContact CB-CB 3.54Å
53	Y	88.5	Confident	82.4	Confident	27 Å²	27	61.8 Å²	61.8	11%	0.106	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.6	175.1	-79.5	-89.8	0	0	0	111.1	W51 C123 C127 T128 P129 T137 F138 K140	W51-Y53 HydrophobicContact CB-CD2 4.47Å; W51-Y53 HydrophobicContact CB-CE2 3.91Å; W51-Y53 WeakPolarHBondContact O-CD2 3.48Å; Y53-C123 HydrophobicContact CD1-CB 4.39Å; Y53-C123 HydrophobicContact CE1-CB 3.97Å; Y53-C127 HydrophobicContact CD1-CB 3.62Å; Y53-C127 HydrophobicContact CG-CB 4.17Å; Y53-T128 WeakPolarHBondContact CA-O 3.15Å; Y53-P129 HydrophobicContact CE1-CB 4.15Å; Y53-T137 PolarHBondContact O-N 3.12Å; Y53-T137 PolarHBondContact O-OG1 2.8Å; Y53-F138 PolarHBondContact N-O 3.27Å; Y53-F138 PolarHBondContact O-N 3.24Å; Y53-F138 VanDerWaalsContact O-O 3.05Å; Y53-K140 HydrophobicContact CD2-CB 3.75Å; Y53-K140 HydrophobicContact CE2-CB 3.55Å; Y53-K140 HydrophobicContact CE2-CD 3.8Å; Y53-K140 HydrophobicContact CE2-CG 4.35Å
54	R	88.9	Confident	83.7	Confident	108 Å²	108	59.8 Å²	59.8	41%	0.408	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.9	170.6	-173.6	175.6	175.8	-172.5	0.5	110.1	C127 T128 E130	R54-C127 VanDerWaalsContact O-CA 3.29Å; R54-C127 WeakPolarHBondContact O-CA 3.49Å; R54-T128 PolarHBondContact N-O 3.11Å; R54-T128 PolarHBondContact O-N 2.82Å; R54-E130 HydrophobicContact CB-CB 4.41Å
55	R	85.6	Confident	84.4	Confident	129 Å²	129	62.2 Å²	62.2	49%	0.487	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.2	175	-158	-176.6	-167.5	171.1	-2.3	110.3	R61 T137 F138	R55-R61 VanDerWaalsContact NE-NH2 3.1Å; R55-T137 PolarHBondContact N-OG1 2.72Å; R55-F138 HydrophobicContact CB-CD2 4.26Å; R55-F138 HydrophobicContact CB-CE2 3.94Å; R55-F138 HydrophobicContact CG-CE2 4.1Å
56	L	86.1	Confident	85.2	Confident	35 Å²	35	58.6 Å²	58.6	18%	0.183	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-70.9	143.5	170.9	-72.5	166.5	0	0	0	110.7	R60 R61 T126 T128	L56-R60 HydrophobicContact CB-CB 4.48Å; L56-R60 HydrophobicContact CD2-CB 4.31Å; L56-R61 HydrophobicContact CB-CG 4.11Å; L56-R61 PolarHBondContact O-NE 2.96Å; L56-T126 WeakPolarHBondContact CB-O 3.41Å; L56-T126 PolarHBondContact N-O 2.92Å; L56-T128 HydrophobicContact CD1-CG2 4.03Å; L56-T128 HydrophobicContact CD2-CG2 3.69Å; L56-T128 HydrophobicContact CG-CG2 3.94Å
57	A	85.7	Confident	85.7	Confident	64 Å²	64	58.8 Å²	58.8	53%	0.529	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-54.9	145.4	167.8	0	0	0	0	0	109.7	V59 R60 R61	A57-V59 PolarHBondContact O-N 2.89Å; A57-V59 VanDerWaalsContact O-N 3.08Å; A57-R60 PolarHBondContact O-N 3.02Å; A57-R61 PolarHBondContact O-N 2.95Å
58	L	82.4	Confident	85.8	Confident	107 Å²	107	61.3 Å²	61.3	56%	0.56	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-48.9	-44.5	-171.5	-174	69.2	0	0	0	112.7	R60 R61 V64	L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 2.93Å; L58-R61 PolarHBondContact O-N 3.15Å; L58-V64 HydrophobicContact CD1-CG2 4.41Å; L58-V64 WeakPolarHBondContact O-CB 3.37Å
59	V	82.9	Confident	85.7	Confident	106 Å²	106	61.1 Å²	61.1	64%	0.642	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-65.7	-30.5	-179.1	-176	0	0	0	0	113	A57 L65	A57-V59 PolarHBondContact O-N 2.89Å; A57-V59 VanDerWaalsContact O-N 3.08Å; V59-L65 WeakPolarHBondContact O-CB 3.48Å; V59-L65 WeakPolarHBondContact O-CD1 3.46Å
60	R	83.4	Confident	85.8	Confident	185 Å²	185	66.2 Å²	66.2	70%	0.698	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-90.2	-3.6	-178.1	-68.7	-172.2	178.9	-173.6	-0.5	113.9	L56 A57 L58	L56-R60 HydrophobicContact CB-CB 4.48Å; L56-R60 HydrophobicContact CD2-CB 4.31Å; A57-R60 PolarHBondContact O-N 3.02Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 2.93Å
61	R	85.9	Confident	85.8	Confident	43 Å²	43	69.6 Å²	69.6	16%	0.162	36%	0.364	C	S	.	.	S	Bend	trans	-66.4	139.6	177.6	-63.5	-178.5	-170.9	169.3	9.3	109.1	R55 L56 A57 L58 T63 V64 L65	R55-R61 VanDerWaalsContact NE-NH2 3.1Å; L56-R61 HydrophobicContact CB-CG 4.11Å; L56-R61 PolarHBondContact O-NE 2.96Å; A57-R61 PolarHBondContact O-N 2.95Å; L58-R61 PolarHBondContact O-N 3.15Å; R61-T63 PolarHBondContact O-N 3.29Å; R61-T63 VanDerWaalsContact O-N 3.13Å; R61-V64 HydrophobicContact CB-CG2 4.47Å; R61-V64 PolarHBondContact O-N 2.66Å; R61-L65 WeakPolarHBondContact O-CB 3.24Å; R61-L65 PolarHBondContact O-N 3.5Å
62	L	84.1	Confident	85.9	Confident	90 Å²	90	69.1 Å²	69.1	47%	0.471	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.1	174.9	-78.1	153.8	0	0	0	112.3	P66 A124 L125	L62-P66 WeakPolarHBondContact O-CD 3.17Å; L62-P66 WeakPolarHBondContact O-CG 3.39Å; L62-A124 WeakPolarHBondContact CD1-O 3.09Å; L62-L125 HydrophobicContact CB-CD2 3.94Å; L62-L125 PolarHBondContact N-O 3.47Å
63	T	84.4	Confident	86	Confident	17 Å²	17	71.1 Å²	71.1	10%	0.104	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.9	169.5	61.7	0	0	0	0	113	R61 F67 H108 V112 L125 T126	R61-T63 PolarHBondContact O-N 3.29Å; R61-T63 VanDerWaalsContact O-N 3.13Å; T63-F67 VanDerWaalsContact O-CD2 3.32Å; T63-F67 WeakPolarHBondContact O-CD2 3.4Å; T63-H108 PolarHBondContact O-CD2 3.38Å; T63-H108 VanDerWaalsContact O-CD2 3.3Å; T63-H108 PolarHBondContact O-NE2 3.46Å; T63-H108 VanDerWaalsContact O-NE2 3.08Å; T63-V112 HydrophobicContact CG2-CG2 4.49Å; T63-L125 HydrophobicContact CG2-CB 4.11Å; T63-L125 HydrophobicContact CG2-CD1 4.47Å; T63-T126 HydrophobicContact CG2-CG2 4.39Å
64	V	86.7	Confident	85.8	Confident	38 Å²	38	72.9 Å²	72.9	23%	0.23	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-48.1	-173.1	-177.8	0	0	0	0	111.7	L58 R61 F67 A68	L58-V64 HydrophobicContact CD1-CG2 4.41Å; L58-V64 WeakPolarHBondContact O-CB 3.37Å; R61-V64 HydrophobicContact CB-CG2 4.47Å; R61-V64 PolarHBondContact O-N 2.66Å; V64-F67 PolarHBondContact O-N 2.89Å; V64-A68 HydrophobicContact CG1-CB 3.97Å; V64-A68 WeakPolarHBondContact O-CB 3.4Å; V64-A68 PolarHBondContact O-N 3.48Å
65	L	87.1	Confident	85.6	Confident	88 Å²	88	69.3 Å²	69.3	46%	0.461	38%	0.382	S	S	.	.	H	α-helix	trans	-55.2	-54	-173.8	-171	106	0	0	0	113.8	V59 R61 F67 G69	V59-L65 WeakPolarHBondContact O-CB 3.48Å; V59-L65 WeakPolarHBondContact O-CD1 3.46Å; R61-L65 WeakPolarHBondContact O-CB 3.24Å; R61-L65 PolarHBondContact O-N 3.5Å; L65-F67 VanDerWaalsContact C-N 3.29Å; L65-F67 PolarHBondContact O-N 3.13Å; L65-G69 VanDerWaalsContact O-CA 3.25Å; L65-G69 WeakPolarHBondContact O-CA 3.22Å; L65-G69 PolarHBondContact O-N 2.89Å
66	P	87.1	Confident	85.4	Confident	35 Å²	35	68.2 Å²	68.2	23%	0.227	39%	0.385	C	S	.	.	H	α-helix	trans	-66.9	-31.3	-179.8	25.6	-33	0	0	0	112.3	L62 L70 L71	L62-P66 WeakPolarHBondContact O-CD 3.17Å; L62-P66 WeakPolarHBondContact O-CG 3.39Å; P66-L70 WeakPolarHBondContact O-CB 3.5Å; P66-L70 PolarHBondContact O-N 3.35Å; P66-L71 WeakPolarHBondContact O-CG 3.41Å; P66-L71 PolarHBondContact O-N 3.32Å
67	F	89	Confident	85.2	Confident	13 Å²	13	68.4 Å²	68.4	6%	0.057	40%	0.395	C	S	.	.	I	π-helix	trans	-79.8	-58.5	-178.6	-67.8	-81.6	0	0	0	112	T63 V64 L65 L71 Y72 I104 A107 H108 T111	T63-F67 VanDerWaalsContact O-CD2 3.32Å; T63-F67 WeakPolarHBondContact O-CD2 3.4Å; V64-F67 PolarHBondContact O-N 2.89Å; L65-F67 VanDerWaalsContact C-N 3.29Å; L65-F67 PolarHBondContact O-N 3.13Å; F67-L71 HydrophobicContact CD1-CD1 3.58Å; F67-L71 HydrophobicContact CE1-CD1 3.69Å; F67-L71 HydrophobicContact CG-CD1 4.26Å; F67-L71 HydrophobicContact CZ-CD1 4.43Å; F67-L71 PolarHBondContact O-N 3.4Å; F67-Y72 HydrophobicContact CB-CD2 4.19Å; F67-Y72 HydrophobicContact CB-CE2 3.97Å; F67-Y72 WeakPolarHBondContact O-CD2 3.44Å; F67-Y72 PolarHBondContact O-N 2.77Å; F67-I104 HydrophobicContact CD1-CG2 4.05Å; F67-A107 HydrophobicContact CE1-CB 4.02Å; F67-A107 HydrophobicContact CZ-CB 4.28Å; F67-H108 HydrophobicContact CD1-CB 3.58Å; F67-H108 AromaticContact CD1-CG 3.94Å; F67-H108 HydrophobicContact CD2-CB 4.4Å; F67-H108 AromaticContact CD2-CD2 3.81Å; F67-H108 HydrophobicContact CE1-CB 3.66Å; F67-H108 HydrophobicContact CE2-CB 4.47Å; F67-H108 HydrophobicContact CG-CB 3.97Å; F67-H108 AromaticContact CG-CD2 3.91Å; F67-H108 AromaticContact CG-CG 3.81Å; F67-H108 HydrophobicContact CZ-CB 4.13Å; F67-T111 HydrophobicContact CE2-CG2 4.05Å; F67-T111 WeakPolarHBondContact CE2-OG1 3.13Å; F67-T111 HydrophobicContact CZ-CG2 3.98Å
68	A	85.3	Confident	84.8	Confident	57 Å²	57	66.4 Å²	66.4	47%	0.471	38%	0.379	S	S	.	.	I	π-helix	trans	-75.2	-29.6	-177.4	0	0	0	0	0	113.6	V64 P73	V64-A68 HydrophobicContact CG1-CB 3.97Å; V64-A68 WeakPolarHBondContact O-CB 3.4Å; V64-A68 PolarHBondContact O-N 3.48Å; A68-P73 VanDerWaalsContact O-CD 3.27Å; A68-P73 WeakPolarHBondContact O-CD 3.5Å; A68-P73 WeakPolarHBondContact O-CG 3.31Å
69	G	82.5	Confident	84.2	Confident	49 Å²	49	61.8 Å²	61.8	51%	0.505	36%	0.356	S	S	.	.	I	π-helix	trans	-91.9	-25	-177.5	0	0	0	0	0	114.7	L65	L65-G69 VanDerWaalsContact O-CA 3.25Å; L65-G69 WeakPolarHBondContact O-CA 3.22Å; L65-G69 PolarHBondContact O-N 2.89Å
70	L	85.1	Confident	83.6	Confident	119 Å²	119	61 Å²	61	62%	0.623	36%	0.361	S	S	*	.	I	π-helix	trans	-126.2	-59.7	-176.1	-73.1	162.6	0	0	0	112.5	P66 A74	P66-L70 WeakPolarHBondContact O-CB 3.5Å; P66-L70 PolarHBondContact O-N 3.35Å; L70-A74 WeakPolarHBondContact O-CA 3.36Å; L70-A74 WeakPolarHBondContact O-CB 3.31Å; L70-A74 PolarHBondContact O-N 3.3Å
71	L	86.9	Confident	82.9	Confident	71 Å²	71	55.8 Å²	55.8	37%	0.372	35%	0.353	S	S	.	.	I	π-helix	trans	-69.8	-48.7	-168.5	-65.3	168.7	0	0	0	113.7	P66 F67 A74 W75 I104	P66-L71 WeakPolarHBondContact O-CG 3.41Å; P66-L71 PolarHBondContact O-N 3.32Å; F67-L71 HydrophobicContact CD1-CD1 3.58Å; F67-L71 HydrophobicContact CE1-CD1 3.69Å; F67-L71 HydrophobicContact CG-CD1 4.26Å; F67-L71 HydrophobicContact CZ-CD1 4.43Å; F67-L71 PolarHBondContact O-N 3.4Å; L71-A74 PolarHBondContact O-N 3.02Å; L71-W75 WeakPolarHBondContact O-CB 3.11Å; L71-W75 PolarHBondContact O-N 3.35Å; L71-I104 HydrophobicContact CB-CD1 4.31Å; L71-I104 HydrophobicContact CB-CG1 4.43Å; L71-I104 HydrophobicContact CB-CG2 3.98Å
72	Y	89.3	Confident	81.9	Confident	57 Å²	57	55.3 Å²	55.3	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-43.5	176.6	-69.1	-64.6	0	0	0	112.5	F67 W75 L76 L101 I104 C105 H108	F67-Y72 HydrophobicContact CB-CD2 4.19Å; F67-Y72 HydrophobicContact CB-CE2 3.97Å; F67-Y72 WeakPolarHBondContact O-CD2 3.44Å; F67-Y72 PolarHBondContact O-N 2.77Å; Y72-W75 WeakPolarHBondContact O-CB 3.31Å; Y72-W75 PolarHBondContact O-N 3.28Å; Y72-L76 WeakPolarHBondContact O-CG 3.3Å; Y72-L76 PolarHBondContact O-N 3.18Å; Y72-L101 HydrophobicContact CD1-CD1 3.91Å; Y72-L101 HydrophobicContact CE1-CD1 3.85Å; Y72-I104 HydrophobicContact CD1-CG2 4.03Å; Y72-I104 HydrophobicContact CE1-CG2 3.7Å; Y72-I104 HydrophobicContact CE2-CG2 4.35Å; Y72-I104 HydrophobicContact CG-CG2 4.48Å; Y72-C105 PolarHBondContact OH-SG 3.23Å; Y72-C105 VanDerWaalsContact OH-SG 3.34Å; Y72-H108 AromaticContact CE2-ND1 3.8Å; Y72-H108 PolarHBondContact OH-ND1 3.28Å
73	P	88	Confident	81	Confident	56 Å²	56	55.8 Å²	55.8	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-36.4	173	-24.4	35.4	0	0	0	113.8	A68 W75 L76 G77	A68-P73 VanDerWaalsContact O-CD 3.27Å; A68-P73 WeakPolarHBondContact O-CD 3.5Å; A68-P73 WeakPolarHBondContact O-CG 3.31Å; P73-W75 VanDerWaalsContact C-N 3.33Å; P73-L76 PolarHBondContact O-N 2.63Å; P73-G77 PolarHBondContact O-N 3.15Å
74	A	84.8	Confident	79.8	Confident	63 Å²	63	59.1 Å²	59.1	52%	0.521	38%	0.381	S	S	.	.	H	α-helix	trans	-65.8	-38.4	175.1	0	0	0	0	0	111.2	L70 L71 G77 A78	L70-A74 WeakPolarHBondContact O-CA 3.36Å; L70-A74 WeakPolarHBondContact O-CB 3.31Å; L70-A74 PolarHBondContact O-N 3.3Å; L71-A74 PolarHBondContact O-N 3.02Å; A74-G77 PolarHBondContact O-N 2.92Å; A74-A78 VanDerWaalsContact O-CB 3.28Å; A74-A78 WeakPolarHBondContact O-CB 3.41Å; A74-A78 PolarHBondContact O-N 3.15Å
75	W	85.1	Confident	78.4	Confident	34 Å²	34	60.5 Å²	60.5	13%	0.129	40%	0.404	C	S	.	.	H	α-helix	trans	-62.5	-48.7	172.3	-176.3	87.8	0	0	0	111.6	L71 Y72 P73 G77 A78 A79 A97 L101 I104	L71-W75 WeakPolarHBondContact O-CB 3.11Å; L71-W75 PolarHBondContact O-N 3.35Å; Y72-W75 WeakPolarHBondContact O-CB 3.31Å; Y72-W75 PolarHBondContact O-N 3.28Å; P73-W75 VanDerWaalsContact C-N 3.33Å; W75-G77 VanDerWaalsContact C-N 3.33Å; W75-G77 PolarHBondContact O-N 3.22Å; W75-A78 PolarHBondContact O-N 2.82Å; W75-A79 VanDerWaalsContact O-CB 3.24Å; W75-A79 WeakPolarHBondContact O-CB 3.27Å; W75-A79 PolarHBondContact O-N 3.27Å; W75-A97 HydrophobicContact CZ2-CB 4.24Å; W75-A97 PolarHBondContact NE1-O 2.81Å; W75-L101 HydrophobicContact CD2-CB 4.4Å; W75-L101 HydrophobicContact CD2-CD1 4.08Å; W75-L101 HydrophobicContact CE3-CD1 4.2Å; W75-L101 HydrophobicContact CH2-CD2 3.98Å; W75-L101 HydrophobicContact CZ2-CB 3.91Å; W75-L101 HydrophobicContact CZ2-CD2 3.99Å; W75-L101 HydrophobicContact CZ2-CG 4.37Å; W75-L101 HydrophobicContact CZ3-CD1 4.48Å; W75-L101 HydrophobicContact CZ3-CD2 4.44Å; W75-I104 HydrophobicContact CB-CD1 4.2Å
76	L	82.4	Confident	76.9	Confident	106 Å²	106	59 Å²	59	56%	0.555	39%	0.392	S	S	*	.	H	α-helix	trans	-63.8	-33.8	175.5	-75.6	169.5	0	0	0	113.3	Y72 P73 A79 A80	Y72-L76 WeakPolarHBondContact O-CG 3.3Å; Y72-L76 PolarHBondContact O-N 3.18Å; P73-L76 PolarHBondContact O-N 2.63Å; L76-A79 VanDerWaalsContact O-CB 3.29Å; L76-A79 WeakPolarHBondContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.33Å; L76-A80 PolarHBondContact O-N 2.84Å
77	G	80.4	Confident	75.3	Confident	38 Å²	38	59.5 Å²	59.5	39%	0.392	40%	0.403	S	S	.	.	H	α-helix	trans	-72.5	-44.2	177.8	0	0	0	0	0	111.9	P73 A74 W75 A79 A80 S81	P73-G77 PolarHBondContact O-N 3.15Å; A74-G77 PolarHBondContact O-N 2.92Å; W75-G77 VanDerWaalsContact C-N 3.33Å; W75-G77 PolarHBondContact O-N 3.22Å; G77-A79 PolarHBondContact O-N 3.17Å; G77-A80 PolarHBondContact O-N 2.75Å; G77-S81 WeakPolarHBondContact O-CB 3.27Å; G77-S81 PolarHBondContact O-N 2.78Å; G77-S81 PolarHBondContact O-OG 2.9Å; G77-S81 VanDerWaalsContact O-OG 3.11Å
78	A	77.1	Confident	73.5	Confident	23 Å²	23	65.2 Å²	65.2	19%	0.19	45%	0.445	C	S	.	.	H	α-helix	trans	-65.8	-30.1	173.8	0	0	0	0	0	112.1	A74 W75 S81 C83 W84	A74-A78 VanDerWaalsContact O-CB 3.28Å; A74-A78 WeakPolarHBondContact O-CB 3.41Å; A74-A78 PolarHBondContact O-N 3.15Å; W75-A78 PolarHBondContact O-N 2.82Å; A78-S81 WeakPolarHBondContact CA-OG 3.34Å; A78-S81 PolarHBondContact O-OG 2.82Å; A78-C83 HydrophobicContact CB-CB 4.48Å; A78-C83 PolarHBondContact O-N 2.99Å; A78-W84 HydrophobicContact CB-CZ2 4.44Å; A78-W84 VanDerWaalsContact O-CD1 3.22Å
79	A	70.2	Confident	71.7	Confident	9 Å²	9	65.4 Å²	65.4	7%	0.074	44%	0.443	C	S	.	.	H	α-helix	trans	-63	-52.6	168.3	0	0	0	0	0	112.3	W75 L76 G77 S81 G82 W86	W75-A79 VanDerWaalsContact O-CB 3.24Å; W75-A79 WeakPolarHBondContact O-CB 3.27Å; W75-A79 PolarHBondContact O-N 3.27Å; L76-A79 VanDerWaalsContact O-CB 3.29Å; L76-A79 WeakPolarHBondContact O-CB 3.28Å; G77-A79 PolarHBondContact O-N 3.17Å; A79-S81 PolarHBondContact O-N 3.08Å; A79-G82 PolarHBondContact O-N 2.91Å; A79-W86 VanDerWaalsContact CA-CE3 3.5Å; A79-W86 HydrophobicContact CB-CE3 3.51Å; A79-W86 HydrophobicContact CB-CH2 3.94Å; A79-W86 HydrophobicContact CB-CZ3 3.06Å
80	A	70.1	Confident	70.4	Confident	91 Å²	91	73.6 Å²	73.6	75%	0.752	46%	0.459	S	S	*	.	H	α-helix	trans	-68.2	-29.5	-179	0	0	0	0	0	114	L76 G77 G82	L76-A80 WeakPolarHBondContact O-CB 3.33Å; L76-A80 PolarHBondContact O-N 2.84Å; G77-A80 PolarHBondContact O-N 2.75Å; A80-G82 VanDerWaalsContact C-N 3.27Å; A80-G82 PolarHBondContact O-N 2.9Å
81	S	69.9	Low	68.8	Low	75 Å²	75	73.5 Å²	73.5	52%	0.524	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	2.4	179.2	66.2	0	0	0	0	114.2	G77 A78 A79 C83	G77-S81 WeakPolarHBondContact O-CB 3.27Å; G77-S81 PolarHBondContact O-N 2.78Å; G77-S81 PolarHBondContact O-OG 2.9Å; G77-S81 VanDerWaalsContact O-OG 3.11Å; A78-S81 WeakPolarHBondContact CA-OG 3.34Å; A78-S81 PolarHBondContact O-OG 2.82Å; A79-S81 PolarHBondContact O-N 3.08Å; S81-C83 PolarHBondContact O-N 3.33Å; S81-C83 PolarHBondContact OG-SG 3.47Å
82	G	64.6	Low	67.2	Low	32 Å²	32	77.7 Å²	77.7	33%	0.33	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	7.7	-179.4	0	0	0	0	0	114.6	A79 A80 W84 G85	A79-G82 PolarHBondContact O-N 2.91Å; A80-G82 VanDerWaalsContact C-N 3.27Å; A80-G82 PolarHBondContact O-N 2.9Å; G82-W84 PolarHBondContact O-N 2.93Å; G82-W84 VanDerWaalsContact O-N 3.14Å; G82-G85 PolarHBondContact O-N 2.95Å
83	C	64.2	Low	65.7	Low	100 Å²	100	77.9 Å²	77.9	68%	0.676	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.1	-178.4	-75.2	0	0	0	0	113.6	A78 S81 G85	A78-C83 HydrophobicContact CB-CB 4.48Å; A78-C83 PolarHBondContact O-N 2.99Å; S81-C83 PolarHBondContact O-N 3.33Å; S81-C83 PolarHBondContact OG-SG 3.47Å; C83-G85 VanDerWaalsContact C-N 3.34Å
84	W	60.8	Low	64.8	Low	87 Å²	87	76.7 Å²	76.7	33%	0.33	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	4.1	174	-59.7	106.5	0	0	0	114.1	A78 G82 P94 A96 A97 A100	A78-W84 HydrophobicContact CB-CZ2 4.44Å; A78-W84 VanDerWaalsContact O-CD1 3.22Å; G82-W84 PolarHBondContact O-N 2.93Å; G82-W84 VanDerWaalsContact O-N 3.14Å; W84-P94 HydrophobicContact CB-CG 3.71Å; W84-P94 WeakPolarHBondContact O-CB 2.92Å; W84-P94 VanDerWaalsContact O-CG 3.31Å; W84-P94 WeakPolarHBondContact O-CG 3.49Å; W84-A96 HydrophobicContact CE3-CB 4.17Å; W84-A96 HydrophobicContact CZ3-CB 4.24Å; W84-A97 HydrophobicContact CB-CB 4.26Å; W84-A97 HydrophobicContact CD2-CB 4.04Å; W84-A97 HydrophobicContact CE3-CB 4.39Å; W84-A97 HydrophobicContact CG-CB 3.97Å; W84-A100 HydrophobicContact CH2-CB 3.83Å; W84-A100 HydrophobicContact CZ2-CB 4.19Å
85	G	56	Low	63.9	Low	68 Å²	68	80.2 Å²	80.2	70%	0.701	49%	0.486	S	S	*	.			trans	84.3	24.8	-174.8	0	0	0	0	0	114	G82 C83 G87	G82-G85 PolarHBondContact O-N 2.95Å; C83-G85 VanDerWaalsContact C-N 3.34Å; G85-G87 PolarHBondContact O-N 3.38Å
86	W	55.4	Low	63.2	Low	55 Å²	55	81.2 Å²	81.2	21%	0.208	50%	0.502	C	S	.	.			trans	-72.7	105.3	-175	-150.1	-37.3	0	0	0	110.7	A79 W90	A79-W86 VanDerWaalsContact CA-CE3 3.5Å; A79-W86 HydrophobicContact CB-CE3 3.51Å; A79-W86 HydrophobicContact CB-CH2 3.94Å; A79-W86 HydrophobicContact CB-CZ3 3.06Å; W86-W90 HydrophobicContact CZ2-CE3 4.3Å; W86-W90 HydrophobicContact CZ2-CZ3 4.34Å
87	G	53.6	Low	62.9	Low	46 Å²	46	76.2 Å²	76.2	47%	0.474	48%	0.475	S	S	.	.			trans	-71	161.9	170	0	0	0	0	0	112.1	G85 S89	G85-G87 PolarHBondContact O-N 3.38Å; G87-S89 PolarHBondContact O-N 2.79Å
88	S	51.3	Low	62.7	Low	133 Å²	133	78.8 Å²	78.8	93%	0.93	48%	0.48	S	S	*	.	S	Bend	trans	-60.3	-3.2	-175.1	51.7	0	0	0	0	116.4
89	S	48.7	Very low	62.7	Low	62 Å²	62	82.4 Å²	82.4	43%	0.434	50%	0.495	S	S	.	.			trans	-101.4	121.9	174	62.8	0	0	0	0	111.4	G87 T91	G87-S89 PolarHBondContact O-N 2.79Å; S89-T91 WeakPolarHBondContact CB-OG1 3.28Å; S89-T91 PolarHBondContact O-N 2.87Å; S89-T91 PolarHBondContact OG-OG1 2.93Å
90	W	54.7	Low	63.3	Low	220 Å²	220	83 Å²	83	83%	0.833	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	7.9	175	-77.7	77	0	0	0	115.1	W86	W86-W90 HydrophobicContact CZ2-CE3 4.3Å; W86-W90 HydrophobicContact CZ2-CZ3 4.34Å
91	T	51.2	Low	64	Low	117 Å²	117	80.9 Å²	80.9	72%	0.718	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-13.6	-169.3	47.2	0	0	0	0	114.7	S89	S89-T91 WeakPolarHBondContact CB-OG1 3.28Å; S89-T91 PolarHBondContact O-N 2.87Å; S89-T91 PolarHBondContact OG-OG1 2.93Å
92	Q	53	Low	64.5	Low	160 Å²	160	79.9 Å²	79.9	75%	0.748	47%	0.472	S	S	*	.			trans	-131.2	94.4	177.7	-72.2	-177	-12.9	0	0	110.7
93	V	58.6	Low	65.5	Low	60 Å²	60	82.6 Å²	82.6	36%	0.364	48%	0.482	S	S	.	.			trans	-75.2	123.8	172.4	-175.8	0	0	0	0	108.2	E95 L98	V93-E95 PolarHBondContact O-N 3.3Å; V93-L98 HydrophobicContact CB-CD1 4.21Å; V93-L98 HydrophobicContact CG1-CD1 4Å; V93-L98 HydrophobicContact CG1-CD2 4.33Å; V93-L98 HydrophobicContact CG1-CG 3.77Å
94	P	68.5	Low	66.6	Low	32 Å²	32	79 Å²	79	21%	0.208	46%	0.456	C	S	.	.			trans	-63.4	131.5	177.7	22.4	-30.5	0	0	0	110.8	W84 A96 A97 L98	W84-P94 HydrophobicContact CB-CG 3.71Å; W84-P94 WeakPolarHBondContact O-CB 2.92Å; W84-P94 VanDerWaalsContact O-CG 3.31Å; W84-P94 WeakPolarHBondContact O-CG 3.49Å; P94-A96 PolarHBondContact O-N 2.86Å; P94-A96 VanDerWaalsContact O-N 3.14Å; P94-A97 HydrophobicContact CG-CB 4Å; P94-A97 WeakPolarHBondContact O-CB 3.45Å; P94-A97 PolarHBondContact O-N 2.79Å; P94-L98 PolarHBondContact O-N 3.37Å
95	E	66.8	Low	67.9	Low	137 Å²	137	77.5 Å²	77.5	64%	0.64	46%	0.458	S	S	*	.	H	α-helix	trans	-53.8	-36.4	-176.9	-64.4	177.4	173.1	0	0	112.8	V93 A97 L98 L99	V93-E95 PolarHBondContact O-N 3.3Å; E95-A97 VanDerWaalsContact C-N 3.27Å; E95-A97 PolarHBondContact O-N 3.43Å; E95-L98 PolarHBondContact O-N 3.46Å; E95-L99 WeakPolarHBondContact O-CG 3.45Å; E95-L99 PolarHBondContact O-N 2.94Å
96	A	70.4	Confident	69.2	Low	55 Å²	55	78 Å²	78	46%	0.455	45%	0.445	S	S	.	.	H	α-helix	trans	-60.2	-35.5	176.3	0	0	0	0	0	112.8	W84 P94 A100	W84-A96 HydrophobicContact CE3-CB 4.17Å; W84-A96 HydrophobicContact CZ3-CB 4.24Å; P94-A96 PolarHBondContact O-N 2.86Å; P94-A96 VanDerWaalsContact O-N 3.14Å; A96-A100 WeakPolarHBondContact O-CB 3.37Å; A96-A100 PolarHBondContact O-N 2.99Å
97	A	75.8	Confident	70.7	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-71.5	-41.5	177	0	0	0	0	0	110.9	W75 W84 P94 E95 L99 A100 L101	W75-A97 HydrophobicContact CZ2-CB 4.24Å; W75-A97 PolarHBondContact NE1-O 2.81Å; W84-A97 HydrophobicContact CB-CB 4.26Å; W84-A97 HydrophobicContact CD2-CB 4.04Å; W84-A97 HydrophobicContact CE3-CB 4.39Å; W84-A97 HydrophobicContact CG-CB 3.97Å; P94-A97 HydrophobicContact CG-CB 4Å; P94-A97 WeakPolarHBondContact O-CB 3.45Å; P94-A97 PolarHBondContact O-N 2.79Å; E95-A97 VanDerWaalsContact C-N 3.27Å; E95-A97 PolarHBondContact O-N 3.43Å; A97-L99 VanDerWaalsContact C-N 3.35Å; A97-L99 PolarHBondContact O-N 3.23Å; A97-A100 PolarHBondContact O-N 3.25Å; A97-L101 PolarHBondContact O-N 2.99Å
98	L	76.6	Confident	72.5	Confident	92 Å²	92	77.7 Å²	77.7	48%	0.482	44%	0.441	S	S	.	.	H	α-helix	trans	-62.8	-40.3	175.4	-76.3	162.3	0	0	0	112.1	V93 P94 E95 L101 A102	V93-L98 HydrophobicContact CB-CD1 4.21Å; V93-L98 HydrophobicContact CG1-CD1 4Å; V93-L98 HydrophobicContact CG1-CD2 4.33Å; V93-L98 HydrophobicContact CG1-CG 3.77Å; P94-L98 PolarHBondContact O-N 3.37Å; E95-L98 PolarHBondContact O-N 3.46Å; L98-L101 WeakPolarHBondContact O-CB 3.24Å; L98-L101 PolarHBondContact O-N 2.86Å; L98-A102 WeakPolarHBondContact O-CB 3.31Å; L98-A102 PolarHBondContact O-N 3.22Å
99	L	77.1	Confident	74.2	Confident	99 Å²	99	73.6 Å²	73.6	52%	0.518	42%	0.415	S	S	.	.	H	α-helix	trans	-65.6	-41.3	174.9	-71.7	169.8	0	0	0	112.2	E95 A97 L101 A102 T103	E95-L99 WeakPolarHBondContact O-CG 3.45Å; E95-L99 PolarHBondContact O-N 2.94Å; A97-L99 VanDerWaalsContact C-N 3.35Å; A97-L99 PolarHBondContact O-N 3.23Å; L99-L101 VanDerWaalsContact C-N 3.3Å; L99-L101 PolarHBondContact O-N 3.46Å; L99-A102 PolarHBondContact O-N 3.18Å; L99-T103 WeakPolarHBondContact O-CG2 3.25Å; L99-T103 PolarHBondContact O-N 3.49Å; L99-T103 PolarHBondContact O-OG1 2.82Å
100	A	81.7	Confident	75.9	Confident	21 Å²	21	74.4 Å²	74.4	17%	0.174	41%	0.414	C	S	.	.	H	α-helix	trans	-61.5	-39.3	173.3	0	0	0	0	0	111.6	W84 A96 A97 T103 I104	W84-A100 HydrophobicContact CH2-CB 3.83Å; W84-A100 HydrophobicContact CZ2-CB 4.19Å; A96-A100 WeakPolarHBondContact O-CB 3.37Å; A96-A100 PolarHBondContact O-N 2.99Å; A97-A100 PolarHBondContact O-N 3.25Å; A100-T103 WeakPolarHBondContact CA-OG1 3.45Å; A100-T103 PolarHBondContact O-OG1 2.86Å; A100-I104 WeakPolarHBondContact O-CD1 3.47Å; A100-I104 WeakPolarHBondContact O-CG1 3.46Å; A100-I104 PolarHBondContact O-N 3.26Å; A100-I104 VanDerWaalsContact O-N 3.11Å
101	L	84.9	Confident	77.5	Confident	47 Å²	47	65.8 Å²	65.8	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-66.7	-45.8	175.1	-174.6	64	0	0	0	111.8	Y72 W75 A97 L98 L99 T103 I104 C105	Y72-L101 HydrophobicContact CD1-CD1 3.91Å; Y72-L101 HydrophobicContact CE1-CD1 3.85Å; W75-L101 HydrophobicContact CD2-CB 4.4Å; W75-L101 HydrophobicContact CD2-CD1 4.08Å; W75-L101 HydrophobicContact CE3-CD1 4.2Å; W75-L101 HydrophobicContact CH2-CD2 3.98Å; W75-L101 HydrophobicContact CZ2-CB 3.91Å; W75-L101 HydrophobicContact CZ2-CD2 3.99Å; W75-L101 HydrophobicContact CZ2-CG 4.37Å; W75-L101 HydrophobicContact CZ3-CD1 4.48Å; W75-L101 HydrophobicContact CZ3-CD2 4.44Å; A97-L101 PolarHBondContact O-N 2.99Å; L98-L101 WeakPolarHBondContact O-CB 3.24Å; L98-L101 PolarHBondContact O-N 2.86Å; L99-L101 VanDerWaalsContact C-N 3.3Å; L99-L101 PolarHBondContact O-N 3.46Å; L101-T103 VanDerWaalsContact C-N 3.34Å; L101-T103 PolarHBondContact O-N 2.85Å; L101-I104 PolarHBondContact O-N 2.9Å; L101-C105 WeakPolarHBondContact O-CB 3.45Å; L101-C105 PolarHBondContact O-N 2.79Å; L101-C105 PolarHBondContact O-SG 3.4Å; L101-C105 VanDerWaalsContact O-SG 3.34Å
102	A	81.6	Confident	79.2	Confident	55 Å²	55	63.2 Å²	63.2	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-61.1	-42	179.1	0	0	0	0	0	111.9	L98 L99 C105 L106	L98-A102 WeakPolarHBondContact O-CB 3.31Å; L98-A102 PolarHBondContact O-N 3.22Å; L99-A102 PolarHBondContact O-N 3.18Å; A102-C105 PolarHBondContact O-N 2.86Å; A102-L106 WeakPolarHBondContact O-CB 3.18Å; A102-L106 PolarHBondContact O-N 3.5Å
103	T	83.9	Confident	80.7	Confident	88 Å²	88	57.3 Å²	57.3	54%	0.54	34%	0.343	S	S	.	.	H	α-helix	trans	-66.1	-39.6	176.2	50	0	0	0	0	112.4	L99 A100 L101 L106 A107	L99-T103 WeakPolarHBondContact O-CG2 3.25Å; L99-T103 PolarHBondContact O-N 3.49Å; L99-T103 PolarHBondContact O-OG1 2.82Å; A100-T103 WeakPolarHBondContact CA-OG1 3.45Å; A100-T103 PolarHBondContact O-OG1 2.86Å; L101-T103 VanDerWaalsContact C-N 3.34Å; L101-T103 PolarHBondContact O-N 2.85Å; T103-L106 PolarHBondContact O-N 2.83Å; T103-A107 VanDerWaalsContact O-CB 3.3Å; T103-A107 WeakPolarHBondContact O-CB 3.36Å; T103-A107 PolarHBondContact O-N 2.91Å
104	I	88.3	Confident	81.9	Confident	25 Å²	25	56.1 Å²	56.1	13%	0.128	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-44.8	172.8	-68.3	164.2	0	0	0	110.6	F67 L71 Y72 W75 A100 L101 A107 H108	F67-I104 HydrophobicContact CD1-CG2 4.05Å; L71-I104 HydrophobicContact CB-CD1 4.31Å; L71-I104 HydrophobicContact CB-CG1 4.43Å; L71-I104 HydrophobicContact CB-CG2 3.98Å; Y72-I104 HydrophobicContact CD1-CG2 4.03Å; Y72-I104 HydrophobicContact CE1-CG2 3.7Å; Y72-I104 HydrophobicContact CE2-CG2 4.35Å; Y72-I104 HydrophobicContact CG-CG2 4.48Å; W75-I104 HydrophobicContact CB-CD1 4.2Å; A100-I104 WeakPolarHBondContact O-CD1 3.47Å; A100-I104 WeakPolarHBondContact O-CG1 3.46Å; A100-I104 PolarHBondContact O-N 3.26Å; A100-I104 VanDerWaalsContact O-N 3.11Å; L101-I104 PolarHBondContact O-N 2.9Å; I104-A107 PolarHBondContact O-N 3.22Å; I104-H108 VanDerWaalsContact O-CB 3.31Å; I104-H108 WeakPolarHBondContact O-CB 3.42Å; I104-H108 PolarHBondContact O-N 2.7Å
105	C	87.1	Confident	82.6	Confident	55 Å²	55	55 Å²	55	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-62.3	-42.8	176.7	-73.2	0	0	0	0	112.4	Y72 L101 A102 H108 A109	Y72-C105 PolarHBondContact OH-SG 3.23Å; Y72-C105 VanDerWaalsContact OH-SG 3.34Å; L101-C105 WeakPolarHBondContact O-CB 3.45Å; L101-C105 PolarHBondContact O-N 2.79Å; L101-C105 PolarHBondContact O-SG 3.4Å; L101-C105 VanDerWaalsContact O-SG 3.34Å; A102-C105 PolarHBondContact O-N 2.86Å; C105-H108 PolarHBondContact O-N 3.01Å; C105-A109 WeakPolarHBondContact O-CB 3.4Å; C105-A109 PolarHBondContact O-N 3.19Å
106	L	84.8	Confident	83.3	Confident	79 Å²	79	53.5 Å²	53.5	41%	0.414	32%	0.324	S	S	.	.	H	α-helix	trans	-65.4	-44.7	177	-174.9	66.2	0	0	0	111.4	A102 T103 H108 A109 L110 F249	A102-L106 WeakPolarHBondContact O-CB 3.18Å; A102-L106 PolarHBondContact O-N 3.5Å; T103-L106 PolarHBondContact O-N 2.83Å; L106-H108 VanDerWaalsContact C-N 3.29Å; L106-H108 PolarHBondContact O-N 3.11Å; L106-A109 PolarHBondContact O-N 3.34Å; L106-L110 HydrophobicContact CG-CD1 4.19Å; L106-L110 WeakPolarHBondContact O-CB 3.43Å; L106-L110 WeakPolarHBondContact O-CG 3.19Å; L106-L110 PolarHBondContact O-N 3.22Å; L106-F249 HydrophobicContact CD1-CD2 4.47Å; L106-F249 HydrophobicContact CD1-CE2 4.2Å
107	A	86.9	Confident	83.8	Confident	43 Å²	43	56.2 Å²	56.2	36%	0.355	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-37.6	174.9	0	0	0	0	0	111.8	F67 T103 I104 T111	F67-A107 HydrophobicContact CE1-CB 4.02Å; F67-A107 HydrophobicContact CZ-CB 4.28Å; T103-A107 VanDerWaalsContact O-CB 3.3Å; T103-A107 WeakPolarHBondContact O-CB 3.36Å; T103-A107 PolarHBondContact O-N 2.91Å; I104-A107 PolarHBondContact O-N 3.22Å; A107-T111 WeakPolarHBondContact O-CB 3.11Å; A107-T111 VanDerWaalsContact O-CG2 3.29Å; A107-T111 WeakPolarHBondContact O-CG2 3.23Å; A107-T111 PolarHBondContact O-N 2.74Å; A107-T111 PolarHBondContact O-OG1 3.41Å
108	H	90.2	Very high	84.1	Confident	52 Å²	52	58.4 Å²	58.4	24%	0.241	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-46.3	174.7	-170.6	-169.2	0	0	0	111.4	T63 F67 Y72 I104 C105 L106 L110 T111 V112	T63-H108 PolarHBondContact O-CD2 3.38Å; T63-H108 VanDerWaalsContact O-CD2 3.3Å; T63-H108 PolarHBondContact O-NE2 3.46Å; T63-H108 VanDerWaalsContact O-NE2 3.08Å; F67-H108 HydrophobicContact CD1-CB 3.58Å; F67-H108 AromaticContact CD1-CG 3.94Å; F67-H108 HydrophobicContact CD2-CB 4.4Å; F67-H108 AromaticContact CD2-CD2 3.81Å; F67-H108 HydrophobicContact CE1-CB 3.66Å; F67-H108 HydrophobicContact CE2-CB 4.47Å; F67-H108 HydrophobicContact CG-CB 3.97Å; F67-H108 AromaticContact CG-CD2 3.91Å; F67-H108 AromaticContact CG-CG 3.81Å; F67-H108 HydrophobicContact CZ-CB 4.13Å; Y72-H108 AromaticContact CE2-ND1 3.8Å; Y72-H108 PolarHBondContact OH-ND1 3.28Å; I104-H108 VanDerWaalsContact O-CB 3.31Å; I104-H108 WeakPolarHBondContact O-CB 3.42Å; I104-H108 PolarHBondContact O-N 2.7Å; C105-H108 PolarHBondContact O-N 3.01Å; L106-H108 VanDerWaalsContact C-N 3.29Å; L106-H108 PolarHBondContact O-N 3.11Å; H108-L110 PolarHBondContact O-N 3.46Å; H108-T111 WeakPolarHBondContact CA-OG1 3.5Å; H108-T111 PolarHBondContact O-N 3.01Å; H108-T111 PolarHBondContact O-OG1 2.88Å; H108-V112 WeakPolarHBondContact O-CG2 3.45Å; H108-V112 PolarHBondContact O-N 3.33Å; H108-V112 VanDerWaalsContact O-N 3.09Å
109	A	87	Confident	84.4	Confident	47 Å²	47	56.1 Å²	56.1	39%	0.388	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-45.3	175.9	0	0	0	0	0	112	C105 L106 T111 V112 L113	C105-A109 WeakPolarHBondContact O-CB 3.4Å; C105-A109 PolarHBondContact O-N 3.19Å; L106-A109 PolarHBondContact O-N 3.34Å; A109-T111 PolarHBondContact O-N 2.68Å; A109-V112 PolarHBondContact O-N 2.94Å; A109-L113 WeakPolarHBondContact O-CB 3.32Å; A109-L113 WeakPolarHBondContact O-CG 3.3Å; A109-L113 PolarHBondContact O-N 3.03Å
110	L	84.8	Confident	84.8	Confident	78 Å²	78	56.2 Å²	56.2	41%	0.408	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-39.3	178.2	-75.1	171.6	0	0	0	112.7	L106 H108 V112 L113 S114 W117	L106-L110 HydrophobicContact CG-CD1 4.19Å; L106-L110 WeakPolarHBondContact O-CB 3.43Å; L106-L110 WeakPolarHBondContact O-CG 3.19Å; L106-L110 PolarHBondContact O-N 3.22Å; H108-L110 PolarHBondContact O-N 3.46Å; L110-V112 VanDerWaalsContact C-N 3.34Å; L110-L113 PolarHBondContact O-N 3.48Å; L110-S114 VanDerWaalsContact O-CB 3.31Å; L110-S114 WeakPolarHBondContact O-CB 3.43Å; L110-S114 PolarHBondContact O-N 3.28Å; L110-W117 HydrophobicContact CD2-CH2 4.31Å
111	T	87.6	Confident	85	Confident	39 Å²	39	56.4 Å²	56.4	24%	0.239	33%	0.327	C	S	.	.	H	α-helix	trans	-65.1	-39.1	175.6	50.7	0	0	0	0	111.5	F67 A107 H108 A109 S114 L125	F67-T111 HydrophobicContact CE2-CG2 4.05Å; F67-T111 WeakPolarHBondContact CE2-OG1 3.13Å; F67-T111 HydrophobicContact CZ-CG2 3.98Å; A107-T111 WeakPolarHBondContact O-CB 3.11Å; A107-T111 VanDerWaalsContact O-CG2 3.29Å; A107-T111 WeakPolarHBondContact O-CG2 3.23Å; A107-T111 PolarHBondContact O-N 2.74Å; A107-T111 PolarHBondContact O-OG1 3.41Å; H108-T111 WeakPolarHBondContact CA-OG1 3.5Å; H108-T111 PolarHBondContact O-N 3.01Å; H108-T111 PolarHBondContact O-OG1 2.88Å; A109-T111 PolarHBondContact O-N 2.68Å; T111-S114 PolarHBondContact O-OG 3.33Å; T111-L125 WeakPolarHBondContact O-CD1 3.46Å
112	V	87.4	Confident	85	Confident	63 Å²	63	57.2 Å²	57.2	38%	0.382	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-47.1	173.1	173.5	0	0	0	0	111.6	T63 H108 A109 L110 S114 G115	T63-V112 HydrophobicContact CG2-CG2 4.49Å; H108-V112 WeakPolarHBondContact O-CG2 3.45Å; H108-V112 PolarHBondContact O-N 3.33Å; H108-V112 VanDerWaalsContact O-N 3.09Å; A109-V112 PolarHBondContact O-N 2.94Å; L110-V112 VanDerWaalsContact C-N 3.34Å; V112-S114 VanDerWaalsContact C-N 3.34Å; V112-S114 PolarHBondContact O-N 3.43Å; V112-G115 PolarHBondContact O-N 3.23Å
113	L	85.5	Confident	85.2	Confident	37 Å²	37	54.7 Å²	54.7	19%	0.194	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-34.5	179	-72.4	171.3	0	0	0	112.8	A109 L110 G115 H116 W117 V245	A109-L113 WeakPolarHBondContact O-CB 3.32Å; A109-L113 WeakPolarHBondContact O-CG 3.3Å; A109-L113 PolarHBondContact O-N 3.03Å; L110-L113 PolarHBondContact O-N 3.48Å; L113-G115 PolarHBondContact O-N 2.98Å; L113-H116 WeakPolarHBondContact O-CA 3.27Å; L113-H116 WeakPolarHBondContact O-CB 3.4Å; L113-H116 PolarHBondContact O-N 2.97Å; L113-W117 HydrophobicContact CB-CH2 4.31Å; L113-W117 HydrophobicContact CB-CZ2 4.11Å; L113-W117 HydrophobicContact CD1-CZ2 4.47Å; L113-W117 PolarHBondContact O-N 2.77Å; L113-V245 HydrophobicContact CD1-CG1 4Å
114	S	83.8	Confident	85.3	Confident	34 Å²	34	53.6 Å²	53.6	24%	0.238	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-32	175.9	76.7	0	0	0	0	112.2	L110 T111 V112 H116 W117 S118 A121 L125	L110-S114 VanDerWaalsContact O-CB 3.31Å; L110-S114 WeakPolarHBondContact O-CB 3.43Å; L110-S114 PolarHBondContact O-N 3.28Å; T111-S114 PolarHBondContact O-OG 3.33Å; V112-S114 VanDerWaalsContact C-N 3.34Å; V112-S114 PolarHBondContact O-N 3.43Å; S114-H116 VanDerWaalsContact C-N 3.26Å; S114-H116 PolarHBondContact O-N 2.87Å; S114-W117 PolarHBondContact O-N 3.14Å; S114-S118 PolarHBondContact O-N 2.87Å; S114-A121 WeakPolarHBondContact O-CB 3.26Å; S114-L125 WeakPolarHBondContact OG-CD1 3.32Å
115	G	82.6	Confident	85.2	Confident	9 Å²	9	53.9 Å²	53.9	9%	0.093	31%	0.31	C	S	.	.	H	α-helix	trans	-71.2	-16	172.2	0	0	0	0	0	114.2	V112 L113 H122	V112-G115 PolarHBondContact O-N 3.23Å; L113-G115 PolarHBondContact O-N 2.98Å; G115-H122 VanDerWaalsContact O-CB 3.27Å; G115-H122 WeakPolarHBondContact O-CB 3.33Å; G115-H122 PolarHBondContact O-ND1 2.95Å
116	H	81.9	Confident	85.2	Confident	106 Å²	106	51.9 Å²	51.9	49%	0.491	30%	0.297	S	S	.	.	H	α-helix	trans	-88.3	-35.8	170.2	-85.8	-75.5	0	0	0	112.2	L113 S114	L113-H116 WeakPolarHBondContact O-CA 3.27Å; L113-H116 WeakPolarHBondContact O-CB 3.4Å; L113-H116 PolarHBondContact O-N 2.97Å; S114-H116 VanDerWaalsContact C-N 3.26Å; S114-H116 PolarHBondContact O-N 2.87Å
117	W	80.2	Confident	85.3	Confident	111 Å²	111	48.5 Å²	48.5	42%	0.42	28%	0.279	S	S	.	.	H	α-helix	trans	-75.4	-28.1	-178.4	-61.4	-27.3	0	0	0	114.2	L110 L113 S114 T240 P242	L110-W117 HydrophobicContact CD2-CH2 4.31Å; L113-W117 HydrophobicContact CB-CH2 4.31Å; L113-W117 HydrophobicContact CB-CZ2 4.11Å; L113-W117 HydrophobicContact CD1-CZ2 4.47Å; L113-W117 PolarHBondContact O-N 2.77Å; S114-W117 PolarHBondContact O-N 3.14Å; W117-T240 PolarHBondContact NE1-O 3.48Å; W117-P242 HydrophobicContact CD2-CG 4.31Å; W117-P242 HydrophobicContact CZ2-CB 4.27Å; W117-P242 HydrophobicContact CZ2-CG 4.18Å
118	S	82.5	Confident	85.3	Confident	46 Å²	46	49 Å²	49	32%	0.322	28%	0.278	S	S	.	.			trans	-137.5	123.9	-177.9	174.8	0	0	0	0	111.7	S114 H120 A121 H122	S114-S118 PolarHBondContact O-N 2.87Å; S118-H120 PolarHBondContact O-N 2.9Å; S118-H120 PolarHBondContact OG-N 2.86Å; S118-A121 PolarHBondContact O-N 3.02Å; S118-A121 VanDerWaalsContact O-N 3.15Å; S118-A121 PolarHBondContact OG-N 3.07Å; S118-H122 PolarHBondContact O-N 2.95Å
119	V	83.4	Confident	85	Confident	45 Å²	45	49.5 Å²	49.5	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-60.7	-33.9	172.9	-179.2	0	0	0	0	111	H122 C123 T150 L152	V119-H122 WeakPolarHBondContact O-CB 3.32Å; V119-H122 PolarHBondContact O-N 3.35Å; V119-C123 WeakPolarHBondContact O-CB 3.28Å; V119-C123 PolarHBondContact O-N 3.35Å; V119-C123 PolarHBondContact O-SG 2.89Å; V119-T150 HydrophobicContact CG1-CG2 4.38Å; V119-T150 WeakPolarHBondContact CG2-O 3.39Å; V119-L152 HydrophobicContact CG1-CB 3.96Å
120	H	85.7	Confident	84.8	Confident	100 Å²	100	49 Å²	49	46%	0.463	28%	0.275	S	S	.	.	H	α-helix	trans	-66	-43	175.9	-60.4	-36.6	0	0	0	112	S118 C123 A124 K140	S118-H120 PolarHBondContact O-N 2.9Å; S118-H120 PolarHBondContact OG-N 2.86Å; H120-C123 PolarHBondContact O-N 2.84Å; H120-A124 WeakPolarHBondContact O-CB 3.43Å; H120-A124 PolarHBondContact O-N 3.35Å; H120-K140 VanDerWaalsContact CE1-CE 3.41Å; H120-K140 WeakPolarHBondContact CE1-CE 3.27Å; H120-K140 PolarHBondContact CE1-NZ 3.12Å; H120-K140 WeakPolarHBondContact ND1-CE 3.41Å; H120-K140 PolarHBondContact ND1-NZ 2.96Å
121	A	84.8	Confident	84.4	Confident	26 Å²	26	52.9 Å²	52.9	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-41.5	174.3	0	0	0	0	0	110.8	S114 S118 C123 A124 L125	S114-A121 WeakPolarHBondContact O-CB 3.26Å; S118-A121 PolarHBondContact O-N 3.02Å; S118-A121 VanDerWaalsContact O-N 3.15Å; S118-A121 PolarHBondContact OG-N 3.07Å; A121-C123 PolarHBondContact O-N 3.15Å; A121-A124 PolarHBondContact O-N 3.04Å; A121-L125 WeakPolarHBondContact O-CB 3.39Å; A121-L125 VanDerWaalsContact O-CG 3.23Å; A121-L125 WeakPolarHBondContact O-CG 3.24Å; A121-L125 PolarHBondContact O-N 3.15Å
122	H	85.1	Confident	83.9	Confident	63 Å²	63	54.6 Å²	54.6	29%	0.292	29%	0.293	S	S	.	.	H	α-helix	trans	-56.1	-50.3	175.8	-163.6	82.9	0	0	0	111.9	G115 S118 V119 A124 L125 T126	G115-H122 VanDerWaalsContact O-CB 3.27Å; G115-H122 WeakPolarHBondContact O-CB 3.33Å; G115-H122 PolarHBondContact O-ND1 2.95Å; S118-H122 PolarHBondContact O-N 2.95Å; V119-H122 WeakPolarHBondContact O-CB 3.32Å; V119-H122 PolarHBondContact O-N 3.35Å; H122-A124 VanDerWaalsContact C-N 3.34Å; H122-A124 PolarHBondContact O-N 3.43Å; H122-L125 PolarHBondContact O-N 2.86Å; H122-T126 PolarHBondContact CD2-OG1 2.93Å; H122-T126 PolarHBondContact NE2-OG1 3.19Å; H122-T126 PolarHBondContact O-N 2.66Å; H122-T126 PolarHBondContact O-OG1 3.47Å
123	C	85.5	Confident	83.5	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.02	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-42.9	177.8	-68.1	0	0	0	0	111.5	Y53 V119 H120 A121 C127	Y53-C123 HydrophobicContact CD1-CB 4.39Å; Y53-C123 HydrophobicContact CE1-CB 3.97Å; V119-C123 WeakPolarHBondContact O-CB 3.28Å; V119-C123 PolarHBondContact O-N 3.35Å; V119-C123 PolarHBondContact O-SG 2.89Å; H120-C123 PolarHBondContact O-N 2.84Å; A121-C123 PolarHBondContact O-N 3.15Å; C123-C127 CarbonylContact O-C 3.44Å; C123-C127 WeakPolarHBondContact O-CA 3.34Å; C123-C127 VanDerWaalsContact O-CB 3.32Å; C123-C127 WeakPolarHBondContact O-CB 3.41Å; C123-C127 PolarHBondContact O-N 2.81Å
124	A	85.9	Confident	83.2	Confident	65 Å²	65	52.5 Å²	52.5	54%	0.537	28%	0.284	S	S	.	.	H	α-helix	trans	-66.8	-37.7	179.7	0	0	0	0	0	112.9	L62 H120 A121 H122	L62-A124 WeakPolarHBondContact CD1-O 3.09Å; H120-A124 WeakPolarHBondContact O-CB 3.43Å; H120-A124 PolarHBondContact O-N 3.35Å; A121-A124 PolarHBondContact O-N 3.04Å; H122-A124 VanDerWaalsContact C-N 3.34Å; H122-A124 PolarHBondContact O-N 3.43Å
125	L	86.6	Confident	83.1	Confident	31 Å²	31	57.4 Å²	57.4	16%	0.162	30%	0.298	C	S	.	.	H	α-helix	trans	-84	-30.9	-174.4	-68.5	170.7	0	0	0	113.8	L62 T63 T111 S114 A121 H122	L62-L125 HydrophobicContact CB-CD2 3.94Å; L62-L125 PolarHBondContact N-O 3.47Å; T63-L125 HydrophobicContact CG2-CB 4.11Å; T63-L125 HydrophobicContact CG2-CD1 4.47Å; T111-L125 WeakPolarHBondContact O-CD1 3.46Å; S114-L125 WeakPolarHBondContact OG-CD1 3.32Å; A121-L125 WeakPolarHBondContact O-CB 3.39Å; A121-L125 VanDerWaalsContact O-CG 3.23Å; A121-L125 WeakPolarHBondContact O-CG 3.24Å; A121-L125 PolarHBondContact O-N 3.15Å; H122-L125 PolarHBondContact O-N 2.86Å
126	T	86.3	Confident	83.1	Confident	13 Å²	13	57 Å²	57	8%	0.08	29%	0.293	C	S	.	.	H	α-helix	trans	-122.1	-11.8	-168.9	68.7	0	0	0	0	114.5	L56 T63 H122	L56-T126 WeakPolarHBondContact CB-O 3.41Å; L56-T126 PolarHBondContact N-O 2.92Å; T63-T126 HydrophobicContact CG2-CG2 4.39Å; H122-T126 PolarHBondContact CD2-OG1 2.93Å; H122-T126 PolarHBondContact NE2-OG1 3.19Å; H122-T126 PolarHBondContact O-N 2.66Å; H122-T126 PolarHBondContact O-OG1 3.47Å
127	C	87	Confident	83.3	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.054	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	160.1	-174.6	-54.8	0	0	0	0	112.3	Y53 R54 C123	Y53-C127 HydrophobicContact CD1-CB 3.62Å; Y53-C127 HydrophobicContact CG-CB 4.17Å; R54-C127 VanDerWaalsContact O-CA 3.29Å; R54-C127 WeakPolarHBondContact O-CA 3.49Å; C123-C127 CarbonylContact O-C 3.44Å; C123-C127 WeakPolarHBondContact O-CA 3.34Å; C123-C127 VanDerWaalsContact O-CB 3.32Å; C123-C127 WeakPolarHBondContact O-CB 3.41Å; C123-C127 PolarHBondContact O-N 2.81Å
128	T	87.4	Confident	83.8	Confident	53 Å²	53	51.4 Å²	51.4	33%	0.325	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.4	167.5	51.5	0	0	0	0	109.5	Y53 R54 L56	Y53-T128 WeakPolarHBondContact CA-O 3.15Å; R54-T128 PolarHBondContact N-O 3.11Å; R54-T128 PolarHBondContact O-N 2.82Å; L56-T128 HydrophobicContact CD1-CG2 4.03Å; L56-T128 HydrophobicContact CD2-CG2 3.69Å; L56-T128 HydrophobicContact CG-CG2 3.94Å
129	P	84.3	Confident	84.1	Confident	62 Å²	62	49.3 Å²	49.3	40%	0.403	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	137.7	173.9	27.9	-32.9	0	0	0	109.5	Y53	Y53-P129 HydrophobicContact CE1-CB 4.15Å
130	E	83.7	Confident	84.4	Confident	37 Å²	37	48.1 Å²	48.1	17%	0.173	25%	0.252	C	S	.	.			trans	-125.3	136.5	179.4	-165.5	81.7	-151.1	0	0	109.1	P52 R54 R135	P52-E130 WeakPolarHBondContact CB-O 3.4Å; P52-E130 WeakPolarHBondContact CG-O 3.46Å; P52-E130 PolarHBondContact O-N 3.24Å; P52-E130 VanDerWaalsContact O-N 3.09Å; R54-E130 HydrophobicContact CB-CB 4.41Å; E130-R135 HydrophobicContact CG-CB 4.06Å; E130-R135 IonicContact OE1-NH1 2.69Å
131	Y	75.6	Confident	84.5	Confident	159 Å²	159	43.4 Å²	43.4	62%	0.624	23%	0.23	S	C	*	.	S	Bend	trans	-84.9	-24.7	-179.4	-65.2	-85	0	0	0	113	P133	Y131-P133 WeakPolarHBondContact O-CD 3.36Å
132	D	77.9	Confident	84.6	Confident	75 Å²	75	43.7 Å²	43.7	40%	0.401	23%	0.229	S	C	.	.			trans	-98.2	115.1	179.8	-170.7	-13.7	0	0	0	110.3	S134 R135 A136	D132-S134 PolarHBondContact O-N 3.47Å; D132-S134 WeakPolarHBondContact OD1-CB 3.23Å; D132-S134 PolarHBondContact OD1-N 3.14Å; D132-S134 PolarHBondContact OD1-OG 3.23Å; D132-S134 PolarHBondContact OD2-OG 3.18Å; D132-R135 HydrophobicContact CB-CG 4.39Å; D132-R135 PolarHBondContact O-N 3.01Å; D132-A136 PolarHBondContact O-N 3Å
133	P	78.3	Confident	84.6	Confident	7 Å²	7	41.3 Å²	41.3	5%	0.045	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-28.2	178.8	-26.5	37.7	0	0	0	113.7	L39 Y131 R135 A136 L167 Y178	L39-P133 HydrophobicContact CD1-CG 3.66Å; Y131-P133 WeakPolarHBondContact O-CD 3.36Å; P133-R135 VanDerWaalsContact C-N 3.29Å; P133-R135 PolarHBondContact O-N 3.2Å; P133-A136 WeakPolarHBondContact O-CB 3.44Å; P133-A136 PolarHBondContact O-N 2.86Å; P133-L167 HydrophobicContact CB-CD1 3.92Å; P133-Y178 HydrophobicContact CB-CE2 4.28Å; P133-Y178 HydrophobicContact CG-CE2 3.82Å
134	S	78.1	Confident	84.3	Confident	49 Å²	49	42.4 Å²	42.4	34%	0.343	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-31.1	-179	68.4	0	0	0	0	112.8	D132 R157	D132-S134 PolarHBondContact O-N 3.47Å; D132-S134 WeakPolarHBondContact OD1-CB 3.23Å; D132-S134 PolarHBondContact OD1-N 3.14Å; D132-S134 PolarHBondContact OD1-OG 3.23Å; D132-S134 PolarHBondContact OD2-OG 3.18Å; S134-R157 PolarHBondContact O-NH2 3.24Å
135	R	82.1	Confident	83.6	Confident	137 Å²	137	44.6 Å²	44.6	52%	0.517	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-11.7	179.3	-55.6	-176.1	88.3	-165	15.7	112.7	E130 D132 P133	E130-R135 HydrophobicContact CG-CB 4.06Å; E130-R135 IonicContact OE1-NH1 2.69Å; D132-R135 HydrophobicContact CB-CG 4.39Å; D132-R135 PolarHBondContact O-N 3.01Å; P133-R135 VanDerWaalsContact C-N 3.29Å; P133-R135 PolarHBondContact O-N 3.2Å
136	A	83.9	Confident	82.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.			trans	-73.2	146.8	179.2	0	0	0	0	0	111.8	P52 D132 P133 R157	P52-A136 HydrophobicContact CB-CB 3.54Å; D132-A136 PolarHBondContact O-N 3Å; P133-A136 WeakPolarHBondContact O-CB 3.44Å; P133-A136 PolarHBondContact O-N 2.86Å; A136-R157 PolarHBondContact O-NH2 3.08Å
137	T	86.3	Confident	82	Confident	52 Å²	52	48.1 Å²	48.1	32%	0.319	25%	0.253	S	S	.	.	S	Bend	trans	-111.3	-29.6	175.9	48	0	0	0	0	111.8	Y53 R55 L155	Y53-T137 PolarHBondContact O-N 3.12Å; Y53-T137 PolarHBondContact O-OG1 2.8Å; R55-T137 PolarHBondContact N-OG1 2.72Å; T137-L155 PolarHBondContact O-N 3Å
138	F	88.8	Confident	81.5	Confident	49 Å²	49	48.8 Å²	48.8	22%	0.215	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	160.7	-179.9	-66.8	-76.3	0	0	0	110	Y53 R55 L152 V153 A154	Y53-F138 PolarHBondContact N-O 3.27Å; Y53-F138 PolarHBondContact O-N 3.24Å; Y53-F138 VanDerWaalsContact O-O 3.05Å; R55-F138 HydrophobicContact CB-CD2 4.26Å; R55-F138 HydrophobicContact CB-CE2 3.94Å; R55-F138 HydrophobicContact CG-CE2 4.1Å; F138-L152 HydrophobicContact CB-CD1 3.79Å; F138-L152 HydrophobicContact CB-CG 4.08Å; F138-L152 HydrophobicContact CD1-CG 4.34Å; F138-L152 HydrophobicContact CG-CD2 4.46Å; F138-L152 HydrophobicContact CG-CG 4.35Å; F138-V153 CarbonylContact C-O 3.55Å; F138-V153 WeakPolarHBondContact CA-O 3.41Å; F138-A154 HydrophobicContact CD1-CB 4.17Å; F138-A154 HydrophobicContact CE1-CB 4Å
139	V	88.9	Confident	81	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	126.1	175.9	178.5	0	0	0	0	108.2	V50 W51 V141 V153 L155 F169	V50-V139 HydrophobicContact CB-CG1 4.43Å; V50-V139 HydrophobicContact CG1-CG1 3.11Å; W51-V139 WeakPolarHBondContact O-CA 3.48Å; V139-V141 HydrophobicContact CG1-CG2 4.06Å; V139-V153 PolarHBondContact N-O 3.32Å; V139-V153 PolarHBondContact O-N 3.24Å; V139-L155 HydrophobicContact CG2-CB 4.42Å; V139-L155 HydrophobicContact CG2-CD1 3.9Å; V139-F169 HydrophobicContact CG1-CE1 4.36Å
140	K	89.8	Confident	81	Confident	21 Å²	21	47.5 Å²	47.5	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	115.1	172.4	179.1	-176.7	168.7	-165.1	0	108	W51 Y53 H120 T150 L152	W51-K140 HydrophobicContact CE3-CD 3.87Å; W51-K140 HydrophobicContact CE3-CG 4.25Å; W51-K140 HydrophobicContact CZ3-CD 4.32Å; W51-K140 PolarHBondContact N-O 3Å; W51-K140 PolarHBondContact O-N 2.89Å; Y53-K140 HydrophobicContact CD2-CB 3.75Å; Y53-K140 HydrophobicContact CE2-CB 3.55Å; Y53-K140 HydrophobicContact CE2-CD 3.8Å; Y53-K140 HydrophobicContact CE2-CG 4.35Å; H120-K140 VanDerWaalsContact CE1-CE 3.41Å; H120-K140 WeakPolarHBondContact CE1-CE 3.27Å; H120-K140 PolarHBondContact CE1-NZ 3.12Å; H120-K140 WeakPolarHBondContact ND1-CE 3.41Å; H120-K140 PolarHBondContact ND1-NZ 2.96Å; K140-T150 HydrophobicContact CG-CG2 3.95Å; K140-L152 HydrophobicContact CB-CD1 4.16Å
141	V	87.9	Confident	81.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.4	-177.5	-174.2	0	0	0	0	108.9	V47 V139 T150 E151 V153 F169 F171	V47-V141 HydrophobicContact CB-CG1 4.35Å; V47-V141 HydrophobicContact CG1-CG1 3.59Å; V47-V141 HydrophobicContact CG2-CG1 3.76Å; V139-V141 HydrophobicContact CG1-CG2 4.06Å; V141-T150 WeakPolarHBondContact O-CA 3.23Å; V141-T150 WeakPolarHBondContact O-CG2 3.24Å; V141-E151 PolarHBondContact N-O 3.25Å; V141-E151 PolarHBondContact O-N 3.35Å; V141-V153 HydrophobicContact CG2-CG2 4.12Å; V141-F169 HydrophobicContact CG2-CD2 4.27Å; V141-F169 HydrophobicContact CG2-CE2 3.75Å; V141-F169 HydrophobicContact CG2-CZ 4.21Å; V141-F171 HydrophobicContact CB-CD2 3.95Å; V141-F171 HydrophobicContact CB-CE2 4.17Å; V141-F171 HydrophobicContact CB-CG 4.24Å; V141-F171 HydrophobicContact CG1-CB 4.33Å; V141-F171 HydrophobicContact CG1-CD1 3.74Å; V141-F171 HydrophobicContact CG1-CD2 3.83Å; V141-F171 HydrophobicContact CG1-CE1 3.92Å; V141-F171 HydrophobicContact CG1-CE2 4.01Å; V141-F171 HydrophobicContact CG1-CG 3.68Å; V141-F171 HydrophobicContact CG1-CZ 4.05Å; V141-F171 HydrophobicContact CG2-CD2 4.37Å; V141-F171 HydrophobicContact CG2-CG 4.49Å
142	V	86.5	Confident	81.7	Confident	33 Å²	33	43.6 Å²	43.6	20%	0.2	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.1	173	-178.7	0	0	0	0	108.4	A48 A49 W51 T150	A48-V142 PolarHBondContact N-O 3.44Å; A49-V142 HydrophobicContact CB-CB 4.31Å; A49-V142 PolarHBondContact N-O 3.01Å; A49-V142 VanDerWaalsContact N-O 3.17Å; A49-V142 PolarHBondContact O-N 3.28Å; W51-V142 HydrophobicContact CE3-CG2 3.98Å; W51-V142 HydrophobicContact CH2-CG2 3.91Å; W51-V142 HydrophobicContact CZ3-CB 4.46Å; W51-V142 HydrophobicContact CZ3-CG2 3.26Å; V142-T150 HydrophobicContact CG2-CG2 4.03Å
143	P	85.5	Confident	82.1	Confident	12 Å²	12	41 Å²	41	8%	0.078	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	162.9	176.2	28.8	-33.8	0	0	0	111.6	L46 N147 F171	L46-P143 CarbonylContact O-C 3.56Å; L46-P143 VanDerWaalsContact O-CA 3.29Å; L46-P143 WeakPolarHBondContact O-CA 3.43Å; P143-N147 HydrophobicContact CB-CB 4.37Å; P143-N147 WeakPolarHBondContact CB-O 3.06Å; P143-F171 HydrophobicContact CB-CE1 4.2Å; P143-F171 HydrophobicContact CB-CZ 4.07Å; P143-F171 HydrophobicContact CG-CZ 4.33Å
144	T	80.2	Confident	82.6	Confident	26 Å²	26	42.8 Å²	42.8	16%	0.16	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-61.2	156.9	167	48.2	0	0	0	0	110.8	E45 L46 A48 N146 N147	E45-T144 PolarHBondContact O-OG1 2.93Å; L46-T144 PolarHBondContact O-N 3.21Å; L46-T144 PolarHBondContact O-OG1 3.48Å; A48-T144 HydrophobicContact CB-CG2 4.11Å; T144-N146 PolarHBondContact O-N 3.24Å; T144-N147 PolarHBondContact O-N 3.25Å; T144-N147 PolarHBondContact OG1-ND2 3.26Å
145	P	70.6	Confident	83.1	Confident	112 Å²	112	41.2 Å²	41.2	73%	0.727	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	136.4	175.5	-20.7	32	0	0	0	109.2	N147	P145-N147 PolarHBondContact O-N 2.96Å
146	N	67.1	Low	83.3	Confident	74 Å²	74	39.5 Å²	39.5	40%	0.396	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	8.2	178.9	-54.6	-33.1	0	0	0	117.4	T144 G430	T144-N146 PolarHBondContact O-N 3.24Å; N146-G430 CarbonylContact C-O 3.53Å
147	N	72.8	Confident	83.4	Confident	44 Å²	44	45.1 Å²	45.1	24%	0.235	25%	0.251	C	S	.	.	S	Bend	trans	-114.4	44.6	177	-76	-48	0	0	0	113.5	E45 L46 P143 T144 P145 Q172	E45-N147 PolarHBondContact O-ND2 3.33Å; L46-N147 HydrophobicContact CD1-CB 3.92Å; P143-N147 HydrophobicContact CB-CB 4.37Å; P143-N147 WeakPolarHBondContact CB-O 3.06Å; T144-N147 PolarHBondContact O-N 3.25Å; T144-N147 PolarHBondContact OG1-ND2 3.26Å; P145-N147 PolarHBondContact O-N 2.96Å; N147-Q172 PolarHBondContact O-NE2 3.04Å
148	G	75.8	Confident	83	Confident	21 Å²	21	45.4 Å²	45.4	22%	0.216	25%	0.251	C	S	.	.			trans	96.5	-153.8	177.1	0	0	0	0	0	115.4	F429 G430	G148-F429 VanDerWaalsContact CA-O 3.31Å; G148-F429 WeakPolarHBondContact CA-O 3.44Å; G148-G430 PolarHBondContact N-O 3.23Å
149	S	77.4	Confident	82.4	Confident	56 Å²	56	50.4 Å²	50.4	39%	0.392	27%	0.272	S	S	.	.			trans	-117.2	159.2	-177.3	45.1	0	0	0	0	112.9	E151	S149-E151 PolarHBondContact O-N 3.45Å
150	T	84.8	Confident	81.2	Confident	32 Å²	32	51.3 Å²	51.3	20%	0.196	28%	0.282	C	S	.	.			trans	-63.1	131.6	172.6	-55.8	0	0	0	0	110.5	V119 K140 V141 V142	V119-T150 HydrophobicContact CG1-CG2 4.38Å; V119-T150 WeakPolarHBondContact CG2-O 3.39Å; K140-T150 HydrophobicContact CG-CG2 3.95Å; V141-T150 WeakPolarHBondContact O-CA 3.23Å; V141-T150 WeakPolarHBondContact O-CG2 3.24Å; V142-T150 HydrophobicContact CG2-CG2 4.03Å
151	E	84.8	Confident	79.7	Confident	71 Å²	71	57.3 Å²	57.3	33%	0.332	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	154.6	179.5	-68.9	176.5	-174.3	0	0	110.8	V141 S149 V153 F171	V141-E151 PolarHBondContact N-O 3.25Å; V141-E151 PolarHBondContact O-N 3.35Å; S149-E151 PolarHBondContact O-N 3.45Å; E151-V153 HydrophobicContact CB-CG2 4.43Å; E151-F171 HydrophobicContact CB-CE2 4.09Å; E151-F171 HydrophobicContact CG-CE2 4.34Å
152	L	87.4	Confident	78.3	Confident	44 Å²	44	64.3 Å²	64.3	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	110.7	172.4	-173.6	68	0	0	0	108.4	V119 F138 K140	V119-L152 HydrophobicContact CG1-CB 3.96Å; F138-L152 HydrophobicContact CB-CD1 3.79Å; F138-L152 HydrophobicContact CB-CG 4.08Å; F138-L152 HydrophobicContact CD1-CG 4.34Å; F138-L152 HydrophobicContact CG-CD2 4.46Å; F138-L152 HydrophobicContact CG-CG 4.35Å; K140-L152 HydrophobicContact CB-CD1 4.16Å
153	V	88.3	Confident	77.1	Confident	20 Å²	20	65.5 Å²	65.5	12%	0.121	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142.8	-173.9	-175	0	0	0	0	109.8	F138 V139 V141 E151 F169 E170 F171	F138-V153 CarbonylContact C-O 3.55Å; F138-V153 WeakPolarHBondContact CA-O 3.41Å; V139-V153 PolarHBondContact N-O 3.32Å; V139-V153 PolarHBondContact O-N 3.24Å; V141-V153 HydrophobicContact CG2-CG2 4.12Å; E151-V153 HydrophobicContact CB-CG2 4.43Å; V153-F169 HydrophobicContact CG1-CB 4.07Å; V153-F169 HydrophobicContact CG1-CD2 4.33Å; V153-E170 WeakPolarHBondContact CG1-O 3.19Å; V153-F171 HydrophobicContact CG2-CD2 4.12Å
154	A	87.7	Confident	76.2	Confident	44 Å²	44	70.3 Å²	70.3	36%	0.364	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.6	174.5	0	0	0	0	0	111.3	F138	F138-A154 HydrophobicContact CD1-CB 4.17Å; F138-A154 HydrophobicContact CE1-CB 4Å
155	L	88.3	Confident	75.9	Confident	16 Å²	16	74.6 Å²	74.6	8%	0.084	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-88.1	118.5	174.8	-167.4	72.8	0	0	0	109.6	T137 V139 L167 F169 F186	T137-L155 PolarHBondContact O-N 3Å; V139-L155 HydrophobicContact CG2-CB 4.42Å; V139-L155 HydrophobicContact CG2-CD1 3.9Å; L155-L167 HydrophobicContact CD1-CB 4.32Å; L155-L167 HydrophobicContact CD2-CB 4.31Å; L155-L167 HydrophobicContact CD2-CD1 4.3Å; L155-L167 HydrophobicContact CD2-CD2 3.9Å; L155-L167 HydrophobicContact CD2-CG 4.39Å; L155-L167 HydrophobicContact CG-CB 4.44Å; L155-L167 HydrophobicContact CG-CD2 4.45Å; L155-F169 HydrophobicContact CD1-CB 4.34Å; L155-F169 HydrophobicContact CD1-CD1 4.3Å; L155-F186 HydrophobicContact CD1-CE1 3.91Å; L155-F186 HydrophobicContact CD1-CZ 3.89Å
156	H	87.2	Confident	76.4	Confident	101 Å²	101	72.2 Å²	72.2	47%	0.468	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	142	173.7	-63.9	-80.1	0	0	0	110.6	S168	H156-S168 WeakPolarHBondContact CA-O 3.28Å; H156-S168 WeakPolarHBondContact CB-O 3.23Å; H156-S168 PolarHBondContact N-O 3.31Å; H156-S168 PolarHBondContact O-N 3.33Å
157	R	85.6	Confident	77.3	Confident	118 Å²	118	69.2 Å²	69.2	45%	0.445	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	107.6	-177.8	-56.4	-177.6	-179.4	-155.9	-9.6	108.6	S134 A136 L167	S134-R157 PolarHBondContact O-NH2 3.24Å; A136-R157 PolarHBondContact O-NH2 3.08Å; R157-L167 HydrophobicContact CG-CD2 3.89Å
158	D	78.2	Confident	78	Confident	59 Å²	59	67.3 Å²	67.3	32%	0.316	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.1	177.2	-67	-26.8	0	0	0	109.2	G160 V166	D158-G160 PolarHBondContact O-N 2.97Å; D158-V166 PolarHBondContact N-O 2.89Å; D158-V166 PolarHBondContact O-N 3.13Å
159	K	75.3	Confident	78.7	Confident	153 Å²	153	66.3 Å²	66.3	67%	0.665	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.4	169.6	-68.2	-174.9	177.3	-175.9	0	108.8	K217	K159-K217 PolarHBondContact O-NZ 3.2Å
160	G	64.1	Low	79.2	Confident	20 Å²	20	67.9 Å²	67.9	21%	0.206	36%	0.358	C	S	.	.			trans	-64.5	166	171.8	0	0	0	0	0	112.1	D158 D162 G163 L164	D158-G160 PolarHBondContact O-N 2.97Å; G160-D162 PolarHBondContact O-N 3.46Å; G160-G163 PolarHBondContact O-N 3.08Å; G160-G163 VanDerWaalsContact O-N 3.11Å; G160-L164 PolarHBondContact N-O 3.16Å
161	E	58.4	Low	79.3	Confident	147 Å²	147	66.3 Å²	66.3	69%	0.687	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.3	174.4	-67.6	-173.3	160	0	0	111.8	G163	E161-G163 PolarHBondContact O-N 3.33Å
162	D	57.4	Low	79.3	Confident	147 Å²	147	63.6 Å²	63.6	79%	0.786	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	1.3	173	-52.9	-39.7	0	0	0	113.8	G160 L164	G160-D162 PolarHBondContact O-N 3.46Å; D162-L164 HydrophobicContact CB-CD1 4.43Å; D162-L164 PolarHBondContact O-N 3.21Å
163	G	62	Low	79.1	Confident	59 Å²	59	64.9 Å²	64.9	61%	0.608	34%	0.339	S	S	*	.	S	Bend	trans	76.4	-5.7	-174.9	0	0	0	0	0	115.2	G160 E161	G160-G163 PolarHBondContact O-N 3.08Å; G160-G163 VanDerWaalsContact O-N 3.11Å; E161-G163 PolarHBondContact O-N 3.33Å
164	L	67	Low	78.9	Confident	113 Å²	113	64.5 Å²	64.5	59%	0.592	34%	0.337	S	S	*	.			trans	-75	138.2	175.4	-68.4	168.2	0	0	0	111.5	G160 D162 V166	G160-L164 PolarHBondContact N-O 3.16Å; D162-L164 HydrophobicContact CB-CD1 4.43Å; D162-L164 PolarHBondContact O-N 3.21Å; L164-V166 PolarHBondContact O-N 3.37Å
165	E	74.3	Confident	78.8	Confident	116 Å²	116	65.4 Å²	65.4	54%	0.542	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119.1	175.7	-67.6	-169	163.1	0	0	110.8
166	V	80.5	Confident	78.8	Confident	62 Å²	62	64.7 Å²	64.7	38%	0.376	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115	173.7	-177	0	0	0	0	108.5	D158 L164	D158-V166 PolarHBondContact N-O 2.89Å; D158-V166 PolarHBondContact O-N 3.13Å; L164-V166 PolarHBondContact O-N 3.37Å
167	L	86.4	Confident	78.8	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.052	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	129.4	175	-57.5	172.3	0	0	0	109.2	P133 L155 R157 Y178	P133-L167 HydrophobicContact CB-CD1 3.92Å; L155-L167 HydrophobicContact CD1-CB 4.32Å; L155-L167 HydrophobicContact CD2-CB 4.31Å; L155-L167 HydrophobicContact CD2-CD1 4.3Å; L155-L167 HydrophobicContact CD2-CD2 3.9Å; L155-L167 HydrophobicContact CD2-CG 4.39Å; L155-L167 HydrophobicContact CG-CB 4.44Å; L155-L167 HydrophobicContact CG-CD2 4.45Å; R157-L167 HydrophobicContact CG-CD2 3.89Å; L167-Y178 HydrophobicContact CD1-CD1 4.29Å; L167-Y178 PolarHBondContact O-N 3.12Å
168	S	88.3	Confident	78.7	Confident	4 Å²	4	58.2 Å²	58.2	3%	0.028	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	155.6	174.6	65.3	0	0	0	0	112.4	H156 Y176	H156-S168 WeakPolarHBondContact CA-O 3.28Å; H156-S168 WeakPolarHBondContact CB-O 3.23Å; H156-S168 PolarHBondContact N-O 3.31Å; H156-S168 PolarHBondContact O-N 3.33Å; S168-Y176 CarbonylContact C-O 3.58Å; S168-Y176 WeakPolarHBondContact CA-O 3.43Å; S168-Y176 WeakPolarHBondContact CB-O 3.48Å
169	F	90.2	Very high	78.9	Confident	1 Å²	1	57 Å²	57	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	159.1	168.9	69	-95	0	0	0	109.7	V50 V139 V141 V153 L155 F171 Y176 F186	V50-F169 HydrophobicContact CG1-CE1 4.26Å; V50-F169 HydrophobicContact CG1-CZ 4.35Å; V50-F169 HydrophobicContact CG2-CZ 4.36Å; V139-F169 HydrophobicContact CG1-CE1 4.36Å; V141-F169 HydrophobicContact CG2-CD2 4.27Å; V141-F169 HydrophobicContact CG2-CE2 3.75Å; V141-F169 HydrophobicContact CG2-CZ 4.21Å; V153-F169 HydrophobicContact CG1-CB 4.07Å; V153-F169 HydrophobicContact CG1-CD2 4.33Å; L155-F169 HydrophobicContact CD1-CB 4.34Å; L155-F169 HydrophobicContact CD1-CD1 4.3Å; F169-F171 HydrophobicContact CD2-CB 4.14Å; F169-F171 HydrophobicContact CE2-CB 3.86Å; F169-Y176 HydrophobicContact CD2-CD2 4.22Å; F169-Y176 HydrophobicContact CE1-CG 4.32Å; F169-Y176 AromaticContact CE2-CD2 3.55Å; F169-Y176 HydrophobicContact CE2-CD2 3.55Å; F169-Y176 HydrophobicContact CE2-CE2 4.3Å; F169-Y176 AromaticContact CE2-CG 3.89Å; F169-Y176 HydrophobicContact CE2-CG 3.89Å; F169-Y176 HydrophobicContact CZ-CD1 4.39Å; F169-Y176 AromaticContact CZ-CD2 3.87Å; F169-Y176 HydrophobicContact CZ-CD2 3.87Å; F169-Y176 AromaticContact CZ-CG 3.7Å; F169-Y176 HydrophobicContact CZ-CG 3.7Å; F169-Y176 PolarHBondContact N-O 3.5Å; F169-Y176 PolarHBondContact O-N 3.49Å; F169-F186 AromaticContact CD1-CD1 3.75Å; F169-F186 HydrophobicContact CD1-CD1 3.75Å; F169-F186 AromaticContact CD1-CE1 3.74Å; F169-F186 HydrophobicContact CD1-CE1 3.74Å; F169-F186 HydrophobicContact CD1-CG 4.35Å; F169-F186 HydrophobicContact CD1-CZ 4.35Å; F169-F186 HydrophobicContact CE1-CB 4.01Å; F169-F186 AromaticContact CE1-CD1 3.44Å; F169-F186 HydrophobicContact CE1-CD1 3.44Å; F169-F186 VanDerWaalsContact CE1-CD1 3.44Å; F169-F186 HydrophobicContact CE1-CD2 4.16Å; F169-F186 AromaticContact CE1-CE1 3.85Å; F169-F186 HydrophobicContact CE1-CE1 3.85Å; F169-F186 AromaticContact CE1-CG 3.61Å; F169-F186 HydrophobicContact CE1-CG 3.61Å; F169-F186 HydrophobicContact CE1-CZ 4.37Å
170	E	87.7	Confident	78.8	Confident	88 Å²	88	52.9 Å²	52.9	41%	0.411	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.6	177.7	-170.7	-177.3	150.3	0	0	109.6	V153 K173 I174	V153-E170 WeakPolarHBondContact CG1-O 3.19Å; E170-K173 WeakPolarHBondContact OE1-CA 3.37Å; E170-K173 WeakPolarHBondContact OE1-CD 3.07Å; E170-K173 IonicContact OE1-NZ 3.52Å; E170-I174 CarbonylContact C-O 3.43Å; E170-I174 VanDerWaalsContact CA-O 3.3Å; E170-I174 WeakPolarHBondContact CA-O 3.44Å
171	F	87.1	Confident	79	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.2	175	177.4	-109.8	0	0	0	109.6	L46 V47 V141 P143 E151 V153 F169 K173 I174 Y176	L46-F171 HydrophobicContact CD2-CD1 3.75Å; L46-F171 HydrophobicContact CD2-CE1 3.95Å; L46-F171 HydrophobicContact CG-CD1 4.37Å; L46-F171 HydrophobicContact CG-CE1 4.14Å; V47-F171 HydrophobicContact CG2-CD1 3.69Å; V47-F171 HydrophobicContact CG2-CE1 3.97Å; V141-F171 HydrophobicContact CB-CD2 3.95Å; V141-F171 HydrophobicContact CB-CE2 4.17Å; V141-F171 HydrophobicContact CB-CG 4.24Å; V141-F171 HydrophobicContact CG1-CB 4.33Å; V141-F171 HydrophobicContact CG1-CD1 3.74Å; V141-F171 HydrophobicContact CG1-CD2 3.83Å; V141-F171 HydrophobicContact CG1-CE1 3.92Å; V141-F171 HydrophobicContact CG1-CE2 4.01Å; V141-F171 HydrophobicContact CG1-CG 3.68Å; V141-F171 HydrophobicContact CG1-CZ 4.05Å; V141-F171 HydrophobicContact CG2-CD2 4.37Å; V141-F171 HydrophobicContact CG2-CG 4.49Å; P143-F171 HydrophobicContact CB-CE1 4.2Å; P143-F171 HydrophobicContact CB-CZ 4.07Å; P143-F171 HydrophobicContact CG-CZ 4.33Å; E151-F171 HydrophobicContact CB-CE2 4.09Å; E151-F171 HydrophobicContact CG-CE2 4.34Å; V153-F171 HydrophobicContact CG2-CD2 4.12Å; F169-F171 HydrophobicContact CD2-CB 4.14Å; F169-F171 HydrophobicContact CE2-CB 3.86Å; F171-K173 PolarHBondContact O-N 3.07Å; F171-K173 VanDerWaalsContact O-N 3.16Å; F171-I174 PolarHBondContact N-O 3.11Å; F171-I174 PolarHBondContact O-N 2.93Å; F171-Y176 HydrophobicContact CB-CE2 4.26Å
172	Q	83.1	Confident	79.7	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.065	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	43.2	-174.8	-60	-178	3.9	0	0	113.1	L46 N147 I174 R425 F429	L46-Q172 HydrophobicContact CD2-CB 4.39Å; N147-Q172 PolarHBondContact O-NE2 3.04Å; Q172-I174 VanDerWaalsContact C-N 3.27Å; Q172-I174 PolarHBondContact O-N 3.34Å; Q172-R425 HydrophobicContact CB-CG 4.4Å; Q172-R425 WeakPolarHBondContact O-CD 3.24Å; Q172-R425 WeakPolarHBondContact O-CG 3.41Å; Q172-F429 HydrophobicContact CB-CB 4.34Å; Q172-F429 HydrophobicContact CB-CD2 4.07Å; Q172-F429 HydrophobicContact CB-CG 4.09Å; Q172-F429 HydrophobicContact CG-CB 3.92Å; Q172-F429 HydrophobicContact CG-CD1 4.2Å; Q172-F429 HydrophobicContact CG-CD2 4.43Å; Q172-F429 HydrophobicContact CG-CG 3.94Å
173	K	83.4	Confident	80.3	Confident	70 Å²	70	58.5 Å²	58.5	30%	0.304	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	14	-178.1	-50.8	-57	-169.3	177.5	0	116.3	E170 F171 F416 F429	E170-K173 WeakPolarHBondContact OE1-CA 3.37Å; E170-K173 WeakPolarHBondContact OE1-CD 3.07Å; E170-K173 IonicContact OE1-NZ 3.52Å; F171-K173 PolarHBondContact O-N 3.07Å; F171-K173 VanDerWaalsContact O-N 3.16Å; K173-F416 HydrophobicContact CB-CB 4.04Å; K173-F416 HydrophobicContact CB-CD1 4.16Å; K173-F416 HydrophobicContact CB-CD2 3.55Å; K173-F416 HydrophobicContact CB-CE2 3.99Å; K173-F416 HydrophobicContact CB-CG 3.64Å; K173-F416 HydrophobicContact CB-CZ 4.46Å; K173-F416 HydrophobicContact CD-CE2 4.32Å; K173-F416 HydrophobicContact CG-CD1 4.45Å; K173-F416 HydrophobicContact CG-CD2 3.96Å; K173-F416 HydrophobicContact CG-CE1 4.35Å; K173-F416 HydrophobicContact CG-CE2 3.84Å; K173-F416 HydrophobicContact CG-CG 4.26Å; K173-F416 HydrophobicContact CG-CZ 4.04Å; K173-F429 HydrophobicContact CG-CE2 4.12Å; K173-F429 HydrophobicContact CG-CZ 4.38Å
174	I	84.3	Confident	81.2	Confident	13 Å²	13	62.4 Å²	62.4	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128	166.3	-54.3	-176.6	0	0	0	109.6	L46 E170 F171 Q172 Y176 P188 R425	L46-I174 HydrophobicContact CD2-CD1 3.57Å; L46-I174 HydrophobicContact CD2-CG1 4.33Å; E170-I174 CarbonylContact C-O 3.43Å; E170-I174 VanDerWaalsContact CA-O 3.3Å; E170-I174 WeakPolarHBondContact CA-O 3.44Å; F171-I174 PolarHBondContact N-O 3.11Å; F171-I174 PolarHBondContact O-N 2.93Å; Q172-I174 VanDerWaalsContact C-N 3.27Å; Q172-I174 PolarHBondContact O-N 3.34Å; I174-Y176 HydrophobicContact CB-CD2 4.42Å; I174-Y176 HydrophobicContact CB-CE2 3.77Å; I174-Y176 HydrophobicContact CG2-CD2 4.17Å; I174-Y176 HydrophobicContact CG2-CE2 3.67Å; I174-Y176 WeakPolarHBondContact O-CD2 3.35Å; I174-P188 HydrophobicContact CG2-CB 4.45Å; I174-R425 VanDerWaalsContact CD1-CZ 3.47Å
175	K	86.6	Confident	82	Confident	63 Å²	63	60 Å²	60	27%	0.274	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.1	170.8	-171.2	173.6	-177.6	172.8	0	110.4	V189 K217	K175-V189 HydrophobicContact CB-CG2 4.19Å; K175-V189 HydrophobicContact CD-CG2 4.44Å; K175-V189 HydrophobicContact CG-CG2 4.24Å; K175-V189 PolarHBondContact O-N 2.69Å; K175-K217 PolarHBondContact NZ-O 2.88Å
176	Y	87.3	Confident	82.5	Confident	1 Å²	1	54.5 Å²	54.5	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.6	169.9	-68.7	-96.5	0	0	0	108.9	D44 V47 S168 F169 F171 I174 L187 P188	D44-Y176 WeakPolarHBondContact OD2-CE1 3.48Å; D44-Y176 PolarHBondContact OD2-OH 3.21Å; V47-Y176 HydrophobicContact CG2-CE2 4.39Å; S168-Y176 CarbonylContact C-O 3.58Å; S168-Y176 WeakPolarHBondContact CA-O 3.43Å; S168-Y176 WeakPolarHBondContact CB-O 3.48Å; F169-Y176 HydrophobicContact CD2-CD2 4.22Å; F169-Y176 HydrophobicContact CE1-CG 4.32Å; F169-Y176 AromaticContact CE2-CD2 3.55Å; F169-Y176 HydrophobicContact CE2-CD2 3.55Å; F169-Y176 HydrophobicContact CE2-CE2 4.3Å; F169-Y176 AromaticContact CE2-CG 3.89Å; F169-Y176 HydrophobicContact CE2-CG 3.89Å; F169-Y176 HydrophobicContact CZ-CD1 4.39Å; F169-Y176 AromaticContact CZ-CD2 3.87Å; F169-Y176 HydrophobicContact CZ-CD2 3.87Å; F169-Y176 AromaticContact CZ-CG 3.7Å; F169-Y176 HydrophobicContact CZ-CG 3.7Å; F169-Y176 PolarHBondContact N-O 3.5Å; F169-Y176 PolarHBondContact O-N 3.49Å; F171-Y176 HydrophobicContact CB-CE2 4.26Å; I174-Y176 HydrophobicContact CB-CD2 4.42Å; I174-Y176 HydrophobicContact CB-CE2 3.77Å; I174-Y176 HydrophobicContact CG2-CD2 4.17Å; I174-Y176 HydrophobicContact CG2-CE2 3.67Å; I174-Y176 WeakPolarHBondContact O-CD2 3.35Å; Y176-L187 WeakPolarHBondContact CA-O 3.37Å; Y176-P188 HydrophobicContact CD1-CB 4.22Å; Y176-P188 HydrophobicContact CE1-CB 3.98Å; Y176-P188 HydrophobicContact CE1-CG 4.41Å
177	S	87	Confident	82.6	Confident	36 Å²	36	53.3 Å²	53.3	25%	0.252	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.1	174.8	53.2	0	0	0	0	110.2	L187	S177-L187 PolarHBondContact N-O 3Å; S177-L187 PolarHBondContact O-N 3.42Å
178	Y	84.9	Confident	82.5	Confident	46 Å²	46	55.5 Å²	55.5	18%	0.18	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.4	174.2	-173.3	-109.7	0	0	0	110.5	P133 L167 A180 F186	P133-Y178 HydrophobicContact CB-CE2 4.28Å; P133-Y178 HydrophobicContact CG-CE2 3.82Å; L167-Y178 HydrophobicContact CD1-CD1 4.29Å; L167-Y178 PolarHBondContact O-N 3.12Å; Y178-A180 HydrophobicContact CD1-CB 4.2Å; Y178-A180 HydrophobicContact CE1-CB 4.1Å; Y178-A180 PolarHBondContact O-N 3.29Å; Y178-F186 HydrophobicContact CD2-CD1 4.21Å; Y178-F186 HydrophobicContact CD2-CD2 4Å; Y178-F186 HydrophobicContact CD2-CE1 4.11Å; Y178-F186 AromaticContact CD2-CE2 3.88Å; Y178-F186 HydrophobicContact CD2-CE2 3.88Å; Y178-F186 HydrophobicContact CD2-CG 4.17Å; Y178-F186 AromaticContact CD2-CZ 3.94Å; Y178-F186 HydrophobicContact CD2-CZ 3.94Å; Y178-F186 HydrophobicContact CE2-CE2 4.5Å; Y178-F186 HydrophobicContact CG-CE1 4.27Å; Y178-F186 HydrophobicContact CG-CZ 4.35Å
179	D	81.2	Confident	82.2	Confident	35 Å²	35	56.2 Å²	56.2	19%	0.187	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	106.4	171.2	174.4	15.4	0	0	0	109.8	L181 E182 K183 K184 Q185 L187	D179-L181 PolarHBondContact OD1-N 2.75Å; D179-E182 PolarHBondContact OD1-N 2.87Å; D179-E182 WeakPolarHBondContact OD2-CB 3.39Å; D179-K183 PolarHBondContact OD2-N 2.95Å; D179-K184 WeakPolarHBondContact O-CA 3.36Å; D179-K184 PolarHBondContact O-N 3.13Å; D179-Q185 PolarHBondContact N-O 2.94Å; D179-L187 HydrophobicContact CB-CD1 3.93Å
180	A	73.2	Confident	81.8	Confident	66 Å²	66	59.9 Å²	59.9	55%	0.545	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-21	-178.8	0	0	0	0	0	113.9	Y178	Y178-A180 HydrophobicContact CD1-CB 4.2Å; Y178-A180 HydrophobicContact CE1-CB 4.1Å; Y178-A180 PolarHBondContact O-N 3.29Å
181	L	69	Low	81.7	Confident	156 Å²	156	57.1 Å²	57.1	82%	0.817	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-45.7	-165.9	-70.6	169.3	0	0	0	112.8	D179	D179-L181 PolarHBondContact OD1-N 2.75Å
182	E	72.4	Confident	81.5	Confident	158 Å²	158	58.1 Å²	58.1	74%	0.738	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-61.6	-176	-63	-175	170.5	0	0	112.2	D179	D179-E182 PolarHBondContact OD1-N 2.87Å; D179-E182 WeakPolarHBondContact OD2-CB 3.39Å
183	K	70.3	Confident	81.3	Confident	118 Å²	118	59 Å²	59	51%	0.513	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-14	-162.5	-63.8	178.8	-174.5	170.6	0	115	D179 Q185 L187	D179-K183 PolarHBondContact OD2-N 2.95Å; K183-Q185 WeakPolarHBondContact O-CG 3.49Å; K183-Q185 PolarHBondContact O-N 2.88Å; K183-L187 HydrophobicContact CD-CD1 3.97Å
184	K	80.3	Confident	81.1	Confident	141 Å²	141	58 Å²	58	61%	0.613	32%	0.323	S	S	*	.			trans	49.9	38	-176.2	-62.4	-176	179.9	179.6	0	113.1	D179	D179-K184 WeakPolarHBondContact O-CA 3.36Å; D179-K184 PolarHBondContact O-N 3.13Å
185	Q	84.1	Confident	81.2	Confident	62 Å²	62	60.2 Å²	60.2	29%	0.29	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.6	-174.9	-74.7	171.2	2.7	0	0	110	L39 D179 K183	L39-Q185 WeakPolarHBondContact O-CA 3.4Å; D179-Q185 PolarHBondContact N-O 2.94Å; K183-Q185 WeakPolarHBondContact O-CG 3.49Å; K183-Q185 PolarHBondContact O-N 2.88Å
186	F	84.5	Confident	81.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.9	168.5	-72.3	-82.6	0	0	0	109.8	L39 V50 L155 F169 Y178	L39-F186 HydrophobicContact CB-CD2 4.25Å; L39-F186 PolarHBondContact O-N 2.84Å; V50-F186 HydrophobicContact CG1-CD2 4.02Å; V50-F186 HydrophobicContact CG1-CE2 4.38Å; L155-F186 HydrophobicContact CD1-CE1 3.91Å; L155-F186 HydrophobicContact CD1-CZ 3.89Å; F169-F186 AromaticContact CD1-CD1 3.75Å; F169-F186 HydrophobicContact CD1-CD1 3.75Å; F169-F186 AromaticContact CD1-CE1 3.74Å; F169-F186 HydrophobicContact CD1-CE1 3.74Å; F169-F186 HydrophobicContact CD1-CG 4.35Å; F169-F186 HydrophobicContact CD1-CZ 4.35Å; F169-F186 HydrophobicContact CE1-CB 4.01Å; F169-F186 AromaticContact CE1-CD1 3.44Å; F169-F186 HydrophobicContact CE1-CD1 3.44Å; F169-F186 VanDerWaalsContact CE1-CD1 3.44Å; F169-F186 HydrophobicContact CE1-CD2 4.16Å; F169-F186 AromaticContact CE1-CE1 3.85Å; F169-F186 HydrophobicContact CE1-CE1 3.85Å; F169-F186 AromaticContact CE1-CG 3.61Å; F169-F186 HydrophobicContact CE1-CG 3.61Å; F169-F186 HydrophobicContact CE1-CZ 4.37Å; Y178-F186 HydrophobicContact CD2-CD1 4.21Å; Y178-F186 HydrophobicContact CD2-CD2 4Å; Y178-F186 HydrophobicContact CD2-CE1 4.11Å; Y178-F186 AromaticContact CD2-CE2 3.88Å; Y178-F186 HydrophobicContact CD2-CE2 3.88Å; Y178-F186 HydrophobicContact CD2-CG 4.17Å; Y178-F186 AromaticContact CD2-CZ 3.94Å; Y178-F186 HydrophobicContact CD2-CZ 3.94Å; Y178-F186 HydrophobicContact CE2-CE2 4.5Å; Y178-F186 HydrophobicContact CG-CE1 4.27Å; Y178-F186 HydrophobicContact CG-CZ 4.35Å
187	L	82.9	Confident	81.2	Confident	37 Å²	37	58.5 Å²	58.5	19%	0.194	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.6	178.6	-62.2	170.2	0	0	0	109.6	A41 Y176 S177 D179 K183	A41-L187 HydrophobicContact CB-CD2 3.58Å; Y176-L187 WeakPolarHBondContact CA-O 3.37Å; S177-L187 PolarHBondContact N-O 3Å; S177-L187 PolarHBondContact O-N 3.42Å; D179-L187 HydrophobicContact CB-CD1 3.93Å; K183-L187 HydrophobicContact CD-CD1 3.97Å
188	P	84.6	Confident	81.1	Confident	57 Å²	57	59.3 Å²	59.3	37%	0.37	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	149.1	168.7	28.9	-33.8	0	0	0	109.7	I174 Y176 A190	I174-P188 HydrophobicContact CG2-CB 4.45Å; Y176-P188 HydrophobicContact CD1-CB 4.22Å; Y176-P188 HydrophobicContact CE1-CB 3.98Å; Y176-P188 HydrophobicContact CE1-CG 4.41Å; P188-A190 PolarHBondContact O-N 3.39Å
189	V	83.1	Confident	81.3	Confident	19 Å²	19	61.9 Å²	61.9	12%	0.115	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-60	120.9	177.9	178.1	0	0	0	0	110.1	K175 F191 K218 F219	K175-V189 HydrophobicContact CB-CG2 4.19Å; K175-V189 HydrophobicContact CD-CG2 4.44Å; K175-V189 HydrophobicContact CG-CG2 4.24Å; K175-V189 PolarHBondContact O-N 2.69Å; V189-F191 WeakPolarHBondContact O-CD2 3.46Å; V189-F191 WeakPolarHBondContact O-CE2 3.43Å; V189-K218 HydrophobicContact CG1-CG 4.25Å; V189-F219 HydrophobicContact CG1-CD1 3.6Å; V189-F219 HydrophobicContact CG1-CE1 3.76Å
190	A	81	Confident	81.6	Confident	78 Å²	78	60.2 Å²	60.2	65%	0.645	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-78.3	123	179.2	0	0	0	0	0	111.3	P188 F219	P188-A190 PolarHBondContact O-N 3.39Å; A190-F219 WeakPolarHBondContact O-CE1 3.45Å
191	F	85.1	Confident	82.2	Confident	30 Å²	30	60 Å²	60	13%	0.132	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-88.5	155.9	175.5	-69.8	-87.9	0	0	0	111.4	V189 V193 F219 P316 R413 N417	V189-F191 WeakPolarHBondContact O-CD2 3.46Å; V189-F191 WeakPolarHBondContact O-CE2 3.43Å; F191-V193 HydrophobicContact CB-CG1 4.39Å; F191-V193 HydrophobicContact CB-CG2 4.24Å; F191-V193 WeakPolarHBondContact O-CG2 3.38Å; F191-V193 PolarHBondContact O-N 2.7Å; F191-F219 AromaticContact CD1-CD1 3.96Å; F191-F219 HydrophobicContact CD1-CD1 3.96Å; F191-F219 HydrophobicContact CD1-CE1 4.03Å; F191-F219 AromaticContact CE1-CD1 3.67Å; F191-F219 HydrophobicContact CE1-CD1 3.67Å; F191-F219 HydrophobicContact CE1-CE1 4.21Å; F191-F219 HydrophobicContact CZ-CD1 4.22Å; F191-P316 HydrophobicContact CD1-CB 4.26Å; F191-P316 HydrophobicContact CD1-CG 3.76Å; F191-P316 HydrophobicContact CE1-CG 3.72Å; F191-R413 HydrophobicContact CB-CG 4.17Å; F191-R413 HydrophobicContact CD1-CB 4.35Å; F191-R413 HydrophobicContact CD1-CG 4.16Å; F191-R413 HydrophobicContact CG-CG 4.06Å; F191-N417 HydrophobicContact CD2-CB 4.43Å; F191-N417 HydrophobicContact CE1-CB 4.41Å; F191-N417 HydrophobicContact CE2-CB 3.6Å; F191-N417 VanDerWaalsContact CE2-CG 3.48Å; F191-N417 HydrophobicContact CZ-CB 3.61Å; F191-N417 VanDerWaalsContact CZ-ND2 3.26Å; F191-N417 WeakPolarHBondContact CZ-ND2 3.46Å
192	P	82.9	Confident	83	Confident	21 Å²	21	56.3 Å²	56.3	14%	0.136	31%	0.314	C	S	.	.	S	Bend	trans	-76.2	68	-179.1	32.9	-37.2	0	0	0	111.9	Y200 P316 Y410 L412	P192-Y200 PolarHBondContact O-OH 2.93Å; P192-P316 HydrophobicContact CG-CB 4.31Å; P192-Y410 HydrophobicContact CG-CE1 4.17Å; P192-L412 WeakPolarHBondContact O-CD2 3.41Å
193	V	79.6	Confident	83.6	Confident	32 Å²	32	50.4 Å²	50.4	19%	0.194	29%	0.287	C	S	.	.			trans	-119.1	12.9	-172.4	-75.4	0	0	0	0	115	F191 L372 L412 R413	F191-V193 HydrophobicContact CB-CG1 4.39Å; F191-V193 HydrophobicContact CB-CG2 4.24Å; F191-V193 WeakPolarHBondContact O-CG2 3.38Å; F191-V193 PolarHBondContact O-N 2.7Å; V193-L372 HydrophobicContact CB-CD1 3.63Å; V193-L372 HydrophobicContact CB-CG 4.27Å; V193-L372 HydrophobicContact CG1-CD1 3.82Å; V193-L372 HydrophobicContact CG2-CD1 4.17Å; V193-L412 HydrophobicContact CG1-CB 4.12Å; V193-L412 HydrophobicContact CG1-CD2 4.27Å; V193-R413 HydrophobicContact CG1-CG 4.29Å
194	G	78.2	Confident	84.3	Confident	50 Å²	50	50.4 Å²	50.4	52%	0.515	28%	0.284	S	S	.	.	S	Bend	trans	-137.3	22	-178.2	0	0	0	0	0	114.7	V369	G194-V369 WeakPolarHBondContact O-CG1 3.39Å
195	N	86.4	Confident	84.5	Confident	59 Å²	59	44.1 Å²	44.1	32%	0.316	26%	0.259	S	S	.	.			trans	-91	163.7	-179.7	-63	-20.8	0	0	0	111.3	Y199 Y200 L370	N195-Y199 HydrophobicContact CB-CD1 3.73Å; N195-Y199 HydrophobicContact CB-CE1 4.49Å; N195-Y199 HydrophobicContact CB-CG 3.9Å; N195-Y199 WeakPolarHBondContact ND2-CD1 3.33Å; N195-Y199 WeakPolarHBondContact ND2-CE1 3.21Å; N195-Y200 HydrophobicContact CB-CE2 3.92Å; N195-Y200 PolarHBondContact N-OH 2.78Å; N195-Y200 WeakPolarHBondContact O-CE2 3.36Å; N195-L370 PolarHBondContact O-N 3.05Å
196	A	87.3	Confident	84.8	Confident	28 Å²	28	42.7 Å²	42.7	23%	0.231	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-67.6	152.9	171.3	0	0	0	0	0	112	S198 Y199 Y200 R368	A196-S198 PolarHBondContact O-N 3.31Å; A196-Y199 VanDerWaalsContact O-CB 3.29Å; A196-Y199 WeakPolarHBondContact O-CB 3.06Å; A196-Y199 PolarHBondContact O-N 2.89Å; A196-Y200 WeakPolarHBondContact O-CD2 3.3Å; A196-R368 CarbonylContact C-O 3.43Å; A196-R368 WeakPolarHBondContact CA-O 3.26Å
197	F	86.1	Confident	84.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57	-32.4	176.2	-69.6	-17.8	0	0	0	113.1	Y199 Y200 Q201 I361 L364 R368 L370	F197-Y199 PolarHBondContact O-N 3.25Å; F197-Y200 HydrophobicContact CD1-CD2 4.48Å; F197-Y200 PolarHBondContact O-N 3.22Å; F197-Y200 VanDerWaalsContact O-N 3.12Å; F197-Q201 WeakPolarHBondContact O-CB 3.4Å; F197-Q201 WeakPolarHBondContact O-CG 3.35Å; F197-Q201 PolarHBondContact O-N 3.34Å; F197-I361 HydrophobicContact CD1-CD1 4.43Å; F197-L364 HydrophobicContact CD2-CB 4.09Å; F197-L364 HydrophobicContact CD2-CD1 4.39Å; F197-L364 HydrophobicContact CE2-CB 4.14Å; F197-L364 HydrophobicContact CE2-CD1 3.73Å; F197-L364 HydrophobicContact CZ-CD1 4.39Å; F197-R368 HydrophobicContact CD2-CB 3.9Å; F197-R368 HydrophobicContact CD2-CG 4.31Å; F197-R368 HydrophobicContact CE2-CB 3.95Å; F197-R368 HydrophobicContact CE2-CG 3.85Å; F197-R368 WeakPolarHBondContact CG-O 3.38Å; F197-R368 HydrophobicContact CZ-CG 4.27Å; F197-R368 PolarHBondContact N-O 3.19Å; F197-L370 HydrophobicContact CD1-CB 4.34Å; F197-L370 HydrophobicContact CE1-CB 3.86Å; F197-L370 HydrophobicContact CE1-CD1 3.83Å; F197-L370 HydrophobicContact CE1-CG 4.46Å
198	S	86.1	Confident	85	Confident	52 Å²	52	49.4 Å²	49.4	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-54.2	-38	172.2	60.9	0	0	0	0	113.4	A196 S202 P366	A196-S198 PolarHBondContact O-N 3.31Å; S198-S202 VanDerWaalsContact O-CB 3.26Å; S198-S202 WeakPolarHBondContact O-CB 3.03Å; S198-S202 PolarHBondContact O-N 3.26Å; S198-S202 VanDerWaalsContact O-N 3.07Å; S198-S202 PolarHBondContact O-OG 2.89Å; S198-P366 WeakPolarHBondContact CB-O 3.35Å; S198-P366 PolarHBondContact N-O 3.23Å
199	Y	88.8	Confident	85	Confident	100 Å²	100	51.1 Å²	51.1	39%	0.392	29%	0.289	S	S	.	.	H	α-helix	trans	-63.5	-47	176.5	174.8	-94.2	0	0	0	111.1	N195 A196 F197 S202 N203	N195-Y199 HydrophobicContact CB-CD1 3.73Å; N195-Y199 HydrophobicContact CB-CE1 4.49Å; N195-Y199 HydrophobicContact CB-CG 3.9Å; N195-Y199 WeakPolarHBondContact ND2-CD1 3.33Å; N195-Y199 WeakPolarHBondContact ND2-CE1 3.21Å; A196-Y199 VanDerWaalsContact O-CB 3.29Å; A196-Y199 WeakPolarHBondContact O-CB 3.06Å; A196-Y199 PolarHBondContact O-N 2.89Å; F197-Y199 PolarHBondContact O-N 3.25Å; Y199-S202 PolarHBondContact O-OG 3.12Å; Y199-N203 WeakPolarHBondContact O-CB 3.34Å; Y199-N203 PolarHBondContact O-N 3.1Å
200	Y	88	Confident	85	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-71.5	-38.4	-178.1	-58.5	-71.4	0	0	0	112.7	P192 N195 A196 F197 N203 L336 L370 Y410 L412	P192-Y200 PolarHBondContact O-OH 2.93Å; N195-Y200 HydrophobicContact CB-CE2 3.92Å; N195-Y200 PolarHBondContact N-OH 2.78Å; N195-Y200 WeakPolarHBondContact O-CE2 3.36Å; A196-Y200 WeakPolarHBondContact O-CD2 3.3Å; F197-Y200 HydrophobicContact CD1-CD2 4.48Å; F197-Y200 PolarHBondContact O-N 3.22Å; F197-Y200 VanDerWaalsContact O-N 3.12Å; Y200-N203 PolarHBondContact O-N 3.32Å; Y200-L336 HydrophobicContact CD1-CD2 4.04Å; Y200-L336 HydrophobicContact CD2-CD2 3.86Å; Y200-L336 HydrophobicContact CE1-CD2 4.46Å; Y200-L336 HydrophobicContact CE2-CD2 4.29Å; Y200-L336 HydrophobicContact CG-CD2 3.72Å; Y200-L370 HydrophobicContact CE2-CB 3.99Å; Y200-L370 HydrophobicContact CE2-CD2 4.01Å; Y200-Y410 AromaticContact CD1-CD1 3.63Å; Y200-Y410 HydrophobicContact CD1-CD1 3.63Å; Y200-Y410 AromaticContact CD1-CE1 3.61Å; Y200-Y410 HydrophobicContact CD1-CE1 3.61Å; Y200-Y410 HydrophobicContact CD1-CG 4.14Å; Y200-Y410 AromaticContact CE1-CD1 3.91Å; Y200-Y410 HydrophobicContact CE1-CD1 3.91Å; Y200-Y410 AromaticContact CE1-CE1 3.58Å; Y200-Y410 HydrophobicContact CE1-CE1 3.58Å; Y200-L412 HydrophobicContact CE1-CD2 4.05Å
201	Q	84.9	Confident	85.2	Confident	62 Å²	62	53 Å²	53	29%	0.29	29%	0.289	S	S	.	.	H	α-helix	trans	-69.4	-35.2	179.2	-70.4	174.7	-11.3	0	0	112.8	F197 R204 I361	F197-Q201 WeakPolarHBondContact O-CB 3.4Å; F197-Q201 WeakPolarHBondContact O-CG 3.35Å; F197-Q201 PolarHBondContact O-N 3.34Å; Q201-R204 PolarHBondContact O-NH1 2.97Å; Q201-I361 HydrophobicContact CG-CD1 4.07Å; Q201-I361 HydrophobicContact CG-CG1 4.35Å; Q201-I361 PolarHBondContact NE2-O 3.15Å
202	S	86.3	Confident	85.2	Confident	78 Å²	78	52.1 Å²	52.1	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-80.4	-22	178.8	60.6	0	0	0	0	113.1	S198 Y199 R204	S198-S202 VanDerWaalsContact O-CB 3.26Å; S198-S202 WeakPolarHBondContact O-CB 3.03Å; S198-S202 PolarHBondContact O-N 3.26Å; S198-S202 VanDerWaalsContact O-N 3.07Å; S198-S202 PolarHBondContact O-OG 2.89Å; Y199-S202 PolarHBondContact O-OG 3.12Å; S202-R204 PolarHBondContact O-NH1 3.44Å
203	N	85	Confident	85.3	Confident	34 Å²	34	59.4 Å²	59.4	18%	0.182	31%	0.31	C	S	.	.			trans	-61.4	144.3	-178.8	-153.2	-24.6	0	0	0	111.9	Y199 Y200 G205 Y410	Y199-N203 WeakPolarHBondContact O-CB 3.34Å; Y199-N203 PolarHBondContact O-N 3.1Å; Y200-N203 PolarHBondContact O-N 3.32Å; N203-G205 PolarHBondContact OD1-N 3.46Å; N203-G205 VanDerWaalsContact OD1-N 3.16Å; N203-Y410 HydrophobicContact CB-CE2 4.41Å; N203-Y410 VanDerWaalsContact ND2-CE2 3.34Å; N203-Y410 WeakPolarHBondContact ND2-CE2 3.47Å
204	R	84.1	Confident	85.5	Confident	118 Å²	118	59.9 Å²	59.9	45%	0.445	32%	0.318	S	S	.	.			trans	-126.4	20.4	-178.7	-64.3	-67.3	-179.3	-95.3	-0.2	112.4	Q201 S202 Q207 Y301	Q201-R204 PolarHBondContact O-NH1 2.97Å; S202-R204 PolarHBondContact O-NH1 3.44Å; R204-Q207 PolarHBondContact O-NE2 2.86Å; R204-Y301 WeakPolarHBondContact O-CD1 3.34Å; R204-Y301 WeakPolarHBondContact O-CE1 3.07Å
205	G	85.9	Confident	85.8	Confident	9 Å²	9	57.9 Å²	57.9	9%	0.093	30%	0.296	C	S	.	.			trans	68.4	-174.4	-177.6	0	0	0	0	0	112.2	N203	N203-G205 PolarHBondContact OD1-N 3.46Å; N203-G205 VanDerWaalsContact OD1-N 3.16Å
206	F	89.3	Confident	85.8	Confident	32 Å²	32	58.9 Å²	58.9	14%	0.14	30%	0.299	C	S	.	.			trans	-73.3	128.8	-179.9	-62.9	-71.9	0	0	0	111.9	E211 I212 A215 S303 V315 P316 D318	F206-E211 HydrophobicContact CD1-CB 3.71Å; F206-E211 HydrophobicContact CE1-CB 4.37Å; F206-I212 HydrophobicContact CB-CD1 4.21Å; F206-I212 HydrophobicContact CB-CG1 3.59Å; F206-I212 HydrophobicContact CD2-CG1 4.41Å; F206-I212 HydrophobicContact CG-CG1 4.01Å; F206-A215 HydrophobicContact CE1-CB 4.11Å; F206-A215 HydrophobicContact CE2-CB 4.47Å; F206-A215 HydrophobicContact CZ-CB 3.78Å; F206-S303 PolarHBondContact O-N 2.71Å; F206-V315 HydrophobicContact CD2-CG2 4.34Å; F206-V315 HydrophobicContact CE2-CG2 3.73Å; F206-V315 HydrophobicContact CZ-CG2 4.42Å; F206-P316 WeakPolarHBondContact CZ-O 3.24Å; F206-D318 WeakPolarHBondContact CD2-OD1 3.41Å
207	Q	85.4	Confident	85.6	Confident	58 Å²	58	62 Å²	62	27%	0.271	31%	0.307	S	S	.	.			trans	-96.3	-39.4	-176.4	-63.5	-74.9	-46.8	0	0	111	R204 E211	R204-Q207 PolarHBondContact O-NE2 2.86Å; Q207-E211 PolarHBondContact N-OE2 2.83Å; Q207-E211 VanDerWaalsContact N-OE2 3.15Å
208	E	86.2	Confident	85.5	Confident	120 Å²	120	67.7 Å²	67.7	56%	0.561	33%	0.332	S	S	*	.	S	Bend	trans	-109.7	148.1	-178.1	-58.5	-171.1	173.8	0	0	112.2	S210 E211 I212	E208-S210 VanDerWaalsContact CB-OG 3.29Å; E208-S210 WeakPolarHBondContact CB-OG 3.47Å; E208-S210 PolarHBondContact O-N 3.12Å; E208-S210 PolarHBondContact OE2-OG 3.29Å; E208-S210 VanDerWaalsContact OE2-OG 3.06Å; E208-E211 HydrophobicContact CB-CG 4.23Å; E208-E211 PolarHBondContact O-N 3.02Å; E208-I212 PolarHBondContact O-N 2.84Å
209	D	84.3	Confident	85.4	Confident	93 Å²	93	66.9 Å²	66.9	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-69.8	-21.9	178.3	-67.8	-10	0	0	0	112.6	I212 R213	D209-I212 PolarHBondContact O-N 3.35Å; D209-R213 WeakPolarHBondContact O-CG 3.43Å; D209-R213 PolarHBondContact O-N 2.88Å; D209-R213 VanDerWaalsContact O-N 3.15Å
210	S	84.3	Confident	85.2	Confident	52 Å²	52	63.3 Å²	63.3	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-61.7	-48.3	172	47.8	0	0	0	0	111.3	E208 I212 R213 A214	E208-S210 VanDerWaalsContact CB-OG 3.29Å; E208-S210 WeakPolarHBondContact CB-OG 3.47Å; E208-S210 PolarHBondContact O-N 3.12Å; E208-S210 PolarHBondContact OE2-OG 3.29Å; E208-S210 VanDerWaalsContact OE2-OG 3.06Å; S210-I212 VanDerWaalsContact C-N 3.27Å; S210-I212 PolarHBondContact O-N 2.73Å; S210-R213 PolarHBondContact O-N 3.31Å; S210-A214 PolarHBondContact O-N 3.35Å
211	E	84.7	Confident	85.1	Confident	84 Å²	84	66.6 Å²	66.6	39%	0.393	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-37.6	178.4	-59.9	176.5	155.3	0	0	111.6	F206 Q207 E208 A214 A215	F206-E211 HydrophobicContact CD1-CB 3.71Å; F206-E211 HydrophobicContact CE1-CB 4.37Å; Q207-E211 PolarHBondContact N-OE2 2.83Å; Q207-E211 VanDerWaalsContact N-OE2 3.15Å; E208-E211 HydrophobicContact CB-CG 4.23Å; E208-E211 PolarHBondContact O-N 3.02Å; E211-A214 PolarHBondContact O-N 2.66Å; E211-A215 WeakPolarHBondContact O-CB 3.44Å; E211-A215 PolarHBondContact O-N 2.97Å
212	I	85.1	Confident	85.2	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-48.8	177.3	-60.2	171.8	0	0	0	110.2	F206 E208 D209 S210 A214 A215 E216 R302	F206-I212 HydrophobicContact CB-CD1 4.21Å; F206-I212 HydrophobicContact CB-CG1 3.59Å; F206-I212 HydrophobicContact CD2-CG1 4.41Å; F206-I212 HydrophobicContact CG-CG1 4.01Å; E208-I212 PolarHBondContact O-N 2.84Å; D209-I212 PolarHBondContact O-N 3.35Å; S210-I212 VanDerWaalsContact C-N 3.27Å; S210-I212 PolarHBondContact O-N 2.73Å; I212-A214 VanDerWaalsContact C-N 3.32Å; I212-A214 PolarHBondContact O-N 2.98Å; I212-A215 PolarHBondContact O-N 3.43Å; I212-E216 HydrophobicContact CG2-CG 4.36Å; I212-E216 WeakPolarHBondContact O-CB 3.46Å; I212-E216 WeakPolarHBondContact O-CG 3.45Å; I212-E216 PolarHBondContact O-N 3.24Å; I212-R302 HydrophobicContact CD1-CG 4.32Å
213	R	85	Confident	85	Confident	173 Å²	173	65.5 Å²	65.5	65%	0.653	32%	0.324	S	S	*	.	H	α-helix	trans	-62.6	-39.4	178.3	-69.9	179.4	-168.7	176.8	5	112.1	D209 S210 E216 K217	D209-R213 WeakPolarHBondContact O-CG 3.43Å; D209-R213 PolarHBondContact O-N 2.88Å; D209-R213 VanDerWaalsContact O-N 3.15Å; S210-R213 PolarHBondContact O-N 3.31Å; R213-E216 PolarHBondContact O-N 2.81Å; R213-K217 WeakPolarHBondContact O-CB 3.48Å; R213-K217 PolarHBondContact O-N 3.31Å
214	A	83.9	Confident	84.3	Confident	43 Å²	43	65.8 Å²	65.8	36%	0.355	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174.7	0	0	0	0	0	111.5	S210 E211 I212 K217 K218	S210-A214 PolarHBondContact O-N 3.35Å; E211-A214 PolarHBondContact O-N 2.66Å; I212-A214 VanDerWaalsContact C-N 3.32Å; I212-A214 PolarHBondContact O-N 2.98Å; A214-K217 PolarHBondContact O-N 3.3Å; A214-K218 WeakPolarHBondContact O-CB 3.46Å; A214-K218 PolarHBondContact O-N 3.08Å
215	A	84.6	Confident	83.5	Confident	8 Å²	8	65 Å²	65	7%	0.066	33%	0.332	C	S	.	.	H	α-helix	trans	-65.8	-44.2	176	0	0	0	0	0	112.4	F206 E211 I212 K217 K218 F219 V315	F206-A215 HydrophobicContact CE1-CB 4.11Å; F206-A215 HydrophobicContact CE2-CB 4.47Å; F206-A215 HydrophobicContact CZ-CB 3.78Å; E211-A215 WeakPolarHBondContact O-CB 3.44Å; E211-A215 PolarHBondContact O-N 2.97Å; I212-A215 PolarHBondContact O-N 3.43Å; A215-K217 VanDerWaalsContact C-N 3.3Å; A215-K217 PolarHBondContact O-N 2.79Å; A215-K218 PolarHBondContact O-N 3.1Å; A215-F219 HydrophobicContact CB-CD2 4.32Å; A215-F219 WeakPolarHBondContact O-CD2 3.42Å; A215-F219 PolarHBondContact O-N 3.07Å; A215-V315 HydrophobicContact CB-CB 4.46Å; A215-V315 HydrophobicContact CB-CG2 4.18Å
216	E	86.2	Confident	82.6	Confident	80 Å²	80	65.9 Å²	65.9	37%	0.374	33%	0.334	S	S	.	.	H	α-helix	trans	-58.9	-40.8	175.2	-77.2	177.5	177	0	0	111.7	I212 R213 G220 V315	I212-E216 HydrophobicContact CG2-CG 4.36Å; I212-E216 WeakPolarHBondContact O-CB 3.46Å; I212-E216 WeakPolarHBondContact O-CG 3.45Å; I212-E216 PolarHBondContact O-N 3.24Å; R213-E216 PolarHBondContact O-N 2.81Å; E216-G220 WeakPolarHBondContact O-CA 3.41Å; E216-G220 PolarHBondContact O-N 3.23Å; E216-V315 HydrophobicContact CB-CG1 4.49Å; E216-V315 HydrophobicContact CG-CG1 3.72Å
217	K	83	Confident	81.6	Confident	92 Å²	92	69.6 Å²	69.6	40%	0.4	36%	0.359	S	S	.	.	H	α-helix	trans	-69.8	-36.8	177.1	-170	172.6	-178.1	173.1	0	112.8	K159 K175 R213 A214 A215	K159-K217 PolarHBondContact O-NZ 3.2Å; K175-K217 PolarHBondContact NZ-O 2.88Å; R213-K217 WeakPolarHBondContact O-CB 3.48Å; R213-K217 PolarHBondContact O-N 3.31Å; A214-K217 PolarHBondContact O-N 3.3Å; A215-K217 VanDerWaalsContact C-N 3.3Å; A215-K217 PolarHBondContact O-N 2.79Å
218	K	83.4	Confident	80.7	Confident	120 Å²	120	68.5 Å²	68.5	52%	0.522	36%	0.357	S	S	.	.	H	α-helix	trans	-72.3	-52.2	179.6	-175.2	175.5	180	177.5	0	112	V189 A214 A215	V189-K218 HydrophobicContact CG1-CG 4.25Å; A214-K218 WeakPolarHBondContact O-CB 3.46Å; A214-K218 PolarHBondContact O-N 3.08Å; A215-K218 PolarHBondContact O-N 3.1Å
219	F	84.8	Confident	80.2	Confident	36 Å²	36	64.3 Å²	64.3	16%	0.158	34%	0.34	C	S	.	.	H	α-helix	trans	-94.9	-23.9	-172	-62.7	-67	0	0	0	114	V189 A190 F191 A215 P316	V189-F219 HydrophobicContact CG1-CD1 3.6Å; V189-F219 HydrophobicContact CG1-CE1 3.76Å; A190-F219 WeakPolarHBondContact O-CE1 3.45Å; F191-F219 AromaticContact CD1-CD1 3.96Å; F191-F219 HydrophobicContact CD1-CD1 3.96Å; F191-F219 HydrophobicContact CD1-CE1 4.03Å; F191-F219 AromaticContact CE1-CD1 3.67Å; F191-F219 HydrophobicContact CE1-CD1 3.67Å; F191-F219 HydrophobicContact CE1-CE1 4.21Å; F191-F219 HydrophobicContact CZ-CD1 4.22Å; A215-F219 HydrophobicContact CB-CD2 4.32Å; A215-F219 WeakPolarHBondContact O-CD2 3.42Å; A215-F219 PolarHBondContact O-N 3.07Å; F219-P316 HydrophobicContact CB-CG 4.03Å; F219-P316 HydrophobicContact CD1-CB 4.48Å; F219-P316 HydrophobicContact CD1-CG 3.92Å; F219-P316 HydrophobicContact CD2-CB 4.21Å; F219-P316 HydrophobicContact CD2-CG 3.99Å; F219-P316 HydrophobicContact CE1-CB 4.46Å; F219-P316 HydrophobicContact CE1-CG 4.36Å; F219-P316 HydrophobicContact CE2-CB 4.19Å; F219-P316 HydrophobicContact CE2-CG 4.42Å; F219-P316 HydrophobicContact CG-CB 4.36Å; F219-P316 HydrophobicContact CG-CG 3.72Å; F219-P316 HydrophobicContact CZ-CB 4.32Å
220	G	85.5	Confident	80.2	Confident	25 Å²	25	64.9 Å²	64.9	26%	0.258	34%	0.343	S	S	.	.			trans	80.4	178.6	-169.5	0	0	0	0	0	112.8	E216	E216-G220 WeakPolarHBondContact O-CA 3.41Å; E216-G220 PolarHBondContact O-N 3.23Å
221	S	84.8	Confident	80.4	Confident	69 Å²	69	66.4 Å²	66.4	48%	0.483	34%	0.343	S	S	.	.			trans	-79.8	156.2	176.7	56.7	0	0	0	0	112.1	K223 D312	S221-K223 PolarHBondContact O-N 2.93Å; S221-D312 WeakPolarHBondContact CB-O 3.07Å
222	N	87.3	Confident	80.4	Confident	10 Å²	10	66 Å²	66	5%	0.053	35%	0.35	C	S	.	.			trans	-78.8	52.3	177	-173.6	38.5	0	0	0	112.2	S311 D312 I314 P332 T414 G415	N222-S311 WeakPolarHBondContact CB-O 3.48Å; N222-S311 PolarHBondContact ND2-O 3.39Å; N222-D312 PolarHBondContact N-O 2.96Å; N222-I314 HydrophobicContact CB-CB 4.42Å; N222-I314 WeakPolarHBondContact CB-O 3.36Å; N222-P332 PolarHBondContact ND2-O 3.16Å; N222-P332 VanDerWaalsContact ND2-O 3.16Å; N222-T414 HydrophobicContact CB-CG2 4.16Å; N222-T414 WeakPolarHBondContact OD1-CA 3.26Å; N222-T414 WeakPolarHBondContact OD1-CB 3.44Å; N222-G415 PolarHBondContact OD1-N 3.21Å
223	K	81.3	Confident	80.4	Confident	106 Å²	106	70.9 Å²	70.9	46%	0.461	37%	0.372	S	S	.	.			trans	-104.3	111.6	178.9	-67.5	-176.6	179.4	-178.2	0	110.5	S221 E225 D312	S221-K223 PolarHBondContact O-N 2.93Å; K223-E225 VanDerWaalsContact C-N 3.29Å; K223-E225 PolarHBondContact O-N 3.39Å; K223-D312 HydrophobicContact CG-CB 3.95Å
224	A	70.9	Confident	80.3	Confident	40 Å²	40	63 Å²	63	33%	0.331	34%	0.343	S	S	.	.			trans	-96.6	45.1	169.8	0	0	0	0	0	110.9
225	E	67.8	Low	80.5	Confident	101 Å²	101	63.2 Å²	63.2	47%	0.472	34%	0.336	S	S	.	.			trans	-82	125.9	-177.7	-172.7	169.8	-160.9	0	0	111.2	K223 V227 R289	K223-E225 VanDerWaalsContact C-N 3.29Å; K223-E225 PolarHBondContact O-N 3.39Å; E225-V227 PolarHBondContact O-N 3.49Å; E225-R289 IonicContact OE1-CZ 3.06Å; E225-R289 IonicContact OE1-NE 3.38Å; E225-R289 IonicContact OE1-NH2 2.89Å; E225-R289 PolarHBondContact OE1-NH2 2.98Å
226	M	67.8	Low	80.5	Confident	29 Å²	29	68.3 Å²	68.3	14%	0.143	36%	0.357	C	S	.	.			trans	-78.2	110.2	168.5	-60.2	-170.4	-173.1	0	0	109.1	V228 I288 L424 L428	M226-V228 PolarHBondContact O-N 2.88Å; M226-I288 HydrophobicContact CE-CG2 4.24Å; M226-I288 HydrophobicContact SD-CG2 3.84Å; M226-L424 HydrophobicContact CE-CB 4.17Å; M226-L424 HydrophobicContact CE-CD1 4.19Å; M226-L424 HydrophobicContact CE-CD2 3.69Å; M226-L424 HydrophobicContact CE-CG 4.23Å; M226-L428 HydrophobicContact CE-CD1 4.08Å; M226-L428 HydrophobicContact CE-CD2 4.5Å; M226-L428 HydrophobicContact CE-CG 4.41Å; M226-L428 HydrophobicContact CG-CD1 3.9Å; M226-L428 HydrophobicContact SD-CD1 3.97Å; M226-L428 HydrophobicContact SD-CD2 3.89Å; M226-L428 HydrophobicContact SD-CG 4.33Å
227	V	66.6	Low	80.3	Confident	110 Å²	110	70.6 Å²	70.6	67%	0.667	37%	0.367	S	S	*	.			trans	-72.5	110.4	171.3	-174	0	0	0	0	107.3	E225	E225-V227 PolarHBondContact O-N 3.49Å
228	V	68.3	Low	80.1	Confident	35 Å²	35	69.9 Å²	69.9	21%	0.212	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-76.6	126.5	171.7	-178.8	0	0	0	0	106.5	M226 M285 R289	M226-V228 PolarHBondContact O-N 2.88Å; V228-M285 HydrophobicContact CG1-CB 4.3Å; V228-R289 HydrophobicContact CG2-CB 4.41Å
229	P	74.4	Confident	80.2	Confident	32 Å²	32	65.5 Å²	65.5	21%	0.208	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-61.5	146.6	176.8	25.9	-33.8	0	0	0	110	E233 L234	P229-E233 HydrophobicContact CB-CB 4.25Å; P229-E233 WeakPolarHBondContact CB-OE2 3.45Å; P229-L234 HydrophobicContact CB-CD2 4.28Å; P229-L234 HydrophobicContact CB-CG 4.02Å; P229-L234 HydrophobicContact CG-CD1 3.9Å; P229-L234 HydrophobicContact CG-CD2 3.62Å; P229-L234 HydrophobicContact CG-CG 3.62Å
230	D	85.3	Confident	80.2	Confident	104 Å²	104	65.3 Å²	65.3	56%	0.556	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-65.8	157.4	177.4	-76.5	-29.8	0	0	0	110.7	S232 E233 L234	D230-S232 PolarHBondContact O-N 3.29Å; D230-E233 HydrophobicContact CB-CG 4.34Å; D230-E233 PolarHBondContact N-OE2 3.37Å; D230-E233 PolarHBondContact O-N 3.38Å; D230-L234 PolarHBondContact O-N 3.48Å; D230-L234 VanDerWaalsContact O-N 3.16Å
231	F	86.9	Confident	79.8	Confident	84 Å²	84	65.7 Å²	65.7	37%	0.368	35%	0.35	S	S	.	.	H	α-helix	trans	-52.1	-41.6	175.8	176.6	-91.1	0	0	0	111.4	E233 F235 A275 V278 M282	F231-E233 VanDerWaalsContact C-N 3.34Å; F231-E233 PolarHBondContact O-N 2.96Å; F231-F235 HydrophobicContact CD1-CB 4.38Å; F231-F235 HydrophobicContact CE1-CB 4.05Å; F231-F235 HydrophobicContact CE1-CD2 4.45Å; F231-F235 HydrophobicContact CE1-CG 4.23Å; F231-F235 HydrophobicContact CZ-CB 4.36Å; F231-F235 HydrophobicContact CZ-CD2 4.24Å; F231-F235 HydrophobicContact CZ-CG 4.44Å; F231-F235 WeakPolarHBondContact O-CB 3.13Å; F231-F235 PolarHBondContact O-N 3.09Å; F231-A275 HydrophobicContact CZ-CB 3.96Å; F231-V278 HydrophobicContact CD2-CB 4.36Å; F231-V278 HydrophobicContact CD2-CG1 3.55Å; F231-V278 HydrophobicContact CE2-CB 3.92Å; F231-V278 HydrophobicContact CE2-CG1 3.61Å; F231-V278 HydrophobicContact CG-CG1 4.36Å; F231-V278 HydrophobicContact CZ-CG1 4.44Å; F231-M282 VanDerWaalsContact CA-SD 3.59Å; F231-M282 HydrophobicContact CB-CE 4.15Å; F231-M282 HydrophobicContact CB-SD 3.62Å; F231-M282 HydrophobicContact CD2-SD 3.72Å; F231-M282 HydrophobicContact CG-SD 4.17Å
232	S	86.4	Confident	79.4	Confident	77 Å²	77	65 Å²	65	54%	0.538	35%	0.345	S	S	.	.	H	α-helix	trans	-64.6	-35.6	-179.9	56.4	0	0	0	0	113	D230 K236	D230-S232 PolarHBondContact O-N 3.29Å; S232-K236 WeakPolarHBondContact O-CB 3.48Å; S232-K236 PolarHBondContact O-N 3.21Å
233	E	84.8	Confident	78.9	Confident	115 Å²	115	66.1 Å²	66.1	54%	0.537	35%	0.349	S	S	.	.	H	α-helix	trans	-70.8	-48.3	179.1	-65.8	-174.5	151.6	0	0	111	P229 D230 F231 K236 E237	P229-E233 HydrophobicContact CB-CB 4.25Å; P229-E233 WeakPolarHBondContact CB-OE2 3.45Å; D230-E233 HydrophobicContact CB-CG 4.34Å; D230-E233 PolarHBondContact N-OE2 3.37Å; D230-E233 PolarHBondContact O-N 3.38Å; F231-E233 VanDerWaalsContact C-N 3.34Å; F231-E233 PolarHBondContact O-N 2.96Å; E233-K236 PolarHBondContact O-N 2.88Å; E233-E237 PolarHBondContact O-N 3.15Å
234	L	82.1	Confident	78.9	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-64.2	-41.7	176.1	-72.3	175.3	0	0	0	111.9	P229 D230 K236 E237 R238 V278 M282	P229-L234 HydrophobicContact CB-CD2 4.28Å; P229-L234 HydrophobicContact CB-CG 4.02Å; P229-L234 HydrophobicContact CG-CD1 3.9Å; P229-L234 HydrophobicContact CG-CD2 3.62Å; P229-L234 HydrophobicContact CG-CG 3.62Å; D230-L234 PolarHBondContact O-N 3.48Å; D230-L234 VanDerWaalsContact O-N 3.16Å; L234-K236 VanDerWaalsContact C-N 3.33Å; L234-E237 WeakPolarHBondContact O-CB 3.49Å; L234-E237 PolarHBondContact O-N 2.99Å; L234-R238 WeakPolarHBondContact O-CG 3.47Å; L234-R238 PolarHBondContact O-N 3.4Å; L234-V278 HydrophobicContact CB-CG1 3.66Å; L234-V278 HydrophobicContact CD1-CG1 4.27Å; L234-M282 HydrophobicContact CD1-CG 3.53Å; L234-M282 HydrophobicContact CD1-SD 4.48Å
235	F	87.9	Confident	79.5	Confident	48 Å²	48	61.6 Å²	61.6	21%	0.211	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-38.7	176.6	-174.9	-99.5	0	0	0	111.2	F231 R238 A239 V271 E274 A275 V278	F231-F235 HydrophobicContact CD1-CB 4.38Å; F231-F235 HydrophobicContact CE1-CB 4.05Å; F231-F235 HydrophobicContact CE1-CD2 4.45Å; F231-F235 HydrophobicContact CE1-CG 4.23Å; F231-F235 HydrophobicContact CZ-CB 4.36Å; F231-F235 HydrophobicContact CZ-CD2 4.24Å; F231-F235 HydrophobicContact CZ-CG 4.44Å; F231-F235 WeakPolarHBondContact O-CB 3.13Å; F231-F235 PolarHBondContact O-N 3.09Å; F235-R238 PolarHBondContact O-N 3.42Å; F235-A239 HydrophobicContact CD1-CB 4.43Å; F235-A239 HydrophobicContact CE1-CB 4.16Å; F235-A239 WeakPolarHBondContact O-CB 3.33Å; F235-A239 PolarHBondContact O-N 3.44Å; F235-V271 HydrophobicContact CZ-CG1 4.09Å; F235-E274 HydrophobicContact CE2-CB 4.1Å; F235-A275 HydrophobicContact CE2-CB 4.41Å; F235-V278 HydrophobicContact CB-CG2 4.39Å; F235-V278 HydrophobicContact CD2-CG2 4.29Å
236	K	86.1	Confident	80	Confident	115 Å²	115	60 Å²	60	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-40.9	173.9	-177.3	179.1	-180	179.6	0	112	S232 E233 L234 R238 A239 T240	S232-K236 WeakPolarHBondContact O-CB 3.48Å; S232-K236 PolarHBondContact O-N 3.21Å; E233-K236 PolarHBondContact O-N 2.88Å; L234-K236 VanDerWaalsContact C-N 3.33Å; K236-R238 VanDerWaalsContact C-N 3.3Å; K236-R238 PolarHBondContact O-N 3.01Å; K236-A239 PolarHBondContact O-N 3.35Å; K236-T240 HydrophobicContact CG-CG2 4.32Å; K236-T240 WeakPolarHBondContact O-CB 3.37Å; K236-T240 VanDerWaalsContact O-CG2 3.3Å; K236-T240 WeakPolarHBondContact O-CG2 3.28Å; K236-T240 PolarHBondContact O-N 2.93Å; K236-T240 PolarHBondContact O-OG1 3.11Å
237	E	81.3	Confident	80.7	Confident	128 Å²	128	59.2 Å²	59.2	60%	0.598	31%	0.312	S	S	*	.	H	α-helix	trans	-58.8	-43.4	174.6	-170.4	-174.2	168.2	0	0	111.2	E233 L234 T240 A241	E233-E237 PolarHBondContact O-N 3.15Å; L234-E237 WeakPolarHBondContact O-CB 3.49Å; L234-E237 PolarHBondContact O-N 2.99Å; E237-T240 PolarHBondContact O-OG1 3.04Å; E237-A241 PolarHBondContact O-N 3.22Å
238	R	79.5	Confident	81.6	Confident	77 Å²	77	56.5 Å²	56.5	29%	0.291	30%	0.296	S	S	.	.	H	α-helix	trans	-70.3	-45.9	176.5	-68.5	-68.6	-179.1	164.7	3	113.1	L234 F235 K236 T240 A241 V278	L234-R238 WeakPolarHBondContact O-CG 3.47Å; L234-R238 PolarHBondContact O-N 3.4Å; F235-R238 PolarHBondContact O-N 3.42Å; K236-R238 VanDerWaalsContact C-N 3.3Å; K236-R238 PolarHBondContact O-N 3.01Å; R238-T240 PolarHBondContact O-N 2.78Å; R238-A241 WeakPolarHBondContact O-CB 3.5Å; R238-A241 PolarHBondContact O-N 3.38Å; R238-V278 HydrophobicContact CB-CG2 4.44Å; R238-V278 HydrophobicContact CG-CG2 3.9Å
239	A	85.1	Confident	82.3	Confident	28 Å²	28	59.2 Å²	59.2	23%	0.231	31%	0.305	C	S	.	.	H	α-helix	trans	-67.1	-24.6	-179.1	0	0	0	0	0	112.8	F235 K236 A241 F244 V245	F235-A239 HydrophobicContact CD1-CB 4.43Å; F235-A239 HydrophobicContact CE1-CB 4.16Å; F235-A239 WeakPolarHBondContact O-CB 3.33Å; F235-A239 PolarHBondContact O-N 3.44Å; K236-A239 PolarHBondContact O-N 3.35Å; A239-A241 VanDerWaalsContact C-N 3.33Å; A239-F244 HydrophobicContact CB-CD1 4.18Å; A239-F244 HydrophobicContact CB-CE1 4.04Å; A239-F244 WeakPolarHBondContact O-CD1 3.43Å; A239-V245 WeakPolarHBondContact O-CG2 3.36Å
240	T	84.2	Confident	82.5	Confident	32 Å²	32	58.1 Å²	58.1	20%	0.196	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	0.4	173.1	56.3	0	0	0	0	112.8	W117 K236 E237 R238	W117-T240 PolarHBondContact NE1-O 3.48Å; K236-T240 HydrophobicContact CG-CG2 4.32Å; K236-T240 WeakPolarHBondContact O-CB 3.37Å; K236-T240 VanDerWaalsContact O-CG2 3.3Å; K236-T240 WeakPolarHBondContact O-CG2 3.28Å; K236-T240 PolarHBondContact O-N 2.93Å; K236-T240 PolarHBondContact O-OG1 3.11Å; E237-T240 PolarHBondContact O-OG1 3.04Å; R238-T240 PolarHBondContact O-N 2.78Å
241	A	78.1	Confident	82.3	Confident	32 Å²	32	53.5 Å²	53.5	26%	0.264	27%	0.274	S	S	.	.	S	Bend	trans	-60.5	135.5	175	0	0	0	0	0	110.2	E237 R238 A239 F243 F244 V245	E237-A241 PolarHBondContact O-N 3.22Å; R238-A241 WeakPolarHBondContact O-CB 3.5Å; R238-A241 PolarHBondContact O-N 3.38Å; A239-A241 VanDerWaalsContact C-N 3.33Å; A241-F243 PolarHBondContact O-N 2.94Å; A241-F243 VanDerWaalsContact O-N 3.08Å; A241-F244 PolarHBondContact O-N 3.02Å; A241-F244 VanDerWaalsContact O-N 3.07Å; A241-V245 WeakPolarHBondContact O-CG2 3.46Å; A241-V245 PolarHBondContact O-N 3.15Å
242	P	76.2	Confident	81.9	Confident	56 Å²	56	51.5 Å²	51.5	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-53.3	-36.6	-175.7	-28.4	33.7	0	0	0	114	W117 F246	W117-P242 HydrophobicContact CD2-CG 4.31Å; W117-P242 HydrophobicContact CZ2-CB 4.27Å; W117-P242 HydrophobicContact CZ2-CG 4.18Å; P242-F246 WeakPolarHBondContact O-CB 3.4Å; P242-F246 PolarHBondContact O-N 2.72Å
243	F	76.5	Confident	81.5	Confident	32 Å²	32	49.6 Å²	49.6	14%	0.14	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-46.4	178.9	-168.9	-89.5	0	0	0	112.4	A241 V245 F246 Q247 I445 V486 L490 P491	A241-F243 PolarHBondContact O-N 2.94Å; A241-F243 VanDerWaalsContact O-N 3.08Å; F243-V245 PolarHBondContact O-N 3.12Å; F243-F246 WeakPolarHBondContact O-CB 3.41Å; F243-F246 PolarHBondContact O-N 3.27Å; F243-Q247 HydrophobicContact CD1-CG 4.01Å; F243-Q247 HydrophobicContact CE1-CG 3.67Å; F243-Q247 VanDerWaalsContact CE1-NE2 3.3Å; F243-Q247 HydrophobicContact CZ-CG 4.34Å; F243-Q247 WeakPolarHBondContact O-CG 3.32Å; F243-Q247 PolarHBondContact O-N 3.06Å; F243-I445 HydrophobicContact CD2-CD1 3.99Å; F243-I445 HydrophobicContact CE2-CD1 3.66Å; F243-V486 HydrophobicContact CE2-CG1 4.12Å; F243-V486 HydrophobicContact CZ-CG1 4.22Å; F243-L490 HydrophobicContact CE2-CD2 4.14Å; F243-L490 HydrophobicContact CZ-CD2 3.97Å; F243-P491 HydrophobicContact CD1-CG 3.42Å; F243-P491 VanDerWaalsContact CD1-CG 3.42Å; F243-P491 HydrophobicContact CE1-CB 4.42Å; F243-P491 VanDerWaalsContact CE1-CD 3.43Å; F243-P491 HydrophobicContact CE1-CG 2.97Å; F243-P491 HydrophobicContact CG-CG 4.48Å; F243-P491 HydrophobicContact CZ-CG 3.73Å
244	F	81.6	Confident	81.1	Confident	13 Å²	13	46.7 Å²	46.7	6%	0.057	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-40.6	177.7	-175.5	-95.6	0	0	0	111.6	A239 A241 F246 Q247 V248 L270 V271 E274	A239-F244 HydrophobicContact CB-CD1 4.18Å; A239-F244 HydrophobicContact CB-CE1 4.04Å; A239-F244 WeakPolarHBondContact O-CD1 3.43Å; A241-F244 PolarHBondContact O-N 3.02Å; A241-F244 VanDerWaalsContact O-N 3.07Å; F244-F246 VanDerWaalsContact C-N 3.28Å; F244-F246 PolarHBondContact O-N 3.39Å; F244-Q247 PolarHBondContact O-N 2.77Å; F244-V248 HydrophobicContact CD1-CG2 3.93Å; F244-V248 HydrophobicContact CE1-CG2 3.54Å; F244-V248 HydrophobicContact CE2-CG2 4.42Å; F244-V248 HydrophobicContact CZ-CG2 3.82Å; F244-V248 WeakPolarHBondContact O-CG2 3.47Å; F244-V248 PolarHBondContact O-N 3.01Å; F244-L270 HydrophobicContact CE2-CB 4.38Å; F244-V271 HydrophobicContact CZ-CG2 4.13Å; F244-E274 HydrophobicContact CD2-CG 3.73Å; F244-E274 HydrophobicContact CE2-CB 4.46Å; F244-E274 HydrophobicContact CE2-CG 3.67Å
245	V	82.9	Confident	80.9	Confident	39 Å²	39	49.2 Å²	49.2	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-59	-42.8	173.8	173.8	0	0	0	0	110.9	L113 A239 A241 F243 V248 F249	L113-V245 HydrophobicContact CD1-CG1 4Å; A239-V245 WeakPolarHBondContact O-CG2 3.36Å; A241-V245 WeakPolarHBondContact O-CG2 3.46Å; A241-V245 PolarHBondContact O-N 3.15Å; F243-V245 PolarHBondContact O-N 3.12Å; V245-V248 PolarHBondContact O-N 3.04Å; V245-F249 WeakPolarHBondContact O-CB 3.43Å; V245-F249 PolarHBondContact O-N 2.79Å
246	F	79.1	Confident	80.3	Confident	68 Å²	68	51.1 Å²	51.1	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-43.8	175.8	179.1	-97.3	0	0	0	111.9	P242 F243 F244 F249 C250 V486	P242-F246 WeakPolarHBondContact O-CB 3.4Å; P242-F246 PolarHBondContact O-N 2.72Å; F243-F246 WeakPolarHBondContact O-CB 3.41Å; F243-F246 PolarHBondContact O-N 3.27Å; F244-F246 VanDerWaalsContact C-N 3.28Å; F244-F246 PolarHBondContact O-N 3.39Å; F246-F249 WeakPolarHBondContact O-CB 3.39Å; F246-F249 PolarHBondContact O-N 2.63Å; F246-C250 WeakPolarHBondContact CE1-SG 3.22Å; F246-C250 PolarHBondContact O-N 3.43Å; F246-C250 PolarHBondContact O-SG 3.06Å; F246-V486 HydrophobicContact CD1-CG1 4.25Å; F246-V486 HydrophobicContact CE1-CB 3.68Å; F246-V486 HydrophobicContact CE1-CG1 3.75Å; F246-V486 HydrophobicContact CE1-CG2 3.67Å; F246-V486 HydrophobicContact CZ-CB 4.42Å; F246-V486 HydrophobicContact CZ-CG2 4Å
247	Q	81.2	Confident	79.6	Confident	11 Å²	11	48 Å²	48	5%	0.051	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-46.3	176	-69.8	178.7	-55	0	0	112.7	F243 F244 F249 C250 V251 L270 P488	F243-Q247 HydrophobicContact CD1-CG 4.01Å; F243-Q247 HydrophobicContact CE1-CG 3.67Å; F243-Q247 VanDerWaalsContact CE1-NE2 3.3Å; F243-Q247 HydrophobicContact CZ-CG 4.34Å; F243-Q247 WeakPolarHBondContact O-CG 3.32Å; F243-Q247 PolarHBondContact O-N 3.06Å; F244-Q247 PolarHBondContact O-N 2.77Å; Q247-F249 VanDerWaalsContact C-N 3.26Å; Q247-F249 PolarHBondContact O-N 3.16Å; Q247-C250 WeakPolarHBondContact O-CB 3.39Å; Q247-C250 PolarHBondContact O-N 3.17Å; Q247-V251 WeakPolarHBondContact O-CG2 3.41Å; Q247-V251 PolarHBondContact O-N 3.18Å; Q247-L270 HydrophobicContact CB-CD1 4.28Å; Q247-P488 PolarHBondContact NE2-O 2.68Å
248	V	85.3	Confident	78.8	Confident	53 Å²	53	48.3 Å²	48.3	32%	0.321	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-38.2	177.3	173.8	0	0	0	0	110.7	F244 V245 V251 G252 L267	F244-V248 HydrophobicContact CD1-CG2 3.93Å; F244-V248 HydrophobicContact CE1-CG2 3.54Å; F244-V248 HydrophobicContact CE2-CG2 4.42Å; F244-V248 HydrophobicContact CZ-CG2 3.82Å; F244-V248 WeakPolarHBondContact O-CG2 3.47Å; F244-V248 PolarHBondContact O-N 3.01Å; V245-V248 PolarHBondContact O-N 3.04Å; V248-V251 PolarHBondContact O-N 3.3Å; V248-G252 PolarHBondContact O-N 3.16Å; V248-L267 HydrophobicContact CG1-CD1 4.28Å; V248-L267 HydrophobicContact CG2-CD1 4.02Å
249	F	82.7	Confident	78.2	Confident	93 Å²	93	49.8 Å²	49.8	41%	0.408	27%	0.27	S	S	.	.	H	α-helix	trans	-62.1	-45.3	173.2	173.5	-105.1	0	0	0	112	L106 V245 F246 Q247 V251 G252 L253	L106-F249 HydrophobicContact CD1-CD2 4.47Å; L106-F249 HydrophobicContact CD1-CE2 4.2Å; V245-F249 WeakPolarHBondContact O-CB 3.43Å; V245-F249 PolarHBondContact O-N 2.79Å; F246-F249 WeakPolarHBondContact O-CB 3.39Å; F246-F249 PolarHBondContact O-N 2.63Å; Q247-F249 VanDerWaalsContact C-N 3.26Å; Q247-F249 PolarHBondContact O-N 3.16Å; F249-V251 PolarHBondContact O-N 3.19Å; F249-G252 PolarHBondContact O-N 3.44Å; F249-L253 HydrophobicContact CD1-CD1 4.05Å; F249-L253 HydrophobicContact CE1-CD1 3.52Å; F249-L253 HydrophobicContact CE1-CG 4.46Å; F249-L253 HydrophobicContact CE2-CD1 4.29Å; F249-L253 HydrophobicContact CE2-CG 4.45Å; F249-L253 HydrophobicContact CZ-CD1 3.67Å; F249-L253 HydrophobicContact CZ-CD2 4.44Å; F249-L253 HydrophobicContact CZ-CG 4.28Å; F249-L253 WeakPolarHBondContact O-CG 3.32Å; F249-L253 PolarHBondContact O-N 3.37Å
250	C	78.6	Confident	77.8	Confident	9 Å²	9	56.2 Å²	56.2	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-46.8	175.3	-63.6	0	0	0	0	112.2	F246 Q247 G252 L253 W254 T483	F246-C250 WeakPolarHBondContact CE1-SG 3.22Å; F246-C250 PolarHBondContact O-N 3.43Å; F246-C250 PolarHBondContact O-SG 3.06Å; Q247-C250 WeakPolarHBondContact O-CB 3.39Å; Q247-C250 PolarHBondContact O-N 3.17Å; C250-G252 VanDerWaalsContact C-N 3.28Å; C250-G252 PolarHBondContact O-N 3.45Å; C250-L253 WeakPolarHBondContact O-CB 3.12Å; C250-L253 PolarHBondContact O-N 3.02Å; C250-L253 VanDerWaalsContact O-N 3.09Å; C250-W254 PolarHBondContact O-N 3.4Å; C250-T483 HydrophobicContact CB-CG2 3.86Å
251	V	81.2	Confident	77.5	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-34.8	177.6	176.7	0	0	0	0	111.6	Q247 V248 F249 L253 W254 C255 S263 T266 L267 L270	Q247-V251 WeakPolarHBondContact O-CG2 3.41Å; Q247-V251 PolarHBondContact O-N 3.18Å; V248-V251 PolarHBondContact O-N 3.3Å; F249-V251 PolarHBondContact O-N 3.19Å; V251-L253 VanDerWaalsContact C-N 3.3Å; V251-L253 PolarHBondContact O-N 2.96Å; V251-W254 HydrophobicContact CG2-CE3 4.39Å; V251-W254 PolarHBondContact O-N 3.22Å; V251-C255 PolarHBondContact O-N 2.79Å; V251-S263 WeakPolarHBondContact CG1-O 3.45Å; V251-T266 HydrophobicContact CG2-CG2 4.04Å; V251-L267 HydrophobicContact CG1-CB 3.97Å; V251-L270 HydrophobicContact CG2-CD1 4.09Å
252	G	80.1	Confident	77.3	Confident	41 Å²	41	62.2 Å²	62.2	42%	0.423	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-37.9	172.2	0	0	0	0	0	112.7	V248 F249 C250 C255	V248-G252 PolarHBondContact O-N 3.16Å; F249-G252 PolarHBondContact O-N 3.44Å; C250-G252 VanDerWaalsContact C-N 3.28Å; C250-G252 PolarHBondContact O-N 3.45Å; G252-C255 WeakPolarHBondContact O-CB 3.31Å; G252-C255 PolarHBondContact O-N 3.05Å
253	L	77.7	Confident	77.5	Confident	37 Å²	37	59.8 Å²	59.8	19%	0.194	29%	0.287	C	S	.	.	H	α-helix	trans	-69.4	-37.6	174.4	-65.9	168.5	0	0	0	111.9	F249 C250 V251 C255 L256 T479 T483	F249-L253 HydrophobicContact CD1-CD1 4.05Å; F249-L253 HydrophobicContact CE1-CD1 3.52Å; F249-L253 HydrophobicContact CE1-CG 4.46Å; F249-L253 HydrophobicContact CE2-CD1 4.29Å; F249-L253 HydrophobicContact CE2-CG 4.45Å; F249-L253 HydrophobicContact CZ-CD1 3.67Å; F249-L253 HydrophobicContact CZ-CD2 4.44Å; F249-L253 HydrophobicContact CZ-CG 4.28Å; F249-L253 WeakPolarHBondContact O-CG 3.32Å; F249-L253 PolarHBondContact O-N 3.37Å; C250-L253 WeakPolarHBondContact O-CB 3.12Å; C250-L253 PolarHBondContact O-N 3.02Å; C250-L253 VanDerWaalsContact O-N 3.09Å; V251-L253 VanDerWaalsContact C-N 3.3Å; V251-L253 PolarHBondContact O-N 2.96Å; L253-C255 PolarHBondContact O-N 2.88Å; L253-L256 HydrophobicContact CD2-CD1 4.25Å; L253-L256 WeakPolarHBondContact O-CB 3.49Å; L253-L256 PolarHBondContact O-N 2.54Å; L253-L256 VanDerWaalsContact O-N 3.13Å; L253-T479 HydrophobicContact CB-CG2 3.83Å; L253-T479 HydrophobicContact CD1-CG2 3.58Å; L253-T479 HydrophobicContact CD2-CG2 4.03Å; L253-T479 HydrophobicContact CG-CG2 4.01Å; L253-T483 HydrophobicContact CB-CG2 4.48Å; L253-T483 HydrophobicContact CD1-CG2 3.83Å
254	W	75.7	Confident	77.8	Confident	55 Å²	55	62 Å²	62	21%	0.208	30%	0.302	C	S	.	.	H	α-helix	trans	-65.3	-26	173.6	-62.7	-9.4	0	0	0	113.1	C250 V251 L256 D257 S263 T266 T483	C250-W254 PolarHBondContact O-N 3.4Å; V251-W254 HydrophobicContact CG2-CE3 4.39Å; V251-W254 PolarHBondContact O-N 3.22Å; W254-L256 PolarHBondContact O-N 3.4Å; W254-D257 WeakPolarHBondContact O-CB 3.4Å; W254-D257 PolarHBondContact O-N 3.33Å; W254-S263 WeakPolarHBondContact CB-OG 3.44Å; W254-S263 PolarHBondContact O-OG 3.15Å; W254-T266 HydrophobicContact CZ3-CG2 4.25Å; W254-T483 PolarHBondContact NE1-OG1 2.92Å
255	C	77.6	Confident	77.9	Confident	59 Å²	59	68.2 Å²	68.2	40%	0.399	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-15.5	175.3	-165.2	0	0	0	0	113.2	V251 G252 L253 S263	V251-C255 PolarHBondContact O-N 2.79Å; G252-C255 WeakPolarHBondContact O-CB 3.31Å; G252-C255 PolarHBondContact O-N 3.05Å; L253-C255 PolarHBondContact O-N 2.88Å; C255-S263 PolarHBondContact N-OG 2.87Å
256	L	75.9	Confident	77.7	Confident	89 Å²	89	67.4 Å²	67.4	47%	0.466	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-10	175	-62.3	174.6	0	0	0	112.8	L253 W254 L476	L253-L256 HydrophobicContact CD2-CD1 4.25Å; L253-L256 WeakPolarHBondContact O-CB 3.49Å; L253-L256 PolarHBondContact O-N 2.54Å; L253-L256 VanDerWaalsContact O-N 3.13Å; W254-L256 PolarHBondContact O-N 3.4Å; L256-L476 HydrophobicContact CB-CD2 3.6Å; L256-L476 HydrophobicContact CD1-CD2 4.4Å; L256-L476 WeakPolarHBondContact O-CD1 3.34Å
257	D	71.5	Confident	78	Confident	49 Å²	49	67.2 Å²	67.2	26%	0.262	33%	0.327	S	S	.	.	S	Bend	trans	-84.3	164.8	173	-168.2	23.1	0	0	0	111.7	W254 Y259	W254-D257 WeakPolarHBondContact O-CB 3.4Å; W254-D257 PolarHBondContact O-N 3.33Å; D257-Y259 PolarHBondContact O-N 2.75Å
258	E	64.4	Low	78.2	Confident	134 Å²	134	70.3 Å²	70.3	63%	0.626	35%	0.35	S	S	*	.	S	Bend	trans	-60	-19.8	-178	-71.4	178.5	-175.3	0	0	112.5	W260 K473	E258-W260 PolarHBondContact O-N 3.47Å; E258-K473 WeakPolarHBondContact OE1-CE 3.47Å; E258-K473 IonicContact OE1-NZ 3.72Å; E258-K473 PolarHBondContact OE1-NZ 3.25Å
259	Y	66	Low	78.1	Confident	109 Å²	109	71.6 Å²	71.6	43%	0.427	35%	0.353	S	S	.	.			trans	-95.8	53.5	-177.1	-61.3	-88.8	0	0	0	114.9	D257 Y261 Y262	D257-Y259 PolarHBondContact O-N 2.75Å; Y259-Y261 AromaticContact CD1-CE1 3.64Å; Y259-Y261 HydrophobicContact CD1-CE1 3.64Å; Y259-Y261 AromaticContact CD1-CZ 4Å; Y259-Y261 HydrophobicContact CG-CE1 4.41Å; Y259-Y261 PolarHBondContact O-N 3.07Å; Y259-Y262 HydrophobicContact CD1-CD2 4.18Å; Y259-Y262 AromaticContact CD1-CE2 3.98Å; Y259-Y262 HydrophobicContact CD1-CE2 3.98Å; Y259-Y262 HydrophobicContact CG-CD2 4.37Å; Y259-Y262 PolarHBondContact O-N 3.18Å
260	W	76.8	Confident	78.1	Confident	163 Å²	163	67.4 Å²	67.4	62%	0.617	34%	0.335	S	S	*	.	H	α-helix	trans	-57.1	-26.2	-177.9	66.5	-88.3	0	0	0	114.9	E258 S263 V264	E258-W260 PolarHBondContact O-N 3.47Å; W260-S263 PolarHBondContact O-N 2.79Å; W260-V264 HydrophobicContact CE3-CG2 4.06Å; W260-V264 HydrophobicContact CZ3-CG2 4.48Å; W260-V264 WeakPolarHBondContact O-CG2 3.2Å; W260-V264 PolarHBondContact O-N 3.3Å; W260-V264 VanDerWaalsContact O-N 3.11Å
261	Y	78	Confident	78.5	Confident	98 Å²	98	69.7 Å²	69.7	38%	0.384	35%	0.349	S	S	.	.	H	α-helix	trans	-68.6	-39	-177.1	67.7	-88.5	0	0	0	113.5	Y259 S263 V264 F265 D1011	Y259-Y261 AromaticContact CD1-CE1 3.64Å; Y259-Y261 HydrophobicContact CD1-CE1 3.64Å; Y259-Y261 AromaticContact CD1-CZ 4Å; Y259-Y261 HydrophobicContact CG-CE1 4.41Å; Y259-Y261 PolarHBondContact O-N 3.07Å; Y261-S263 VanDerWaalsContact C-N 3.32Å; Y261-S263 PolarHBondContact O-N 2.96Å; Y261-V264 PolarHBondContact O-N 2.81Å; Y261-F265 WeakPolarHBondContact O-CB 3.28Å; Y261-F265 PolarHBondContact O-N 2.77Å; Y261-D1011 PolarHBondContact OH-OD2 2.73Å
262	Y	73.5	Confident	78.7	Confident	91 Å²	91	72.2 Å²	72.2	36%	0.357	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-39.4	176.8	-73.3	-55.4	0	0	0	111.3	Y259 F265 T266 D1011	Y259-Y262 HydrophobicContact CD1-CD2 4.18Å; Y259-Y262 AromaticContact CD1-CE2 3.98Å; Y259-Y262 HydrophobicContact CD1-CE2 3.98Å; Y259-Y262 HydrophobicContact CG-CD2 4.37Å; Y259-Y262 PolarHBondContact O-N 3.18Å; Y262-F265 PolarHBondContact O-N 2.87Å; Y262-T266 WeakPolarHBondContact O-CB 3.4Å; Y262-T266 PolarHBondContact O-N 3.36Å; Y262-T266 PolarHBondContact O-OG1 3.04Å; Y262-D1011 VanDerWaalsContact OH-CG 3.24Å; Y262-D1011 PolarHBondContact OH-OD2 3.15Å
263	S	81.1	Confident	78.7	Confident	6 Å²	6	72.5 Å²	72.5	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-64	-44.5	177.2	-57.9	0	0	0	0	111.5	V251 W254 C255 W260 Y261 T266 L267	V251-S263 WeakPolarHBondContact CG1-O 3.45Å; W254-S263 WeakPolarHBondContact CB-OG 3.44Å; W254-S263 PolarHBondContact O-OG 3.15Å; C255-S263 PolarHBondContact N-OG 2.87Å; W260-S263 PolarHBondContact O-N 2.79Å; Y261-S263 VanDerWaalsContact C-N 3.32Å; Y261-S263 PolarHBondContact O-N 2.96Å; S263-T266 PolarHBondContact O-N 2.86Å; S263-L267 WeakPolarHBondContact O-CB 3.28Å; S263-L267 PolarHBondContact O-N 2.82Å
264	V	83.6	Confident	78.9	Confident	77 Å²	77	71.8 Å²	71.8	47%	0.467	36%	0.355	S	S	.	.	H	α-helix	trans	-64.7	-42.9	176.2	172.3	0	0	0	0	111.7	W260 Y261 L267 S268	W260-V264 HydrophobicContact CE3-CG2 4.06Å; W260-V264 HydrophobicContact CZ3-CG2 4.48Å; W260-V264 WeakPolarHBondContact O-CG2 3.2Å; W260-V264 PolarHBondContact O-N 3.3Å; W260-V264 VanDerWaalsContact O-N 3.11Å; Y261-V264 PolarHBondContact O-N 2.81Å; V264-L267 PolarHBondContact O-N 3.47Å; V264-S268 WeakPolarHBondContact O-CB 3.39Å; V264-S268 PolarHBondContact O-N 2.92Å
265	F	82.3	Confident	79.4	Confident	145 Å²	145	70.4 Å²	70.4	64%	0.636	36%	0.355	S	S	*	.	H	α-helix	trans	-61.8	-45.9	176.4	178.9	-99.2	0	0	0	111.8	Y261 Y262 L267 S268 M269	Y261-F265 WeakPolarHBondContact O-CB 3.28Å; Y261-F265 PolarHBondContact O-N 2.77Å; Y262-F265 PolarHBondContact O-N 2.87Å; F265-L267 PolarHBondContact O-N 2.77Å; F265-S268 WeakPolarHBondContact O-CB 3.35Å; F265-S268 PolarHBondContact O-N 2.77Å; F265-M269 PolarHBondContact O-N 2.89Å
266	T	79.4	Confident	79.4	Confident	22 Å²	22	70.2 Å²	70.2	14%	0.135	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-43.2	178.1	-56.7	0	0	0	0	111.6	V251 W254 Y262 S263 S268 M269 L270	V251-T266 HydrophobicContact CG2-CG2 4.04Å; W254-T266 HydrophobicContact CZ3-CG2 4.25Å; Y262-T266 WeakPolarHBondContact O-CB 3.4Å; Y262-T266 PolarHBondContact O-N 3.36Å; Y262-T266 PolarHBondContact O-OG1 3.04Å; S263-T266 PolarHBondContact O-N 2.86Å; T266-S268 VanDerWaalsContact C-N 3.34Å; T266-S268 PolarHBondContact O-N 3.46Å; T266-M269 PolarHBondContact O-N 2.79Å; T266-L270 HydrophobicContact CG2-CD1 4.24Å; T266-L270 WeakPolarHBondContact O-CG 3.32Å; T266-L270 PolarHBondContact O-N 3.42Å
267	L	84.9	Confident	79.3	Confident	63 Å²	63	67.3 Å²	67.3	33%	0.33	34%	0.339	S	S	.	.	H	α-helix	trans	-60.7	-44.3	175.3	-175.1	62	0	0	0	111.6	V248 V251 S263 V264 F265 L270 V271	V248-L267 HydrophobicContact CG1-CD1 4.28Å; V248-L267 HydrophobicContact CG2-CD1 4.02Å; V251-L267 HydrophobicContact CG1-CB 3.97Å; S263-L267 WeakPolarHBondContact O-CB 3.28Å; S263-L267 PolarHBondContact O-N 2.82Å; V264-L267 PolarHBondContact O-N 3.47Å; F265-L267 PolarHBondContact O-N 2.77Å; L267-L270 PolarHBondContact O-N 3.02Å; L267-V271 HydrophobicContact CD1-CG2 4.42Å; L267-V271 WeakPolarHBondContact O-CG2 2.96Å; L267-V271 PolarHBondContact O-N 3.32Å
268	S	85.9	Confident	79.8	Confident	77 Å²	77	65 Å²	65	54%	0.538	33%	0.327	S	S	.	.	H	α-helix	trans	-61.1	-45	177.7	-173.7	0	0	0	0	111.6	V264 F265 T266 V271 A272	V264-S268 WeakPolarHBondContact O-CB 3.39Å; V264-S268 PolarHBondContact O-N 2.92Å; F265-S268 WeakPolarHBondContact O-CB 3.35Å; F265-S268 PolarHBondContact O-N 2.77Å; T266-S268 VanDerWaalsContact C-N 3.34Å; T266-S268 PolarHBondContact O-N 3.46Å; S268-V271 PolarHBondContact O-N 3.29Å; S268-A272 VanDerWaalsContact O-CB 3.3Å; S268-A272 WeakPolarHBondContact O-CB 3.37Å; S268-A272 PolarHBondContact O-N 3.37Å
269	M	83.1	Confident	80.5	Confident	79 Å²	79	63.5 Å²	63.5	39%	0.389	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-46.5	176.4	-175.8	-176.8	71.1	0	0	112	F265 T266 A272 F273	F265-M269 PolarHBondContact O-N 2.89Å; T266-M269 PolarHBondContact O-N 2.79Å; M269-A272 PolarHBondContact O-N 3.44Å; M269-F273 WeakPolarHBondContact O-CB 3.27Å; M269-F273 PolarHBondContact O-N 2.76Å
270	L	82.9	Confident	80.6	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-46.1	178.5	-74.6	171.8	0	0	0	112.1	F244 Q247 V251 T266 L267 F273 E274 P488	F244-L270 HydrophobicContact CE2-CB 4.38Å; Q247-L270 HydrophobicContact CB-CD1 4.28Å; V251-L270 HydrophobicContact CG2-CD1 4.09Å; T266-L270 HydrophobicContact CG2-CD1 4.24Å; T266-L270 WeakPolarHBondContact O-CG 3.32Å; T266-L270 PolarHBondContact O-N 3.42Å; L267-L270 PolarHBondContact O-N 3.02Å; L270-F273 PolarHBondContact O-N 2.95Å; L270-E274 PolarHBondContact O-N 3.12Å; L270-E274 VanDerWaalsContact O-N 3.1Å; L270-P488 HydrophobicContact CD2-CB 4.25Å
271	V	87.8	Confident	80.4	Confident	58 Å²	58	56.1 Å²	56.1	35%	0.352	30%	0.297	S	S	.	.	H	α-helix	trans	-65.2	-44	178.7	170.5	0	0	0	0	111.3	F235 F244 L267 S268 F273 E274 A275	F235-V271 HydrophobicContact CZ-CG1 4.09Å; F244-V271 HydrophobicContact CZ-CG2 4.13Å; L267-V271 HydrophobicContact CD1-CG2 4.42Å; L267-V271 WeakPolarHBondContact O-CG2 2.96Å; L267-V271 PolarHBondContact O-N 3.32Å; S268-V271 PolarHBondContact O-N 3.29Å; V271-F273 VanDerWaalsContact C-N 3.29Å; V271-F273 PolarHBondContact O-N 3.47Å; V271-E274 PolarHBondContact O-N 3.02Å; V271-A275 VanDerWaalsContact O-CB 3.31Å; V271-A275 WeakPolarHBondContact O-CB 3.09Å; V271-A275 PolarHBondContact O-N 3.42Å
272	A	85.3	Confident	80.2	Confident	59 Å²	59	53.9 Å²	53.9	49%	0.488	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-38.7	178.1	0	0	0	0	0	111.9	S268 M269 S276	S268-A272 VanDerWaalsContact O-CB 3.3Å; S268-A272 WeakPolarHBondContact O-CB 3.37Å; S268-A272 PolarHBondContact O-N 3.37Å; M269-A272 PolarHBondContact O-N 3.44Å; A272-S276 PolarHBondContact O-N 2.9Å
273	F	79.6	Confident	80.2	Confident	48 Å²	48	57.1 Å²	57.1	21%	0.211	30%	0.302	C	S	.	.	H	α-helix	trans	-65.6	-50.7	176.9	179.8	-100.2	0	0	0	112.3	M269 L270 V271 A275 S276 L277 I492	M269-F273 WeakPolarHBondContact O-CB 3.27Å; M269-F273 PolarHBondContact O-N 2.76Å; L270-F273 PolarHBondContact O-N 2.95Å; V271-F273 VanDerWaalsContact C-N 3.29Å; V271-F273 PolarHBondContact O-N 3.47Å; F273-A275 VanDerWaalsContact C-N 3.27Å; F273-A275 PolarHBondContact O-N 3.21Å; F273-S276 WeakPolarHBondContact O-CB 3.36Å; F273-S276 PolarHBondContact O-N 2.96Å; F273-S276 PolarHBondContact O-OG 3.02Å; F273-L277 HydrophobicContact CD1-CD1 4.07Å; F273-L277 HydrophobicContact CD1-CG 4.48Å; F273-L277 HydrophobicContact CE1-CD1 3.4Å; F273-L277 HydrophobicContact CE1-CG 3.98Å; F273-L277 HydrophobicContact CZ-CD1 3.82Å; F273-L277 HydrophobicContact CZ-CD2 4.2Å; F273-L277 HydrophobicContact CZ-CG 4.04Å; F273-L277 PolarHBondContact O-N 3.44Å; F273-I492 HydrophobicContact CD1-CD1 4.38Å; F273-I492 HydrophobicContact CD1-CG1 3.81Å; F273-I492 HydrophobicContact CD2-CG1 4.45Å; F273-I492 HydrophobicContact CD2-CG2 4.29Å; F273-I492 HydrophobicContact CE1-CB 4.18Å; F273-I492 HydrophobicContact CE1-CG1 3.66Å; F273-I492 HydrophobicContact CE1-CG2 4.43Å; F273-I492 HydrophobicContact CE2-CB 4.38Å; F273-I492 HydrophobicContact CE2-CG1 4.34Å; F273-I492 HydrophobicContact CE2-CG2 3.75Å; F273-I492 HydrophobicContact CG-CD1 4.38Å; F273-I492 HydrophobicContact CG-CG1 4.2Å; F273-I492 HydrophobicContact CZ-CB 4Å; F273-I492 HydrophobicContact CZ-CG1 3.95Å; F273-I492 HydrophobicContact CZ-CG2 3.83Å
274	E	81.6	Confident	79.5	Confident	22 Å²	22	60.6 Å²	60.6	10%	0.103	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-38.5	176.6	-74.5	-65.6	167.2	0	0	111.8	F235 F244 L270 V271 S276 L277 V278	F235-E274 HydrophobicContact CE2-CB 4.1Å; F244-E274 HydrophobicContact CD2-CG 3.73Å; F244-E274 HydrophobicContact CE2-CB 4.46Å; F244-E274 HydrophobicContact CE2-CG 3.67Å; L270-E274 PolarHBondContact O-N 3.12Å; L270-E274 VanDerWaalsContact O-N 3.1Å; V271-E274 PolarHBondContact O-N 3.02Å; E274-S276 VanDerWaalsContact C-N 3.33Å; E274-S276 PolarHBondContact O-N 3.38Å; E274-L277 PolarHBondContact O-N 3.41Å; E274-V278 WeakPolarHBondContact O-CG2 3.3Å; E274-V278 PolarHBondContact O-N 2.7Å
275	A	85.7	Confident	78.6	Confident	25 Å²	25	58.5 Å²	58.5	21%	0.207	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-41.4	173.3	0	0	0	0	0	112	F231 F235 V271 F273 V278 Q279	F231-A275 HydrophobicContact CZ-CB 3.96Å; F235-A275 HydrophobicContact CE2-CB 4.41Å; V271-A275 VanDerWaalsContact O-CB 3.31Å; V271-A275 WeakPolarHBondContact O-CB 3.09Å; V271-A275 PolarHBondContact O-N 3.42Å; F273-A275 VanDerWaalsContact C-N 3.27Å; F273-A275 PolarHBondContact O-N 3.21Å; A275-V278 PolarHBondContact O-N 3.23Å; A275-Q279 WeakPolarHBondContact O-CB 3.41Å; A275-Q279 PolarHBondContact O-N 3Å
276	S	79.1	Confident	77.9	Confident	55 Å²	55	54 Å²	54	39%	0.385	29%	0.292	S	S	.	.	H	α-helix	trans	-64.1	-39.4	177	80.7	0	0	0	0	112.5	A272 F273 E274 Q279 Q280	A272-S276 PolarHBondContact O-N 2.9Å; F273-S276 WeakPolarHBondContact O-CB 3.36Å; F273-S276 PolarHBondContact O-N 2.96Å; F273-S276 PolarHBondContact O-OG 3.02Å; E274-S276 VanDerWaalsContact C-N 3.33Å; E274-S276 PolarHBondContact O-N 3.38Å; S276-Q279 PolarHBondContact O-N 2.85Å; S276-Q280 PolarHBondContact O-N 3.18Å
277	L	73.7	Confident	77.2	Confident	28 Å²	28	58.4 Å²	58.4	15%	0.147	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-43.2	175.8	-71.7	-179.6	0	0	0	111.6	F273 E274 Q279 Q280 Q281	F273-L277 HydrophobicContact CD1-CD1 4.07Å; F273-L277 HydrophobicContact CD1-CG 4.48Å; F273-L277 HydrophobicContact CE1-CD1 3.4Å; F273-L277 HydrophobicContact CE1-CG 3.98Å; F273-L277 HydrophobicContact CZ-CD1 3.82Å; F273-L277 HydrophobicContact CZ-CD2 4.2Å; F273-L277 HydrophobicContact CZ-CG 4.04Å; F273-L277 PolarHBondContact O-N 3.44Å; E274-L277 PolarHBondContact O-N 3.41Å; L277-Q279 VanDerWaalsContact C-N 3.33Å; L277-Q279 PolarHBondContact O-N 3.19Å; L277-Q280 PolarHBondContact O-N 2.74Å; L277-Q281 WeakPolarHBondContact O-CB 3.5Å; L277-Q281 PolarHBondContact O-N 3.36Å
278	V	81.4	Confident	76.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-43	175	172.9	0	0	0	0	110.4	F231 L234 F235 R238 E274 A275 Q280 Q281 M282	F231-V278 HydrophobicContact CD2-CB 4.36Å; F231-V278 HydrophobicContact CD2-CG1 3.55Å; F231-V278 HydrophobicContact CE2-CB 3.92Å; F231-V278 HydrophobicContact CE2-CG1 3.61Å; F231-V278 HydrophobicContact CG-CG1 4.36Å; F231-V278 HydrophobicContact CZ-CG1 4.44Å; L234-V278 HydrophobicContact CB-CG1 3.66Å; L234-V278 HydrophobicContact CD1-CG1 4.27Å; F235-V278 HydrophobicContact CB-CG2 4.39Å; F235-V278 HydrophobicContact CD2-CG2 4.29Å; R238-V278 HydrophobicContact CB-CG2 4.44Å; R238-V278 HydrophobicContact CG-CG2 3.9Å; E274-V278 WeakPolarHBondContact O-CG2 3.3Å; E274-V278 PolarHBondContact O-N 2.7Å; A275-V278 PolarHBondContact O-N 3.23Å; V278-Q280 VanDerWaalsContact C-N 3.33Å; V278-Q280 PolarHBondContact O-N 2.83Å; V278-Q281 PolarHBondContact O-N 3.28Å; V278-M282 HydrophobicContact CG1-CG 4.4Å; V278-M282 HydrophobicContact CG1-SD 4.36Å; V278-M282 WeakPolarHBondContact O-CG 3.38Å; V278-M282 PolarHBondContact O-N 3.44Å
279	Q	78.2	Confident	75.1	Confident	103 Å²	103	60.7 Å²	60.7	48%	0.481	31%	0.307	S	S	.	.	H	α-helix	trans	-63.2	-39.8	178	-168.4	170.3	14.4	0	0	112	A275 S276 L277 M282 R283	A275-Q279 WeakPolarHBondContact O-CB 3.41Å; A275-Q279 PolarHBondContact O-N 3Å; S276-Q279 PolarHBondContact O-N 2.85Å; L277-Q279 VanDerWaalsContact C-N 3.33Å; L277-Q279 PolarHBondContact O-N 3.19Å; Q279-M282 PolarHBondContact O-N 3.21Å; Q279-R283 WeakPolarHBondContact O-CG 3.4Å; Q279-R283 PolarHBondContact O-N 2.7Å; Q279-R283 VanDerWaalsContact O-N 3.12Å
280	Q	69.8	Low	73.9	Confident	83 Å²	83	65.1 Å²	65.1	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-43.9	173	-171.4	176.8	5.3	0	0	111.5	S276 L277 V278 M282 R283 N284	S276-Q280 PolarHBondContact O-N 3.18Å; L277-Q280 PolarHBondContact O-N 2.74Å; V278-Q280 VanDerWaalsContact C-N 3.33Å; V278-Q280 PolarHBondContact O-N 2.83Å; Q280-M282 PolarHBondContact O-N 2.78Å; Q280-R283 PolarHBondContact O-N 3.32Å; Q280-N284 PolarHBondContact O-N 3.35Å; Q280-N284 PolarHBondContact O-OD1 3.47Å
281	Q	71.9	Confident	72.6	Confident	35 Å²	35	68.9 Å²	68.9	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-61.5	-41.7	176.7	-174.3	176.3	-29.6	0	0	111.8	L277 V278 N284 M285	L277-Q281 WeakPolarHBondContact O-CB 3.5Å; L277-Q281 PolarHBondContact O-N 3.36Å; V278-Q281 PolarHBondContact O-N 3.28Å; Q281-N284 PolarHBondContact O-N 3.12Å; Q281-M285 WeakPolarHBondContact O-CG 3.48Å; Q281-M285 PolarHBondContact O-N 3.43Å
282	M	73.6	Confident	71.3	Confident	51 Å²	51	67.9 Å²	67.9	25%	0.251	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-41.3	176.8	-74.7	-176.3	79.2	0	0	112.7	F231 L234 V278 Q279 Q280 N284 M285 S286	F231-M282 VanDerWaalsContact CA-SD 3.59Å; F231-M282 HydrophobicContact CB-CE 4.15Å; F231-M282 HydrophobicContact CB-SD 3.62Å; F231-M282 HydrophobicContact CD2-SD 3.72Å; F231-M282 HydrophobicContact CG-SD 4.17Å; L234-M282 HydrophobicContact CD1-CG 3.53Å; L234-M282 HydrophobicContact CD1-SD 4.48Å; V278-M282 HydrophobicContact CG1-CG 4.4Å; V278-M282 HydrophobicContact CG1-SD 4.36Å; V278-M282 WeakPolarHBondContact O-CG 3.38Å; V278-M282 PolarHBondContact O-N 3.44Å; Q279-M282 PolarHBondContact O-N 3.21Å; Q280-M282 PolarHBondContact O-N 2.78Å; M282-N284 VanDerWaalsContact C-N 3.33Å; M282-N284 PolarHBondContact O-N 2.98Å; M282-M285 PolarHBondContact O-N 2.79Å; M282-S286 WeakPolarHBondContact O-CB 3.37Å; M282-S286 PolarHBondContact O-N 3.29Å
283	R	72.5	Confident	70.4	Confident	158 Å²	158	68.1 Å²	68.1	60%	0.596	34%	0.337	S	S	*	.	H	α-helix	trans	-57.6	-48.9	175.4	-73.3	-178.7	-169.9	-172.4	4.5	110.4	Q279 Q280 M285 S286 E287	Q279-R283 WeakPolarHBondContact O-CG 3.4Å; Q279-R283 PolarHBondContact O-N 2.7Å; Q279-R283 VanDerWaalsContact O-N 3.12Å; Q280-R283 PolarHBondContact O-N 3.32Å; R283-M285 PolarHBondContact O-N 3.42Å; R283-S286 PolarHBondContact O-N 3.25Å; R283-S286 VanDerWaalsContact O-N 3.17Å; R283-S286 PolarHBondContact O-OG 3.35Å; R283-E287 PolarHBondContact O-N 3.17Å; R283-E287 VanDerWaalsContact O-N 3.14Å
284	N	66.4	Low	70.2	Confident	79 Å²	79	74.4 Å²	74.4	42%	0.422	37%	0.365	S	S	.	.	H	α-helix	trans	-60.3	-42.3	178	-64	-4.6	0	0	0	112.2	Q280 Q281 M282 E287 I288	Q280-N284 PolarHBondContact O-N 3.35Å; Q280-N284 PolarHBondContact O-OD1 3.47Å; Q281-N284 PolarHBondContact O-N 3.12Å; M282-N284 VanDerWaalsContact C-N 3.33Å; M282-N284 PolarHBondContact O-N 2.98Å; N284-E287 PolarHBondContact O-N 2.78Å; N284-I288 PolarHBondContact O-N 3.44Å
285	M	64.8	Low	70.2	Confident	34 Å²	34	77.1 Å²	77.1	17%	0.167	38%	0.384	C	S	.	.	H	α-helix	trans	-70.1	-31.7	177.5	-63.8	-161.4	89.8	0	0	113	V228 Q281 M282 R283 E287 I288 R289 R433	V228-M285 HydrophobicContact CG1-CB 4.3Å; Q281-M285 WeakPolarHBondContact O-CG 3.48Å; Q281-M285 PolarHBondContact O-N 3.43Å; M282-M285 PolarHBondContact O-N 2.79Å; R283-M285 PolarHBondContact O-N 3.42Å; M285-E287 VanDerWaalsContact C-N 3.31Å; M285-E287 PolarHBondContact O-N 3.34Å; M285-I288 PolarHBondContact O-N 2.76Å; M285-R289 PolarHBondContact O-N 2.87Å; M285-R433 VanDerWaalsContact CE-NH2 3.31Å
286	S	68.6	Low	70.3	Confident	50 Å²	50	77.8 Å²	77.8	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-68.1	-30.3	175.7	79.5	0	0	0	0	112.8	M282 R283 R289 K290	M282-S286 WeakPolarHBondContact O-CB 3.37Å; M282-S286 PolarHBondContact O-N 3.29Å; R283-S286 PolarHBondContact O-N 3.25Å; R283-S286 VanDerWaalsContact O-N 3.17Å; R283-S286 PolarHBondContact O-OG 3.35Å; S286-R289 PolarHBondContact O-N 3.21Å; S286-K290 PolarHBondContact O-N 3.4Å
287	E	64.3	Low	70.8	Confident	115 Å²	115	80.9 Å²	80.9	54%	0.537	39%	0.393	S	S	.	.	H	α-helix	trans	-68.3	-41.8	173.5	-71	179.1	176.1	0	0	111.5	R283 N284 M285 R289 K290	R283-E287 PolarHBondContact O-N 3.17Å; R283-E287 VanDerWaalsContact O-N 3.14Å; N284-E287 PolarHBondContact O-N 2.78Å; M285-E287 VanDerWaalsContact C-N 3.31Å; M285-E287 PolarHBondContact O-N 3.34Å; E287-R289 VanDerWaalsContact C-N 3.28Å; E287-R289 PolarHBondContact O-N 2.85Å; E287-K290 WeakPolarHBondContact O-CB 3.35Å; E287-K290 PolarHBondContact O-N 2.81Å; E287-K290 VanDerWaalsContact O-N 3.15Å
288	I	62.3	Low	71.6	Confident	60 Å²	60	80.4 Å²	80.4	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-37.6	174.9	-61.3	170.1	0	0	0	110.8	M226 N284 M285 K290 M291	M226-I288 HydrophobicContact CE-CG2 4.24Å; M226-I288 HydrophobicContact SD-CG2 3.84Å; N284-I288 PolarHBondContact O-N 3.44Å; M285-I288 PolarHBondContact O-N 2.76Å; I288-K290 VanDerWaalsContact C-N 3.27Å; I288-K290 PolarHBondContact O-N 2.73Å; I288-M291 VanDerWaalsContact O-CB 3.26Å; I288-M291 WeakPolarHBondContact O-CB 3.28Å; I288-M291 WeakPolarHBondContact O-CG 3.27Å; I288-M291 PolarHBondContact O-N 2.85Å; I288-M291 VanDerWaalsContact O-N 3.08Å
289	R	64	Low	72.2	Confident	127 Å²	127	82.9 Å²	82.9	48%	0.479	40%	0.402	S	S	.	.	H	α-helix	trans	-60.9	-33.1	176.7	-173.4	-179.6	179.7	-169.6	1.5	113.1	E225 V228 M285 S286 E287 M291 G292	E225-R289 IonicContact OE1-CZ 3.06Å; E225-R289 IonicContact OE1-NE 3.38Å; E225-R289 IonicContact OE1-NH2 2.89Å; E225-R289 PolarHBondContact OE1-NH2 2.98Å; V228-R289 HydrophobicContact CG2-CB 4.41Å; M285-R289 PolarHBondContact O-N 2.87Å; S286-R289 PolarHBondContact O-N 3.21Å; E287-R289 VanDerWaalsContact C-N 3.28Å; E287-R289 PolarHBondContact O-N 2.85Å; R289-M291 PolarHBondContact O-N 3.44Å; R289-M291 VanDerWaalsContact O-N 3.11Å; R289-G292 PolarHBondContact O-N 3.08Å; R289-G292 VanDerWaalsContact O-N 3.1Å
290	K	58.7	Low	72.9	Confident	172 Å²	172	78 Å²	78	75%	0.748	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.2	178	-66.8	176.3	-176.3	172.1	0	113	S286 E287 I288	S286-K290 PolarHBondContact O-N 3.4Å; E287-K290 WeakPolarHBondContact O-CB 3.35Å; E287-K290 PolarHBondContact O-N 2.81Å; E287-K290 VanDerWaalsContact O-N 3.15Å; I288-K290 VanDerWaalsContact C-N 3.27Å; I288-K290 PolarHBondContact O-N 2.73Å
291	M	56	Low	74	Confident	84 Å²	84	75.7 Å²	75.7	41%	0.414	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-11.8	174.4	-54.7	179.2	-173.1	0	0	113.4	I288 R289 L948	I288-M291 VanDerWaalsContact O-CB 3.26Å; I288-M291 WeakPolarHBondContact O-CB 3.28Å; I288-M291 WeakPolarHBondContact O-CG 3.27Å; I288-M291 PolarHBondContact O-N 2.85Å; I288-M291 VanDerWaalsContact O-N 3.08Å; R289-M291 PolarHBondContact O-N 3.44Å; R289-M291 VanDerWaalsContact O-N 3.11Å; M291-L948 HydrophobicContact CE-CD1 3.46Å; M291-L948 VanDerWaalsContact CE-CD1 3.46Å; M291-L948 HydrophobicContact SD-CD1 4.28Å
292	G	59.2	Low	74.8	Confident	37 Å²	37	75 Å²	75	38%	0.381	36%	0.363	S	S	.	.	S	Bend	trans	-73.1	147.7	177.7	0	0	0	0	0	113.5	R289	R289-G292 PolarHBondContact O-N 3.08Å; R289-G292 VanDerWaalsContact O-N 3.1Å
293	N	67.3	Low	75.5	Confident	64 Å²	64	74.1 Å²	74.1	34%	0.342	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-69.6	130	179.1	-67.2	-4.3	0	0	0	110.8	L330	N293-L330 VanDerWaalsContact OD1-CD1 3.31Å; N293-L330 WeakPolarHBondContact OD1-CD1 3.37Å
294	K	74.4	Confident	76.1	Confident	181 Å²	181	75.2 Å²	75.2	79%	0.787	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-75.8	142.8	173.4	-69.6	-176.5	-179.3	178.7	0	110.7	H296	K294-H296 PolarHBondContact O-N 3.45Å
295	P	82.4	Confident	77.2	Confident	78 Å²	78	78.1 Å²	78.1	51%	0.506	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62.8	137.4	177.5	-20.7	32.2	0	0	0	111.5	S311 D312	P295-S311 VanDerWaalsContact CA-OG 3.23Å; P295-S311 WeakPolarHBondContact CA-OG 3.2Å; P295-D312 WeakPolarHBondContact CB-OD1 3.28Å; P295-D312 WeakPolarHBondContact CG-OD1 3.4Å; P295-D312 WeakPolarHBondContact CG-OD2 3.42Å
296	H	87.8	Confident	78.4	Confident	39 Å²	39	78.6 Å²	78.6	18%	0.181	37%	0.374	C	S	.	.			trans	-139.6	161.8	175.1	65.6	-82.1	0	0	0	110.9	K294 S311 L330	K294-H296 PolarHBondContact O-N 3.45Å; H296-S311 PolarHBondContact N-OG 3.03Å; H296-S311 VanDerWaalsContact N-OG 3.14Å; H296-S311 WeakPolarHBondContact O-CB 3.48Å; H296-S311 PolarHBondContact O-N 3.06Å; H296-L330 PolarHBondContact CE1-O 2.96Å; H296-L330 VanDerWaalsContact CE1-O 3.3Å
297	M	90.3	Very high	79.5	Confident	121 Å²	121	81.8 Å²	81.8	60%	0.596	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.1	-179.3	-60	-60	-71.3	0	0	110.6	P308 V309 A310	M297-P308 HydrophobicContact CE-CB 3.89Å; M297-P308 WeakPolarHBondContact CE-O 3.38Å; M297-V309 WeakPolarHBondContact CA-O 3.16Å; M297-A310 HydrophobicContact SD-CB 4.18Å
298	I	90.8	Very high	80.8	Confident	18 Å²	18	80 Å²	80	9%	0.092	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150	174.8	-165.9	166.6	0	0	0	110	V300 P308 V309 I314 V320 S321 I322 P332	I298-V300 HydrophobicContact CG2-CG2 3.89Å; I298-P308 WeakPolarHBondContact O-CA 3.45Å; I298-V309 PolarHBondContact N-O 3.06Å; I298-V309 PolarHBondContact O-N 2.96Å; I298-I314 HydrophobicContact CG2-CD1 3.71Å; I298-I314 HydrophobicContact CG2-CG1 4.26Å; I298-V320 HydrophobicContact CD1-CB 4.3Å; I298-S321 WeakPolarHBondContact CD1-O 3.24Å; I298-S321 WeakPolarHBondContact CG1-O 3.28Å; I298-I322 HydrophobicContact CD1-CG1 4.48Å; I298-P332 HydrophobicContact CD1-CG 4.35Å
299	Q	92.9	Very high	82.2	Confident	52 Å²	52	77.8 Å²	77.8	24%	0.243	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.7	176	-64.6	-64.4	-29.4	0	0	110.1	W306 V320 S321	Q299-W306 HydrophobicContact CB-CE3 4.01Å; Q299-W306 HydrophobicContact CB-CZ3 4.44Å; Q299-V320 WeakPolarHBondContact O-CA 3.45Å; Q299-S321 PolarHBondContact O-N 2.58Å
300	V	93.3	Very high	83.6	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.8	178.4	-168.2	0	0	0	0	109.4	I298 R302 W306 R307 V309 D318 I319 V320	I298-V300 HydrophobicContact CG2-CG2 3.89Å; V300-R302 HydrophobicContact CG1-CG 4.01Å; V300-W306 WeakPolarHBondContact O-CA 3.42Å; V300-R307 PolarHBondContact N-O 3.26Å; V300-R307 PolarHBondContact O-N 3.45Å; V300-V309 HydrophobicContact CB-CB 4.41Å; V300-V309 HydrophobicContact CB-CG2 4.13Å; V300-V309 HydrophobicContact CG2-CB 3.8Å; V300-V309 HydrophobicContact CG2-CG2 4.08Å; V300-D318 HydrophobicContact CG1-CB 3.83Å; V300-I319 CarbonylContact C-O 3.59Å; V300-I319 WeakPolarHBondContact CA-O 3.29Å; V300-I319 WeakPolarHBondContact CG1-O 3.45Å; V300-V320 HydrophobicContact CG1-CG1 4.29Å; V300-V320 HydrophobicContact CG2-CG1 4.1Å
301	Y	91.9	Very high	85.1	Confident	34 Å²	34	65 Å²	65	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	100.9	177.3	-169.7	-100.2	0	0	0	110.5	R204 R304 W306 I319 L400	R204-Y301 WeakPolarHBondContact O-CD1 3.34Å; R204-Y301 WeakPolarHBondContact O-CE1 3.07Å; Y301-R304 VanDerWaalsContact CE2-C 3.48Å; Y301-R304 WeakPolarHBondContact CE2-O 3.43Å; Y301-R304 VanDerWaalsContact CZ-C 3.46Å; Y301-R304 WeakPolarHBondContact OH-CA 3.26Å; Y301-R304 PolarHBondContact OH-O 3.47Å; Y301-W306 AromaticContact CD2-CD1 3.9Å; Y301-W306 AromaticContact CD2-CD2 3.91Å; Y301-W306 HydrophobicContact CD2-CD2 3.91Å; Y301-W306 AromaticContact CD2-CE2 3.77Å; Y301-W306 HydrophobicContact CD2-CG 4.01Å; Y301-W306 HydrophobicContact CD2-CZ2 4.37Å; Y301-W306 AromaticContact CD2-NE1 3.75Å; Y301-I319 PolarHBondContact N-O 2.82Å; Y301-L400 HydrophobicContact CD1-CD2 3.67Å; Y301-L400 HydrophobicContact CD2-CD2 3.71Å; Y301-L400 HydrophobicContact CE1-CD1 4.42Å; Y301-L400 HydrophobicContact CE1-CD2 3.82Å; Y301-L400 HydrophobicContact CE2-CD2 3.87Å; Y301-L400 HydrophobicContact CE2-CG 4.44Å; Y301-L400 HydrophobicContact CG-CD2 3.59Å
302	R	90.4	Very high	86.7	Confident	22 Å²	22	62.8 Å²	62.8	8%	0.083	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.1	179	-69.9	177.6	176.5	179.2	4.8	110.3	I212 V300 R304 K305 E313 D318	I212-R302 HydrophobicContact CD1-CG 4.32Å; V300-R302 HydrophobicContact CG1-CG 4.01Å; R302-R304 PolarHBondContact O-N 3.43Å; R302-K305 PolarHBondContact N-O 3.15Å; R302-K305 PolarHBondContact O-N 3.03Å; R302-E313 PolarHBondContact NH2-O 2.76Å; R302-D318 IonicContact CZ-OD1 2.65Å; R302-D318 IonicContact CZ-OD2 3.14Å; R302-D318 IonicContact NE-OD1 2.78Å; R302-D318 PolarHBondContact NE-OD1 3.27Å; R302-D318 IonicContact NE-OD2 3.55Å; R302-D318 IonicContact NH2-OD1 3.15Å; R302-D318 IonicContact NH2-OD2 3.98Å; R302-D318 PolarHBondContact NH2-OD2 3.45Å
303	S	87.1	Confident	88.2	Confident	32 Å²	32	66.1 Å²	66.1	22%	0.224	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	41.6	-179.2	-35.4	0	0	0	0	113.1	F206 K305	F206-S303 PolarHBondContact O-N 2.71Å; S303-K305 PolarHBondContact O-N 3.42Å
304	R	85.3	Confident	89.4	Confident	181 Å²	181	63.1 Å²	63.1	68%	0.683	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	13.3	-177.4	-52.2	-175.8	-179.1	-176.5	0.4	116.4	Y301 R302	Y301-R304 VanDerWaalsContact CE2-C 3.48Å; Y301-R304 WeakPolarHBondContact CE2-O 3.43Å; Y301-R304 VanDerWaalsContact CZ-C 3.46Å; Y301-R304 WeakPolarHBondContact OH-CA 3.26Å; Y301-R304 PolarHBondContact OH-O 3.47Å; R302-R304 PolarHBondContact O-N 3.43Å
305	K	89.4	Confident	90.2	Very high	139 Å²	139	54.5 Å²	54.5	60%	0.604	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	148.1	179.3	-65.9	-175.2	-179.1	-180	0	111	R302 S303	R302-K305 PolarHBondContact N-O 3.15Å; R302-K305 PolarHBondContact O-N 3.03Å; S303-K305 PolarHBondContact O-N 3.42Å
306	W	90.7	Very high	90.7	Very high	44 Å²	44	50.9 Å²	50.9	17%	0.167	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	125.9	168.6	-68.9	101.5	0	0	0	109.5	Q299 V300 Y301 I319 L400 K401 V403 V408	Q299-W306 HydrophobicContact CB-CE3 4.01Å; Q299-W306 HydrophobicContact CB-CZ3 4.44Å; V300-W306 WeakPolarHBondContact O-CA 3.42Å; Y301-W306 AromaticContact CD2-CD1 3.9Å; Y301-W306 AromaticContact CD2-CD2 3.91Å; Y301-W306 HydrophobicContact CD2-CD2 3.91Å; Y301-W306 AromaticContact CD2-CE2 3.77Å; Y301-W306 HydrophobicContact CD2-CG 4.01Å; Y301-W306 HydrophobicContact CD2-CZ2 4.37Å; Y301-W306 AromaticContact CD2-NE1 3.75Å; W306-I319 HydrophobicContact CH2-CG2 4.21Å; W306-L400 HydrophobicContact CZ2-CD2 3.97Å; W306-K401 PolarHBondContact NE1-O 2.9Å; W306-V403 HydrophobicContact CB-CG2 3.86Å; W306-V403 HydrophobicContact CG-CG2 4.04Å; W306-V408 HydrophobicContact CH2-CG1 4.41Å; W306-V408 HydrophobicContact CH2-CG2 4.43Å; W306-V408 HydrophobicContact CZ2-CG2 4.44Å
307	R	91.6	Very high	90.8	Very high	118 Å²	118	49.4 Å²	49.4	45%	0.445	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.9	176.4	-60.8	-175	-173.6	179.8	5.3	109.6	V300 V309	V300-R307 PolarHBondContact N-O 3.26Å; V300-R307 PolarHBondContact O-N 3.45Å; R307-V309 PolarHBondContact O-N 3.31Å
308	P	91.7	Very high	90.9	Very high	77 Å²	77	43.6 Å²	43.6	50%	0.5	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	123.2	169.6	29.7	-32.1	0	0	0	109.3	M297 I298	M297-P308 HydrophobicContact CE-CB 3.89Å; M297-P308 WeakPolarHBondContact CE-O 3.38Å; I298-P308 WeakPolarHBondContact O-CA 3.45Å
309	V	92	Very high	91	Very high	14 Å²	14	43 Å²	43	9%	0.085	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150	177.5	179.9	0	0	0	0	108.5	M297 I298 V300 R307 E313	M297-V309 WeakPolarHBondContact CA-O 3.16Å; I298-V309 PolarHBondContact N-O 3.06Å; I298-V309 PolarHBondContact O-N 2.96Å; V300-V309 HydrophobicContact CB-CB 4.41Å; V300-V309 HydrophobicContact CB-CG2 4.13Å; V300-V309 HydrophobicContact CG2-CB 3.8Å; V300-V309 HydrophobicContact CG2-CG2 4.08Å; R307-V309 PolarHBondContact O-N 3.31Å; V309-E313 HydrophobicContact CG1-CB 3.74Å
310	A	92.1	Very high	91	Very high	25 Å²	25	40.5 Å²	40.5	21%	0.207	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	143.8	175.3	0	0	0	0	0	110.9	M297 D312 E313	M297-A310 HydrophobicContact SD-CB 4.18Å; A310-D312 PolarHBondContact O-N 2.98Å; A310-E313 HydrophobicContact CB-CG 4.46Å; A310-E313 PolarHBondContact O-N 3.39Å
311	S	89.8	Confident	91	Very high	5 Å²	5	40.7 Å²	40.7	4%	0.035	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-57.5	-24.1	-178.5	56.3	0	0	0	0	114.9	N222 P295 H296 I314	N222-S311 WeakPolarHBondContact CB-O 3.48Å; N222-S311 PolarHBondContact ND2-O 3.39Å; P295-S311 VanDerWaalsContact CA-OG 3.23Å; P295-S311 WeakPolarHBondContact CA-OG 3.2Å; H296-S311 PolarHBondContact N-OG 3.03Å; H296-S311 VanDerWaalsContact N-OG 3.14Å; H296-S311 WeakPolarHBondContact O-CB 3.48Å; H296-S311 PolarHBondContact O-N 3.06Å; S311-I314 WeakPolarHBondContact O-CD1 3.31Å; S311-I314 WeakPolarHBondContact O-CG1 3.36Å
312	D	90.1	Very high	91	Very high	37 Å²	37	39.4 Å²	39.4	20%	0.198	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-78.6	-20.8	-178.6	-65.3	5.2	0	0	0	112.8	S221 N222 K223 P295 A310	S221-D312 WeakPolarHBondContact CB-O 3.07Å; N222-D312 PolarHBondContact N-O 2.96Å; K223-D312 HydrophobicContact CG-CB 3.95Å; P295-D312 WeakPolarHBondContact CB-OD1 3.28Å; P295-D312 WeakPolarHBondContact CG-OD1 3.4Å; P295-D312 WeakPolarHBondContact CG-OD2 3.42Å; A310-D312 PolarHBondContact O-N 2.98Å
313	E	90.8	Very high	90.7	Very high	108 Å²	108	39.5 Å²	39.5	51%	0.505	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-95.2	4.1	-177.7	-63.3	175.8	-178.5	0	0	112.3	R302 V309 A310	R302-E313 PolarHBondContact NH2-O 2.76Å; V309-E313 HydrophobicContact CG1-CB 3.74Å; A310-E313 HydrophobicContact CB-CG 4.46Å; A310-E313 PolarHBondContact O-N 3.39Å
314	I	91.8	Very high	90.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.211	C	C	.	.			trans	-71.5	135.2	176.1	-58.3	174.1	0	0	0	109.2	N222 I298 S311 D318 P332 V411 T414	N222-I314 HydrophobicContact CB-CB 4.42Å; N222-I314 WeakPolarHBondContact CB-O 3.36Å; I298-I314 HydrophobicContact CG2-CD1 3.71Å; I298-I314 HydrophobicContact CG2-CG1 4.26Å; S311-I314 WeakPolarHBondContact O-CD1 3.31Å; S311-I314 WeakPolarHBondContact O-CG1 3.36Å; I314-D318 HydrophobicContact CG2-CB 4.4Å; I314-P332 HydrophobicContact CD1-CG 3.83Å; I314-V411 HydrophobicContact CG2-CB 4.31Å; I314-V411 HydrophobicContact CG2-CG1 3.95Å; I314-V411 HydrophobicContact CG2-CG2 3.63Å; I314-T414 HydrophobicContact CG2-CG2 4.45Å
315	V	92.3	Very high	90.2	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.19	C	C	.	.			trans	-122.3	152.7	175.1	-69.7	0	0	0	0	111.3	F206 A215 E216 G317 D318	F206-V315 HydrophobicContact CD2-CG2 4.34Å; F206-V315 HydrophobicContact CE2-CG2 3.73Å; F206-V315 HydrophobicContact CZ-CG2 4.42Å; A215-V315 HydrophobicContact CB-CB 4.46Å; A215-V315 HydrophobicContact CB-CG2 4.18Å; E216-V315 HydrophobicContact CB-CG1 4.49Å; E216-V315 HydrophobicContact CG-CG1 3.72Å; V315-G317 PolarHBondContact O-N 3.05Å; V315-D318 WeakPolarHBondContact CG2-OD2 3.34Å; V315-D318 PolarHBondContact N-OD2 3.25Å; V315-D318 WeakPolarHBondContact O-CB 3.29Å; V315-D318 PolarHBondContact O-N 2.9Å; V315-D318 VanDerWaalsContact O-N 3.16Å
316	P	92.3	Very high	89.1	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.013	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	132	173.3	-23.1	33.9	0	0	0	111	F191 P192 F206 F219 T414	F191-P316 HydrophobicContact CD1-CB 4.26Å; F191-P316 HydrophobicContact CD1-CG 3.76Å; F191-P316 HydrophobicContact CE1-CG 3.72Å; P192-P316 HydrophobicContact CG-CB 4.31Å; F206-P316 WeakPolarHBondContact CZ-O 3.24Å; F219-P316 HydrophobicContact CB-CG 4.03Å; F219-P316 HydrophobicContact CD1-CB 4.48Å; F219-P316 HydrophobicContact CD1-CG 3.92Å; F219-P316 HydrophobicContact CD2-CB 4.21Å; F219-P316 HydrophobicContact CD2-CG 3.99Å; F219-P316 HydrophobicContact CE1-CB 4.46Å; F219-P316 HydrophobicContact CE1-CG 4.36Å; F219-P316 HydrophobicContact CE2-CB 4.19Å; F219-P316 HydrophobicContact CE2-CG 4.42Å; F219-P316 HydrophobicContact CG-CB 4.36Å; F219-P316 HydrophobicContact CG-CG 3.72Å; F219-P316 HydrophobicContact CZ-CB 4.32Å; P316-T414 HydrophobicContact CG-CG2 4.1Å
317	G	90	Very high	88.1	Confident	7 Å²	7	42.9 Å²	42.9	7%	0.072	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	106.5	-20.2	-172.1	0	0	0	0	0	115.2	V315 Y410 V411	V315-G317 PolarHBondContact O-N 3.05Å; G317-Y410 WeakPolarHBondContact CA-OH 3.45Å; G317-Y410 WeakPolarHBondContact O-CE2 3.44Å; G317-V411 PolarHBondContact N-O 3.21Å; G317-V411 VanDerWaalsContact N-O 3.08Å
318	D	92.7	Very high	87.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.231	C	C	.	.			trans	-64.9	149.6	174.1	-84.3	-41.8	0	0	0	111.9	F206 V300 R302 I314 V315 V320 V411	F206-D318 WeakPolarHBondContact CD2-OD1 3.41Å; V300-D318 HydrophobicContact CG1-CB 3.83Å; R302-D318 IonicContact CZ-OD1 2.65Å; R302-D318 IonicContact CZ-OD2 3.14Å; R302-D318 IonicContact NE-OD1 2.78Å; R302-D318 PolarHBondContact NE-OD1 3.27Å; R302-D318 IonicContact NE-OD2 3.55Å; R302-D318 IonicContact NH2-OD1 3.15Å; R302-D318 IonicContact NH2-OD2 3.98Å; R302-D318 PolarHBondContact NH2-OD2 3.45Å; I314-D318 HydrophobicContact CG2-CB 4.4Å; V315-D318 WeakPolarHBondContact CG2-OD2 3.34Å; V315-D318 PolarHBondContact N-OD2 3.25Å; V315-D318 WeakPolarHBondContact O-CB 3.29Å; V315-D318 PolarHBondContact O-N 2.9Å; V315-D318 VanDerWaalsContact O-N 3.16Å; D318-V320 HydrophobicContact CB-CG1 4.4Å; D318-V411 HydrophobicContact CB-CB 4.5Å; D318-V411 HydrophobicContact CB-CG2 4.01Å; D318-V411 WeakPolarHBondContact O-CG2 3.41Å; D318-V411 PolarHBondContact O-N 3.1Å
319	I	92.9	Very high	86.7	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123	168.3	-62.6	176.4	0	0	0	107.9	V300 Y301 W306 L400 V408 A409 Y410	V300-I319 CarbonylContact C-O 3.59Å; V300-I319 WeakPolarHBondContact CA-O 3.29Å; V300-I319 WeakPolarHBondContact CG1-O 3.45Å; Y301-I319 PolarHBondContact N-O 2.82Å; W306-I319 HydrophobicContact CH2-CG2 4.21Å; I319-L400 HydrophobicContact CG2-CD2 4.44Å; I319-V408 HydrophobicContact CG2-CG1 3.54Å; I319-A409 CarbonylContact C-O 3.53Å; I319-A409 WeakPolarHBondContact CA-O 3.38Å; I319-Y410 HydrophobicContact CG1-CD2 4.44Å
320	V	93.5	Very high	86.4	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	152.7	-173.8	-60.4	0	0	0	0	111.4	I298 Q299 V300 D318 I322 V335 A409 V411	I298-V320 HydrophobicContact CD1-CB 4.3Å; Q299-V320 WeakPolarHBondContact O-CA 3.45Å; V300-V320 HydrophobicContact CG1-CG1 4.29Å; V300-V320 HydrophobicContact CG2-CG1 4.1Å; D318-V320 HydrophobicContact CB-CG1 4.4Å; V320-I322 HydrophobicContact CG2-CD1 4.01Å; V320-I322 HydrophobicContact CG2-CG1 3.97Å; V320-V335 HydrophobicContact CG2-CG1 4.14Å; V320-A409 HydrophobicContact CG2-CB 4.19Å; V320-A409 PolarHBondContact N-O 3Å; V320-A409 PolarHBondContact O-N 3.3Å; V320-V411 HydrophobicContact CG1-CG2 3.68Å; V320-V411 HydrophobicContact CG2-CG2 4.06Å
321	S	92.9	Very high	86.3	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.7	168.8	-168.1	0	0	0	0	110.3	I298 Q299 S402 D404 G406 C407	I298-S321 WeakPolarHBondContact CD1-O 3.24Å; I298-S321 WeakPolarHBondContact CG1-O 3.28Å; Q299-S321 PolarHBondContact O-N 2.58Å; S321-S402 WeakPolarHBondContact OG-CB 3.44Å; S321-S402 PolarHBondContact OG-OG 3.08Å; S321-D404 VanDerWaalsContact OG-CG 3.26Å; S321-D404 PolarHBondContact OG-OD1 3Å; S321-D404 PolarHBondContact OG-OD2 2.98Å; S321-D404 VanDerWaalsContact OG-OD2 3.11Å; S321-G406 WeakPolarHBondContact OG-CA 3.37Å; S321-C407 CarbonylContact C-O 3.58Å; S321-C407 WeakPolarHBondContact CA-O 3.44Å
322	I	91.1	Very high	86.2	Confident	7 Å²	7	42 Å²	42	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.3	-178.3	-59.8	177	0	0	0	108.7	I298 V320 V331 V335 I381 V387 C407 A409	I298-I322 HydrophobicContact CD1-CG1 4.48Å; V320-I322 HydrophobicContact CG2-CD1 4.01Å; V320-I322 HydrophobicContact CG2-CG1 3.97Å; I322-V331 HydrophobicContact CD1-CG1 4.29Å; I322-V331 HydrophobicContact CG2-CG2 4.21Å; I322-V335 HydrophobicContact CD1-CB 3.98Å; I322-V335 HydrophobicContact CD1-CG1 4.09Å; I322-V335 HydrophobicContact CD1-CG2 3.15Å; I322-I381 HydrophobicContact CD1-CD1 4.36Å; I322-I381 HydrophobicContact CG2-CD1 4.43Å; I322-V387 HydrophobicContact CG2-CG2 3.67Å; I322-C407 PolarHBondContact N-O 3.23Å; I322-C407 WeakPolarHBondContact O-CB 3.29Å; I322-C407 PolarHBondContact O-N 2.91Å; I322-A409 HydrophobicContact CD1-CB 3.72Å; I322-A409 HydrophobicContact CG1-CB 4.37Å
323	G	85.8	Confident	86.3	Confident	25 Å²	25	40.2 Å²	40.2	26%	0.258	21%	0.211	S	C	.	.			trans	-141.9	177.7	179.6	0	0	0	0	0	111.8	S325	G323-S325 PolarHBondContact O-N 3.27Å
324	R	84.3	Confident	86.3	Confident	150 Å²	150	35.3 Å²	35.3	57%	0.566	19%	0.188	S	C	*	.			trans	-69.5	113.6	174.5	-177.2	-177.3	-179.4	171.6	0.7	109	V388 H390	R324-V388 WeakPolarHBondContact CD-O 3.25Å; R324-H390 WeakPolarHBondContact CB-ND1 3.47Å; R324-H390 PolarHBondContact N-CE1 2.96Å; R324-H390 PolarHBondContact N-ND1 3.1Å
325	S	75.7	Confident	86.4	Confident	34 Å²	34	35.3 Å²	35.3	24%	0.238	19%	0.188	C	C	.	.			trans	-80.5	136	174.8	176.1	0	0	0	0	111.2	G323 Q327 E328 N329	G323-S325 PolarHBondContact O-N 3.27Å; S325-Q327 PolarHBondContact O-N 3.14Å; S325-Q327 PolarHBondContact OG-N 3.41Å; S325-E328 PolarHBondContact O-N 2.89Å; S325-N329 PolarHBondContact OG-ND2 3.11Å
326	P	68.1	Low	86.5	Confident	131 Å²	131	35.3 Å²	35.3	85%	0.851	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.8	174.1	26.2	-33	0	0	0	113.2	E328	P326-E328 VanDerWaalsContact C-N 3.34Å
327	Q	69.2	Low	86.5	Confident	152 Å²	152	35.2 Å²	35.2	71%	0.71	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	9.6	178.4	-66.9	175.5	-14	0	0	112.9	S325 N329	S325-Q327 PolarHBondContact O-N 3.14Å; S325-Q327 PolarHBondContact OG-N 3.41Å; Q327-N329 PolarHBondContact O-N 2.84Å
328	E	71.9	Confident	86.5	Confident	112 Å²	112	35.6 Å²	35.6	52%	0.523	19%	0.188	S	C	.	.			trans	56.1	31.1	-174.8	-49.7	-155.6	142.1	0	0	114.7	S325 P326 K386	S325-E328 PolarHBondContact O-N 2.89Å; P326-E328 VanDerWaalsContact C-N 3.34Å; E328-K386 IonicContact OE1-NZ 3.64Å; E328-K386 PolarHBondContact OE1-NZ 2.9Å; E328-K386 IonicContact OE2-NZ 2.63Å; E328-K386 PolarHBondContact OE2-NZ 3.04Å
329	N	82.7	Confident	86.2	Confident	48 Å²	48	36.6 Å²	36.6	26%	0.257	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-61.5	140.3	177.2	-62.2	-22.6	0	0	0	111.2	S325 Q327	S325-N329 PolarHBondContact OG-ND2 3.11Å; Q327-N329 PolarHBondContact O-N 2.84Å
330	L	85.4	Confident	85.9	Confident	33 Å²	33	36.6 Å²	36.6	17%	0.173	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-82.1	154.9	176.3	-60.1	176.6	0	0	0	110.8	N293 H296 M348 T385 K386	N293-L330 VanDerWaalsContact OD1-CD1 3.31Å; N293-L330 WeakPolarHBondContact OD1-CD1 3.37Å; H296-L330 PolarHBondContact CE1-O 2.96Å; H296-L330 VanDerWaalsContact CE1-O 3.3Å; L330-M348 HydrophobicContact CD1-SD 3.91Å; L330-M348 HydrophobicContact CD2-SD 4.4Å; L330-T385 WeakPolarHBondContact CA-O 3.4Å; L330-K386 HydrophobicContact CD2-CB 3.78Å
331	V	89.4	Confident	85.5	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.036	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-64.6	128.8	175.2	-179	0	0	0	0	109	I322 C333 V335 I381 G383 G384 T385 V387	I322-V331 HydrophobicContact CD1-CG1 4.29Å; I322-V331 HydrophobicContact CG2-CG2 4.21Å; V331-C333 WeakPolarHBondContact CG1-O 3.38Å; V331-V335 HydrophobicContact CG1-CG2 4.41Å; V331-I381 HydrophobicContact CB-CG2 4.36Å; V331-I381 HydrophobicContact CG1-CG2 4.14Å; V331-I381 HydrophobicContact CG2-CG2 3.9Å; V331-G383 CarbonylContact O-C 3.55Å; V331-G383 WeakPolarHBondContact O-CA 3.18Å; V331-G384 PolarHBondContact O-N 3.23Å; V331-T385 WeakPolarHBondContact CG2-O 3.33Å; V331-T385 PolarHBondContact N-O 2.84Å; V331-V387 HydrophobicContact CG2-CG2 3.68Å
332	P	88.3	Confident	85.2	Confident	20 Å²	20	40.5 Å²	40.5	13%	0.13	21%	0.206	C	C	.	.			trans	-82.9	-16.1	-168.3	30	-35.7	0	0	0	115.4	N222 I298 I314	N222-P332 PolarHBondContact ND2-O 3.16Å; N222-P332 VanDerWaalsContact ND2-O 3.16Å; I298-P332 HydrophobicContact CD1-CG 4.35Å; I314-P332 HydrophobicContact CD1-CG 3.83Å
333	C	90.6	Very high	85	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.007	21%	0.207	C	C	.	.	S	Bend	trans	-154.3	169.1	-174.5	55.6	0	0	0	0	111.7	V331 V335 G383 V411 R413 T414 T418	V331-C333 WeakPolarHBondContact CG1-O 3.38Å; C333-V335 VanDerWaalsContact SG-CG1 3.56Å; C333-G383 WeakPolarHBondContact O-CA 3.34Å; C333-G383 PolarHBondContact O-N 3.41Å; C333-V411 HydrophobicContact CB-CG1 4.41Å; C333-R413 WeakPolarHBondContact CB-O 3.4Å; C333-T414 HydrophobicContact CB-CG2 4.17Å; C333-T418 HydrophobicContact CB-CG2 4.41Å
334	D	92.6	Very high	85	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.1	175.7	-69.9	-2.9	0	0	0	109	I381 F382 G383 L412 R413 T418 S419	D334-I381 WeakPolarHBondContact CA-O 3.48Å; D334-F382 WeakPolarHBondContact OD1-CA 3.36Å; D334-G383 PolarHBondContact OD1-N 3.31Å; D334-L412 WeakPolarHBondContact O-CB 3.41Å; D334-L412 PolarHBondContact O-N 3.46Å; D334-R413 HydrophobicContact CB-CB 4.22Å; D334-R413 PolarHBondContact N-O 3.32Å; D334-R413 PolarHBondContact O-N 2.97Å; D334-T418 WeakPolarHBondContact OD2-CA 3.45Å; D334-S419 PolarHBondContact OD1-N 3.33Å; D334-S419 PolarHBondContact OD2-N 3.29Å; D334-S419 PolarHBondContact OD2-OG 3.02Å
335	V	93.3	Very high	84.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	142	-170.8	-59.9	0	0	0	0	111.8	V320 I322 V331 C333 V380 I381 A409 Y410 V411	V320-V335 HydrophobicContact CG2-CG1 4.14Å; I322-V335 HydrophobicContact CD1-CB 3.98Å; I322-V335 HydrophobicContact CD1-CG1 4.09Å; I322-V335 HydrophobicContact CD1-CG2 3.15Å; V331-V335 HydrophobicContact CG1-CG2 4.41Å; C333-V335 VanDerWaalsContact SG-CG1 3.56Å; V335-V380 CarbonylContact O-C 3.49Å; V335-V380 WeakPolarHBondContact O-CA 3.3Å; V335-V380 WeakPolarHBondContact O-CG1 3.33Å; V335-I381 HydrophobicContact CG2-CB 3.73Å; V335-I381 HydrophobicContact CG2-CD1 4.33Å; V335-I381 HydrophobicContact CG2-CG1 4.46Å; V335-I381 HydrophobicContact CG2-CG2 4.5Å; V335-I381 PolarHBondContact N-O 3.12Å; V335-I381 PolarHBondContact O-N 2.79Å; V335-A409 HydrophobicContact CB-CB 4Å; V335-A409 HydrophobicContact CG2-CB 4.07Å; V335-Y410 CarbonylContact C-O 3.56Å; V335-Y410 VanDerWaalsContact CA-O 3.24Å; V335-Y410 WeakPolarHBondContact CA-O 3.35Å; V335-V411 HydrophobicContact CG1-CG2 4.1Å
336	L	93.3	Very high	85	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124.2	175.2	-176.3	66.5	0	0	0	110	Y200 L338 I361 L370 H379 V380 A409 Y410 L412	Y200-L336 HydrophobicContact CD1-CD2 4.04Å; Y200-L336 HydrophobicContact CD2-CD2 3.86Å; Y200-L336 HydrophobicContact CE1-CD2 4.46Å; Y200-L336 HydrophobicContact CE2-CD2 4.29Å; Y200-L336 HydrophobicContact CG-CD2 3.72Å; L336-L338 PolarHBondContact O-N 3.28Å; L336-I361 HydrophobicContact CD1-CG2 4.19Å; L336-I361 HydrophobicContact CD2-CD1 3.98Å; L336-I361 HydrophobicContact CG-CD1 4.45Å; L336-L370 HydrophobicContact CD1-CD1 4.02Å; L336-L370 HydrophobicContact CD2-CD2 4.34Å; L336-H379 HydrophobicContact CD1-CB 3.96Å; L336-V380 HydrophobicContact CD1-CG2 3.81Å; L336-A409 CarbonylContact O-C 3.49Å; L336-A409 WeakPolarHBondContact O-CA 3.45Å; L336-A409 WeakPolarHBondContact O-CB 3.48Å; L336-Y410 PolarHBondContact N-O 2.96Å; L336-Y410 PolarHBondContact O-N 3.15Å; L336-L412 HydrophobicContact CB-CD1 3.99Å; L336-L412 HydrophobicContact CB-CD2 4.16Å; L336-L412 HydrophobicContact CB-CG 4Å
337	L	92.1	Very high	84.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	110.5	-178.5	-172.5	58.5	0	0	0	110.5	G340 K358 P360 I361 H379 I381 C407	L337-G340 WeakPolarHBondContact CD2-O 3.08Å; L337-G340 WeakPolarHBondContact CG-O 3.24Å; L337-K358 HydrophobicContact CD2-CB 3.76Å; L337-P360 HydrophobicContact CG-CB 4.34Å; L337-P360 WeakPolarHBondContact O-CA 3.45Å; L337-I361 PolarHBondContact O-N 3.37Å; L337-I361 VanDerWaalsContact O-N 3.12Å; L337-H379 VanDerWaalsContact CB-O 3.29Å; L337-H379 WeakPolarHBondContact CB-O 3.39Å; L337-H379 PolarHBondContact N-O 2.92Å; L337-I381 HydrophobicContact CD1-CD1 4.34Å; L337-C407 HydrophobicContact CD1-CB 3.63Å
338	L	89.9	Confident	84.7	Confident	16 Å²	16	24.5 Å²	24.5	8%	0.084	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-47.3	178.4	-60.8	-178.4	0	0	0	111.2	L336 P360 I361 V408	L336-L338 PolarHBondContact O-N 3.28Å; L338-P360 VanDerWaalsContact O-CB 3.3Å; L338-P360 WeakPolarHBondContact O-CB 3.31Å; L338-I361 HydrophobicContact CD2-CD1 3.67Å; L338-I361 HydrophobicContact CD2-CG1 4.07Å; L338-V408 WeakPolarHBondContact CA-O 3.44Å; L338-V408 WeakPolarHBondContact CB-O 3.49Å; L338-V408 HydrophobicContact CD1-CG1 4.46Å; L338-V408 PolarHBondContact N-O 3.24Å
339	R	87.4	Confident	84.4	Confident	21 Å²	21	20.3 Å²	20.3	8%	0.079	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.7	-174.6	-52.6	-172.9	76.6	-169.1	13.2	112.2	E362 P393 T397 S398 G399 L400 C407 V408	R339-E362 IonicContact CZ-OE2 3.57Å; R339-E362 IonicContact NE-OE2 3.62Å; R339-E362 PolarHBondContact NE-OE2 3.18Å; R339-E362 IonicContact NH2-OE2 3.74Å; R339-P393 HydrophobicContact CB-CB 4.21Å; R339-T397 PolarHBondContact NH2-O 2.78Å; R339-S398 PolarHBondContact NH2-O 3.27Å; R339-G399 PolarHBondContact NH1-O 3.39Å; R339-L400 PolarHBondContact NH1-O 3.03Å; R339-L400 VanDerWaalsContact NH1-O 3.08Å; R339-C407 CarbonylContact O-C 3.45Å; R339-C407 WeakPolarHBondContact O-CA 3.49Å; R339-V408 HydrophobicContact CB-CB 4.29Å; R339-V408 PolarHBondContact N-O 3.2Å; R339-V408 PolarHBondContact O-N 2.8Å
340	G	85.5	Confident	83.5	Confident	3 Å²	3	19.7 Å²	19.7	3%	0.031	10%	0.102	C	C	.	.	S	Bend	trans	84.1	155.4	-173.4	0	0	0	0	0	111.2	L337 P360 M391	L337-G340 WeakPolarHBondContact CD2-O 3.08Å; L337-G340 WeakPolarHBondContact CG-O 3.24Å; G340-P360 WeakPolarHBondContact O-CD 3.37Å; G340-M391 WeakPolarHBondContact CA-O 2.91Å
341	R	85.7	Confident	82	Confident	84 Å²	84	19 Å²	19	32%	0.317	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	144.3	-179.8	-62.5	176	-175.3	-174.2	-2.2	108.7	M357 P360 H390 M391 C407	R341-M357 HydrophobicContact CB-CE 4.28Å; R341-P360 HydrophobicContact CG-CG 4.45Å; R341-H390 CarbonylContact O-C 3.57Å; R341-M391 HydrophobicContact CB-CB 4.34Å; R341-M391 PolarHBondContact N-O 3.41Å; R341-M391 PolarHBondContact O-N 2.87Å; R341-C407 PolarHBondContact O-SG 2.9Å
342	C	86.9	Confident	80.7	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.014	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	154.1	176.8	61.9	0	0	0	0	112.5	K358 I381 V387 Q389 H390	C342-K358 PolarHBondContact N-O 3.37Å; C342-K358 PolarHBondContact O-N 3.39Å; C342-I381 WeakPolarHBondContact SG-CD1 3.47Å; C342-V387 HydrophobicContact CB-CG1 4.3Å; C342-Q389 CarbonylContact C-O 3.48Å; C342-Q389 WeakPolarHBondContact CA-O 3.48Å; C342-H390 HydrophobicContact CB-CB 4.23Å
343	I	86.1	Confident	79.1	Confident	11 Å²	11	25.7 Å²	25.7	6%	0.056	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.7	172.6	-57	176.7	0	0	0	106.9	P355 Q356 V388 Q389 M575 L577	I343-P355 HydrophobicContact CG2-CB 3.68Å; I343-Q356 WeakPolarHBondContact CA-O 3.28Å; I343-V388 HydrophobicContact CG2-CB 4.38Å; I343-V388 PolarHBondContact O-N 2.84Å; I343-Q389 HydrophobicContact CB-CB 4.25Å; I343-Q389 HydrophobicContact CD1-CB 4.23Å; I343-Q389 HydrophobicContact CG1-CB 4.44Å; I343-Q389 PolarHBondContact N-O 2.92Å; I343-Q389 PolarHBondContact O-N 2.81Å; I343-M575 HydrophobicContact CD1-CB 4.34Å; I343-M575 HydrophobicContact CD1-SD 3.95Å; I343-M575 HydrophobicContact CG1-SD 4.34Å; I343-L577 HydrophobicContact CD1-CD2 3.95Å
344	V	86.6	Confident	78.1	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.4	-176	-60.5	0	0	0	0	110.1	E346 P355 Q356 K358 I381 K386 V387	V344-E346 HydrophobicContact CG2-CG 3.78Å; V344-P355 CarbonylContact O-C 3.59Å; V344-P355 VanDerWaalsContact O-CA 3.24Å; V344-P355 WeakPolarHBondContact O-CA 3.46Å; V344-Q356 PolarHBondContact N-O 3.23Å; V344-Q356 PolarHBondContact O-N 2.86Å; V344-K358 HydrophobicContact CG1-CG 4.35Å; V344-K358 HydrophobicContact CG2-CD 4.21Å; V344-K358 VanDerWaalsContact CG2-CE 3.41Å; V344-K358 HydrophobicContact CG2-CG 3.66Å; V344-I381 HydrophobicContact CG1-CG1 4.28Å; V344-I381 HydrophobicContact CG1-CG2 3.95Å; V344-K386 CarbonylContact C-O 3.56Å; V344-K386 WeakPolarHBondContact CA-O 3.26Å; V344-V387 HydrophobicContact CG1-CG2 4.29Å
345	D	81.5	Confident	77.3	Confident	48 Å²	48	27.6 Å²	27.6	26%	0.257	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	110.7	169.3	-179.3	4.1	0	0	0	108.1	A347 T385 K386 V388	D345-A347 WeakPolarHBondContact OD1-CB 3.36Å; D345-A347 PolarHBondContact OD1-N 3.06Å; D345-T385 WeakPolarHBondContact O-CA 3.25Å; D345-T385 WeakPolarHBondContact O-CB 3.32Å; D345-K386 HydrophobicContact CB-CB 4.29Å; D345-K386 PolarHBondContact N-O 3.04Å; D345-K386 PolarHBondContact O-N 3.42Å; D345-V388 HydrophobicContact CB-CG2 3.8Å
346	E	77.9	Confident	76.6	Confident	10 Å²	10	29.5 Å²	29.5	5%	0.047	16%	0.16	C	C	.	.			trans	-99.9	13.6	-179.4	-48	-164.8	148.9	0	0	112.6	V344 M348 L349 T350 K358 T385	V344-E346 HydrophobicContact CG2-CG 3.78Å; E346-M348 PolarHBondContact O-N 3.03Å; E346-L349 PolarHBondContact O-N 3.2Å; E346-T350 HydrophobicContact CB-CG2 4.06Å; E346-T350 PolarHBondContact O-N 3.26Å; E346-T350 PolarHBondContact O-OG1 2.89Å; E346-K358 WeakPolarHBondContact OE1-CE 3.43Å; E346-K358 IonicContact OE1-NZ 3.3Å; E346-K358 PolarHBondContact OE1-NZ 3.24Å; E346-K358 IonicContact OE2-NZ 2.71Å; E346-T385 HydrophobicContact CB-CG2 4.08Å; E346-T385 HydrophobicContact CG-CG2 3.77Å
347	A	67	Low	76.1	Confident	26 Å²	26	30.7 Å²	30.7	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-56.5	-28.7	-176.4	0	0	0	0	0	113.9	D345 L349 G351 E352	D345-A347 WeakPolarHBondContact OD1-CB 3.36Å; D345-A347 PolarHBondContact OD1-N 3.06Å; A347-L349 VanDerWaalsContact C-N 3.27Å; A347-L349 PolarHBondContact O-N 2.73Å; A347-G351 WeakPolarHBondContact O-CA 3.32Å; A347-G351 PolarHBondContact O-N 3.38Å; A347-E352 VanDerWaalsContact CA-O 3.28Å; A347-E352 WeakPolarHBondContact CA-O 3.34Å; A347-E352 WeakPolarHBondContact CB-O 3.49Å
348	M	63.7	Low	75.8	Confident	68 Å²	68	30.7 Å²	30.7	34%	0.335	17%	0.166	S	C	.	.	H	α-helix	trans	-81.4	5.6	176	-58.7	-172.4	82.1	0	0	114.5	L330 E346	L330-M348 HydrophobicContact CD1-SD 3.91Å; L330-M348 HydrophobicContact CD2-SD 4.4Å; E346-M348 PolarHBondContact O-N 3.03Å
349	L	66.3	Low	75.6	Confident	25 Å²	25	32.1 Å²	32.1	13%	0.131	17%	0.173	C	C	.	.	H	α-helix	trans	-132.3	-38.9	179.5	-88.3	156.3	0	0	0	112.5	E346 A347 F382 G383 T385 Q420 D950	E346-L349 PolarHBondContact O-N 3.2Å; A347-L349 VanDerWaalsContact C-N 3.27Å; A347-L349 PolarHBondContact O-N 2.73Å; L349-F382 HydrophobicContact CD1-CB 3.37Å; L349-F382 HydrophobicContact CD1-CG 4.35Å; L349-G383 WeakPolarHBondContact CD1-O 3.42Å; L349-T385 HydrophobicContact CD1-CG2 3.35Å; L349-Q420 HydrophobicContact CD2-CB 3.97Å; L349-D950 WeakPolarHBondContact CA-OD2 3.43Å; L349-D950 PolarHBondContact N-OD2 2.87Å
350	T	63.1	Low	75.7	Confident	34 Å²	34	31.5 Å²	31.5	21%	0.209	17%	0.171	C	C	.	.	H	α-helix	trans	-105.1	-10.6	-179.3	65.1	0	0	0	0	111.6	E346 E352 T863	E346-T350 HydrophobicContact CB-CG2 4.06Å; E346-T350 PolarHBondContact O-N 3.26Å; E346-T350 PolarHBondContact O-OG1 2.89Å; T350-E352 PolarHBondContact O-N 2.98Å; T350-E352 PolarHBondContact OG1-N 3.02Å; T350-T863 WeakPolarHBondContact CA-OG1 3.49Å; T350-T863 WeakPolarHBondContact O-CB 3.37Å; T350-T863 WeakPolarHBondContact O-CG2 3.46Å; T350-T863 PolarHBondContact O-OG1 2.89Å
351	G	53.9	Low	75.8	Confident	20 Å²	20	31.3 Å²	31.3	21%	0.206	17%	0.17	C	C	.	.			trans	66.3	-5.2	-175.1	0	0	0	0	0	113.5	A347 S353	A347-G351 WeakPolarHBondContact O-CA 3.32Å; A347-G351 PolarHBondContact O-N 3.38Å; G351-S353 PolarHBondContact O-N 2.89Å
352	E	63.5	Low	75.5	Confident	105 Å²	105	30.2 Å²	30.2	49%	0.491	17%	0.168	S	C	.	.			trans	-80.2	118.9	176.5	-63.1	-174.8	172.7	0	0	108.1	A347 T350 V354	A347-E352 VanDerWaalsContact CA-O 3.28Å; A347-E352 WeakPolarHBondContact CA-O 3.34Å; A347-E352 WeakPolarHBondContact CB-O 3.49Å; T350-E352 PolarHBondContact O-N 2.98Å; T350-E352 PolarHBondContact OG1-N 3.02Å; E352-V354 PolarHBondContact O-N 2.61Å
353	S	55.2	Low	74.8	Confident	60 Å²	60	36.1 Å²	36.1	42%	0.42	20%	0.199	S	C	.	.			trans	-73.3	10.9	-178.4	62.2	0	0	0	0	114.3	G351 P355 N881	G351-S353 PolarHBondContact O-N 2.89Å; S353-P355 WeakPolarHBondContact O-CD 3.34Å; S353-N881 VanDerWaalsContact CB-ND2 3.29Å; S353-N881 WeakPolarHBondContact CB-ND2 3.44Å; S353-N881 PolarHBondContact OG-ND2 3.13Å; S353-N881 VanDerWaalsContact OG-ND2 3.12Å
354	V	68	Low	74.3	Confident	20 Å²	20	38.1 Å²	38.1	12%	0.121	21%	0.21	C	C	.	.	S	Bend	trans	-106.9	113.4	-169.6	177.9	0	0	0	0	108.4	E352 Q356 G584 P586	E352-V354 PolarHBondContact O-N 2.61Å; V354-Q356 PolarHBondContact O-N 2.64Å; V354-G584 WeakPolarHBondContact CG1-O 3.36Å; V354-P586 VanDerWaalsContact CG2-CD 3.41Å; V354-P586 HydrophobicContact CG2-CG 3.51Å
355	P	75.9	Confident	73.9	Confident	26 Å²	26	41.4 Å²	41.4	17%	0.169	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-58.3	136.1	175.5	-22.4	29.4	0	0	0	111.8	I343 V344 S353 V583	I343-P355 HydrophobicContact CG2-CB 3.68Å; V344-P355 CarbonylContact O-C 3.59Å; V344-P355 VanDerWaalsContact O-CA 3.24Å; V344-P355 WeakPolarHBondContact O-CA 3.46Å; S353-P355 WeakPolarHBondContact O-CD 3.34Å; P355-V583 HydrophobicContact CB-CG1 3.59Å; P355-V583 HydrophobicContact CG-CG1 3.5Å
356	Q	78.4	Confident	73.8	Confident	40 Å²	40	42 Å²	42	19%	0.187	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	142	-179.7	-64.8	-67.9	-20.5	0	0	110.1	I343 V344 V354	I343-Q356 WeakPolarHBondContact CA-O 3.28Å; V344-Q356 PolarHBondContact N-O 3.23Å; V344-Q356 PolarHBondContact O-N 2.86Å; V354-Q356 PolarHBondContact O-N 2.64Å
357	M	82.8	Confident	73.9	Confident	26 Å²	26	48.1 Å²	48.1	13%	0.128	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	135.9	170.8	-169.9	-175	-147.8	0	0	110.2	R341 M575	R341-M357 HydrophobicContact CB-CE 4.28Å; M357-M575 HydrophobicContact CB-SD 4.17Å; M357-M575 HydrophobicContact CE-CE 3.2Å; M357-M575 HydrophobicContact CE-SD 3.36Å; M357-M575 WeakPolarHBondContact CE-SD 3.26Å; M357-M575 HydrophobicContact CG-SD 3.9Å; M357-M575 HydrophobicContact SD-CE 3.27Å; M357-M575 WeakPolarHBondContact SD-CE 3.36Å; M357-M575 HydrophobicContact SD-SD 3.32Å
358	K	86.8	Confident	74.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.4	175.3	-56.4	-69	-178.4	166.2	0	111.2	L337 C342 V344 E346 A376 R377 L378 V380 I381	L337-K358 HydrophobicContact CD2-CB 3.76Å; C342-K358 PolarHBondContact N-O 3.37Å; C342-K358 PolarHBondContact O-N 3.39Å; V344-K358 HydrophobicContact CG1-CG 4.35Å; V344-K358 HydrophobicContact CG2-CD 4.21Å; V344-K358 VanDerWaalsContact CG2-CE 3.41Å; V344-K358 HydrophobicContact CG2-CG 3.66Å; E346-K358 WeakPolarHBondContact OE1-CE 3.43Å; E346-K358 IonicContact OE1-NZ 3.3Å; E346-K358 PolarHBondContact OE1-NZ 3.24Å; E346-K358 IonicContact OE2-NZ 2.71Å; K358-A376 PolarHBondContact NZ-O 2.8Å; K358-R377 PolarHBondContact NZ-O 3.38Å; K358-L378 CarbonylContact C-O 3.55Å; K358-L378 WeakPolarHBondContact CA-O 3.43Å; K358-L378 WeakPolarHBondContact CB-O 3.39Å; K358-L378 WeakPolarHBondContact CD-O 3.36Å; K358-V380 WeakPolarHBondContact CD-O 3.47Å; K358-V380 VanDerWaalsContact CE-O 3.25Å; K358-V380 WeakPolarHBondContact CE-O 3.15Å; K358-V380 PolarHBondContact NZ-O 3.42Å; K358-I381 HydrophobicContact CB-CG1 4.48Å; K358-I381 HydrophobicContact CG-CG1 4.13Å
359	E	86.1	Confident	75.7	Confident	46 Å²	46	52.9 Å²	52.9	22%	0.215	29%	0.29	C	S	.	.			trans	-113.7	142.4	-176.4	-63.7	-172.5	139.2	0	0	111.2	L378 H379 H622	E359-L378 PolarHBondContact N-O 2.69Å; E359-H379 PolarHBondContact O-ND1 3.18Å; E359-H622 IonicContact OE1-CE1 2.81Å; E359-H622 PolarHBondContact OE1-CE1 3.43Å; E359-H622 VanDerWaalsContact OE1-CE1 3.22Å; E359-H622 IonicContact OE1-ND1 2.79Å; E359-H622 IonicContact OE2-CE1 2.73Å; E359-H622 IonicContact OE2-ND1 3.2Å
360	P	88.4	Confident	76.5	Confident	7 Å²	7	52 Å²	52	5%	0.045	29%	0.285	C	S	.	.			trans	-73	154.5	177.4	30.5	-34.9	0	0	0	112	L337 L338 G340 R341 E362	L337-P360 HydrophobicContact CG-CB 4.34Å; L337-P360 WeakPolarHBondContact O-CA 3.45Å; L338-P360 VanDerWaalsContact O-CB 3.3Å; L338-P360 WeakPolarHBondContact O-CB 3.31Å; G340-P360 WeakPolarHBondContact O-CD 3.37Å; R341-P360 HydrophobicContact CG-CG 4.45Å; P360-E362 VanDerWaalsContact C-N 3.27Å; P360-E362 HydrophobicContact CB-CG 4.17Å; P360-E362 HydrophobicContact CG-CG 4.11Å; P360-E362 PolarHBondContact O-N 2.73Å
361	I	87.4	Confident	77.3	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-80.9	1	176.3	65.8	168.7	0	0	0	114.2	F197 Q201 L336 L337 L338 D363 L364 H379	F197-I361 HydrophobicContact CD1-CD1 4.43Å; Q201-I361 HydrophobicContact CG-CD1 4.07Å; Q201-I361 HydrophobicContact CG-CG1 4.35Å; Q201-I361 PolarHBondContact NE2-O 3.15Å; L336-I361 HydrophobicContact CD1-CG2 4.19Å; L336-I361 HydrophobicContact CD2-CD1 3.98Å; L336-I361 HydrophobicContact CG-CD1 4.45Å; L337-I361 PolarHBondContact O-N 3.37Å; L337-I361 VanDerWaalsContact O-N 3.12Å; L338-I361 HydrophobicContact CD2-CD1 3.67Å; L338-I361 HydrophobicContact CD2-CG1 4.07Å; I361-D363 VanDerWaalsContact C-N 3.29Å; I361-D363 PolarHBondContact O-N 2.91Å; I361-L364 HydrophobicContact CB-CD1 4.34Å; I361-L364 HydrophobicContact CG2-CD1 4.32Å; I361-L364 PolarHBondContact O-N 3.12Å; I361-H379 HydrophobicContact CG2-CB 3.86Å
362	E	79.4	Confident	78.4	Confident	60 Å²	60	55.3 Å²	55.3	28%	0.28	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-63.8	-29.5	-173.9	68	-172.8	158.2	0	0	114.1	R339 P360	R339-E362 IonicContact CZ-OE2 3.57Å; R339-E362 IonicContact NE-OE2 3.62Å; R339-E362 PolarHBondContact NE-OE2 3.18Å; R339-E362 IonicContact NH2-OE2 3.74Å; P360-E362 VanDerWaalsContact C-N 3.27Å; P360-E362 HydrophobicContact CB-CG 4.17Å; P360-E362 HydrophobicContact CG-CG 4.11Å; P360-E362 PolarHBondContact O-N 2.73Å
363	D	72.3	Confident	78.7	Confident	126 Å²	126	59 Å²	59	67%	0.674	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-92.3	1.6	-177.8	-63.5	-38.4	0	0	0	113.4	I361	I361-D363 VanDerWaalsContact C-N 3.29Å; I361-D363 PolarHBondContact O-N 2.91Å
364	L	76.8	Confident	79.5	Confident	53 Å²	53	58.8 Å²	58.8	28%	0.277	32%	0.316	S	S	.	.	S	Bend	trans	-95.3	157.2	-176.2	-66.9	171.7	0	0	0	112.7	F197 I361	F197-L364 HydrophobicContact CD2-CB 4.09Å; F197-L364 HydrophobicContact CD2-CD1 4.39Å; F197-L364 HydrophobicContact CE2-CB 4.14Å; F197-L364 HydrophobicContact CE2-CD1 3.73Å; F197-L364 HydrophobicContact CZ-CD1 4.39Å; I361-L364 HydrophobicContact CB-CD1 4.34Å; I361-L364 HydrophobicContact CG2-CD1 4.32Å; I361-L364 PolarHBondContact O-N 3.12Å
365	S	77.9	Confident	80	Confident	70 Å²	70	58.1 Å²	58.1	49%	0.49	31%	0.312	S	S	.	.			trans	-59.4	126.1	176.6	57.3	0	0	0	0	111.3	D367 R368	S365-D367 VanDerWaalsContact C-N 3.27Å; S365-D367 PolarHBondContact O-N 2.91Å; S365-R368 PolarHBondContact O-N 2.91Å
366	P	78.3	Confident	80	Confident	59 Å²	59	57.2 Å²	57.2	38%	0.383	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.9	-172.1	25.7	-34.6	0	0	0	114.4	S198 R368	S198-P366 WeakPolarHBondContact CB-O 3.35Å; S198-P366 PolarHBondContact N-O 3.23Å; P366-R368 VanDerWaalsContact C-N 3.32Å; P366-R368 PolarHBondContact O-N 3.23Å
367	D	81.3	Confident	80	Confident	140 Å²	140	60.8 Å²	60.8	75%	0.749	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.4	-177.7	-56.6	-37.8	0	0	0	113.8	S365	S365-D367 VanDerWaalsContact C-N 3.27Å; S365-D367 PolarHBondContact O-N 2.91Å
368	R	82.3	Confident	79.9	Confident	111 Å²	111	61.8 Å²	61.8	42%	0.419	32%	0.324	S	S	.	.			trans	-71.9	131.8	-179.4	179.6	170	172.6	164.7	0.4	110.4	A196 F197 S365 P366 D375	A196-R368 CarbonylContact C-O 3.43Å; A196-R368 WeakPolarHBondContact CA-O 3.26Å; F197-R368 HydrophobicContact CD2-CB 3.9Å; F197-R368 HydrophobicContact CD2-CG 4.31Å; F197-R368 HydrophobicContact CE2-CB 3.95Å; F197-R368 HydrophobicContact CE2-CG 3.85Å; F197-R368 WeakPolarHBondContact CG-O 3.38Å; F197-R368 HydrophobicContact CZ-CG 4.27Å; F197-R368 PolarHBondContact N-O 3.19Å; S365-R368 PolarHBondContact O-N 2.91Å; P366-R368 VanDerWaalsContact C-N 3.32Å; P366-R368 PolarHBondContact O-N 3.23Å; R368-D375 IonicContact CZ-OD1 3.22Å; R368-D375 IonicContact NE-OD1 3.15Å; R368-D375 IonicContact NE-OD2 3.46Å; R368-D375 IonicContact NH2-OD1 3.79Å; R368-D375 PolarHBondContact NH2-OD1 3.02Å; R368-D375 IonicContact NH2-OD2 3.54Å
369	V	85.2	Confident	80	Confident	82 Å²	82	62.3 Å²	62.3	50%	0.497	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-80	136.7	173.7	-179.2	0	0	0	0	109.6	G194 D371	G194-V369 WeakPolarHBondContact O-CG1 3.39Å; V369-D371 PolarHBondContact O-N 3Å
370	L	83.3	Confident	80.2	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	32%	0.317	C	S	.	.			trans	-63.5	114.5	174.8	177.2	67.6	0	0	0	109.8	N195 F197 Y200 L336 L372 D375 L412	N195-L370 PolarHBondContact O-N 3.05Å; F197-L370 HydrophobicContact CD1-CB 4.34Å; F197-L370 HydrophobicContact CE1-CB 3.86Å; F197-L370 HydrophobicContact CE1-CD1 3.83Å; F197-L370 HydrophobicContact CE1-CG 4.46Å; Y200-L370 HydrophobicContact CE2-CB 3.99Å; Y200-L370 HydrophobicContact CE2-CD2 4.01Å; L336-L370 HydrophobicContact CD1-CD1 4.02Å; L336-L370 HydrophobicContact CD2-CD2 4.34Å; L370-L372 HydrophobicContact CD2-CD2 4.47Å; L370-D375 HydrophobicContact CD1-CB 3.95Å; L370-L412 HydrophobicContact CD2-CD1 4.4Å; L370-L412 HydrophobicContact CD2-CD2 4.17Å
371	D	81	Confident	80.4	Confident	77 Å²	77	59.9 Å²	59.9	41%	0.412	31%	0.314	S	S	.	.			trans	-103	109.6	167.6	177.7	9	0	0	0	109.7	V369 Q373 A374 D375	V369-D371 PolarHBondContact O-N 3Å; D371-Q373 PolarHBondContact O-N 2.97Å; D371-Q373 VanDerWaalsContact O-N 3.15Å; D371-Q373 PolarHBondContact OD1-N 3.36Å; D371-A374 PolarHBondContact O-N 3.06Å; D371-D375 PolarHBondContact N-OD2 2.57Å; D371-D375 VanDerWaalsContact N-OD2 3.16Å; D371-D375 VanDerWaalsContact O-CB 3.26Å; D371-D375 WeakPolarHBondContact O-CB 3.26Å; D371-D375 PolarHBondContact O-N 3.03Å
372	L	75.6	Confident	80.5	Confident	47 Å²	47	61.6 Å²	61.6	25%	0.246	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.3	179.1	-76.6	175.9	0	0	0	114.1	V193 L370 A376 V380 L412	V193-L372 HydrophobicContact CB-CD1 3.63Å; V193-L372 HydrophobicContact CB-CG 4.27Å; V193-L372 HydrophobicContact CG1-CD1 3.82Å; V193-L372 HydrophobicContact CG2-CD1 4.17Å; L370-L372 HydrophobicContact CD2-CD2 4.47Å; L372-A376 HydrophobicContact CD2-CB 4.35Å; L372-A376 WeakPolarHBondContact O-CB 3.1Å; L372-V380 HydrophobicContact CD2-CG2 4.47Å; L372-L412 HydrophobicContact CD2-CD1 4.27Å
373	Q	70.9	Confident	80.8	Confident	184 Å²	184	58.8 Å²	58.8	86%	0.86	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-37.4	179.2	-64.6	-171.4	0.1	0	0	112.1	D371	D371-Q373 PolarHBondContact O-N 2.97Å; D371-Q373 VanDerWaalsContact O-N 3.15Å; D371-Q373 PolarHBondContact OD1-N 3.36Å
374	A	70.9	Confident	81.3	Confident	55 Å²	55	52.9 Å²	52.9	46%	0.455	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-46.7	-177.9	0	0	0	0	0	112.8	D371	D371-A374 PolarHBondContact O-N 3.06Å
375	D	79.3	Confident	81.7	Confident	6 Å²	6	50.3 Å²	50.3	3%	0.032	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-24.1	-168.5	-63	-29.7	0	0	0	112.6	R368 L370 D371 R377 L378 H379	R368-D375 IonicContact CZ-OD1 3.22Å; R368-D375 IonicContact NE-OD1 3.15Å; R368-D375 IonicContact NE-OD2 3.46Å; R368-D375 IonicContact NH2-OD1 3.79Å; R368-D375 PolarHBondContact NH2-OD1 3.02Å; R368-D375 IonicContact NH2-OD2 3.54Å; L370-D375 HydrophobicContact CD1-CB 3.95Å; D371-D375 PolarHBondContact N-OD2 2.57Å; D371-D375 VanDerWaalsContact N-OD2 3.16Å; D371-D375 VanDerWaalsContact O-CB 3.26Å; D371-D375 WeakPolarHBondContact O-CB 3.26Å; D371-D375 PolarHBondContact O-N 3.03Å; D375-R377 PolarHBondContact O-N 3.26Å; D375-L378 PolarHBondContact O-N 2.87Å; D375-H379 PolarHBondContact O-N 2.92Å
376	A	76.8	Confident	82	Confident	6 Å²	6	49.5 Å²	49.5	5%	0.05	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-27.7	-177.1	0	0	0	0	0	113.2	K358 L372 L378 V380 F382	K358-A376 PolarHBondContact NZ-O 2.8Å; L372-A376 HydrophobicContact CD2-CB 4.35Å; L372-A376 WeakPolarHBondContact O-CB 3.1Å; A376-L378 VanDerWaalsContact C-N 3.3Å; A376-L378 PolarHBondContact O-N 3.2Å; A376-V380 HydrophobicContact CB-CB 3.91Å; A376-V380 HydrophobicContact CB-CG2 3.95Å; A376-V380 WeakPolarHBondContact O-CB 3.47Å; A376-V380 PolarHBondContact O-N 3.44Å; A376-F382 HydrophobicContact CB-CE1 4.27Å; A376-F382 HydrophobicContact CB-CZ 3.81Å
377	R	77.2	Confident	82.5	Confident	115 Å²	115	47.1 Å²	47.1	43%	0.434	24%	0.236	S	C	.	.	H	α-helix	trans	-63.8	-35.3	178.5	-171.2	176.3	176.6	177.1	1.6	112.5	K358 D375	K358-R377 PolarHBondContact NZ-O 3.38Å; D375-R377 PolarHBondContact O-N 3.26Å
378	L	81	Confident	82.6	Confident	48 Å²	48	42 Å²	42	25%	0.251	21%	0.21	S	C	.	.	H	α-helix	trans	-102.3	-36.6	-176	-66.8	172.7	0	0	0	112.9	K358 E359 D375 A376 H622	K358-L378 CarbonylContact C-O 3.55Å; K358-L378 WeakPolarHBondContact CA-O 3.43Å; K358-L378 WeakPolarHBondContact CB-O 3.39Å; K358-L378 WeakPolarHBondContact CD-O 3.36Å; E359-L378 PolarHBondContact N-O 2.69Å; D375-L378 PolarHBondContact O-N 2.87Å; A376-L378 VanDerWaalsContact C-N 3.3Å; A376-L378 PolarHBondContact O-N 3.2Å; L378-H622 HydrophobicContact CD1-CB 4.4Å; L378-H622 HydrophobicContact CD2-CB 3.99Å
379	H	88.5	Confident	82.7	Confident	11 Å²	11	38 Å²	38	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-110.2	-13.5	-167.5	-55.7	-57.3	0	0	0	114	L336 L337 E359 I361 D375	L336-H379 HydrophobicContact CD1-CB 3.96Å; L337-H379 VanDerWaalsContact CB-O 3.29Å; L337-H379 WeakPolarHBondContact CB-O 3.39Å; L337-H379 PolarHBondContact N-O 2.92Å; E359-H379 PolarHBondContact O-ND1 3.18Å; I361-H379 HydrophobicContact CG2-CB 3.86Å; D375-H379 PolarHBondContact O-N 2.92Å
380	V	90.6	Very high	82.8	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.6	-179.4	177.6	0	0	0	0	109.9	V335 L336 K358 L372 A376 F382 L412	V335-V380 CarbonylContact O-C 3.49Å; V335-V380 WeakPolarHBondContact O-CA 3.3Å; V335-V380 WeakPolarHBondContact O-CG1 3.33Å; L336-V380 HydrophobicContact CD1-CG2 3.81Å; K358-V380 WeakPolarHBondContact CD-O 3.47Å; K358-V380 VanDerWaalsContact CE-O 3.25Å; K358-V380 WeakPolarHBondContact CE-O 3.15Å; K358-V380 PolarHBondContact NZ-O 3.42Å; L372-V380 HydrophobicContact CD2-CG2 4.47Å; A376-V380 HydrophobicContact CB-CB 3.91Å; A376-V380 HydrophobicContact CB-CG2 3.95Å; A376-V380 WeakPolarHBondContact O-CB 3.47Å; A376-V380 PolarHBondContact O-N 3.44Å; V380-F382 HydrophobicContact CG1-CD1 4.06Å; V380-F382 HydrophobicContact CG1-CE1 3.92Å; V380-F382 HydrophobicContact CG1-CZ 4.41Å; V380-L412 HydrophobicContact CG1-CD1 4.2Å; V380-L412 HydrophobicContact CG2-CD1 3.85Å
381	I	91.8	Very high	82.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.6	168.9	-53.4	163.4	0	0	0	106.6	I322 V331 D334 V335 L337 C342 V344 K358 T385	I322-I381 HydrophobicContact CD1-CD1 4.36Å; I322-I381 HydrophobicContact CG2-CD1 4.43Å; V331-I381 HydrophobicContact CB-CG2 4.36Å; V331-I381 HydrophobicContact CG1-CG2 4.14Å; V331-I381 HydrophobicContact CG2-CG2 3.9Å; D334-I381 WeakPolarHBondContact CA-O 3.48Å; V335-I381 HydrophobicContact CG2-CB 3.73Å; V335-I381 HydrophobicContact CG2-CD1 4.33Å; V335-I381 HydrophobicContact CG2-CG1 4.46Å; V335-I381 HydrophobicContact CG2-CG2 4.5Å; V335-I381 PolarHBondContact N-O 3.12Å; V335-I381 PolarHBondContact O-N 2.79Å; L337-I381 HydrophobicContact CD1-CD1 4.34Å; C342-I381 WeakPolarHBondContact SG-CD1 3.47Å; V344-I381 HydrophobicContact CG1-CG1 4.28Å; V344-I381 HydrophobicContact CG1-CG2 3.95Å; K358-I381 HydrophobicContact CB-CG1 4.48Å; K358-I381 HydrophobicContact CG-CG1 4.13Å; I381-T385 VanDerWaalsContact CG2-OG1 3.3Å; I381-T385 WeakPolarHBondContact CG2-OG1 3.16Å
382	F	89.7	Confident	82.8	Confident	36 Å²	36	41 Å²	41	16%	0.158	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-86.3	149.7	-176.9	-59.7	-72.2	0	0	0	111.5	D334 L349 A376 V380 T385 S419	D334-F382 WeakPolarHBondContact OD1-CA 3.36Å; L349-F382 HydrophobicContact CD1-CB 3.37Å; L349-F382 HydrophobicContact CD1-CG 4.35Å; A376-F382 HydrophobicContact CB-CE1 4.27Å; A376-F382 HydrophobicContact CB-CZ 3.81Å; V380-F382 HydrophobicContact CG1-CD1 4.06Å; V380-F382 HydrophobicContact CG1-CE1 3.92Å; V380-F382 HydrophobicContact CG1-CZ 4.41Å; F382-T385 HydrophobicContact CB-CG2 3.96Å; F382-T385 WeakPolarHBondContact O-CB 3.29Å; F382-T385 VanDerWaalsContact O-CG2 3.27Å; F382-T385 WeakPolarHBondContact O-CG2 3.16Å; F382-T385 PolarHBondContact O-N 3.33Å; F382-T385 PolarHBondContact O-OG1 3.05Å; F382-S419 VanDerWaalsContact CD1-OG 3.29Å; F382-S419 WeakPolarHBondContact CD1-OG 3.44Å
383	G	86.8	Confident	82.9	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.01	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	136.6	172.7	0	0	0	0	0	110.6	V331 C333 D334 L349 Q420	V331-G383 CarbonylContact O-C 3.55Å; V331-G383 WeakPolarHBondContact O-CA 3.18Å; C333-G383 WeakPolarHBondContact O-CA 3.34Å; C333-G383 PolarHBondContact O-N 3.41Å; D334-G383 PolarHBondContact OD1-N 3.31Å; L349-G383 WeakPolarHBondContact CD1-O 3.42Å; G383-Q420 VanDerWaalsContact O-CB 3.24Å; G383-Q420 WeakPolarHBondContact O-CB 3.42Å; G383-Q420 PolarHBondContact O-OE1 2.91Å
384	G	81.5	Confident	83	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.01	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.4	-7.2	-175.1	0	0	0	0	0	114.7	V331 Q420	V331-G384 PolarHBondContact O-N 3.23Å; G384-Q420 VanDerWaalsContact CA-OE1 3.22Å
385	T	85.5	Confident	82.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.			trans	-77.8	154.8	173.2	62.4	0	0	0	0	111.8	L330 V331 D345 E346 L349 I381 F382	L330-T385 WeakPolarHBondContact CA-O 3.4Å; V331-T385 WeakPolarHBondContact CG2-O 3.33Å; V331-T385 PolarHBondContact N-O 2.84Å; D345-T385 WeakPolarHBondContact O-CA 3.25Å; D345-T385 WeakPolarHBondContact O-CB 3.32Å; E346-T385 HydrophobicContact CB-CG2 4.08Å; E346-T385 HydrophobicContact CG-CG2 3.77Å; L349-T385 HydrophobicContact CD1-CG2 3.35Å; I381-T385 VanDerWaalsContact CG2-OG1 3.3Å; I381-T385 WeakPolarHBondContact CG2-OG1 3.16Å; F382-T385 HydrophobicContact CB-CG2 3.96Å; F382-T385 WeakPolarHBondContact O-CB 3.29Å; F382-T385 VanDerWaalsContact O-CG2 3.27Å; F382-T385 WeakPolarHBondContact O-CG2 3.16Å; F382-T385 PolarHBondContact O-N 3.33Å; F382-T385 PolarHBondContact O-OG1 3.05Å
386	K	84.9	Confident	81.3	Confident	52 Å²	52	47.7 Å²	47.7	23%	0.226	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.9	175.4	-178.6	178.6	177	179.1	0	110.2	E328 L330 V344 D345 V388	E328-K386 IonicContact OE1-NZ 3.64Å; E328-K386 PolarHBondContact OE1-NZ 2.9Å; E328-K386 IonicContact OE2-NZ 2.63Å; E328-K386 PolarHBondContact OE2-NZ 3.04Å; L330-K386 HydrophobicContact CD2-CB 3.78Å; V344-K386 CarbonylContact C-O 3.56Å; V344-K386 WeakPolarHBondContact CA-O 3.26Å; D345-K386 HydrophobicContact CB-CB 4.29Å; D345-K386 PolarHBondContact N-O 3.04Å; D345-K386 PolarHBondContact O-N 3.42Å; K386-V388 PolarHBondContact O-N 2.86Å
387	V	87.8	Confident	80.6	Confident	10 Å²	10	50.3 Å²	50.3	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	108.9	172.6	-175.1	0	0	0	0	109	I322 V331 C342 V344 H390	I322-V387 HydrophobicContact CG2-CG2 3.67Å; V331-V387 HydrophobicContact CG2-CG2 3.68Å; C342-V387 HydrophobicContact CB-CG1 4.3Å; V344-V387 HydrophobicContact CG1-CG2 4.29Å; V387-H390 HydrophobicContact CG1-CB 4.34Å
388	V	84.6	Confident	79.8	Confident	32 Å²	32	50.7 Å²	50.7	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-45.9	-180	-178.2	0	0	0	0	110.2	R324 I343 D345 K386 L577	R324-V388 WeakPolarHBondContact CD-O 3.25Å; I343-V388 HydrophobicContact CG2-CB 4.38Å; I343-V388 PolarHBondContact O-N 2.84Å; D345-V388 HydrophobicContact CB-CG2 3.8Å; K386-V388 PolarHBondContact O-N 2.86Å; V388-L577 HydrophobicContact CG1-CD1 3.77Å; V388-L577 HydrophobicContact CG1-CD2 3.83Å
389	Q	84.2	Confident	79.3	Confident	28 Å²	28	50.4 Å²	50.4	13%	0.131	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149.3	-178.8	-164.6	177.5	10	0	0	110	C342 I343 L577 D578	C342-Q389 CarbonylContact C-O 3.48Å; C342-Q389 WeakPolarHBondContact CA-O 3.48Å; I343-Q389 HydrophobicContact CB-CB 4.25Å; I343-Q389 HydrophobicContact CD1-CB 4.23Å; I343-Q389 HydrophobicContact CG1-CB 4.44Å; I343-Q389 PolarHBondContact N-O 2.92Å; I343-Q389 PolarHBondContact O-N 2.81Å; Q389-L577 HydrophobicContact CB-CD2 4.25Å; Q389-D578 PolarHBondContact NE2-OD1 3.5Å; Q389-D578 PolarHBondContact NE2-OD2 2.82Å
390	H	86.9	Confident	78.7	Confident	52 Å²	52	51.4 Å²	51.4	24%	0.241	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	149	173.6	67.6	-74.7	0	0	0	110	R324 R341 C342 V387 N405	R324-H390 WeakPolarHBondContact CB-ND1 3.47Å; R324-H390 PolarHBondContact N-CE1 2.96Å; R324-H390 PolarHBondContact N-ND1 3.1Å; R341-H390 CarbonylContact O-C 3.57Å; C342-H390 HydrophobicContact CB-CB 4.23Å; V387-H390 HydrophobicContact CG1-CB 4.34Å; H390-N405 PolarHBondContact CD2-O 3.28Å
391	M	82.9	Confident	78.2	Confident	106 Å²	106	56 Å²	56	52%	0.522	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.4	177	-70	-111.9	-77.3	0	0	108.4	G340 R341	G340-M391 WeakPolarHBondContact CA-O 2.91Å; R341-M391 HydrophobicContact CB-CB 4.34Å; R341-M391 PolarHBondContact N-O 3.41Å; R341-M391 PolarHBondContact O-N 2.87Å
392	P	80.7	Confident	77.7	Confident	70 Å²	70	56.6 Å²	56.6	46%	0.455	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-64.3	152.8	-177.5	25.1	-33.1	0	0	0	111.8	N405	P392-N405 HydrophobicContact CB-CB 4.12Å; P392-N405 WeakPolarHBondContact CB-O 3.49Å
393	P	79.6	Confident	77.4	Confident	15 Å²	15	60.2 Å²	60.2	10%	0.097	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-59.1	142.1	174.5	22.6	-30.7	0	0	0	111.7	R339	R339-P393 HydrophobicContact CB-CB 4.21Å
394	Q	72.6	Confident	77.3	Confident	125 Å²	125	63.6 Å²	63.6	58%	0.584	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-60.9	138.7	-175.6	-67.7	-174.8	0.9	0	0	111.9	A396 T397	Q394-A396 PolarHBondContact O-N 3.25Å; Q394-A396 VanDerWaalsContact O-N 3.15Å; Q394-T397 PolarHBondContact O-N 3.37Å
395	K	60.5	Low	77.4	Confident	193 Å²	193	68.7 Å²	68.7	84%	0.839	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-28.4	-173.2	-72	-176.4	180	178.6	0	113.7	K401	K395-K401 PolarHBondContact O-NZ 2.82Å
396	A	54.4	Low	77.4	Confident	99 Å²	99	68.7 Å²	68.7	82%	0.818	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-12	-172.6	0	0	0	0	0	115.2	Q394	Q394-A396 PolarHBondContact O-N 3.25Å; Q394-A396 VanDerWaalsContact O-N 3.15Å
397	T	61.3	Low	77.7	Confident	61 Å²	61	66.2 Å²	66.2	37%	0.374	38%	0.378	S	S	.	.	S	Bend	trans	-100.6	123.5	-169.2	-41	0	0	0	0	111.6	R339 Q394	R339-T397 PolarHBondContact NH2-O 2.78Å; Q394-T397 PolarHBondContact O-N 3.37Å
398	S	60.1	Low	77.9	Confident	122 Å²	122	65.9 Å²	65.9	85%	0.853	38%	0.376	S	S	*	.			trans	-58	131.3	177.9	131.9	0	0	0	0	111.4	R339	R339-S398 PolarHBondContact NH2-O 3.27Å
399	G	69.9	Low	78.3	Confident	43 Å²	43	64.4 Å²	64.4	44%	0.443	37%	0.367	S	S	.	.	S	Bend	trans	149.7	176	176.2	0	0	0	0	0	114.2	R339	R339-G399 PolarHBondContact NH1-O 3.39Å
400	L	76.9	Confident	78.8	Confident	32 Å²	32	63.2 Å²	63.2	17%	0.168	36%	0.361	C	S	.	.			trans	-57.8	138.7	178.4	-105.6	83.2	0	0	0	111.3	Y301 W306 I319 R339	Y301-L400 HydrophobicContact CD1-CD2 3.67Å; Y301-L400 HydrophobicContact CD2-CD2 3.71Å; Y301-L400 HydrophobicContact CE1-CD1 4.42Å; Y301-L400 HydrophobicContact CE1-CD2 3.82Å; Y301-L400 HydrophobicContact CE2-CD2 3.87Å; Y301-L400 HydrophobicContact CE2-CG 4.44Å; Y301-L400 HydrophobicContact CG-CD2 3.59Å; W306-L400 HydrophobicContact CZ2-CD2 3.97Å; I319-L400 HydrophobicContact CG2-CD2 4.44Å; R339-L400 PolarHBondContact NH1-O 3.03Å; R339-L400 VanDerWaalsContact NH1-O 3.08Å
401	K	79.8	Confident	79.1	Confident	98 Å²	98	60.8 Å²	60.8	43%	0.426	35%	0.35	S	S	.	.			trans	-125.6	138.4	171.3	-69.8	-179.1	-179.6	171.3	0	108.5	W306 K395	W306-K401 PolarHBondContact NE1-O 2.9Å; K395-K401 PolarHBondContact O-NZ 2.82Å
402	S	82.3	Confident	79.5	Confident	12 Å²	12	55.9 Å²	55.9	8%	0.084	33%	0.326	C	S	.	.			trans	-81	161	174.4	70.2	0	0	0	0	111.2	S321 D404 N405 G406	S321-S402 WeakPolarHBondContact OG-CB 3.44Å; S321-S402 PolarHBondContact OG-OG 3.08Å; S402-D404 VanDerWaalsContact C-N 3.32Å; S402-D404 WeakPolarHBondContact CB-OD1 3.3Å; S402-D404 PolarHBondContact OG-OD1 3.45Å; S402-N405 PolarHBondContact OG-N 3.35Å; S402-G406 PolarHBondContact OG-N 2.74Å; S402-G406 VanDerWaalsContact OG-N 3.1Å; S402-G406 PolarHBondContact OG-O 3.29Å
403	V	83.4	Confident	80	Confident	113 Å²	113	55.7 Å²	55.7	69%	0.685	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-26.6	-179.6	-175.7	0	0	0	0	111.7	W306	W306-V403 HydrophobicContact CB-CG2 3.86Å; W306-V403 HydrophobicContact CG-CG2 4.04Å
404	D	83.1	Confident	80.5	Confident	72 Å²	72	55.1 Å²	55.1	39%	0.385	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.3	-173.4	59.9	-3.9	0	0	0	114	S321 S402 G406	S321-D404 VanDerWaalsContact OG-CG 3.26Å; S321-D404 PolarHBondContact OG-OD1 3Å; S321-D404 PolarHBondContact OG-OD2 2.98Å; S321-D404 VanDerWaalsContact OG-OD2 3.11Å; S402-D404 VanDerWaalsContact C-N 3.32Å; S402-D404 WeakPolarHBondContact CB-OD1 3.3Å; S402-D404 PolarHBondContact OG-OD1 3.45Å; D404-G406 PolarHBondContact O-N 2.97Å; D404-G406 VanDerWaalsContact O-N 3.15Å; D404-G406 PolarHBondContact OD1-N 2.73Å
405	N	84.6	Confident	81.3	Confident	108 Å²	108	49.5 Å²	49.5	58%	0.578	29%	0.287	S	S	*	.	S	Bend	trans	56.7	19.8	-171.2	-62.8	-49.7	0	0	0	114.3	H390 P392 S402	H390-N405 PolarHBondContact CD2-O 3.28Å; P392-N405 HydrophobicContact CB-CB 4.12Å; P392-N405 WeakPolarHBondContact CB-O 3.49Å; S402-N405 PolarHBondContact OG-N 3.35Å
406	G	86.2	Confident	82.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-69.1	171.3	171.1	0	0	0	0	0	113.8	S321 S402 D404	S321-G406 WeakPolarHBondContact OG-CA 3.37Å; S402-G406 PolarHBondContact OG-N 2.74Å; S402-G406 VanDerWaalsContact OG-N 3.1Å; S402-G406 PolarHBondContact OG-O 3.29Å; D404-G406 PolarHBondContact O-N 2.97Å; D404-G406 VanDerWaalsContact O-N 3.15Å; D404-G406 PolarHBondContact OD1-N 2.73Å
407	C	90.1	Very high	83.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136.3	172.3	-63.2	0	0	0	0	110	S321 I322 L337 R339 R341	S321-C407 CarbonylContact C-O 3.58Å; S321-C407 WeakPolarHBondContact CA-O 3.44Å; I322-C407 PolarHBondContact N-O 3.23Å; I322-C407 WeakPolarHBondContact O-CB 3.29Å; I322-C407 PolarHBondContact O-N 2.91Å; L337-C407 HydrophobicContact CD1-CB 3.63Å; R339-C407 CarbonylContact O-C 3.45Å; R339-C407 WeakPolarHBondContact O-CA 3.49Å; R341-C407 PolarHBondContact O-SG 2.9Å
408	V	91.9	Very high	85.2	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.3	179.2	-177.7	0	0	0	0	108.5	W306 I319 L338 R339	W306-V408 HydrophobicContact CH2-CG1 4.41Å; W306-V408 HydrophobicContact CH2-CG2 4.43Å; W306-V408 HydrophobicContact CZ2-CG2 4.44Å; I319-V408 HydrophobicContact CG2-CG1 3.54Å; L338-V408 WeakPolarHBondContact CA-O 3.44Å; L338-V408 WeakPolarHBondContact CB-O 3.49Å; L338-V408 HydrophobicContact CD1-CG1 4.46Å; L338-V408 PolarHBondContact N-O 3.24Å; R339-V408 HydrophobicContact CB-CB 4.29Å; R339-V408 PolarHBondContact N-O 3.2Å; R339-V408 PolarHBondContact O-N 2.8Å
409	A	93.3	Very high	86.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.8	-177.2	0	0	0	0	0	112.3	I319 V320 I322 V335 L336	I319-A409 CarbonylContact C-O 3.53Å; I319-A409 WeakPolarHBondContact CA-O 3.38Å; V320-A409 HydrophobicContact CG2-CB 4.19Å; V320-A409 PolarHBondContact N-O 3Å; V320-A409 PolarHBondContact O-N 3.3Å; I322-A409 HydrophobicContact CD1-CB 3.72Å; I322-A409 HydrophobicContact CG1-CB 4.37Å; V335-A409 HydrophobicContact CB-CB 4Å; V335-A409 HydrophobicContact CG2-CB 4.07Å; L336-A409 CarbonylContact O-C 3.49Å; L336-A409 WeakPolarHBondContact O-CA 3.45Å; L336-A409 WeakPolarHBondContact O-CB 3.48Å
410	Y	93.6	Very high	86.6	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132	178.3	177.9	-91.3	0	0	0	110.5	P192 Y200 N203 G317 I319 V335 L336 L412	P192-Y410 HydrophobicContact CG-CE1 4.17Å; Y200-Y410 AromaticContact CD1-CD1 3.63Å; Y200-Y410 HydrophobicContact CD1-CD1 3.63Å; Y200-Y410 AromaticContact CD1-CE1 3.61Å; Y200-Y410 HydrophobicContact CD1-CE1 3.61Å; Y200-Y410 HydrophobicContact CD1-CG 4.14Å; Y200-Y410 AromaticContact CE1-CD1 3.91Å; Y200-Y410 HydrophobicContact CE1-CD1 3.91Å; Y200-Y410 AromaticContact CE1-CE1 3.58Å; Y200-Y410 HydrophobicContact CE1-CE1 3.58Å; N203-Y410 HydrophobicContact CB-CE2 4.41Å; N203-Y410 VanDerWaalsContact ND2-CE2 3.34Å; N203-Y410 WeakPolarHBondContact ND2-CE2 3.47Å; G317-Y410 WeakPolarHBondContact CA-OH 3.45Å; G317-Y410 WeakPolarHBondContact O-CE2 3.44Å; I319-Y410 HydrophobicContact CG1-CD2 4.44Å; V335-Y410 CarbonylContact C-O 3.56Å; V335-Y410 VanDerWaalsContact CA-O 3.24Å; V335-Y410 WeakPolarHBondContact CA-O 3.35Å; L336-Y410 PolarHBondContact N-O 2.96Å; L336-Y410 PolarHBondContact O-N 3.15Å; Y410-L412 HydrophobicContact CD1-CD2 3.96Å; Y410-L412 HydrophobicContact CE1-CD2 4.16Å; Y410-L412 PolarHBondContact O-N 2.65Å
411	V	94.1	Very high	86.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.8	-177	-177.8	0	0	0	0	111.3	I314 G317 D318 V320 C333 V335 T414	I314-V411 HydrophobicContact CG2-CB 4.31Å; I314-V411 HydrophobicContact CG2-CG1 3.95Å; I314-V411 HydrophobicContact CG2-CG2 3.63Å; G317-V411 PolarHBondContact N-O 3.21Å; G317-V411 VanDerWaalsContact N-O 3.08Å; D318-V411 HydrophobicContact CB-CB 4.5Å; D318-V411 HydrophobicContact CB-CG2 4.01Å; D318-V411 WeakPolarHBondContact O-CG2 3.41Å; D318-V411 PolarHBondContact O-N 3.1Å; V320-V411 HydrophobicContact CG1-CG2 3.68Å; V320-V411 HydrophobicContact CG2-CG2 4.06Å; C333-V411 HydrophobicContact CB-CG1 4.41Å; V335-V411 HydrophobicContact CG1-CG2 4.1Å; V411-T414 HydrophobicContact CG1-CG2 3.68Å
412	L	91.6	Very high	86.7	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-51.8	-180	-66.3	176.6	0	0	0	112.4	P192 V193 Y200 D334 L336 L370 L372 V380 Y410	P192-L412 WeakPolarHBondContact O-CD2 3.41Å; V193-L412 HydrophobicContact CG1-CB 4.12Å; V193-L412 HydrophobicContact CG1-CD2 4.27Å; Y200-L412 HydrophobicContact CE1-CD2 4.05Å; D334-L412 WeakPolarHBondContact O-CB 3.41Å; D334-L412 PolarHBondContact O-N 3.46Å; L336-L412 HydrophobicContact CB-CD1 3.99Å; L336-L412 HydrophobicContact CB-CD2 4.16Å; L336-L412 HydrophobicContact CB-CG 4Å; L370-L412 HydrophobicContact CD2-CD1 4.4Å; L370-L412 HydrophobicContact CD2-CD2 4.17Å; L372-L412 HydrophobicContact CD2-CD1 4.27Å; V380-L412 HydrophobicContact CG1-CD1 4.2Å; V380-L412 HydrophobicContact CG2-CD1 3.85Å; Y410-L412 HydrophobicContact CD1-CD2 3.96Å; Y410-L412 HydrophobicContact CE1-CD2 4.16Å; Y410-L412 PolarHBondContact O-N 2.65Å
413	R	90.8	Very high	86.3	Confident	67 Å²	67	29.8 Å²	29.8	25%	0.253	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.1	-175.5	-58.2	-177.8	179.4	161.8	-4.7	110.6	F191 V193 C333 D334 N417 T418	F191-R413 HydrophobicContact CB-CG 4.17Å; F191-R413 HydrophobicContact CD1-CB 4.35Å; F191-R413 HydrophobicContact CD1-CG 4.16Å; F191-R413 HydrophobicContact CG-CG 4.06Å; V193-R413 HydrophobicContact CG1-CG 4.29Å; C333-R413 WeakPolarHBondContact CB-O 3.4Å; D334-R413 HydrophobicContact CB-CB 4.22Å; D334-R413 PolarHBondContact N-O 3.32Å; D334-R413 PolarHBondContact O-N 2.97Å; R413-N417 VanDerWaalsContact CD-O 3.23Å; R413-N417 WeakPolarHBondContact CD-O 3.16Å; R413-T418 HydrophobicContact CB-CG2 4.44Å; R413-T418 WeakPolarHBondContact O-CG2 3.49Å
414	T	91	Very high	85.8	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.018	13%	0.13	C	C	.	.			trans	-131.3	159.9	-178.9	55.2	0	0	0	0	111.3	N222 I314 P316 C333 V411 N417	N222-T414 HydrophobicContact CB-CG2 4.16Å; N222-T414 WeakPolarHBondContact OD1-CA 3.26Å; N222-T414 WeakPolarHBondContact OD1-CB 3.44Å; I314-T414 HydrophobicContact CG2-CG2 4.45Å; P316-T414 HydrophobicContact CG-CG2 4.1Å; C333-T414 HydrophobicContact CB-CG2 4.17Å; V411-T414 HydrophobicContact CG1-CG2 3.68Å; T414-N417 PolarHBondContact O-N 3.27Å
415	G	87.7	Confident	85.5	Confident	6 Å²	6	23 Å²	23	6%	0.062	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	60.9	-139.1	176.1	0	0	0	0	0	113.7	N222 N417 T418	N222-G415 PolarHBondContact OD1-N 3.21Å; G415-N417 PolarHBondContact O-N 3.31Å; G415-N417 VanDerWaalsContact O-N 3.13Å; G415-T418 WeakPolarHBondContact O-CB 3.29Å; G415-T418 WeakPolarHBondContact O-CG2 3.3Å; G415-T418 PolarHBondContact O-N 3.26Å; G415-T418 PolarHBondContact O-OG1 3.28Å
416	F	84.2	Confident	84.9	Confident	18 Å²	18	20.3 Å²	20.3	8%	0.079	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-67.7	-5.9	179.8	-75	-81.6	0	0	0	114.8	K173 G421 K422 R425	K173-F416 HydrophobicContact CB-CB 4.04Å; K173-F416 HydrophobicContact CB-CD1 4.16Å; K173-F416 HydrophobicContact CB-CD2 3.55Å; K173-F416 HydrophobicContact CB-CE2 3.99Å; K173-F416 HydrophobicContact CB-CG 3.64Å; K173-F416 HydrophobicContact CB-CZ 4.46Å; K173-F416 HydrophobicContact CD-CE2 4.32Å; K173-F416 HydrophobicContact CG-CD1 4.45Å; K173-F416 HydrophobicContact CG-CD2 3.96Å; K173-F416 HydrophobicContact CG-CE1 4.35Å; K173-F416 HydrophobicContact CG-CE2 3.84Å; K173-F416 HydrophobicContact CG-CG 4.26Å; K173-F416 HydrophobicContact CG-CZ 4.04Å; F416-G421 CarbonylContact O-C 3.54Å; F416-G421 VanDerWaalsContact O-C 3.26Å; F416-K422 PolarHBondContact O-N 3.01Å; F416-R425 HydrophobicContact CD1-CB 4.19Å
417	N	86.8	Confident	84.1	Confident	42 Å²	42	21.8 Å²	21.8	23%	0.225	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-91.5	-12.4	176.2	-64.3	-61.3	0	0	0	113.2	F191 R413 T414 G415	F191-N417 HydrophobicContact CD2-CB 4.43Å; F191-N417 HydrophobicContact CE1-CB 4.41Å; F191-N417 HydrophobicContact CE2-CB 3.6Å; F191-N417 VanDerWaalsContact CE2-CG 3.48Å; F191-N417 HydrophobicContact CZ-CB 3.61Å; F191-N417 VanDerWaalsContact CZ-ND2 3.26Å; F191-N417 WeakPolarHBondContact CZ-ND2 3.46Å; R413-N417 VanDerWaalsContact CD-O 3.23Å; R413-N417 WeakPolarHBondContact CD-O 3.16Å; T414-N417 PolarHBondContact O-N 3.27Å; G415-N417 PolarHBondContact O-N 3.31Å; G415-N417 VanDerWaalsContact O-N 3.13Å
418	T	87.2	Confident	83.2	Confident	5 Å²	5	24 Å²	24	3%	0.031	12%	0.122	C	C	.	.	S	Bend	trans	-62	164.9	169.2	60.7	0	0	0	0	110.9	C333 D334 R413 G415 Q420 G421 K422	C333-T418 HydrophobicContact CB-CG2 4.41Å; D334-T418 WeakPolarHBondContact OD2-CA 3.45Å; R413-T418 HydrophobicContact CB-CG2 4.44Å; R413-T418 WeakPolarHBondContact O-CG2 3.49Å; G415-T418 WeakPolarHBondContact O-CB 3.29Å; G415-T418 WeakPolarHBondContact O-CG2 3.3Å; G415-T418 PolarHBondContact O-N 3.26Å; G415-T418 PolarHBondContact O-OG1 3.28Å; T418-Q420 VanDerWaalsContact C-N 3.34Å; T418-Q420 PolarHBondContact O-N 2.92Å; T418-G421 PolarHBondContact O-N 3.3Å; T418-G421 WeakPolarHBondContact OG1-CA 3.44Å; T418-G421 PolarHBondContact OG1-N 2.86Å; T418-K422 WeakPolarHBondContact O-CB 3.46Å; T418-K422 PolarHBondContact O-N 3.42Å
419	S	81.3	Confident	82.2	Confident	37 Å²	37	26.9 Å²	26.9	26%	0.259	13%	0.134	S	C	.	.	H	α-helix	trans	-61.7	-42.6	177.3	-57.3	0	0	0	0	111.6	D334 F382 L423	D334-S419 PolarHBondContact OD1-N 3.33Å; D334-S419 PolarHBondContact OD2-N 3.29Å; D334-S419 PolarHBondContact OD2-OG 3.02Å; F382-S419 VanDerWaalsContact CD1-OG 3.29Å; F382-S419 WeakPolarHBondContact CD1-OG 3.44Å; S419-L423 PolarHBondContact O-N 3.46Å
420	Q	79.1	Confident	80.4	Confident	25 Å²	25	27.1 Å²	27.1	12%	0.117	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-45.3	172.7	-176.3	-175.2	24.6	0	0	111.6	L349 G383 G384 T418 K422 L423 L424	L349-Q420 HydrophobicContact CD2-CB 3.97Å; G383-Q420 VanDerWaalsContact O-CB 3.24Å; G383-Q420 WeakPolarHBondContact O-CB 3.42Å; G383-Q420 PolarHBondContact O-OE1 2.91Å; G384-Q420 VanDerWaalsContact CA-OE1 3.22Å; T418-Q420 VanDerWaalsContact C-N 3.34Å; T418-Q420 PolarHBondContact O-N 2.92Å; Q420-K422 PolarHBondContact O-N 3.35Å; Q420-L423 WeakPolarHBondContact O-CB 3.42Å; Q420-L423 PolarHBondContact O-N 2.98Å; Q420-L424 HydrophobicContact CG-CD1 4.28Å; Q420-L424 HydrophobicContact CG-CG 4.46Å; Q420-L424 WeakPolarHBondContact O-CG 3.32Å; Q420-L424 PolarHBondContact O-N 3.35Å
421	G	80.7	Confident	78.9	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-41.3	179.1	0	0	0	0	0	113	F416 T418 L423 L424 R425	F416-G421 CarbonylContact O-C 3.54Å; F416-G421 VanDerWaalsContact O-C 3.26Å; T418-G421 PolarHBondContact O-N 3.3Å; T418-G421 WeakPolarHBondContact OG1-CA 3.44Å; T418-G421 PolarHBondContact OG1-N 2.86Å; G421-L423 VanDerWaalsContact C-N 3.33Å; G421-L423 PolarHBondContact O-N 3.49Å; G421-L424 PolarHBondContact O-N 2.95Å; G421-R425 WeakPolarHBondContact O-CB 3.39Å; G421-R425 PolarHBondContact O-N 3.44Å
422	K	78.3	Confident	77.3	Confident	88 Å²	88	35.6 Å²	35.6	38%	0.383	18%	0.176	S	C	.	.	H	α-helix	trans	-61.4	-43.2	175.2	-174.6	174.4	-176.1	173.2	0	110.5	E45 F416 T418 Q420 R425 T426	E45-K422 IonicContact OE2-NZ 3.73Å; E45-K422 PolarHBondContact OE2-NZ 3.45Å; F416-K422 PolarHBondContact O-N 3.01Å; T418-K422 WeakPolarHBondContact O-CB 3.46Å; T418-K422 PolarHBondContact O-N 3.42Å; Q420-K422 PolarHBondContact O-N 3.35Å; K422-R425 PolarHBondContact O-N 2.84Å; K422-T426 PolarHBondContact O-N 2.6Å; K422-T426 PolarHBondContact O-OG1 3.05Å; K422-T426 VanDerWaalsContact O-OG1 3.06Å
423	L	73.1	Confident	75.8	Confident	31 Å²	31	41.8 Å²	41.8	16%	0.162	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-52.3	176	179.3	69.7	0	0	0	111.6	S419 Q420 G421 R425 T426 I427 V866 D950	S419-L423 PolarHBondContact O-N 3.46Å; Q420-L423 WeakPolarHBondContact O-CB 3.42Å; Q420-L423 PolarHBondContact O-N 2.98Å; G421-L423 VanDerWaalsContact C-N 3.33Å; G421-L423 PolarHBondContact O-N 3.49Å; L423-R425 VanDerWaalsContact C-N 3.26Å; L423-R425 PolarHBondContact O-N 3.37Å; L423-T426 PolarHBondContact O-N 3.27Å; L423-T426 VanDerWaalsContact O-N 3.09Å; L423-I427 HydrophobicContact CD1-CD1 4.37Å; L423-I427 HydrophobicContact CG-CD1 3.98Å; L423-I427 WeakPolarHBondContact O-CD1 3.19Å; L423-I427 WeakPolarHBondContact O-CG1 3.41Å; L423-I427 PolarHBondContact O-N 3.34Å; L423-V866 HydrophobicContact CD1-CG1 3.94Å; L423-D950 HydrophobicContact CD2-CB 3.69Å; L423-D950 WeakPolarHBondContact CD2-OD1 3.44Å
424	L	73.6	Confident	74.1	Confident	22 Å²	22	40.7 Å²	40.7	12%	0.115	20%	0.2	C	C	.	.	H	α-helix	trans	-56.9	-40.4	177.8	-68.7	179.2	0	0	0	111.8	M226 Q420 G421 I427 L428	M226-L424 HydrophobicContact CE-CB 4.17Å; M226-L424 HydrophobicContact CE-CD1 4.19Å; M226-L424 HydrophobicContact CE-CD2 3.69Å; M226-L424 HydrophobicContact CE-CG 4.23Å; Q420-L424 HydrophobicContact CG-CD1 4.28Å; Q420-L424 HydrophobicContact CG-CG 4.46Å; Q420-L424 WeakPolarHBondContact O-CG 3.32Å; Q420-L424 PolarHBondContact O-N 3.35Å; G421-L424 PolarHBondContact O-N 2.95Å; L424-I427 HydrophobicContact CD2-CD1 4.5Å; L424-I427 PolarHBondContact O-N 3.16Å; L424-L428 VanDerWaalsContact O-CG 3.28Å; L424-L428 WeakPolarHBondContact O-CG 3.38Å; L424-L428 PolarHBondContact O-N 2.99Å
425	R	77.2	Confident	72.5	Confident	21 Å²	21	44.1 Å²	44.1	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-47.8	174.7	-175.3	-173.9	64.1	-151.7	16.3	111.7	Q172 I174 F416 G421 K422 L423 I427 L428 F429	Q172-R425 HydrophobicContact CB-CG 4.4Å; Q172-R425 WeakPolarHBondContact O-CD 3.24Å; Q172-R425 WeakPolarHBondContact O-CG 3.41Å; I174-R425 VanDerWaalsContact CD1-CZ 3.47Å; F416-R425 HydrophobicContact CD1-CB 4.19Å; G421-R425 WeakPolarHBondContact O-CB 3.39Å; G421-R425 PolarHBondContact O-N 3.44Å; K422-R425 PolarHBondContact O-N 2.84Å; L423-R425 VanDerWaalsContact C-N 3.26Å; L423-R425 PolarHBondContact O-N 3.37Å; R425-I427 PolarHBondContact O-N 2.7Å; R425-L428 PolarHBondContact O-N 3.07Å; R425-L428 VanDerWaalsContact O-N 3.13Å; R425-F429 HydrophobicContact CG-CD2 3.67Å; R425-F429 HydrophobicContact CG-CE2 4.27Å; R425-F429 WeakPolarHBondContact O-CD2 3.31Å; R425-F429 PolarHBondContact O-N 2.79Å
426	T	71.4	Confident	70.7	Confident	51 Å²	51	45.5 Å²	45.5	31%	0.313	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-36.3	178.1	-60.5	0	0	0	0	111.7	K422 L423 G430	K422-T426 PolarHBondContact O-N 2.6Å; K422-T426 PolarHBondContact O-OG1 3.05Å; K422-T426 VanDerWaalsContact O-OG1 3.06Å; L423-T426 PolarHBondContact O-N 3.27Å; L423-T426 VanDerWaalsContact O-N 3.09Å; T426-G430 WeakPolarHBondContact O-CA 3.45Å; T426-G430 PolarHBondContact O-N 2.93Å
427	I	70	Confident	69.3	Low	30 Å²	30	48.6 Å²	48.6	15%	0.154	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-44.8	174.2	-69.4	151.9	0	0	0	111.4	L423 L424 R425 I953	L423-I427 HydrophobicContact CD1-CD1 4.37Å; L423-I427 HydrophobicContact CG-CD1 3.98Å; L423-I427 WeakPolarHBondContact O-CD1 3.19Å; L423-I427 WeakPolarHBondContact O-CG1 3.41Å; L423-I427 PolarHBondContact O-N 3.34Å; L424-I427 HydrophobicContact CD2-CD1 4.5Å; L424-I427 PolarHBondContact O-N 3.16Å; R425-I427 PolarHBondContact O-N 2.7Å; I427-I953 HydrophobicContact CD1-CB 3.92Å; I427-I953 HydrophobicContact CD1-CG2 3.37Å; I427-I953 HydrophobicContact CG1-CG2 4.11Å; I427-I953 HydrophobicContact CG2-CG2 4Å
428	L	70.6	Confident	68.3	Low	48 Å²	48	49.8 Å²	49.8	25%	0.251	26%	0.256	S	S	.	.	H	α-helix	trans	-72.8	-39.7	-176.5	-70.6	169.2	0	0	0	113.4	M226 L424 R425	M226-L428 HydrophobicContact CE-CD1 4.08Å; M226-L428 HydrophobicContact CE-CD2 4.5Å; M226-L428 HydrophobicContact CE-CG 4.41Å; M226-L428 HydrophobicContact CG-CD1 3.9Å; M226-L428 HydrophobicContact SD-CD1 3.97Å; M226-L428 HydrophobicContact SD-CD2 3.89Å; M226-L428 HydrophobicContact SD-CG 4.33Å; L424-L428 VanDerWaalsContact O-CG 3.28Å; L424-L428 WeakPolarHBondContact O-CG 3.38Å; L424-L428 PolarHBondContact O-N 2.99Å; R425-L428 PolarHBondContact O-N 3.07Å; R425-L428 VanDerWaalsContact O-N 3.13Å
429	F	70.4	Confident	67.6	Low	63 Å²	63	55.9 Å²	55.9	28%	0.276	29%	0.287	S	S	.	.	H	α-helix	trans	-121.2	-9.9	-167.7	-56.1	-75.1	0	0	0	115	G148 Q172 K173 R425	G148-F429 VanDerWaalsContact CA-O 3.31Å; G148-F429 WeakPolarHBondContact CA-O 3.44Å; Q172-F429 HydrophobicContact CB-CB 4.34Å; Q172-F429 HydrophobicContact CB-CD2 4.07Å; Q172-F429 HydrophobicContact CB-CG 4.09Å; Q172-F429 HydrophobicContact CG-CB 3.92Å; Q172-F429 HydrophobicContact CG-CD1 4.2Å; Q172-F429 HydrophobicContact CG-CD2 4.43Å; Q172-F429 HydrophobicContact CG-CG 3.94Å; K173-F429 HydrophobicContact CG-CE2 4.12Å; K173-F429 HydrophobicContact CG-CZ 4.38Å; R425-F429 HydrophobicContact CG-CD2 3.67Å; R425-F429 HydrophobicContact CG-CE2 4.27Å; R425-F429 WeakPolarHBondContact O-CD2 3.31Å; R425-F429 PolarHBondContact O-N 2.79Å
430	G	56.5	Low	67.2	Low	4 Å²	4	56.5 Å²	56.5	4%	0.041	29%	0.286	C	S	.	.	S	Bend	trans	-69.7	-42.6	-168	0	0	0	0	0	115.5	N146 G148 T426	N146-G430 CarbonylContact C-O 3.53Å; G148-G430 PolarHBondContact N-O 3.23Å; T426-G430 WeakPolarHBondContact O-CA 3.45Å; T426-G430 PolarHBondContact O-N 2.93Å
431	V	61.7	Low	66.9	Low	34 Å²	34	55.8 Å²	55.8	21%	0.206	28%	0.283	C	S	.	.	S	Bend	trans	-125	136	-176.5	-178.5	0	0	0	0	111.9	R433 K870	V431-R433 PolarHBondContact O-N 3.12Å; V431-K870 HydrophobicContact CB-CG 4.37Å; V431-K870 HydrophobicContact CG2-CD 4.37Å; V431-K870 HydrophobicContact CG2-CG 3.62Å
432	K	59.7	Low	66.8	Low	148 Å²	148	62.1 Å²	62.1	64%	0.643	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-55.7	123.9	173.7	-71.3	-177	178.7	179	0	109.6	V434	K432-V434 PolarHBondContact O-N 3.04Å
433	R	60.1	Low	66.9	Low	134 Å²	134	61.4 Å²	61.4	51%	0.506	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-61.2	131.7	172.6	-66.6	-177.3	-176.7	172	3	108.9	M285 V431 T435	M285-R433 VanDerWaalsContact CE-NH2 3.31Å; V431-R433 PolarHBondContact O-N 3.12Å; R433-T435 PolarHBondContact O-N 3.28Å
434	V	56.7	Low	67.3	Low	44 Å²	44	60.5 Å²	60.5	27%	0.267	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-73.5	120.7	172.5	-176.5	0	0	0	0	107.7	K432 F516 R517 F520	K432-V434 PolarHBondContact O-N 3.04Å; V434-F516 WeakPolarHBondContact O-CB 3.37Å; V434-R517 HydrophobicContact CB-CG 4.5Å; V434-R517 HydrophobicContact CG2-CG 4.22Å; V434-F520 HydrophobicContact CG1-CD2 4.36Å; V434-F520 HydrophobicContact CG1-CE2 3.45Å; V434-F520 VanDerWaalsContact CG1-CE2 3.45Å; V434-F520 HydrophobicContact CG1-CZ 3.73Å
435	T	56.2	Low	67.6	Low	74 Å²	74	60.5 Å²	60.5	45%	0.454	31%	0.305	S	S	.	.			trans	-106.3	163.9	-179.9	60	0	0	0	0	110.9	R433 N437 N438	R433-T435 PolarHBondContact O-N 3.28Å; T435-N437 PolarHBondContact O-N 3.49Å; T435-N438 PolarHBondContact O-OD1 2.96Å
436	A	50.9	Low	68	Low	36 Å²	36	63.9 Å²	63.9	30%	0.298	32%	0.324	S	S	.	.	S	Bend	trans	-69.1	-13.3	175.4	0	0	0	0	0	113.7	N438 F516	A436-N438 VanDerWaalsContact C-N 3.28Å; A436-N438 PolarHBondContact O-N 3.02Å; A436-F516 HydrophobicContact CB-CD1 4.21Å; A436-F516 HydrophobicContact CB-CE1 3.74Å; A436-F516 HydrophobicContact CB-CZ 4.15Å
437	N	55	Low	68.6	Low	82 Å²	82	64.1 Å²	64.1	44%	0.439	32%	0.321	S	S	.	.			trans	-84	72.1	-175	-165.7	16	0	0	0	110.8	T435	T435-N437 PolarHBondContact O-N 3.49Å
438	N	64.9	Low	69.2	Low	68 Å²	68	62.9 Å²	62.9	36%	0.364	32%	0.315	S	S	.	.			trans	-85.4	144.9	-178.7	-70.9	-29.6	0	0	0	111	T435 A436 E440 T441 F442	T435-N438 PolarHBondContact O-OD1 2.96Å; A436-N438 VanDerWaalsContact C-N 3.28Å; A436-N438 PolarHBondContact O-N 3.02Å; N438-E440 HydrophobicContact CB-CB 4.49Å; N438-E440 PolarHBondContact O-N 3.44Å; N438-E440 VanDerWaalsContact O-N 3.12Å; N438-T441 WeakPolarHBondContact O-CB 3.48Å; N438-T441 PolarHBondContact O-N 2.85Å; N438-F442 PolarHBondContact O-N 2.94Å
439	L	71.6	Confident	69.9	Low	133 Å²	133	63 Å²	63	70%	0.696	32%	0.316	S	S	*	.	H	α-helix	trans	-50.1	-36.7	170.2	179.6	65.8	0	0	0	111.5	T441 F442 I443	L439-T441 PolarHBondContact O-N 3.03Å; L439-F442 PolarHBondContact O-N 2.87Å; L439-I443 HydrophobicContact CD1-CD1 4.27Å; L439-I443 HydrophobicContact CD1-CG1 4.41Å; L439-I443 HydrophobicContact CD2-CD1 4.41Å; L439-I443 HydrophobicContact CG-CD1 3.86Å; L439-I443 HydrophobicContact CG-CG1 4.4Å; L439-I443 VanDerWaalsContact O-CG1 3.29Å; L439-I443 WeakPolarHBondContact O-CG1 3.48Å; L439-I443 PolarHBondContact O-N 3.26Å
440	E	73.5	Confident	70.8	Confident	49 Å²	49	64.5 Å²	64.5	23%	0.229	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-44.6	175.5	-64.9	-176.3	-151.6	0	0	112.6	N438 F442 I443 F444 N1045 I1046 F1047	N438-E440 HydrophobicContact CB-CB 4.49Å; N438-E440 PolarHBondContact O-N 3.44Å; N438-E440 VanDerWaalsContact O-N 3.12Å; E440-F442 VanDerWaalsContact C-N 3.32Å; E440-F442 PolarHBondContact O-N 2.75Å; E440-I443 PolarHBondContact O-N 3.26Å; E440-F444 WeakPolarHBondContact O-CB 3.47Å; E440-F444 PolarHBondContact O-N 3.18Å; E440-N1045 PolarHBondContact OE1-OD1 3.37Å; E440-I1046 HydrophobicContact CB-CD1 4.29Å; E440-I1046 PolarHBondContact OE2-N 2.85Å; E440-F1047 WeakPolarHBondContact O-CE2 3.39Å
441	T	73.4	Confident	72.1	Confident	10 Å²	10	67.6 Å²	67.6	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-40.2	178.5	-50.1	0	0	0	0	111.2	N438 L439 F444 I445 L490 F985	N438-T441 WeakPolarHBondContact O-CB 3.48Å; N438-T441 PolarHBondContact O-N 2.85Å; L439-T441 PolarHBondContact O-N 3.03Å; T441-F444 WeakPolarHBondContact O-CB 3.35Å; T441-F444 PolarHBondContact O-N 3.33Å; T441-I445 HydrophobicContact CG2-CD1 4.14Å; T441-I445 WeakPolarHBondContact O-CG1 3.32Å; T441-I445 PolarHBondContact O-N 2.83Å; T441-L490 HydrophobicContact CG2-CD2 4.08Å; T441-F985 HydrophobicContact CG2-CE1 4.4Å
442	F	77.6	Confident	73.3	Confident	134 Å²	134	66 Å²	66	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-66.6	-44	177.9	-173	-93.8	0	0	0	112.3	N438 L439 E440 F444 I445 L446	N438-F442 PolarHBondContact O-N 2.94Å; L439-F442 PolarHBondContact O-N 2.87Å; E440-F442 VanDerWaalsContact C-N 3.32Å; E440-F442 PolarHBondContact O-N 2.75Å; F442-F444 PolarHBondContact O-N 3.49Å; F442-I445 PolarHBondContact O-N 2.97Å; F442-L446 WeakPolarHBondContact O-CB 3.49Å; F442-L446 PolarHBondContact O-N 2.78Å
443	I	81.5	Confident	74.8	Confident	73 Å²	73	63.3 Å²	63.3	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-62.6	-36.5	175.3	-61.4	168.3	0	0	0	109.9	L439 E440 L446 F447 F1047	L439-I443 HydrophobicContact CD1-CD1 4.27Å; L439-I443 HydrophobicContact CD1-CG1 4.41Å; L439-I443 HydrophobicContact CD2-CD1 4.41Å; L439-I443 HydrophobicContact CG-CD1 3.86Å; L439-I443 HydrophobicContact CG-CG1 4.4Å; L439-I443 VanDerWaalsContact O-CG1 3.29Å; L439-I443 WeakPolarHBondContact O-CG1 3.48Å; L439-I443 PolarHBondContact O-N 3.26Å; E440-I443 PolarHBondContact O-N 3.26Å; I443-L446 PolarHBondContact O-N 3.27Å; I443-F447 WeakPolarHBondContact O-CB 3.3Å; I443-F447 PolarHBondContact O-N 2.93Å; I443-F1047 VanDerWaalsContact C-CZ 3.47Å; I443-F1047 HydrophobicContact CB-CE2 3.66Å; I443-F1047 HydrophobicContact CB-CZ 3.84Å; I443-F1047 HydrophobicContact CG2-CD2 4.31Å; I443-F1047 HydrophobicContact CG2-CE1 4Å; I443-F1047 HydrophobicContact CG2-CE2 3.55Å; I443-F1047 HydrophobicContact CG2-CZ 3.36Å
444	F	80.8	Confident	76.2	Confident	12 Å²	12	59.9 Å²	59.9	5%	0.053	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-46.1	177.7	175.1	-101.9	0	0	0	112.3	E440 T441 F442 L446 F447 L448 F985 L988 A989 I1046 F1047	E440-F444 WeakPolarHBondContact O-CB 3.47Å; E440-F444 PolarHBondContact O-N 3.18Å; T441-F444 WeakPolarHBondContact O-CB 3.35Å; T441-F444 PolarHBondContact O-N 3.33Å; F442-F444 PolarHBondContact O-N 3.49Å; F444-L446 VanDerWaalsContact C-N 3.34Å; F444-L446 PolarHBondContact O-N 3.25Å; F444-F447 WeakPolarHBondContact O-CB 3.42Å; F444-F447 PolarHBondContact O-N 3.07Å; F444-L448 HydrophobicContact CD1-CD1 4.3Å; F444-L448 HydrophobicContact CE1-CD1 3.65Å; F444-L448 HydrophobicContact CE1-CG 4.48Å; F444-L448 HydrophobicContact CE2-CD1 4.41Å; F444-L448 HydrophobicContact CZ-CD1 3.72Å; F444-L448 HydrophobicContact CZ-CG 4.32Å; F444-L448 PolarHBondContact O-N 3.27Å; F444-L448 VanDerWaalsContact O-N 3.12Å; F444-F985 HydrophobicContact CD1-CD1 4.03Å; F444-F985 HydrophobicContact CD1-CE1 4.34Å; F444-F985 AromaticContact CE1-CD1 3.9Å; F444-F985 HydrophobicContact CE1-CD1 3.9Å; F444-F985 HydrophobicContact CZ-CD1 4.32Å; F444-F985 WeakPolarHBondContact CZ-O 3.39Å; F444-L988 HydrophobicContact CE1-CD2 4.06Å; F444-A989 HydrophobicContact CE2-CB 3.81Å; F444-A989 HydrophobicContact CZ-CB 3.71Å; F444-I1046 HydrophobicContact CD2-CG2 4.22Å; F444-F1047 VanDerWaalsContact CA-CZ 3.46Å; F444-F1047 HydrophobicContact CB-CE2 4.08Å; F444-F1047 HydrophobicContact CB-CZ 3.94Å; F444-F1047 VanDerWaalsContact N-CZ 3.33Å
445	I	80.8	Confident	77.6	Confident	23 Å²	23	58.6 Å²	58.6	12%	0.118	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-44.2	174.2	-68	162	0	0	0	110.8	F243 T441 F442 F447 L448 L449 V486	F243-I445 HydrophobicContact CD2-CD1 3.99Å; F243-I445 HydrophobicContact CE2-CD1 3.66Å; T441-I445 HydrophobicContact CG2-CD1 4.14Å; T441-I445 WeakPolarHBondContact O-CG1 3.32Å; T441-I445 PolarHBondContact O-N 2.83Å; F442-I445 PolarHBondContact O-N 2.97Å; I445-F447 VanDerWaalsContact C-N 3.29Å; I445-F447 PolarHBondContact O-N 3.21Å; I445-L448 PolarHBondContact O-N 3.13Å; I445-L449 WeakPolarHBondContact O-CB 3.19Å; I445-L449 PolarHBondContact O-N 3.15Å; I445-V486 HydrophobicContact CD1-CG1 4.48Å; I445-V486 HydrophobicContact CG1-CG1 4.5Å; I445-V486 HydrophobicContact CG2-CG2 3.67Å
446	L	83.9	Confident	79.1	Confident	92 Å²	92	55.5 Å²	55.5	48%	0.482	30%	0.3	S	S	.	.	H	α-helix	trans	-60.4	-40	177.9	-175	67.9	0	0	0	111.8	F442 I443 F444 L449 V450	F442-L446 WeakPolarHBondContact O-CB 3.49Å; F442-L446 PolarHBondContact O-N 2.78Å; I443-L446 PolarHBondContact O-N 3.27Å; F444-L446 VanDerWaalsContact C-N 3.34Å; F444-L446 PolarHBondContact O-N 3.25Å; L446-L449 PolarHBondContact O-N 2.81Å; L446-V450 PolarHBondContact O-N 3.02Å
447	F	84.4	Confident	80.9	Confident	56 Å²	56	56.2 Å²	56.2	25%	0.246	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-46.2	175.5	169.7	-99.9	0	0	0	112	I443 F444 I445 L449 V450 F451 F1047 M1056	I443-F447 WeakPolarHBondContact O-CB 3.3Å; I443-F447 PolarHBondContact O-N 2.93Å; F444-F447 WeakPolarHBondContact O-CB 3.42Å; F444-F447 PolarHBondContact O-N 3.07Å; I445-F447 VanDerWaalsContact C-N 3.29Å; I445-F447 PolarHBondContact O-N 3.21Å; F447-L449 VanDerWaalsContact C-N 3.34Å; F447-V450 PolarHBondContact O-N 3.14Å; F447-F451 HydrophobicContact CD2-CE2 4.36Å; F447-F451 AromaticContact CE1-CE2 3.93Å; F447-F451 HydrophobicContact CE1-CE2 3.93Å; F447-F451 AromaticContact CE2-CE2 3.76Å; F447-F451 HydrophobicContact CE2-CE2 3.76Å; F447-F451 HydrophobicContact CE2-CZ 4.38Å; F447-F451 AromaticContact CZ-CE2 3.53Å; F447-F451 HydrophobicContact CZ-CE2 3.53Å; F447-F451 HydrophobicContact CZ-CZ 4.15Å; F447-F451 WeakPolarHBondContact O-CD2 3.5Å; F447-F1047 HydrophobicContact CB-CE1 4.49Å; F447-M1056 HydrophobicContact CE1-CE 4.19Å; F447-M1056 HydrophobicContact CZ-CE 3.83Å; F447-M1056 HydrophobicContact CZ-SD 4.4Å
448	L	83.8	Confident	82.5	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-37	177.4	-64.7	178.7	0	0	0	112.2	F444 I445 V450 F451 A452 V485 A989 A992 L993	F444-L448 HydrophobicContact CD1-CD1 4.3Å; F444-L448 HydrophobicContact CE1-CD1 3.65Å; F444-L448 HydrophobicContact CE1-CG 4.48Å; F444-L448 HydrophobicContact CE2-CD1 4.41Å; F444-L448 HydrophobicContact CZ-CD1 3.72Å; F444-L448 HydrophobicContact CZ-CG 4.32Å; F444-L448 PolarHBondContact O-N 3.27Å; F444-L448 VanDerWaalsContact O-N 3.12Å; I445-L448 PolarHBondContact O-N 3.13Å; L448-V450 PolarHBondContact O-N 3.19Å; L448-F451 PolarHBondContact O-N 3.16Å; L448-F451 VanDerWaalsContact O-N 3.1Å; L448-A452 PolarHBondContact O-N 3.46Å; L448-A452 VanDerWaalsContact O-N 3.12Å; L448-V485 HydrophobicContact CB-CG1 3.43Å; L448-V485 VanDerWaalsContact CB-CG1 3.43Å; L448-V485 HydrophobicContact CD1-CG1 4.4Å; L448-V485 HydrophobicContact CG-CG1 4.48Å; L448-A989 HydrophobicContact CD2-CB 4.19Å; L448-A992 HydrophobicContact CD1-CB 4.35Å; L448-L993 HydrophobicContact CD2-CG 4.45Å
449	L	85.4	Confident	83.6	Confident	51 Å²	51	53.9 Å²	53.9	27%	0.267	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-30.6	178.8	-168.8	69.5	0	0	0	112.6	I445 L446 F447 F451 A452 I453 L482	I445-L449 WeakPolarHBondContact O-CB 3.19Å; I445-L449 PolarHBondContact O-N 3.15Å; L446-L449 PolarHBondContact O-N 2.81Å; F447-L449 VanDerWaalsContact C-N 3.34Å; L449-F451 VanDerWaalsContact C-N 3.33Å; L449-F451 PolarHBondContact O-N 2.87Å; L449-A452 HydrophobicContact CD1-CB 4.4Å; L449-A452 WeakPolarHBondContact O-CB 3.35Å; L449-A452 PolarHBondContact O-N 3.06Å; L449-I453 HydrophobicContact CD2-CD1 4.35Å; L449-I453 HydrophobicContact CG-CD1 3.98Å; L449-I453 HydrophobicContact CG-CG1 4.3Å; L449-I453 WeakPolarHBondContact O-CB 3.46Å; L449-I453 VanDerWaalsContact O-CG1 3.26Å; L449-I453 WeakPolarHBondContact O-CG1 3Å; L449-I453 PolarHBondContact O-N 3.49Å; L449-L482 HydrophobicContact CD1-CD2 4.1Å
450	V	88.3	Confident	84.3	Confident	93 Å²	93	52.9 Å²	52.9	56%	0.564	27%	0.273	S	S	*	.	H	α-helix	trans	-59.8	-43.8	175.2	174	0	0	0	0	111.3	L446 F447 L448 A454	L446-V450 PolarHBondContact O-N 3.02Å; F447-V450 PolarHBondContact O-N 3.14Å; L448-V450 PolarHBondContact O-N 3.19Å; V450-A454 PolarHBondContact O-N 3.07Å; V450-A454 VanDerWaalsContact O-N 3.16Å
451	F	84.9	Confident	85	Confident	69 Å²	69	54.5 Å²	54.5	30%	0.303	29%	0.287	S	S	.	.	H	α-helix	trans	-69.9	-38.6	176.5	-66	-83.7	0	0	0	111.6	F447 L448 L449 I453 A454 A455 L993 M1056	F447-F451 HydrophobicContact CD2-CE2 4.36Å; F447-F451 AromaticContact CE1-CE2 3.93Å; F447-F451 HydrophobicContact CE1-CE2 3.93Å; F447-F451 AromaticContact CE2-CE2 3.76Å; F447-F451 HydrophobicContact CE2-CE2 3.76Å; F447-F451 HydrophobicContact CE2-CZ 4.38Å; F447-F451 AromaticContact CZ-CE2 3.53Å; F447-F451 HydrophobicContact CZ-CE2 3.53Å; F447-F451 HydrophobicContact CZ-CZ 4.15Å; F447-F451 WeakPolarHBondContact O-CD2 3.5Å; L448-F451 PolarHBondContact O-N 3.16Å; L448-F451 VanDerWaalsContact O-N 3.1Å; L449-F451 VanDerWaalsContact C-N 3.33Å; L449-F451 PolarHBondContact O-N 2.87Å; F451-I453 PolarHBondContact O-N 2.96Å; F451-A454 PolarHBondContact O-N 3.21Å; F451-A455 WeakPolarHBondContact O-CB 3.42Å; F451-A455 PolarHBondContact O-N 3.46Å; F451-L993 HydrophobicContact CB-CD2 3.75Å; F451-L993 HydrophobicContact CD1-CD2 4.14Å; F451-L993 HydrophobicContact CD2-CD2 3.86Å; F451-L993 HydrophobicContact CG-CD2 3.64Å; F451-M1056 HydrophobicContact CE1-SD 4.45Å; F451-M1056 HydrophobicContact CE2-CE 4.26Å; F451-M1056 HydrophobicContact CZ-CE 3.99Å; F451-M1056 HydrophobicContact CZ-SD 3.82Å
452	A	87.1	Confident	85.5	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-44.8	175.8	0	0	0	0	0	111.9	L448 L449 A455 A456 L482 V485	L448-A452 PolarHBondContact O-N 3.46Å; L448-A452 VanDerWaalsContact O-N 3.12Å; L449-A452 HydrophobicContact CD1-CB 4.4Å; L449-A452 WeakPolarHBondContact O-CB 3.35Å; L449-A452 PolarHBondContact O-N 3.06Å; A452-A455 PolarHBondContact O-N 3.44Å; A452-A456 VanDerWaalsContact O-CB 3.31Å; A452-A456 WeakPolarHBondContact O-CB 3.39Å; A452-A456 PolarHBondContact O-N 3.14Å; A452-L482 HydrophobicContact CB-CD2 3.85Å; A452-V485 HydrophobicContact CB-CB 4.05Å; A452-V485 HydrophobicContact CB-CG1 4.21Å; A452-V485 HydrophobicContact CB-CG2 3.66Å
453	I	89.8	Confident	85.7	Confident	93 Å²	93	50.7 Å²	50.7	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-41.2	177.3	-69	165.8	0	0	0	110.6	L449 F451 A456 A457 L482	L449-I453 HydrophobicContact CD2-CD1 4.35Å; L449-I453 HydrophobicContact CG-CD1 3.98Å; L449-I453 HydrophobicContact CG-CG1 4.3Å; L449-I453 WeakPolarHBondContact O-CB 3.46Å; L449-I453 VanDerWaalsContact O-CG1 3.26Å; L449-I453 WeakPolarHBondContact O-CG1 3Å; L449-I453 PolarHBondContact O-N 3.49Å; F451-I453 PolarHBondContact O-N 2.96Å; I453-A456 PolarHBondContact O-N 2.93Å; I453-A457 VanDerWaalsContact O-CB 3.22Å; I453-A457 WeakPolarHBondContact O-CB 3.44Å; I453-A457 PolarHBondContact O-N 2.86Å; I453-L482 HydrophobicContact CB-CD2 4.41Å; I453-L482 HydrophobicContact CG1-CD2 3.66Å
454	A	89.1	Confident	85.8	Confident	62 Å²	62	50.6 Å²	50.6	51%	0.512	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-43.9	176.3	0	0	0	0	0	111.9	V450 F451 A457 Y458	V450-A454 PolarHBondContact O-N 3.07Å; V450-A454 VanDerWaalsContact O-N 3.16Å; F451-A454 PolarHBondContact O-N 3.21Å; A454-A457 PolarHBondContact O-N 2.85Å; A454-Y458 PolarHBondContact O-N 2.94Å
455	A	86.9	Confident	86	Confident	16 Å²	16	55.5 Å²	55.5	13%	0.132	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-45	176.4	0	0	0	0	0	112.1	F451 A452 A457 Y458 V459 I481	F451-A455 WeakPolarHBondContact O-CB 3.42Å; F451-A455 PolarHBondContact O-N 3.46Å; A452-A455 PolarHBondContact O-N 3.44Å; A455-A457 PolarHBondContact O-N 3.01Å; A455-Y458 WeakPolarHBondContact O-CB 3.46Å; A455-Y458 PolarHBondContact O-N 3.12Å; A455-V459 WeakPolarHBondContact O-CG2 3.38Å; A455-V459 PolarHBondContact O-N 2.8Å; A455-I481 HydrophobicContact CB-CG2 4.04Å
456	A	88.3	Confident	85.8	Confident	10 Å²	10	55 Å²	55	8%	0.083	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-40	175.7	0	0	0	0	0	112.1	A452 I453 V459 W460 C478 L482	A452-A456 VanDerWaalsContact O-CB 3.31Å; A452-A456 WeakPolarHBondContact O-CB 3.39Å; A452-A456 PolarHBondContact O-N 3.14Å; I453-A456 PolarHBondContact O-N 2.93Å; A456-V459 PolarHBondContact O-N 3.01Å; A456-W460 WeakPolarHBondContact O-CB 3.26Å; A456-W460 PolarHBondContact O-N 2.86Å; A456-C478 HydrophobicContact CB-CB 4.17Å; A456-C478 PolarHBondContact O-SG 3.29Å; A456-L482 HydrophobicContact CB-CD2 4.35Å; A456-L482 HydrophobicContact CB-CG 4.26Å
457	A	88.7	Confident	85.2	Confident	50 Å²	50	56.4 Å²	56.4	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-40.2	175.2	0	0	0	0	0	111.9	I453 A454 A455 W460 V461	I453-A457 VanDerWaalsContact O-CB 3.22Å; I453-A457 WeakPolarHBondContact O-CB 3.44Å; I453-A457 PolarHBondContact O-N 2.86Å; A454-A457 PolarHBondContact O-N 2.85Å; A455-A457 PolarHBondContact O-N 3.01Å; A457-W460 PolarHBondContact O-N 2.9Å; A457-V461 WeakPolarHBondContact O-CG2 3.48Å; A457-V461 PolarHBondContact O-N 3.46Å
458	Y	88.9	Confident	84.5	Confident	102 Å²	102	58.4 Å²	58.4	40%	0.4	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-48.4	172.8	176	-92.4	0	0	0	111.2	A454 A455 W460 V461 E462 V1001 L1004	A454-Y458 PolarHBondContact O-N 2.94Å; A455-Y458 WeakPolarHBondContact O-CB 3.46Å; A455-Y458 PolarHBondContact O-N 3.12Å; Y458-W460 VanDerWaalsContact C-N 3.3Å; Y458-W460 PolarHBondContact O-N 3.27Å; Y458-V461 PolarHBondContact O-N 2.88Å; Y458-E462 HydrophobicContact CE1-CB 4.5Å; Y458-E462 WeakPolarHBondContact O-CB 3.48Å; Y458-E462 PolarHBondContact O-N 2.91Å; Y458-V1001 HydrophobicContact CD1-CG2 4.07Å; Y458-V1001 HydrophobicContact CE1-CB 4.42Å; Y458-V1001 HydrophobicContact CE1-CG2 3.7Å; Y458-L1004 HydrophobicContact CD1-CD1 4.2Å; Y458-L1004 HydrophobicContact CE1-CD1 3.82Å
459	V	87.3	Confident	84	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.8	-41.6	178.2	172	0	0	0	0	111.9	A455 A456 G463 L474 I481 S1000 L1004	A455-V459 WeakPolarHBondContact O-CG2 3.38Å; A455-V459 PolarHBondContact O-N 2.8Å; A456-V459 PolarHBondContact O-N 3.01Å; V459-G463 WeakPolarHBondContact O-CA 3.38Å; V459-G463 PolarHBondContact O-N 3.01Å; V459-L474 HydrophobicContact CG1-CD1 3.79Å; V459-I481 HydrophobicContact CB-CD1 4.27Å; V459-I481 HydrophobicContact CG2-CD1 3.7Å; V459-S1000 VanDerWaalsContact CG2-CA 3.44Å; V459-L1004 HydrophobicContact CB-CD1 4.46Å; V459-L1004 HydrophobicContact CG1-CD2 4.34Å; V459-L1004 HydrophobicContact CG2-CD1 4.11Å; V459-L1004 HydrophobicContact CG2-CG 4.44Å
460	W	86.8	Confident	83.7	Confident	111 Å²	111	61.2 Å²	61.2	42%	0.42	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-47.5	176.5	-176.4	-97.2	0	0	0	112.5	A456 A457 Y458 T464 L474 F475	A456-W460 WeakPolarHBondContact O-CB 3.26Å; A456-W460 PolarHBondContact O-N 2.86Å; A457-W460 PolarHBondContact O-N 2.9Å; Y458-W460 VanDerWaalsContact C-N 3.3Å; Y458-W460 PolarHBondContact O-N 3.27Å; W460-T464 HydrophobicContact CD2-CG2 4.43Å; W460-T464 HydrophobicContact CZ2-CG2 4.38Å; W460-T464 WeakPolarHBondContact O-CB 3.3Å; W460-T464 VanDerWaalsContact O-CG2 3.27Å; W460-T464 WeakPolarHBondContact O-CG2 3.4Å; W460-T464 PolarHBondContact O-N 3.26Å; W460-T464 PolarHBondContact O-OG1 3.25Å; W460-L474 HydrophobicContact CD2-CD2 4.45Å; W460-L474 HydrophobicContact CE3-CD2 3.92Å; W460-L474 HydrophobicContact CE3-CG 4.06Å; W460-L474 HydrophobicContact CZ3-CD2 4.25Å; W460-L474 HydrophobicContact CZ3-CG 4.38Å; W460-F475 HydrophobicContact CZ3-CB 4.22Å
461	V	87.6	Confident	83.3	Confident	84 Å²	84	65.8 Å²	65.8	51%	0.509	35%	0.348	S	S	.	.	H	α-helix	trans	-66.4	-46.2	-178.9	171	0	0	0	0	111.3	A457 Y458 T464	A457-V461 WeakPolarHBondContact O-CG2 3.48Å; A457-V461 PolarHBondContact O-N 3.46Å; Y458-V461 PolarHBondContact O-N 2.88Å; V461-T464 PolarHBondContact O-OG1 2.99Å; V461-T464 VanDerWaalsContact O-OG1 3.04Å
462	E	84.3	Confident	82.9	Confident	63 Å²	63	67.5 Å²	67.5	29%	0.294	35%	0.353	S	S	.	.	H	α-helix	trans	-72.5	-40.1	-179.5	-156.4	62.9	-145.9	0	0	111.4	Y458 T464 K465 L1004	Y458-E462 HydrophobicContact CE1-CB 4.5Å; Y458-E462 WeakPolarHBondContact O-CB 3.48Å; Y458-E462 PolarHBondContact O-N 2.91Å; E462-T464 VanDerWaalsContact C-N 3.29Å; E462-T464 PolarHBondContact O-N 2.9Å; E462-K465 WeakPolarHBondContact O-CB 3.39Å; E462-K465 PolarHBondContact O-N 2.85Å; E462-K465 VanDerWaalsContact OE1-CD 3.31Å; E462-K465 WeakPolarHBondContact OE1-CD 3.31Å; E462-K465 IonicContact OE1-NZ 3.44Å; E462-K465 PolarHBondContact OE1-NZ 3.35Å; E462-K465 WeakPolarHBondContact OE2-CE 3.29Å; E462-K465 IonicContact OE2-NZ 2.61Å; E462-K465 PolarHBondContact OE2-NZ 3.16Å; E462-L1004 HydrophobicContact CB-CD1 3.79Å; E462-L1004 HydrophobicContact CG-CD1 4.18Å
463	G	81.4	Confident	82.4	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-67.9	-24.4	179.2	0	0	0	0	0	114.3	V459	V459-G463 WeakPolarHBondContact O-CA 3.38Å; V459-G463 PolarHBondContact O-N 3.01Å
464	T	83.3	Confident	82	Confident	70 Å²	70	66.3 Å²	66.3	43%	0.429	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-12.9	174.6	47	0	0	0	0	113.8	W460 V461 E462 D466 L474	W460-T464 HydrophobicContact CD2-CG2 4.43Å; W460-T464 HydrophobicContact CZ2-CG2 4.38Å; W460-T464 WeakPolarHBondContact O-CB 3.3Å; W460-T464 VanDerWaalsContact O-CG2 3.27Å; W460-T464 WeakPolarHBondContact O-CG2 3.4Å; W460-T464 PolarHBondContact O-N 3.26Å; W460-T464 PolarHBondContact O-OG1 3.25Å; V461-T464 PolarHBondContact O-OG1 2.99Å; V461-T464 VanDerWaalsContact O-OG1 3.04Å; E462-T464 VanDerWaalsContact C-N 3.29Å; E462-T464 PolarHBondContact O-N 2.9Å; T464-D466 PolarHBondContact O-N 2.53Å; T464-L474 HydrophobicContact CG2-CD2 3.89Å
465	K	84.5	Confident	81.7	Confident	116 Å²	116	67.6 Å²	67.6	50%	0.504	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.4	172.4	-67.6	175.2	-176.5	172.7	0	112.8	E462 P467	E462-K465 WeakPolarHBondContact O-CB 3.39Å; E462-K465 PolarHBondContact O-N 2.85Å; E462-K465 VanDerWaalsContact OE1-CD 3.31Å; E462-K465 WeakPolarHBondContact OE1-CD 3.31Å; E462-K465 IonicContact OE1-NZ 3.44Å; E462-K465 PolarHBondContact OE1-NZ 3.35Å; E462-K465 WeakPolarHBondContact OE2-CE 3.29Å; E462-K465 IonicContact OE2-NZ 2.61Å; E462-K465 PolarHBondContact OE2-NZ 3.16Å; K465-P467 VanDerWaalsContact O-CD 3.26Å; K465-P467 WeakPolarHBondContact O-CD 3.31Å
466	D	77.2	Confident	81.3	Confident	12 Å²	12	67.6 Å²	67.6	6%	0.064	34%	0.336	C	S	.	.			trans	-90.5	107.1	175.8	-175.7	-8.1	0	0	0	110.1	T464 S468 R469 F1084	T464-D466 PolarHBondContact O-N 2.53Å; D466-S468 PolarHBondContact O-N 3.2Å; D466-S468 WeakPolarHBondContact OD1-CB 3.46Å; D466-S468 PolarHBondContact OD1-N 2.96Å; D466-S468 PolarHBondContact OD1-OG 3.27Å; D466-S468 PolarHBondContact OD2-OG 3.03Å; D466-R469 HydrophobicContact CB-CG 3.85Å; D466-R469 PolarHBondContact O-N 3Å; D466-R469 WeakPolarHBondContact OD2-CG 3.34Å; D466-R469 IonicContact OD2-CZ 3.82Å; D466-R469 IonicContact OD2-NE 3.67Å; D466-R469 PolarHBondContact OD2-NE 2.86Å; D466-R469 IonicContact OD2-NH2 2.64Å; D466-F1084 HydrophobicContact CB-CD1 3.68Å; D466-F1084 HydrophobicContact CB-CD2 4.41Å; D466-F1084 HydrophobicContact CB-CE1 3.9Å; D466-F1084 HydrophobicContact CB-CG 3.95Å; D466-F1084 HydrophobicContact CB-CZ 4.36Å; D466-F1084 VanDerWaalsContact OD2-CB 3.27Å; D466-F1084 WeakPolarHBondContact OD2-CB 3.49Å
467	P	70.6	Confident	80.8	Confident	122 Å²	122	68.6 Å²	68.6	79%	0.792	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.5	-176.9	28.3	-33.4	0	0	0	113.9	K465 R469	K465-P467 VanDerWaalsContact O-CD 3.26Å; K465-P467 WeakPolarHBondContact O-CD 3.31Å; P467-R469 VanDerWaalsContact C-N 3.31Å
468	S	70.8	Confident	80.6	Confident	98 Å²	98	66.8 Å²	66.8	69%	0.685	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.3	178.2	72	0	0	0	0	113.6	D466	D466-S468 PolarHBondContact O-N 3.2Å; D466-S468 WeakPolarHBondContact OD1-CB 3.46Å; D466-S468 PolarHBondContact OD1-N 2.96Å; D466-S468 PolarHBondContact OD1-OG 3.27Å; D466-S468 PolarHBondContact OD2-OG 3.03Å
469	R	72.4	Confident	80.2	Confident	35 Å²	35	62.8 Å²	62.8	13%	0.132	31%	0.31	C	S	.	.	S	Bend	trans	-83.4	139.8	-172.5	-67.3	-176.5	-175.5	-169.9	-9	113.5	D466 P467 R471	D466-R469 HydrophobicContact CB-CG 3.85Å; D466-R469 PolarHBondContact O-N 3Å; D466-R469 WeakPolarHBondContact OD2-CG 3.34Å; D466-R469 IonicContact OD2-CZ 3.82Å; D466-R469 IonicContact OD2-NE 3.67Å; D466-R469 PolarHBondContact OD2-NE 2.86Å; D466-R469 IonicContact OD2-NH2 2.64Å; P467-R469 VanDerWaalsContact C-N 3.31Å; R469-R471 PolarHBondContact O-N 2.9Å
470	N	79.3	Confident	79.9	Confident	79 Å²	79	64.7 Å²	64.7	42%	0.422	32%	0.32	S	S	.	.			trans	-70.5	117.5	169.8	-171	-11.9	0	0	0	110.8	Y472 K473 L474	N470-Y472 PolarHBondContact O-N 2.76Å; N470-Y472 WeakPolarHBondContact OD1-CB 3.34Å; N470-Y472 PolarHBondContact OD1-N 2.8Å; N470-K473 HydrophobicContact CB-CB 4.43Å; N470-K473 HydrophobicContact CB-CG 4.4Å; N470-K473 PolarHBondContact O-N 2.82Å; N470-L474 PolarHBondContact O-N 2.88Å; N470-L474 VanDerWaalsContact O-N 3.15Å
471	R	79.6	Confident	79.7	Confident	189 Å²	189	59.4 Å²	59.4	71%	0.713	30%	0.3	S	S	*	.	H	α-helix	trans	-61.6	-29.9	178.7	-60.7	-177.9	-170.2	-179.1	2.8	112.9	R469 F475	R469-R471 PolarHBondContact O-N 2.9Å; R471-F475 WeakPolarHBondContact O-CB 3.47Å; R471-F475 PolarHBondContact O-N 3.37Å
472	Y	77.7	Confident	79.5	Confident	104 Å²	104	58 Å²	58	41%	0.408	29%	0.289	S	S	.	.	H	α-helix	trans	-65.9	-46.8	177.2	177	-104.8	0	0	0	111.6	N470 L474 F475 L476	N470-Y472 PolarHBondContact O-N 2.76Å; N470-Y472 WeakPolarHBondContact OD1-CB 3.34Å; N470-Y472 PolarHBondContact OD1-N 2.8Å; Y472-L474 PolarHBondContact O-N 2.96Å; Y472-F475 WeakPolarHBondContact O-CB 3.49Å; Y472-F475 PolarHBondContact O-N 2.96Å; Y472-L476 HydrophobicContact CD1-CD1 4Å; Y472-L476 HydrophobicContact CE1-CD1 3.45Å; Y472-L476 VanDerWaalsContact CE1-CD1 3.45Å; Y472-L476 HydrophobicContact CE1-CG 4.15Å; Y472-L476 PolarHBondContact O-N 3.49Å
473	K	76	Confident	79.4	Confident	56 Å²	56	55.2 Å²	55.2	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-40	177.4	-68.5	-167.2	171.4	-164.5	0	111.1	E258 N470 F475 L476 E477 Y1088	E258-K473 WeakPolarHBondContact OE1-CE 3.47Å; E258-K473 IonicContact OE1-NZ 3.72Å; E258-K473 PolarHBondContact OE1-NZ 3.25Å; N470-K473 HydrophobicContact CB-CB 4.43Å; N470-K473 HydrophobicContact CB-CG 4.4Å; N470-K473 PolarHBondContact O-N 2.82Å; K473-F475 VanDerWaalsContact C-N 3.29Å; K473-F475 PolarHBondContact O-N 3.32Å; K473-L476 WeakPolarHBondContact O-CB 3.5Å; K473-L476 PolarHBondContact O-N 3.21Å; K473-L476 VanDerWaalsContact O-N 3.12Å; K473-E477 WeakPolarHBondContact O-CG 3.33Å; K473-E477 PolarHBondContact O-N 3.41Å; K473-Y1088 HydrophobicContact CB-CE1 3.98Å; K473-Y1088 HydrophobicContact CD-CD1 3.74Å; K473-Y1088 HydrophobicContact CD-CE1 3.1Å; K473-Y1088 HydrophobicContact CG-CE1 4.14Å
474	L	81.1	Confident	79.2	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-38.7	173.4	-171.5	66.4	0	0	0	112.8	V459 W460 T464 N470 Y472 E477 C478	V459-L474 HydrophobicContact CG1-CD1 3.79Å; W460-L474 HydrophobicContact CD2-CD2 4.45Å; W460-L474 HydrophobicContact CE3-CD2 3.92Å; W460-L474 HydrophobicContact CE3-CG 4.06Å; W460-L474 HydrophobicContact CZ3-CD2 4.25Å; W460-L474 HydrophobicContact CZ3-CG 4.38Å; T464-L474 HydrophobicContact CG2-CD2 3.89Å; N470-L474 PolarHBondContact O-N 2.88Å; N470-L474 VanDerWaalsContact O-N 3.15Å; Y472-L474 PolarHBondContact O-N 2.96Å; L474-E477 PolarHBondContact O-N 2.91Å; L474-C478 PolarHBondContact O-N 3.3Å; L474-C478 PolarHBondContact O-SG 3.44Å
475	F	82.4	Confident	79	Confident	89 Å²	89	52.8 Å²	52.8	39%	0.39	26%	0.262	S	S	.	.	H	α-helix	trans	-65.1	-41.4	173.9	169.4	-96.4	0	0	0	112.5	W460 R471 Y472 K473 E477 C478 T479	W460-F475 HydrophobicContact CZ3-CB 4.22Å; R471-F475 WeakPolarHBondContact O-CB 3.47Å; R471-F475 PolarHBondContact O-N 3.37Å; Y472-F475 WeakPolarHBondContact O-CB 3.49Å; Y472-F475 PolarHBondContact O-N 2.96Å; K473-F475 VanDerWaalsContact C-N 3.29Å; K473-F475 PolarHBondContact O-N 3.32Å; F475-E477 VanDerWaalsContact C-N 3.34Å; F475-C478 PolarHBondContact O-N 3.01Å; F475-T479 WeakPolarHBondContact O-CB 3.26Å; F475-T479 PolarHBondContact O-N 3.33Å; F475-T479 PolarHBondContact O-OG1 2.87Å
476	L	78.9	Confident	78.6	Confident	16 Å²	16	47.8 Å²	47.8	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-43.1	174.8	-70.1	176.9	0	0	0	111.4	L256 Y472 K473 T479 L480	L256-L476 HydrophobicContact CB-CD2 3.6Å; L256-L476 HydrophobicContact CD1-CD2 4.4Å; L256-L476 WeakPolarHBondContact O-CD1 3.34Å; Y472-L476 HydrophobicContact CD1-CD1 4Å; Y472-L476 HydrophobicContact CE1-CD1 3.45Å; Y472-L476 VanDerWaalsContact CE1-CD1 3.45Å; Y472-L476 HydrophobicContact CE1-CG 4.15Å; Y472-L476 PolarHBondContact O-N 3.49Å; K473-L476 WeakPolarHBondContact O-CB 3.5Å; K473-L476 PolarHBondContact O-N 3.21Å; K473-L476 VanDerWaalsContact O-N 3.12Å; L476-T479 CarbonylContact O-C 3.51Å; L476-T479 WeakPolarHBondContact O-CA 3.33Å; L476-T479 VanDerWaalsContact O-CB 3.31Å; L476-T479 WeakPolarHBondContact O-CB 3.36Å; L476-T479 PolarHBondContact O-N 3.06Å; L476-T479 VanDerWaalsContact O-N 3.09Å; L476-L480 WeakPolarHBondContact O-CB 3.45Å; L476-L480 PolarHBondContact O-N 2.9Å
477	E	78	Confident	78.3	Confident	31 Å²	31	48.1 Å²	48.1	15%	0.145	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-44.4	177.4	-65.2	-62.8	173	0	0	112.5	K473 L474 F475 T479 L480 I481 Y1003	K473-E477 WeakPolarHBondContact O-CG 3.33Å; K473-E477 PolarHBondContact O-N 3.41Å; L474-E477 PolarHBondContact O-N 2.91Å; F475-E477 VanDerWaalsContact C-N 3.34Å; E477-T479 PolarHBondContact O-N 3.3Å; E477-L480 PolarHBondContact O-N 3.04Å; E477-L480 VanDerWaalsContact O-N 3.13Å; E477-I481 WeakPolarHBondContact O-CG1 3.39Å; E477-I481 PolarHBondContact O-N 3.32Å; E477-Y1003 HydrophobicContact CB-CE1 4.47Å; E477-Y1003 VanDerWaalsContact CD-CZ 3.44Å; E477-Y1003 VanDerWaalsContact CD-OH 3.25Å; E477-Y1003 HydrophobicContact CG-CE1 3.75Å; E477-Y1003 PolarHBondContact OE1-OH 3.49Å
478	C	84.7	Confident	78.3	Confident	13 Å²	13	43.3 Å²	43.3	9%	0.088	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-37.4	172.9	-66.9	0	0	0	0	111.3	A456 L474 F475 L482	A456-C478 HydrophobicContact CB-CB 4.17Å; A456-C478 PolarHBondContact O-SG 3.29Å; L474-C478 PolarHBondContact O-N 3.3Å; L474-C478 PolarHBondContact O-SG 3.44Å; F475-C478 PolarHBondContact O-N 3.01Å; C478-L482 WeakPolarHBondContact O-CG 2.93Å; C478-L482 PolarHBondContact O-N 2.9Å
479	T	81.1	Confident	78.4	Confident	17 Å²	17	42.6 Å²	42.6	10%	0.104	20%	0.198	C	C	.	.	H	α-helix	trans	-72.3	-36.9	177.8	-58	0	0	0	0	112.1	L253 F475 L476 E477 L482 T483	L253-T479 HydrophobicContact CB-CG2 3.83Å; L253-T479 HydrophobicContact CD1-CG2 3.58Å; L253-T479 HydrophobicContact CD2-CG2 4.03Å; L253-T479 HydrophobicContact CG-CG2 4.01Å; F475-T479 WeakPolarHBondContact O-CB 3.26Å; F475-T479 PolarHBondContact O-N 3.33Å; F475-T479 PolarHBondContact O-OG1 2.87Å; L476-T479 CarbonylContact O-C 3.51Å; L476-T479 WeakPolarHBondContact O-CA 3.33Å; L476-T479 VanDerWaalsContact O-CB 3.31Å; L476-T479 WeakPolarHBondContact O-CB 3.36Å; L476-T479 PolarHBondContact O-N 3.06Å; L476-T479 VanDerWaalsContact O-N 3.09Å; E477-T479 PolarHBondContact O-N 3.3Å; T479-L482 PolarHBondContact O-N 2.76Å; T479-T483 HydrophobicContact CG2-CG2 4.49Å; T479-T483 WeakPolarHBondContact O-CG2 3.33Å; T479-T483 PolarHBondContact O-N 3.11Å; T479-T483 VanDerWaalsContact O-N 3.07Å; T479-T483 PolarHBondContact O-OG1 2.79Å
480	L	79.2	Confident	78.6	Confident	40 Å²	40	41.3 Å²	41.3	21%	0.209	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-39.8	177.4	-167.1	144.3	0	0	0	111.3	L476 E477 L482 T483 S484	L476-L480 WeakPolarHBondContact O-CB 3.45Å; L476-L480 PolarHBondContact O-N 2.9Å; E477-L480 PolarHBondContact O-N 3.04Å; E477-L480 VanDerWaalsContact O-N 3.13Å; L480-L482 PolarHBondContact O-N 3.3Å; L480-T483 WeakPolarHBondContact CA-OG1 3.27Å; L480-T483 PolarHBondContact O-N 2.64Å; L480-T483 PolarHBondContact O-OG1 2.97Å; L480-S484 VanDerWaalsContact O-CB 3.29Å; L480-S484 WeakPolarHBondContact O-CB 3.21Å; L480-S484 PolarHBondContact O-N 3.4Å; L480-S484 PolarHBondContact O-OG 2.55Å
481	I	84.4	Confident	78.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-43.2	173.6	-64.7	161.6	0	0	0	111.5	A455 V459 E477 T483 S484 V485 Q999	A455-I481 HydrophobicContact CB-CG2 4.04Å; V459-I481 HydrophobicContact CB-CD1 4.27Å; V459-I481 HydrophobicContact CG2-CD1 3.7Å; E477-I481 WeakPolarHBondContact O-CG1 3.39Å; E477-I481 PolarHBondContact O-N 3.32Å; I481-T483 VanDerWaalsContact C-N 3.26Å; I481-T483 PolarHBondContact O-N 2.76Å; I481-S484 PolarHBondContact O-OG 2.72Å; I481-V485 WeakPolarHBondContact O-CG2 3.5Å; I481-Q999 WeakPolarHBondContact CD1-O 3.47Å; I481-Q999 HydrophobicContact CG1-CB 3.99Å
482	L	83.5	Confident	78.1	Confident	54 Å²	54	31.4 Å²	31.4	28%	0.283	16%	0.156	S	C	.	.	H	α-helix	trans	-65.3	-33	179.3	-70.1	174	0	0	0	112.4	L449 A452 I453 A456 C478 T479 L480	L449-L482 HydrophobicContact CD1-CD2 4.1Å; A452-L482 HydrophobicContact CB-CD2 3.85Å; I453-L482 HydrophobicContact CB-CD2 4.41Å; I453-L482 HydrophobicContact CG1-CD2 3.66Å; A456-L482 HydrophobicContact CB-CD2 4.35Å; A456-L482 HydrophobicContact CB-CG 4.26Å; C478-L482 WeakPolarHBondContact O-CG 2.93Å; C478-L482 PolarHBondContact O-N 2.9Å; T479-L482 PolarHBondContact O-N 2.76Å; L480-L482 PolarHBondContact O-N 3.3Å
483	T	80.3	Confident	78.1	Confident	6 Å²	6	27.5 Å²	27.5	4%	0.037	14%	0.142	C	C	.	.	H	α-helix	trans	-88	-31.3	-176	49.8	0	0	0	0	112.9	C250 L253 W254 T479 L480 I481 V485 V486	C250-T483 HydrophobicContact CB-CG2 3.86Å; L253-T483 HydrophobicContact CB-CG2 4.48Å; L253-T483 HydrophobicContact CD1-CG2 3.83Å; W254-T483 PolarHBondContact NE1-OG1 2.92Å; T479-T483 HydrophobicContact CG2-CG2 4.49Å; T479-T483 WeakPolarHBondContact O-CG2 3.33Å; T479-T483 PolarHBondContact O-N 3.11Å; T479-T483 VanDerWaalsContact O-N 3.07Å; T479-T483 PolarHBondContact O-OG1 2.79Å; L480-T483 WeakPolarHBondContact CA-OG1 3.27Å; L480-T483 PolarHBondContact O-N 2.64Å; L480-T483 PolarHBondContact O-OG1 2.97Å; I481-T483 VanDerWaalsContact C-N 3.26Å; I481-T483 PolarHBondContact O-N 2.76Å; T483-V485 VanDerWaalsContact C-N 3.29Å; T483-V485 PolarHBondContact O-N 3.41Å; T483-V486 PolarHBondContact O-N 3.02Å
484	S	78.2	Confident	78.2	Confident	15 Å²	15	25.9 Å²	25.9	11%	0.105	14%	0.136	C	C	.	.	H	α-helix	trans	-70.3	-22.9	178.8	68.2	0	0	0	0	114	L480 I481 V486 Q999	L480-S484 VanDerWaalsContact O-CB 3.29Å; L480-S484 WeakPolarHBondContact O-CB 3.21Å; L480-S484 PolarHBondContact O-N 3.4Å; L480-S484 PolarHBondContact O-OG 2.55Å; I481-S484 PolarHBondContact O-OG 2.72Å; S484-V486 PolarHBondContact O-N 2.79Å; S484-Q999 PolarHBondContact OG-OE1 2.92Å
485	V	79.1	Confident	78.1	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.03	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21	179.3	166	0	0	0	0	112.9	L448 A452 I481 T483 P487 A996	L448-V485 HydrophobicContact CB-CG1 3.43Å; L448-V485 VanDerWaalsContact CB-CG1 3.43Å; L448-V485 HydrophobicContact CD1-CG1 4.4Å; L448-V485 HydrophobicContact CG-CG1 4.48Å; A452-V485 HydrophobicContact CB-CB 4.05Å; A452-V485 HydrophobicContact CB-CG1 4.21Å; A452-V485 HydrophobicContact CB-CG2 3.66Å; I481-V485 WeakPolarHBondContact O-CG2 3.5Å; T483-V485 VanDerWaalsContact C-N 3.29Å; T483-V485 PolarHBondContact O-N 3.41Å; V485-P487 WeakPolarHBondContact O-CD 3.38Å; V485-A996 HydrophobicContact CG2-CB 4.02Å
486	V	76.3	Confident	78	Confident	10 Å²	10	24.4 Å²	24.4	6%	0.061	13%	0.133	C	C	.	.	S	Bend	trans	-105.4	94.5	173.5	-173.5	0	0	0	0	108.9	F243 F246 I445 T483 S484	F243-V486 HydrophobicContact CE2-CG1 4.12Å; F243-V486 HydrophobicContact CZ-CG1 4.22Å; F246-V486 HydrophobicContact CD1-CG1 4.25Å; F246-V486 HydrophobicContact CE1-CB 3.68Å; F246-V486 HydrophobicContact CE1-CG1 3.75Å; F246-V486 HydrophobicContact CE1-CG2 3.67Å; F246-V486 HydrophobicContact CZ-CB 4.42Å; F246-V486 HydrophobicContact CZ-CG2 4Å; I445-V486 HydrophobicContact CD1-CG1 4.48Å; I445-V486 HydrophobicContact CG1-CG1 4.5Å; I445-V486 HydrophobicContact CG2-CG2 3.67Å; T483-V486 PolarHBondContact O-N 3.02Å; S484-V486 PolarHBondContact O-N 2.79Å
487	P	71.1	Confident	78.3	Confident	20 Å²	20	23.7 Å²	23.7	13%	0.13	13%	0.129	C	C	.	.			trans	-65.6	132	-177	20.9	-30.2	0	0	0	111.1	V485 E489 L490 L988	V485-P487 WeakPolarHBondContact O-CD 3.38Å; P487-E489 WeakPolarHBondContact CB-OE2 3.38Å; P487-E489 PolarHBondContact O-N 3.44Å; P487-L490 PolarHBondContact O-N 2.76Å; P487-L988 HydrophobicContact CB-CD1 4.13Å; P487-L988 HydrophobicContact CG-CD1 3.38Å; P487-L988 HydrophobicContact CG-CD2 3.38Å; P487-L988 HydrophobicContact CG-CG 3.4Å; P487-L988 VanDerWaalsContact CG-CG 3.4Å
488	P	70.4	Confident	78.5	Confident	21 Å²	21	22.5 Å²	22.5	14%	0.136	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.5	179.4	25.2	-32.8	0	0	0	113.2	Q247 L270 L490	Q247-P488 PolarHBondContact NE2-O 2.68Å; L270-P488 HydrophobicContact CD2-CB 4.25Å; P488-L490 VanDerWaalsContact C-N 3.35Å; P488-L490 PolarHBondContact O-N 3.45Å
489	E	73.2	Confident	78.5	Confident	82 Å²	82	24 Å²	24	38%	0.383	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-18.8	-177	-58.3	78	-167.8	0	0	113.7	P487 I492 E493	P487-E489 WeakPolarHBondContact CB-OE2 3.38Å; P487-E489 PolarHBondContact O-N 3.44Å; E489-I492 WeakPolarHBondContact O-CA 3.18Å; E489-I492 VanDerWaalsContact O-CB 3.29Å; E489-I492 WeakPolarHBondContact O-CB 3.38Å; E489-I492 PolarHBondContact O-N 3.22Å; E489-E493 WeakPolarHBondContact O-CB 3.45Å; E489-E493 PolarHBondContact O-N 2.82Å
490	L	75.6	Confident	78.6	Confident	9 Å²	9	24.9 Å²	24.9	5%	0.047	14%	0.136	C	C	.	.	H	α-helix	trans	-54.8	-46.2	-169.8	174	144	0	0	0	114.8	F243 T441 P487 P488 I492 L494 F985 L988	F243-L490 HydrophobicContact CE2-CD2 4.14Å; F243-L490 HydrophobicContact CZ-CD2 3.97Å; T441-L490 HydrophobicContact CG2-CD2 4.08Å; P487-L490 PolarHBondContact O-N 2.76Å; P488-L490 VanDerWaalsContact C-N 3.35Å; P488-L490 PolarHBondContact O-N 3.45Å; L490-I492 VanDerWaalsContact C-N 3.34Å; L490-L494 HydrophobicContact CD2-CD1 4.02Å; L490-L494 HydrophobicContact CG-CD1 4.39Å; L490-L494 VanDerWaalsContact O-CG 3.32Å; L490-L494 WeakPolarHBondContact O-CG 3.39Å; L490-L494 PolarHBondContact O-N 2.64Å; L490-F985 HydrophobicContact CD1-CD1 4.14Å; L490-F985 HydrophobicContact CD1-CE1 3.72Å; L490-F985 HydrophobicContact CG-CE1 4.4Å; L490-L988 HydrophobicContact CB-CD2 4.35Å; L490-L988 HydrophobicContact CD1-CD2 3.33Å; L490-L988 HydrophobicContact CG-CD2 4.38Å
491	P	72.1	Confident	79	Confident	23 Å²	23	23.2 Å²	23.2	15%	0.149	13%	0.128	C	C	.	.	H	α-helix	trans	-70.7	-31.2	176.9	-17.6	30.7	0	0	0	113.5	F243 E493 S495	F243-P491 HydrophobicContact CD1-CG 3.42Å; F243-P491 VanDerWaalsContact CD1-CG 3.42Å; F243-P491 HydrophobicContact CE1-CB 4.42Å; F243-P491 VanDerWaalsContact CE1-CD 3.43Å; F243-P491 HydrophobicContact CE1-CG 2.97Å; F243-P491 HydrophobicContact CG-CG 4.48Å; F243-P491 HydrophobicContact CZ-CG 3.73Å; P491-E493 VanDerWaalsContact C-N 3.35Å; P491-S495 WeakPolarHBondContact O-CB 3.48Å; P491-S495 PolarHBondContact O-N 2.83Å; P491-S495 PolarHBondContact O-OG 2.86Å
492	I	76.7	Confident	79	Confident	37 Å²	37	25.3 Å²	25.3	19%	0.19	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-49.9	179.6	-56.4	-179.7	0	0	0	108.2	F273 E489 L490 S495 L496	F273-I492 HydrophobicContact CD1-CD1 4.38Å; F273-I492 HydrophobicContact CD1-CG1 3.81Å; F273-I492 HydrophobicContact CD2-CG1 4.45Å; F273-I492 HydrophobicContact CD2-CG2 4.29Å; F273-I492 HydrophobicContact CE1-CB 4.18Å; F273-I492 HydrophobicContact CE1-CG1 3.66Å; F273-I492 HydrophobicContact CE1-CG2 4.43Å; F273-I492 HydrophobicContact CE2-CB 4.38Å; F273-I492 HydrophobicContact CE2-CG1 4.34Å; F273-I492 HydrophobicContact CE2-CG2 3.75Å; F273-I492 HydrophobicContact CG-CD1 4.38Å; F273-I492 HydrophobicContact CG-CG1 4.2Å; F273-I492 HydrophobicContact CZ-CB 4Å; F273-I492 HydrophobicContact CZ-CG1 3.95Å; F273-I492 HydrophobicContact CZ-CG2 3.83Å; E489-I492 WeakPolarHBondContact O-CA 3.18Å; E489-I492 VanDerWaalsContact O-CB 3.29Å; E489-I492 WeakPolarHBondContact O-CB 3.38Å; E489-I492 PolarHBondContact O-N 3.22Å; L490-I492 VanDerWaalsContact C-N 3.34Å; I492-S495 PolarHBondContact O-N 2.93Å; I492-L496 VanDerWaalsContact O-CB 3.32Å; I492-L496 WeakPolarHBondContact O-CB 3.44Å; I492-L496 PolarHBondContact O-N 3.03Å
493	E	78.5	Confident	79	Confident	21 Å²	21	27.4 Å²	27.4	10%	0.098	15%	0.15	C	C	.	.	H	α-helix	trans	-55.7	-50.1	176.4	-88.2	-179.5	-157.5	0	0	113.3	E489 P491 S495 L496 A497 M984 F1025	E489-E493 WeakPolarHBondContact O-CB 3.45Å; E489-E493 PolarHBondContact O-N 2.82Å; P491-E493 VanDerWaalsContact C-N 3.35Å; E493-S495 VanDerWaalsContact C-N 3.34Å; E493-S495 PolarHBondContact O-N 3.31Å; E493-L496 PolarHBondContact O-N 2.83Å; E493-A497 PolarHBondContact O-N 3.33Å; E493-M984 HydrophobicContact CB-CE 3.36Å; E493-M984 HydrophobicContact CG-CE 3.54Å; E493-M984 WeakPolarHBondContact OE2-CE 3.29Å; E493-F1025 HydrophobicContact CG-CB 4.34Å; E493-F1025 HydrophobicContact CG-CD1 4.44Å; E493-F1025 HydrophobicContact CG-CG 4.43Å; E493-F1025 WeakPolarHBondContact OE1-CD1 3.28Å; E493-F1025 VanDerWaalsContact OE1-CD2 3.24Å; E493-F1025 WeakPolarHBondContact OE1-CD2 3.46Å; E493-F1025 WeakPolarHBondContact OE1-CG 3.41Å
494	L	78.3	Confident	79.3	Confident	23 Å²	23	28.8 Å²	28.8	12%	0.12	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-42.8	177.9	-69.9	170.2	0	0	0	111.9	L490 V498 T981 F985	L490-L494 HydrophobicContact CD2-CD1 4.02Å; L490-L494 HydrophobicContact CG-CD1 4.39Å; L490-L494 VanDerWaalsContact O-CG 3.32Å; L490-L494 WeakPolarHBondContact O-CG 3.39Å; L490-L494 PolarHBondContact O-N 2.64Å; L494-V498 WeakPolarHBondContact O-CG2 3.49Å; L494-V498 PolarHBondContact O-N 3.02Å; L494-T981 HydrophobicContact CD2-CG2 3.42Å; L494-T981 VanDerWaalsContact CD2-CG2 3.42Å; L494-F985 HydrophobicContact CD1-CZ 4.02Å; L494-F985 HydrophobicContact CD2-CE2 3.99Å; L494-F985 HydrophobicContact CD2-CZ 4.13Å
495	S	78.2	Confident	79.7	Confident	12 Å²	12	28.1 Å²	28.1	8%	0.084	16%	0.157	C	C	.	.	H	α-helix	trans	-67	-39.4	179.5	-59	0	0	0	0	111.6	P491 I492 E493 V498 N499	P491-S495 WeakPolarHBondContact O-CB 3.48Å; P491-S495 PolarHBondContact O-N 2.83Å; P491-S495 PolarHBondContact O-OG 2.86Å; I492-S495 PolarHBondContact O-N 2.93Å; E493-S495 VanDerWaalsContact C-N 3.34Å; E493-S495 PolarHBondContact O-N 3.31Å; S495-V498 PolarHBondContact O-N 2.95Å; S495-N499 WeakPolarHBondContact O-CB 3.48Å; S495-N499 VanDerWaalsContact O-CG 3.32Å; S495-N499 PolarHBondContact O-N 2.98Å; S495-N499 PolarHBondContact O-ND2 3.29Å
496	L	81.3	Confident	79.9	Confident	58 Å²	58	29.5 Å²	29.5	30%	0.304	17%	0.169	S	C	.	.	H	α-helix	trans	-68	-41.2	179.9	-165.7	157.8	0	0	0	111.8	I492 E493 V498 N499 T500 S1029	I492-L496 VanDerWaalsContact O-CB 3.32Å; I492-L496 WeakPolarHBondContact O-CB 3.44Å; I492-L496 PolarHBondContact O-N 3.03Å; E493-L496 PolarHBondContact O-N 2.83Å; L496-V498 PolarHBondContact O-N 3Å; L496-N499 PolarHBondContact O-N 3.38Å; L496-T500 WeakPolarHBondContact O-CB 3.3Å; L496-T500 PolarHBondContact O-N 3.18Å; L496-T500 PolarHBondContact O-OG1 3.38Å; L496-S1029 WeakPolarHBondContact CD2-OG 3.44Å
497	A	84	Confident	80.4	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-41.9	174.9	0	0	0	0	0	112.4	E493 S501 M984	E493-A497 PolarHBondContact O-N 3.33Å; A497-S501 WeakPolarHBondContact O-CB 3.44Å; A497-S501 PolarHBondContact O-N 2.88Å; A497-S501 VanDerWaalsContact O-N 3.17Å; A497-S501 PolarHBondContact O-OG 2.91Å; A497-M984 HydrophobicContact CB-SD 4.44Å
498	V	83.4	Confident	81	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-68	-44.9	176.9	171.2	0	0	0	0	111.3	L494 S495 L496 T500 S501 L502 P515 F516 I518 P519 T977	L494-V498 WeakPolarHBondContact O-CG2 3.49Å; L494-V498 PolarHBondContact O-N 3.02Å; S495-V498 PolarHBondContact O-N 2.95Å; L496-V498 PolarHBondContact O-N 3Å; V498-T500 PolarHBondContact O-N 3.28Å; V498-S501 WeakPolarHBondContact O-CB 3.31Å; V498-S501 PolarHBondContact O-N 3.13Å; V498-S501 VanDerWaalsContact O-N 3.15Å; V498-L502 PolarHBondContact O-N 3.4Å; V498-P515 HydrophobicContact CG1-CB 3.38Å; V498-P515 WeakPolarHBondContact CG1-O 3.29Å; V498-F516 HydrophobicContact CG2-CD1 4.33Å; V498-F516 HydrophobicContact CG2-CE1 4.43Å; V498-I518 HydrophobicContact CG1-CD1 4.44Å; V498-P519 HydrophobicContact CG2-CG 4.45Å; V498-T977 HydrophobicContact CG2-CG2 4.44Å
499	N	82.9	Confident	81.6	Confident	45 Å²	45	42.6 Å²	42.6	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-40.1	179	-79.4	-19.3	0	0	0	112.5	S495 L496 S501 L502 I503	S495-N499 WeakPolarHBondContact O-CB 3.48Å; S495-N499 VanDerWaalsContact O-CG 3.32Å; S495-N499 PolarHBondContact O-N 2.98Å; S495-N499 PolarHBondContact O-ND2 3.29Å; L496-N499 PolarHBondContact O-N 3.38Å; N499-S501 VanDerWaalsContact C-N 3.27Å; N499-S501 PolarHBondContact O-N 3.45Å; N499-L502 WeakPolarHBondContact O-CB 3.47Å; N499-L502 PolarHBondContact O-N 3.48Å; N499-I503 WeakPolarHBondContact O-CG1 3.45Å; N499-I503 PolarHBondContact O-N 3.38Å
500	T	84.9	Confident	82.2	Confident	35 Å²	35	38.8 Å²	38.8	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-39.6	174.5	-60.2	0	0	0	0	111.2	L496 V498 I503 A504 R1030	L496-T500 WeakPolarHBondContact O-CB 3.3Å; L496-T500 PolarHBondContact O-N 3.18Å; L496-T500 PolarHBondContact O-OG1 3.38Å; V498-T500 PolarHBondContact O-N 3.28Å; T500-I503 PolarHBondContact O-N 3.22Å; T500-A504 PolarHBondContact O-N 3.37Å; T500-R1030 HydrophobicContact CG2-CG 4.05Å
501	S	87.2	Confident	82.5	Confident	5 Å²	5	42 Å²	42	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-67.2	-36.2	176.3	-59.2	0	0	0	0	112.6	A497 V498 N499 A504 L505 Q973 T977	A497-S501 WeakPolarHBondContact O-CB 3.44Å; A497-S501 PolarHBondContact O-N 2.88Å; A497-S501 VanDerWaalsContact O-N 3.17Å; A497-S501 PolarHBondContact O-OG 2.91Å; V498-S501 WeakPolarHBondContact O-CB 3.31Å; V498-S501 PolarHBondContact O-N 3.13Å; V498-S501 VanDerWaalsContact O-N 3.15Å; N499-S501 VanDerWaalsContact C-N 3.27Å; N499-S501 PolarHBondContact O-N 3.45Å; S501-A504 PolarHBondContact O-N 3.18Å; S501-L505 WeakPolarHBondContact O-CG 3.2Å; S501-L505 PolarHBondContact O-N 3.2Å; S501-Q973 PolarHBondContact OG-NE2 3.05Å; S501-T977 WeakPolarHBondContact CB-OG1 3.32Å; S501-T977 PolarHBondContact OG-OG1 3.01Å
502	L	84.5	Confident	82.9	Confident	45 Å²	45	42 Å²	42	24%	0.236	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-45.3	173.9	-176.3	151.3	0	0	0	111.4	V498 N499 A504 L505 A506 P515 I518	V498-L502 PolarHBondContact O-N 3.4Å; N499-L502 WeakPolarHBondContact O-CB 3.47Å; N499-L502 PolarHBondContact O-N 3.48Å; L502-A504 VanDerWaalsContact C-N 3.31Å; L502-A504 PolarHBondContact O-N 3.18Å; L502-L505 PolarHBondContact O-N 2.82Å; L502-A506 WeakPolarHBondContact O-CB 3.42Å; L502-A506 PolarHBondContact O-N 3.49Å; L502-P515 HydrophobicContact CD1-CB 4.05Å; L502-P515 HydrophobicContact CD1-CG 3.67Å; L502-I518 HydrophobicContact CB-CD1 4.35Å
503	I	83.9	Confident	82.8	Confident	98 Å²	98	44 Å²	44	50%	0.503	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-40	176.9	-64.8	166	0	0	0	110.7	N499 T500 A506 K507	N499-I503 WeakPolarHBondContact O-CG1 3.45Å; N499-I503 PolarHBondContact O-N 3.38Å; T500-I503 PolarHBondContact O-N 3.22Å; I503-A506 PolarHBondContact O-N 2.85Å; I503-K507 WeakPolarHBondContact O-CG 3.34Å; I503-K507 PolarHBondContact O-N 3.47Å
504	A	86.3	Confident	82.6	Confident	35 Å²	35	44.4 Å²	44.4	29%	0.289	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-41.9	177.1	0	0	0	0	0	112.4	T500 S501 L502 K507	T500-A504 PolarHBondContact O-N 3.37Å; S501-A504 PolarHBondContact O-N 3.18Å; L502-A504 VanDerWaalsContact C-N 3.31Å; L502-A504 PolarHBondContact O-N 3.18Å; A504-K507 PolarHBondContact O-N 3.07Å
505	L	86.9	Confident	82.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-39.4	175.3	-74.2	171.1	0	0	0	112.3	S501 L502 K507 L508 Y509 M510 I518 F957 V970 Q973	S501-L505 WeakPolarHBondContact O-CG 3.2Å; S501-L505 PolarHBondContact O-N 3.2Å; L502-L505 PolarHBondContact O-N 2.82Å; L505-K507 VanDerWaalsContact C-N 3.26Å; L505-K507 PolarHBondContact O-N 3.1Å; L505-L508 CarbonylContact O-C 3.23Å; L505-L508 WeakPolarHBondContact O-CA 3.05Å; L505-L508 WeakPolarHBondContact O-CB 3.32Å; L505-L508 PolarHBondContact O-N 3.47Å; L505-Y509 PolarHBondContact O-N 3.27Å; L505-M510 CarbonylContact C-O 3.58Å; L505-M510 VanDerWaalsContact C-O 3.23Å; L505-M510 HydrophobicContact CB-CB 4.09Å; L505-M510 HydrophobicContact CD2-CB 4.38Å; L505-M510 WeakPolarHBondContact O-CB 3.39Å; L505-M510 PolarHBondContact O-N 2.94Å; L505-I518 HydrophobicContact CD1-CD1 4.08Å; L505-I518 HydrophobicContact CD1-CG1 4.17Å; L505-F957 HydrophobicContact CD1-CE1 4.12Å; L505-V970 HydrophobicContact CD2-CG2 4.39Å; L505-Q973 HydrophobicContact CD1-CB 4.44Å; L505-Q973 HydrophobicContact CD1-CG 4.22Å; L505-Q973 HydrophobicContact CD2-CB 3.91Å; L505-Q973 HydrophobicContact CD2-CG 4.28Å; L505-Q973 HydrophobicContact CG-CB 4.18Å; L505-Q973 HydrophobicContact CG-CG 3.99Å
506	A	83.3	Confident	82.8	Confident	34 Å²	34	46.6 Å²	46.6	28%	0.281	24%	0.242	S	C	.	.	H	α-helix	trans	-60	-37.3	177.8	0	0	0	0	0	112.1	L502 I503 L508 Y509 M510	L502-A506 WeakPolarHBondContact O-CB 3.42Å; L502-A506 PolarHBondContact O-N 3.49Å; I503-A506 PolarHBondContact O-N 2.85Å; A506-L508 PolarHBondContact O-N 2.94Å; A506-Y509 WeakPolarHBondContact O-CA 3.39Å; A506-Y509 PolarHBondContact O-N 3.34Å; A506-M510 WeakPolarHBondContact CA-O 3.11Å; A506-M510 PolarHBondContact N-O 3.32Å
507	K	85.3	Confident	83	Confident	161 Å²	161	44.2 Å²	44.2	70%	0.7	23%	0.229	S	C	*	.	H	α-helix	trans	-64.3	-22	173.3	-71.2	179.1	179.8	-175.7	0	113.8	I503 A504 L505 Y509	I503-K507 WeakPolarHBondContact O-CG 3.34Å; I503-K507 PolarHBondContact O-N 3.47Å; A504-K507 PolarHBondContact O-N 3.07Å; L505-K507 VanDerWaalsContact C-N 3.26Å; L505-K507 PolarHBondContact O-N 3.1Å; K507-Y509 VanDerWaalsContact C-N 3.29Å
508	L	84.8	Confident	83.3	Confident	74 Å²	74	44.2 Å²	44.2	39%	0.387	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	16.6	173.2	-60	173.6	0	0	0	112	L505 A506 M510 H969	L505-L508 CarbonylContact O-C 3.23Å; L505-L508 WeakPolarHBondContact O-CA 3.05Å; L505-L508 WeakPolarHBondContact O-CB 3.32Å; L505-L508 PolarHBondContact O-N 3.47Å; A506-L508 PolarHBondContact O-N 2.94Å; L508-M510 PolarHBondContact O-N 3.18Å; L508-H969 HydrophobicContact CD1-CB 3.95Å
509	Y	83.3	Confident	83.5	Confident	91 Å²	91	44.9 Å²	44.9	36%	0.357	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	25.3	-178.2	-52.4	-83.1	0	0	0	114.3	L505 A506 K507 I886 K960 L961	L505-Y509 PolarHBondContact O-N 3.27Å; A506-Y509 WeakPolarHBondContact O-CA 3.39Å; A506-Y509 PolarHBondContact O-N 3.34Å; K507-Y509 VanDerWaalsContact C-N 3.29Å; Y509-I886 HydrophobicContact CD2-CD1 4.16Å; Y509-I886 HydrophobicContact CE2-CD1 3.36Å; Y509-I886 HydrophobicContact CE2-CG1 4.38Å; Y509-K960 PolarHBondContact O-N 3.35Å; Y509-K960 VanDerWaalsContact O-N 3.1Å; Y509-L961 HydrophobicContact CD2-CD1 4.46Å
510	M	84.5	Confident	83.7	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.9	172.7	-70	-55.8	-59.6	0	0	110	L505 A506 L508 V876 F957 S959 C966 V970	L505-M510 CarbonylContact C-O 3.58Å; L505-M510 VanDerWaalsContact C-O 3.23Å; L505-M510 HydrophobicContact CB-CB 4.09Å; L505-M510 HydrophobicContact CD2-CB 4.38Å; L505-M510 WeakPolarHBondContact O-CB 3.39Å; L505-M510 PolarHBondContact O-N 2.94Å; A506-M510 WeakPolarHBondContact CA-O 3.11Å; A506-M510 PolarHBondContact N-O 3.32Å; L508-M510 PolarHBondContact O-N 3.18Å; M510-V876 HydrophobicContact CE-CG1 4.03Å; M510-F957 HydrophobicContact CE-CB 4.04Å; M510-S959 WeakPolarHBondContact SD-CA 3.27Å; M510-S959 WeakPolarHBondContact SD-CB 3.48Å; M510-S959 PolarHBondContact SD-OG 3.1Å; M510-C966 HydrophobicContact CE-CB 4.13Å; M510-C966 HydrophobicContact CG-CB 4.27Å; M510-C966 HydrophobicContact SD-CB 3.36Å; M510-C966 WeakPolarHBondContact SD-CB 3.33Å; M510-V970 HydrophobicContact CE-CG2 3.95Å
511	Y	82.5	Confident	84	Confident	78 Å²	78	43.5 Å²	43.5	31%	0.306	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	136.4	176	-68.7	-94.1	0	0	0	109.6	T943 F957 T958 K960	Y511-T943 VanDerWaalsContact OH-CG2 3.26Å; Y511-T943 WeakPolarHBondContact OH-CG2 3.31Å; Y511-T943 PolarHBondContact OH-OG1 2.94Å; Y511-F957 CarbonylContact O-C 3.56Å; Y511-F957 WeakPolarHBondContact O-CA 3.29Å; Y511-T958 PolarHBondContact N-O 2.75Å; Y511-T958 PolarHBondContact O-N 3.05Å; Y511-K960 HydrophobicContact CD2-CD 4.21Å; Y511-K960 HydrophobicContact CD2-CG 4.06Å; Y511-K960 HydrophobicContact CE2-CD 3.48Å; Y511-K960 VanDerWaalsContact CE2-CD 3.48Å; Y511-K960 HydrophobicContact CE2-CG 3.81Å; Y511-K960 VanDerWaalsContact CZ-NZ 3.34Å; Y511-K960 PolarHBondContact OH-NZ 3.01Å
512	C	80.3	Confident	84.1	Confident	21 Å²	21	43.4 Å²	43.4	14%	0.142	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.4	177.8	-175.6	0	0	0	0	109.8	E514 P956 F957	C512-E514 VanDerWaalsContact SG-C 3.51Å; C512-E514 PolarHBondContact SG-O 3.06Å; C512-E514 VanDerWaalsContact SG-O 3.41Å; C512-P956 CarbonylContact C-O 3.57Å; C512-P956 VanDerWaalsContact CA-O 3.27Å; C512-P956 WeakPolarHBondContact CA-O 3.29Å; C512-F957 HydrophobicContact CB-CD1 3.85Å; C512-F957 HydrophobicContact CB-CE1 3.81Å; C512-F957 WeakPolarHBondContact SG-CE1 3.4Å
513	T	73.8	Confident	84.3	Confident	81 Å²	81	43.2 Å²	43.2	50%	0.497	22%	0.22	S	C	.	.	S	Bend	trans	-90.9	-26.9	177	56	0	0	0	0	112.2	P956	T513-P956 PolarHBondContact N-O 3.29Å; T513-P956 WeakPolarHBondContact OG1-CA 3.45Å; T513-P956 PolarHBondContact OG1-O 3.27Å
514	E	75.8	Confident	84.6	Confident	28 Å²	28	38.6 Å²	38.6	13%	0.131	20%	0.196	C	C	.	.			trans	-122.2	84.5	-179.1	-65.5	-176.2	-153.8	0	0	111.1	C512 F516 R517 K870 P956	C512-E514 VanDerWaalsContact SG-C 3.51Å; C512-E514 PolarHBondContact SG-O 3.06Å; C512-E514 VanDerWaalsContact SG-O 3.41Å; E514-F516 VanDerWaalsContact C-N 3.33Å; E514-F516 PolarHBondContact O-N 3.5Å; E514-R517 HydrophobicContact CB-CG 4.21Å; E514-R517 WeakPolarHBondContact O-CB 3.41Å; E514-R517 PolarHBondContact O-N 3.3Å; E514-R517 IonicContact OE2-CZ 2.7Å; E514-R517 IonicContact OE2-NE 2.85Å; E514-R517 PolarHBondContact OE2-NE 3.44Å; E514-R517 IonicContact OE2-NH2 2.73Å; E514-R517 PolarHBondContact OE2-NH2 2.94Å; E514-K870 IonicContact OE1-NZ 3.19Å; E514-K870 PolarHBondContact OE1-NZ 3.14Å; E514-P956 HydrophobicContact CB-CB 4.13Å
515	P	78.9	Confident	84.8	Confident	30 Å²	30	40.3 Å²	40.3	20%	0.195	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-61.7	-33.1	-168.4	-22.8	32.2	0	0	0	114.8	V498 L502 R517 I518	V498-P515 HydrophobicContact CG1-CB 3.38Å; V498-P515 WeakPolarHBondContact CG1-O 3.29Å; L502-P515 HydrophobicContact CD1-CB 4.05Å; L502-P515 HydrophobicContact CD1-CG 3.67Å; P515-R517 PolarHBondContact O-N 2.9Å; P515-R517 VanDerWaalsContact O-N 3.09Å; P515-I518 WeakPolarHBondContact O-CB 3.14Å; P515-I518 WeakPolarHBondContact O-CD1 3.3Å; P515-I518 VanDerWaalsContact O-CG1 3.24Å; P515-I518 WeakPolarHBondContact O-CG1 3.49Å; P515-I518 PolarHBondContact O-N 3.4Å
516	F	81.6	Confident	85.1	Confident	51 Å²	51	40.5 Å²	40.5	22%	0.224	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-68.9	-4.6	178.9	-69.4	-72.2	0	0	0	114	V434 A436 V498 E514 P519 F520	V434-F516 WeakPolarHBondContact O-CB 3.37Å; A436-F516 HydrophobicContact CB-CD1 4.21Å; A436-F516 HydrophobicContact CB-CE1 3.74Å; A436-F516 HydrophobicContact CB-CZ 4.15Å; V498-F516 HydrophobicContact CG2-CD1 4.33Å; V498-F516 HydrophobicContact CG2-CE1 4.43Å; E514-F516 VanDerWaalsContact C-N 3.33Å; E514-F516 PolarHBondContact O-N 3.5Å; F516-P519 WeakPolarHBondContact O-CD 3.41Å; F516-F520 WeakPolarHBondContact O-CD2 3.17Å
517	R	85.5	Confident	85.6	Confident	8 Å²	8	38.9 Å²	38.9	3%	0.03	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-82.5	-13.5	168.7	-68.7	-172.7	176.6	-126.3	13.9	113.6	V434 E514 P515 F520 A521 A872 D873 F957	V434-R517 HydrophobicContact CB-CG 4.5Å; V434-R517 HydrophobicContact CG2-CG 4.22Å; E514-R517 HydrophobicContact CB-CG 4.21Å; E514-R517 WeakPolarHBondContact O-CB 3.41Å; E514-R517 PolarHBondContact O-N 3.3Å; E514-R517 IonicContact OE2-CZ 2.7Å; E514-R517 IonicContact OE2-NE 2.85Å; E514-R517 PolarHBondContact OE2-NE 3.44Å; E514-R517 IonicContact OE2-NH2 2.73Å; E514-R517 PolarHBondContact OE2-NH2 2.94Å; P515-R517 PolarHBondContact O-N 2.9Å; P515-R517 VanDerWaalsContact O-N 3.09Å; R517-F520 WeakPolarHBondContact O-CB 3.33Å; R517-F520 PolarHBondContact O-N 3.13Å; R517-A521 PolarHBondContact O-N 2.86Å; R517-A872 PolarHBondContact NH1-O 3.23Å; R517-D873 PolarHBondContact NH1-O 2.99Å; R517-F957 HydrophobicContact CB-CE2 4.17Å; R517-F957 HydrophobicContact CB-CZ 4.37Å
518	I	89.8	Confident	86.1	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-56.6	-47.3	179	-64.5	167.5	0	0	0	111.8	V498 L502 L505 P515 F520 A521 F957 Q973 G974 T977	V498-I518 HydrophobicContact CG1-CD1 4.44Å; L502-I518 HydrophobicContact CB-CD1 4.35Å; L505-I518 HydrophobicContact CD1-CD1 4.08Å; L505-I518 HydrophobicContact CD1-CG1 4.17Å; P515-I518 WeakPolarHBondContact O-CB 3.14Å; P515-I518 WeakPolarHBondContact O-CD1 3.3Å; P515-I518 VanDerWaalsContact O-CG1 3.24Å; P515-I518 WeakPolarHBondContact O-CG1 3.49Å; P515-I518 PolarHBondContact O-N 3.4Å; I518-F520 PolarHBondContact O-N 3.1Å; I518-A521 VanDerWaalsContact O-CB 3.31Å; I518-A521 WeakPolarHBondContact O-CB 3.22Å; I518-A521 PolarHBondContact O-N 3.15Å; I518-A521 VanDerWaalsContact O-N 3.1Å; I518-F957 HydrophobicContact CG1-CE1 3.82Å; I518-F957 HydrophobicContact CG1-CZ 3.84Å; I518-Q973 HydrophobicContact CG2-CG 4.43Å; I518-G974 WeakPolarHBondContact O-CA 3.29Å; I518-T977 HydrophobicContact CG2-CG2 4.4Å
519	P	88.7	Confident	86.6	Confident	20 Å²	20	27.7 Å²	27.7	13%	0.13	13%	0.134	C	C	.	.	H	α-helix	trans	-62.7	-27.3	176.8	-23.2	34.8	0	0	0	114.1	V498 F516 A521 G522 T977 L978	V498-P519 HydrophobicContact CG2-CG 4.45Å; F516-P519 WeakPolarHBondContact O-CD 3.41Å; P519-A521 VanDerWaalsContact C-N 3.3Å; P519-A521 PolarHBondContact O-N 3.47Å; P519-G522 PolarHBondContact O-N 3.5Å; P519-G522 VanDerWaalsContact O-N 3.17Å; P519-T977 HydrophobicContact CG-CG2 4.13Å; P519-L978 HydrophobicContact CB-CD1 4.45Å
520	F	87.2	Confident	87	Confident	51 Å²	51	23.6 Å²	23.6	22%	0.224	12%	0.118	C	C	.	.	H	α-helix	trans	-69.6	-29	176.6	-69.9	-98	0	0	0	112	V434 F516 R517 I518 G522 K523 V524 V874	V434-F520 HydrophobicContact CG1-CD2 4.36Å; V434-F520 HydrophobicContact CG1-CE2 3.45Å; V434-F520 VanDerWaalsContact CG1-CE2 3.45Å; V434-F520 HydrophobicContact CG1-CZ 3.73Å; F516-F520 WeakPolarHBondContact O-CD2 3.17Å; R517-F520 WeakPolarHBondContact O-CB 3.33Å; R517-F520 PolarHBondContact O-N 3.13Å; I518-F520 PolarHBondContact O-N 3.1Å; F520-G522 PolarHBondContact O-N 2.91Å; F520-K523 PolarHBondContact O-N 3.22Å; F520-V524 PolarHBondContact O-N 3.48Å; F520-V874 HydrophobicContact CB-CG2 4.29Å
521	A	90.9	Very high	87.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.4	-26.7	171.8	0	0	0	0	0	112.8	R517 I518 P519 K523 V874 V970	R517-A521 PolarHBondContact O-N 2.86Å; I518-A521 VanDerWaalsContact O-CB 3.31Å; I518-A521 WeakPolarHBondContact O-CB 3.22Å; I518-A521 PolarHBondContact O-N 3.15Å; I518-A521 VanDerWaalsContact O-N 3.1Å; P519-A521 VanDerWaalsContact C-N 3.3Å; P519-A521 PolarHBondContact O-N 3.47Å; A521-K523 VanDerWaalsContact C-N 3.3Å; A521-K523 PolarHBondContact O-N 3.17Å; A521-V874 HydrophobicContact CB-CG1 4.33Å; A521-V874 HydrophobicContact CB-CG2 4Å; A521-V970 HydrophobicContact CB-CG1 3.69Å
522	G	88.1	Confident	87.1	Confident	2 Å²	2	22.4 Å²	22.4	2%	0.021	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-22	172	0	0	0	0	0	114.4	P519 F520 P1042	P519-G522 PolarHBondContact O-N 3.5Å; P519-G522 VanDerWaalsContact O-N 3.17Å; F520-G522 PolarHBondContact O-N 2.91Å; G522-P1042 WeakPolarHBondContact O-CG 3.45Å
523	K	88.4	Confident	87	Confident	42 Å²	42	21.5 Å²	21.5	18%	0.183	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-2.3	-177.4	-53.2	-171.5	-169.9	-170.8	0	113.8	F520 A521 E525 V855 L978 P1044	F520-K523 PolarHBondContact O-N 3.22Å; A521-K523 VanDerWaalsContact C-N 3.3Å; A521-K523 PolarHBondContact O-N 3.17Å; K523-E525 WeakPolarHBondContact O-CG 3.32Å; K523-E525 PolarHBondContact O-N 3.1Å; K523-V855 HydrophobicContact CB-CG1 4.33Å; K523-V855 HydrophobicContact CB-CG2 4.17Å; K523-V855 WeakPolarHBondContact O-CB 3.35Å; K523-L978 HydrophobicContact CD-CD2 4.45Å; K523-L978 HydrophobicContact CG-CD2 3.59Å; K523-P1044 HydrophobicContact CD-CB 4.35Å; K523-P1044 WeakPolarHBondContact CE-O 3.37Å; K523-P1044 PolarHBondContact NZ-O 3.25Å
524	V	91.3	Very high	87.6	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.09	C	C	.	.			trans	-57.7	133	-174.3	170.3	0	0	0	0	111.7	F520 H738 V855 L857 V874	F520-V524 PolarHBondContact O-N 3.48Å; V524-H738 PolarHBondContact O-CE1 3.24Å; V524-H738 PolarHBondContact O-ND1 3.18Å; V524-V855 HydrophobicContact CG2-CG1 4.22Å; V524-L857 HydrophobicContact CG1-CB 3.61Å; V524-L857 HydrophobicContact CG1-CD1 4.43Å; V524-L857 HydrophobicContact CG2-CB 4.03Å; V524-L857 HydrophobicContact CG2-CD1 4.29Å; V524-V874 HydrophobicContact CG2-CB 4.41Å; V524-V874 HydrophobicContact CG2-CG2 4.06Å
525	E	90.3	Very high	88.2	Confident	71 Å²	71	16.3 Å²	16.3	33%	0.332	8%	0.084	S	C	.	.			trans	-112.6	-39.8	178.7	-48.2	-157	147.9	0	0	112.7	K523 R739 Y854 V855 R1041	K523-E525 WeakPolarHBondContact O-CG 3.32Å; K523-E525 PolarHBondContact O-N 3.1Å; E525-R739 PolarHBondContact O-N 3.03Å; E525-Y854 WeakPolarHBondContact OE2-CD1 3.49Å; E525-V855 HydrophobicContact CG-CB 4.37Å; E525-V855 PolarHBondContact N-O 3.33Å; E525-R1041 VanDerWaalsContact CG-NH1 3.3Å; E525-R1041 IonicContact OE1-NH1 3.5Å
526	V	93	Very high	88.6	Confident	4 Å²	4	14.9 Å²	14.9	2%	0.024	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.8	-178.1	-172.9	0	0	0	0	109.2	R739 V741 L849 Y854 V855 L857	V526-R739 CarbonylContact C-O 3.6Å; V526-R739 WeakPolarHBondContact CA-O 3.25Å; V526-R739 HydrophobicContact CG2-CB 4.4Å; V526-V741 HydrophobicContact CG1-CB 4.42Å; V526-V741 HydrophobicContact CG1-CG2 3.72Å; V526-L849 HydrophobicContact CG1-CD1 4.32Å; V526-Y854 HydrophobicContact CG2-CD1 4.19Å; V526-Y854 HydrophobicContact CG2-CG 4.34Å; V526-V855 PolarHBondContact N-O 2.98Å; V526-L857 PolarHBondContact O-N 3.5Å
527	C	94.6	Very high	88.6	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.2	174.6	-59.6	0	0	0	0	109.2	F529 R739 V740 V741 L857	C527-F529 HydrophobicContact CB-CD2 4.4Å; C527-F529 HydrophobicContact CB-CE2 3.58Å; C527-F529 HydrophobicContact CB-CZ 4.25Å; C527-F529 WeakPolarHBondContact O-CD2 3.44Å; C527-R739 PolarHBondContact N-O 2.94Å; C527-V740 WeakPolarHBondContact O-CA 3.2Å; C527-V741 PolarHBondContact O-N 3.35Å; C527-L857 HydrophobicContact CB-CD2 4.43Å
528	C	95.1	Very high	87.9	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	135.7	176.1	-60.6	0	0	0	0	110.2	V741 I743 I846 L857 M858 C859	C528-V741 CarbonylContact C-O 3.49Å; C528-V741 VanDerWaalsContact CA-O 3.28Å; C528-V741 WeakPolarHBondContact CA-O 3.3Å; C528-I743 HydrophobicContact CB-CD1 3.83Å; C528-I743 HydrophobicContact CB-CG1 4.37Å; C528-I846 HydrophobicContact CB-CD1 3.87Å; C528-I846 VanDerWaalsContact SG-CD1 3.59Å; C528-L857 WeakPolarHBondContact CB-O 3.31Å; C528-L857 PolarHBondContact N-O 2.91Å; C528-M858 HydrophobicContact CB-SD 3.7Å; C528-M858 CarbonylContact O-C 3.47Å; C528-M858 WeakPolarHBondContact O-CA 3.23Å; C528-C859 PolarHBondContact O-N 3.05Å
529	F	94.4	Very high	87.1	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137.4	-178.2	-67.9	-96.8	0	0	0	111.1	C527 T534 L535 I730 I733 V740 V741 M742 I743 C859 I964 I967	C527-F529 HydrophobicContact CB-CD2 4.4Å; C527-F529 HydrophobicContact CB-CE2 3.58Å; C527-F529 HydrophobicContact CB-CZ 4.25Å; C527-F529 WeakPolarHBondContact O-CD2 3.44Å; F529-T534 HydrophobicContact CD1-CG2 4.32Å; F529-L535 HydrophobicContact CB-CD1 4Å; F529-L535 HydrophobicContact CB-CD2 4.42Å; F529-L535 HydrophobicContact CB-CG 4.22Å; F529-L535 HydrophobicContact CD1-CD2 4.05Å; F529-L535 HydrophobicContact CG-CD2 4.38Å; F529-I730 HydrophobicContact CD2-CD1 4.37Å; F529-I730 HydrophobicContact CE1-CD1 4.04Å; F529-I730 HydrophobicContact CE2-CD1 3.93Å; F529-I730 HydrophobicContact CZ-CD1 3.76Å; F529-I733 HydrophobicContact CZ-CD1 3.79Å; F529-V740 HydrophobicContact CD2-CG1 3.76Å; F529-V740 HydrophobicContact CE2-CG1 3.76Å; F529-V741 PolarHBondContact N-O 2.8Å; F529-M742 WeakPolarHBondContact O-CA 3.43Å; F529-I743 PolarHBondContact O-N 3.23Å; F529-C859 HydrophobicContact CD1-CB 4.16Å; F529-C859 HydrophobicContact CE1-CB 4.43Å; F529-I964 HydrophobicContact CD1-CG2 4.36Å; F529-I964 HydrophobicContact CE1-CG2 3.69Å; F529-I967 HydrophobicContact CD1-CD1 4.04Å; F529-I967 HydrophobicContact CE1-CD1 3.14Å; F529-I967 HydrophobicContact CZ-CD1 3.64Å
530	D	92.3	Very high	86.7	Confident	6 Å²	6	20.2 Å²	20.2	3%	0.032	11%	0.111	C	C	.	.			trans	-74.6	157.3	158.4	-159.3	6.2	0	0	0	110.5	T534 L535 T744 K842 M858 C859 N864	D530-T534 VanDerWaalsContact O-CB 3.26Å; D530-T534 WeakPolarHBondContact O-CB 3.48Å; D530-T534 WeakPolarHBondContact O-CG2 3.14Å; D530-L535 WeakPolarHBondContact O-CG 3.44Å; D530-T744 PolarHBondContact OD1-OG1 3.07Å; D530-K842 IonicContact OD1-NZ 3.56Å; D530-K842 PolarHBondContact OD1-NZ 3.04Å; D530-K842 IonicContact OD2-NZ 3.53Å; D530-K842 PolarHBondContact OD2-NZ 3.41Å; D530-M858 HydrophobicContact CB-CE 4.4Å; D530-C859 PolarHBondContact N-O 3.36Å; D530-N864 PolarHBondContact OD2-ND2 2.99Å
531	K	88.4	Confident	86.6	Confident	1 Å²	1	21.3 Å²	21.3	0%	0.004	12%	0.122	C	C	.	.	I	π-helix	trans	-89.7	-60.9	-177.7	-168.2	-123.5	66.9	163.3	0	111.6	L535 T536 M742 T744 D746 V754	K531-L535 PolarHBondContact O-N 2.98Å; K531-T536 HydrophobicContact CD-CG2 4.45Å; K531-T536 HydrophobicContact CG-CG2 4.49Å; K531-T536 PolarHBondContact O-N 2.82Å; K531-T536 PolarHBondContact O-OG1 3.24Å; K531-T536 VanDerWaalsContact O-OG1 3.05Å; K531-M742 HydrophobicContact CB-CG 4.39Å; K531-M742 HydrophobicContact CB-SD 4.05Å; K531-M742 HydrophobicContact CG-CE 4.47Å; K531-M742 HydrophobicContact CG-SD 3.99Å; K531-T744 HydrophobicContact CB-CG2 4.26Å; K531-T744 WeakPolarHBondContact CB-OG1 3.45Å; K531-D746 WeakPolarHBondContact CD-OD2 3.36Å; K531-D746 WeakPolarHBondContact CE-OD2 3.49Å; K531-D746 IonicContact NZ-OD2 3.53Å; K531-D746 PolarHBondContact NZ-OD2 3.11Å; K531-V754 HydrophobicContact CD-CG2 4.32Å; K531-V754 HydrophobicContact CG-CG1 4.1Å
532	T	81.3	Confident	86.5	Confident	53 Å²	53	22.4 Å²	22.4	33%	0.325	13%	0.129	S	C	.	.	I	π-helix	trans	-73.7	136.6	-176	-55.8	0	0	0	0	109.3	T534 T536	T532-T534 PolarHBondContact O-N 3.18Å; T532-T536 WeakPolarHBondContact CA-OG1 3.39Å
533	G	78.3	Confident	86.5	Confident	3 Å²	3	28.8 Å²	28.8	3%	0.031	15%	0.152	C	C	.	.	I	π-helix	trans	67	-20.8	-178	0	0	0	0	0	116.6	T536 D538 K723 D861	G533-T536 CarbonylContact C-O 3.52Å; G533-T536 PolarHBondContact N-O 2.92Å; G533-D538 WeakPolarHBondContact CA-OD1 3.37Å; G533-D538 PolarHBondContact N-OD1 3.5Å; G533-K723 WeakPolarHBondContact O-CE 3.42Å; G533-K723 PolarHBondContact O-NZ 3.42Å; G533-D861 VanDerWaalsContact C-CG 3.46Å; G533-D861 VanDerWaalsContact C-OD1 3.23Å; G533-D861 WeakPolarHBondContact CA-OD2 3.34Å
534	T	85.8	Confident	86.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-95	-70.5	174	-65.2	0	0	0	0	112	F529 D530 T532 K723 G860 D861 L878 I964	F529-T534 HydrophobicContact CD1-CG2 4.32Å; D530-T534 VanDerWaalsContact O-CB 3.26Å; D530-T534 WeakPolarHBondContact O-CB 3.48Å; D530-T534 WeakPolarHBondContact O-CG2 3.14Å; T532-T534 PolarHBondContact O-N 3.18Å; T534-K723 WeakPolarHBondContact O-CD 3.45Å; T534-K723 VanDerWaalsContact O-CE 3.28Å; T534-K723 WeakPolarHBondContact O-CE 3.39Å; T534-K723 PolarHBondContact O-NZ 3.06Å; T534-G860 WeakPolarHBondContact OG1-CA 3.38Å; T534-D861 PolarHBondContact N-OD1 3.48Å; T534-D861 PolarHBondContact OG1-N 3.46Å; T534-D861 PolarHBondContact OG1-OD1 3.47Å; T534-L878 HydrophobicContact CG2-CD1 4.1Å; T534-I964 WeakPolarHBondContact O-CD1 3.28Å
535	L	89.3	Confident	86.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-82.9	-36.2	-178.9	-67.8	170.4	0	0	0	113.6	F529 D530 K531 K723 S726 I730 M742 L758 F760 I964	F529-L535 HydrophobicContact CB-CD1 4Å; F529-L535 HydrophobicContact CB-CD2 4.42Å; F529-L535 HydrophobicContact CB-CG 4.22Å; F529-L535 HydrophobicContact CD1-CD2 4.05Å; F529-L535 HydrophobicContact CG-CD2 4.38Å; D530-L535 WeakPolarHBondContact O-CG 3.44Å; K531-L535 PolarHBondContact O-N 2.98Å; L535-K723 PolarHBondContact O-N 3.2Å; L535-K723 VanDerWaalsContact O-N 3.16Å; L535-S726 PolarHBondContact O-OG 3.48Å; L535-I730 HydrophobicContact CD2-CD1 4.09Å; L535-I730 HydrophobicContact CD2-CG1 4.3Å; L535-M742 HydrophobicContact CD1-CE 3.8Å; L535-L758 HydrophobicContact CB-CD1 4.25Å; L535-L758 HydrophobicContact CD1-CD1 3.96Å; L535-L758 HydrophobicContact CD2-CD1 4.04Å; L535-L758 HydrophobicContact CG-CD1 4.32Å; L535-F760 HydrophobicContact CD1-CE2 4.46Å; L535-F760 HydrophobicContact CD1-CZ 3.86Å; L535-F760 HydrophobicContact CD2-CZ 4.44Å; L535-I964 HydrophobicContact CD2-CD1 3.79Å
536	T	86.6	Confident	86.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-100	155.6	174.6	58.2	0	0	0	0	110.4	K531 T532 G533 C720 P721 L722	K531-T536 HydrophobicContact CD-CG2 4.45Å; K531-T536 HydrophobicContact CG-CG2 4.49Å; K531-T536 PolarHBondContact O-N 2.82Å; K531-T536 PolarHBondContact O-OG1 3.24Å; K531-T536 VanDerWaalsContact O-OG1 3.05Å; T532-T536 WeakPolarHBondContact CA-OG1 3.39Å; G533-T536 CarbonylContact C-O 3.52Å; G533-T536 PolarHBondContact N-O 2.92Å; T536-C720 HydrophobicContact CG2-CB 4.25Å; T536-P721 WeakPolarHBondContact CA-O 3.42Å; T536-P721 WeakPolarHBondContact CB-O 2.84Å; T536-L722 HydrophobicContact CG2-CD2 3.98Å
537	S	81.3	Confident	86.1	Confident	15 Å²	15	24 Å²	24	11%	0.105	13%	0.134	C	C	.	.			trans	-72	155.9	171	64.7	0	0	0	0	111.5	S539 P721	S537-S539 PolarHBondContact O-N 2.96Å; S537-S539 PolarHBondContact OG-OG 3.35Å; S537-P721 PolarHBondContact N-O 3.04Å; S537-P721 WeakPolarHBondContact OG-CG 3.43Å; S537-P721 PolarHBondContact OG-O 3.01Å
538	D	70.1	Confident	85.5	Confident	70 Å²	70	26.5 Å²	26.5	37%	0.374	15%	0.147	S	C	.	.	S	Bend	trans	-76.1	-11.4	174.4	-64.8	-40.4	0	0	0	113.2	G533 L540	G533-D538 WeakPolarHBondContact CA-OD1 3.37Å; G533-D538 PolarHBondContact N-OD1 3.5Å; D538-L540 PolarHBondContact O-N 3.04Å
539	S	73.3	Confident	84.6	Confident	70 Å²	70	34 Å²	34	49%	0.49	18%	0.175	S	C	.	.			trans	-76.4	112.7	177.4	51.4	0	0	0	0	111.3	S537 P721	S537-S539 PolarHBondContact O-N 2.96Å; S537-S539 PolarHBondContact OG-OG 3.35Å; S539-P721 VanDerWaalsContact O-CD 3.3Å; S539-P721 WeakPolarHBondContact O-CD 3.36Å
540	L	81.3	Confident	83.2	Confident	37 Å²	37	41.9 Å²	41.9	19%	0.194	22%	0.218	C	C	.	.			trans	-86.6	131.4	177.1	-65.3	169.4	0	0	0	110.7	D538 P586 L587 A590 V718 C720	D538-L540 PolarHBondContact O-N 3.04Å; L540-P586 HydrophobicContact CD1-CB 4.37Å; L540-L587 HydrophobicContact CD1-CB 3.57Å; L540-L587 HydrophobicContact CD1-CD1 3.91Å; L540-L587 HydrophobicContact CD1-CG 4.34Å; L540-A590 HydrophobicContact CB-CB 4.26Å; L540-V718 HydrophobicContact CB-CG1 3.95Å; L540-V718 HydrophobicContact CD2-CG1 4.1Å; L540-C720 WeakPolarHBondContact CD2-SG 3.39Å
541	V	85.7	Confident	81.9	Confident	73 Å²	73	43.2 Å²	43.2	44%	0.442	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.8	178.3	-177.3	0	0	0	0	109.4	V718 S719 P721	V541-V718 WeakPolarHBondContact O-CA 3.46Å; V541-S719 PolarHBondContact N-O 3.49Å; V541-S719 VanDerWaalsContact N-O 3.12Å; V541-S719 PolarHBondContact O-N 2.99Å; V541-S719 PolarHBondContact O-OG 2.86Å; V541-P721 HydrophobicContact CG2-CG 4.39Å
542	V	88.4	Confident	80.9	Confident	24 Å²	24	46.5 Å²	46.5	15%	0.145	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.3	176.2	-179.4	0	0	0	0	108.8	V557 A590 M591 A594 I716 V718	V542-V557 HydrophobicContact CG1-CG2 4.2Å; V542-A590 HydrophobicContact CG2-CB 4.1Å; V542-M591 HydrophobicContact CG2-CG 4.31Å; V542-A594 HydrophobicContact CB-CB 3.83Å; V542-A594 HydrophobicContact CG1-CB 4.14Å; V542-A594 HydrophobicContact CG2-CB 3.98Å; V542-I716 HydrophobicContact CG1-CD1 4.02Å; V542-I716 HydrophobicContact CG1-CG1 4.19Å; V542-V718 HydrophobicContact CG2-CG2 4.33Å
543	R	87.8	Confident	80.8	Confident	136 Å²	136	51 Å²	51	51%	0.513	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-33.7	177.9	-164.2	179.8	-179.8	-172.7	-0.9	111.6	V554 E678 V717	R543-V554 HydrophobicContact CB-CG1 4.48Å; R543-V554 HydrophobicContact CG-CG1 4.29Å; R543-E678 IonicContact CZ-OE2 2.77Å; R543-E678 IonicContact NH1-OE2 3.18Å; R543-E678 PolarHBondContact NH1-OE2 3.15Å; R543-V717 HydrophobicContact CB-CB 4.36Å; R543-V717 HydrophobicContact CB-CG1 4.19Å; R543-V717 PolarHBondContact N-O 2.87Å
544	G	90.1	Very high	81	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.3	-156.4	178.5	0	0	0	0	0	112.3	V554 T555 V717	G544-V554 VanDerWaalsContact CA-CG1 3.49Å; G544-T555 WeakPolarHBondContact CA-O 3.46Å; G544-V717 PolarHBondContact O-N 3.38Å
545	V	89.8	Confident	81	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.4	179.9	-174.2	0	0	0	0	110.6	L548 T555 I560 T564 L568 F715	V545-L548 HydrophobicContact CB-CD1 3.92Å; V545-L548 HydrophobicContact CG1-CD1 3.65Å; V545-L548 HydrophobicContact CG1-CG 3.98Å; V545-T555 PolarHBondContact N-O 2.65Å; V545-T555 WeakPolarHBondContact O-CB 3.46Å; V545-T555 PolarHBondContact O-N 3.08Å; V545-I560 HydrophobicContact CB-CG2 4.08Å; V545-I560 HydrophobicContact CG2-CD1 4.48Å; V545-I560 HydrophobicContact CG2-CG2 3.97Å; V545-T564 HydrophobicContact CG1-CG2 4.08Å; V545-T564 HydrophobicContact CG2-CG2 4.13Å; V545-L568 HydrophobicContact CG2-CD1 4.15Å; V545-F715 CarbonylContact C-O 3.55Å; V545-F715 VanDerWaalsContact CA-O 3.24Å; V545-F715 WeakPolarHBondContact CA-O 3.37Å; V545-F715 WeakPolarHBondContact CG1-O 3.44Å
546	A	89.8	Confident	80.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	164.2	176.7	0	0	0	0	0	112.1	V554 I671 I675 G714 F715 V717	A546-V554 HydrophobicContact CB-CG2 4.44Å; A546-I671 HydrophobicContact CB-CG2 4.35Å; A546-I675 HydrophobicContact CB-CD1 3.29Å; A546-G714 WeakPolarHBondContact O-CA 3.49Å; A546-F715 HydrophobicContact CB-CB 4.35Å; A546-F715 PolarHBondContact N-O 3.04Å; A546-F715 PolarHBondContact O-N 3.43Å; A546-V717 HydrophobicContact CB-CG2 3.94Å
547	G	84.6	Confident	80.6	Confident	15 Å²	15	57.7 Å²	57.7	16%	0.155	31%	0.306	C	S	.	.	S	Bend	trans	75.9	17.9	177	0	0	0	0	0	115.1	F712	G547-F712 WeakPolarHBondContact O-CE1 3.46Å
548	L	82.4	Confident	80.6	Confident	53 Å²	53	62 Å²	62	28%	0.277	34%	0.336	S	S	.	.	S	Bend	trans	-92.8	-25.5	173.9	-71.1	171.3	0	0	0	113.2	V545 I560 P561	V545-L548 HydrophobicContact CB-CD1 3.92Å; V545-L548 HydrophobicContact CG1-CD1 3.65Å; V545-L548 HydrophobicContact CG1-CG 3.98Å; L548-I560 HydrophobicContact CD1-CB 4.33Å; L548-I560 HydrophobicContact CD1-CG2 4.12Å; L548-P561 HydrophobicContact CD1-CG 4.47Å; L548-P561 HydrophobicContact CD2-CG 4.15Å
549	R	76	Confident	81.2	Confident	158 Å²	158	61.4 Å²	61.4	60%	0.596	34%	0.337	S	S	*	.	S	Bend	trans	-122.5	161.1	176.1	-63.8	-178.5	-179.4	-178	0	108.2	G551	R549-G551 PolarHBondContact O-N 2.93Å
550	D	65.2	Low	81.9	Confident	166 Å²	166	58.7 Å²	58.7	89%	0.888	32%	0.317	S	S	*	.	S	Bend	trans	-60.1	123	174.5	-67.4	-32.8	0	0	0	109.9
551	G	64.9	Low	82.2	Confident	34 Å²	34	59.7 Å²	59.7	35%	0.351	33%	0.326	S	S	.	.	S	Bend	trans	103.2	-168	-179.5	0	0	0	0	0	116	R549	R549-G551 PolarHBondContact O-N 2.93Å
552	K	68.3	Low	82.3	Confident	69 Å²	69	60.6 Å²	60.6	30%	0.3	33%	0.327	S	S	.	.	S	Bend	trans	-88.4	-11.5	-168.9	-172.1	-174.8	-176.8	177.4	0	114.4	V554 E674 E678	K552-V554 PolarHBondContact O-N 2.93Å; K552-V554 VanDerWaalsContact O-N 3.15Å; K552-E674 HydrophobicContact CD-CG 4.28Å; K552-E674 VanDerWaalsContact CD-OE1 3.27Å; K552-E674 WeakPolarHBondContact CD-OE1 3.22Å; K552-E674 WeakPolarHBondContact CE-OE1 3.41Å; K552-E674 IonicContact NZ-OE1 2.69Å; K552-E674 PolarHBondContact NZ-OE1 3.3Å; K552-E678 WeakPolarHBondContact CE-OE1 3.31Å; K552-E678 IonicContact NZ-OE1 2.9Å; K552-E678 PolarHBondContact NZ-OE1 3.44Å
553	E	78.4	Confident	82.3	Confident	149 Å²	149	62.6 Å²	62.6	70%	0.696	34%	0.335	S	S	*	.			trans	-58.3	122.4	-170.2	-72.3	-168.1	161.6	0	0	112.3	T555	E553-T555 PolarHBondContact O-N 2.92Å
554	V	82.3	Confident	82.4	Confident	40 Å²	40	56.1 Å²	56.1	24%	0.242	31%	0.311	C	S	.	.			trans	-76.6	111.8	175.4	-177.4	0	0	0	0	107.7	R543 G544 A546 K552 V717	R543-V554 HydrophobicContact CB-CG1 4.48Å; R543-V554 HydrophobicContact CG-CG1 4.29Å; G544-V554 VanDerWaalsContact CA-CG1 3.49Å; A546-V554 HydrophobicContact CB-CG2 4.44Å; K552-V554 PolarHBondContact O-N 2.93Å; K552-V554 VanDerWaalsContact O-N 3.15Å; V554-V717 HydrophobicContact CG2-CG2 4.39Å
555	T	84.9	Confident	82.3	Confident	9 Å²	9	56.7 Å²	56.7	6%	0.055	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-73.8	126.8	177.7	-53.6	0	0	0	0	109.1	G544 V545 E553 S559 I560	G544-T555 WeakPolarHBondContact CA-O 3.46Å; V545-T555 PolarHBondContact N-O 2.65Å; V545-T555 WeakPolarHBondContact O-CB 3.46Å; V545-T555 PolarHBondContact O-N 3.08Å; E553-T555 PolarHBondContact O-N 2.92Å; T555-S559 WeakPolarHBondContact CG2-OG 3.47Å; T555-I560 HydrophobicContact CG2-CG2 4.21Å
556	P	85.5	Confident	82.3	Confident	72 Å²	72	58.3 Å²	58.3	47%	0.468	32%	0.319	S	S	.	.			trans	-66.3	147.4	178.2	24.6	-30.2	0	0	0	110.6	S558 S559	P556-S558 PolarHBondContact O-N 3.17Å; P556-S559 WeakPolarHBondContact CD-OG 3.26Å; P556-S559 WeakPolarHBondContact CG-OG 3.45Å; P556-S559 PolarHBondContact O-N 2.69Å; P556-S559 PolarHBondContact O-OG 3.07Å
557	V	82.8	Confident	82.3	Confident	21 Å²	21	58.3 Å²	58.3	13%	0.127	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-58.3	-23.4	-171.7	-174	0	0	0	0	113.3	V542 S559 I560 H565 A594 V595	V542-V557 HydrophobicContact CG1-CG2 4.2Å; V557-S559 VanDerWaalsContact C-N 3.27Å; V557-S559 PolarHBondContact O-N 3.18Å; V557-I560 HydrophobicContact CG1-CD1 4.08Å; V557-I560 WeakPolarHBondContact O-CG1 3.4Å; V557-H565 PolarHBondContact O-CE1 2.91Å; V557-H565 PolarHBondContact O-NE2 3.44Å; V557-A594 VanDerWaalsContact CG1-O 3.31Å; V557-A594 WeakPolarHBondContact CG1-O 3.37Å; V557-A594 HydrophobicContact CG2-CB 4.45Å; V557-V595 HydrophobicContact CG1-CB 4.06Å; V557-V595 HydrophobicContact CG1-CG1 4.4Å; V557-V595 HydrophobicContact CG1-CG2 3.6Å
558	S	81.1	Confident	82.6	Confident	107 Å²	107	58 Å²	58	75%	0.748	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-70.6	-17.5	175.8	52.9	0	0	0	0	114.9	P556	P556-S558 PolarHBondContact O-N 3.17Å
559	S	83.7	Confident	82.9	Confident	57 Å²	57	55.4 Å²	55.4	40%	0.399	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-120.1	13.9	-171.3	63.3	0	0	0	0	113.8	T555 P556 V557	T555-S559 WeakPolarHBondContact CG2-OG 3.47Å; P556-S559 WeakPolarHBondContact CD-OG 3.26Å; P556-S559 WeakPolarHBondContact CG-OG 3.45Å; P556-S559 PolarHBondContact O-N 2.69Å; P556-S559 PolarHBondContact O-OG 3.07Å; V557-S559 VanDerWaalsContact C-N 3.27Å; V557-S559 PolarHBondContact O-N 3.18Å
560	I	86.6	Confident	83.5	Confident	12 Å²	12	47.9 Å²	47.9	6%	0.062	27%	0.273	C	S	.	.			trans	-80.1	152.9	-178.5	66.4	-176.2	0	0	0	111.7	V545 L548 T555 V557 T564 H565 L568	V545-I560 HydrophobicContact CB-CG2 4.08Å; V545-I560 HydrophobicContact CG2-CD1 4.48Å; V545-I560 HydrophobicContact CG2-CG2 3.97Å; L548-I560 HydrophobicContact CD1-CB 4.33Å; L548-I560 HydrophobicContact CD1-CG2 4.12Å; T555-I560 HydrophobicContact CG2-CG2 4.21Å; V557-I560 HydrophobicContact CG1-CD1 4.08Å; V557-I560 WeakPolarHBondContact O-CG1 3.4Å; I560-T564 HydrophobicContact CB-CG2 4.43Å; I560-T564 HydrophobicContact CD1-CG2 4.14Å; I560-H565 WeakPolarHBondContact CG1-CD2 3.34Å; I560-H565 WeakPolarHBondContact CG1-NE2 3.38Å; I560-H565 PolarHBondContact O-CD2 3.19Å; I560-L568 HydrophobicContact CD1-CD1 4Å
561	P	88.6	Confident	84.7	Confident	59 Å²	59	40.1 Å²	40.1	38%	0.383	23%	0.231	S	C	.	.			trans	-60.9	155.5	176	-24.4	34.7	0	0	0	113.7	L548 E563 T564 H565	L548-P561 HydrophobicContact CD1-CG 4.47Å; L548-P561 HydrophobicContact CD2-CG 4.15Å; P561-E563 VanDerWaalsContact C-N 3.28Å; P561-E563 PolarHBondContact O-N 2.9Å; P561-T564 WeakPolarHBondContact O-CB 3.37Å; P561-T564 PolarHBondContact O-N 3.19Å; P561-T564 VanDerWaalsContact O-N 3.15Å; P561-H565 PolarHBondContact O-N 3.35Å
562	I	86.7	Confident	85.9	Confident	91 Å²	91	38.6 Å²	38.6	47%	0.467	22%	0.215	S	C	.	.	H	α-helix	trans	-58.9	-38.5	-179.7	-63.8	170.4	0	0	0	111.7	T564 H565 R566 T612	I562-T564 PolarHBondContact O-N 2.85Å; I562-H565 WeakPolarHBondContact O-CB 3.39Å; I562-H565 PolarHBondContact O-N 2.91Å; I562-R566 HydrophobicContact CG2-CG 4.31Å; I562-R566 WeakPolarHBondContact O-CB 3.49Å; I562-R566 VanDerWaalsContact O-CG 3.31Å; I562-R566 WeakPolarHBondContact O-CG 3.42Å; I562-R566 PolarHBondContact O-N 3.45Å; I562-T612 HydrophobicContact CG2-CG2 4.41Å
563	E	88.4	Confident	86.7	Confident	66 Å²	66	36.8 Å²	36.8	31%	0.308	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-44.8	178	-61	172	173.5	0	0	111.5	P561 R566 A567 Y687 K711 V713	P561-E563 VanDerWaalsContact C-N 3.28Å; P561-E563 PolarHBondContact O-N 2.9Å; E563-R566 PolarHBondContact O-N 2.74Å; E563-A567 WeakPolarHBondContact O-CB 3.48Å; E563-A567 PolarHBondContact O-N 2.74Å; E563-Y687 HydrophobicContact CB-CD1 4.36Å; E563-Y687 HydrophobicContact CB-CE1 4.44Å; E563-Y687 HydrophobicContact CG-CD1 4.45Å; E563-Y687 HydrophobicContact CG-CE1 4.2Å; E563-K711 IonicContact OE1-NZ 2.89Å; E563-K711 PolarHBondContact OE1-NZ 3.18Å; E563-K711 WeakPolarHBondContact OE2-CE 3.36Å; E563-K711 IonicContact OE2-NZ 2.72Å; E563-K711 PolarHBondContact OE2-NZ 3.27Å; E563-V713 HydrophobicContact CB-CG1 4.16Å
564	T	90	Very high	87.1	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-42.3	175.9	-49.9	0	0	0	0	111.5	V545 I560 P561 I562 R566 A567 L568 L685 V713	V545-T564 HydrophobicContact CG1-CG2 4.08Å; V545-T564 HydrophobicContact CG2-CG2 4.13Å; I560-T564 HydrophobicContact CB-CG2 4.43Å; I560-T564 HydrophobicContact CD1-CG2 4.14Å; P561-T564 WeakPolarHBondContact O-CB 3.37Å; P561-T564 PolarHBondContact O-N 3.19Å; P561-T564 VanDerWaalsContact O-N 3.15Å; I562-T564 PolarHBondContact O-N 2.85Å; T564-R566 PolarHBondContact O-N 3.41Å; T564-A567 PolarHBondContact O-N 3.35Å; T564-L568 HydrophobicContact CG2-CD1 4.25Å; T564-L568 WeakPolarHBondContact O-CG 3.41Å; T564-L568 PolarHBondContact O-N 3.35Å; T564-L685 HydrophobicContact CG2-CD1 4.01Å; T564-V713 VanDerWaalsContact CG2-O 3.31Å; T564-V713 WeakPolarHBondContact CG2-O 3.43Å; T564-V713 PolarHBondContact OG1-O 3.3Å
565	H	88.6	Confident	87	Confident	11 Å²	11	29 Å²	29	5%	0.051	17%	0.172	C	C	.	.	H	α-helix	trans	-55.9	-49.3	173.1	-94.8	-63.2	0	0	0	111.5	V557 I560 P561 I562 L568 A569 V595 I610	V557-H565 PolarHBondContact O-CE1 2.91Å; V557-H565 PolarHBondContact O-NE2 3.44Å; I560-H565 WeakPolarHBondContact CG1-CD2 3.34Å; I560-H565 WeakPolarHBondContact CG1-NE2 3.38Å; I560-H565 PolarHBondContact O-CD2 3.19Å; P561-H565 PolarHBondContact O-N 3.35Å; I562-H565 WeakPolarHBondContact O-CB 3.39Å; I562-H565 PolarHBondContact O-N 2.91Å; H565-L568 PolarHBondContact O-N 3.47Å; H565-A569 VanDerWaalsContact O-CB 3.23Å; H565-A569 WeakPolarHBondContact O-CB 3.29Å; H565-A569 PolarHBondContact O-N 3.28Å; H565-V595 WeakPolarHBondContact ND1-CG1 3.45Å; H565-I610 WeakPolarHBondContact CE1-CD1 3.36Å; H565-I610 WeakPolarHBondContact NE2-CD1 3.41Å
566	R	89.2	Confident	87	Confident	34 Å²	34	31.2 Å²	31.2	13%	0.128	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-44.8	179.1	-72	174.7	178	173.6	-2	111.2	I562 E563 T564 L568 A569 S570 L615 Y636 I647 Y687	I562-R566 HydrophobicContact CG2-CG 4.31Å; I562-R566 WeakPolarHBondContact O-CB 3.49Å; I562-R566 VanDerWaalsContact O-CG 3.31Å; I562-R566 WeakPolarHBondContact O-CG 3.42Å; I562-R566 PolarHBondContact O-N 3.45Å; E563-R566 PolarHBondContact O-N 2.74Å; T564-R566 PolarHBondContact O-N 3.41Å; R566-L568 PolarHBondContact O-N 2.81Å; R566-A569 PolarHBondContact O-N 3.18Å; R566-S570 WeakPolarHBondContact O-CB 3.2Å; R566-S570 PolarHBondContact O-N 3.47Å; R566-S570 PolarHBondContact O-OG 2.86Å; R566-L615 HydrophobicContact CB-CD1 4.26Å; R566-L615 HydrophobicContact CG-CD1 4.19Å; R566-Y636 PolarHBondContact NH1-OH 3.37Å; R566-Y636 VanDerWaalsContact NH1-OH 3.13Å; R566-I647 HydrophobicContact CB-CD1 4.31Å; R566-Y687 HydrophobicContact CB-CE2 4.35Å
567	A	90.6	Very high	86.7	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-44	179.1	0	0	0	0	0	112.4	E563 T564 C571 A649 V713	E563-A567 WeakPolarHBondContact O-CB 3.48Å; E563-A567 PolarHBondContact O-N 2.74Å; T564-A567 PolarHBondContact O-N 3.35Å; A567-C571 WeakPolarHBondContact O-CB 3.13Å; A567-C571 PolarHBondContact O-N 3.47Å; A567-A649 HydrophobicContact CB-CB 4.31Å; A567-V713 HydrophobicContact CB-CG2 4.07Å
568	L	89.9	Confident	86.3	Confident	7 Å²	7	31.8 Å²	31.8	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-38.1	176.9	-72.4	173.4	0	0	0	112.8	V545 I560 T564 H565 R566 M591 V595 L685 I716	V545-L568 HydrophobicContact CG2-CD1 4.15Å; I560-L568 HydrophobicContact CD1-CD1 4Å; T564-L568 HydrophobicContact CG2-CD1 4.25Å; T564-L568 WeakPolarHBondContact O-CG 3.41Å; T564-L568 PolarHBondContact O-N 3.35Å; H565-L568 PolarHBondContact O-N 3.47Å; R566-L568 PolarHBondContact O-N 2.81Å; L568-M591 HydrophobicContact CD2-SD 4.49Å; L568-V595 HydrophobicContact CB-CG2 3.99Å; L568-V595 HydrophobicContact CD1-CG2 3.77Å; L568-V595 HydrophobicContact CG-CG2 4.5Å; L568-L685 HydrophobicContact CD1-CD1 4.37Å; L568-L685 HydrophobicContact CD2-CD1 3.68Å; L568-L685 HydrophobicContact CD2-CD2 3.85Å; L568-L685 HydrophobicContact CD2-CG 4.41Å; L568-L685 HydrophobicContact CG-CD1 3.86Å; L568-I716 HydrophobicContact CD1-CD1 4.06Å; L568-I716 HydrophobicContact CD2-CB 4.38Å; L568-I716 HydrophobicContact CD2-CD1 3.44Å; L568-I716 VanDerWaalsContact CD2-CD1 3.44Å; L568-I716 HydrophobicContact CG-CD1 4.42Å
569	A	89.1	Confident	86	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-76.1	-31	-179.1	0	0	0	0	0	113.5	H565 R566 H572 W597 L615	H565-A569 VanDerWaalsContact O-CB 3.23Å; H565-A569 WeakPolarHBondContact O-CB 3.29Å; H565-A569 PolarHBondContact O-N 3.28Å; R566-A569 PolarHBondContact O-N 3.18Å; A569-H572 PolarHBondContact O-CD2 3.42Å; A569-H572 PolarHBondContact O-NE2 3.29Å; A569-H572 VanDerWaalsContact O-NE2 3.11Å; A569-W597 HydrophobicContact CB-CB 4.38Å; A569-W597 HydrophobicContact CB-CD2 3.4Å; A569-W597 HydrophobicContact CB-CE3 3.49Å; A569-W597 VanDerWaalsContact CB-CE3 3.49Å; A569-W597 HydrophobicContact CB-CG 3.84Å; A569-W597 HydrophobicContact CB-CH2 4.28Å; A569-W597 HydrophobicContact CB-CZ2 4.22Å; A569-W597 HydrophobicContact CB-CZ3 3.95Å; A569-L615 HydrophobicContact CB-CD1 4.27Å
570	S	89.6	Confident	85.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-93.2	-33.5	-179.5	65.5	0	0	0	0	113.4	R566 H572 V632 A649	R566-S570 WeakPolarHBondContact O-CB 3.2Å; R566-S570 PolarHBondContact O-N 3.47Å; R566-S570 PolarHBondContact O-OG 2.86Å; S570-H572 PolarHBondContact O-N 2.88Å; S570-V632 WeakPolarHBondContact O-CG1 3.41Å; S570-A649 VanDerWaalsContact OG-CB 3.23Å; S570-A649 WeakPolarHBondContact OG-CB 3.42Å
571	C	90.2	Very high	85.3	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.014	19%	0.19	C	C	.	.	S	Bend	trans	-85.6	75.6	-173.7	-158.1	0	0	0	0	111.2	A567 A649 K651	A567-C571 WeakPolarHBondContact O-CB 3.13Å; A567-C571 PolarHBondContact O-N 3.47Å; C571-A649 HydrophobicContact CB-CB 3.89Å; C571-A649 PolarHBondContact SG-O 2.91Å; C571-A649 VanDerWaalsContact SG-O 3.35Å; C571-K651 HydrophobicContact CB-CD 4.31Å; C571-K651 HydrophobicContact CB-CG 4.49Å; C571-K651 WeakPolarHBondContact O-CD 3.41Å; C571-K651 WeakPolarHBondContact O-CE 3.24Å; C571-K651 PolarHBondContact O-NZ 3.07Å
572	H	89.3	Confident	84.9	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.009	18%	0.181	C	C	.	.			trans	-148	156.1	173.8	65.4	67.8	0	0	0	111.4	A569 S570 L574 E588 R620	A569-H572 PolarHBondContact O-CD2 3.42Å; A569-H572 PolarHBondContact O-NE2 3.29Å; A569-H572 VanDerWaalsContact O-NE2 3.11Å; S570-H572 PolarHBondContact O-N 2.88Å; H572-L574 HydrophobicContact CB-CB 4.45Å; H572-L574 HydrophobicContact CB-CD1 4.01Å; H572-L574 HydrophobicContact CB-CG 4.07Å; H572-L574 WeakPolarHBondContact ND1-CB 3.31Å; H572-L574 PolarHBondContact ND1-N 2.92Å; H572-E588 WeakPolarHBondContact CA-OE2 3.5Å; H572-E588 HydrophobicContact CB-CB 4.27Å; H572-E588 WeakPolarHBondContact CB-OE2 3.39Å; H572-R620 WeakPolarHBondContact O-CD 3.37Å; H572-R620 PolarHBondContact O-NE 3.44Å
573	S	84.8	Confident	84.5	Confident	32 Å²	32	29.4 Å²	29.4	22%	0.224	16%	0.164	C	C	.	.			trans	-97.9	7.4	169.1	60.7	0	0	0	0	113	E588	S573-E588 PolarHBondContact N-OE2 3.33Å; S573-E588 PolarHBondContact OG-OE2 3.48Å; S573-E588 VanDerWaalsContact OG-OE2 3.12Å
574	L	86.3	Confident	83.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.156	C	C	.	.			trans	-55.9	148.9	174.4	-58.7	162.8	0	0	0	112.5	H572 L582 V583 E588 K589 L592 L599	H572-L574 HydrophobicContact CB-CB 4.45Å; H572-L574 HydrophobicContact CB-CD1 4.01Å; H572-L574 HydrophobicContact CB-CG 4.07Å; H572-L574 WeakPolarHBondContact ND1-CB 3.31Å; H572-L574 PolarHBondContact ND1-N 2.92Å; L574-L582 HydrophobicContact CB-CD1 4.11Å; L574-L582 HydrophobicContact CB-CG 4.5Å; L574-L582 HydrophobicContact CD1-CD2 4.22Å; L574-L582 HydrophobicContact CD2-CG 4.48Å; L574-V583 WeakPolarHBondContact CA-O 2.97Å; L574-E588 HydrophobicContact CD1-CB 4.03Å; L574-E588 HydrophobicContact CD2-CB 4.05Å; L574-E588 HydrophobicContact CG-CB 3.87Å; L574-E588 PolarHBondContact N-OE2 2.92Å; L574-K589 HydrophobicContact CD2-CB 3.91Å; L574-L592 HydrophobicContact CD1-CB 3.71Å; L574-L592 HydrophobicContact CD1-CD2 3.64Å; L574-L592 HydrophobicContact CD1-CG 4.26Å; L574-L599 VanDerWaalsContact C-CD2 3.5Å; L574-L599 HydrophobicContact CB-CD2 4.21Å; L574-L599 WeakPolarHBondContact O-CD2 3.24Å
575	M	81.4	Confident	83.3	Confident	24 Å²	24	29.9 Å²	29.9	12%	0.118	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	153.5	178.8	-54.5	-148.1	114	0	0	110.8	I343 M357 V583	I343-M575 HydrophobicContact CD1-CB 4.34Å; I343-M575 HydrophobicContact CD1-SD 3.95Å; I343-M575 HydrophobicContact CG1-SD 4.34Å; M357-M575 HydrophobicContact CB-SD 4.17Å; M357-M575 HydrophobicContact CE-CE 3.2Å; M357-M575 HydrophobicContact CE-SD 3.36Å; M357-M575 WeakPolarHBondContact CE-SD 3.26Å; M357-M575 HydrophobicContact CG-SD 3.9Å; M357-M575 HydrophobicContact SD-CE 3.27Å; M357-M575 WeakPolarHBondContact SD-CE 3.36Å; M357-M575 HydrophobicContact SD-SD 3.32Å; M575-V583 PolarHBondContact N-O 3.42Å; M575-V583 PolarHBondContact O-N 3.15Å
576	Q	83.6	Confident	82.7	Confident	56 Å²	56	31.9 Å²	31.9	26%	0.262	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.9	173.4	-167.4	177.8	36.4	0	0	109.9	G580 T581 L599	Q576-G580 PolarHBondContact NE2-O 3.35Å; Q576-G580 VanDerWaalsContact NE2-O 3.08Å; Q576-T581 WeakPolarHBondContact CA-O 3.26Å; Q576-L599 PolarHBondContact OE1-O 3.49Å; Q576-L599 VanDerWaalsContact OE1-O 3.12Å
577	L	79.4	Confident	82.3	Confident	18 Å²	18	30.7 Å²	30.7	9%	0.094	18%	0.182	C	C	.	.			trans	-71.9	169.6	174.3	-72.6	-174	0	0	0	111.7	I343 V388 Q389 D579 G580 T581 V583	I343-L577 HydrophobicContact CD1-CD2 3.95Å; V388-L577 HydrophobicContact CG1-CD1 3.77Å; V388-L577 HydrophobicContact CG1-CD2 3.83Å; Q389-L577 HydrophobicContact CB-CD2 4.25Å; L577-D579 WeakPolarHBondContact CB-OD1 3.17Å; L577-D579 PolarHBondContact O-N 3.21Å; L577-G580 PolarHBondContact O-N 3.38Å; L577-T581 WeakPolarHBondContact CD1-OG1 3.39Å; L577-T581 PolarHBondContact N-O 3.46Å; L577-V583 HydrophobicContact CD1-CG2 3.52Å; L577-V583 HydrophobicContact CG-CB 4.26Å; L577-V583 HydrophobicContact CG-CG2 3.59Å
578	D	75.9	Confident	82.1	Confident	87 Å²	87	31 Å²	31	47%	0.465	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.4	-178	-78	-40.9	0	0	0	114.7	Q389 G580 K601	Q389-D578 PolarHBondContact NE2-OD1 3.5Å; Q389-D578 PolarHBondContact NE2-OD2 2.82Å; D578-G580 PolarHBondContact O-N 3.06Å; D578-K601 PolarHBondContact O-NZ 2.9Å; D578-K601 IonicContact OD1-NZ 3.83Å; D578-K601 PolarHBondContact OD1-NZ 3.43Å
579	D	74.5	Confident	81.9	Confident	115 Å²	115	34.9 Å²	34.9	62%	0.615	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	1.2	175	61.7	2.3	0	0	0	113.4	L577 T581	L577-D579 WeakPolarHBondContact CB-OD1 3.17Å; L577-D579 PolarHBondContact O-N 3.21Å; D579-T581 VanDerWaalsContact C-N 3.3Å; D579-T581 WeakPolarHBondContact OD1-CB 3.49Å; D579-T581 WeakPolarHBondContact OD1-CG2 3.44Å; D579-T581 PolarHBondContact OD1-N 3.13Å; D579-T581 PolarHBondContact OD1-OG1 3.45Å; D579-T581 PolarHBondContact OD2-OG1 3.35Å
580	G	74.4	Confident	81.8	Confident	38 Å²	38	35.8 Å²	35.8	39%	0.392	21%	0.208	S	C	.	.	S	Bend	trans	83.9	-0.6	-179.2	0	0	0	0	0	114.2	Q576 L577 D578	Q576-G580 PolarHBondContact NE2-O 3.35Å; Q576-G580 VanDerWaalsContact NE2-O 3.08Å; L577-G580 PolarHBondContact O-N 3.38Å; D578-G580 PolarHBondContact O-N 3.06Å
581	T	80.2	Confident	81.7	Confident	65 Å²	65	36 Å²	36	40%	0.399	21%	0.209	S	C	.	.			trans	-74.2	137.7	178.9	64.1	0	0	0	0	111.5	Q576 L577 D579	Q576-T581 WeakPolarHBondContact CA-O 3.26Å; L577-T581 WeakPolarHBondContact CD1-OG1 3.39Å; L577-T581 PolarHBondContact N-O 3.46Å; D579-T581 VanDerWaalsContact C-N 3.3Å; D579-T581 WeakPolarHBondContact OD1-CB 3.49Å; D579-T581 WeakPolarHBondContact OD1-CG2 3.44Å; D579-T581 PolarHBondContact OD1-N 3.13Å; D579-T581 PolarHBondContact OD1-OG1 3.45Å; D579-T581 PolarHBondContact OD2-OG1 3.35Å
582	L	80.8	Confident	81.7	Confident	37 Å²	37	36 Å²	36	19%	0.194	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.6	177.3	-171.5	75.7	0	0	0	110.1	L574 K589 L592 L599	L574-L582 HydrophobicContact CB-CD1 4.11Å; L574-L582 HydrophobicContact CB-CG 4.5Å; L574-L582 HydrophobicContact CD1-CD2 4.22Å; L574-L582 HydrophobicContact CD2-CG 4.48Å; L582-K589 HydrophobicContact CD2-CG 4.21Å; L582-K589 PolarHBondContact O-NZ 3.08Å; L582-L592 HydrophobicContact CD1-CD2 4.44Å; L582-L592 HydrophobicContact CD2-CD2 3.94Å; L582-L599 HydrophobicContact CD1-CB 3.97Å; L582-L599 HydrophobicContact CD1-CD2 3.98Å
583	V	77.4	Confident	81.6	Confident	21 Å²	21	40.2 Å²	40.2	13%	0.127	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.5	-171.7	176.1	0	0	0	0	110.4	P355 L574 M575 L577	P355-V583 HydrophobicContact CB-CG1 3.59Å; P355-V583 HydrophobicContact CG-CG1 3.5Å; L574-V583 WeakPolarHBondContact CA-O 2.97Å; M575-V583 PolarHBondContact N-O 3.42Å; M575-V583 PolarHBondContact O-N 3.15Å; L577-V583 HydrophobicContact CD1-CG2 3.52Å; L577-V583 HydrophobicContact CG-CB 4.26Å; L577-V583 HydrophobicContact CG-CG2 3.59Å
584	G	76.4	Confident	81.7	Confident	13 Å²	13	40.7 Å²	40.7	13%	0.134	24%	0.241	C	C	.	.	S	Bend	trans	138.8	-171.6	-179.1	0	0	0	0	0	110.8	V354	V354-G584 WeakPolarHBondContact CG1-O 3.36Å
585	D	76.8	Confident	81.7	Confident	64 Å²	64	41 Å²	41	34%	0.342	24%	0.243	S	C	.	.			trans	-52.8	124.8	-172.4	-178.7	-13	0	0	0	111.3	L587 E588 K589	D585-L587 PolarHBondContact O-N 3.07Å; D585-L587 VanDerWaalsContact O-N 3.12Å; D585-L587 WeakPolarHBondContact OD1-CB 3.4Å; D585-L587 PolarHBondContact OD1-N 3.24Å; D585-E588 HydrophobicContact CB-CB 4.31Å; D585-E588 HydrophobicContact CB-CG 3.84Å; D585-E588 WeakPolarHBondContact O-CB 3.41Å; D585-E588 PolarHBondContact O-N 2.84Å; D585-K589 PolarHBondContact O-N 3.02Å
586	P	76.8	Confident	82	Confident	54 Å²	54	42.8 Å²	42.8	35%	0.351	25%	0.253	S	S	.	.	H	α-helix	trans	-53.9	-32.3	179.2	-27.2	34.7	0	0	0	112.7	V354 L540 K589 A590	V354-P586 VanDerWaalsContact CG2-CD 3.41Å; V354-P586 HydrophobicContact CG2-CG 3.51Å; L540-P586 HydrophobicContact CD1-CB 4.37Å; P586-K589 PolarHBondContact O-N 3.37Å; P586-A590 VanDerWaalsContact O-CB 3.28Å; P586-A590 WeakPolarHBondContact O-CB 3.24Å; P586-A590 PolarHBondContact O-N 3.1Å
587	L	81.5	Confident	82.3	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-48.8	175.9	178	66.7	0	0	0	110.6	L540 D585 A590 M591 L683 V718	L540-L587 HydrophobicContact CD1-CB 3.57Å; L540-L587 HydrophobicContact CD1-CD1 3.91Å; L540-L587 HydrophobicContact CD1-CG 4.34Å; D585-L587 PolarHBondContact O-N 3.07Å; D585-L587 VanDerWaalsContact O-N 3.12Å; D585-L587 WeakPolarHBondContact OD1-CB 3.4Å; D585-L587 PolarHBondContact OD1-N 3.24Å; L587-A590 PolarHBondContact O-N 2.91Å; L587-M591 HydrophobicContact CD1-CE 3.57Å; L587-M591 HydrophobicContact CD2-CE 4.09Å; L587-M591 HydrophobicContact CG-CE 3.56Å; L587-M591 VanDerWaalsContact O-CG 3.24Å; L587-M591 WeakPolarHBondContact O-CG 3.37Å; L587-M591 PolarHBondContact O-N 3.16Å; L587-L683 HydrophobicContact CD2-CD1 3.82Å; L587-V718 HydrophobicContact CD1-CB 4.03Å; L587-V718 HydrophobicContact CD1-CG1 3.74Å; L587-V718 HydrophobicContact CD1-CG2 3.76Å
588	E	86.8	Confident	82.6	Confident	8 Å²	8	42 Å²	42	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-68.9	-38.3	178.7	-56.6	-169	150.6	0	0	111.6	H572 S573 L574 D585 A590 M591 L592 K651	H572-E588 WeakPolarHBondContact CA-OE2 3.5Å; H572-E588 HydrophobicContact CB-CB 4.27Å; H572-E588 WeakPolarHBondContact CB-OE2 3.39Å; S573-E588 PolarHBondContact N-OE2 3.33Å; S573-E588 PolarHBondContact OG-OE2 3.48Å; S573-E588 VanDerWaalsContact OG-OE2 3.12Å; L574-E588 HydrophobicContact CD1-CB 4.03Å; L574-E588 HydrophobicContact CD2-CB 4.05Å; L574-E588 HydrophobicContact CG-CB 3.87Å; L574-E588 PolarHBondContact N-OE2 2.92Å; D585-E588 HydrophobicContact CB-CB 4.31Å; D585-E588 HydrophobicContact CB-CG 3.84Å; D585-E588 WeakPolarHBondContact O-CB 3.41Å; D585-E588 PolarHBondContact O-N 2.84Å; E588-A590 VanDerWaalsContact C-N 3.31Å; E588-A590 PolarHBondContact O-N 2.83Å; E588-M591 WeakPolarHBondContact O-CB 3.35Å; E588-M591 PolarHBondContact O-N 3.16Å; E588-M591 VanDerWaalsContact O-N 3.15Å; E588-L592 PolarHBondContact O-N 2.88Å; E588-K651 VanDerWaalsContact CG-NZ 3.27Å; E588-K651 WeakPolarHBondContact OE1-CE 3.28Å; E588-K651 IonicContact OE1-NZ 3.7Å; E588-K651 PolarHBondContact OE1-NZ 3.45Å
589	K	85.4	Confident	83.2	Confident	88 Å²	88	38.2 Å²	38.2	38%	0.383	23%	0.231	S	C	.	.	H	α-helix	trans	-60.4	-44.5	175.3	-178.6	169.3	-179.5	166.8	0	110.5	L574 L582 D585 P586 M591 L592 T593	L574-K589 HydrophobicContact CD2-CB 3.91Å; L582-K589 HydrophobicContact CD2-CG 4.21Å; L582-K589 PolarHBondContact O-NZ 3.08Å; D585-K589 PolarHBondContact O-N 3.02Å; P586-K589 PolarHBondContact O-N 3.37Å; K589-M591 VanDerWaalsContact C-N 3.33Å; K589-L592 PolarHBondContact O-N 3.15Å; K589-T593 VanDerWaalsContact O-CB 3.23Å; K589-T593 WeakPolarHBondContact O-CB 3.48Å; K589-T593 PolarHBondContact O-N 3.37Å; K589-T593 PolarHBondContact O-OG1 3.11Å
590	A	85.4	Confident	83.8	Confident	20 Å²	20	34.7 Å²	34.7	17%	0.165	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-41.3	174.6	0	0	0	0	0	111.2	L540 V542 P586 L587 E588 A594	L540-A590 HydrophobicContact CB-CB 4.26Å; V542-A590 HydrophobicContact CG2-CB 4.1Å; P586-A590 VanDerWaalsContact O-CB 3.28Å; P586-A590 WeakPolarHBondContact O-CB 3.24Å; P586-A590 PolarHBondContact O-N 3.1Å; L587-A590 PolarHBondContact O-N 2.91Å; E588-A590 VanDerWaalsContact C-N 3.31Å; E588-A590 PolarHBondContact O-N 2.83Å; A590-A594 WeakPolarHBondContact O-CB 3.27Å; A590-A594 PolarHBondContact O-N 3.42Å
591	M	89.1	Confident	83.9	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-52	175	-65.7	173.3	-174.4	0	0	112.5	V542 L568 L587 E588 K589 T593 A594 V595 L683 I716 V718	V542-M591 HydrophobicContact CG2-CG 4.31Å; L568-M591 HydrophobicContact CD2-SD 4.49Å; L587-M591 HydrophobicContact CD1-CE 3.57Å; L587-M591 HydrophobicContact CD2-CE 4.09Å; L587-M591 HydrophobicContact CG-CE 3.56Å; L587-M591 VanDerWaalsContact O-CG 3.24Å; L587-M591 WeakPolarHBondContact O-CG 3.37Å; L587-M591 PolarHBondContact O-N 3.16Å; E588-M591 WeakPolarHBondContact O-CB 3.35Å; E588-M591 PolarHBondContact O-N 3.16Å; E588-M591 VanDerWaalsContact O-N 3.15Å; K589-M591 VanDerWaalsContact C-N 3.33Å; M591-T593 VanDerWaalsContact C-N 3.3Å; M591-T593 PolarHBondContact O-N 3.49Å; M591-A594 PolarHBondContact O-N 2.87Å; M591-V595 WeakPolarHBondContact O-CG2 3.45Å; M591-V595 PolarHBondContact O-N 2.86Å; M591-L683 HydrophobicContact CE-CD1 3.68Å; M591-I716 HydrophobicContact CB-CD1 4.3Å; M591-I716 HydrophobicContact CE-CD1 4.12Å; M591-I716 HydrophobicContact CE-CG1 4.34Å; M591-I716 HydrophobicContact CE-CG2 3.84Å; M591-I716 HydrophobicContact CG-CD1 3.58Å; M591-I716 HydrophobicContact SD-CD1 4Å; M591-V718 HydrophobicContact CE-CG2 3.96Å
592	L	89.3	Confident	83.8	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-38.3	-178.1	-168.3	71.8	0	0	0	111.5	L574 L582 E588 K589 V595 D596 W597 L599 V605	L574-L592 HydrophobicContact CD1-CB 3.71Å; L574-L592 HydrophobicContact CD1-CD2 3.64Å; L574-L592 HydrophobicContact CD1-CG 4.26Å; L582-L592 HydrophobicContact CD1-CD2 4.44Å; L582-L592 HydrophobicContact CD2-CD2 3.94Å; E588-L592 PolarHBondContact O-N 2.88Å; K589-L592 PolarHBondContact O-N 3.15Å; L592-V595 PolarHBondContact O-N 3.17Å; L592-D596 PolarHBondContact O-N 3.04Å; L592-W597 HydrophobicContact CD1-CB 3.67Å; L592-W597 HydrophobicContact CG-CB 4.32Å; L592-W597 PolarHBondContact O-N 3.14Å; L592-L599 HydrophobicContact CD2-CB 4.31Å; L592-V605 HydrophobicContact CD1-CG1 4.11Å
593	T	87.5	Confident	83.9	Confident	92 Å²	92	41 Å²	41	56%	0.564	23%	0.229	S	C	*	.	H	α-helix	trans	-68	-40.6	175.7	-51.7	0	0	0	0	111.3	K589 M591 V595 D596	K589-T593 VanDerWaalsContact O-CB 3.23Å; K589-T593 WeakPolarHBondContact O-CB 3.48Å; K589-T593 PolarHBondContact O-N 3.37Å; K589-T593 PolarHBondContact O-OG1 3.11Å; M591-T593 VanDerWaalsContact C-N 3.3Å; M591-T593 PolarHBondContact O-N 3.49Å; T593-V595 VanDerWaalsContact C-N 3.31Å; T593-V595 PolarHBondContact O-N 2.89Å; T593-D596 PolarHBondContact O-N 2.87Å
594	A	87	Confident	84.3	Confident	42 Å²	42	43.7 Å²	43.7	35%	0.347	24%	0.239	S	C	.	.	H	α-helix	trans	-66.6	-33.2	178.1	0	0	0	0	0	112.7	V542 V557 A590 M591 D596	V542-A594 HydrophobicContact CB-CB 3.83Å; V542-A594 HydrophobicContact CG1-CB 4.14Å; V542-A594 HydrophobicContact CG2-CB 3.98Å; V557-A594 VanDerWaalsContact CG1-O 3.31Å; V557-A594 WeakPolarHBondContact CG1-O 3.37Å; V557-A594 HydrophobicContact CG2-CB 4.45Å; A590-A594 WeakPolarHBondContact O-CB 3.27Å; A590-A594 PolarHBondContact O-N 3.42Å; M591-A594 PolarHBondContact O-N 2.87Å; A594-D596 VanDerWaalsContact C-N 3.29Å
595	V	86.5	Confident	84.8	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-82.3	-9.9	178.2	-172.2	0	0	0	0	112.1	V557 H565 L568 M591 L592 T593 W597	V557-V595 HydrophobicContact CG1-CB 4.06Å; V557-V595 HydrophobicContact CG1-CG1 4.4Å; V557-V595 HydrophobicContact CG1-CG2 3.6Å; H565-V595 WeakPolarHBondContact ND1-CG1 3.45Å; L568-V595 HydrophobicContact CB-CG2 3.99Å; L568-V595 HydrophobicContact CD1-CG2 3.77Å; L568-V595 HydrophobicContact CG-CG2 4.5Å; M591-V595 WeakPolarHBondContact O-CG2 3.45Å; M591-V595 PolarHBondContact O-N 2.86Å; L592-V595 PolarHBondContact O-N 3.17Å; T593-V595 VanDerWaalsContact C-N 3.31Å; T593-V595 PolarHBondContact O-N 2.89Å; V595-W597 VanDerWaalsContact O-CD1 3.26Å
596	D	87.8	Confident	85.4	Confident	62 Å²	62	44.3 Å²	44.3	33%	0.332	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	46.6	-180	-163.5	35	0	0	0	113.9	L592 T593 A594 R608 S609	L592-D596 PolarHBondContact O-N 3.04Å; T593-D596 PolarHBondContact O-N 2.87Å; A594-D596 VanDerWaalsContact C-N 3.29Å; D596-R608 PolarHBondContact O-N 2.83Å; D596-R608 VanDerWaalsContact OD1-CD 3.27Å; D596-R608 WeakPolarHBondContact OD1-CD 3.42Å; D596-R608 WeakPolarHBondContact OD2-CB 3.48Å; D596-S609 WeakPolarHBondContact OD2-CB 3.24Å
597	W	88.6	Confident	85.8	Confident	12 Å²	12	42.9 Å²	42.9	5%	0.045	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	151.8	173	-76.5	54.2	0	0	0	111	A569 L592 V595 V605 P607 L615	A569-W597 HydrophobicContact CB-CB 4.38Å; A569-W597 HydrophobicContact CB-CD2 3.4Å; A569-W597 HydrophobicContact CB-CE3 3.49Å; A569-W597 VanDerWaalsContact CB-CE3 3.49Å; A569-W597 HydrophobicContact CB-CG 3.84Å; A569-W597 HydrophobicContact CB-CH2 4.28Å; A569-W597 HydrophobicContact CB-CZ2 4.22Å; A569-W597 HydrophobicContact CB-CZ3 3.95Å; L592-W597 HydrophobicContact CD1-CB 3.67Å; L592-W597 HydrophobicContact CG-CB 4.32Å; L592-W597 PolarHBondContact O-N 3.14Å; V595-W597 VanDerWaalsContact O-CD1 3.26Å; W597-V605 HydrophobicContact CB-CG1 4.04Å; W597-V605 HydrophobicContact CD2-CG1 4.46Å; W597-V605 HydrophobicContact CE3-CB 3.94Å; W597-V605 HydrophobicContact CE3-CG1 3.68Å; W597-V605 HydrophobicContact CZ3-CB 4.37Å; W597-P607 HydrophobicContact CD2-CB 4.1Å; W597-P607 HydrophobicContact CG-CB 4.49Å; W597-P607 HydrophobicContact CH2-CG 4.47Å; W597-P607 HydrophobicContact CZ2-CB 4.04Å; W597-P607 HydrophobicContact CZ2-CG 4.38Å; W597-L615 HydrophobicContact CE3-CD1 4.45Å; W597-L615 HydrophobicContact CH2-CD1 3.65Å; W597-L615 HydrophobicContact CH2-CG 4.3Å; W597-L615 HydrophobicContact CZ3-CB 4.45Å; W597-L615 HydrophobicContact CZ3-CD1 3.5Å; W597-L615 VanDerWaalsContact CZ3-CD1 3.5Å; W597-L615 HydrophobicContact CZ3-CG 4.07Å
598	T	87.3	Confident	85.7	Confident	44 Å²	44	51 Å²	51	27%	0.27	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135.5	176.3	45.4	0	0	0	0	111.9	V605 F606 R608	T598-V605 CarbonylContact O-C 3.58Å; T598-V605 VanDerWaalsContact O-CA 3.32Å; T598-V605 WeakPolarHBondContact O-CA 3.39Å; T598-V605 WeakPolarHBondContact O-CG1 3.44Å; T598-F606 PolarHBondContact N-O 3.11Å; T598-F606 PolarHBondContact O-N 2.81Å; T598-F606 PolarHBondContact OG1-O 3.02Å; T598-R608 HydrophobicContact CG2-CG 4.01Å; T598-R608 VanDerWaalsContact CG2-CZ 3.46Å; T598-R608 VanDerWaalsContact CG2-NH2 3.34Å
599	L	88.3	Confident	84.8	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.042	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	134.8	173.3	179.8	68.2	0	0	0	110.3	L574 Q576 L582 L592 V605	L574-L599 VanDerWaalsContact C-CD2 3.5Å; L574-L599 HydrophobicContact CB-CD2 4.21Å; L574-L599 WeakPolarHBondContact O-CD2 3.24Å; Q576-L599 PolarHBondContact OE1-O 3.49Å; Q576-L599 VanDerWaalsContact OE1-O 3.12Å; L582-L599 HydrophobicContact CD1-CB 3.97Å; L582-L599 HydrophobicContact CD1-CD2 3.98Å; L592-L599 HydrophobicContact CD2-CB 4.31Å; L599-V605 HydrophobicContact CD1-CG2 3.94Å
600	T	86.4	Confident	84	Confident	41 Å²	41	54.2 Å²	54.2	25%	0.252	29%	0.285	S	S	.	.			trans	-100.3	167.8	172.1	70.6	0	0	0	0	112.2	D602 E603 K604 F606	T600-D602 PolarHBondContact O-N 3.33Å; T600-E603 PolarHBondContact O-N 3.45Å; T600-K604 PolarHBondContact N-O 3.44Å; T600-K604 PolarHBondContact OG1-N 2.8Å; T600-K604 PolarHBondContact OG1-O 2.84Å; T600-F606 HydrophobicContact CG2-CD2 3.82Å; T600-F606 HydrophobicContact CG2-CE2 3.78Å
601	K	77	Confident	83	Confident	115 Å²	115	63.5 Å²	63.5	50%	0.5	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.8	175.7	-63.1	-169.6	-178.2	-169.6	0	114.2	D578 E603	D578-K601 PolarHBondContact O-NZ 2.9Å; D578-K601 IonicContact OD1-NZ 3.83Å; D578-K601 PolarHBondContact OD1-NZ 3.43Å; K601-E603 PolarHBondContact O-N 3.29Å
602	D	77.3	Confident	82.2	Confident	116 Å²	116	64.9 Å²	64.9	62%	0.62	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	19.7	-179.9	-64	-36	0	0	0	113.4	T600 K604	T600-D602 PolarHBondContact O-N 3.33Å; D602-K604 HydrophobicContact CB-CG 4.4Å; D602-K604 PolarHBondContact O-N 3.2Å; D602-K604 VanDerWaalsContact O-N 3.14Å
603	E	82.4	Confident	81.8	Confident	41 Å²	41	67.1 Å²	67.1	19%	0.192	34%	0.341	C	S	.	.	S	Bend	trans	57.5	27.8	-178.1	-50.9	-168.9	154.6	0	0	113.7	T600 K601 I617 R620	T600-E603 PolarHBondContact O-N 3.45Å; K601-E603 PolarHBondContact O-N 3.29Å; E603-I617 HydrophobicContact CB-CB 4.31Å; E603-I617 PolarHBondContact O-N 3.36Å; E603-R620 IonicContact OE1-CZ 3.81Å; E603-R620 IonicContact OE1-NH1 2.69Å; E603-R620 PolarHBondContact OE1-NH1 2.73Å; E603-R620 IonicContact OE1-NH2 3.96Å; E603-R620 IonicContact OE2-CZ 2.63Å; E603-R620 IonicContact OE2-NH1 3.98Å; E603-R620 PolarHBondContact OE2-NH1 3.12Å; E603-R620 IonicContact OE2-NH2 2.75Å
604	K	86.2	Confident	81.6	Confident	79 Å²	79	63.9 Å²	63.9	34%	0.343	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	137.2	172.2	-60	178.9	-175.4	173.9	0	109.5	T600 D602 F606 L615 K616	T600-K604 PolarHBondContact N-O 3.44Å; T600-K604 PolarHBondContact OG1-N 2.8Å; T600-K604 PolarHBondContact OG1-O 2.84Å; D602-K604 HydrophobicContact CB-CG 4.4Å; D602-K604 PolarHBondContact O-N 3.2Å; D602-K604 VanDerWaalsContact O-N 3.14Å; K604-F606 HydrophobicContact CB-CD2 4.31Å; K604-F606 HydrophobicContact CB-CE2 3.46Å; K604-F606 VanDerWaalsContact CB-CE2 3.46Å; K604-F606 HydrophobicContact CB-CZ 3.75Å; K604-F606 HydrophobicContact CD-CE2 4.23Å; K604-F606 HydrophobicContact CD-CZ 3.87Å; K604-F606 HydrophobicContact CG-CZ 4.44Å; K604-L615 CarbonylContact C-O 3.58Å; K604-L615 VanDerWaalsContact CA-O 3.27Å; K604-L615 WeakPolarHBondContact CA-O 3.41Å; K604-K616 HydrophobicContact CG-CB 4.36Å; K604-K616 HydrophobicContact CG-CG 4.19Å
605	V	87.8	Confident	81.7	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.5	179.3	-150.8	0	0	0	0	108.6	L592 W597 T598 L599 G614 L615 I617	L592-V605 HydrophobicContact CD1-CG1 4.11Å; W597-V605 HydrophobicContact CB-CG1 4.04Å; W597-V605 HydrophobicContact CD2-CG1 4.46Å; W597-V605 HydrophobicContact CE3-CB 3.94Å; W597-V605 HydrophobicContact CE3-CG1 3.68Å; W597-V605 HydrophobicContact CZ3-CB 4.37Å; T598-V605 CarbonylContact O-C 3.58Å; T598-V605 VanDerWaalsContact O-CA 3.32Å; T598-V605 WeakPolarHBondContact O-CA 3.39Å; T598-V605 WeakPolarHBondContact O-CG1 3.44Å; L599-V605 HydrophobicContact CD1-CG2 3.94Å; V605-G614 CarbonylContact O-C 3.58Å; V605-G614 VanDerWaalsContact O-CA 3.28Å; V605-G614 WeakPolarHBondContact O-CA 3.46Å; V605-L615 PolarHBondContact N-O 3.36Å; V605-L615 PolarHBondContact O-N 3.29Å; V605-I617 HydrophobicContact CG2-CD1 3.83Å; V605-I617 HydrophobicContact CG2-CG1 4.27Å
606	F	88	Confident	81.8	Confident	89 Å²	89	65.9 Å²	65.9	39%	0.39	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.9	-179.4	-59.5	-83.7	0	0	0	110.8	T598 T600 K604	T598-F606 PolarHBondContact N-O 3.11Å; T598-F606 PolarHBondContact O-N 2.81Å; T598-F606 PolarHBondContact OG1-O 3.02Å; T600-F606 HydrophobicContact CG2-CD2 3.82Å; T600-F606 HydrophobicContact CG2-CE2 3.78Å; K604-F606 HydrophobicContact CB-CD2 4.31Å; K604-F606 HydrophobicContact CB-CE2 3.46Å; K604-F606 VanDerWaalsContact CB-CE2 3.46Å; K604-F606 HydrophobicContact CB-CZ 3.75Å; K604-F606 HydrophobicContact CD-CE2 4.23Å; K604-F606 HydrophobicContact CD-CZ 3.87Å; K604-F606 HydrophobicContact CG-CZ 4.44Å
607	P	85.7	Confident	81.9	Confident	25 Å²	25	63 Å²	63	16%	0.162	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	143.9	173.1	30.5	-34.2	0	0	0	111	W597 I610 T612	W597-P607 HydrophobicContact CD2-CB 4.1Å; W597-P607 HydrophobicContact CG-CB 4.49Å; W597-P607 HydrophobicContact CH2-CG 4.47Å; W597-P607 HydrophobicContact CZ2-CB 4.04Å; W597-P607 HydrophobicContact CZ2-CG 4.38Å; P607-I610 HydrophobicContact CB-CB 4.4Å; P607-I610 WeakPolarHBondContact CB-O 3.34Å; P607-I610 VanDerWaalsContact CG-O 3.24Å; P607-I610 WeakPolarHBondContact CG-O 3.43Å; P607-T612 WeakPolarHBondContact CG-O 3.26Å
608	R	79.1	Confident	81.8	Confident	178 Å²	178	65.1 Å²	65.1	67%	0.672	32%	0.32	S	S	*	.	S	Bend	trans	-87.3	-43.9	173.8	-77	-179	169.7	176.2	6.3	113.2	D596 T598	D596-R608 PolarHBondContact O-N 2.83Å; D596-R608 VanDerWaalsContact OD1-CD 3.27Å; D596-R608 WeakPolarHBondContact OD1-CD 3.42Å; D596-R608 WeakPolarHBondContact OD2-CB 3.48Å; T598-R608 HydrophobicContact CG2-CG 4.01Å; T598-R608 VanDerWaalsContact CG2-CZ 3.46Å; T598-R608 VanDerWaalsContact CG2-NH2 3.34Å
609	S	67.8	Low	81.6	Confident	98 Å²	98	65.5 Å²	65.5	69%	0.685	32%	0.319	S	S	*	.	S	Bend	trans	-103.9	-33.6	-173.6	-171.8	0	0	0	0	114	D596	D596-S609 WeakPolarHBondContact OD2-CB 3.24Å
610	I	69	Low	81.4	Confident	65 Å²	65	66.4 Å²	66.4	33%	0.333	32%	0.322	S	S	.	.	S	Bend	trans	-91.3	134.3	-171.7	-56.4	172.9	0	0	0	111	H565 P607 T612	H565-I610 WeakPolarHBondContact CE1-CD1 3.36Å; H565-I610 WeakPolarHBondContact NE2-CD1 3.41Å; P607-I610 HydrophobicContact CB-CB 4.4Å; P607-I610 WeakPolarHBondContact CB-O 3.34Å; P607-I610 VanDerWaalsContact CG-O 3.24Å; P607-I610 WeakPolarHBondContact CG-O 3.43Å; I610-T612 HydrophobicContact CG2-CG2 3.89Å; I610-T612 PolarHBondContact O-N 3.37Å
611	K	65.7	Low	81.4	Confident	215 Å²	215	66.1 Å²	66.1	94%	0.935	32%	0.317	S	S	*	.			trans	-73.1	62.2	173.7	-68	-175.2	179	-179.8	0	112.1
612	T	72.5	Confident	81.6	Confident	32 Å²	32	61.8 Å²	61.8	20%	0.196	30%	0.299	C	S	.	.			trans	-116.9	150.7	173.4	38.5	0	0	0	0	110.8	I562 P607 I610	I562-T612 HydrophobicContact CG2-CG2 4.41Å; P607-T612 WeakPolarHBondContact CG-O 3.26Å; I610-T612 HydrophobicContact CG2-CG2 3.89Å; I610-T612 PolarHBondContact O-N 3.37Å
613	Q	79.6	Confident	81.8	Confident	50 Å²	50	60.4 Å²	60.4	23%	0.234	29%	0.287	C	S	.	.			trans	-63.9	145.6	176.8	-111.3	145.3	-5.5	0	0	111.6	E637 K638	Q613-E637 PolarHBondContact NE2-O 3.06Å; Q613-E637 PolarHBondContact OE1-O 3.15Å; Q613-K638 VanDerWaalsContact NE2-C 3.34Å; Q613-K638 PolarHBondContact NE2-O 2.98Å; Q613-K638 VanDerWaalsContact NE2-O 3.11Å
614	G	84.3	Confident	81.3	Confident	23 Å²	23	59.8 Å²	59.8	24%	0.237	29%	0.29	C	S	.	.			trans	-65.1	151.6	173.2	0	0	0	0	0	111.9	V605	V605-G614 CarbonylContact O-C 3.58Å; V605-G614 VanDerWaalsContact O-CA 3.28Å; V605-G614 WeakPolarHBondContact O-CA 3.46Å
615	L	88.7	Confident	80.3	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	143.4	177.1	-71	155.1	0	0	0	109.3	R566 A569 W597 K604 V605 Y636 I647	R566-L615 HydrophobicContact CB-CD1 4.26Å; R566-L615 HydrophobicContact CG-CD1 4.19Å; A569-L615 HydrophobicContact CB-CD1 4.27Å; W597-L615 HydrophobicContact CE3-CD1 4.45Å; W597-L615 HydrophobicContact CH2-CD1 3.65Å; W597-L615 HydrophobicContact CH2-CG 4.3Å; W597-L615 HydrophobicContact CZ3-CB 4.45Å; W597-L615 HydrophobicContact CZ3-CD1 3.5Å; W597-L615 VanDerWaalsContact CZ3-CD1 3.5Å; W597-L615 HydrophobicContact CZ3-CG 4.07Å; K604-L615 CarbonylContact C-O 3.58Å; K604-L615 VanDerWaalsContact CA-O 3.27Å; K604-L615 WeakPolarHBondContact CA-O 3.41Å; V605-L615 PolarHBondContact N-O 3.36Å; V605-L615 PolarHBondContact O-N 3.29Å; L615-Y636 HydrophobicContact CD2-CD1 4.29Å; L615-Y636 HydrophobicContact CD2-CG 4.46Å; L615-I647 HydrophobicContact CD2-CD1 3.76Å
616	K	89.4	Confident	79.4	Confident	87 Å²	87	65 Å²	65	38%	0.378	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.7	168.3	-174.6	178.2	179.5	-174.5	0	109.5	K604 A634 S635	K604-K616 HydrophobicContact CG-CB 4.36Å; K604-K616 HydrophobicContact CG-CG 4.19Å; K616-A634 CarbonylContact O-C 3.58Å; K616-A634 VanDerWaalsContact O-CA 3.23Å; K616-A634 WeakPolarHBondContact O-CA 3.26Å; K616-S635 PolarHBondContact N-O 2.72Å; K616-S635 PolarHBondContact O-N 3.47Å
617	I	89.1	Confident	79	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.015	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.3	175.3	-61.3	167.8	0	0	0	108.5	E603 V605 R620 V632	E603-I617 HydrophobicContact CB-CB 4.31Å; E603-I617 PolarHBondContact O-N 3.36Å; V605-I617 HydrophobicContact CG2-CD1 3.83Å; V605-I617 HydrophobicContact CG2-CG1 4.27Å; I617-R620 HydrophobicContact CG2-CG 3.77Å; I617-V632 HydrophobicContact CG1-CG1 4.32Å; I617-V632 HydrophobicContact CG2-CG1 3.61Å
618	H	85.6	Confident	78.9	Confident	55 Å²	55	66.1 Å²	66.1	26%	0.255	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-43.3	178.8	-68.9	-83.7	0	0	0	112.5	L633 S635 Y646	H618-L633 PolarHBondContact N-O 3.05Å; H618-S635 WeakPolarHBondContact NE2-CB 3.48Å; H618-S635 PolarHBondContact NE2-OG 2.68Å; H618-Y646 AromaticContact CD2-CE1 3.87Å; H618-Y646 AromaticContact NE2-CE1 3.78Å
619	Q	83.8	Confident	79.4	Confident	53 Å²	53	59.1 Å²	59.1	25%	0.248	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	134.5	-177.4	-167.3	175	11.8	0	0	110.3	F621 V632 L633	Q619-F621 HydrophobicContact CG-CE2 4Å; Q619-F621 HydrophobicContact CG-CZ 4.21Å; Q619-F621 VanDerWaalsContact NE2-CZ 3.32Å; Q619-V632 WeakPolarHBondContact O-CA 3.46Å; Q619-L633 HydrophobicContact CB-CB 4.22Å; Q619-L633 PolarHBondContact N-O 2.84Å; Q619-L633 PolarHBondContact O-N 3.5Å
620	R	84.7	Confident	80.4	Confident	26 Å²	26	54.7 Å²	54.7	10%	0.098	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.4	176.3	-59.5	-173.4	-176	90.6	5.5	109.4	H572 E603 I617 V632	H572-R620 WeakPolarHBondContact O-CD 3.37Å; H572-R620 PolarHBondContact O-NE 3.44Å; E603-R620 IonicContact OE1-CZ 3.81Å; E603-R620 IonicContact OE1-NH1 2.69Å; E603-R620 PolarHBondContact OE1-NH1 2.73Å; E603-R620 IonicContact OE1-NH2 3.96Å; E603-R620 IonicContact OE2-CZ 2.63Å; E603-R620 IonicContact OE2-NH1 3.98Å; E603-R620 PolarHBondContact OE2-NH1 3.12Å; E603-R620 IonicContact OE2-NH2 2.75Å; I617-R620 HydrophobicContact CG2-CG 3.77Å; R620-V632 HydrophobicContact CB-CG2 4.4Å; R620-V632 HydrophobicContact CG-CG1 4.36Å; R620-V632 HydrophobicContact CG-CG2 4.17Å
621	F	84.9	Confident	81.5	Confident	35 Å²	35	51.7 Å²	51.7	15%	0.154	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	100.8	164.8	-65.7	-82.8	0	0	0	107.7	Q619 M630 S631 R703 L706	Q619-F621 HydrophobicContact CG-CE2 4Å; Q619-F621 HydrophobicContact CG-CZ 4.21Å; Q619-F621 VanDerWaalsContact NE2-CZ 3.32Å; F621-M630 WeakPolarHBondContact O-CA 3.35Å; F621-M630 VanDerWaalsContact O-CB 3.31Å; F621-M630 WeakPolarHBondContact O-CB 3.46Å; F621-S631 WeakPolarHBondContact CA-O 3.36Å; F621-S631 WeakPolarHBondContact CB-O 3.45Å; F621-S631 WeakPolarHBondContact CB-OG 3.37Å; F621-S631 PolarHBondContact N-O 3.43Å; F621-S631 PolarHBondContact O-N 2.92Å; F621-S631 VanDerWaalsContact O-N 3.13Å; F621-R703 HydrophobicContact CB-CG 4.39Å; F621-R703 HydrophobicContact CD1-CB 3.83Å; F621-R703 HydrophobicContact CD1-CG 3.95Å; F621-R703 HydrophobicContact CE1-CB 3.78Å; F621-R703 HydrophobicContact CE1-CG 4.41Å; F621-R703 HydrophobicContact CG-CB 4.31Å; F621-R703 HydrophobicContact CG-CG 4.07Å; F621-R703 HydrophobicContact CZ-CB 4.25Å; F621-L706 HydrophobicContact CD2-CD1 3.7Å; F621-L706 HydrophobicContact CE2-CD1 3.38Å; F621-L706 HydrophobicContact CZ-CD1 4.48Å
622	H	82.3	Confident	82.8	Confident	25 Å²	25	41.4 Å²	41.4	12%	0.116	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	157.1	-178.3	-67.1	93.4	0	0	0	112.9	E359 L378 A624 R703	E359-H622 IonicContact OE1-CE1 2.81Å; E359-H622 PolarHBondContact OE1-CE1 3.43Å; E359-H622 VanDerWaalsContact OE1-CE1 3.22Å; E359-H622 IonicContact OE1-ND1 2.79Å; E359-H622 IonicContact OE2-CE1 2.73Å; E359-H622 IonicContact OE2-ND1 3.2Å; L378-H622 HydrophobicContact CD1-CB 4.4Å; L378-H622 HydrophobicContact CD2-CB 3.99Å; H622-A624 PolarHBondContact O-N 3.4Å; H622-R703 PolarHBondContact O-NH2 3.43Å; H622-R703 VanDerWaalsContact O-NH2 3.16Å
623	F	80.6	Confident	83.7	Confident	86 Å²	86	39.9 Å²	39.9	38%	0.377	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	119.1	175.4	179.2	-92.2	0	0	0	110.3	R629 M630	F623-R629 WeakPolarHBondContact CA-O 3.45Å; F623-M630 HydrophobicContact CB-CB 4.15Å; F623-M630 HydrophobicContact CB-SD 4.43Å
624	A	71.7	Confident	84.2	Confident	29 Å²	29	37.5 Å²	37.5	24%	0.24	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.3	174.3	0	0	0	0	0	109.4	H622 A626 L627 K628 R629	H622-A624 PolarHBondContact O-N 3.4Å; A624-A626 VanDerWaalsContact C-N 3.31Å; A624-A626 PolarHBondContact O-N 3.15Å; A624-L627 HydrophobicContact CB-CB 4.06Å; A624-L627 HydrophobicContact CB-CD1 4.1Å; A624-L627 HydrophobicContact CB-CG 4.14Å; A624-L627 CarbonylContact O-C 2.98Å; A624-L627 PolarHBondContact O-N 3.17Å; A624-K628 PolarHBondContact O-N 3.14Å; A624-R629 PolarHBondContact N-O 3.49Å
625	S	66.4	Low	84.5	Confident	89 Å²	89	36.6 Å²	36.6	62%	0.622	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-39.5	-176.4	-169.6	0	0	0	0	112.7	L627 K628	S625-L627 VanDerWaalsContact C-N 3.31Å; S625-L627 PolarHBondContact O-N 2.83Å; S625-K628 VanDerWaalsContact O-CG 3.28Å; S625-K628 WeakPolarHBondContact O-CG 3.43Å; S625-K628 PolarHBondContact O-N 2.93Å
626	A	68.8	Low	84.5	Confident	99 Å²	99	37.4 Å²	37.4	82%	0.818	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-35	175.4	0	0	0	0	0	112.9	A624	A624-A626 VanDerWaalsContact C-N 3.31Å; A624-A626 PolarHBondContact O-N 3.15Å
627	L	78.6	Confident	84.3	Confident	62 Å²	62	38.5 Å²	38.5	33%	0.325	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-13.7	-178.3	-60.8	179.8	0	0	0	113.5	A624 S625 R629 T656	A624-L627 HydrophobicContact CB-CB 4.06Å; A624-L627 HydrophobicContact CB-CD1 4.1Å; A624-L627 HydrophobicContact CB-CG 4.14Å; A624-L627 CarbonylContact O-C 2.98Å; A624-L627 PolarHBondContact O-N 3.17Å; S625-L627 VanDerWaalsContact C-N 3.31Å; S625-L627 PolarHBondContact O-N 2.83Å; L627-R629 HydrophobicContact CB-CG 4.32Å; L627-R629 WeakPolarHBondContact O-CG 3.45Å; L627-R629 PolarHBondContact O-N 3.43Å; L627-R629 VanDerWaalsContact O-N 3.12Å; L627-R629 PolarHBondContact O-NH1 3Å; L627-T656 WeakPolarHBondContact O-CG2 3.24Å
628	K	84.4	Confident	83.8	Confident	76 Å²	76	43.6 Å²	43.6	33%	0.33	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	29.6	179.4	-56.7	177.2	-178.8	172.5	0	115.4	A624 S625 G652 A653	A624-K628 PolarHBondContact O-N 3.14Å; S625-K628 VanDerWaalsContact O-CG 3.28Å; S625-K628 WeakPolarHBondContact O-CG 3.43Å; S625-K628 PolarHBondContact O-N 2.93Å; K628-G652 WeakPolarHBondContact O-CA 3.31Å; K628-A653 HydrophobicContact CB-CB 3.84Å; K628-A653 HydrophobicContact CD-CB 4.37Å; K628-A653 PolarHBondContact O-N 3.36Å
629	R	88.9	Confident	83	Confident	31 Å²	31	48.4 Å²	48.4	12%	0.117	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	164.2	-178	69.4	-167	179	-96.4	1.8	112.4	F623 A624 L627 K651 L657 R703 E707	F623-R629 WeakPolarHBondContact CA-O 3.45Å; A624-R629 PolarHBondContact N-O 3.49Å; L627-R629 HydrophobicContact CB-CG 4.32Å; L627-R629 WeakPolarHBondContact O-CG 3.45Å; L627-R629 PolarHBondContact O-N 3.43Å; L627-R629 VanDerWaalsContact O-N 3.12Å; L627-R629 PolarHBondContact O-NH1 3Å; R629-K651 WeakPolarHBondContact CA-O 3.33Å; R629-L657 HydrophobicContact CB-CD1 3.86Å; R629-R703 PolarHBondContact O-NH2 2.88Å; R629-E707 IonicContact CZ-OE2 3.66Å; R629-E707 VanDerWaalsContact NE-CD 3.32Å; R629-E707 IonicContact NE-OE1 3.7Å; R629-E707 IonicContact NE-OE2 3.35Å; R629-E707 PolarHBondContact NE-OE2 3.19Å; R629-E707 IonicContact NH2-OE2 3.68Å; R629-E707 PolarHBondContact NH2-OE2 3.19Å
630	M	90.3	Very high	82.3	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.5	170.9	66.1	-179.5	-82.8	0	0	111.2	F621 F623 V632 V650 K651	F621-M630 WeakPolarHBondContact O-CA 3.35Å; F621-M630 VanDerWaalsContact O-CB 3.31Å; F621-M630 WeakPolarHBondContact O-CB 3.46Å; F623-M630 HydrophobicContact CB-CB 4.15Å; F623-M630 HydrophobicContact CB-SD 4.43Å; M630-V632 HydrophobicContact CE-CG2 4.24Å; M630-V650 WeakPolarHBondContact O-CA 3.39Å; M630-V650 WeakPolarHBondContact O-CG1 3.48Å; M630-K651 HydrophobicContact CG-CD 4.23Å; M630-K651 HydrophobicContact CG-CG 3.52Å; M630-K651 PolarHBondContact N-O 3.06Å; M630-K651 PolarHBondContact O-N 3.22Å; M630-K651 HydrophobicContact SD-CD 4.24Å; M630-K651 WeakPolarHBondContact SD-CE 3.42Å; M630-K651 HydrophobicContact SD-CG 4.16Å
631	S	91.9	Very high	81.8	Confident	1 Å²	1	51 Å²	51	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.9	-177.5	47.1	0	0	0	0	110.3	F621 A649 E707	F621-S631 WeakPolarHBondContact CA-O 3.36Å; F621-S631 WeakPolarHBondContact CB-O 3.45Å; F621-S631 WeakPolarHBondContact CB-OG 3.37Å; F621-S631 PolarHBondContact N-O 3.43Å; F621-S631 PolarHBondContact O-N 2.92Å; F621-S631 VanDerWaalsContact O-N 3.13Å; S631-A649 CarbonylContact C-O 3.54Å; S631-A649 WeakPolarHBondContact CA-O 3.47Å; S631-E707 PolarHBondContact OG-OE1 3.26Å
632	V	91.7	Very high	81.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.8	-179.7	177.4	0	0	0	0	109.3	S570 I617 Q619 R620 M630 A648 A649	S570-V632 WeakPolarHBondContact O-CG1 3.41Å; I617-V632 HydrophobicContact CG1-CG1 4.32Å; I617-V632 HydrophobicContact CG2-CG1 3.61Å; Q619-V632 WeakPolarHBondContact O-CA 3.46Å; R620-V632 HydrophobicContact CB-CG2 4.4Å; R620-V632 HydrophobicContact CG-CG1 4.36Å; R620-V632 HydrophobicContact CG-CG2 4.17Å; M630-V632 HydrophobicContact CE-CG2 4.24Å; V632-A648 WeakPolarHBondContact O-CA 3.34Å; V632-A649 PolarHBondContact N-O 3.41Å; V632-A649 PolarHBondContact O-N 3.15Å
633	L	91.5	Very high	81.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.5	168.5	-178.6	66	0	0	0	108.8	H618 Q619 Y646 L690 A698 V701 L706	H618-L633 PolarHBondContact N-O 3.05Å; Q619-L633 HydrophobicContact CB-CB 4.22Å; Q619-L633 PolarHBondContact N-O 2.84Å; Q619-L633 PolarHBondContact O-N 3.5Å; L633-Y646 HydrophobicContact CD1-CD1 4.3Å; L633-Y646 HydrophobicContact CG-CD1 4.45Å; L633-L690 HydrophobicContact CD1-CD1 3.66Å; L633-A698 HydrophobicContact CD2-CB 4.3Å; L633-A698 WeakPolarHBondContact CD2-O 3.41Å; L633-V701 HydrophobicContact CD2-CG2 4.4Å; L633-L706 HydrophobicContact CB-CD1 4.25Å; L633-L706 HydrophobicContact CD1-CD2 4.14Å
634	A	91.1	Very high	81.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	161.4	179	0	0	0	0	0	111.1	K616 Y646 I647	K616-A634 CarbonylContact O-C 3.58Å; K616-A634 VanDerWaalsContact O-CA 3.23Å; K616-A634 WeakPolarHBondContact O-CA 3.26Å; A634-Y646 CarbonylContact O-C 3.6Å; A634-Y646 WeakPolarHBondContact O-CA 3.43Å; A634-I647 HydrophobicContact CB-CD1 4.36Å; A634-I647 HydrophobicContact CB-CG1 3.99Å; A634-I647 PolarHBondContact N-O 2.78Å; A634-I647 WeakPolarHBondContact O-CG1 3.47Å; A634-I647 PolarHBondContact O-N 2.76Å
635	S	90.4	Very high	81.9	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.4	173.6	67.8	0	0	0	0	111.9	K616 H618 C645	K616-S635 PolarHBondContact N-O 2.72Å; K616-S635 PolarHBondContact O-N 3.47Å; H618-S635 WeakPolarHBondContact NE2-CB 3.48Å; H618-S635 PolarHBondContact NE2-OG 2.68Å; S635-C645 CarbonylContact C-O 3.59Å; S635-C645 WeakPolarHBondContact CA-O 3.4Å
636	Y	88.1	Confident	83	Confident	21 Å²	21	52.5 Å²	52.5	8%	0.082	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.7	166.7	66.2	-78.7	0	0	0	110.2	R566 L615 C645 I647	R566-Y636 PolarHBondContact NH1-OH 3.37Å; R566-Y636 VanDerWaalsContact NH1-OH 3.13Å; L615-Y636 HydrophobicContact CD2-CD1 4.29Å; L615-Y636 HydrophobicContact CD2-CG 4.46Å; Y636-C645 HydrophobicContact CD1-CB 4.41Å; Y636-C645 HydrophobicContact CE1-CB 3.97Å; Y636-C645 HydrophobicContact CE2-CB 4.41Å; Y636-C645 PolarHBondContact N-O 2.8Å; Y636-C645 PolarHBondContact O-N 3.06Å; Y636-I647 HydrophobicContact CD1-CG2 4.04Å; Y636-I647 HydrophobicContact CE1-CG2 3.58Å
637	E	85	Confident	84.1	Confident	110 Å²	110	47.8 Å²	47.8	51%	0.514	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	143	171.2	-67.7	171.5	-175.7	0	0	108.8	Q613 L644	Q613-E637 PolarHBondContact NE2-O 3.06Å; Q613-E637 PolarHBondContact OE1-O 3.15Å; E637-L644 HydrophobicContact CG-CD2 3.83Å
638	K	78.4	Confident	84.8	Confident	110 Å²	110	44.9 Å²	44.9	48%	0.478	25%	0.253	S	S	.	.			trans	-76.7	151.8	175.1	-78.8	180	176.6	179.1	0	111	Q613 G640 S641 D643 C645	Q613-K638 VanDerWaalsContact NE2-C 3.34Å; Q613-K638 PolarHBondContact NE2-O 2.98Å; Q613-K638 VanDerWaalsContact NE2-O 3.11Å; K638-G640 PolarHBondContact O-N 2.78Å; K638-G640 VanDerWaalsContact O-N 3.07Å; K638-S641 PolarHBondContact O-N 3.48Å; K638-S641 VanDerWaalsContact O-O 3.07Å; K638-D643 PolarHBondContact N-O 2.75Å; K638-C645 HydrophobicContact CG-CB 4.47Å
639	L	70	Confident	85.2	Confident	155 Å²	155	41.2 Å²	41.2	81%	0.812	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	115.8	174	-115.8	98.9	0	0	0	109.5
640	G	68.4	Low	85.5	Confident	91 Å²	91	39.8 Å²	39.8	94%	0.938	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	6.4	177.2	0	0	0	0	0	116.6	K638	K638-G640 PolarHBondContact O-N 2.78Å; K638-G640 VanDerWaalsContact O-N 3.07Å
641	S	75.3	Confident	85.6	Confident	43 Å²	43	40.3 Å²	40.3	30%	0.301	23%	0.234	S	C	.	.			trans	-133.7	150.1	172.5	173.9	0	0	0	0	111.1	K638 D643	K638-S641 PolarHBondContact O-N 3.48Å; K638-S641 VanDerWaalsContact O-O 3.07Å; S641-D643 PolarHBondContact O-N 2.91Å; S641-D643 WeakPolarHBondContact OG-CB 3.41Å; S641-D643 PolarHBondContact OG-N 3.31Å; S641-D643 PolarHBondContact OG-OD2 2.69Å
642	T	72.1	Confident	85.5	Confident	129 Å²	129	40.4 Å²	40.4	79%	0.791	24%	0.235	S	C	*	.			trans	-77.9	-0.6	169.5	50.2	0	0	0	0	113.1	L644	T642-L644 PolarHBondContact O-N 2.91Å
643	D	78.8	Confident	85.3	Confident	91 Å²	91	41 Å²	41	49%	0.487	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-70.5	124.9	-179.4	-65.3	-35.9	0	0	0	111.7	K638 S641	K638-D643 PolarHBondContact N-O 2.75Å; S641-D643 PolarHBondContact O-N 2.91Å; S641-D643 WeakPolarHBondContact OG-CB 3.41Å; S641-D643 PolarHBondContact OG-N 3.31Å; S641-D643 PolarHBondContact OG-OD2 2.69Å
644	L	82.8	Confident	85.2	Confident	61 Å²	61	41.2 Å²	41.2	32%	0.319	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	125.7	173.9	-66.3	170.9	0	0	0	110.3	E637 T642 Y646 H692	E637-L644 HydrophobicContact CG-CD2 3.83Å; T642-L644 PolarHBondContact O-N 2.91Å; L644-Y646 HydrophobicContact CB-CE2 4.28Å; L644-H692 PolarHBondContact O-ND1 3.24Å
645	C	86.2	Confident	84.9	Confident	7 Å²	7	45.3 Å²	45.3	5%	0.047	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.2	170.1	-171.4	0	0	0	0	109.7	S635 Y636 K638	S635-C645 CarbonylContact C-O 3.59Å; S635-C645 WeakPolarHBondContact CA-O 3.4Å; Y636-C645 HydrophobicContact CD1-CB 4.41Å; Y636-C645 HydrophobicContact CE1-CB 3.97Å; Y636-C645 HydrophobicContact CE2-CB 4.41Å; Y636-C645 PolarHBondContact N-O 2.8Å; Y636-C645 PolarHBondContact O-N 3.06Å; K638-C645 HydrophobicContact CG-CB 4.47Å
646	Y	90.2	Very high	84.8	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.027	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.2	179.7	-69.1	-97.5	0	0	0	111.2	H618 L633 A634 L644 L690 G691 L693 A698	H618-Y646 AromaticContact CD2-CE1 3.87Å; H618-Y646 AromaticContact NE2-CE1 3.78Å; L633-Y646 HydrophobicContact CD1-CD1 4.3Å; L633-Y646 HydrophobicContact CG-CD1 4.45Å; A634-Y646 CarbonylContact O-C 3.6Å; A634-Y646 WeakPolarHBondContact O-CA 3.43Å; L644-Y646 HydrophobicContact CB-CE2 4.28Å; Y646-L690 PolarHBondContact O-N 3.47Å; Y646-G691 PolarHBondContact N-O 2.61Å; Y646-L693 HydrophobicContact CD1-CB 4.48Å; Y646-L693 HydrophobicContact CD1-CD1 4.28Å; Y646-L693 HydrophobicContact CD2-CB 3.72Å; Y646-L693 HydrophobicContact CD2-CD1 4.44Å; Y646-L693 HydrophobicContact CD2-CG 4.22Å; Y646-L693 HydrophobicContact CE2-CB 3.8Å; Y646-L693 WeakPolarHBondContact CE2-O 3.21Å; Y646-L693 HydrophobicContact CG-CB 4.06Å; Y646-L693 HydrophobicContact CG-CD1 3.98Å; Y646-L693 HydrophobicContact CG-CG 4.26Å; Y646-L693 PolarHBondContact OH-O 3.46Å; Y646-A698 HydrophobicContact CE1-CB 3.88Å
647	I	92.4	Very high	84.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146	178.8	62.3	166.5	0	0	0	110.1	R566 L615 A634 Y636 Y687 K688 E689	R566-I647 HydrophobicContact CB-CD1 4.31Å; L615-I647 HydrophobicContact CD2-CD1 3.76Å; A634-I647 HydrophobicContact CB-CD1 4.36Å; A634-I647 HydrophobicContact CB-CG1 3.99Å; A634-I647 PolarHBondContact N-O 2.78Å; A634-I647 WeakPolarHBondContact O-CG1 3.47Å; A634-I647 PolarHBondContact O-N 2.76Å; Y636-I647 HydrophobicContact CD1-CG2 4.04Å; Y636-I647 HydrophobicContact CE1-CG2 3.58Å; I647-Y687 HydrophobicContact CB-CE2 4.1Å; I647-Y687 HydrophobicContact CD1-CE2 3.92Å; I647-Y687 HydrophobicContact CG2-CE2 4.14Å; I647-Y687 WeakPolarHBondContact CG2-OH 3.33Å; I647-K688 CarbonylContact C-O 3.46Å; I647-K688 WeakPolarHBondContact CA-O 3.26Å; I647-E689 HydrophobicContact CG2-CG 4.32Å
648	A	92.6	Very high	85	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.6	168.1	0	0	0	0	0	108.8	V632 K688 L690 L706	V632-A648 WeakPolarHBondContact O-CA 3.34Å; A648-K688 HydrophobicContact CB-CB 4.27Å; A648-K688 PolarHBondContact N-O 3.24Å; A648-K688 PolarHBondContact O-N 3.33Å; A648-L690 HydrophobicContact CB-CD1 4.09Å; A648-L706 HydrophobicContact CB-CB 4.38Å; A648-L706 HydrophobicContact CB-CD2 3.89Å
649	A	94	Very high	85.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.1	174.2	0	0	0	0	0	109.3	A567 S570 C571 S631 V632	A567-A649 HydrophobicContact CB-CB 4.31Å; S570-A649 VanDerWaalsContact OG-CB 3.23Å; S570-A649 WeakPolarHBondContact OG-CB 3.42Å; C571-A649 HydrophobicContact CB-CB 3.89Å; C571-A649 PolarHBondContact SG-O 2.91Å; C571-A649 VanDerWaalsContact SG-O 3.35Å; S631-A649 CarbonylContact C-O 3.54Å; S631-A649 WeakPolarHBondContact CA-O 3.47Å; V632-A649 PolarHBondContact N-O 3.41Å; V632-A649 PolarHBondContact O-N 3.15Å
650	V	93.6	Very high	86.4	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.1	-177.2	-172.4	0	0	0	0	108.6	M630 L657 G686 L710	M630-V650 WeakPolarHBondContact O-CA 3.39Å; M630-V650 WeakPolarHBondContact O-CG1 3.48Å; V650-L657 HydrophobicContact CG1-CD2 4.1Å; V650-L657 HydrophobicContact CG1-CG 4.39Å; V650-G686 PolarHBondContact N-O 3.34Å; V650-G686 PolarHBondContact O-N 2.98Å; V650-L710 HydrophobicContact CB-CD1 3.92Å; V650-L710 HydrophobicContact CG1-CD1 4.14Å; V650-L710 HydrophobicContact CG2-CD1 3.8Å; V650-L710 HydrophobicContact CG2-CD2 3.75Å; V650-L710 HydrophobicContact CG2-CG 4.45Å
651	K	93.1	Very high	87.4	Confident	15 Å²	15	34 Å²	34	7%	0.065	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	146.3	169	73.9	-176.6	176.8	-175.5	0	110.7	C571 E588 R629 M630 A684 L685	C571-K651 HydrophobicContact CB-CD 4.31Å; C571-K651 HydrophobicContact CB-CG 4.49Å; C571-K651 WeakPolarHBondContact O-CD 3.41Å; C571-K651 WeakPolarHBondContact O-CE 3.24Å; C571-K651 PolarHBondContact O-NZ 3.07Å; E588-K651 VanDerWaalsContact CG-NZ 3.27Å; E588-K651 WeakPolarHBondContact OE1-CE 3.28Å; E588-K651 IonicContact OE1-NZ 3.7Å; E588-K651 PolarHBondContact OE1-NZ 3.45Å; R629-K651 WeakPolarHBondContact CA-O 3.33Å; M630-K651 HydrophobicContact CG-CD 4.23Å; M630-K651 HydrophobicContact CG-CG 3.52Å; M630-K651 PolarHBondContact N-O 3.06Å; M630-K651 PolarHBondContact O-N 3.22Å; M630-K651 HydrophobicContact SD-CD 4.24Å; M630-K651 WeakPolarHBondContact SD-CE 3.42Å; M630-K651 HydrophobicContact SD-CG 4.16Å; K651-A684 WeakPolarHBondContact CA-O 3.38Å; K651-L685 HydrophobicContact CB-CD2 3.76Å
652	G	91	Very high	88	Confident	3 Å²	3	35.5 Å²	35.5	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.1	-165	179.1	0	0	0	0	0	114	K628 A684	K628-G652 WeakPolarHBondContact O-CA 3.31Å; G652-A684 PolarHBondContact N-O 3.28Å; G652-A684 VanDerWaalsContact N-O 3.14Å; G652-A684 PolarHBondContact O-N 2.92Å
653	A	87.5	Confident	88.4	Confident	13 Å²	13	36.8 Å²	36.8	11%	0.107	20%	0.202	C	C	.	.			trans	-64.5	130.3	179.4	0	0	0	0	0	111.1	K628 E655 T656 L657	K628-A653 HydrophobicContact CB-CB 3.84Å; K628-A653 HydrophobicContact CD-CB 4.37Å; K628-A653 PolarHBondContact O-N 3.36Å; A653-E655 VanDerWaalsContact C-N 3.27Å; A653-E655 HydrophobicContact CB-CG 4.49Å; A653-E655 PolarHBondContact O-N 3.26Å; A653-T656 PolarHBondContact O-N 3.43Å; A653-L657 PolarHBondContact O-N 2.98Å; A653-L657 VanDerWaalsContact O-N 3.13Å
654	P	88.2	Confident	88.4	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-50.5	-41.6	-179.5	-33.6	40	0	0	0	114.8	T656 H658 Y668 V682 A684 F715	P654-T656 VanDerWaalsContact C-N 3.27Å; P654-T656 PolarHBondContact O-N 2.89Å; P654-H658 WeakPolarHBondContact O-CB 3.39Å; P654-H658 PolarHBondContact O-N 3.39Å; P654-H658 VanDerWaalsContact O-N 3.16Å; P654-Y668 VanDerWaalsContact CA-OH 3.26Å; P654-Y668 WeakPolarHBondContact CA-OH 3.47Å; P654-Y668 HydrophobicContact CB-CE1 4.37Å; P654-Y668 PolarHBondContact O-OH 3.49Å; P654-V682 HydrophobicContact CG-CB 4.48Å; P654-V682 HydrophobicContact CG-CG1 4.16Å; P654-A684 HydrophobicContact CB-CB 4.45Å; P654-A684 HydrophobicContact CG-CB 4.37Å; P654-F715 HydrophobicContact CB-CE1 3.82Å; P654-F715 HydrophobicContact CG-CD1 4.3Å; P654-F715 HydrophobicContact CG-CE1 3.92Å
655	E	85.1	Confident	88.4	Confident	86 Å²	86	34.1 Å²	34.1	40%	0.402	19%	0.194	S	C	.	.	H	α-helix	trans	-65.9	-29.7	179.8	65.2	-85.6	-163	0	0	113.1	A653	A653-E655 VanDerWaalsContact C-N 3.27Å; A653-E655 HydrophobicContact CB-CG 4.49Å; A653-E655 PolarHBondContact O-N 3.26Å
656	T	87.6	Confident	88.1	Confident	30 Å²	30	39.8 Å²	39.8	18%	0.184	23%	0.231	C	C	.	.	H	α-helix	trans	-86.2	-39.4	-176.5	-51.2	0	0	0	0	111.7	L627 A653 P654 H658 S659 M660	L627-T656 WeakPolarHBondContact O-CG2 3.24Å; A653-T656 PolarHBondContact O-N 3.43Å; P654-T656 VanDerWaalsContact C-N 3.27Å; P654-T656 PolarHBondContact O-N 2.89Å; T656-H658 VanDerWaalsContact C-N 3.28Å; T656-S659 PolarHBondContact O-OG 3.05Å; T656-M660 HydrophobicContact CG2-CE 4.39Å
657	L	90.1	Very high	87.8	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-74.3	-21.8	177.8	-87.4	73	0	0	0	112.2	R629 V650 A653 S659 M660 F661 A684	R629-L657 HydrophobicContact CB-CD1 3.86Å; V650-L657 HydrophobicContact CG1-CD2 4.1Å; V650-L657 HydrophobicContact CG1-CG 4.39Å; A653-L657 PolarHBondContact O-N 2.98Å; A653-L657 VanDerWaalsContact O-N 3.13Å; L657-S659 VanDerWaalsContact C-N 3.29Å; L657-S659 PolarHBondContact O-N 2.98Å; L657-M660 WeakPolarHBondContact O-CA 3.25Å; L657-M660 WeakPolarHBondContact O-CB 3.47Å; L657-M660 PolarHBondContact O-N 3.02Å; L657-F661 HydrophobicContact CB-CE2 3.64Å; L657-F661 HydrophobicContact CB-CZ 3.63Å; L657-F661 HydrophobicContact CD2-CE1 4.44Å; L657-F661 HydrophobicContact CD2-CZ 3.89Å; L657-F661 HydrophobicContact CG-CZ 4.32Å; L657-F661 WeakPolarHBondContact O-CD2 3.27Å; L657-F661 WeakPolarHBondContact O-CE2 3.27Å; L657-F661 PolarHBondContact O-N 3.44Å; L657-A684 HydrophobicContact CB-CB 4.17Å; L657-A684 HydrophobicContact CD2-CB 4.02Å; L657-A684 WeakPolarHBondContact CD2-O 3.4Å
658	H	88.3	Confident	87.6	Confident	65 Å²	65	43.1 Å²	43.1	30%	0.301	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-52	-45.1	-178.7	-174.5	64	0	0	0	112.9	P654 T656 M660 C664 Y668 H669	P654-H658 WeakPolarHBondContact O-CB 3.39Å; P654-H658 PolarHBondContact O-N 3.39Å; P654-H658 VanDerWaalsContact O-N 3.16Å; T656-H658 VanDerWaalsContact C-N 3.28Å; H658-M660 PolarHBondContact O-N 2.93Å; H658-C664 VanDerWaalsContact CE1-SG 3.55Å; H658-C664 PolarHBondContact ND1-SG 2.94Å; H658-C664 VanDerWaalsContact ND1-SG 3.38Å; H658-Y668 HydrophobicContact CB-CE1 3.93Å; H658-Y668 AromaticContact ND1-CD1 3.43Å; H658-Y668 WeakPolarHBondContact ND1-CD1 3.48Å; H658-Y668 AromaticContact ND1-CE1 3.58Å; H658-H669 AromaticContact CD2-CE1 3.89Å; H658-H669 AromaticContact CD2-NE2 3.45Å; H658-H669 PolarHBondContact CD2-NE2 3.44Å; H658-H669 AromaticContact CE1-CD2 3.89Å; H658-H669 AromaticContact CE1-NE2 3.28Å; H658-H669 PolarHBondContact CE1-NE2 3.24Å; H658-H669 VanDerWaalsContact CE1-NE2 3.28Å; H658-H669 AromaticContact CG-NE2 3.85Å; H658-H669 AromaticContact ND1-NE2 3.74Å; H658-H669 AromaticContact NE2-CD2 3.95Å; H658-H669 AromaticContact NE2-CE1 3.92Å; H658-H669 AromaticContact NE2-NE2 3.04Å; H658-H669 PolarHBondContact NE2-NE2 2.84Å
659	S	88.4	Confident	87.2	Confident	103 Å²	103	47.5 Å²	47.5	72%	0.72	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-75.4	-7.7	178.8	64.9	0	0	0	0	114.3	T656 L657	T656-S659 PolarHBondContact O-OG 3.05Å; L657-S659 VanDerWaalsContact C-N 3.29Å; L657-S659 PolarHBondContact O-N 2.98Å
660	M	88.7	Confident	86.8	Confident	33 Å²	33	53 Å²	53	16%	0.163	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-100.8	-11.9	-176.3	-58.3	-177.1	174.2	0	0	112.8	T656 L657 H658 E707 S709 L710	T656-M660 HydrophobicContact CG2-CE 4.39Å; L657-M660 WeakPolarHBondContact O-CA 3.25Å; L657-M660 WeakPolarHBondContact O-CB 3.47Å; L657-M660 PolarHBondContact O-N 3.02Å; H658-M660 PolarHBondContact O-N 2.93Å; M660-E707 HydrophobicContact SD-CB 4.31Å; M660-S709 PolarHBondContact O-N 3.07Å; M660-L710 HydrophobicContact CB-CD1 4.04Å; M660-L710 PolarHBondContact O-N 3.09Å
661	F	90.4	Very high	86.5	Confident	21 Å²	21	53.5 Å²	53.5	9%	0.092	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	136.7	177.9	-63.9	-56.9	0	0	0	111.5	L657 C664 Y668 A684 L710 F712	L657-F661 HydrophobicContact CB-CE2 3.64Å; L657-F661 HydrophobicContact CB-CZ 3.63Å; L657-F661 HydrophobicContact CD2-CE1 4.44Å; L657-F661 HydrophobicContact CD2-CZ 3.89Å; L657-F661 HydrophobicContact CG-CZ 4.32Å; L657-F661 WeakPolarHBondContact O-CD2 3.27Å; L657-F661 WeakPolarHBondContact O-CE2 3.27Å; L657-F661 PolarHBondContact O-N 3.44Å; F661-C664 HydrophobicContact CB-CB 4.44Å; F661-Y668 HydrophobicContact CD2-CE2 4.26Å; F661-Y668 AromaticContact CE2-CE2 3.75Å; F661-Y668 HydrophobicContact CE2-CE2 3.75Å; F661-Y668 AromaticContact CE2-CZ 3.96Å; F661-A684 HydrophobicContact CZ-CB 4.3Å; F661-L710 CarbonylContact C-O 3.5Å; F661-L710 VanDerWaalsContact CA-O 3.24Å; F661-L710 WeakPolarHBondContact CA-O 3.42Å; F661-L710 HydrophobicContact CD1-CB 3.75Å; F661-L710 HydrophobicContact CE1-CB 4.13Å; F661-F712 HydrophobicContact CD1-CB 4.01Å; F661-F712 HydrophobicContact CE1-CB 4.1Å; F661-F712 HydrophobicContact CE1-CD2 4.19Å; F661-F712 AromaticContact CE2-CD2 3.9Å; F661-F712 HydrophobicContact CE2-CD2 3.9Å; F661-F712 HydrophobicContact CG-CB 4.27Å; F661-F712 HydrophobicContact CZ-CB 4.41Å; F661-F712 AromaticContact CZ-CD2 3.71Å; F661-F712 HydrophobicContact CZ-CD2 3.71Å
662	S	86.6	Confident	86.1	Confident	76 Å²	76	54.1 Å²	54.1	53%	0.531	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-35.2	174	53.9	0	0	0	0	112.4	L710	S662-L710 PolarHBondContact N-O 3.39Å; S662-L710 PolarHBondContact OG-O 2.72Å
663	Q	80.8	Confident	85.7	Confident	156 Å²	156	56.3 Å²	56.3	73%	0.729	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	113.9	174.6	-68.1	177.6	-2.8	0	0	108.3
664	C	79.4	Confident	85.6	Confident	48 Å²	48	58.4 Å²	58.4	32%	0.324	32%	0.32	S	S	.	.			trans	-110.3	133.2	179.1	-165.8	0	0	0	0	109.7	H658 F661 Y668	H658-C664 VanDerWaalsContact CE1-SG 3.55Å; H658-C664 PolarHBondContact ND1-SG 2.94Å; H658-C664 VanDerWaalsContact ND1-SG 3.38Å; F661-C664 HydrophobicContact CB-CB 4.44Å; C664-Y668 VanDerWaalsContact SG-CB 3.59Å; C664-Y668 VanDerWaalsContact SG-CD2 3.55Å; C664-Y668 VanDerWaalsContact SG-CG 3.51Å
665	P	82.6	Confident	85.5	Confident	47 Å²	47	58.3 Å²	58.3	31%	0.305	32%	0.319	S	S	.	.			trans	-59.7	144	173.8	-21.7	32.1	0	0	0	111.6	D667 Y668 F712	P665-D667 PolarHBondContact O-N 3.35Å; P665-Y668 VanDerWaalsContact O-CB 3.28Å; P665-Y668 WeakPolarHBondContact O-CB 3.43Å; P665-Y668 PolarHBondContact O-N 3.01Å; P665-F712 HydrophobicContact CG-CD1 3.51Å; P665-F712 HydrophobicContact CG-CE1 3.8Å; P665-F712 HydrophobicContact CG-CG 4.39Å
666	P	80	Confident	85.4	Confident	127 Å²	127	54.4 Å²	54.4	83%	0.825	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.2	178.2	24.2	-32.6	0	0	0	112.3	Y668	P666-Y668 VanDerWaalsContact C-N 3.3Å; P666-Y668 PolarHBondContact O-N 3.34Å
667	D	84.2	Confident	85.1	Confident	73 Å²	73	56.8 Å²	56.8	39%	0.39	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	6.5	-177.9	-62.7	-26.7	0	0	0	114.5	P665 H669 H670 I671	P665-D667 PolarHBondContact O-N 3.35Å; D667-H669 PolarHBondContact O-N 3Å; D667-H670 PolarHBondContact O-N 2.87Å; D667-H670 VanDerWaalsContact O-N 3.15Å; D667-I671 HydrophobicContact CB-CD1 3.86Å; D667-I671 HydrophobicContact CB-CG1 4.14Å; D667-I671 WeakPolarHBondContact O-CG1 3.4Å; D667-I671 PolarHBondContact O-N 3.06Å
668	Y	86.8	Confident	84.7	Confident	3 Å²	3	59.8 Å²	59.8	1%	0.012	32%	0.321	C	S	.	.	H	α-helix	trans	-53.1	-49.1	-173.9	-178.6	-86.6	0	0	0	113.4	P654 H658 F661 C664 P665 P666 H672 A684 F712 F715	P654-Y668 VanDerWaalsContact CA-OH 3.26Å; P654-Y668 WeakPolarHBondContact CA-OH 3.47Å; P654-Y668 HydrophobicContact CB-CE1 4.37Å; P654-Y668 PolarHBondContact O-OH 3.49Å; H658-Y668 HydrophobicContact CB-CE1 3.93Å; H658-Y668 AromaticContact ND1-CD1 3.43Å; H658-Y668 WeakPolarHBondContact ND1-CD1 3.48Å; H658-Y668 AromaticContact ND1-CE1 3.58Å; F661-Y668 HydrophobicContact CD2-CE2 4.26Å; F661-Y668 AromaticContact CE2-CE2 3.75Å; F661-Y668 HydrophobicContact CE2-CE2 3.75Å; F661-Y668 AromaticContact CE2-CZ 3.96Å; C664-Y668 VanDerWaalsContact SG-CB 3.59Å; C664-Y668 VanDerWaalsContact SG-CD2 3.55Å; C664-Y668 VanDerWaalsContact SG-CG 3.51Å; P665-Y668 VanDerWaalsContact O-CB 3.28Å; P665-Y668 WeakPolarHBondContact O-CB 3.43Å; P665-Y668 PolarHBondContact O-N 3.01Å; P666-Y668 VanDerWaalsContact C-N 3.3Å; P666-Y668 PolarHBondContact O-N 3.34Å; Y668-H672 VanDerWaalsContact O-CB 3.32Å; Y668-H672 WeakPolarHBondContact O-CB 3.48Å; Y668-H672 PolarHBondContact O-N 3.09Å; Y668-H672 VanDerWaalsContact O-N 3.11Å; Y668-A684 WeakPolarHBondContact OH-CB 3.39Å; Y668-F712 HydrophobicContact CD2-CD2 4.15Å; Y668-F712 AromaticContact CD2-CE2 3.87Å; Y668-F712 HydrophobicContact CD2-CE2 3.87Å; Y668-F712 HydrophobicContact CD2-CZ 4.09Å; Y668-F712 AromaticContact CE2-CD2 3.72Å; Y668-F712 HydrophobicContact CE2-CD2 3.72Å; Y668-F712 AromaticContact CE2-CE2 3.47Å; Y668-F712 HydrophobicContact CE2-CE2 3.47Å; Y668-F712 VanDerWaalsContact CE2-CE2 3.47Å; Y668-F712 HydrophobicContact CE2-CZ 4.13Å; Y668-F715 HydrophobicContact CD1-CZ 4Å; Y668-F715 HydrophobicContact CD2-CE1 4.25Å; Y668-F715 AromaticContact CD2-CE2 3.87Å; Y668-F715 HydrophobicContact CD2-CE2 3.87Å; Y668-F715 AromaticContact CD2-CZ 3.37Å; Y668-F715 HydrophobicContact CD2-CZ 3.37Å; Y668-F715 HydrophobicContact CE1-CE1 4.28Å; Y668-F715 AromaticContact CE1-CZ 3.81Å; Y668-F715 HydrophobicContact CE1-CZ 3.81Å; Y668-F715 AromaticContact CE2-CE1 3.59Å; Y668-F715 HydrophobicContact CE2-CE1 3.59Å; Y668-F715 HydrophobicContact CE2-CE2 4.03Å; Y668-F715 AromaticContact CE2-CZ 3.16Å; Y668-F715 HydrophobicContact CE2-CZ 3.16Å; Y668-F715 HydrophobicContact CG-CE2 4.3Å; Y668-F715 AromaticContact CG-CZ 3.79Å; Y668-F715 HydrophobicContact CG-CZ 3.79Å; Y668-F715 AromaticContact CZ-CE1 3.58Å; Y668-F715 AromaticContact CZ-CZ 3.38Å
669	H	85.1	Confident	84.2	Confident	94 Å²	94	57.3 Å²	57.3	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-71	-36.1	-179.4	-76	-65.5	0	0	0	112.4	H658 D667 T673	H658-H669 AromaticContact CD2-CE1 3.89Å; H658-H669 AromaticContact CD2-NE2 3.45Å; H658-H669 PolarHBondContact CD2-NE2 3.44Å; H658-H669 AromaticContact CE1-CD2 3.89Å; H658-H669 AromaticContact CE1-NE2 3.28Å; H658-H669 PolarHBondContact CE1-NE2 3.24Å; H658-H669 VanDerWaalsContact CE1-NE2 3.28Å; H658-H669 AromaticContact CG-NE2 3.85Å; H658-H669 AromaticContact ND1-NE2 3.74Å; H658-H669 AromaticContact NE2-CD2 3.95Å; H658-H669 AromaticContact NE2-CE1 3.92Å; H658-H669 AromaticContact NE2-NE2 3.04Å; H658-H669 PolarHBondContact NE2-NE2 2.84Å; D667-H669 PolarHBondContact O-N 3Å; H669-T673 VanDerWaalsContact O-CB 3.3Å; H669-T673 WeakPolarHBondContact O-CB 3.33Å; H669-T673 PolarHBondContact O-N 3.21Å; H669-T673 PolarHBondContact O-OG1 3.2Å
670	H	85.6	Confident	84	Confident	116 Å²	116	52.7 Å²	52.7	54%	0.537	28%	0.282	S	S	.	.	H	α-helix	trans	-64.8	-53.3	178.6	-176.2	-89.1	0	0	0	110.5	D667 H672 T673 E674	D667-H670 PolarHBondContact O-N 2.87Å; D667-H670 VanDerWaalsContact O-N 3.15Å; H670-H672 PolarHBondContact O-N 3.23Å; H670-T673 PolarHBondContact O-N 3.11Å; H670-E674 IonicContact CE1-OE2 3.69Å; H670-E674 PolarHBondContact CE1-OE2 2.91Å; H670-E674 IonicContact ND1-OE2 3.56Å; H670-E674 WeakPolarHBondContact O-CB 3.43Å; H670-E674 PolarHBondContact O-N 3.49Å
671	I	86.3	Confident	83.8	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-46.2	179	-65.5	169.4	0	0	0	111	A546 D667 T673 E674 I675 F715	A546-I671 HydrophobicContact CB-CG2 4.35Å; D667-I671 HydrophobicContact CB-CD1 3.86Å; D667-I671 HydrophobicContact CB-CG1 4.14Å; D667-I671 WeakPolarHBondContact O-CG1 3.4Å; D667-I671 PolarHBondContact O-N 3.06Å; I671-T673 PolarHBondContact O-N 3.43Å; I671-E674 PolarHBondContact O-N 3.17Å; I671-I675 HydrophobicContact CG2-CD1 3.59Å; I671-I675 HydrophobicContact CG2-CG1 4.4Å; I671-I675 WeakPolarHBondContact O-CB 3.15Å; I671-I675 VanDerWaalsContact O-CG1 3.28Å; I671-I675 WeakPolarHBondContact O-CG1 3.48Å; I671-I675 PolarHBondContact O-N 3.41Å; I671-F715 HydrophobicContact CB-CE2 4.42Å; I671-F715 HydrophobicContact CG2-CD2 3.96Å; I671-F715 HydrophobicContact CG2-CE2 4.21Å
672	H	85.8	Confident	83.7	Confident	29 Å²	29	56.3 Å²	56.3	13%	0.134	29%	0.294	C	S	.	.	H	α-helix	trans	-58.5	-48.5	177.1	164.2	-118.8	0	0	0	112.1	Y668 H670 S676 F715	Y668-H672 VanDerWaalsContact O-CB 3.32Å; Y668-H672 WeakPolarHBondContact O-CB 3.48Å; Y668-H672 PolarHBondContact O-N 3.09Å; Y668-H672 VanDerWaalsContact O-N 3.11Å; H670-H672 PolarHBondContact O-N 3.23Å; H672-S676 VanDerWaalsContact O-CB 3.27Å; H672-S676 WeakPolarHBondContact O-CB 3.25Å; H672-S676 PolarHBondContact O-N 3.15Å; H672-S676 PolarHBondContact O-OG 3.23Å; H672-F715 HydrophobicContact CB-CE2 4.44Å; H672-F715 HydrophobicContact CB-CZ 4.03Å
673	T	83.4	Confident	83.9	Confident	48 Å²	48	53.7 Å²	53.7	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-44.7	-177.1	-56.8	0	0	0	0	110.9	H669 H670 I671 S676 R677	H669-T673 VanDerWaalsContact O-CB 3.3Å; H669-T673 WeakPolarHBondContact O-CB 3.33Å; H669-T673 PolarHBondContact O-N 3.21Å; H669-T673 PolarHBondContact O-OG1 3.2Å; H670-T673 PolarHBondContact O-N 3.11Å; I671-T673 PolarHBondContact O-N 3.43Å; T673-S676 PolarHBondContact O-N 2.82Å; T673-R677 WeakPolarHBondContact O-CG 3.18Å; T673-R677 PolarHBondContact O-N 2.91Å
674	E	84.8	Confident	84.4	Confident	57 Å²	57	46.3 Å²	46.3	27%	0.266	24%	0.239	S	C	.	.	H	α-helix	trans	-67	-43.9	-177.6	-158.5	-177.1	165.2	0	0	112.4	K552 H670 I671 S676 R677 E678	K552-E674 HydrophobicContact CD-CG 4.28Å; K552-E674 VanDerWaalsContact CD-OE1 3.27Å; K552-E674 WeakPolarHBondContact CD-OE1 3.22Å; K552-E674 WeakPolarHBondContact CE-OE1 3.41Å; K552-E674 IonicContact NZ-OE1 2.69Å; K552-E674 PolarHBondContact NZ-OE1 3.3Å; H670-E674 IonicContact CE1-OE2 3.69Å; H670-E674 PolarHBondContact CE1-OE2 2.91Å; H670-E674 IonicContact ND1-OE2 3.56Å; H670-E674 WeakPolarHBondContact O-CB 3.43Å; H670-E674 PolarHBondContact O-N 3.49Å; I671-E674 PolarHBondContact O-N 3.17Å; E674-S676 VanDerWaalsContact C-N 3.31Å; E674-S676 PolarHBondContact O-N 3.21Å; E674-R677 WeakPolarHBondContact O-CB 3.25Å; E674-R677 PolarHBondContact O-N 3.04Å; E674-E678 PolarHBondContact O-N 3.35Å
675	I	85.1	Confident	85.1	Confident	2 Å²	2	44 Å²	44	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-66.7	-35.8	175.9	-64.7	172.6	0	0	0	111	A546 I671 R677 E678 A680 V682 V717	A546-I675 HydrophobicContact CB-CD1 3.29Å; I671-I675 HydrophobicContact CG2-CD1 3.59Å; I671-I675 HydrophobicContact CG2-CG1 4.4Å; I671-I675 WeakPolarHBondContact O-CB 3.15Å; I671-I675 VanDerWaalsContact O-CG1 3.28Å; I671-I675 WeakPolarHBondContact O-CG1 3.48Å; I671-I675 PolarHBondContact O-N 3.41Å; I675-R677 VanDerWaalsContact C-N 3.3Å; I675-R677 PolarHBondContact O-N 3.26Å; I675-E678 WeakPolarHBondContact O-CB 3.22Å; I675-E678 PolarHBondContact O-N 3.21Å; I675-A680 HydrophobicContact CG2-CB 3.93Å; I675-V682 HydrophobicContact CB-CG2 4Å; I675-V682 HydrophobicContact CG2-CG2 3.45Å; I675-V682 VanDerWaalsContact CG2-CG2 3.45Å; I675-V717 HydrophobicContact CD1-CG2 4.12Å; I675-V717 HydrophobicContact CG2-CB 4.48Å; I675-V717 HydrophobicContact CG2-CG1 3.71Å; I675-V717 HydrophobicContact CG2-CG2 3.93Å
676	S	82.7	Confident	85.6	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.028	21%	0.21	C	C	.	.	H	α-helix	trans	-67	-31.2	175.3	-60.4	0	0	0	0	112.6	H672 T673 E674 E678 G679	H672-S676 VanDerWaalsContact O-CB 3.27Å; H672-S676 WeakPolarHBondContact O-CB 3.25Å; H672-S676 PolarHBondContact O-N 3.15Å; H672-S676 PolarHBondContact O-OG 3.23Å; T673-S676 PolarHBondContact O-N 2.82Å; E674-S676 VanDerWaalsContact C-N 3.31Å; E674-S676 PolarHBondContact O-N 3.21Å; S676-E678 VanDerWaalsContact C-N 3.26Å; S676-E678 PolarHBondContact O-N 3.08Å; S676-G679 PolarHBondContact O-N 3.19Å; S676-G679 VanDerWaalsContact O-N 3.08Å
677	R	82	Confident	86.2	Confident	80 Å²	80	36 Å²	36	30%	0.302	17%	0.171	S	C	.	.	H	α-helix	trans	-66.6	-26.5	172.9	-75.8	175.2	-179.4	161.2	1.2	112.8	T673 E674 I675 G679 H753 I784 D785	T673-R677 WeakPolarHBondContact O-CG 3.18Å; T673-R677 PolarHBondContact O-N 2.91Å; E674-R677 WeakPolarHBondContact O-CB 3.25Å; E674-R677 PolarHBondContact O-N 3.04Å; I675-R677 VanDerWaalsContact C-N 3.3Å; I675-R677 PolarHBondContact O-N 3.26Å; R677-G679 PolarHBondContact O-N 2.74Å; R677-H753 PolarHBondContact O-ND1 3.13Å; R677-I784 HydrophobicContact CG-CG2 4.05Å; R677-I784 PolarHBondContact NE-O 2.84Å; R677-I784 PolarHBondContact NH2-O 2.91Å; R677-D785 IonicContact CZ-OD1 3.6Å; R677-D785 IonicContact NE-OD1 3.47Å
678	E	82.2	Confident	86.6	Confident	64 Å²	64	34.5 Å²	34.5	30%	0.299	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	8.2	170.8	-59.8	-172.4	172	0	0	113.2	R543 K552 E674 I675 S676 A680 H753	R543-E678 IonicContact CZ-OE2 2.77Å; R543-E678 IonicContact NH1-OE2 3.18Å; R543-E678 PolarHBondContact NH1-OE2 3.15Å; K552-E678 WeakPolarHBondContact CE-OE1 3.31Å; K552-E678 IonicContact NZ-OE1 2.9Å; K552-E678 PolarHBondContact NZ-OE1 3.44Å; E674-E678 PolarHBondContact O-N 3.35Å; I675-E678 WeakPolarHBondContact O-CB 3.22Å; I675-E678 PolarHBondContact O-N 3.21Å; S676-E678 VanDerWaalsContact C-N 3.26Å; S676-E678 PolarHBondContact O-N 3.08Å; E678-A680 PolarHBondContact O-N 3.35Å; E678-H753 PolarHBondContact O-NE2 3.16Å
679	G	77.6	Confident	86.7	Confident	13 Å²	13	39.1 Å²	39.1	13%	0.134	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	7	178.9	0	0	0	0	0	114.4	S676 R677 T750	S676-G679 PolarHBondContact O-N 3.19Å; S676-G679 VanDerWaalsContact O-N 3.08Å; R677-G679 PolarHBondContact O-N 2.74Å; G679-T750 WeakPolarHBondContact O-CG2 3.23Å
680	A	83.6	Confident	86.7	Confident	6 Å²	6	37.1 Å²	37.1	5%	0.05	18%	0.175	C	C	.	.			trans	-80.2	143.2	176.3	0	0	0	0	0	111.4	I675 E678 V717	I675-A680 HydrophobicContact CG2-CB 3.93Å; E678-A680 PolarHBondContact O-N 3.35Å; A680-V717 HydrophobicContact CB-CG1 3.49Å; A680-V717 VanDerWaalsContact CB-CG1 3.49Å
681	R	84.3	Confident	86.6	Confident	117 Å²	117	33.1 Å²	33.1	44%	0.442	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	121.6	169.3	-174.6	173	-178.7	174.2	-2.6	108.7	V718	R681-V718 HydrophobicContact CB-CB 4.48Å; R681-V718 WeakPolarHBondContact CB-O 3.25Å; R681-V718 PolarHBondContact N-O 2.71Å; R681-V718 PolarHBondContact O-N 3.05Å
682	V	88.3	Confident	86.4	Confident	12 Å²	12	39 Å²	39	7%	0.073	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134	-177.1	-172.7	0	0	0	0	110.2	P654 I675 F715 I716	P654-V682 HydrophobicContact CG-CB 4.48Å; P654-V682 HydrophobicContact CG-CG1 4.16Å; I675-V682 HydrophobicContact CB-CG2 4Å; I675-V682 HydrophobicContact CG2-CG2 3.45Å; I675-V682 VanDerWaalsContact CG2-CG2 3.45Å; V682-F715 HydrophobicContact CG1-CB 3.77Å; V682-F715 HydrophobicContact CG1-CD1 3.59Å; V682-F715 HydrophobicContact CG1-CE1 4.35Å; V682-F715 HydrophobicContact CG1-CG 3.83Å; V682-I716 WeakPolarHBondContact CA-O 3.36Å
683	L	90.6	Very high	86.1	Confident	22 Å²	22	39.1 Å²	39.1	12%	0.115	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.2	170.9	-65.5	166.6	0	0	0	110.1	L587 M591 F715 I716	L587-L683 HydrophobicContact CD2-CD1 3.82Å; M591-L683 HydrophobicContact CE-CD1 3.68Å; L683-F715 CarbonylContact O-C 3.54Å; L683-F715 WeakPolarHBondContact O-CA 3.46Å; L683-I716 HydrophobicContact CB-CG2 3.66Å; L683-I716 HydrophobicContact CD1-CG2 4.45Å; L683-I716 PolarHBondContact N-O 3.48Å; L683-I716 VanDerWaalsContact N-O 3.07Å; L683-I716 PolarHBondContact O-N 2.85Å
684	A	92.8	Very high	85.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	142.4	175.3	0	0	0	0	0	110.4	K651 G652 P654 L657 F661 Y668 F715	K651-A684 WeakPolarHBondContact CA-O 3.38Å; G652-A684 PolarHBondContact N-O 3.28Å; G652-A684 VanDerWaalsContact N-O 3.14Å; G652-A684 PolarHBondContact O-N 2.92Å; P654-A684 HydrophobicContact CB-CB 4.45Å; P654-A684 HydrophobicContact CG-CB 4.37Å; L657-A684 HydrophobicContact CB-CB 4.17Å; L657-A684 HydrophobicContact CD2-CB 4.02Å; L657-A684 WeakPolarHBondContact CD2-O 3.4Å; F661-A684 HydrophobicContact CZ-CB 4.3Å; Y668-A684 WeakPolarHBondContact OH-CB 3.39Å; A684-F715 HydrophobicContact CB-CD1 3.99Å; A684-F715 HydrophobicContact CB-CE1 3.81Å
685	L	93.4	Very high	85.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.8	176.4	-56.2	171.7	0	0	0	109.9	T564 L568 K651 V713 G714 I716	T564-L685 HydrophobicContact CG2-CD1 4.01Å; L568-L685 HydrophobicContact CD1-CD1 4.37Å; L568-L685 HydrophobicContact CD2-CD1 3.68Å; L568-L685 HydrophobicContact CD2-CD2 3.85Å; L568-L685 HydrophobicContact CD2-CG 4.41Å; L568-L685 HydrophobicContact CG-CD1 3.86Å; K651-L685 HydrophobicContact CB-CD2 3.76Å; L685-V713 HydrophobicContact CB-CG2 3.57Å; L685-V713 PolarHBondContact O-N 3.02Å; L685-V713 VanDerWaalsContact O-N 3.08Å; L685-G714 WeakPolarHBondContact CB-O 3.33Å; L685-G714 PolarHBondContact N-O 3.46Å; L685-I716 HydrophobicContact CD1-CB 4.44Å; L685-I716 HydrophobicContact CD2-CG2 4.35Å
686	G	93.1	Very high	84.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.1	174.4	0	0	0	0	0	111.7	V650 K711	V650-G686 PolarHBondContact N-O 3.34Å; V650-G686 PolarHBondContact O-N 2.98Å; G686-K711 WeakPolarHBondContact CA-O 3.28Å
687	Y	93.1	Very high	84.5	Confident	4 Å²	4	54 Å²	54	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.9	-179.6	-177.6	-98.7	0	0	0	110.4	E563 R566 I647 E689 K711 V713	E563-Y687 HydrophobicContact CB-CD1 4.36Å; E563-Y687 HydrophobicContact CB-CE1 4.44Å; E563-Y687 HydrophobicContact CG-CD1 4.45Å; E563-Y687 HydrophobicContact CG-CE1 4.2Å; R566-Y687 HydrophobicContact CB-CE2 4.35Å; I647-Y687 HydrophobicContact CB-CE2 4.1Å; I647-Y687 HydrophobicContact CD1-CE2 3.92Å; I647-Y687 HydrophobicContact CG2-CE2 4.14Å; I647-Y687 WeakPolarHBondContact CG2-OH 3.33Å; Y687-E689 HydrophobicContact CD1-CG 4.31Å; Y687-E689 HydrophobicContact CE1-CG 3.35Å; Y687-E689 PolarHBondContact OH-OE1 3.07Å; Y687-K711 PolarHBondContact N-O 3.4Å; Y687-K711 WeakPolarHBondContact O-CA 3.36Å; Y687-K711 VanDerWaalsContact O-CB 3.25Å; Y687-K711 WeakPolarHBondContact O-CB 3.47Å; Y687-K711 PolarHBondContact O-N 3.49Å; Y687-V713 VanDerWaalsContact CB-CG1 3.5Å; Y687-V713 HydrophobicContact CG-CG1 4.35Å
688	K	92.4	Very high	84.2	Confident	43 Å²	43	50.5 Å²	50.5	19%	0.187	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	130.6	175.8	175.3	-178.7	-175.9	178.4	0	109.7	I647 A648 L690 A705 C708 L710	I647-K688 CarbonylContact C-O 3.46Å; I647-K688 WeakPolarHBondContact CA-O 3.26Å; A648-K688 HydrophobicContact CB-CB 4.27Å; A648-K688 PolarHBondContact N-O 3.24Å; A648-K688 PolarHBondContact O-N 3.33Å; K688-L690 HydrophobicContact CD-CD2 4.2Å; K688-L690 HydrophobicContact CG-CD2 4.34Å; K688-A705 PolarHBondContact NZ-O 3.42Å; K688-A705 VanDerWaalsContact NZ-O 3.07Å; K688-C708 WeakPolarHBondContact CD-O 3.25Å; K688-C708 PolarHBondContact NZ-O 2.7Å; K688-C708 PolarHBondContact NZ-SG 3.14Å; K688-L710 HydrophobicContact CB-CD2 3.94Å; K688-L710 HydrophobicContact CD-CD2 4.45Å
689	E	88.9	Confident	83.8	Confident	100 Å²	100	55.5 Å²	55.5	47%	0.467	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.8	173.3	-57.7	-161.4	149.5	0	0	109.8	I647 Y687	I647-E689 HydrophobicContact CG2-CG 4.32Å; Y687-E689 HydrophobicContact CD1-CG 4.31Å; Y687-E689 HydrophobicContact CE1-CG 3.35Å; Y687-E689 PolarHBondContact OH-OE1 3.07Å
690	L	84.5	Confident	83.9	Confident	51 Å²	51	61.3 Å²	61.3	27%	0.267	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-4.3	-177.7	-65.8	168.5	0	0	0	112.5	L633 Y646 A648 K688 L693 L706	L633-L690 HydrophobicContact CD1-CD1 3.66Å; Y646-L690 PolarHBondContact O-N 3.47Å; A648-L690 HydrophobicContact CB-CD1 4.09Å; K688-L690 HydrophobicContact CD-CD2 4.2Å; K688-L690 HydrophobicContact CG-CD2 4.34Å; L690-L693 HydrophobicContact CB-CD1 4.2Å; L690-L693 HydrophobicContact CD1-CD1 4.31Å; L690-L706 HydrophobicContact CD1-CD2 3.7Å
691	G	83	Confident	83.8	Confident	32 Å²	32	62.2 Å²	62.2	33%	0.33	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73	-137.6	179.7	0	0	0	0	0	112.4	Y646	Y646-G691 PolarHBondContact N-O 2.61Å
692	H	82	Confident	83.7	Confident	134 Å²	134	63.8 Å²	63.8	62%	0.62	31%	0.307	S	S	*	.			trans	-96.7	125.1	-179.1	-170.3	73.7	0	0	0	110.5	L644	L644-H692 PolarHBondContact O-ND1 3.24Å
693	L	79.6	Confident	83.5	Confident	32 Å²	32	65.1 Å²	65.1	17%	0.168	31%	0.311	C	S	.	.			trans	-121.3	141.4	175.2	-67.2	170.7	0	0	0	109.7	Y646 L690 Q697	Y646-L693 HydrophobicContact CD1-CB 4.48Å; Y646-L693 HydrophobicContact CD1-CD1 4.28Å; Y646-L693 HydrophobicContact CD2-CB 3.72Å; Y646-L693 HydrophobicContact CD2-CD1 4.44Å; Y646-L693 HydrophobicContact CD2-CG 4.22Å; Y646-L693 HydrophobicContact CE2-CB 3.8Å; Y646-L693 WeakPolarHBondContact CE2-O 3.21Å; Y646-L693 HydrophobicContact CG-CB 4.06Å; Y646-L693 HydrophobicContact CG-CD1 3.98Å; Y646-L693 HydrophobicContact CG-CG 4.26Å; Y646-L693 PolarHBondContact OH-O 3.46Å; L690-L693 HydrophobicContact CB-CD1 4.2Å; L690-L693 HydrophobicContact CD1-CD1 4.31Å; L693-Q697 HydrophobicContact CD2-CB 4.48Å
694	T	78.3	Confident	83.2	Confident	70 Å²	70	70.5 Å²	70.5	43%	0.429	34%	0.335	S	S	.	.			trans	-69.6	155.3	169.3	60.7	0	0	0	0	110.7	Q696 Q697 A698	T694-Q696 PolarHBondContact O-N 3.19Å; T694-Q696 VanDerWaalsContact O-N 3.15Å; T694-Q697 VanDerWaalsContact N-OE1 3.15Å; T694-Q697 PolarHBondContact O-N 2.92Å; T694-Q697 WeakPolarHBondContact OG1-CB 3.44Å; T694-Q697 WeakPolarHBondContact OG1-CG 3.45Å; T694-Q697 PolarHBondContact OG1-N 3.46Å; T694-Q697 PolarHBondContact OG1-OE1 3.41Å; T694-A698 PolarHBondContact O-N 2.95Å
695	H	74.5	Confident	82.9	Confident	112 Å²	112	72.7 Å²	72.7	52%	0.519	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.7	-177.4	-160.2	-60.7	0	0	0	113.3
696	Q	73.2	Confident	82.5	Confident	140 Å²	140	72.7 Å²	72.7	65%	0.654	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-46.9	175.6	-168.3	169.7	-5.2	0	0	111.2	T694 A698 R699 E700	T694-Q696 PolarHBondContact O-N 3.19Å; T694-Q696 VanDerWaalsContact O-N 3.15Å; Q696-A698 VanDerWaalsContact C-N 3.27Å; Q696-A698 PolarHBondContact O-N 2.92Å; Q696-R699 PolarHBondContact O-N 2.76Å; Q696-R699 VanDerWaalsContact O-N 3.1Å; Q696-E700 PolarHBondContact O-N 3.05Å
697	Q	77.9	Confident	82.3	Confident	101 Å²	101	73.2 Å²	73.2	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-58.5	-40	174.7	-73.7	166.9	-28.9	0	0	111.9	L693 T694 R699 E700 V701	L693-Q697 HydrophobicContact CD2-CB 4.48Å; T694-Q697 VanDerWaalsContact N-OE1 3.15Å; T694-Q697 PolarHBondContact O-N 2.92Å; T694-Q697 WeakPolarHBondContact OG1-CB 3.44Å; T694-Q697 WeakPolarHBondContact OG1-CG 3.45Å; T694-Q697 PolarHBondContact OG1-N 3.46Å; T694-Q697 PolarHBondContact OG1-OE1 3.41Å; Q697-R699 PolarHBondContact O-N 2.89Å; Q697-E700 PolarHBondContact O-N 3.16Å; Q697-V701 WeakPolarHBondContact O-CG2 3.44Å; Q697-V701 PolarHBondContact O-N 2.83Å
698	A	75.3	Confident	82	Confident	6 Å²	6	75.4 Å²	75.4	5%	0.05	37%	0.371	C	S	.	.	H	α-helix	trans	-62	-26.1	178.5	0	0	0	0	0	113.9	L633 Y646 T694 Q696	L633-A698 HydrophobicContact CD2-CB 4.3Å; L633-A698 WeakPolarHBondContact CD2-O 3.41Å; Y646-A698 HydrophobicContact CE1-CB 3.88Å; T694-A698 PolarHBondContact O-N 2.95Å; Q696-A698 VanDerWaalsContact C-N 3.27Å; Q696-A698 PolarHBondContact O-N 2.92Å
699	R	73.6	Confident	81.9	Confident	170 Å²	170	77.3 Å²	77.3	64%	0.642	39%	0.39	S	S	*	.	H	α-helix	trans	-85.2	-28.6	176.6	-75.2	-175.8	173.3	-172.2	-1	113.3	Q696 Q697	Q696-R699 PolarHBondContact O-N 2.76Å; Q696-R699 VanDerWaalsContact O-N 3.1Å; Q697-R699 PolarHBondContact O-N 2.89Å
700	E	78.8	Confident	82	Confident	134 Å²	134	72.5 Å²	72.5	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-90.2	-3.7	-176.4	-68.6	174.4	-170.2	0	0	113	Q696 Q697 K702	Q696-E700 PolarHBondContact O-N 3.05Å; Q697-E700 PolarHBondContact O-N 3.16Å; E700-K702 PolarHBondContact O-N 3.39Å
701	V	81.3	Confident	82.4	Confident	26 Å²	26	74.5 Å²	74.5	16%	0.158	37%	0.374	C	S	.	.			trans	-62.2	120.3	179.3	-170.7	0	0	0	0	110.4	L633 Q697 A705 L706	L633-V701 HydrophobicContact CD2-CG2 4.4Å; Q697-V701 WeakPolarHBondContact O-CG2 3.44Å; Q697-V701 PolarHBondContact O-N 2.83Å; V701-A705 HydrophobicContact CG1-CB 4.1Å; V701-L706 HydrophobicContact CG1-CD2 3.66Å; V701-L706 HydrophobicContact CG1-CG 3.83Å
702	K	82.3	Confident	82.8	Confident	149 Å²	149	74.1 Å²	74.1	65%	0.648	36%	0.363	S	S	*	.			trans	-79.2	155.1	175.5	-62	-174.4	179.2	-179.7	0	111.8	E700 E704 A705	E700-K702 PolarHBondContact O-N 3.39Å; K702-E704 VanDerWaalsContact C-N 3.28Å; K702-E704 WeakPolarHBondContact CB-OE2 3.19Å; K702-E704 PolarHBondContact O-N 2.88Å; K702-A705 WeakPolarHBondContact O-CB 3.38Å; K702-A705 PolarHBondContact O-N 3.04Å; K702-A705 VanDerWaalsContact O-N 3.12Å
703	R	84.8	Confident	83.2	Confident	41 Å²	41	68 Å²	68	16%	0.155	34%	0.335	C	S	.	.	H	α-helix	trans	-54.6	-42.1	179.8	-171.4	175.5	-170.1	149.4	12.8	112.4	F621 H622 R629 A705 L706 E707	F621-R703 HydrophobicContact CB-CG 4.39Å; F621-R703 HydrophobicContact CD1-CB 3.83Å; F621-R703 HydrophobicContact CD1-CG 3.95Å; F621-R703 HydrophobicContact CE1-CB 3.78Å; F621-R703 HydrophobicContact CE1-CG 4.41Å; F621-R703 HydrophobicContact CG-CB 4.31Å; F621-R703 HydrophobicContact CG-CG 4.07Å; F621-R703 HydrophobicContact CZ-CB 4.25Å; H622-R703 PolarHBondContact O-NH2 3.43Å; H622-R703 VanDerWaalsContact O-NH2 3.16Å; R629-R703 PolarHBondContact O-NH2 2.88Å; R703-A705 VanDerWaalsContact C-N 3.25Å; R703-A705 PolarHBondContact O-N 2.97Å; R703-L706 PolarHBondContact O-N 3.49Å; R703-E707 VanDerWaalsContact CG-CD 3.48Å; R703-E707 HydrophobicContact CG-CG 4.28Å; R703-E707 WeakPolarHBondContact CG-OE1 3.18Å; R703-E707 IonicContact CZ-OE1 3.48Å; R703-E707 IonicContact NE-OE1 2.91Å; R703-E707 PolarHBondContact NE-OE1 3.46Å; R703-E707 IonicContact NE-OE2 2.75Å; R703-E707 IonicContact NH2-OE1 2.69Å; R703-E707 WeakPolarHBondContact O-CG 3.23Å; R703-E707 PolarHBondContact O-N 3.35Å; R703-E707 VanDerWaalsContact O-N 3.11Å
704	E	85.3	Confident	83.8	Confident	134 Å²	134	66.4 Å²	66.4	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-29.3	-177.3	-56.1	80.5	-164.3	0	0	112.7	K702 E707	K702-E704 VanDerWaalsContact C-N 3.28Å; K702-E704 WeakPolarHBondContact CB-OE2 3.19Å; K702-E704 PolarHBondContact O-N 2.88Å; E704-E707 PolarHBondContact O-N 3.22Å
705	A	85.4	Confident	84.4	Confident	47 Å²	47	63.1 Å²	63.1	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-74.2	-29.6	179.1	0	0	0	0	0	112.7	K688 V701 K702 R703 C708	K688-A705 PolarHBondContact NZ-O 3.42Å; K688-A705 VanDerWaalsContact NZ-O 3.07Å; V701-A705 HydrophobicContact CG1-CB 4.1Å; K702-A705 WeakPolarHBondContact O-CB 3.38Å; K702-A705 PolarHBondContact O-N 3.04Å; K702-A705 VanDerWaalsContact O-N 3.12Å; R703-A705 VanDerWaalsContact C-N 3.25Å; R703-A705 PolarHBondContact O-N 2.97Å; A705-C708 PolarHBondContact O-SG 3.4Å; A705-C708 VanDerWaalsContact O-SG 3.33Å
706	L	85.5	Confident	85.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-77.6	-34.7	173.8	-61.1	-176.8	0	0	0	111.7	F621 L633 A648 L690 V701 R703 C708 L710	F621-L706 HydrophobicContact CD2-CD1 3.7Å; F621-L706 HydrophobicContact CE2-CD1 3.38Å; F621-L706 HydrophobicContact CZ-CD1 4.48Å; L633-L706 HydrophobicContact CB-CD1 4.25Å; L633-L706 HydrophobicContact CD1-CD2 4.14Å; A648-L706 HydrophobicContact CB-CB 4.38Å; A648-L706 HydrophobicContact CB-CD2 3.89Å; L690-L706 HydrophobicContact CD1-CD2 3.7Å; V701-L706 HydrophobicContact CG1-CD2 3.66Å; V701-L706 HydrophobicContact CG1-CG 3.83Å; R703-L706 PolarHBondContact O-N 3.49Å; L706-C708 VanDerWaalsContact C-N 3.32Å; L706-C708 PolarHBondContact O-N 3.17Å; L706-L710 WeakPolarHBondContact O-CD2 3.34Å
707	E	88.4	Confident	86	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.056	25%	0.251	C	S	.	.	S	Bend	trans	-92.7	30.4	-172	-64.2	179.2	173.7	0	0	113.9	R629 S631 M660 R703 E704	R629-E707 IonicContact CZ-OE2 3.66Å; R629-E707 VanDerWaalsContact NE-CD 3.32Å; R629-E707 IonicContact NE-OE1 3.7Å; R629-E707 IonicContact NE-OE2 3.35Å; R629-E707 PolarHBondContact NE-OE2 3.19Å; R629-E707 IonicContact NH2-OE2 3.68Å; R629-E707 PolarHBondContact NH2-OE2 3.19Å; S631-E707 PolarHBondContact OG-OE1 3.26Å; M660-E707 HydrophobicContact SD-CB 4.31Å; R703-E707 VanDerWaalsContact CG-CD 3.48Å; R703-E707 HydrophobicContact CG-CG 4.28Å; R703-E707 WeakPolarHBondContact CG-OE1 3.18Å; R703-E707 IonicContact CZ-OE1 3.48Å; R703-E707 IonicContact NE-OE1 2.91Å; R703-E707 PolarHBondContact NE-OE1 3.46Å; R703-E707 IonicContact NE-OE2 2.75Å; R703-E707 IonicContact NH2-OE1 2.69Å; R703-E707 WeakPolarHBondContact O-CG 3.23Å; R703-E707 PolarHBondContact O-N 3.35Å; R703-E707 VanDerWaalsContact O-N 3.11Å; E704-E707 PolarHBondContact O-N 3.22Å
708	C	88.1	Confident	86.5	Confident	50 Å²	50	46.4 Å²	46.4	34%	0.338	23%	0.229	S	C	.	.	S	Bend	trans	-132.7	146.3	179.5	69.5	0	0	0	0	112.7	K688 A705 L706 L710	K688-C708 WeakPolarHBondContact CD-O 3.25Å; K688-C708 PolarHBondContact NZ-O 2.7Å; K688-C708 PolarHBondContact NZ-SG 3.14Å; A705-C708 PolarHBondContact O-SG 3.4Å; A705-C708 VanDerWaalsContact O-SG 3.33Å; L706-C708 VanDerWaalsContact C-N 3.32Å; L706-C708 PolarHBondContact O-N 3.17Å; C708-L710 PolarHBondContact O-N 3.36Å
709	S	89.8	Confident	86.8	Confident	82 Å²	82	48.1 Å²	48.1	57%	0.573	24%	0.241	S	C	*	.	S	Bend	trans	53.1	48.8	177.9	-54.7	0	0	0	0	113.5	M660	M660-S709 PolarHBondContact O-N 3.07Å
710	L	91	Very high	87.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	147.1	-176.8	-62.2	170.9	0	0	0	111.7	V650 M660 F661 S662 K688 L706 C708	V650-L710 HydrophobicContact CB-CD1 3.92Å; V650-L710 HydrophobicContact CG1-CD1 4.14Å; V650-L710 HydrophobicContact CG2-CD1 3.8Å; V650-L710 HydrophobicContact CG2-CD2 3.75Å; V650-L710 HydrophobicContact CG2-CG 4.45Å; M660-L710 HydrophobicContact CB-CD1 4.04Å; M660-L710 PolarHBondContact O-N 3.09Å; F661-L710 CarbonylContact C-O 3.5Å; F661-L710 VanDerWaalsContact CA-O 3.24Å; F661-L710 WeakPolarHBondContact CA-O 3.42Å; F661-L710 HydrophobicContact CD1-CB 3.75Å; F661-L710 HydrophobicContact CE1-CB 4.13Å; S662-L710 PolarHBondContact N-O 3.39Å; S662-L710 PolarHBondContact OG-O 2.72Å; K688-L710 HydrophobicContact CB-CD2 3.94Å; K688-L710 HydrophobicContact CD-CD2 4.45Å; L706-L710 WeakPolarHBondContact O-CD2 3.34Å; C708-L710 PolarHBondContact O-N 3.36Å
711	K	92.3	Very high	87.5	Confident	93 Å²	93	37.6 Å²	37.6	40%	0.404	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	131.2	165.4	-171.1	-175.6	-178.6	-171.6	0	109.2	E563 G686 Y687	E563-K711 IonicContact OE1-NZ 2.89Å; E563-K711 PolarHBondContact OE1-NZ 3.18Å; E563-K711 WeakPolarHBondContact OE2-CE 3.36Å; E563-K711 IonicContact OE2-NZ 2.72Å; E563-K711 PolarHBondContact OE2-NZ 3.27Å; G686-K711 WeakPolarHBondContact CA-O 3.28Å; Y687-K711 PolarHBondContact N-O 3.4Å; Y687-K711 WeakPolarHBondContact O-CA 3.36Å; Y687-K711 VanDerWaalsContact O-CB 3.25Å; Y687-K711 WeakPolarHBondContact O-CB 3.47Å; Y687-K711 PolarHBondContact O-N 3.49Å
712	F	92.6	Very high	87.8	Confident	24 Å²	24	38.2 Å²	38.2	11%	0.105	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.6	172.5	176.2	-107.9	0	0	0	110.2	G547 F661 P665 Y668 G714 F715	G547-F712 WeakPolarHBondContact O-CE1 3.46Å; F661-F712 HydrophobicContact CD1-CB 4.01Å; F661-F712 HydrophobicContact CE1-CB 4.1Å; F661-F712 HydrophobicContact CE1-CD2 4.19Å; F661-F712 AromaticContact CE2-CD2 3.9Å; F661-F712 HydrophobicContact CE2-CD2 3.9Å; F661-F712 HydrophobicContact CG-CB 4.27Å; F661-F712 HydrophobicContact CZ-CB 4.41Å; F661-F712 AromaticContact CZ-CD2 3.71Å; F661-F712 HydrophobicContact CZ-CD2 3.71Å; P665-F712 HydrophobicContact CG-CD1 3.51Å; P665-F712 HydrophobicContact CG-CE1 3.8Å; P665-F712 HydrophobicContact CG-CG 4.39Å; Y668-F712 HydrophobicContact CD2-CD2 4.15Å; Y668-F712 AromaticContact CD2-CE2 3.87Å; Y668-F712 HydrophobicContact CD2-CE2 3.87Å; Y668-F712 HydrophobicContact CD2-CZ 4.09Å; Y668-F712 AromaticContact CE2-CD2 3.72Å; Y668-F712 HydrophobicContact CE2-CD2 3.72Å; Y668-F712 AromaticContact CE2-CE2 3.47Å; Y668-F712 HydrophobicContact CE2-CE2 3.47Å; Y668-F712 VanDerWaalsContact CE2-CE2 3.47Å; Y668-F712 HydrophobicContact CE2-CZ 4.13Å; F712-G714 VanDerWaalsContact CZ-CA 3.43Å; F712-F715 HydrophobicContact CE2-CD1 4.27Å; F712-F715 HydrophobicContact CE2-CD2 4.3Å; F712-F715 HydrophobicContact CE2-CE1 4.14Å; F712-F715 HydrophobicContact CE2-CE2 4.19Å; F712-F715 HydrophobicContact CE2-CG 4.35Å; F712-F715 HydrophobicContact CE2-CZ 4.12Å; F712-F715 HydrophobicContact CZ-CD1 4.47Å; F712-F715 AromaticContact CZ-CD2 3.73Å; F712-F715 HydrophobicContact CZ-CD2 3.73Å; F712-F715 HydrophobicContact CZ-CE1 4.47Å; F712-F715 AromaticContact CZ-CE2 3.75Å; F712-F715 HydrophobicContact CZ-CE2 3.75Å; F712-F715 HydrophobicContact CZ-CG 4.12Å; F712-F715 HydrophobicContact CZ-CZ 4.15Å
713	V	90.3	Very high	88.1	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.024	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	21.9	-177.8	-63.6	0	0	0	0	113.4	E563 T564 A567 L685 Y687	E563-V713 HydrophobicContact CB-CG1 4.16Å; T564-V713 VanDerWaalsContact CG2-O 3.31Å; T564-V713 WeakPolarHBondContact CG2-O 3.43Å; T564-V713 PolarHBondContact OG1-O 3.3Å; A567-V713 HydrophobicContact CB-CG2 4.07Å; L685-V713 HydrophobicContact CB-CG2 3.57Å; L685-V713 PolarHBondContact O-N 3.02Å; L685-V713 VanDerWaalsContact O-N 3.08Å; Y687-V713 VanDerWaalsContact CB-CG1 3.5Å; Y687-V713 HydrophobicContact CG-CG1 4.35Å
714	G	90.9	Very high	88.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	111.5	172.2	172.1	0	0	0	0	0	115	A546 L685 F712	A546-G714 WeakPolarHBondContact O-CA 3.49Å; L685-G714 WeakPolarHBondContact CB-O 3.33Å; L685-G714 PolarHBondContact N-O 3.46Å; F712-G714 VanDerWaalsContact CZ-CA 3.43Å
715	F	91.7	Very high	88.3	Confident	1 Å²	1	29 Å²	29	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.3	174.5	-72.8	-62	0	0	0	110.5	V545 A546 P654 Y668 I671 H672 V682 L683 A684 F712	V545-F715 CarbonylContact C-O 3.55Å; V545-F715 VanDerWaalsContact CA-O 3.24Å; V545-F715 WeakPolarHBondContact CA-O 3.37Å; V545-F715 WeakPolarHBondContact CG1-O 3.44Å; A546-F715 HydrophobicContact CB-CB 4.35Å; A546-F715 PolarHBondContact N-O 3.04Å; A546-F715 PolarHBondContact O-N 3.43Å; P654-F715 HydrophobicContact CB-CE1 3.82Å; P654-F715 HydrophobicContact CG-CD1 4.3Å; P654-F715 HydrophobicContact CG-CE1 3.92Å; Y668-F715 HydrophobicContact CD1-CZ 4Å; Y668-F715 HydrophobicContact CD2-CE1 4.25Å; Y668-F715 AromaticContact CD2-CE2 3.87Å; Y668-F715 HydrophobicContact CD2-CE2 3.87Å; Y668-F715 AromaticContact CD2-CZ 3.37Å; Y668-F715 HydrophobicContact CD2-CZ 3.37Å; Y668-F715 HydrophobicContact CE1-CE1 4.28Å; Y668-F715 AromaticContact CE1-CZ 3.81Å; Y668-F715 HydrophobicContact CE1-CZ 3.81Å; Y668-F715 AromaticContact CE2-CE1 3.59Å; Y668-F715 HydrophobicContact CE2-CE1 3.59Å; Y668-F715 HydrophobicContact CE2-CE2 4.03Å; Y668-F715 AromaticContact CE2-CZ 3.16Å; Y668-F715 HydrophobicContact CE2-CZ 3.16Å; Y668-F715 HydrophobicContact CG-CE2 4.3Å; Y668-F715 AromaticContact CG-CZ 3.79Å; Y668-F715 HydrophobicContact CG-CZ 3.79Å; Y668-F715 AromaticContact CZ-CE1 3.58Å; Y668-F715 AromaticContact CZ-CZ 3.38Å; I671-F715 HydrophobicContact CB-CE2 4.42Å; I671-F715 HydrophobicContact CG2-CD2 3.96Å; I671-F715 HydrophobicContact CG2-CE2 4.21Å; H672-F715 HydrophobicContact CB-CE2 4.44Å; H672-F715 HydrophobicContact CB-CZ 4.03Å; V682-F715 HydrophobicContact CG1-CB 3.77Å; V682-F715 HydrophobicContact CG1-CD1 3.59Å; V682-F715 HydrophobicContact CG1-CE1 4.35Å; V682-F715 HydrophobicContact CG1-CG 3.83Å; L683-F715 CarbonylContact O-C 3.54Å; L683-F715 WeakPolarHBondContact O-CA 3.46Å; A684-F715 HydrophobicContact CB-CD1 3.99Å; A684-F715 HydrophobicContact CB-CE1 3.81Å; F712-F715 HydrophobicContact CE2-CD1 4.27Å; F712-F715 HydrophobicContact CE2-CD2 4.3Å; F712-F715 HydrophobicContact CE2-CE1 4.14Å; F712-F715 HydrophobicContact CE2-CE2 4.19Å; F712-F715 HydrophobicContact CE2-CG 4.35Å; F712-F715 HydrophobicContact CE2-CZ 4.12Å; F712-F715 HydrophobicContact CZ-CD1 4.47Å; F712-F715 AromaticContact CZ-CD2 3.73Å; F712-F715 HydrophobicContact CZ-CD2 3.73Å; F712-F715 HydrophobicContact CZ-CE1 4.47Å; F712-F715 AromaticContact CZ-CE2 3.75Å; F712-F715 HydrophobicContact CZ-CE2 3.75Å; F712-F715 HydrophobicContact CZ-CG 4.12Å; F712-F715 HydrophobicContact CZ-CZ 4.15Å
716	I	91.2	Very high	88.6	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130.3	170.3	-173.8	152.7	0	0	0	110.4	V542 L568 M591 V682 L683 L685 V718	V542-I716 HydrophobicContact CG1-CD1 4.02Å; V542-I716 HydrophobicContact CG1-CG1 4.19Å; L568-I716 HydrophobicContact CD1-CD1 4.06Å; L568-I716 HydrophobicContact CD2-CB 4.38Å; L568-I716 HydrophobicContact CD2-CD1 3.44Å; L568-I716 VanDerWaalsContact CD2-CD1 3.44Å; L568-I716 HydrophobicContact CG-CD1 4.42Å; M591-I716 HydrophobicContact CB-CD1 4.3Å; M591-I716 HydrophobicContact CE-CD1 4.12Å; M591-I716 HydrophobicContact CE-CG1 4.34Å; M591-I716 HydrophobicContact CE-CG2 3.84Å; M591-I716 HydrophobicContact CG-CD1 3.58Å; M591-I716 HydrophobicContact SD-CD1 4Å; V682-I716 WeakPolarHBondContact CA-O 3.36Å; L683-I716 HydrophobicContact CB-CG2 3.66Å; L683-I716 HydrophobicContact CD1-CG2 4.45Å; L683-I716 PolarHBondContact N-O 3.48Å; L683-I716 VanDerWaalsContact N-O 3.07Å; L683-I716 PolarHBondContact O-N 2.85Å; L685-I716 HydrophobicContact CD1-CB 4.44Å; L685-I716 HydrophobicContact CD2-CG2 4.35Å; I716-V718 HydrophobicContact CG1-CG2 4.21Å
717	V	90.5	Very high	88.9	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.7	-175.8	-174	0	0	0	0	109	R543 G544 A546 V554 I675 A680	R543-V717 HydrophobicContact CB-CB 4.36Å; R543-V717 HydrophobicContact CB-CG1 4.19Å; R543-V717 PolarHBondContact N-O 2.87Å; G544-V717 PolarHBondContact O-N 3.38Å; A546-V717 HydrophobicContact CB-CG2 3.94Å; V554-V717 HydrophobicContact CG2-CG2 4.39Å; I675-V717 HydrophobicContact CD1-CG2 4.12Å; I675-V717 HydrophobicContact CG2-CB 4.48Å; I675-V717 HydrophobicContact CG2-CG1 3.71Å; I675-V717 HydrophobicContact CG2-CG2 3.93Å; A680-V717 HydrophobicContact CB-CG1 3.49Å; A680-V717 VanDerWaalsContact CB-CG1 3.49Å
718	V	86.8	Confident	89.1	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.8	-179.1	-174.8	0	0	0	0	109.6	L540 V541 V542 L587 M591 R681 I716	L540-V718 HydrophobicContact CB-CG1 3.95Å; L540-V718 HydrophobicContact CD2-CG1 4.1Å; V541-V718 WeakPolarHBondContact O-CA 3.46Å; V542-V718 HydrophobicContact CG2-CG2 4.33Å; L587-V718 HydrophobicContact CD1-CB 4.03Å; L587-V718 HydrophobicContact CD1-CG1 3.74Å; L587-V718 HydrophobicContact CD1-CG2 3.76Å; M591-V718 HydrophobicContact CE-CG2 3.96Å; R681-V718 HydrophobicContact CB-CB 4.48Å; R681-V718 WeakPolarHBondContact CB-O 3.25Å; R681-V718 PolarHBondContact N-O 2.71Å; R681-V718 PolarHBondContact O-N 3.05Å; I716-V718 HydrophobicContact CG1-CG2 4.21Å
719	S	83.4	Confident	89.3	Confident	42 Å²	42	31 Å²	31	29%	0.294	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.7	177.2	54.4	0	0	0	0	111.1	V541	V541-S719 PolarHBondContact N-O 3.49Å; V541-S719 VanDerWaalsContact N-O 3.12Å; V541-S719 PolarHBondContact O-N 2.99Å; V541-S719 PolarHBondContact O-OG 2.86Å
720	C	80.4	Confident	89.4	Confident	31 Å²	31	27.1 Å²	27.1	21%	0.209	16%	0.164	C	C	.	.			trans	-101.2	105.8	167.9	-57.3	0	0	0	0	107.8	T536 L540	T536-C720 HydrophobicContact CG2-CB 4.25Å; L540-C720 WeakPolarHBondContact CD2-SG 3.39Å
721	P	85.3	Confident	89.5	Confident	52 Å²	52	33.2 Å²	33.2	34%	0.338	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-68.2	151.1	179.4	22.3	-21.3	0	0	0	111.3	T536 S537 S539 V541	T536-P721 WeakPolarHBondContact CA-O 3.42Å; T536-P721 WeakPolarHBondContact CB-O 2.84Å; S537-P721 PolarHBondContact N-O 3.04Å; S537-P721 WeakPolarHBondContact OG-CG 3.43Å; S537-P721 PolarHBondContact OG-O 3.01Å; S539-P721 VanDerWaalsContact O-CD 3.3Å; S539-P721 WeakPolarHBondContact O-CD 3.36Å; V541-P721 HydrophobicContact CG2-CG 4.39Å
722	L	88	Confident	89.4	Confident	38 Å²	38	30.9 Å²	30.9	20%	0.199	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-68.8	148.1	171	-62.3	178.5	0	0	0	110.4	T536 V754 E757 L758	T536-L722 HydrophobicContact CG2-CD2 3.98Å; L722-V754 HydrophobicContact CD2-CG1 3.85Å; L722-E757 HydrophobicContact CD1-CB 4.28Å; L722-E757 HydrophobicContact CD1-CG 3.73Å; L722-E757 WeakPolarHBondContact CD1-OE1 3.43Å; L722-E757 WeakPolarHBondContact CD1-OE2 3.43Å; L722-L758 HydrophobicContact CD1-CD2 3.85Å; L722-L758 HydrophobicContact CD1-CG 4.2Å; L722-L758 HydrophobicContact CD2-CD1 4.26Å; L722-L758 HydrophobicContact CD2-CD2 4.27Å; L722-L758 HydrophobicContact CD2-CG 4.21Å
723	K	87.4	Confident	89.3	Confident	12 Å²	12	29.8 Å²	29.8	5%	0.052	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-65.4	148.5	167.2	-62.6	-178.6	179.7	164.3	0	110.3	G533 T534 L535 D725 S726 S962	G533-K723 WeakPolarHBondContact O-CE 3.42Å; G533-K723 PolarHBondContact O-NZ 3.42Å; T534-K723 WeakPolarHBondContact O-CD 3.45Å; T534-K723 VanDerWaalsContact O-CE 3.28Å; T534-K723 WeakPolarHBondContact O-CE 3.39Å; T534-K723 PolarHBondContact O-NZ 3.06Å; L535-K723 PolarHBondContact O-N 3.2Å; L535-K723 VanDerWaalsContact O-N 3.16Å; K723-D725 WeakPolarHBondContact CB-OD1 3.41Å; K723-D725 PolarHBondContact O-N 2.91Å; K723-S726 PolarHBondContact O-N 2.89Å; K723-S962 PolarHBondContact NZ-O 2.96Å
724	A	86.9	Confident	89.3	Confident	88 Å²	88	32.2 Å²	32.2	73%	0.727	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.9	-174.5	0	0	0	0	0	113.5
725	D	89.3	Confident	89.2	Confident	31 Å²	31	37.4 Å²	37.4	17%	0.166	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-22.8	-178.6	63.7	-28.9	0	0	0	114.1	K723 K727 A728 V729 S963 I964	K723-D725 WeakPolarHBondContact CB-OD1 3.41Å; K723-D725 PolarHBondContact O-N 2.91Å; D725-K727 VanDerWaalsContact C-N 3.32Å; D725-K727 PolarHBondContact O-N 3.16Å; D725-A728 PolarHBondContact O-N 3.13Å; D725-V729 HydrophobicContact CB-CG2 4.37Å; D725-V729 WeakPolarHBondContact O-CG2 3.46Å; D725-V729 PolarHBondContact O-N 3.44Å; D725-S963 VanDerWaalsContact OD2-CA 3.28Å; D725-S963 WeakPolarHBondContact OD2-CA 3.42Å; D725-S963 VanDerWaalsContact OD2-CB 3.28Å; D725-S963 WeakPolarHBondContact OD2-CB 3.26Å; D725-S963 PolarHBondContact OD2-OG 3.18Å; D725-I964 PolarHBondContact OD2-N 2.97Å
726	S	91.4	Very high	88.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-48.5	-49	-175.4	-67	0	0	0	0	113.2	L535 K723 A728 V729 I730 I964	L535-S726 PolarHBondContact O-OG 3.48Å; K723-S726 PolarHBondContact O-N 2.89Å; S726-A728 PolarHBondContact O-N 3.24Å; S726-V729 PolarHBondContact O-N 2.99Å; S726-I730 WeakPolarHBondContact O-CB 3.36Å; S726-I730 WeakPolarHBondContact O-CG1 3Å; S726-I730 PolarHBondContact O-N 3.42Å; S726-I964 WeakPolarHBondContact OG-CD1 3.37Å
727	K	91.6	Very high	88.7	Confident	86 Å²	86	38.7 Å²	38.7	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-64.9	-37.1	-176.9	-170.9	167	-173.1	153.1	0	113	D725 R731 L758 H759	D725-K727 VanDerWaalsContact C-N 3.32Å; D725-K727 PolarHBondContact O-N 3.16Å; K727-R731 WeakPolarHBondContact O-CB 3.46Å; K727-R731 PolarHBondContact O-N 3.4Å; K727-L758 HydrophobicContact CB-CD2 4.31Å; K727-H759 PolarHBondContact NZ-NE2 3.34Å
728	A	91.8	Very high	88.6	Confident	65 Å²	65	39.1 Å²	39.1	54%	0.537	22%	0.223	S	C	.	.	H	α-helix	trans	-74	-43.8	179.8	0	0	0	0	0	111.4	D725 S726 R731 E732	D725-A728 PolarHBondContact O-N 3.13Å; S726-A728 PolarHBondContact O-N 3.24Å; A728-R731 PolarHBondContact O-N 3.06Å; A728-E732 PolarHBondContact O-N 3.37Å
729	V	92.3	Very high	88.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-48	-179.3	172.7	0	0	0	0	111.4	D725 S726 R731 E732 I733 I964 Q965	D725-V729 HydrophobicContact CB-CG2 4.37Å; D725-V729 WeakPolarHBondContact O-CG2 3.46Å; D725-V729 PolarHBondContact O-N 3.44Å; S726-V729 PolarHBondContact O-N 2.99Å; V729-R731 VanDerWaalsContact C-N 3.29Å; V729-R731 PolarHBondContact O-N 2.98Å; V729-E732 WeakPolarHBondContact O-CB 3.45Å; V729-E732 PolarHBondContact O-N 3.36Å; V729-E732 VanDerWaalsContact O-N 3.12Å; V729-I733 HydrophobicContact CG1-CD1 3.87Å; V729-I733 HydrophobicContact CG1-CG1 4.5Å; V729-I733 WeakPolarHBondContact O-CG1 3.21Å; V729-I733 PolarHBondContact O-N 2.8Å; V729-I964 HydrophobicContact CG1-CB 4.29Å; V729-I964 HydrophobicContact CG1-CG2 3.98Å; V729-Q965 HydrophobicContact CG2-CB 4.25Å; V729-Q965 VanDerWaalsContact CG2-OE1 3.3Å
730	I	93.1	Very high	89.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-41.8	179.4	-66.1	-64.5	0	0	0	110.9	F529 L535 S726 E732 I733 Q734 V740 F760	F529-I730 HydrophobicContact CD2-CD1 4.37Å; F529-I730 HydrophobicContact CE1-CD1 4.04Å; F529-I730 HydrophobicContact CE2-CD1 3.93Å; F529-I730 HydrophobicContact CZ-CD1 3.76Å; L535-I730 HydrophobicContact CD2-CD1 4.09Å; L535-I730 HydrophobicContact CD2-CG1 4.3Å; S726-I730 WeakPolarHBondContact O-CB 3.36Å; S726-I730 WeakPolarHBondContact O-CG1 3Å; S726-I730 PolarHBondContact O-N 3.42Å; I730-E732 VanDerWaalsContact C-N 3.34Å; I730-E732 PolarHBondContact O-N 2.68Å; I730-I733 PolarHBondContact O-N 3.16Å; I730-Q734 HydrophobicContact CG2-CG 4.34Å; I730-Q734 WeakPolarHBondContact O-CG 3.18Å; I730-Q734 PolarHBondContact O-N 2.96Å; I730-V740 HydrophobicContact CD1-CG1 4.09Å; I730-F760 HydrophobicContact CB-CE1 4.28Å; I730-F760 HydrophobicContact CD1-CE1 3.87Å; I730-F760 HydrophobicContact CD1-CZ 3.92Å; I730-F760 HydrophobicContact CG1-CE1 3.87Å; I730-F760 HydrophobicContact CG1-CZ 4.37Å; I730-F760 HydrophobicContact CG2-CD1 3.83Å; I730-F760 HydrophobicContact CG2-CE1 3.53Å; I730-F760 HydrophobicContact CG2-CZ 4.49Å
731	R	91.5	Very high	89.9	Confident	128 Å²	128	40.1 Å²	40.1	48%	0.483	22%	0.217	S	C	.	.	H	α-helix	trans	-61.3	-41.2	175	-173.8	-179	-70.5	171.8	-5.6	111.9	K727 A728 V729 N735	K727-R731 WeakPolarHBondContact O-CB 3.46Å; K727-R731 PolarHBondContact O-N 3.4Å; A728-R731 PolarHBondContact O-N 3.06Å; V729-R731 VanDerWaalsContact C-N 3.29Å; V729-R731 PolarHBondContact O-N 2.98Å; R731-N735 VanDerWaalsContact O-CB 3.27Å; R731-N735 WeakPolarHBondContact O-CB 3.23Å; R731-N735 PolarHBondContact O-N 3.21Å; R731-N735 PolarHBondContact O-ND2 2.86Å
732	E	90.8	Very high	90.3	Very high	45 Å²	45	37.6 Å²	37.6	21%	0.21	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-42.8	175	-171.7	177.3	177.4	0	0	111.6	A728 V729 I730 N735 A736 K972 L1037	A728-E732 PolarHBondContact O-N 3.37Å; V729-E732 WeakPolarHBondContact O-CB 3.45Å; V729-E732 PolarHBondContact O-N 3.36Å; V729-E732 VanDerWaalsContact O-N 3.12Å; I730-E732 VanDerWaalsContact C-N 3.34Å; I730-E732 PolarHBondContact O-N 2.68Å; E732-N735 PolarHBondContact O-N 3.49Å; E732-A736 WeakPolarHBondContact O-CB 3.42Å; E732-A736 PolarHBondContact O-N 3.49Å; E732-K972 WeakPolarHBondContact OE1-CE 3.4Å; E732-K972 IonicContact OE1-NZ 2.94Å; E732-K972 PolarHBondContact OE1-NZ 3.32Å; E732-K972 IonicContact OE2-NZ 2.72Å; E732-L1037 HydrophobicContact CG-CB 4.04Å; E732-L1037 WeakPolarHBondContact OE1-CB 3.42Å; E732-L1037 PolarHBondContact OE1-N 3.46Å
733	I	91.3	Very high	90.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-44.3	179	-68.1	173.1	0	0	0	111.5	F529 V729 I730 A736 H738 V740 I967	F529-I733 HydrophobicContact CZ-CD1 3.79Å; V729-I733 HydrophobicContact CG1-CD1 3.87Å; V729-I733 HydrophobicContact CG1-CG1 4.5Å; V729-I733 WeakPolarHBondContact O-CG1 3.21Å; V729-I733 PolarHBondContact O-N 2.8Å; I730-I733 PolarHBondContact O-N 3.16Å; I733-A736 PolarHBondContact O-N 2.97Å; I733-H738 HydrophobicContact CG2-CB 3.59Å; I733-H738 PolarHBondContact O-N 3.05Å; I733-V740 HydrophobicContact CG2-CG2 3.72Å; I733-I967 HydrophobicContact CD1-CG2 4.09Å
734	Q	89.1	Confident	90.6	Very high	55 Å²	55	35.3 Å²	35.3	26%	0.257	19%	0.189	S	C	.	.	H	α-helix	trans	-65	-44.5	176.6	-72.1	176.2	-37.3	0	0	111.9	I730 A736 S737 V740 H759	I730-Q734 HydrophobicContact CG2-CG 4.34Å; I730-Q734 WeakPolarHBondContact O-CG 3.18Å; I730-Q734 PolarHBondContact O-N 2.96Å; Q734-A736 PolarHBondContact O-N 2.81Å; Q734-S737 PolarHBondContact O-N 2.91Å; Q734-V740 HydrophobicContact CG-CG2 3.86Å; Q734-H759 PolarHBondContact NE2-O 3.35Å
735	N	89.4	Confident	90.4	Very high	110 Å²	110	32.8 Å²	32.8	59%	0.588	17%	0.173	S	C	*	.	H	α-helix	trans	-60.3	-30.4	175.4	-74.2	-15.4	0	0	0	112.2	R731 E732 S737	R731-N735 VanDerWaalsContact O-CB 3.27Å; R731-N735 WeakPolarHBondContact O-CB 3.23Å; R731-N735 PolarHBondContact O-N 3.21Å; R731-N735 PolarHBondContact O-ND2 2.86Å; E732-N735 PolarHBondContact O-N 3.49Å; N735-S737 PolarHBondContact O-N 3.38Å
736	A	86.6	Confident	90	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	14	174.9	0	0	0	0	0	114.6	E732 I733 Q734 H738 R975 L1037 S1038	E732-A736 WeakPolarHBondContact O-CB 3.42Å; E732-A736 PolarHBondContact O-N 3.49Å; I733-A736 PolarHBondContact O-N 2.97Å; Q734-A736 PolarHBondContact O-N 2.81Å; A736-H738 VanDerWaalsContact C-N 3.3Å; A736-H738 PolarHBondContact O-N 2.9Å; A736-R975 PolarHBondContact O-NH2 3.13Å; A736-L1037 HydrophobicContact CB-CB 4.06Å; A736-L1037 HydrophobicContact CB-CD2 3.1Å; A736-L1037 HydrophobicContact CB-CG 3.4Å; A736-L1037 VanDerWaalsContact CB-CG 3.4Å; A736-S1038 WeakPolarHBondContact CB-O 3.46Å
737	S	85.8	Confident	89.6	Confident	29 Å²	29	35.6 Å²	35.6	20%	0.203	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	15.6	178.8	77	0	0	0	0	115.9	Q734 N735 R1039 R1041	Q734-S737 PolarHBondContact O-N 2.91Å; N735-S737 PolarHBondContact O-N 3.38Å; S737-R1039 PolarHBondContact OG-O 3.34Å; S737-R1041 PolarHBondContact O-NH2 3.39Å; S737-R1041 PolarHBondContact OG-NE 2.86Å
738	H	89.6	Confident	89.4	Confident	8 Å²	8	32.2 Å²	32.2	4%	0.037	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-81.4	142.3	174.6	-65.2	-75.5	0	0	0	111	V524 I733 A736 R975	V524-H738 PolarHBondContact O-CE1 3.24Å; V524-H738 PolarHBondContact O-ND1 3.18Å; I733-H738 HydrophobicContact CG2-CB 3.59Å; I733-H738 PolarHBondContact O-N 3.05Å; A736-H738 VanDerWaalsContact C-N 3.3Å; A736-H738 PolarHBondContact O-N 2.9Å; H738-R975 PolarHBondContact NE2-NH2 3.26Å
739	R	89.8	Confident	89.1	Confident	81 Å²	81	30.6 Å²	30.6	31%	0.306	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	127	172.2	-176.3	-173.5	177.1	120.5	0.7	108.8	E525 V526 C527 V741 P829 H830 V831	E525-R739 PolarHBondContact O-N 3.03Å; V526-R739 CarbonylContact C-O 3.6Å; V526-R739 WeakPolarHBondContact CA-O 3.25Å; V526-R739 HydrophobicContact CG2-CB 4.4Å; C527-R739 PolarHBondContact N-O 2.94Å; R739-V741 HydrophobicContact CG-CG2 4.3Å; R739-P829 PolarHBondContact NH1-O 3Å; R739-P829 PolarHBondContact NH2-O 3.46Å; R739-H830 VanDerWaalsContact NH2-CA 3.27Å; R739-H830 PolarHBondContact NH2-O 2.97Å; R739-V831 PolarHBondContact NH2-O 2.92Å
740	V	92.4	Very high	88.7	Confident	10 Å²	10	31.3 Å²	31.3	6%	0.061	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133	177	-175.1	0	0	0	0	109.3	C527 F529 I730 I733 Q734 F760	C527-V740 WeakPolarHBondContact O-CA 3.2Å; F529-V740 HydrophobicContact CD2-CG1 3.76Å; F529-V740 HydrophobicContact CE2-CG1 3.76Å; I730-V740 HydrophobicContact CD1-CG1 4.09Å; I733-V740 HydrophobicContact CG2-CG2 3.72Å; Q734-V740 HydrophobicContact CG-CG2 3.86Å; V740-F760 HydrophobicContact CB-CE2 4.47Å; V740-F760 HydrophobicContact CG1-CD1 4.32Å; V740-F760 HydrophobicContact CG1-CD2 3.81Å; V740-F760 HydrophobicContact CG1-CE1 3.91Å; V740-F760 HydrophobicContact CG1-CE2 3.33Å; V740-F760 HydrophobicContact CG1-CG 4.29Å; V740-F760 HydrophobicContact CG1-CZ 3.38Å
741	V	93.6	Very high	88.4	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.024	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.2	178.7	177.7	0	0	0	0	108.9	V526 C527 C528 F529 R739 I743 Q832 F834	V526-V741 HydrophobicContact CG1-CB 4.42Å; V526-V741 HydrophobicContact CG1-CG2 3.72Å; C527-V741 PolarHBondContact O-N 3.35Å; C528-V741 CarbonylContact C-O 3.49Å; C528-V741 VanDerWaalsContact CA-O 3.28Å; C528-V741 WeakPolarHBondContact CA-O 3.3Å; F529-V741 PolarHBondContact N-O 2.8Å; R739-V741 HydrophobicContact CG-CG2 4.3Å; V741-I743 HydrophobicContact CG1-CG1 4.12Å; V741-Q832 WeakPolarHBondContact CA-O 3.31Å; V741-Q832 WeakPolarHBondContact CG1-O 3.2Å; V741-F834 HydrophobicContact CG1-CD2 3.77Å; V741-F834 HydrophobicContact CG1-CE2 3.77Å
742	M	94.1	Very high	88.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.7	173.4	-170.1	-175.7	-67.7	0	0	109.9	F529 K531 L535 T744 A751 V754 A755 F760 Q832 V833 F834	F529-M742 WeakPolarHBondContact O-CA 3.43Å; K531-M742 HydrophobicContact CB-CG 4.39Å; K531-M742 HydrophobicContact CB-SD 4.05Å; K531-M742 HydrophobicContact CG-CE 4.47Å; K531-M742 HydrophobicContact CG-SD 3.99Å; L535-M742 HydrophobicContact CD1-CE 3.8Å; M742-T744 HydrophobicContact CG-CG2 4.45Å; M742-T744 HydrophobicContact SD-CG2 4.31Å; M742-A751 HydrophobicContact SD-CB 4.14Å; M742-V754 HydrophobicContact CE-CB 4.26Å; M742-V754 HydrophobicContact CE-CG1 3.77Å; M742-A755 HydrophobicContact CE-CB 3.99Å; M742-F760 HydrophobicContact CB-CD2 4.24Å; M742-F760 HydrophobicContact CB-CE2 3.88Å; M742-F760 HydrophobicContact CE-CD2 4.35Å; M742-F760 HydrophobicContact CE-CE2 4.01Å; M742-F760 HydrophobicContact CE-CZ 4.34Å; M742-Q832 PolarHBondContact N-O 3.41Å; M742-V833 HydrophobicContact CB-CG1 4.5Å; M742-V833 HydrophobicContact CB-CG2 4.44Å; M742-F834 PolarHBondContact O-N 3.32Å
743	I	93.5	Very high	88.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	104.1	176.9	-53.9	-179.3	0	0	0	108.7	C528 F529 V741 F834 V837 K842 V845 I846	C528-I743 HydrophobicContact CB-CD1 3.83Å; C528-I743 HydrophobicContact CB-CG1 4.37Å; F529-I743 PolarHBondContact O-N 3.23Å; V741-I743 HydrophobicContact CG1-CG1 4.12Å; I743-F834 HydrophobicContact CG1-CB 4.41Å; I743-F834 HydrophobicContact CG1-CD2 4.06Å; I743-F834 HydrophobicContact CG2-CB 4.27Å; I743-V837 HydrophobicContact CG2-CG2 3.69Å; I743-K842 HydrophobicContact CG2-CB 4.16Å; I743-K842 HydrophobicContact CG2-CD 4.21Å; I743-K842 HydrophobicContact CG2-CG 3.72Å; I743-V845 HydrophobicContact CD1-CB 4.36Å; I743-V845 HydrophobicContact CD1-CG1 3.81Å; I743-I846 HydrophobicContact CD1-CD1 4.07Å
744	T	89	Confident	87.9	Confident	1 Å²	1	26 Å²	26	1%	0.006	14%	0.142	C	C	.	.			trans	-137.5	152.5	-171.1	-168.8	0	0	0	0	114.4	D530 K531 M742 D746 A751 F834 A835 R836 V837	D530-T744 PolarHBondContact OD1-OG1 3.07Å; K531-T744 HydrophobicContact CB-CG2 4.26Å; K531-T744 WeakPolarHBondContact CB-OG1 3.45Å; M742-T744 HydrophobicContact CG-CG2 4.45Å; M742-T744 HydrophobicContact SD-CG2 4.31Å; T744-D746 VanDerWaalsContact C-N 3.28Å; T744-D746 HydrophobicContact CG2-CB 4.1Å; T744-D746 PolarHBondContact OG1-N 3.41Å; T744-A751 HydrophobicContact CG2-CB 3.7Å; T744-F834 PolarHBondContact N-O 3.41Å; T744-A835 CarbonylContact O-C 3.47Å; T744-A835 WeakPolarHBondContact O-CA 3.35Å; T744-R836 PolarHBondContact O-N 2.92Å; T744-V837 WeakPolarHBondContact O-CG2 3.42Å; T744-V837 PolarHBondContact O-N 3.34Å
745	G	82.9	Confident	87.9	Confident	36 Å²	36	23.4 Å²	23.4	37%	0.371	13%	0.13	S	C	.	.	S	Bend	trans	-79.3	-7.7	172	0	0	0	0	0	114.3
746	D	81	Confident	87.9	Confident	42 Å²	42	22 Å²	22	23%	0.225	12%	0.119	C	C	.	.	S	Bend	trans	-73.3	167	-175.3	-83.1	7.5	0	0	0	113.9	K531 T744 R836	K531-D746 WeakPolarHBondContact CD-OD2 3.36Å; K531-D746 WeakPolarHBondContact CE-OD2 3.49Å; K531-D746 IonicContact NZ-OD2 3.53Å; K531-D746 PolarHBondContact NZ-OD2 3.11Å; T744-D746 VanDerWaalsContact C-N 3.28Å; T744-D746 HydrophobicContact CG2-CB 4.1Å; T744-D746 PolarHBondContact OG1-N 3.41Å; D746-R836 PolarHBondContact O-N 3.1Å
747	N	82.7	Confident	88	Confident	47 Å²	47	26.2 Å²	26.2	25%	0.251	14%	0.139	S	C	.	.			trans	-57.5	134.6	175.6	-174.2	-22	0	0	0	110.3	L749 T750 A751	N747-L749 PolarHBondContact O-N 3.31Å; N747-L749 VanDerWaalsContact O-N 3.15Å; N747-L749 PolarHBondContact OD1-N 2.87Å; N747-T750 PolarHBondContact O-N 3.12Å; N747-T750 VanDerWaalsContact O-N 3.15Å; N747-A751 PolarHBondContact O-N 3.31Å
748	P	86.6	Confident	88.1	Confident	15 Å²	15	25 Å²	25	10%	0.097	13%	0.13	C	C	.	.	H	α-helix	trans	-50.1	-36.9	176.8	18.5	-34.5	0	0	0	114.5	A751 C752 I768 T809 A835	P748-A751 PolarHBondContact O-N 2.91Å; P748-C752 VanDerWaalsContact O-CB 3.32Å; P748-C752 WeakPolarHBondContact O-CB 3.38Å; P748-C752 PolarHBondContact O-N 3.31Å; P748-C752 PolarHBondContact O-SG 3.16Å; P748-I768 HydrophobicContact CB-CD1 4.19Å; P748-I768 HydrophobicContact CB-CG2 4.11Å; P748-I768 HydrophobicContact CG-CG2 4.46Å; P748-T809 HydrophobicContact CB-CG2 4.32Å; P748-T809 HydrophobicContact CG-CG2 4.16Å; P748-A835 VanDerWaalsContact CA-CB 3.49Å; P748-A835 HydrophobicContact CB-CB 3.85Å
749	L	85.8	Confident	88	Confident	32 Å²	32	28.2 Å²	28.2	17%	0.168	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-47.3	179.7	-63.6	178.8	0	0	0	112	N747 C752 H753 I768 I784	N747-L749 PolarHBondContact O-N 3.31Å; N747-L749 VanDerWaalsContact O-N 3.15Å; N747-L749 PolarHBondContact OD1-N 2.87Å; L749-C752 PolarHBondContact O-N 2.96Å; L749-H753 PolarHBondContact O-N 3.39Å; L749-I768 HydrophobicContact CD2-CD1 4.01Å; L749-I784 HydrophobicContact CD2-CG2 4.16Å
750	T	84	Confident	87.4	Confident	15 Å²	15	25 Å²	25	9%	0.092	13%	0.134	C	C	.	.	H	α-helix	trans	-64.6	-43	177	-52.6	0	0	0	0	111.7	G679 N747 C752 H753 V754	G679-T750 WeakPolarHBondContact O-CG2 3.23Å; N747-T750 PolarHBondContact O-N 3.12Å; N747-T750 VanDerWaalsContact O-N 3.15Å; T750-C752 VanDerWaalsContact C-N 3.35Å; T750-C752 PolarHBondContact O-N 3.44Å; T750-H753 PolarHBondContact O-N 3.38Å; T750-V754 WeakPolarHBondContact O-CG2 3.31Å; T750-V754 PolarHBondContact O-N 3.25Å
751	A	86.4	Confident	86.7	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.2	-42.6	177.4	0	0	0	0	0	111.6	M742 T744 N747 P748 A755 V833 A835	M742-A751 HydrophobicContact SD-CB 4.14Å; T744-A751 HydrophobicContact CG2-CB 3.7Å; N747-A751 PolarHBondContact O-N 3.31Å; P748-A751 PolarHBondContact O-N 2.91Å; A751-A755 WeakPolarHBondContact O-CB 3.27Å; A751-A755 PolarHBondContact O-N 2.86Å; A751-V833 HydrophobicContact CB-CG1 3.8Å; A751-A835 HydrophobicContact CB-CB 4.15Å
752	C	88.2	Confident	85.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-39.7	176	-69.3	0	0	0	0	112.2	P748 L749 T750 A755 Q756 I784	P748-C752 VanDerWaalsContact O-CB 3.32Å; P748-C752 WeakPolarHBondContact O-CB 3.38Å; P748-C752 PolarHBondContact O-N 3.31Å; P748-C752 PolarHBondContact O-SG 3.16Å; L749-C752 PolarHBondContact O-N 2.96Å; T750-C752 VanDerWaalsContact C-N 3.35Å; T750-C752 PolarHBondContact O-N 3.44Å; C752-A755 PolarHBondContact O-N 3.1Å; C752-Q756 WeakPolarHBondContact O-CB 3.21Å; C752-Q756 VanDerWaalsContact O-CG 3.28Å; C752-Q756 WeakPolarHBondContact O-CG 3.36Å; C752-Q756 PolarHBondContact O-N 3.45Å; C752-I784 HydrophobicContact CB-CD1 3.8Å
753	H	87.9	Confident	84.8	Confident	54 Å²	54	34.1 Å²	34.1	25%	0.25	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-50.4	175.9	-178.6	85.7	0	0	0	111.8	R677 E678 L749 T750 A755 Q756 E757	R677-H753 PolarHBondContact O-ND1 3.13Å; E678-H753 PolarHBondContact O-NE2 3.16Å; L749-H753 PolarHBondContact O-N 3.39Å; T750-H753 PolarHBondContact O-N 3.38Å; H753-A755 VanDerWaalsContact C-N 3.29Å; H753-A755 PolarHBondContact O-N 3.13Å; H753-Q756 WeakPolarHBondContact O-CB 3.01Å; H753-Q756 PolarHBondContact O-N 3.23Å; H753-Q756 VanDerWaalsContact O-N 3.11Å; H753-E757 PolarHBondContact O-N 3.26Å
754	V	88.3	Confident	83.7	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-40	177.2	170.7	0	0	0	0	111.1	K531 L722 M742 T750 Q756 E757 L758	K531-V754 HydrophobicContact CD-CG2 4.32Å; K531-V754 HydrophobicContact CG-CG1 4.1Å; L722-V754 HydrophobicContact CD2-CG1 3.85Å; M742-V754 HydrophobicContact CE-CB 4.26Å; M742-V754 HydrophobicContact CE-CG1 3.77Å; T750-V754 WeakPolarHBondContact O-CG2 3.31Å; T750-V754 PolarHBondContact O-N 3.25Å; V754-Q756 VanDerWaalsContact C-N 3.34Å; V754-Q756 PolarHBondContact O-N 2.95Å; V754-E757 PolarHBondContact O-N 2.85Å; V754-L758 HydrophobicContact CG1-CD1 3.83Å; V754-L758 HydrophobicContact CG1-CG 4.45Å; V754-L758 WeakPolarHBondContact O-CB 3.45Å; V754-L758 WeakPolarHBondContact O-CG 3.43Å; V754-L758 PolarHBondContact O-N 3.38Å
755	A	89.4	Confident	83.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-38.7	175	0	0	0	0	0	112.1	M742 A751 C752 H753 H759 F760 I761 V833	M742-A755 HydrophobicContact CE-CB 3.99Å; A751-A755 WeakPolarHBondContact O-CB 3.27Å; A751-A755 PolarHBondContact O-N 2.86Å; C752-A755 PolarHBondContact O-N 3.1Å; H753-A755 VanDerWaalsContact C-N 3.29Å; H753-A755 PolarHBondContact O-N 3.13Å; A755-H759 PolarHBondContact O-N 3.27Å; A755-F760 HydrophobicContact CB-CB 3.95Å; A755-F760 HydrophobicContact CB-CD2 4.46Å; A755-F760 HydrophobicContact CB-CG 4.3Å; A755-F760 WeakPolarHBondContact O-CB 3.25Å; A755-F760 PolarHBondContact O-N 3.4Å; A755-I761 HydrophobicContact CB-CD1 3.86Å; A755-I761 HydrophobicContact CB-CG1 4.31Å; A755-V833 HydrophobicContact CB-CG2 3.84Å
756	Q	88.4	Confident	83.2	Confident	80 Å²	80	40 Å²	40	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-67.5	-43.4	174.4	-74.4	170.6	-17.8	0	0	111.8	C752 H753 V754 L758 H759 I761	C752-Q756 WeakPolarHBondContact O-CB 3.21Å; C752-Q756 VanDerWaalsContact O-CG 3.28Å; C752-Q756 WeakPolarHBondContact O-CG 3.36Å; C752-Q756 PolarHBondContact O-N 3.45Å; H753-Q756 WeakPolarHBondContact O-CB 3.01Å; H753-Q756 PolarHBondContact O-N 3.23Å; H753-Q756 VanDerWaalsContact O-N 3.11Å; V754-Q756 VanDerWaalsContact C-N 3.34Å; V754-Q756 PolarHBondContact O-N 2.95Å; Q756-L758 VanDerWaalsContact C-N 3.33Å; Q756-L758 PolarHBondContact O-N 3.45Å; Q756-H759 PolarHBondContact O-N 3.2Å; Q756-I761 HydrophobicContact CG-CB 4.5Å; Q756-I761 HydrophobicContact CG-CD1 4.49Å
757	E	88.6	Confident	83.4	Confident	90 Å²	90	38 Å²	38	42%	0.421	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-35.6	-179.3	-166.4	-178.6	177.8	0	0	113	L722 H753 V754 H759	L722-E757 HydrophobicContact CD1-CB 4.28Å; L722-E757 HydrophobicContact CD1-CG 3.73Å; L722-E757 WeakPolarHBondContact CD1-OE1 3.43Å; L722-E757 WeakPolarHBondContact CD1-OE2 3.43Å; H753-E757 PolarHBondContact O-N 3.26Å; V754-E757 PolarHBondContact O-N 2.85Å; E757-H759 VanDerWaalsContact C-N 3.27Å
758	L	88.6	Confident	83.7	Confident	2 Å²	2	36 Å²	36	1%	0.01	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	0.9	174.1	-66.9	173.8	0	0	0	113.5	L535 L722 K727 V754 Q756 F760	L535-L758 HydrophobicContact CB-CD1 4.25Å; L535-L758 HydrophobicContact CD1-CD1 3.96Å; L535-L758 HydrophobicContact CD2-CD1 4.04Å; L535-L758 HydrophobicContact CG-CD1 4.32Å; L722-L758 HydrophobicContact CD1-CD2 3.85Å; L722-L758 HydrophobicContact CD1-CG 4.2Å; L722-L758 HydrophobicContact CD2-CD1 4.26Å; L722-L758 HydrophobicContact CD2-CD2 4.27Å; L722-L758 HydrophobicContact CD2-CG 4.21Å; K727-L758 HydrophobicContact CB-CD2 4.31Å; V754-L758 HydrophobicContact CG1-CD1 3.83Å; V754-L758 HydrophobicContact CG1-CG 4.45Å; V754-L758 WeakPolarHBondContact O-CB 3.45Å; V754-L758 WeakPolarHBondContact O-CG 3.43Å; V754-L758 PolarHBondContact O-N 3.38Å; Q756-L758 VanDerWaalsContact C-N 3.33Å; Q756-L758 PolarHBondContact O-N 3.45Å; L758-F760 VanDerWaalsContact C-N 3.31Å; L758-F760 HydrophobicContact CB-CD1 3.55Å; L758-F760 HydrophobicContact CB-CE1 3.54Å; L758-F760 HydrophobicContact CD1-CD1 4.45Å; L758-F760 HydrophobicContact CD1-CE1 3.72Å; L758-F760 HydrophobicContact CD1-CZ 4.23Å; L758-F760 HydrophobicContact CG-CE1 4.28Å; L758-F760 PolarHBondContact O-N 3Å
759	H	86.4	Confident	83.6	Confident	76 Å²	76	35.2 Å²	35.2	35%	0.352	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	35.7	-177	-56.2	-78	0	0	0	114.1	K727 Q734 A755 Q756 E757 I761	K727-H759 PolarHBondContact NZ-NE2 3.34Å; Q734-H759 PolarHBondContact NE2-O 3.35Å; A755-H759 PolarHBondContact O-N 3.27Å; Q756-H759 PolarHBondContact O-N 3.2Å; E757-H759 VanDerWaalsContact C-N 3.27Å; H759-I761 PolarHBondContact O-N 3.05Å
760	F	78.2	Confident	83.4	Confident	14 Å²	14	37.1 Å²	37.1	6%	0.061	19%	0.194	C	C	.	.	S	Bend	trans	-67.4	-27.5	167.6	-75.7	38.5	0	0	0	110.9	L535 I730 V740 M742 A755 L758	L535-F760 HydrophobicContact CD1-CE2 4.46Å; L535-F760 HydrophobicContact CD1-CZ 3.86Å; L535-F760 HydrophobicContact CD2-CZ 4.44Å; I730-F760 HydrophobicContact CB-CE1 4.28Å; I730-F760 HydrophobicContact CD1-CE1 3.87Å; I730-F760 HydrophobicContact CD1-CZ 3.92Å; I730-F760 HydrophobicContact CG1-CE1 3.87Å; I730-F760 HydrophobicContact CG1-CZ 4.37Å; I730-F760 HydrophobicContact CG2-CD1 3.83Å; I730-F760 HydrophobicContact CG2-CE1 3.53Å; I730-F760 HydrophobicContact CG2-CZ 4.49Å; V740-F760 HydrophobicContact CB-CE2 4.47Å; V740-F760 HydrophobicContact CG1-CD1 4.32Å; V740-F760 HydrophobicContact CG1-CD2 3.81Å; V740-F760 HydrophobicContact CG1-CE1 3.91Å; V740-F760 HydrophobicContact CG1-CE2 3.33Å; V740-F760 HydrophobicContact CG1-CG 4.29Å; V740-F760 HydrophobicContact CG1-CZ 3.38Å; M742-F760 HydrophobicContact CB-CD2 4.24Å; M742-F760 HydrophobicContact CB-CE2 3.88Å; M742-F760 HydrophobicContact CE-CD2 4.35Å; M742-F760 HydrophobicContact CE-CE2 4.01Å; M742-F760 HydrophobicContact CE-CZ 4.34Å; A755-F760 HydrophobicContact CB-CB 3.95Å; A755-F760 HydrophobicContact CB-CD2 4.46Å; A755-F760 HydrophobicContact CB-CG 4.3Å; A755-F760 WeakPolarHBondContact O-CB 3.25Å; A755-F760 PolarHBondContact O-N 3.4Å; L758-F760 VanDerWaalsContact C-N 3.31Å; L758-F760 HydrophobicContact CB-CD1 3.55Å; L758-F760 HydrophobicContact CB-CE1 3.54Å; L758-F760 HydrophobicContact CD1-CD1 4.45Å; L758-F760 HydrophobicContact CD1-CE1 3.72Å; L758-F760 HydrophobicContact CD1-CZ 4.23Å; L758-F760 HydrophobicContact CG-CE1 4.28Å; L758-F760 PolarHBondContact O-N 3Å
761	I	76.6	Confident	83	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.062	20%	0.204	C	C	.	.			trans	-121	107.5	-174.3	-59.4	169.6	0	0	0	108.5	A755 Q756 H759 K763 T766 A805 V833	A755-I761 HydrophobicContact CB-CD1 3.86Å; A755-I761 HydrophobicContact CB-CG1 4.31Å; Q756-I761 HydrophobicContact CG-CB 4.5Å; Q756-I761 HydrophobicContact CG-CD1 4.49Å; H759-I761 PolarHBondContact O-N 3.05Å; I761-K763 VanDerWaalsContact C-N 3.35Å; I761-K763 HydrophobicContact CG2-CB 4.29Å; I761-T766 HydrophobicContact CD1-CG2 4.08Å; I761-A805 HydrophobicContact CB-CB 4.36Å; I761-A805 HydrophobicContact CD1-CB 4.29Å; I761-A805 HydrophobicContact CG1-CB 4.09Å; I761-A805 HydrophobicContact CG2-CB 3.47Å; I761-A805 VanDerWaalsContact CG2-CB 3.47Å; I761-V833 HydrophobicContact CD1-CG2 4.33Å
762	D	70.1	Confident	82.3	Confident	138 Å²	138	40.3 Å²	40.3	74%	0.738	22%	0.215	S	C	*	.			trans	-96.4	13.7	174.7	-67.7	-30.5	0	0	0	112.6
763	K	77.8	Confident	81.1	Confident	56 Å²	56	46.4 Å²	46.4	24%	0.243	26%	0.257	C	S	.	.	S	Bend	trans	-104.9	151	-173.3	-61.7	-172.9	178.8	-162.7	0	112.4	I761 H765 A801 L802 H804 A805	I761-K763 VanDerWaalsContact C-N 3.35Å; I761-K763 HydrophobicContact CG2-CB 4.29Å; K763-H765 PolarHBondContact O-N 3.31Å; K763-A801 PolarHBondContact NZ-O 2.85Å; K763-L802 WeakPolarHBondContact CE-O 3.48Å; K763-L802 PolarHBondContact NZ-O 3.36Å; K763-H804 WeakPolarHBondContact CD-O 3.25Å; K763-H804 PolarHBondContact NZ-O 3.06Å; K763-A805 HydrophobicContact CB-CB 4.41Å; K763-A805 HydrophobicContact CD-CB 4.31Å
764	A	70.1	Confident	79.9	Confident	90 Å²	90	49.2 Å²	49.2	74%	0.744	27%	0.271	S	S	*	.	S	Bend	trans	-62.6	-37.2	-176.4	0	0	0	0	0	113.8
765	H	78	Confident	78.2	Confident	67 Å²	67	59.6 Å²	59.6	31%	0.31	32%	0.315	S	S	.	.			trans	-131.4	132.8	-178.2	-57.4	-57.2	0	0	0	112.1	K763 I788 A805	K763-H765 PolarHBondContact O-N 3.31Å; H765-I788 HydrophobicContact CB-CD1 4.3Å; H765-I788 VanDerWaalsContact CD2-CD1 3.48Å; H765-I788 WeakPolarHBondContact CD2-CD1 3.44Å; H765-A805 PolarHBondContact O-N 2.93Å
766	T	83.6	Confident	76.6	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.018	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.9	170.3	-49.6	0	0	0	0	109.1	I761 S783 I784 A805 C807	I761-T766 HydrophobicContact CD1-CG2 4.08Å; T766-S783 WeakPolarHBondContact O-CA 3.47Å; T766-I784 HydrophobicContact CG2-CD1 4.38Å; T766-I784 PolarHBondContact O-N 3.49Å; T766-A805 CarbonylContact C-O 3.54Å; T766-A805 WeakPolarHBondContact CA-O 3.41Å; T766-A805 HydrophobicContact CG2-CB 4.18Å; T766-C807 HydrophobicContact CG2-CB 4.21Å
767	L	87	Confident	75.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.9	177.4	-62.6	177.1	0	0	0	110	W781 I788 L790 L800 H804 A805 L806 C807	L767-W781 HydrophobicContact CB-CB 4.21Å; L767-W781 HydrophobicContact CB-CD2 4.32Å; L767-W781 HydrophobicContact CB-CE3 3.69Å; L767-W781 HydrophobicContact CB-CZ3 4.43Å; L767-W781 HydrophobicContact CD1-CB 4.23Å; L767-W781 WeakPolarHBondContact O-CZ3 3.27Å; L767-I788 HydrophobicContact CD2-CG2 4.29Å; L767-L790 HydrophobicContact CD1-CD1 3.9Å; L767-L800 HydrophobicContact CD1-CD2 3.91Å; L767-H804 HydrophobicContact CD1-CB 3.7Å; L767-H804 HydrophobicContact CG-CB 3.92Å; L767-A805 PolarHBondContact N-O 3.48Å; L767-L806 HydrophobicContact CB-CD2 4.28Å; L767-L806 HydrophobicContact CD1-CD2 4.38Å; L767-C807 PolarHBondContact O-N 3.48Å
768	I	87.5	Confident	74.5	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.1	175.9	-58.9	165.7	0	0	0	108.1	P748 L749 H770 R782 I784 C807 T809	P748-I768 HydrophobicContact CB-CD1 4.19Å; P748-I768 HydrophobicContact CB-CG2 4.11Å; P748-I768 HydrophobicContact CG-CG2 4.46Å; L749-I768 HydrophobicContact CD2-CD1 4.01Å; I768-H770 PolarHBondContact O-CD2 3.22Å; I768-H770 PolarHBondContact O-N 3.31Å; I768-R782 PolarHBondContact N-O 3.36Å; I768-R782 PolarHBondContact O-N 2.81Å; I768-I784 HydrophobicContact CD1-CG1 4.19Å; I768-C807 WeakPolarHBondContact CA-O 3.48Å; I768-C807 HydrophobicContact CG1-CB 3.99Å; I768-T809 HydrophobicContact CG2-CG2 3.87Å
769	L	85	Confident	73.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.1	175	-172.3	68	0	0	0	110.4	C779 W781 L792 C807 L808 T809 L816	L769-C779 HydrophobicContact CD1-CB 3.76Å; L769-C779 HydrophobicContact CG-CB 4.41Å; L769-W781 HydrophobicContact CB-CD2 4.42Å; L769-W781 HydrophobicContact CB-CE3 3.94Å; L769-W781 HydrophobicContact CB-CH2 3.99Å; L769-W781 HydrophobicContact CB-CZ2 4.45Å; L769-W781 HydrophobicContact CB-CZ3 3.72Å; L769-W781 HydrophobicContact CD1-CD2 3.95Å; L769-W781 HydrophobicContact CD1-CE3 4.34Å; L769-W781 HydrophobicContact CD1-CG 4.35Å; L769-W781 HydrophobicContact CD1-CZ2 4.13Å; L769-L792 HydrophobicContact CD1-CD1 3.99Å; L769-C807 PolarHBondContact N-O 2.95Å; L769-L808 HydrophobicContact CD2-CD1 3.72Å; L769-L808 HydrophobicContact CD2-CG 4.27Å; L769-T809 PolarHBondContact O-OG1 3.2Å; L769-L816 HydrophobicContact CD2-CD1 3.64Å; L769-L816 HydrophobicContact CD2-CG 4.28Å
770	H	81.8	Confident	73.8	Confident	71 Å²	71	64.1 Å²	64.1	33%	0.329	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.1	173.4	-70.7	-89.4	0	0	0	110.7	I768 E780	I768-H770 PolarHBondContact O-CD2 3.22Å; I768-H770 PolarHBondContact O-N 3.31Å; H770-E780 PolarHBondContact N-O 3.4Å; H770-E780 PolarHBondContact O-N 3.45Å
771	P	75.4	Confident	74.1	Confident	49 Å²	49	63.7 Å²	63.7	32%	0.318	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-66.2	154.8	170.3	30.5	-34.8	0	0	0	110.3	S773 D811	P771-S773 PolarHBondContact O-N 3.5Å; P771-D811 HydrophobicContact CG-CB 4.03Å
772	P	72.6	Confident	74.5	Confident	34 Å²	34	68.1 Å²	68.1	22%	0.221	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-65.3	133.2	-178.6	26.8	-34.6	0	0	0	111.6	E774 R777	P772-E774 VanDerWaalsContact C-N 3.26Å; P772-E774 PolarHBondContact O-N 3.09Å; P772-R777 HydrophobicContact CB-CB 3.99Å; P772-R777 WeakPolarHBondContact CB-O 3.46Å; P772-R777 VanDerWaalsContact CG-O 3.3Å; P772-R777 WeakPolarHBondContact CG-O 3.32Å
773	S	62.6	Low	75.3	Confident	127 Å²	127	61.8 Å²	61.8	89%	0.888	34%	0.339	S	S	*	.	S	Bend	trans	-74	-15.4	179.3	-164	0	0	0	0	113.4	P771	P771-S773 PolarHBondContact O-N 3.5Å
774	E	62.8	Low	75.4	Confident	114 Å²	114	60.4 Å²	60.4	53%	0.533	33%	0.333	S	S	.	.	S	Bend	trans	-129.3	142	178	-71.3	175.9	158.8	0	0	109.9	P772 G776 R777	P772-E774 VanDerWaalsContact C-N 3.26Å; P772-E774 PolarHBondContact O-N 3.09Å; E774-G776 PolarHBondContact O-N 3.17Å; E774-R777 PolarHBondContact O-N 3.31Å; E774-R777 IonicContact OE2-CZ 3.67Å; E774-R777 IonicContact OE2-NE 3.59Å; E774-R777 PolarHBondContact OE2-NE 3.02Å; E774-R777 IonicContact OE2-NH2 2.72Å; E774-R777 PolarHBondContact OE2-NH2 3.06Å; E774-R777 VanDerWaalsContact OE2-NH2 3.15Å
775	K	52.6	Low	75.6	Confident	225 Å²	225	60.6 Å²	60.6	98%	0.978	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	109.6	175.6	-74.1	-176.5	178.2	179.4	0	109.7
776	G	56.3	Low	75.5	Confident	80 Å²	80	61.3 Å²	61.3	83%	0.825	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.2	-8.6	174.4	0	0	0	0	0	116.3	E774	E774-G776 PolarHBondContact O-N 3.17Å
777	R	65.1	Low	75.2	Confident	143 Å²	143	65.1 Å²	65.1	54%	0.54	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-84.7	147.7	170.7	-70.5	-170.6	-166.9	-153.8	1.6	111.5	P772 E774	P772-R777 HydrophobicContact CB-CB 3.99Å; P772-R777 WeakPolarHBondContact CB-O 3.46Å; P772-R777 VanDerWaalsContact CG-O 3.3Å; P772-R777 WeakPolarHBondContact CG-O 3.32Å; E774-R777 PolarHBondContact O-N 3.31Å; E774-R777 IonicContact OE2-CZ 3.67Å; E774-R777 IonicContact OE2-NE 3.59Å; E774-R777 PolarHBondContact OE2-NE 3.02Å; E774-R777 IonicContact OE2-NH2 2.72Å; E774-R777 PolarHBondContact OE2-NH2 3.06Å; E774-R777 VanDerWaalsContact OE2-NH2 3.15Å
778	P	67	Low	74.9	Confident	68 Å²	68	67.1 Å²	67.1	44%	0.442	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-68.8	155.6	171	29.4	-33.6	0	0	0	111
779	C	74.6	Confident	74.6	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.02	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-59.5	149	171.2	-60.2	0	0	0	0	111.1	L769 L792 H815	L769-C779 HydrophobicContact CD1-CB 3.76Å; L769-C779 HydrophobicContact CG-CB 4.41Å; C779-L792 HydrophobicContact CB-CB 4.16Å; C779-L792 HydrophobicContact CB-CD2 4.1Å; C779-L792 VanDerWaalsContact O-CB 3.24Å; C779-L792 WeakPolarHBondContact O-CB 3.36Å; C779-L792 PolarHBondContact O-N 2.99Å; C779-H815 PolarHBondContact SG-CD2 3.5Å
780	E	85.1	Confident	74.4	Confident	49 Å²	49	73 Å²	73	23%	0.229	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.1	179.6	-67	173.3	-174.8	0	0	110	H770 R782 V789 L790	H770-E780 PolarHBondContact N-O 3.4Å; H770-E780 PolarHBondContact O-N 3.45Å; E780-R782 IonicContact OE2-CZ 3.5Å; E780-R782 IonicContact OE2-NE 2.78Å; E780-R782 PolarHBondContact OE2-NE 2.9Å; E780-R782 IonicContact OE2-NH2 3.44Å; E780-R782 PolarHBondContact OE2-NH2 3.47Å; E780-V789 HydrophobicContact CB-CG1 4.38Å; E780-L790 CarbonylContact C-O 3.55Å
781	W	83.9	Confident	74.2	Confident	4 Å²	4	72 Å²	72	2%	0.015	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.4	165.2	-69.9	103.7	0	0	0	109	L767 L769 V789 L790 L792 L806 L827	L767-W781 HydrophobicContact CB-CB 4.21Å; L767-W781 HydrophobicContact CB-CD2 4.32Å; L767-W781 HydrophobicContact CB-CE3 3.69Å; L767-W781 HydrophobicContact CB-CZ3 4.43Å; L767-W781 HydrophobicContact CD1-CB 4.23Å; L767-W781 WeakPolarHBondContact O-CZ3 3.27Å; L769-W781 HydrophobicContact CB-CD2 4.42Å; L769-W781 HydrophobicContact CB-CE3 3.94Å; L769-W781 HydrophobicContact CB-CH2 3.99Å; L769-W781 HydrophobicContact CB-CZ2 4.45Å; L769-W781 HydrophobicContact CB-CZ3 3.72Å; L769-W781 HydrophobicContact CD1-CD2 3.95Å; L769-W781 HydrophobicContact CD1-CE3 4.34Å; L769-W781 HydrophobicContact CD1-CG 4.35Å; L769-W781 HydrophobicContact CD1-CZ2 4.13Å; W781-V789 CarbonylContact O-C 3.59Å; W781-V789 VanDerWaalsContact O-CA 3.3Å; W781-V789 WeakPolarHBondContact O-CA 3.29Å; W781-L790 HydrophobicContact CB-CB 4.17Å; W781-L790 PolarHBondContact N-O 3.32Å; W781-L790 PolarHBondContact O-N 3.48Å; W781-L792 HydrophobicContact CZ2-CD1 4.47Å; W781-L806 HydrophobicContact CE3-CD2 4.24Å; W781-L806 HydrophobicContact CH2-CB 4.12Å; W781-L806 HydrophobicContact CH2-CD1 4.43Å; W781-L806 HydrophobicContact CH2-CD2 3.99Å; W781-L806 HydrophobicContact CH2-CG 4.41Å; W781-L806 HydrophobicContact CZ2-CD2 4.38Å; W781-L806 HydrophobicContact CZ3-CB 4.18Å; W781-L806 HydrophobicContact CZ3-CD2 3.91Å; W781-L827 HydrophobicContact CH2-CD2 4.41Å; W781-L827 HydrophobicContact CZ2-CD1 4.21Å; W781-L827 HydrophobicContact CZ2-CD2 4.12Å
782	R	86.6	Confident	73.9	Confident	105 Å²	105	70.8 Å²	70.8	40%	0.396	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135	175.9	-61.1	-172.4	178.4	179.9	-0.8	110.8	I768 E780 V789	I768-R782 PolarHBondContact N-O 3.36Å; I768-R782 PolarHBondContact O-N 2.81Å; E780-R782 IonicContact OE2-CZ 3.5Å; E780-R782 IonicContact OE2-NE 2.78Å; E780-R782 PolarHBondContact OE2-NE 2.9Å; E780-R782 IonicContact OE2-NH2 3.44Å; E780-R782 PolarHBondContact OE2-NH2 3.47Å; R782-V789 HydrophobicContact CG-CG1 4.23Å; R782-V789 HydrophobicContact CG-CG2 4.2Å
783	S	85.5	Confident	73.3	Confident	6 Å²	6	74.5 Å²	74.5	4%	0.042	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	156.7	172.1	58.3	0	0	0	0	112.4	T766 D785 S786 S787 I788	T766-S783 WeakPolarHBondContact O-CA 3.47Å; S783-D785 PolarHBondContact O-N 3.15Å; S783-S786 WeakPolarHBondContact O-CA 3.47Å; S783-S786 PolarHBondContact O-N 2.81Å; S783-S786 WeakPolarHBondContact OG-CA 3.26Å; S783-S786 PolarHBondContact OG-N 3.25Å; S783-S787 PolarHBondContact OG-N 2.85Å; S783-S787 PolarHBondContact OG-OG 2.88Å; S783-I788 PolarHBondContact N-O 2.94Å; S783-I788 PolarHBondContact OG-N 3.28Å; S783-I788 PolarHBondContact OG-O 2.9Å
784	I	79.8	Confident	72.8	Confident	26 Å²	26	74.1 Å²	74.1	13%	0.133	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.2	175.8	-62.3	170.4	0	0	0	111.7	R677 L749 C752 T766 I768 S786	R677-I784 HydrophobicContact CG-CG2 4.05Å; R677-I784 PolarHBondContact NE-O 2.84Å; R677-I784 PolarHBondContact NH2-O 2.91Å; L749-I784 HydrophobicContact CD2-CG2 4.16Å; C752-I784 HydrophobicContact CB-CD1 3.8Å; T766-I784 HydrophobicContact CG2-CD1 4.38Å; T766-I784 PolarHBondContact O-N 3.49Å; I768-I784 HydrophobicContact CD1-CG1 4.19Å; I784-S786 VanDerWaalsContact C-N 3.27Å; I784-S786 PolarHBondContact O-N 3.31Å
785	D	76.1	Confident	72.5	Confident	95 Å²	95	71.8 Å²	71.8	51%	0.508	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-3.5	179.5	-59.3	-33.6	0	0	0	113.1	R677 S783 S787	R677-D785 IonicContact CZ-OD1 3.6Å; R677-D785 IonicContact NE-OD1 3.47Å; S783-D785 PolarHBondContact O-N 3.15Å; D785-S787 PolarHBondContact O-N 3.44Å
786	S	74.5	Confident	73.2	Confident	82 Å²	82	64.2 Å²	64.2	57%	0.573	39%	0.388	S	S	*	.	S	Bend	trans	59.6	15.5	-173.4	-55.5	0	0	0	0	115	S783 I784	S783-S786 WeakPolarHBondContact O-CA 3.47Å; S783-S786 PolarHBondContact O-N 2.81Å; S783-S786 WeakPolarHBondContact OG-CA 3.26Å; S783-S786 PolarHBondContact OG-N 3.25Å; I784-S786 VanDerWaalsContact C-N 3.27Å; I784-S786 PolarHBondContact O-N 3.31Å
787	S	77.8	Confident	73.9	Confident	83 Å²	83	61.8 Å²	61.8	58%	0.58	36%	0.357	S	S	*	.			trans	-72.3	-38.2	177.8	57.5	0	0	0	0	112.8	S783 D785	S783-S787 PolarHBondContact OG-N 2.85Å; S783-S787 PolarHBondContact OG-OG 2.88Å; D785-S787 PolarHBondContact O-N 3.44Å
788	I	80.5	Confident	74.3	Confident	42 Å²	42	58 Å²	58	22%	0.215	35%	0.345	C	S	.	.			trans	-110.8	128.8	-179.7	-56.7	169.5	0	0	0	109.6	H765 L767 S783 L790	H765-I788 HydrophobicContact CB-CD1 4.3Å; H765-I788 VanDerWaalsContact CD2-CD1 3.48Å; H765-I788 WeakPolarHBondContact CD2-CD1 3.44Å; L767-I788 HydrophobicContact CD2-CG2 4.29Å; S783-I788 PolarHBondContact N-O 2.94Å; S783-I788 PolarHBondContact OG-N 3.28Å; S783-I788 PolarHBondContact OG-O 2.9Å; I788-L790 HydrophobicContact CG2-CD1 4.12Å; I788-L790 HydrophobicContact CG2-CD2 4.44Å; I788-L790 HydrophobicContact CG2-CG 3.9Å
789	V	81.7	Confident	74.9	Confident	79 Å²	79	57.1 Å²	57.1	48%	0.479	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	121.9	172	-176.8	0	0	0	0	108.6	E780 W781 R782	E780-V789 HydrophobicContact CB-CG1 4.38Å; W781-V789 CarbonylContact O-C 3.59Å; W781-V789 VanDerWaalsContact O-CA 3.3Å; W781-V789 WeakPolarHBondContact O-CA 3.29Å; R782-V789 HydrophobicContact CG-CG1 4.23Å; R782-V789 HydrophobicContact CG-CG2 4.2Å
790	L	80.4	Confident	75.1	Confident	48 Å²	48	58.1 Å²	58.1	25%	0.251	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.2	-178.8	-62.4	169.3	0	0	0	110.5	L767 E780 W781 I788 L800	L767-L790 HydrophobicContact CD1-CD1 3.9Å; E780-L790 CarbonylContact C-O 3.55Å; W781-L790 HydrophobicContact CB-CB 4.17Å; W781-L790 PolarHBondContact N-O 3.32Å; W781-L790 PolarHBondContact O-N 3.48Å; I788-L790 HydrophobicContact CG2-CD1 4.12Å; I788-L790 HydrophobicContact CG2-CD2 4.44Å; I788-L790 HydrophobicContact CG2-CG 3.9Å; L790-L800 HydrophobicContact CD1-CD2 3.97Å
791	P	76.5	Confident	74.8	Confident	50 Å²	50	56.6 Å²	56.6	33%	0.325	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	149	173.4	31.1	-34	0	0	0	111.3	T793 L794	P791-T793 PolarHBondContact O-N 2.91Å; P791-T793 VanDerWaalsContact O-N 3.15Å; P791-L794 HydrophobicContact CG-CD1 4.26Å; P791-L794 PolarHBondContact O-N 3.42Å
792	L	69.9	Low	74.6	Confident	24 Å²	24	63 Å²	63	13%	0.126	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.7	177	-175	75.4	0	0	0	113.3	L769 C779 W781 L794 L816	L769-L792 HydrophobicContact CD1-CD1 3.99Å; C779-L792 HydrophobicContact CB-CB 4.16Å; C779-L792 HydrophobicContact CB-CD2 4.1Å; C779-L792 VanDerWaalsContact O-CB 3.24Å; C779-L792 WeakPolarHBondContact O-CB 3.36Å; C779-L792 PolarHBondContact O-N 2.99Å; W781-L792 HydrophobicContact CZ2-CD1 4.47Å; L792-L794 VanDerWaalsContact C-N 3.3Å; L792-L794 PolarHBondContact O-N 3.19Å; L792-L816 HydrophobicContact CD2-CD2 3.56Å
793	T	60.5	Low	74.4	Confident	112 Å²	112	64.8 Å²	64.8	69%	0.687	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.4	-174.7	36.3	0	0	0	0	115.1	P791 G795	P791-T793 PolarHBondContact O-N 2.91Å; P791-T793 VanDerWaalsContact O-N 3.15Å; T793-G795 PolarHBondContact O-N 2.9Å
794	L	50.7	Low	74.3	Confident	119 Å²	119	65.6 Å²	65.6	62%	0.623	39%	0.393	S	S	*	.	S	Bend	trans	-86.5	101.3	-176.5	-121.4	89.4	0	0	0	112.5	P791 L792 L800	P791-L794 HydrophobicContact CG-CD1 4.26Å; P791-L794 PolarHBondContact O-N 3.42Å; L792-L794 VanDerWaalsContact C-N 3.3Å; L792-L794 PolarHBondContact O-N 3.19Å; L794-L800 WeakPolarHBondContact O-CD1 3.48Å
795	G	58.4	Low	74.6	Confident	64 Å²	64	64.4 Å²	64.4	66%	0.66	39%	0.387	S	S	*	.	S	Bend	trans	84.7	180	154.2	0	0	0	0	0	117.7	T793	T793-G795 PolarHBondContact O-N 2.9Å
796	S	66.6	Low	75.3	Confident	67 Å²	67	59.9 Å²	59.9	47%	0.469	36%	0.363	S	S	.	.			trans	-67.9	135.9	177.5	69.5	0	0	0	0	109.7	K798 A799	S796-K798 PolarHBondContact O-N 3.32Å; S796-A799 PolarHBondContact O-N 2.94Å
797	P	71.3	Confident	76.1	Confident	28 Å²	28	56 Å²	56	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-57.4	-18.6	178.9	20.7	-31.6	0	0	0	112.9	A801 R826 L827	P797-A801 WeakPolarHBondContact O-CB 3.25Å; P797-A801 PolarHBondContact O-N 3.32Å; P797-R826 HydrophobicContact CG-CB 4.24Å; P797-L827 HydrophobicContact CB-CD1 3.82Å
798	K	73.4	Confident	76.7	Confident	65 Å²	65	52.1 Å²	52.1	28%	0.283	31%	0.308	S	S	.	.	H	α-helix	trans	-68.3	-43.8	175	-61.5	-169.6	-178	-168.7	0	113.5	S796 A801 L802 H830 P1200 S1201	S796-K798 PolarHBondContact O-N 3.32Å; K798-A801 CarbonylContact O-C 3.58Å; K798-A801 PolarHBondContact O-N 3.12Å; K798-L802 PolarHBondContact O-N 3.45Å; K798-H830 WeakPolarHBondContact CG-NE2 3.34Å; K798-P1200 PolarHBondContact NZ-O 3.44Å; K798-S1201 PolarHBondContact NZ-O 3.5Å; K798-S1201 PolarHBondContact NZ-OXT 2.86Å
799	A	78.4	Confident	77.2	Confident	48 Å²	48	50.7 Å²	50.7	40%	0.397	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-46.5	-179.1	0	0	0	0	0	110.8	S796 A801 L802 E803	S796-A799 PolarHBondContact O-N 2.94Å; A799-A801 VanDerWaalsContact C-N 3.31Å; A799-A801 PolarHBondContact O-N 3.46Å; A799-L802 WeakPolarHBondContact O-CB 3.16Å; A799-L802 PolarHBondContact O-N 2.87Å; A799-E803 PolarHBondContact O-N 2.66Å
800	L	79.4	Confident	77.4	Confident	24 Å²	24	47 Å²	47	13%	0.126	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-44.4	171.6	-89.6	149	0	0	0	112	L767 L790 L794 L802 E803 H804	L767-L800 HydrophobicContact CD1-CD2 3.91Å; L790-L800 HydrophobicContact CD1-CD2 3.97Å; L794-L800 WeakPolarHBondContact O-CD1 3.48Å; L800-L802 PolarHBondContact O-N 3.2Å; L800-E803 PolarHBondContact O-N 3.28Å; L800-H804 PolarHBondContact O-N 3.24Å
801	A	79.4	Confident	77.6	Confident	17 Å²	17	50.2 Å²	50.2	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-77.2	0.5	178.5	0	0	0	0	0	114.7	K763 P797 K798 A799 L806 H830	K763-A801 PolarHBondContact NZ-O 2.85Å; P797-A801 WeakPolarHBondContact O-CB 3.25Å; P797-A801 PolarHBondContact O-N 3.32Å; K798-A801 CarbonylContact O-C 3.58Å; K798-A801 PolarHBondContact O-N 3.12Å; A799-A801 VanDerWaalsContact C-N 3.31Å; A799-A801 PolarHBondContact O-N 3.46Å; A801-L806 HydrophobicContact CB-CD1 3.94Å; A801-H830 HydrophobicContact CB-CB 3.61Å
802	L	79.7	Confident	78	Confident	138 Å²	138	47.9 Å²	47.9	72%	0.723	28%	0.282	S	S	*	.	H	α-helix	trans	-92.8	-43.3	168.9	-87.5	154.3	0	0	0	110.4	K763 K798 A799 L800	K763-L802 WeakPolarHBondContact CE-O 3.48Å; K763-L802 PolarHBondContact NZ-O 3.36Å; K798-L802 PolarHBondContact O-N 3.45Å; A799-L802 WeakPolarHBondContact O-CB 3.16Å; A799-L802 PolarHBondContact O-N 2.87Å; L800-L802 PolarHBondContact O-N 3.2Å
803	E	81.4	Confident	78.8	Confident	143 Å²	143	46.7 Å²	46.7	67%	0.668	28%	0.276	S	S	*	.	H	α-helix	trans	-82.4	-36.4	-179.3	-65.2	179.9	177.1	0	0	113.1	A799 L800	A799-E803 PolarHBondContact O-N 2.66Å; L800-E803 PolarHBondContact O-N 3.28Å
804	H	84.4	Confident	80.1	Confident	24 Å²	24	43.5 Å²	43.5	11%	0.111	26%	0.26	C	S	.	.	S	Bend	trans	-127.2	157.4	-170.9	-57.2	-47.8	0	0	0	112.8	K763 L767 L800	K763-H804 WeakPolarHBondContact CD-O 3.25Å; K763-H804 PolarHBondContact NZ-O 3.06Å; L767-H804 HydrophobicContact CD1-CB 3.7Å; L767-H804 HydrophobicContact CG-CB 3.92Å; L800-H804 PolarHBondContact O-N 3.24Å
805	A	85.6	Confident	81.7	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	141.3	168.3	0	0	0	0	0	109.1	I761 K763 H765 T766 L767 Q832	I761-A805 HydrophobicContact CB-CB 4.36Å; I761-A805 HydrophobicContact CD1-CB 4.29Å; I761-A805 HydrophobicContact CG1-CB 4.09Å; I761-A805 HydrophobicContact CG2-CB 3.47Å; I761-A805 VanDerWaalsContact CG2-CB 3.47Å; K763-A805 HydrophobicContact CB-CB 4.41Å; K763-A805 HydrophobicContact CD-CB 4.31Å; H765-A805 PolarHBondContact O-N 2.93Å; T766-A805 CarbonylContact C-O 3.54Å; T766-A805 WeakPolarHBondContact CA-O 3.41Å; T766-A805 HydrophobicContact CG2-CB 4.18Å; L767-A805 PolarHBondContact N-O 3.48Å; A805-Q832 VanDerWaalsContact CA-OE1 3.22Å
806	L	89.9	Confident	82.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.9	-172.5	-57.1	179.7	0	0	0	110.2	L767 W781 A801 L827 H830 V831 Q832 V833	L767-L806 HydrophobicContact CB-CD2 4.28Å; L767-L806 HydrophobicContact CD1-CD2 4.38Å; W781-L806 HydrophobicContact CE3-CD2 4.24Å; W781-L806 HydrophobicContact CH2-CB 4.12Å; W781-L806 HydrophobicContact CH2-CD1 4.43Å; W781-L806 HydrophobicContact CH2-CD2 3.99Å; W781-L806 HydrophobicContact CH2-CG 4.41Å; W781-L806 HydrophobicContact CZ2-CD2 4.38Å; W781-L806 HydrophobicContact CZ3-CB 4.18Å; W781-L806 HydrophobicContact CZ3-CD2 3.91Å; A801-L806 HydrophobicContact CB-CD1 3.94Å; L806-L827 HydrophobicContact CD1-CD1 3.96Å; L806-H830 HydrophobicContact CD1-CB 4.43Å; L806-V831 HydrophobicContact CB-CG2 4.38Å; L806-V831 WeakPolarHBondContact O-CG1 2.9Å; L806-Q832 PolarHBondContact O-N 3.16Å; L806-Q832 VanDerWaalsContact O-N 3.11Å; L806-V833 PolarHBondContact O-N 3.28Å
807	C	91.1	Very high	83.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.1	172.6	177.4	0	0	0	0	109.8	T766 L767 I768 L769 V833	T766-C807 HydrophobicContact CG2-CB 4.21Å; L767-C807 PolarHBondContact O-N 3.48Å; I768-C807 WeakPolarHBondContact CA-O 3.48Å; I768-C807 HydrophobicContact CG1-CB 3.99Å; L769-C807 PolarHBondContact N-O 2.95Å; C807-V833 CarbonylContact C-O 3.46Å; C807-V833 VanDerWaalsContact CA-O 3.25Å; C807-V833 WeakPolarHBondContact CA-O 3.3Å; C807-V833 HydrophobicContact CB-CB 4.25Å
808	L	91.3	Very high	84.4	Confident	1 Å²	1	42 Å²	42	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.1	-179.9	-159.6	115.6	0	0	0	110.3	L769 L813 L816 L827 V831 V833 F834 A835	L769-L808 HydrophobicContact CD2-CD1 3.72Å; L769-L808 HydrophobicContact CD2-CG 4.27Å; L808-L813 HydrophobicContact CD2-CB 3.55Å; L808-L813 HydrophobicContact CD2-CD1 3.46Å; L808-L813 VanDerWaalsContact CD2-CD1 3.46Å; L808-L813 HydrophobicContact CD2-CG 4.07Å; L808-L816 HydrophobicContact CD1-CD1 4.06Å; L808-L827 HydrophobicContact CD1-CD2 3.58Å; L808-L827 HydrophobicContact CD1-CG 4.5Å; L808-V831 HydrophobicContact CB-CG1 3.94Å; L808-V831 HydrophobicContact CB-CG2 4.27Å; L808-V831 HydrophobicContact CD1-CG2 4.4Å; L808-V833 PolarHBondContact N-O 3.17Å; L808-F834 HydrophobicContact CB-CD1 4.01Å; L808-F834 HydrophobicContact CB-CE1 4.18Å; L808-F834 HydrophobicContact CD2-CD1 4.04Å; L808-F834 HydrophobicContact CD2-CE1 4.02Å; L808-F834 WeakPolarHBondContact O-CA 3.4Å; L808-A835 PolarHBondContact O-N 3.27Å
809	T	90.4	Very high	84.8	Confident	13 Å²	13	43.8 Å²	43.8	8%	0.08	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	154.3	178.5	56.8	0	0	0	0	111.2	P748 I768 L769 D811 G812 L813 A835	P748-T809 HydrophobicContact CB-CG2 4.32Å; P748-T809 HydrophobicContact CG-CG2 4.16Å; I768-T809 HydrophobicContact CG2-CG2 3.87Å; L769-T809 PolarHBondContact O-OG1 3.2Å; T809-D811 VanDerWaalsContact C-N 3.27Å; T809-D811 PolarHBondContact O-N 3.17Å; T809-G812 PolarHBondContact O-N 2.77Å; T809-G812 VanDerWaalsContact O-N 3.14Å; T809-G812 PolarHBondContact OG1-N 2.87Å; T809-L813 PolarHBondContact O-N 2.99Å; T809-A835 CarbonylContact C-O 3.55Å; T809-A835 VanDerWaalsContact CA-O 3.32Å; T809-A835 WeakPolarHBondContact CA-O 3.42Å
810	G	86.3	Confident	85	Confident	2 Å²	2	44.4 Å²	44.4	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-37.4	176.2	0	0	0	0	0	113.9	L813 A814 A835 Q841	G810-L813 WeakPolarHBondContact O-CB 3.34Å; G810-L813 PolarHBondContact O-N 3.22Å; G810-A814 PolarHBondContact O-N 3.01Å; G810-A835 PolarHBondContact N-O 3.43Å; G810-Q841 PolarHBondContact O-NE2 3.47Å
811	D	84.8	Confident	85.2	Confident	115 Å²	115	46.6 Å²	46.6	62%	0.615	27%	0.267	S	S	*	.	H	α-helix	trans	-70.4	-41.1	175.6	-62.8	-30.9	0	0	0	111.5	P771 T809 L813 A814 H815	P771-D811 HydrophobicContact CG-CB 4.03Å; T809-D811 VanDerWaalsContact C-N 3.27Å; T809-D811 PolarHBondContact O-N 3.17Å; D811-L813 VanDerWaalsContact C-N 3.31Å; D811-L813 PolarHBondContact O-N 3.33Å; D811-A814 PolarHBondContact O-N 2.83Å; D811-H815 WeakPolarHBondContact O-CB 3.48Å; D811-H815 PolarHBondContact O-N 3.43Å
812	G	85.3	Confident	85.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-39.5	173.2	0	0	0	0	0	112.3	T809 H815 L816	T809-G812 PolarHBondContact O-N 2.77Å; T809-G812 VanDerWaalsContact O-N 3.14Å; T809-G812 PolarHBondContact OG1-N 2.87Å; G812-H815 PolarHBondContact O-N 3.05Å; G812-L816 WeakPolarHBondContact O-CB 3.44Å; G812-L816 VanDerWaalsContact O-CG 3.32Å; G812-L816 WeakPolarHBondContact O-CG 3.33Å; G812-L816 PolarHBondContact O-N 3.39Å
813	L	87	Confident	85.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-50.9	174.9	-172.5	69.1	0	0	0	111.6	L808 T809 G810 D811 H815 L816 Q817 L824 Q841 F844 V845	L808-L813 HydrophobicContact CD2-CB 3.55Å; L808-L813 HydrophobicContact CD2-CD1 3.46Å; L808-L813 VanDerWaalsContact CD2-CD1 3.46Å; L808-L813 HydrophobicContact CD2-CG 4.07Å; T809-L813 PolarHBondContact O-N 2.99Å; G810-L813 WeakPolarHBondContact O-CB 3.34Å; G810-L813 PolarHBondContact O-N 3.22Å; D811-L813 VanDerWaalsContact C-N 3.31Å; D811-L813 PolarHBondContact O-N 3.33Å; L813-H815 VanDerWaalsContact C-N 3.31Å; L813-H815 PolarHBondContact O-N 3.23Å; L813-L816 PolarHBondContact O-N 2.94Å; L813-Q817 WeakPolarHBondContact O-CB 3.47Å; L813-Q817 PolarHBondContact O-N 3.12Å; L813-L824 HydrophobicContact CD1-CD1 3.62Å; L813-L824 HydrophobicContact CD1-CD2 3.88Å; L813-L824 HydrophobicContact CD1-CG 4.3Å; L813-Q841 HydrophobicContact CD2-CB 3.83Å; L813-Q841 HydrophobicContact CD2-CG 4.04Å; L813-F844 HydrophobicContact CD1-CE1 4.31Å; L813-F844 HydrophobicContact CD2-CD1 4.35Å; L813-V845 HydrophobicContact CD2-CG2 4.26Å
814	A	86.6	Confident	85.7	Confident	44 Å²	44	41.9 Å²	41.9	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-62.9	-39.5	-179.5	0	0	0	0	0	111.8	G810 D811 Q817 A818	G810-A814 PolarHBondContact O-N 3.01Å; D811-A814 PolarHBondContact O-N 2.83Å; A814-Q817 PolarHBondContact O-N 3.06Å; A814-A818 PolarHBondContact O-N 2.94Å
815	H	85.1	Confident	85.7	Confident	68 Å²	68	43.1 Å²	43.1	32%	0.315	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-48.3	176.7	-170.5	79.2	0	0	0	111.9	C779 D811 G812 L813 Q817 A818 V819	C779-H815 PolarHBondContact SG-CD2 3.5Å; D811-H815 WeakPolarHBondContact O-CB 3.48Å; D811-H815 PolarHBondContact O-N 3.43Å; G812-H815 PolarHBondContact O-N 3.05Å; L813-H815 VanDerWaalsContact C-N 3.31Å; L813-H815 PolarHBondContact O-N 3.23Å; H815-Q817 VanDerWaalsContact C-N 3.3Å; H815-Q817 PolarHBondContact O-N 3.47Å; H815-A818 PolarHBondContact O-N 3.12Å; H815-V819 WeakPolarHBondContact O-CG2 3.1Å; H815-V819 PolarHBondContact O-N 3.44Å
816	L	84.4	Confident	85.6	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-37.9	177.2	-74.1	177	0	0	0	112.3	L769 L792 L808 G812 L813 A818 V819 D820 L824 L827	L769-L816 HydrophobicContact CD2-CD1 3.64Å; L769-L816 HydrophobicContact CD2-CG 4.28Å; L792-L816 HydrophobicContact CD2-CD2 3.56Å; L808-L816 HydrophobicContact CD1-CD1 4.06Å; G812-L816 WeakPolarHBondContact O-CB 3.44Å; G812-L816 VanDerWaalsContact O-CG 3.32Å; G812-L816 WeakPolarHBondContact O-CG 3.33Å; G812-L816 PolarHBondContact O-N 3.39Å; L813-L816 PolarHBondContact O-N 2.94Å; L816-A818 VanDerWaalsContact C-N 3.27Å; L816-A818 PolarHBondContact O-N 3.37Å; L816-V819 PolarHBondContact O-N 2.89Å; L816-D820 CarbonylContact O-C 3.58Å; L816-D820 PolarHBondContact O-N 3.19Å; L816-D820 VanDerWaalsContact O-O 3.14Å; L816-L824 HydrophobicContact CB-CB 4.28Å; L816-L824 HydrophobicContact CB-CD1 4.29Å; L816-L824 HydrophobicContact CB-CD2 4.35Å; L816-L824 HydrophobicContact CD1-CD1 4.13Å; L816-L827 HydrophobicContact CD1-CD2 4Å
817	Q	85.3	Confident	85.5	Confident	88 Å²	88	51.5 Å²	51.5	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-35.5	176.9	-172.7	176.7	7	0	0	112.2	L813 A814 H815 L824	L813-Q817 WeakPolarHBondContact O-CB 3.47Å; L813-Q817 PolarHBondContact O-N 3.12Å; A814-Q817 PolarHBondContact O-N 3.06Å; H815-Q817 VanDerWaalsContact C-N 3.3Å; H815-Q817 PolarHBondContact O-N 3.47Å; Q817-L824 HydrophobicContact CB-CD2 3.97Å
818	A	84.1	Confident	85.4	Confident	86 Å²	86	51.7 Å²	51.7	71%	0.711	28%	0.278	S	S	*	.	H	α-helix	trans	-77.7	-35.6	178.2	0	0	0	0	0	113.2	A814 H815 L816	A814-A818 PolarHBondContact O-N 2.94Å; H815-A818 PolarHBondContact O-N 3.12Å; L816-A818 VanDerWaalsContact C-N 3.27Å; L816-A818 PolarHBondContact O-N 3.37Å
819	V	82.1	Confident	85.3	Confident	103 Å²	103	52.2 Å²	52.2	62%	0.624	28%	0.282	S	S	*	.	H	α-helix	trans	-91	-51.8	-173.8	178.5	0	0	0	0	112.5	H815 L816	H815-V819 WeakPolarHBondContact O-CG2 3.1Å; H815-V819 PolarHBondContact O-N 3.44Å; L816-V819 PolarHBondContact O-N 2.89Å
820	D	81.7	Confident	85.2	Confident	60 Å²	60	53.6 Å²	53.6	32%	0.321	29%	0.287	S	S	.	.			trans	-146.1	90	-179.2	-171.8	-10.2	0	0	0	111.9	L816 Q822 Q823 L824	L816-D820 CarbonylContact O-C 3.58Å; L816-D820 PolarHBondContact O-N 3.19Å; L816-D820 VanDerWaalsContact O-O 3.14Å; D820-Q822 VanDerWaalsContact C-N 3.25Å; D820-Q822 PolarHBondContact O-N 2.9Å; D820-Q822 PolarHBondContact OD1-N 3.35Å; D820-Q823 HydrophobicContact CB-CB 4.14Å; D820-Q823 PolarHBondContact OD1-N 2.96Å; D820-Q823 VanDerWaalsContact OD2-CB 3.3Å; D820-Q823 WeakPolarHBondContact OD2-CB 3.45Å; D820-L824 PolarHBondContact O-N 3.17Å
821	P	83.3	Confident	85.3	Confident	71 Å²	71	53.5 Å²	53.5	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-67.1	-23.3	178.7	26.3	-33.8	0	0	0	113.3	L825	P821-L825 WeakPolarHBondContact O-CG 3.38Å; P821-L825 PolarHBondContact O-N 2.79Å; P821-L825 VanDerWaalsContact O-N 3.13Å
822	Q	83.2	Confident	85.6	Confident	135 Å²	135	49.5 Å²	49.5	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-76.9	-41.1	-179.5	-68.2	-165.8	-3	0	0	111.9	D820 L824 L825 R826	D820-Q822 VanDerWaalsContact C-N 3.25Å; D820-Q822 PolarHBondContact O-N 2.9Å; D820-Q822 PolarHBondContact OD1-N 3.35Å; Q822-L824 VanDerWaalsContact C-N 3.25Å; Q822-L824 PolarHBondContact O-N 2.96Å; Q822-L825 PolarHBondContact O-N 3.19Å; Q822-R826 PolarHBondContact O-N 3.14Å
823	Q	82.6	Confident	86	Confident	61 Å²	61	49.5 Å²	49.5	29%	0.285	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-38.7	172.9	-174.8	178.4	9.8	0	0	110.8	D820 R826 L827	D820-Q823 HydrophobicContact CB-CB 4.14Å; D820-Q823 PolarHBondContact OD1-N 2.96Å; D820-Q823 VanDerWaalsContact OD2-CB 3.3Å; D820-Q823 WeakPolarHBondContact OD2-CB 3.45Å; Q823-R826 PolarHBondContact O-N 3.3Å; Q823-L827 WeakPolarHBondContact O-CB 3.31Å; Q823-L827 PolarHBondContact O-N 3.09Å
824	L	84.9	Confident	86.3	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-47.8	176.1	178.3	57.3	0	0	0	112.3	L813 L816 Q817 D820 Q822 R826 L827 I828 F844	L813-L824 HydrophobicContact CD1-CD1 3.62Å; L813-L824 HydrophobicContact CD1-CD2 3.88Å; L813-L824 HydrophobicContact CD1-CG 4.3Å; L816-L824 HydrophobicContact CB-CB 4.28Å; L816-L824 HydrophobicContact CB-CD1 4.29Å; L816-L824 HydrophobicContact CB-CD2 4.35Å; L816-L824 HydrophobicContact CD1-CD1 4.13Å; Q817-L824 HydrophobicContact CB-CD2 3.97Å; D820-L824 PolarHBondContact O-N 3.17Å; Q822-L824 VanDerWaalsContact C-N 3.25Å; Q822-L824 PolarHBondContact O-N 2.96Å; L824-R826 PolarHBondContact O-N 3.47Å; L824-L827 PolarHBondContact O-N 2.93Å; L824-I828 HydrophobicContact CD1-CD1 4.05Å; L824-I828 HydrophobicContact CD1-CG1 3.9Å; L824-I828 HydrophobicContact CG-CD1 3.92Å; L824-I828 HydrophobicContact CG-CG1 4.28Å; L824-I828 WeakPolarHBondContact O-CG1 3.48Å; L824-I828 PolarHBondContact O-N 3.3Å; L824-F844 HydrophobicContact CD2-CE1 3.89Å; L824-F844 HydrophobicContact CD2-CZ 4.19Å
825	L	85	Confident	86.4	Confident	51 Å²	51	47.5 Å²	47.5	27%	0.267	25%	0.247	S	C	.	.	H	α-helix	trans	-60.6	-33	177	-72.4	173.7	0	0	0	112.5	P821 Q822 P829 L852	P821-L825 WeakPolarHBondContact O-CG 3.38Å; P821-L825 PolarHBondContact O-N 2.79Å; P821-L825 VanDerWaalsContact O-N 3.13Å; Q822-L825 PolarHBondContact O-N 3.19Å; L825-P829 WeakPolarHBondContact O-CD 3.32Å; L825-L852 WeakPolarHBondContact O-CD1 3.26Å
826	R	84.6	Confident	86.5	Confident	169 Å²	169	49.6 Å²	49.6	64%	0.638	25%	0.252	S	S	*	.	H	α-helix	trans	-74.3	-27.3	173.9	-67.8	178.1	-176.3	172.5	3.5	113.1	P797 Q822 Q823 L824 H830	P797-R826 HydrophobicContact CG-CB 4.24Å; Q822-R826 PolarHBondContact O-N 3.14Å; Q823-R826 PolarHBondContact O-N 3.3Å; L824-R826 PolarHBondContact O-N 3.47Å; R826-H830 PolarHBondContact O-CD2 3.31Å; R826-H830 VanDerWaalsContact O-CD2 3.3Å
827	L	86.8	Confident	86.5	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-82.9	-39.5	-177.8	-177.8	65.4	0	0	0	112.6	W781 P797 L806 L808 L816 Q823 L824 P829 H830 V831	W781-L827 HydrophobicContact CH2-CD2 4.41Å; W781-L827 HydrophobicContact CZ2-CD1 4.21Å; W781-L827 HydrophobicContact CZ2-CD2 4.12Å; P797-L827 HydrophobicContact CB-CD1 3.82Å; L806-L827 HydrophobicContact CD1-CD1 3.96Å; L808-L827 HydrophobicContact CD1-CD2 3.58Å; L808-L827 HydrophobicContact CD1-CG 4.5Å; L816-L827 HydrophobicContact CD1-CD2 4Å; Q823-L827 WeakPolarHBondContact O-CB 3.31Å; Q823-L827 PolarHBondContact O-N 3.09Å; L824-L827 PolarHBondContact O-N 2.93Å; L827-P829 VanDerWaalsContact C-CD 3.5Å; L827-H830 WeakPolarHBondContact O-CA 3.42Å; L827-H830 WeakPolarHBondContact O-CB 3.5Å; L827-H830 PolarHBondContact O-N 2.9Å; L827-V831 HydrophobicContact CD1-CG2 4.5Å; L827-V831 HydrophobicContact CG-CG2 4.07Å; L827-V831 PolarHBondContact O-N 3.47Å
828	I	89.9	Confident	86.4	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.015	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-49.4	-46.8	-175.2	-75.7	167.5	0	0	0	113.1	L824 H830 V831 F834 F844 L849	L824-I828 HydrophobicContact CD1-CD1 4.05Å; L824-I828 HydrophobicContact CD1-CG1 3.9Å; L824-I828 HydrophobicContact CG-CD1 3.92Å; L824-I828 HydrophobicContact CG-CG1 4.28Å; L824-I828 WeakPolarHBondContact O-CG1 3.48Å; L824-I828 PolarHBondContact O-N 3.3Å; I828-H830 PolarHBondContact O-N 3.29Å; I828-V831 PolarHBondContact O-N 2.95Å; I828-F834 HydrophobicContact CG2-CZ 4.33Å; I828-F844 HydrophobicContact CD1-CE1 4.22Å; I828-L849 HydrophobicContact CG2-CD2 3.73Å; I828-L849 HydrophobicContact CG2-CG 3.83Å
829	P	87.9	Confident	86.2	Confident	13 Å²	13	47.1 Å²	47.1	8%	0.084	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-65.7	-6.1	178.5	-22.5	34.2	0	0	0	114.6	R739 L825 L827 L852 Y854	R739-P829 PolarHBondContact NH1-O 3Å; R739-P829 PolarHBondContact NH2-O 3.46Å; L825-P829 WeakPolarHBondContact O-CD 3.32Å; L827-P829 VanDerWaalsContact C-CD 3.5Å; P829-L852 HydrophobicContact CG-CD1 3.42Å; P829-L852 VanDerWaalsContact CG-CD1 3.42Å; P829-Y854 HydrophobicContact CB-CE2 3.83Å; P829-Y854 HydrophobicContact CG-CE2 3.86Å
830	H	87.9	Confident	86.1	Confident	41 Å²	41	49.4 Å²	49.4	19%	0.19	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-109.5	-12.7	-179	-66.3	-62.5	0	0	0	113.4	R739 K798 A801 L806 R826 L827 I828	R739-H830 VanDerWaalsContact NH2-CA 3.27Å; R739-H830 PolarHBondContact NH2-O 2.97Å; K798-H830 WeakPolarHBondContact CG-NE2 3.34Å; A801-H830 HydrophobicContact CB-CB 3.61Å; L806-H830 HydrophobicContact CD1-CB 4.43Å; R826-H830 PolarHBondContact O-CD2 3.31Å; R826-H830 VanDerWaalsContact O-CD2 3.3Å; L827-H830 WeakPolarHBondContact O-CA 3.42Å; L827-H830 WeakPolarHBondContact O-CB 3.5Å; L827-H830 PolarHBondContact O-N 2.9Å; I828-H830 PolarHBondContact O-N 3.29Å
831	V	89.9	Confident	86.4	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	24%	0.235	C	C	.	.			trans	-75.6	139.3	176.7	179.3	0	0	0	0	111.3	R739 L806 L808 L827 I828 V833 F834	R739-V831 PolarHBondContact NH2-O 2.92Å; L806-V831 HydrophobicContact CB-CG2 4.38Å; L806-V831 WeakPolarHBondContact O-CG1 2.9Å; L808-V831 HydrophobicContact CB-CG1 3.94Å; L808-V831 HydrophobicContact CB-CG2 4.27Å; L808-V831 HydrophobicContact CD1-CG2 4.4Å; L827-V831 HydrophobicContact CD1-CG2 4.5Å; L827-V831 HydrophobicContact CG-CG2 4.07Å; L827-V831 PolarHBondContact O-N 3.47Å; I828-V831 PolarHBondContact O-N 2.95Å; V831-V833 VanDerWaalsContact CG1-O 3.26Å; V831-V833 WeakPolarHBondContact CG1-O 3.32Å; V831-F834 HydrophobicContact CB-CE1 4.15Å; V831-F834 HydrophobicContact CB-CE2 3.84Å; V831-F834 HydrophobicContact CB-CZ 3.56Å; V831-F834 HydrophobicContact CG1-CD1 4.16Å; V831-F834 HydrophobicContact CG1-CD2 3.93Å; V831-F834 HydrophobicContact CG1-CE1 3.85Å; V831-F834 HydrophobicContact CG1-CE2 3.61Å; V831-F834 HydrophobicContact CG1-CG 4.21Å; V831-F834 HydrophobicContact CG1-CZ 3.57Å; V831-F834 HydrophobicContact CG2-CE1 4.45Å; V831-F834 HydrophobicContact CG2-CZ 4.21Å
832	Q	90.4	Very high	86.7	Confident	30 Å²	30	45 Å²	45	14%	0.14	21%	0.213	C	C	.	.	S	Bend	trans	-101.2	-32.9	174.1	-67.5	109.4	-13.3	0	0	112.9	V741 M742 A805 L806	V741-Q832 WeakPolarHBondContact CA-O 3.31Å; V741-Q832 WeakPolarHBondContact CG1-O 3.2Å; M742-Q832 PolarHBondContact N-O 3.41Å; A805-Q832 VanDerWaalsContact CA-OE1 3.22Å; L806-Q832 PolarHBondContact O-N 3.16Å; L806-Q832 VanDerWaalsContact O-N 3.11Å
833	V	92.9	Very high	86.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.4	-176.1	-177.4	0	0	0	0	109.7	M742 A751 A755 I761 L806 C807 L808 V831 A835	M742-V833 HydrophobicContact CB-CG1 4.5Å; M742-V833 HydrophobicContact CB-CG2 4.44Å; A751-V833 HydrophobicContact CB-CG1 3.8Å; A755-V833 HydrophobicContact CB-CG2 3.84Å; I761-V833 HydrophobicContact CD1-CG2 4.33Å; L806-V833 PolarHBondContact O-N 3.28Å; C807-V833 CarbonylContact C-O 3.46Å; C807-V833 VanDerWaalsContact CA-O 3.25Å; C807-V833 WeakPolarHBondContact CA-O 3.3Å; C807-V833 HydrophobicContact CB-CB 4.25Å; L808-V833 PolarHBondContact N-O 3.17Å; V831-V833 VanDerWaalsContact CG1-O 3.26Å; V831-V833 WeakPolarHBondContact CG1-O 3.32Å; V833-A835 HydrophobicContact CG1-CB 4.46Å
834	F	93.7	Very high	87.2	Confident	2 Å²	2	41 Å²	41	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.9	167	-64.1	-93	0	0	0	107.7	V741 M742 I743 T744 L808 I828 V831 V837 V845	V741-F834 HydrophobicContact CG1-CD2 3.77Å; V741-F834 HydrophobicContact CG1-CE2 3.77Å; M742-F834 PolarHBondContact O-N 3.32Å; I743-F834 HydrophobicContact CG1-CB 4.41Å; I743-F834 HydrophobicContact CG1-CD2 4.06Å; I743-F834 HydrophobicContact CG2-CB 4.27Å; T744-F834 PolarHBondContact N-O 3.41Å; L808-F834 HydrophobicContact CB-CD1 4.01Å; L808-F834 HydrophobicContact CB-CE1 4.18Å; L808-F834 HydrophobicContact CD2-CD1 4.04Å; L808-F834 HydrophobicContact CD2-CE1 4.02Å; L808-F834 WeakPolarHBondContact O-CA 3.4Å; I828-F834 HydrophobicContact CG2-CZ 4.33Å; V831-F834 HydrophobicContact CB-CE1 4.15Å; V831-F834 HydrophobicContact CB-CE2 3.84Å; V831-F834 HydrophobicContact CB-CZ 3.56Å; V831-F834 HydrophobicContact CG1-CD1 4.16Å; V831-F834 HydrophobicContact CG1-CD2 3.93Å; V831-F834 HydrophobicContact CG1-CE1 3.85Å; V831-F834 HydrophobicContact CG1-CE2 3.61Å; V831-F834 HydrophobicContact CG1-CG 4.21Å; V831-F834 HydrophobicContact CG1-CZ 3.57Å; V831-F834 HydrophobicContact CG2-CE1 4.45Å; V831-F834 HydrophobicContact CG2-CZ 4.21Å; F834-V837 HydrophobicContact CB-CG1 4.03Å; F834-V845 HydrophobicContact CD1-CG2 4Å; F834-V845 HydrophobicContact CD2-CG1 4.23Å; F834-V845 HydrophobicContact CE1-CG1 4.25Å; F834-V845 HydrophobicContact CE1-CG2 3.97Å; F834-V845 HydrophobicContact CE2-CG1 3.86Å; F834-V845 HydrophobicContact CG-CG2 4.46Å; F834-V845 HydrophobicContact CZ-CG1 3.86Å; F834-V845 HydrophobicContact CZ-CG2 4.41Å
835	A	89.6	Confident	87.6	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	157.6	-174.9	0	0	0	0	0	111.3	T744 P748 A751 L808 T809 G810 V833 V837	T744-A835 CarbonylContact O-C 3.47Å; T744-A835 WeakPolarHBondContact O-CA 3.35Å; P748-A835 VanDerWaalsContact CA-CB 3.49Å; P748-A835 HydrophobicContact CB-CB 3.85Å; A751-A835 HydrophobicContact CB-CB 4.15Å; L808-A835 PolarHBondContact O-N 3.27Å; T809-A835 CarbonylContact C-O 3.55Å; T809-A835 VanDerWaalsContact CA-O 3.32Å; T809-A835 WeakPolarHBondContact CA-O 3.42Å; G810-A835 PolarHBondContact N-O 3.43Å; V833-A835 HydrophobicContact CG1-CB 4.46Å; A835-V837 PolarHBondContact O-N 3.03Å; A835-V837 VanDerWaalsContact O-N 3.16Å
836	R	85.6	Confident	87.9	Confident	112 Å²	112	38.5 Å²	38.5	42%	0.423	18%	0.181	S	C	.	.	S	Bend	trans	52.6	30.6	-176.1	-77.2	-79.5	-164.8	170.9	-0.2	113.2	T744 D746	T744-R836 PolarHBondContact O-N 2.92Å; D746-R836 PolarHBondContact O-N 3.1Å
837	V	85.9	Confident	88.1	Confident	9 Å²	9	31.3 Å²	31.3	6%	0.055	16%	0.156	C	C	.	.			trans	-86.7	139.2	-178.9	-65.6	0	0	0	0	112.4	I743 T744 F834 A835 Q841 K842	I743-V837 HydrophobicContact CG2-CG2 3.69Å; T744-V837 WeakPolarHBondContact O-CG2 3.42Å; T744-V837 PolarHBondContact O-N 3.34Å; F834-V837 HydrophobicContact CB-CG1 4.03Å; A835-V837 PolarHBondContact O-N 3.03Å; A835-V837 VanDerWaalsContact O-N 3.16Å; V837-Q841 HydrophobicContact CB-CB 4.15Å; V837-K842 HydrophobicContact CG2-CG 3.82Å
838	A	82.1	Confident	88.3	Confident	47 Å²	47	31 Å²	31	39%	0.388	15%	0.154	S	C	.	.			trans	-76.8	159	172.5	0	0	0	0	0	111.7	K840 Q841 K842	A838-K840 VanDerWaalsContact C-N 3.35Å; A838-K840 PolarHBondContact O-N 2.82Å; A838-Q841 HydrophobicContact CB-CG 4.27Å; A838-Q841 WeakPolarHBondContact O-CA 3.43Å; A838-Q841 VanDerWaalsContact O-CB 3.31Å; A838-Q841 WeakPolarHBondContact O-CB 3.38Å; A838-Q841 PolarHBondContact O-N 3.14Å; A838-K842 PolarHBondContact O-N 3.35Å
839	P	80.2	Confident	88.4	Confident	72 Å²	72	31 Å²	31	47%	0.468	15%	0.154	S	C	.	.	H	α-helix	trans	-52.1	-45.7	179.5	-29	35.4	0	0	0	114.4	Q841 K842 E843 N864	P839-Q841 PolarHBondContact O-N 3.45Å; P839-K842 WeakPolarHBondContact O-CB 3.38Å; P839-K842 PolarHBondContact O-N 3.29Å; P839-K842 VanDerWaalsContact O-N 3.12Å; P839-E843 PolarHBondContact O-N 3.31Å; P839-N864 HydrophobicContact CB-CB 4.43Å; P839-N864 WeakPolarHBondContact CB-O 3.33Å; P839-N864 HydrophobicContact CG-CB 3.93Å
840	K	80.9	Confident	88.4	Confident	151 Å²	151	33.7 Å²	33.7	66%	0.657	17%	0.165	S	C	*	.	H	α-helix	trans	-62.8	-30.2	175.9	-71	-170.7	173.8	-172.2	0	112.9	E45 A838 F844	E45-K840 IonicContact OE1-NZ 2.81Å; E45-K840 PolarHBondContact OE1-NZ 3.38Å; A838-K840 VanDerWaalsContact C-N 3.35Å; A838-K840 PolarHBondContact O-N 2.82Å; K840-F844 PolarHBondContact O-N 3.02Å; K840-F844 VanDerWaalsContact O-N 3.14Å
841	Q	87.4	Confident	88.3	Confident	35 Å²	35	38.5 Å²	38.5	16%	0.164	19%	0.187	C	C	.	.	H	α-helix	trans	-74.5	-33.5	175.9	-66.7	179.1	-36.5	0	0	111.5	G810 L813 V837 A838 P839 E843 F844 V845	G810-Q841 PolarHBondContact O-NE2 3.47Å; L813-Q841 HydrophobicContact CD2-CB 3.83Å; L813-Q841 HydrophobicContact CD2-CG 4.04Å; V837-Q841 HydrophobicContact CB-CB 4.15Å; A838-Q841 HydrophobicContact CB-CG 4.27Å; A838-Q841 WeakPolarHBondContact O-CA 3.43Å; A838-Q841 VanDerWaalsContact O-CB 3.31Å; A838-Q841 WeakPolarHBondContact O-CB 3.38Å; A838-Q841 PolarHBondContact O-N 3.14Å; P839-Q841 PolarHBondContact O-N 3.45Å; Q841-E843 VanDerWaalsContact C-N 3.32Å; Q841-E843 PolarHBondContact O-N 3.07Å; Q841-F844 PolarHBondContact O-N 2.81Å; Q841-V845 WeakPolarHBondContact O-CG2 3.48Å; Q841-V845 PolarHBondContact O-N 3.05Å
842	K	89	Confident	88.2	Confident	2 Å²	2	42 Å²	42	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-47.3	172.4	-61.1	-166.9	164.7	-176.2	0	110.7	D530 I743 V837 A838 P839 F844 V845 I846 N864 D865 A868	D530-K842 IonicContact OD1-NZ 3.56Å; D530-K842 PolarHBondContact OD1-NZ 3.04Å; D530-K842 IonicContact OD2-NZ 3.53Å; D530-K842 PolarHBondContact OD2-NZ 3.41Å; I743-K842 HydrophobicContact CG2-CB 4.16Å; I743-K842 HydrophobicContact CG2-CD 4.21Å; I743-K842 HydrophobicContact CG2-CG 3.72Å; V837-K842 HydrophobicContact CG2-CG 3.82Å; A838-K842 PolarHBondContact O-N 3.35Å; P839-K842 WeakPolarHBondContact O-CB 3.38Å; P839-K842 PolarHBondContact O-N 3.29Å; P839-K842 VanDerWaalsContact O-N 3.12Å; K842-F844 PolarHBondContact O-N 3.27Å; K842-V845 PolarHBondContact O-N 2.9Å; K842-I846 PolarHBondContact O-N 2.93Å; K842-N864 PolarHBondContact NZ-ND2 3.48Å; K842-D865 WeakPolarHBondContact CD-OD1 3.47Å; K842-D865 WeakPolarHBondContact CE-OD1 3.21Å; K842-D865 IonicContact NZ-OD1 3.72Å; K842-D865 PolarHBondContact NZ-OD1 2.86Å; K842-D865 IonicContact NZ-OD2 2.77Å; K842-A868 HydrophobicContact CB-CB 4.02Å
843	E	88.1	Confident	88.1	Confident	61 Å²	61	43.5 Å²	43.5	29%	0.285	23%	0.229	S	C	.	.	H	α-helix	trans	-57.4	-49	174.9	-177.1	-174.6	153.1	0	0	111.8	P839 Q841 V845 I846 T847 H871	P839-E843 PolarHBondContact O-N 3.31Å; Q841-E843 VanDerWaalsContact C-N 3.32Å; Q841-E843 PolarHBondContact O-N 3.07Å; E843-V845 VanDerWaalsContact C-N 3.32Å; E843-V845 PolarHBondContact O-N 3.42Å; E843-I846 PolarHBondContact O-N 3.43Å; E843-T847 HydrophobicContact CG-CG2 4.38Å; E843-T847 WeakPolarHBondContact O-CG2 3.47Å; E843-T847 PolarHBondContact O-N 3Å; E843-T847 PolarHBondContact O-OG1 2.86Å; E843-H871 IonicContact OE1-CD2 3.78Å; E843-H871 PolarHBondContact OE1-CD2 3.21Å; E843-H871 IonicContact OE1-NE2 3.57Å
844	F	89.3	Confident	87.9	Confident	53 Å²	53	45.9 Å²	45.9	23%	0.232	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-39	179.3	175.7	-100.4	0	0	0	113.5	L813 L824 I828 K840 Q841 K842 T847 S848	L813-F844 HydrophobicContact CD1-CE1 4.31Å; L813-F844 HydrophobicContact CD2-CD1 4.35Å; L824-F844 HydrophobicContact CD2-CE1 3.89Å; L824-F844 HydrophobicContact CD2-CZ 4.19Å; I828-F844 HydrophobicContact CD1-CE1 4.22Å; K840-F844 PolarHBondContact O-N 3.02Å; K840-F844 VanDerWaalsContact O-N 3.14Å; Q841-F844 PolarHBondContact O-N 2.81Å; K842-F844 PolarHBondContact O-N 3.27Å; F844-T847 WeakPolarHBondContact CA-OG1 3.47Å; F844-T847 PolarHBondContact O-OG1 3.22Å; F844-T847 VanDerWaalsContact O-OG1 3.06Å; F844-S848 WeakPolarHBondContact CZ-OG 3.43Å; F844-S848 VanDerWaalsContact O-CB 3.23Å; F844-S848 WeakPolarHBondContact O-CB 3.45Å; F844-S848 PolarHBondContact O-N 3.34Å; F844-S848 PolarHBondContact O-OG 3.01Å
845	V	91.6	Very high	87.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.5	-44.3	177.3	172	0	0	0	0	110.8	I743 L813 F834 Q841 K842 E843 L849	I743-V845 HydrophobicContact CD1-CB 4.36Å; I743-V845 HydrophobicContact CD1-CG1 3.81Å; L813-V845 HydrophobicContact CD2-CG2 4.26Å; F834-V845 HydrophobicContact CD1-CG2 4Å; F834-V845 HydrophobicContact CD2-CG1 4.23Å; F834-V845 HydrophobicContact CE1-CG1 4.25Å; F834-V845 HydrophobicContact CE1-CG2 3.97Å; F834-V845 HydrophobicContact CE2-CG1 3.86Å; F834-V845 HydrophobicContact CG-CG2 4.46Å; F834-V845 HydrophobicContact CZ-CG1 3.86Å; F834-V845 HydrophobicContact CZ-CG2 4.41Å; Q841-V845 WeakPolarHBondContact O-CG2 3.48Å; Q841-V845 PolarHBondContact O-N 3.05Å; K842-V845 PolarHBondContact O-N 2.9Å; E843-V845 VanDerWaalsContact C-N 3.32Å; E843-V845 PolarHBondContact O-N 3.42Å; V845-L849 HydrophobicContact CG1-CD1 4.3Å; V845-L849 WeakPolarHBondContact O-CG 3.46Å; V845-L849 PolarHBondContact O-N 3.48Å
846	I	92.1	Very high	87.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.6	-46.1	178.6	-63.9	-60.7	0	0	0	111.3	C528 I743 K842 E843 S848 L849 K850 M858 A868 A872	C528-I846 HydrophobicContact CB-CD1 3.87Å; C528-I846 VanDerWaalsContact SG-CD1 3.59Å; I743-I846 HydrophobicContact CD1-CD1 4.07Å; K842-I846 PolarHBondContact O-N 2.93Å; E843-I846 PolarHBondContact O-N 3.43Å; I846-S848 VanDerWaalsContact C-N 3.35Å; I846-S848 PolarHBondContact O-N 3.01Å; I846-L849 PolarHBondContact O-N 2.82Å; I846-K850 HydrophobicContact CG2-CD 4.34Å; I846-K850 WeakPolarHBondContact O-CG 3.45Å; I846-K850 PolarHBondContact O-N 2.95Å; I846-K850 VanDerWaalsContact O-N 3.1Å; I846-M858 HydrophobicContact CD1-CB 4.38Å; I846-M858 HydrophobicContact CD1-SD 4.48Å; I846-A868 HydrophobicContact CG1-CB 4Å; I846-A872 HydrophobicContact CG2-CB 4.03Å
847	T	89.4	Confident	88.4	Confident	17 Å²	17	41.8 Å²	41.8	10%	0.104	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-40.1	179	55	0	0	0	0	111.6	E843 F844 L849 K850 E851 H871	E843-T847 HydrophobicContact CG-CG2 4.38Å; E843-T847 WeakPolarHBondContact O-CG2 3.47Å; E843-T847 PolarHBondContact O-N 3Å; E843-T847 PolarHBondContact O-OG1 2.86Å; F844-T847 WeakPolarHBondContact CA-OG1 3.47Å; F844-T847 PolarHBondContact O-OG1 3.22Å; F844-T847 VanDerWaalsContact O-OG1 3.06Å; T847-L849 PolarHBondContact O-N 3.18Å; T847-K850 WeakPolarHBondContact O-CB 3.5Å; T847-K850 PolarHBondContact O-N 2.92Å; T847-E851 WeakPolarHBondContact O-CG 3.39Å; T847-E851 PolarHBondContact O-N 3.41Å; T847-H871 HydrophobicContact CG2-CB 3.99Å
848	S	90.5	Very high	88.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-42.3	175.3	-61.9	0	0	0	0	112.5	F844 I846 K850 E851 L852	F844-S848 WeakPolarHBondContact CZ-OG 3.43Å; F844-S848 VanDerWaalsContact O-CB 3.23Å; F844-S848 WeakPolarHBondContact O-CB 3.45Å; F844-S848 PolarHBondContact O-N 3.34Å; F844-S848 PolarHBondContact O-OG 3.01Å; I846-S848 VanDerWaalsContact C-N 3.35Å; I846-S848 PolarHBondContact O-N 3.01Å; S848-K850 VanDerWaalsContact C-N 3.3Å; S848-K850 PolarHBondContact O-N 3.4Å; S848-E851 PolarHBondContact O-N 3.44Å; S848-L852 WeakPolarHBondContact O-CD1 3.28Å; S848-L852 VanDerWaalsContact O-CG 3.27Å; S848-L852 WeakPolarHBondContact O-CG 3.46Å; S848-L852 PolarHBondContact O-N 2.98Å; S848-L852 VanDerWaalsContact O-N 3.15Å
849	L	91	Very high	89.4	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-39.8	175.5	-76.2	169.3	0	0	0	111.7	V526 I828 V845 I846 T847 L852 G853 Y854 T856	V526-L849 HydrophobicContact CG1-CD1 4.32Å; I828-L849 HydrophobicContact CG2-CD2 3.73Å; I828-L849 HydrophobicContact CG2-CG 3.83Å; V845-L849 HydrophobicContact CG1-CD1 4.3Å; V845-L849 WeakPolarHBondContact O-CG 3.46Å; V845-L849 PolarHBondContact O-N 3.48Å; I846-L849 PolarHBondContact O-N 2.82Å; T847-L849 PolarHBondContact O-N 3.18Å; L849-L852 PolarHBondContact O-N 3.35Å; L849-G853 PolarHBondContact O-N 3.49Å; L849-Y854 HydrophobicContact CD2-CD2 4.3Å; L849-Y854 WeakPolarHBondContact O-CB 3.3Å; L849-Y854 WeakPolarHBondContact O-CD2 3.41Å; L849-Y854 PolarHBondContact O-N 3.24Å; L849-Y854 VanDerWaalsContact O-N 3.14Å; L849-T856 HydrophobicContact CB-CG2 3.56Å; L849-T856 HydrophobicContact CD1-CG2 4.16Å
850	K	88.1	Confident	89.8	Confident	69 Å²	69	35.7 Å²	35.7	30%	0.3	18%	0.182	S	C	.	.	H	α-helix	trans	-67.5	-41.7	176.2	-72.3	179.1	53.9	146.8	0	112.9	I846 T847 S848 L852 G853 T856 H871 D873	I846-K850 HydrophobicContact CG2-CD 4.34Å; I846-K850 WeakPolarHBondContact O-CG 3.45Å; I846-K850 PolarHBondContact O-N 2.95Å; I846-K850 VanDerWaalsContact O-N 3.1Å; T847-K850 WeakPolarHBondContact O-CB 3.5Å; T847-K850 PolarHBondContact O-N 2.92Å; S848-K850 VanDerWaalsContact C-N 3.3Å; S848-K850 PolarHBondContact O-N 3.4Å; K850-L852 PolarHBondContact O-N 3.48Å; K850-G853 WeakPolarHBondContact O-CA 3.29Å; K850-G853 PolarHBondContact O-N 3.33Å; K850-T856 HydrophobicContact CG-CG2 4.07Å; K850-T856 WeakPolarHBondContact CG-OG1 3.17Å; K850-H871 WeakPolarHBondContact CD-O 3.46Å; K850-H871 WeakPolarHBondContact CE-O 3.35Å; K850-H871 PolarHBondContact NZ-O 3.15Å; K850-D873 WeakPolarHBondContact CE-OD1 3.42Å; K850-D873 IonicContact NZ-OD1 2.99Å; K850-D873 PolarHBondContact NZ-OD1 3.37Å
851	E	86.4	Confident	89.8	Confident	143 Å²	143	29.6 Å²	29.6	67%	0.668	16%	0.157	S	C	*	.	H	α-helix	trans	-60.8	-30.4	175.8	-75.5	179	-177.2	0	0	112.2	T847 S848 G853	T847-E851 WeakPolarHBondContact O-CG 3.39Å; T847-E851 PolarHBondContact O-N 3.41Å; S848-E851 PolarHBondContact O-N 3.44Å; E851-G853 PolarHBondContact O-N 3.47Å
852	L	88.5	Confident	89.1	Confident	74 Å²	74	28.5 Å²	28.5	39%	0.387	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.8	174.3	-65.4	167.1	0	0	0	113.6	L825 P829 S848 L849 K850 Y854	L825-L852 WeakPolarHBondContact O-CD1 3.26Å; P829-L852 HydrophobicContact CG-CD1 3.42Å; P829-L852 VanDerWaalsContact CG-CD1 3.42Å; S848-L852 WeakPolarHBondContact O-CD1 3.28Å; S848-L852 VanDerWaalsContact O-CG 3.27Å; S848-L852 WeakPolarHBondContact O-CG 3.46Å; S848-L852 PolarHBondContact O-N 2.98Å; S848-L852 VanDerWaalsContact O-N 3.15Å; L849-L852 PolarHBondContact O-N 3.35Å; K850-L852 PolarHBondContact O-N 3.48Å; L852-Y854 HydrophobicContact CB-CD2 3.88Å; L852-Y854 HydrophobicContact CB-CE2 3.97Å
853	G	86.7	Confident	88	Confident	61 Å²	61	30.3 Å²	30.3	63%	0.629	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.8	6.5	176	0	0	0	0	0	115.3	L849 K850 E851	L849-G853 PolarHBondContact O-N 3.49Å; K850-G853 WeakPolarHBondContact O-CA 3.29Å; K850-G853 PolarHBondContact O-N 3.33Å; E851-G853 PolarHBondContact O-N 3.47Å
854	Y	89.7	Confident	87.4	Confident	50 Å²	50	30 Å²	30	20%	0.196	17%	0.167	C	C	.	.			trans	-80.4	138.9	175.9	-63.7	-79.8	0	0	0	111.3	E525 V526 P829 L849 L852	E525-Y854 WeakPolarHBondContact OE2-CD1 3.49Å; V526-Y854 HydrophobicContact CG2-CD1 4.19Å; V526-Y854 HydrophobicContact CG2-CG 4.34Å; P829-Y854 HydrophobicContact CB-CE2 3.83Å; P829-Y854 HydrophobicContact CG-CE2 3.86Å; L849-Y854 HydrophobicContact CD2-CD2 4.3Å; L849-Y854 WeakPolarHBondContact O-CB 3.3Å; L849-Y854 WeakPolarHBondContact O-CD2 3.41Å; L849-Y854 PolarHBondContact O-N 3.24Å; L849-Y854 VanDerWaalsContact O-N 3.14Å; L852-Y854 HydrophobicContact CB-CD2 3.88Å; L852-Y854 HydrophobicContact CB-CE2 3.97Å
855	V	90.3	Very high	87	Confident	28 Å²	28	27.5 Å²	27.5	17%	0.17	16%	0.155	C	C	.	.			trans	-83.7	119.4	169.5	-174.7	0	0	0	0	109	K523 V524 E525 V526 D873	K523-V855 HydrophobicContact CB-CG1 4.33Å; K523-V855 HydrophobicContact CB-CG2 4.17Å; K523-V855 WeakPolarHBondContact O-CB 3.35Å; V524-V855 HydrophobicContact CG2-CG1 4.22Å; E525-V855 HydrophobicContact CG-CB 4.37Å; E525-V855 PolarHBondContact N-O 3.33Å; V526-V855 PolarHBondContact N-O 2.98Å; V855-D873 WeakPolarHBondContact CA-OD2 3.29Å; V855-D873 HydrophobicContact CG1-CB 3.92Å
856	T	93.9	Very high	86.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.2	-170.2	55.5	0	0	0	0	112.4	L849 K850 D873 V874	L849-T856 HydrophobicContact CB-CG2 3.56Å; L849-T856 HydrophobicContact CD1-CG2 4.16Å; K850-T856 HydrophobicContact CG-CG2 4.07Å; K850-T856 WeakPolarHBondContact CG-OG1 3.17Å; T856-D873 PolarHBondContact N-OD2 3.06Å; T856-D873 WeakPolarHBondContact O-CB 3.27Å; T856-D873 PolarHBondContact O-N 2.98Å; T856-D873 VanDerWaalsContact O-N 3.1Å; T856-D873 PolarHBondContact OG1-OD2 3.5Å; T856-V874 PolarHBondContact O-N 3.02Å; T856-V874 VanDerWaalsContact O-N 3.13Å
857	L	95.6	Very high	85.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.1	166.8	-178.7	151.4	0	0	0	108.9	V524 V526 C527 C528 C859 V874 I967 I971	V524-L857 HydrophobicContact CG1-CB 3.61Å; V524-L857 HydrophobicContact CG1-CD1 4.43Å; V524-L857 HydrophobicContact CG2-CB 4.03Å; V524-L857 HydrophobicContact CG2-CD1 4.29Å; V526-L857 PolarHBondContact O-N 3.5Å; C527-L857 HydrophobicContact CB-CD2 4.43Å; C528-L857 WeakPolarHBondContact CB-O 3.31Å; C528-L857 PolarHBondContact N-O 2.91Å; L857-C859 HydrophobicContact CD2-CB 4.47Å; L857-V874 CarbonylContact C-O 3.59Å; L857-V874 WeakPolarHBondContact CA-O 3.43Å; L857-V874 HydrophobicContact CB-CB 4.32Å; L857-V874 HydrophobicContact CD1-CB 4.19Å; L857-V874 HydrophobicContact CD1-CG1 3.8Å; L857-V874 HydrophobicContact CG-CB 4.2Å; L857-V874 HydrophobicContact CG-CG1 4.13Å; L857-I967 HydrophobicContact CD1-CG2 4.01Å; L857-I967 HydrophobicContact CD2-CD1 4.46Å; L857-I967 HydrophobicContact CD2-CG2 4.03Å; L857-I971 HydrophobicContact CD1-CD1 4.4Å; L857-I971 HydrophobicContact CD1-CG1 4.26Å
858	M	94.9	Very high	85.6	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.1	172.6	178.6	61.9	-171.6	0	0	109.3	C528 D530 I846 D865 A868 L869 A872 V874 G875 V876	C528-M858 HydrophobicContact CB-SD 3.7Å; C528-M858 CarbonylContact O-C 3.47Å; C528-M858 WeakPolarHBondContact O-CA 3.23Å; D530-M858 HydrophobicContact CB-CE 4.4Å; I846-M858 HydrophobicContact CD1-CB 4.38Å; I846-M858 HydrophobicContact CD1-SD 4.48Å; M858-D865 HydrophobicContact CE-CB 4.19Å; M858-D865 WeakPolarHBondContact CE-OD1 3.36Å; M858-A868 HydrophobicContact CG-CB 4.08Å; M858-L869 HydrophobicContact CB-CD2 4.22Å; M858-L869 HydrophobicContact CG-CD2 3.87Å; M858-L869 HydrophobicContact CG-CG 4.2Å; M858-L869 VanDerWaalsContact O-CD2 3.3Å; M858-L869 WeakPolarHBondContact O-CD2 3.33Å; M858-A872 HydrophobicContact CB-CB 3.77Å; M858-V874 PolarHBondContact N-O 3.42Å; M858-G875 WeakPolarHBondContact O-CA 3.29Å; M858-V876 PolarHBondContact O-N 3.44Å
859	C	93.9	Very high	85.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.5	169.9	-173.2	0	0	0	0	110.7	C528 F529 D530 L857 V876 I967	C528-C859 PolarHBondContact O-N 3.05Å; F529-C859 HydrophobicContact CD1-CB 4.16Å; F529-C859 HydrophobicContact CE1-CB 4.43Å; D530-C859 PolarHBondContact N-O 3.36Å; L857-C859 HydrophobicContact CD2-CB 4.47Å; C859-V876 VanDerWaalsContact CA-O 3.31Å; C859-V876 WeakPolarHBondContact CA-O 3.43Å; C859-V876 HydrophobicContact CB-CB 4.45Å; C859-I967 HydrophobicContact CB-CD1 3.54Å; C859-I967 HydrophobicContact CB-CG1 4.31Å
860	G	89.1	Confident	85.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	164.1	-178.5	0	0	0	0	0	110.9	T534 D865 V876 A877 L878	T534-G860 WeakPolarHBondContact OG1-CA 3.38Å; G860-D865 WeakPolarHBondContact CA-OD2 3.45Å; G860-V876 PolarHBondContact N-O 3Å; G860-A877 VanDerWaalsContact O-CA 3.3Å; G860-A877 WeakPolarHBondContact O-CA 3.26Å; G860-L878 PolarHBondContact O-N 3.5Å
861	D	81.1	Confident	85	Confident	24 Å²	24	26.8 Å²	26.8	13%	0.128	16%	0.159	C	C	.	.			trans	-120.7	-25	178.8	61.9	-67.2	0	0	0	112.2	G533 T534 L878 A951	G533-D861 VanDerWaalsContact C-CG 3.46Å; G533-D861 VanDerWaalsContact C-OD1 3.23Å; G533-D861 WeakPolarHBondContact CA-OD2 3.34Å; T534-D861 PolarHBondContact N-OD1 3.48Å; T534-D861 PolarHBondContact OG1-N 3.46Å; T534-D861 PolarHBondContact OG1-OD1 3.47Å; D861-L878 HydrophobicContact CB-CB 4.14Å; D861-A951 WeakPolarHBondContact O-CB 3.35Å
862	G	71.3	Confident	85.1	Confident	11 Å²	11	20 Å²	20	11%	0.113	13%	0.127	C	C	.	.	S	Bend	trans	-89.6	164.5	-175.1	0	0	0	0	0	114.9	N864 D865	G862-N864 VanDerWaalsContact C-N 3.28Å; G862-N864 VanDerWaalsContact CA-OD1 3.26Å; G862-N864 WeakPolarHBondContact CA-OD1 3.45Å; G862-N864 PolarHBondContact O-N 3.27Å; G862-D865 WeakPolarHBondContact O-CB 3.24Å; G862-D865 PolarHBondContact O-N 2.92Å
863	T	66.6	Low	85.2	Confident	41 Å²	41	17.8 Å²	17.8	25%	0.252	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-71.5	-23.7	175.1	54.2	0	0	0	0	114	T350 D865 V866 D950	T350-T863 WeakPolarHBondContact CA-OG1 3.49Å; T350-T863 WeakPolarHBondContact O-CB 3.37Å; T350-T863 WeakPolarHBondContact O-CG2 3.46Å; T350-T863 PolarHBondContact O-OG1 2.89Å; T863-D865 PolarHBondContact O-N 3.47Å; T863-D865 VanDerWaalsContact O-N 3.13Å; T863-V866 WeakPolarHBondContact O-CB 3.5Å; T863-V866 WeakPolarHBondContact O-CG2 3.47Å; T863-V866 PolarHBondContact O-N 3.06Å; T863-V866 VanDerWaalsContact O-N 3.14Å; T863-D950 HydrophobicContact CG2-CB 3.92Å
864	N	74.9	Confident	85.5	Confident	54 Å²	54	14.9 Å²	14.9	29%	0.289	9%	0.086	S	C	.	.	G	3₁₀ helix	trans	-56.2	-21.9	169	60.7	-27.6	0	0	0	112.5	D530 P839 K842 G862	D530-N864 PolarHBondContact OD2-ND2 2.99Å; P839-N864 HydrophobicContact CB-CB 4.43Å; P839-N864 WeakPolarHBondContact CB-O 3.33Å; P839-N864 HydrophobicContact CG-CB 3.93Å; K842-N864 PolarHBondContact NZ-ND2 3.48Å; G862-N864 VanDerWaalsContact C-N 3.28Å; G862-N864 VanDerWaalsContact CA-OD1 3.26Å; G862-N864 WeakPolarHBondContact CA-OD1 3.45Å; G862-N864 PolarHBondContact O-N 3.27Å
865	D	82.3	Confident	85.6	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-94.9	-9.3	179.8	-62.2	-42.5	0	0	0	114.3	K842 M858 G860 G862 T863 G867 A868 L869	K842-D865 WeakPolarHBondContact CD-OD1 3.47Å; K842-D865 WeakPolarHBondContact CE-OD1 3.21Å; K842-D865 IonicContact NZ-OD1 3.72Å; K842-D865 PolarHBondContact NZ-OD1 2.86Å; K842-D865 IonicContact NZ-OD2 2.77Å; M858-D865 HydrophobicContact CE-CB 4.19Å; M858-D865 WeakPolarHBondContact CE-OD1 3.36Å; G860-D865 WeakPolarHBondContact CA-OD2 3.45Å; G862-D865 WeakPolarHBondContact O-CB 3.24Å; G862-D865 PolarHBondContact O-N 2.92Å; T863-D865 PolarHBondContact O-N 3.47Å; T863-D865 VanDerWaalsContact O-N 3.13Å; D865-G867 VanDerWaalsContact C-N 3.33Å; D865-G867 PolarHBondContact O-N 2.65Å; D865-A868 CarbonylContact O-C 3.6Å; D865-A868 PolarHBondContact O-N 3.35Å; D865-L869 HydrophobicContact CB-CD1 3.84Å; D865-L869 HydrophobicContact CB-CG 4.05Å; D865-L869 WeakPolarHBondContact O-CB 3.45Å; D865-L869 WeakPolarHBondContact O-CG 3.3Å; D865-L869 PolarHBondContact O-N 3.05Å
866	V	78.2	Confident	85.7	Confident	19 Å²	19	11.2 Å²	11.2	12%	0.115	7%	0.069	C	C	.	.	H	α-helix	trans	-52.6	-46.6	-172.3	160.4	0	0	0	0	112.8	L423 T863 K870 A954	L423-V866 HydrophobicContact CD1-CG1 3.94Å; T863-V866 WeakPolarHBondContact O-CB 3.5Å; T863-V866 WeakPolarHBondContact O-CG2 3.47Å; T863-V866 PolarHBondContact O-N 3.06Å; T863-V866 VanDerWaalsContact O-N 3.14Å; V866-K870 WeakPolarHBondContact O-CB 3.27Å; V866-K870 PolarHBondContact O-N 2.98Å; V866-A954 HydrophobicContact CB-CB 4.27Å; V866-A954 HydrophobicContact CG1-CB 3.62Å; V866-A954 HydrophobicContact CG2-CB 4.21Å
867	G	78.6	Confident	85.4	Confident	22 Å²	22	11.2 Å²	11.2	23%	0.227	7%	0.069	C	C	.	.	H	α-helix	trans	-63.1	-46.9	177.2	0	0	0	0	0	112.1	D865 L869 K870 H871	D865-G867 VanDerWaalsContact C-N 3.33Å; D865-G867 PolarHBondContact O-N 2.65Å; G867-L869 PolarHBondContact O-N 2.91Å; G867-K870 PolarHBondContact O-N 3.37Å; G867-H871 PolarHBondContact O-CD2 3.34Å; G867-H871 PolarHBondContact O-N 3.28Å
868	A	86.8	Confident	85	Confident	1 Å²	1	11.3 Å²	11.3	1%	0.008	7%	0.069	C	C	.	.	H	α-helix	trans	-63.3	-42.6	178.3	0	0	0	0	0	112.5	K842 I846 M858 D865 H871 A872	K842-A868 HydrophobicContact CB-CB 4.02Å; I846-A868 HydrophobicContact CG1-CB 4Å; M858-A868 HydrophobicContact CG-CB 4.08Å; D865-A868 CarbonylContact O-C 3.6Å; D865-A868 PolarHBondContact O-N 3.35Å; A868-H871 PolarHBondContact O-N 3.43Å; A868-A872 WeakPolarHBondContact O-CB 3.3Å; A868-A872 PolarHBondContact O-N 3.18Å
869	L	88	Confident	84.1	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.2	-41.1	177	-74.2	168.4	0	0	0	112	M858 D865 G867 G875 V876 A877 A951 A955	M858-L869 HydrophobicContact CB-CD2 4.22Å; M858-L869 HydrophobicContact CG-CD2 3.87Å; M858-L869 HydrophobicContact CG-CG 4.2Å; M858-L869 VanDerWaalsContact O-CD2 3.3Å; M858-L869 WeakPolarHBondContact O-CD2 3.33Å; D865-L869 HydrophobicContact CB-CD1 3.84Å; D865-L869 HydrophobicContact CB-CG 4.05Å; D865-L869 WeakPolarHBondContact O-CB 3.45Å; D865-L869 WeakPolarHBondContact O-CG 3.3Å; D865-L869 PolarHBondContact O-N 3.05Å; G867-L869 PolarHBondContact O-N 2.91Å; L869-G875 WeakPolarHBondContact O-CA 3.32Å; L869-V876 WeakPolarHBondContact CD2-O 3.49Å; L869-A877 HydrophobicContact CD1-CB 4.45Å; L869-A951 HydrophobicContact CD1-CB 4.18Å; L869-A955 HydrophobicContact CB-CB 4.34Å; L869-A955 HydrophobicContact CD1-CB 4.45Å; L869-A955 HydrophobicContact CD2-CB 4.48Å
870	K	82.9	Confident	82.5	Confident	15 Å²	15	14.4 Å²	14.4	7%	0.065	9%	0.092	C	C	.	.	H	α-helix	trans	-73.4	-38.1	-179.1	-169.7	66.8	179.2	174.7	0	112.4	V431 E514 V866 G867 A954	V431-K870 HydrophobicContact CB-CG 4.37Å; V431-K870 HydrophobicContact CG2-CD 4.37Å; V431-K870 HydrophobicContact CG2-CG 3.62Å; E514-K870 IonicContact OE1-NZ 3.19Å; E514-K870 PolarHBondContact OE1-NZ 3.14Å; V866-K870 WeakPolarHBondContact O-CB 3.27Å; V866-K870 PolarHBondContact O-N 2.98Å; G867-K870 PolarHBondContact O-N 3.37Å; K870-A954 WeakPolarHBondContact CD-O 3.33Å
871	H	84.9	Confident	81.1	Confident	19 Å²	19	19.9 Å²	19.9	9%	0.088	12%	0.121	C	C	.	.	H	α-helix	trans	-81.2	-23	-179.3	-75.2	-60.5	0	0	0	114.2	E843 T847 K850 G867 A868	E843-H871 IonicContact OE1-CD2 3.78Å; E843-H871 PolarHBondContact OE1-CD2 3.21Å; E843-H871 IonicContact OE1-NE2 3.57Å; T847-H871 HydrophobicContact CG2-CB 3.99Å; K850-H871 WeakPolarHBondContact CD-O 3.46Å; K850-H871 WeakPolarHBondContact CE-O 3.35Å; K850-H871 PolarHBondContact NZ-O 3.15Å; G867-H871 PolarHBondContact O-CD2 3.34Å; G867-H871 PolarHBondContact O-N 3.28Å; A868-H871 PolarHBondContact O-N 3.43Å
872	A	89.7	Confident	80.1	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-56.6	152.6	171.2	0	0	0	0	0	111.5	R517 I846 M858 A868 V874	R517-A872 PolarHBondContact NH1-O 3.23Å; I846-A872 HydrophobicContact CG2-CB 4.03Å; M858-A872 HydrophobicContact CB-CB 3.77Å; A868-A872 WeakPolarHBondContact O-CB 3.3Å; A868-A872 PolarHBondContact O-N 3.18Å; A872-V874 VanDerWaalsContact C-N 3.25Å
873	D	89.8	Confident	79.6	Confident	29 Å²	29	22.5 Å²	22.5	16%	0.155	14%	0.139	C	C	.	.	S	Bend	trans	-67.5	-35	173.8	-56.4	-58.6	0	0	0	110.5	R517 K850 V855 T856	R517-D873 PolarHBondContact NH1-O 2.99Å; K850-D873 WeakPolarHBondContact CE-OD1 3.42Å; K850-D873 IonicContact NZ-OD1 2.99Å; K850-D873 PolarHBondContact NZ-OD1 3.37Å; V855-D873 WeakPolarHBondContact CA-OD2 3.29Å; V855-D873 HydrophobicContact CG1-CB 3.92Å; T856-D873 PolarHBondContact N-OD2 3.06Å; T856-D873 WeakPolarHBondContact O-CB 3.27Å; T856-D873 PolarHBondContact O-N 2.98Å; T856-D873 VanDerWaalsContact O-N 3.1Å; T856-D873 PolarHBondContact OG1-OD2 3.5Å
874	V	92.3	Very high	79.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	104.6	172.4	-179.1	0	0	0	0	109.4	F520 A521 V524 T856 L857 M858 A872 V876 F957 V970	F520-V874 HydrophobicContact CB-CG2 4.29Å; A521-V874 HydrophobicContact CB-CG1 4.33Å; A521-V874 HydrophobicContact CB-CG2 4Å; V524-V874 HydrophobicContact CG2-CB 4.41Å; V524-V874 HydrophobicContact CG2-CG2 4.06Å; T856-V874 PolarHBondContact O-N 3.02Å; T856-V874 VanDerWaalsContact O-N 3.13Å; L857-V874 CarbonylContact C-O 3.59Å; L857-V874 WeakPolarHBondContact CA-O 3.43Å; L857-V874 HydrophobicContact CB-CB 4.32Å; L857-V874 HydrophobicContact CD1-CB 4.19Å; L857-V874 HydrophobicContact CD1-CG1 3.8Å; L857-V874 HydrophobicContact CG-CB 4.2Å; L857-V874 HydrophobicContact CG-CG1 4.13Å; M858-V874 PolarHBondContact N-O 3.42Å; A872-V874 VanDerWaalsContact C-N 3.25Å; V874-V876 HydrophobicContact CG1-CG2 4.24Å; V874-F957 HydrophobicContact CG1-CD2 3.8Å; V874-F957 HydrophobicContact CG1-CE2 3.74Å; V874-V970 HydrophobicContact CG1-CG1 4.02Å
875	G	92.3	Very high	78.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.4	171.8	0	0	0	0	0	111.4	M858 L869 P956 F957	M858-G875 WeakPolarHBondContact O-CA 3.29Å; L869-G875 WeakPolarHBondContact O-CA 3.32Å; G875-P956 VanDerWaalsContact O-CD 3.26Å; G875-P956 WeakPolarHBondContact O-CD 3.5Å; G875-P956 WeakPolarHBondContact O-CG 3.45Å; G875-F957 WeakPolarHBondContact O-CB 3.36Å; G875-F957 PolarHBondContact O-N 3.28Å; G875-F957 VanDerWaalsContact O-N 3.08Å
876	V	91.9	Very high	77.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	113.7	178.4	-176.7	0	0	0	0	109.7	M510 M858 C859 G860 L869 V874 F957 I967	M510-V876 HydrophobicContact CE-CG1 4.03Å; M858-V876 PolarHBondContact O-N 3.44Å; C859-V876 VanDerWaalsContact CA-O 3.31Å; C859-V876 WeakPolarHBondContact CA-O 3.43Å; C859-V876 HydrophobicContact CB-CB 4.45Å; G860-V876 PolarHBondContact N-O 3Å; L869-V876 WeakPolarHBondContact CD2-O 3.49Å; V874-V876 HydrophobicContact CG1-CG2 4.24Å; V876-F957 CarbonylContact C-O 3.58Å; V876-F957 WeakPolarHBondContact CA-O 3.29Å; V876-F957 HydrophobicContact CG2-CB 4.15Å; V876-I967 HydrophobicContact CG1-CG1 4.49Å
877	A	89.3	Confident	75.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.5	174.1	0	0	0	0	0	111.9	G860 L869 A951 A955 F957 S959	G860-A877 VanDerWaalsContact O-CA 3.3Å; G860-A877 WeakPolarHBondContact O-CA 3.26Å; L869-A877 HydrophobicContact CD1-CB 4.45Å; A877-A951 HydrophobicContact CB-CB 4.19Å; A877-A951 VanDerWaalsContact CB-O 3.31Å; A877-A951 WeakPolarHBondContact CB-O 3.37Å; A877-A955 HydrophobicContact CB-CB 3.56Å; A877-F957 PolarHBondContact N-O 3.48Å; A877-S959 PolarHBondContact O-N 2.96Å
878	L	86.1	Confident	74	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.4	168.2	-55	178.1	0	0	0	109.3	T534 G860 D861 C966	T534-L878 HydrophobicContact CG2-CD1 4.1Å; G860-L878 PolarHBondContact O-N 3.5Å; D861-L878 HydrophobicContact CB-CB 4.14Å; L878-C966 VanDerWaalsContact CD2-SG 3.5Å
879	L	75.8	Confident	71.6	Confident	19 Å²	19	59.8 Å²	59.8	10%	0.099	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-76.3	128.2	175.2	-71.5	179.1	0	0	0	111.1	A882 V946 T958 S959 K960	L879-A882 HydrophobicContact CB-CB 4.17Å; L879-A882 VanDerWaalsContact O-CB 3.29Å; L879-A882 WeakPolarHBondContact O-CB 3.47Å; L879-A882 PolarHBondContact O-N 2.75Å; L879-V946 HydrophobicContact CD1-CB 4.42Å; L879-V946 HydrophobicContact CD1-CG1 3.72Å; L879-T958 HydrophobicContact CD2-CG2 4.24Å; L879-T958 HydrophobicContact CG-CG2 4.19Å; L879-S959 WeakPolarHBondContact CG-O 3.44Å; L879-S959 PolarHBondContact N-O 3.29Å; L879-K960 HydrophobicContact CD1-CB 4.44Å; L879-K960 HydrophobicContact CD1-CG 4.18Å
880	A	60.8	Low	69	Low	46 Å²	46	70.8 Å²	70.8	38%	0.38	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	139.5	174.3	0	0	0	0	0	111.4	A882	A880-A882 PolarHBondContact O-N 2.93Å; A880-A882 VanDerWaalsContact O-N 3.17Å
881	N	59.9	Low	66.7	Low	114 Å²	114	81.3 Å²	81.3	61%	0.61	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	16.1	-178	-57	-51.9	0	0	0	115.9	S353	S353-N881 VanDerWaalsContact CB-ND2 3.29Å; S353-N881 WeakPolarHBondContact CB-ND2 3.44Å; S353-N881 PolarHBondContact OG-ND2 3.13Å; S353-N881 VanDerWaalsContact OG-ND2 3.12Å
882	A	60.9	Low	64	Low	17 Å²	17	91.4 Å²	91.4	14%	0.14	41%	0.411	C	S	.	.			trans	-68.5	144.9	172.5	0	0	0	0	0	111.5	L879 A880 E884 K960 S962	L879-A882 HydrophobicContact CB-CB 4.17Å; L879-A882 VanDerWaalsContact O-CB 3.29Å; L879-A882 WeakPolarHBondContact O-CB 3.47Å; L879-A882 PolarHBondContact O-N 2.75Å; A880-A882 PolarHBondContact O-N 2.93Å; A880-A882 VanDerWaalsContact O-N 3.17Å; A882-E884 PolarHBondContact O-N 3.17Å; A882-K960 VanDerWaalsContact CB-O 3.24Å; A882-K960 WeakPolarHBondContact CB-O 3.47Å; A882-S962 VanDerWaalsContact O-CB 3.32Å; A882-S962 WeakPolarHBondContact O-CB 3.37Å; A882-S962 PolarHBondContact O-OG 3.36Å
883	P	60	Low	61.3	Low	74 Å²	74	96.8 Å²	96.8	48%	0.481	45%	0.446	S	S	.	.			trans	-63.8	136.6	175.3	27.6	-33.8	0	0	0	110.7	R885	P883-R885 PolarHBondContact O-N 2.84Å
884	E	58.7	Low	58.5	Low	90 Å²	90	107 Å²	107	42%	0.421	48%	0.482	S	S	.	.	S	Bend	trans	-66.3	-28.9	177.4	-69.9	-176.1	174.4	0	0	112.1	A882 S962	A882-E884 PolarHBondContact O-N 3.17Å; E884-S962 WeakPolarHBondContact CA-OG 3.3Å; E884-S962 WeakPolarHBondContact CG-OG 3.09Å; E884-S962 PolarHBondContact N-OG 3Å
885	R	58.6	Low	55.7	Low	207 Å²	207	114.4 Å²	114.4	78%	0.781	52%	0.522	S	S	*	.	S	Bend	trans	-138.3	148.3	175.8	-67.6	-175.4	-178.9	176.8	1.5	110.2	P883 V887	P883-R885 PolarHBondContact O-N 2.84Å; R885-V887 PolarHBondContact O-N 2.87Å
886	I	56.9	Low	52.8	Low	92 Å²	92	121.7 Å²	121.7	47%	0.472	56%	0.561	S	S	.	*			trans	-63.8	119.6	175.4	-57.5	163.6	0	0	0	107.9	Y509 E888 L961	Y509-I886 HydrophobicContact CD2-CD1 4.16Å; Y509-I886 HydrophobicContact CE2-CD1 3.36Å; Y509-I886 HydrophobicContact CE2-CG1 4.38Å; I886-E888 PolarHBondContact O-N 2.99Å; I886-L961 HydrophobicContact CG1-CD2 4.25Å
887	V	45.5	Very low	49.8	Very low	124 Å²	124	130.1 Å²	130.1	75%	0.752	60%	0.6	S	S	*	*			trans	-70.5	101.5	160.7	-179.5	0	0	0	0	105.2	R885 R889	R885-V887 PolarHBondContact O-N 2.87Å; V887-R889 VanDerWaalsContact C-N 3.31Å; V887-R889 PolarHBondContact O-N 3.47Å
888	E	42.2	Very low	47.1	Very low	172 Å²	172	136.1 Å²	136.1	80%	0.804	64%	0.637	S	S	*	*			trans	-55.8	100.7	169.5	-77.4	-176.2	172.7	0	0	107.4	I886 R890	I886-E888 PolarHBondContact O-N 2.99Å; E888-R890 PolarHBondContact O-N 3.44Å
889	R	37.6	Very low	44.5	Very low	235 Å²	235	143.9 Å²	143.9	89%	0.887	68%	0.677	S	S	*	*			trans	-63.1	95.9	163.3	-97.6	-176.6	171.9	178.3	-1.3	105	V887 R891	V887-R889 VanDerWaalsContact C-N 3.31Å; V887-R889 PolarHBondContact O-N 3.47Å; R889-R891 PolarHBondContact O-N 2.97Å
890	R	33	Very low	42.3	Very low	230 Å²	230	147.7 Å²	147.7	87%	0.868	71%	0.705	S	S	*	*			trans	-42.5	110.4	162	-100.6	-178.2	172.7	178.4	-2.4	105.8	E888 R892	E888-R890 PolarHBondContact O-N 3.44Å; R890-R892 PolarHBondContact O-N 3.47Å
891	R	35.1	Very low	40.8	Very low	237 Å²	237	153.1 Å²	153.1	89%	0.894	73%	0.728	S	S	*	*			trans	-49.5	110.9	166.5	-80	178.6	170.4	176.2	-3.5	104.7	R889 P893	R889-R891 PolarHBondContact O-N 2.97Å; R891-P893 WeakPolarHBondContact O-CD 2.98Å; R891-P893 VanDerWaalsContact O-N 3.09Å
892	R	28.4	Very low	39.4	Very low	231 Å²	231	153.2 Å²	153.2	87%	0.872	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-54.8	120.7	171.7	-76.7	-174.9	178	-178.1	-1.3	105.3	R890 R894	R890-R892 PolarHBondContact O-N 3.47Å; R892-R894 PolarHBondContact O-N 2.93Å
893	P	32.3	Very low	37.7	Very low	113 Å²	113	155.9 Å²	155.9	73%	0.734	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-57.1	127.4	168.5	-13.4	27.4	0	0	0	105.7	R891 D895	R891-P893 WeakPolarHBondContact O-CD 2.98Å; R891-P893 VanDerWaalsContact O-N 3.09Å; P893-D895 PolarHBondContact O-N 3Å; P893-D895 VanDerWaalsContact O-N 3.08Å
894	R	31.8	Very low	36.4	Very low	244 Å²	244	158.3 Å²	158.3	92%	0.921	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.1	118.2	170	-82.3	179.2	171.5	173.9	-2.7	106.5	R892 N896	R892-R894 PolarHBondContact O-N 2.93Å; R894-N896 PolarHBondContact O-N 2.81Å; R894-N896 VanDerWaalsContact O-N 3.1Å
895	D	32.2	Very low	34.9	Very low	154 Å²	154	165.4 Å²	165.4	82%	0.824	81%	0.805	S	S	*	*			trans	-53.2	115.7	173.8	-76.2	-42.6	0	0	0	109.2	P893 Q897	P893-D895 PolarHBondContact O-N 3Å; P893-D895 VanDerWaalsContact O-N 3.08Å; D895-Q897 VanDerWaalsContact C-N 3.35Å; D895-Q897 PolarHBondContact O-N 3.29Å; D895-Q897 VanDerWaalsContact O-N 3.07Å
896	N	31.3	Very low	33.3	Very low	153 Å²	153	161.6 Å²	161.6	82%	0.818	81%	0.805	S	S	*	*			trans	-67.1	99.5	158.4	-90.1	-13.5	0	0	0	106.6	R894 V898	R894-N896 PolarHBondContact O-N 2.81Å; R894-N896 VanDerWaalsContact O-N 3.1Å; N896-V898 PolarHBondContact O-N 2.98Å
897	Q	30.3	Very low	31.8	Very low	177 Å²	177	162.1 Å²	162.1	83%	0.827	82%	0.817	S	S	*	*			trans	-65.7	91.7	161.7	-82.4	-176.5	-9.9	0	0	108.4	D895 L899	D895-Q897 VanDerWaalsContact C-N 3.35Å; D895-Q897 PolarHBondContact O-N 3.29Å; D895-Q897 VanDerWaalsContact O-N 3.07Å; Q897-L899 PolarHBondContact O-N 3.37Å
898	V	31.7	Very low	31	Very low	127 Å²	127	160.6 Å²	160.6	77%	0.77	81%	0.811	S	S	*	*			trans	-68	108.2	159.1	176.5	0	0	0	0	106.4	N896 S900	N896-V898 PolarHBondContact O-N 2.98Å; V898-S900 PolarHBondContact O-N 3.12Å
899	L	31.3	Very low	30.3	Very low	166 Å²	166	163.1 Å²	163.1	87%	0.869	81%	0.814	S	S	*	*			trans	-66.7	111.5	171	-83.4	117.9	0	0	0	109.6	Q897	Q897-L899 PolarHBondContact O-N 3.37Å
900	S	30.4	Very low	29.7	Very low	99 Å²	99	156.7 Å²	156.7	69%	0.692	81%	0.805	S	S	*	*			trans	-117.6	103	153.5	64.1	0	0	0	0	108.7	V898	V898-S900 PolarHBondContact O-N 3.12Å
901	N	29.1	Very low	29.5	Very low	159 Å²	159	151.4 Å²	151.4	85%	0.85	80%	0.798	S	S	*	*			trans	-171.8	140.1	130.1	-99.5	-10.3	0	0	0	113.2
902	S	29.5	Very low	29.2	Very low	116 Å²	116	149.3 Å²	149.3	81%	0.811	80%	0.795	S	S	*	*			trans	-65.7	145.6	-179.9	48.4	0	0	0	0	115.7
903	G	26.1	Very low	29.3	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	80%	0.796	S	S	*	*			trans	154.2	137.6	158.5	0	0	0	0	0	114.7
904	P	33	Very low	29.1	Very low	125 Å²	125	153.6 Å²	153.6	81%	0.812	81%	0.805	S	S	*	*			trans	-101.5	155.7	-154.2	38.3	-33.8	0	0	0	116.9
905	R	26.2	Very low	28.9	Very low	240 Å²	240	147.3 Å²	147.3	91%	0.906	80%	0.798	S	S	*	*			trans	36.1	138.4	145.2	-72	-179.1	171.3	175.9	-1.9	120.8
906	V	25.4	Very low	28.8	Very low	127 Å²	127	144.4 Å²	144.4	77%	0.77	80%	0.796	S	S	*	*				166.7	110.6	116.9	157.8	0	0	0	0	108.8
907	S	25.1	Very low	28.8	Very low	103 Å²	103	145 Å²	145	72%	0.72	80%	0.798	S	S	*	*				75.7	149.5	120.7	108.4	0	0	0	0	115.6
908	S	29.1	Very low	28.9	Very low	91 Å²	91	143.8 Å²	143.8	64%	0.636	80%	0.797	S	S	*	*			cis	174.4	163.3	-5.5	42.2	0	0	0	0	106.9
909	R	27.2	Very low	28.9	Very low	226 Å²	226	142.7 Å²	142.7	85%	0.853	80%	0.795	S	S	*	*			trans	103.7	98.1	160.5	-66.9	-177.7	166.2	174.3	-4	114.7
910	S	26.1	Very low	29.4	Very low	100 Å²	100	140 Å²	140	70%	0.699	79%	0.787	S	S	*	*				78.9	132.5	72.2	74.1	0	0	0	0	110.8
911	T	28.2	Very low	29.4	Very low	119 Å²	119	144 Å²	144	73%	0.73	80%	0.795	S	S	*	*			cis	-171.4	120	42.4	-55.7	0	0	0	0	108.5
912	K	29.4	Very low	29.5	Very low	192 Å²	192	145.8 Å²	145.8	84%	0.835	80%	0.798	S	S	*	*				39	124.7	115.9	-78.3	-179.3	176.3	176.2	0	120.1
913	Q	29.4	Very low	30.1	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	79%	0.793	S	S	*	*				178.7	114	117.8	-102.4	169.7	-38.8	0	0	109.2
914	R	29	Very low	31	Very low	246 Å²	246	147.2 Å²	147.2	93%	0.928	79%	0.791	S	S	*	*				46.5	125.2	81.4	-84.2	-174.1	168.3	176.7	-4.2	112.9
915	S	27.6	Very low	31.4	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	78%	0.776	S	S	*	*			cis	-169.6	130	38.1	40.2	0	0	0	0	110
916	A	30.5	Very low	32.6	Very low	93 Å²	93	136.6 Å²	136.6	77%	0.769	76%	0.76	S	S	*	*				83.7	112.3	91.9	0	0	0	0	0	116.8
917	L	31	Very low	33.6	Very low	166 Å²	166	136.9 Å²	136.9	87%	0.869	75%	0.753	S	S	*	*			trans	-174.3	116.2	145.5	-102.3	143.4	0	0	0	112.9
918	L	30.9	Very low	34.5	Very low	152 Å²	152	140.9 Å²	140.9	80%	0.796	75%	0.752	S	S	*	*			trans	24.1	116.5	152.6	-70.2	150.2	0	0	0	123.2
919	S	32	Very low	35.4	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	75%	0.748	S	S	*	*			trans	11.1	159	143.2	54	0	0	0	0	122.9
920	P	42.8	Very low	36.5	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	74%	0.738	S	S	*	*			cis	-144.3	179.4	25	41.8	-20.5	0	0	0	117.9
921	E	29.8	Very low	37.4	Very low	184 Å²	184	139 Å²	139	86%	0.86	73%	0.731	S	S	*	*			trans	77.3	116.1	156.8	-75.7	175.4	154.2	0	0	121
922	E	32.3	Very low	38.3	Very low	196 Å²	196	136.9 Å²	136.9	92%	0.916	72%	0.715	S	S	*	*			trans	-73.7	139	169.6	-65.6	-177.8	147.4	0	0	112
923	P	41.3	Very low	38.9	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	70%	0.702	S	S	*	*			trans	-99.8	164.3	170.1	36.4	-29.8	0	0	0	113.3	A925	P923-A925 VanDerWaalsContact C-N 3.31Å; P923-A925 PolarHBondContact O-N 3.26Å
924	P	44	Very low	39.7	Very low	110 Å²	110	128.7 Å²	128.7	71%	0.714	69%	0.685	S	S	*	*	S	Bend	trans	-86.2	53.7	-157.3	37.3	-37.3	0	0	0	113.3
925	A	42.3	Very low	40.2	Very low	60 Å²	60	120.9 Å²	120.9	50%	0.496	66%	0.662	S	S	.	*	H	α-helix	trans	-76.8	-37.2	-177.7	0	0	0	0	0	112.8	P923 H927 R928 D929	P923-A925 VanDerWaalsContact C-N 3.31Å; P923-A925 PolarHBondContact O-N 3.26Å; A925-H927 PolarHBondContact O-N 3.48Å; A925-R928 PolarHBondContact O-N 3.36Å; A925-D929 PolarHBondContact O-N 3.28Å
926	S	52.4	Low	40.7	Very low	83 Å²	83	123.7 Å²	123.7	58%	0.58	66%	0.655	S	S	*	*	H	α-helix	trans	-69.4	-31.5	-172.6	67.1	0	0	0	0	114.2	R930	S926-R930 WeakPolarHBondContact O-CG 3.4Å; S926-R930 PolarHBondContact O-N 2.91Å; S926-R930 VanDerWaalsContact O-N 3.11Å
927	H	45.1	Very low	41.2	Very low	132 Å²	132	123.9 Å²	123.9	61%	0.611	64%	0.643	S	S	*	*	H	α-helix	trans	-75.6	-37.9	177.4	-114.8	-89.4	0	0	0	111.8	A925 R930 L931	A925-H927 PolarHBondContact O-N 3.48Å; H927-R930 PolarHBondContact O-N 2.93Å; H927-L931 VanDerWaalsContact O-CB 3.31Å; H927-L931 WeakPolarHBondContact O-CB 3.36Å; H927-L931 PolarHBondContact O-N 3.39Å
928	R	43.8	Very low	41.5	Very low	188 Å²	188	121.4 Å²	121.4	71%	0.709	63%	0.63	S	S	*	*	H	α-helix	trans	-70.7	-35.6	178.7	-154.9	165.4	174.6	151.2	-4.2	111	A925 L931 N932	A925-R928 PolarHBondContact O-N 3.36Å; R928-L931 PolarHBondContact O-N 3.37Å; R928-N932 VanDerWaalsContact O-CB 3.24Å; R928-N932 WeakPolarHBondContact O-CB 3.42Å; R928-N932 PolarHBondContact O-N 3.42Å; R928-N932 PolarHBondContact O-ND2 3.47Å
929	D	48.6	Very low	41.8	Very low	100 Å²	100	120.1 Å²	120.1	54%	0.535	62%	0.62	S	S	.	*	H	α-helix	trans	-70.3	-39.9	173.6	-72.7	-22.9	0	0	0	112.4	A925 N932 Q933	A925-D929 PolarHBondContact O-N 3.28Å; D929-N932 PolarHBondContact O-N 3.27Å; D929-Q933 WeakPolarHBondContact O-CB 3.38Å; D929-Q933 PolarHBondContact O-N 3.22Å
930	R	50.8	Low	42	Very low	171 Å²	171	121.6 Å²	121.6	65%	0.645	62%	0.62	S	S	*	*	H	α-helix	trans	-64.2	-39.5	171.3	-79.1	178.5	177.9	176.9	1.1	112.4	S926 H927 Q933 V934	S926-R930 WeakPolarHBondContact O-CG 3.4Å; S926-R930 PolarHBondContact O-N 2.91Å; S926-R930 VanDerWaalsContact O-N 3.11Å; H927-R930 PolarHBondContact O-N 2.93Å; R930-Q933 PolarHBondContact O-N 2.93Å; R930-V934 WeakPolarHBondContact O-CB 3.41Å; R930-V934 VanDerWaalsContact O-CG2 3.27Å; R930-V934 WeakPolarHBondContact O-CG2 3.33Å; R930-V934 PolarHBondContact O-N 3.05Å
931	L	44.1	Very low	41.7	Very low	107 Å²	107	123.8 Å²	123.8	56%	0.56	62%	0.621	S	S	*	*	H	α-helix	trans	-69.6	-39.8	178.3	-150.8	123.6	0	0	0	111.2	H927 R928 Q933 V934 L935	H927-L931 VanDerWaalsContact O-CB 3.31Å; H927-L931 WeakPolarHBondContact O-CB 3.36Å; H927-L931 PolarHBondContact O-N 3.39Å; R928-L931 PolarHBondContact O-N 3.37Å; L931-Q933 VanDerWaalsContact C-N 3.3Å; L931-Q933 PolarHBondContact O-N 2.99Å; L931-V934 PolarHBondContact O-N 3.07Å; L931-L935 HydrophobicContact CD2-CD1 3.9Å; L931-L935 VanDerWaalsContact O-CB 3.28Å; L931-L935 WeakPolarHBondContact O-CB 3.24Å; L931-L935 WeakPolarHBondContact O-CD1 3.28Å; L931-L935 VanDerWaalsContact O-CG 3.24Å; L931-L935 WeakPolarHBondContact O-CG 3.29Å; L931-L935 PolarHBondContact O-N 3.48Å
932	N	46.8	Very low	42	Very low	74 Å²	74	119.2 Å²	119.2	40%	0.396	61%	0.609	S	S	.	*	H	α-helix	trans	-66	-31.6	171.3	-74.6	-23.7	0	0	0	112.3	R928 D929 R936	R928-N932 VanDerWaalsContact O-CB 3.24Å; R928-N932 WeakPolarHBondContact O-CB 3.42Å; R928-N932 PolarHBondContact O-N 3.42Å; R928-N932 PolarHBondContact O-ND2 3.47Å; D929-N932 PolarHBondContact O-N 3.27Å; N932-R936 VanDerWaalsContact O-CB 3.29Å; N932-R936 WeakPolarHBondContact O-CB 3.48Å; N932-R936 VanDerWaalsContact O-CG 3.29Å; N932-R936 WeakPolarHBondContact O-CG 3.16Å; N932-R936 PolarHBondContact O-N 3.32Å
933	Q	42	Very low	42.1	Very low	119 Å²	119	112 Å²	112	56%	0.556	58%	0.578	S	S	*	*	H	α-helix	trans	-76.9	-37.2	176.9	-165.4	165.4	17.3	0	0	111.7	D929 R930 L931 R936 D937	D929-Q933 WeakPolarHBondContact O-CB 3.38Å; D929-Q933 PolarHBondContact O-N 3.22Å; R930-Q933 PolarHBondContact O-N 2.93Å; L931-Q933 VanDerWaalsContact C-N 3.3Å; L931-Q933 PolarHBondContact O-N 2.99Å; Q933-R936 CarbonylContact O-C 3.35Å; Q933-R936 PolarHBondContact O-N 3.01Å; Q933-D937 WeakPolarHBondContact O-CB 3.41Å; Q933-D937 VanDerWaalsContact O-CG 3.31Å; Q933-D937 PolarHBondContact O-N 2.97Å
934	V	47.6	Very low	41.7	Very low	88 Å²	88	112 Å²	112	53%	0.533	58%	0.579	S	S	.	*	H	α-helix	trans	-67.7	-38.1	169.7	171.3	0	0	0	0	111.1	R930 L931 D937 L938	R930-V934 WeakPolarHBondContact O-CB 3.41Å; R930-V934 VanDerWaalsContact O-CG2 3.27Å; R930-V934 WeakPolarHBondContact O-CG2 3.33Å; R930-V934 PolarHBondContact O-N 3.05Å; L931-V934 PolarHBondContact O-N 3.07Å; V934-D937 PolarHBondContact O-N 2.93Å; V934-L938 HydrophobicContact CG1-CD1 4.23Å; V934-L938 WeakPolarHBondContact O-CB 3.4Å; V934-L938 WeakPolarHBondContact O-CG 3.39Å; V934-L938 PolarHBondContact O-N 3.28Å
935	L	39.2	Very low	41.5	Very low	83 Å²	83	114.7 Å²	114.7	44%	0.435	59%	0.585	S	S	.	*	H	α-helix	trans	-64.5	-40.2	171.4	-79.4	162.2	0	0	0	111.3	L931 L938 E939	L931-L935 HydrophobicContact CD2-CD1 3.9Å; L931-L935 VanDerWaalsContact O-CB 3.28Å; L931-L935 WeakPolarHBondContact O-CB 3.24Å; L931-L935 WeakPolarHBondContact O-CD1 3.28Å; L931-L935 VanDerWaalsContact O-CG 3.24Å; L931-L935 WeakPolarHBondContact O-CG 3.29Å; L931-L935 PolarHBondContact O-N 3.48Å; L935-L938 CarbonylContact O-C 3.26Å; L935-L938 PolarHBondContact O-N 3.03Å; L935-E939 WeakPolarHBondContact O-CB 3.48Å; L935-E939 WeakPolarHBondContact O-CG 3.26Å; L935-E939 PolarHBondContact O-N 3.45Å
936	R	37.9	Very low	41.5	Very low	170 Å²	170	114.7 Å²	114.7	64%	0.642	58%	0.579	S	S	*	*	H	α-helix	trans	-69.5	-35.7	173.9	-82.9	-178.8	-175.8	179	3	113.3	N932 Q933 L938 E939 D940	N932-R936 VanDerWaalsContact O-CB 3.29Å; N932-R936 WeakPolarHBondContact O-CB 3.48Å; N932-R936 VanDerWaalsContact O-CG 3.29Å; N932-R936 WeakPolarHBondContact O-CG 3.16Å; N932-R936 PolarHBondContact O-N 3.32Å; Q933-R936 CarbonylContact O-C 3.35Å; Q933-R936 PolarHBondContact O-N 3.01Å; R936-L938 VanDerWaalsContact C-N 3.33Å; R936-E939 CarbonylContact O-C 3.11Å; R936-E939 PolarHBondContact O-N 3.46Å; R936-D940 VanDerWaalsContact O-CB 3.29Å; R936-D940 WeakPolarHBondContact O-CB 3.03Å; R936-D940 PolarHBondContact O-N 2.9Å
937	D	40.3	Very low	41.2	Very low	97 Å²	97	118.3 Å²	118.3	52%	0.519	58%	0.584	S	S	.	*	H	α-helix	trans	-70.4	-32.9	174.6	-76.4	-16.1	0	0	0	110.8	Q933 V934 E941	Q933-D937 WeakPolarHBondContact O-CB 3.41Å; Q933-D937 VanDerWaalsContact O-CG 3.31Å; Q933-D937 PolarHBondContact O-N 2.97Å; V934-D937 PolarHBondContact O-N 2.93Å; D937-E941 PolarHBondContact O-N 3.45Å
938	L	38.5	Very low	41.6	Very low	114 Å²	114	114.6 Å²	114.6	60%	0.597	57%	0.569	S	S	*	*	H	α-helix	trans	-70.7	-31.8	168.2	-75.4	166.2	0	0	0	112.5	V934 L935 R936	V934-L938 HydrophobicContact CG1-CD1 4.23Å; V934-L938 WeakPolarHBondContact O-CB 3.4Å; V934-L938 WeakPolarHBondContact O-CG 3.39Å; V934-L938 PolarHBondContact O-N 3.28Å; L935-L938 CarbonylContact O-C 3.26Å; L935-L938 PolarHBondContact O-N 3.03Å; R936-L938 VanDerWaalsContact C-N 3.33Å
939	E	37.1	Very low	42	Very low	126 Å²	126	106.8 Å²	106.8	59%	0.589	55%	0.547	S	S	*	.	H	α-helix	trans	-76.8	-32.8	172.5	-77.2	177.3	162.7	0	0	112.4	L935 R936 S942	L935-E939 WeakPolarHBondContact O-CB 3.48Å; L935-E939 WeakPolarHBondContact O-CG 3.26Å; L935-E939 PolarHBondContact O-N 3.45Å; R936-E939 CarbonylContact O-C 3.11Å; R936-E939 PolarHBondContact O-N 3.46Å; E939-S942 WeakPolarHBondContact O-CA 3.09Å; E939-S942 WeakPolarHBondContact O-CB 3.41Å; E939-S942 PolarHBondContact O-N 2.85Å; E939-S942 PolarHBondContact O-OG 2.87Å
940	D	35.8	Very low	42.2	Very low	135 Å²	135	102.5 Å²	102.5	72%	0.722	52%	0.524	S	S	*	.	H	α-helix	trans	-80.4	-19.2	176.8	-84.4	-17.5	0	0	0	111.6	R936 S942	R936-D940 VanDerWaalsContact O-CB 3.29Å; R936-D940 WeakPolarHBondContact O-CB 3.03Å; R936-D940 PolarHBondContact O-N 2.9Å; D940-S942 PolarHBondContact O-N 3.01Å
941	E	37	Very low	42.4	Very low	154 Å²	154	94.6 Å²	94.6	72%	0.72	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-6	159.3	-80.6	-161.3	169.3	0	0	112.9	D937 T943	D937-E941 PolarHBondContact O-N 3.45Å; E941-T943 PolarHBondContact O-N 3.42Å
942	S	34.4	Very low	43.2	Very low	87 Å²	87	89.7 Å²	89.7	61%	0.608	47%	0.47	S	S	*	.	S	Bend	trans	-69.4	86.1	159.6	82.9	0	0	0	0	108.4	E939 D940	E939-S942 WeakPolarHBondContact O-CA 3.09Å; E939-S942 WeakPolarHBondContact O-CB 3.41Å; E939-S942 PolarHBondContact O-N 2.85Å; E939-S942 PolarHBondContact O-OG 2.87Å; D940-S942 PolarHBondContact O-N 3.01Å
943	T	34.4	Very low	44.1	Very low	44 Å²	44	87.8 Å²	87.8	27%	0.27	46%	0.459	S	S	.	.			trans	-26.7	140.6	169.8	51.4	0	0	0	0	113	Y511 E941 I945 K960	Y511-T943 VanDerWaalsContact OH-CG2 3.26Å; Y511-T943 WeakPolarHBondContact OH-CG2 3.31Å; Y511-T943 PolarHBondContact OH-OG1 2.94Å; E941-T943 PolarHBondContact O-N 3.42Å; T943-I945 PolarHBondContact O-N 2.82Å; T943-K960 PolarHBondContact OG1-NZ 3.13Å
944	P	33.4	Very low	45.1	Very low	111 Å²	111	82.2 Å²	82.2	72%	0.721	43%	0.434	S	S	*	.			trans	-46.5	132.4	175.6	20.3	-32.4	0	0	0	109.7	V946	P944-V946 PolarHBondContact O-N 3.26Å
945	I	40.6	Very low	46.6	Very low	165 Å²	165	78 Å²	78	85%	0.846	41%	0.408	S	S	*	.			trans	-58.7	92.7	176.5	-59.7	168.6	0	0	0	106.3	T943 K947	T943-I945 PolarHBondContact O-N 2.82Å; I945-K947 PolarHBondContact O-N 2.88Å
946	V	40.8	Very low	48.5	Very low	61 Å²	61	74.1 Å²	74.1	37%	0.37	39%	0.388	S	S	.	.			trans	-65.9	123.6	170.4	-177.8	0	0	0	0	104.6	L879 P944 L948 K960	L879-V946 HydrophobicContact CD1-CB 4.42Å; L879-V946 HydrophobicContact CD1-CG1 3.72Å; P944-V946 PolarHBondContact O-N 3.26Å; V946-L948 PolarHBondContact O-N 3.26Å; V946-K960 HydrophobicContact CG2-CD 4.16Å
947	K	47.8	Very low	50.8	Low	158 Å²	158	66 Å²	66	69%	0.687	36%	0.357	S	S	*	.			trans	-55.1	107.5	173.4	-71.4	-177.3	178.2	-178.9	0	106.9	I945 G949	I945-K947 PolarHBondContact O-N 2.88Å; K947-G949 PolarHBondContact O-N 3.18Å
948	L	52	Low	53	Low	55 Å²	55	61.7 Å²	61.7	29%	0.288	33%	0.334	S	S	.	.			trans	-66.1	123.8	178.4	-68.4	175.2	0	0	0	107.3	M291 V946 S952 I953 T958	M291-L948 HydrophobicContact CE-CD1 3.46Å; M291-L948 VanDerWaalsContact CE-CD1 3.46Å; M291-L948 HydrophobicContact SD-CD1 4.28Å; V946-L948 PolarHBondContact O-N 3.26Å; L948-S952 WeakPolarHBondContact CA-OG 3.44Å; L948-S952 VanDerWaalsContact CB-OG 3.26Å; L948-S952 WeakPolarHBondContact CB-OG 3.29Å; L948-I953 HydrophobicContact CB-CG1 4.03Å; L948-T958 HydrophobicContact CD2-CG2 4.25Å
949	G	53.1	Low	55.3	Low	24 Å²	24	56.3 Å²	56.3	25%	0.247	31%	0.306	C	S	.	.			trans	-76.9	165.5	166.2	0	0	0	0	0	110.7	K947 A951 S952 I953	K947-G949 PolarHBondContact O-N 3.18Å; G949-A951 PolarHBondContact O-N 2.97Å; G949-S952 PolarHBondContact N-OG 3.29Å; G949-S952 VanDerWaalsContact N-OG 3.16Å; G949-S952 WeakPolarHBondContact O-CA 3.37Å; G949-S952 WeakPolarHBondContact O-CB 3.45Å; G949-S952 PolarHBondContact O-N 3.16Å; G949-S952 PolarHBondContact O-OG 3.44Å; G949-I953 PolarHBondContact O-N 2.92Å
950	D	52.2	Low	57.4	Low	9 Å²	9	52 Å²	52	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-36.5	-168.9	-60.6	-35.1	0	0	0	115.5	L349 L423 T863 S952 I953 A954	L349-D950 WeakPolarHBondContact CA-OD2 3.43Å; L349-D950 PolarHBondContact N-OD2 2.87Å; L423-D950 HydrophobicContact CD2-CB 3.69Å; L423-D950 WeakPolarHBondContact CD2-OD1 3.44Å; T863-D950 HydrophobicContact CG2-CB 3.92Å; D950-S952 PolarHBondContact O-N 2.94Å; D950-I953 PolarHBondContact O-N 2.95Å; D950-A954 PolarHBondContact O-N 3.46Å
951	A	54.8	Low	59.7	Low	6 Å²	6	47.3 Å²	47.3	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-54.5	-37.6	173.9	0	0	0	0	0	110.8	D861 L869 A877 G949 A955	D861-A951 WeakPolarHBondContact O-CB 3.35Å; L869-A951 HydrophobicContact CD1-CB 4.18Å; A877-A951 HydrophobicContact CB-CB 4.19Å; A877-A951 VanDerWaalsContact CB-O 3.31Å; A877-A951 WeakPolarHBondContact CB-O 3.37Å; G949-A951 PolarHBondContact O-N 2.97Å; A951-A955 VanDerWaalsContact O-CB 3.31Å; A951-A955 WeakPolarHBondContact O-CB 3.42Å; A951-A955 PolarHBondContact O-N 3.06Å
952	S	62.1	Low	61.8	Low	4 Å²	4	40.6 Å²	40.6	3%	0.028	23%	0.23	C	C	.	.	H	α-helix	trans	-77.2	-18.5	178.6	69.5	0	0	0	0	115.4	L948 G949 D950 T958	L948-S952 WeakPolarHBondContact CA-OG 3.44Å; L948-S952 VanDerWaalsContact CB-OG 3.26Å; L948-S952 WeakPolarHBondContact CB-OG 3.29Å; G949-S952 PolarHBondContact N-OG 3.29Å; G949-S952 VanDerWaalsContact N-OG 3.16Å; G949-S952 WeakPolarHBondContact O-CA 3.37Å; G949-S952 WeakPolarHBondContact O-CB 3.45Å; G949-S952 PolarHBondContact O-N 3.16Å; G949-S952 PolarHBondContact O-OG 3.44Å; D950-S952 PolarHBondContact O-N 2.94Å; S952-T958 WeakPolarHBondContact CA-OG1 3.47Å; S952-T958 WeakPolarHBondContact CB-OG1 3.38Å; S952-T958 PolarHBondContact O-OG1 3.32Å
953	I	64.1	Low	64.3	Low	34 Å²	34	37.4 Å²	37.4	17%	0.174	21%	0.208	C	C	.	.	H	α-helix	trans	-84.8	-34.1	174.4	-52.2	174.6	0	0	0	109.9	I427 L948 G949 D950	I427-I953 HydrophobicContact CD1-CB 3.92Å; I427-I953 HydrophobicContact CD1-CG2 3.37Å; I427-I953 HydrophobicContact CG1-CG2 4.11Å; I427-I953 HydrophobicContact CG2-CG2 4Å; L948-I953 HydrophobicContact CB-CG1 4.03Å; G949-I953 PolarHBondContact O-N 2.92Å; D950-I953 PolarHBondContact O-N 2.95Å
954	A	64.6	Low	67	Low	2 Å²	2	35.3 Å²	35.3	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-78.3	-37.1	178.5	0	0	0	0	0	113.5	V866 K870 D950	V866-A954 HydrophobicContact CB-CB 4.27Å; V866-A954 HydrophobicContact CG1-CB 3.62Å; V866-A954 HydrophobicContact CG2-CB 4.21Å; K870-A954 WeakPolarHBondContact CD-O 3.33Å; D950-A954 PolarHBondContact O-N 3.46Å
955	A	77.6	Confident	69.7	Low	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-74.4	139.6	-177.7	0	0	0	0	0	112.3	L869 A877 A951 F957	L869-A955 HydrophobicContact CB-CB 4.34Å; L869-A955 HydrophobicContact CD1-CB 4.45Å; L869-A955 HydrophobicContact CD2-CB 4.48Å; A877-A955 HydrophobicContact CB-CB 3.56Å; A951-A955 VanDerWaalsContact O-CB 3.31Å; A951-A955 WeakPolarHBondContact O-CB 3.42Å; A951-A955 PolarHBondContact O-N 3.06Å; A955-F957 WeakPolarHBondContact CB-O 3.21Å; A955-F957 PolarHBondContact O-N 3.45Å
956	P	79.3	Confident	72.1	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.136	C	C	.	.	S	Bend	trans	-66.3	-24.1	173.2	24.9	-32.2	0	0	0	113	C512 T513 E514 G875	C512-P956 CarbonylContact C-O 3.57Å; C512-P956 VanDerWaalsContact CA-O 3.27Å; C512-P956 WeakPolarHBondContact CA-O 3.29Å; T513-P956 PolarHBondContact N-O 3.29Å; T513-P956 WeakPolarHBondContact OG1-CA 3.45Å; T513-P956 PolarHBondContact OG1-O 3.27Å; E514-P956 HydrophobicContact CB-CB 4.13Å; G875-P956 VanDerWaalsContact O-CD 3.26Å; G875-P956 WeakPolarHBondContact O-CD 3.5Å; G875-P956 WeakPolarHBondContact O-CG 3.45Å
957	F	87.7	Confident	74.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.8	175.2	-60	-87	0	0	0	110.7	L505 M510 Y511 C512 R517 I518 V874 G875 V876 A877 A955 V970	L505-F957 HydrophobicContact CD1-CE1 4.12Å; M510-F957 HydrophobicContact CE-CB 4.04Å; Y511-F957 CarbonylContact O-C 3.56Å; Y511-F957 WeakPolarHBondContact O-CA 3.29Å; C512-F957 HydrophobicContact CB-CD1 3.85Å; C512-F957 HydrophobicContact CB-CE1 3.81Å; C512-F957 WeakPolarHBondContact SG-CE1 3.4Å; R517-F957 HydrophobicContact CB-CE2 4.17Å; R517-F957 HydrophobicContact CB-CZ 4.37Å; I518-F957 HydrophobicContact CG1-CE1 3.82Å; I518-F957 HydrophobicContact CG1-CZ 3.84Å; V874-F957 HydrophobicContact CG1-CD2 3.8Å; V874-F957 HydrophobicContact CG1-CE2 3.74Å; G875-F957 WeakPolarHBondContact O-CB 3.36Å; G875-F957 PolarHBondContact O-N 3.28Å; G875-F957 VanDerWaalsContact O-N 3.08Å; V876-F957 CarbonylContact C-O 3.58Å; V876-F957 WeakPolarHBondContact CA-O 3.29Å; V876-F957 HydrophobicContact CG2-CB 4.15Å; A877-F957 PolarHBondContact N-O 3.48Å; A955-F957 WeakPolarHBondContact CB-O 3.21Å; A955-F957 PolarHBondContact O-N 3.45Å; F957-V970 HydrophobicContact CD1-CG2 4.31Å; F957-V970 HydrophobicContact CE1-CG1 4.45Å; F957-V970 HydrophobicContact CZ-CG1 4.45Å
958	T	86.2	Confident	76.7	Confident	5 Å²	5	14.8 Å²	14.8	3%	0.031	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125	178.2	-66.7	0	0	0	0	110	Y511 L879 L948 S952	Y511-T958 PolarHBondContact N-O 2.75Å; Y511-T958 PolarHBondContact O-N 3.05Å; L879-T958 HydrophobicContact CD2-CG2 4.24Å; L879-T958 HydrophobicContact CG-CG2 4.19Å; L948-T958 HydrophobicContact CD2-CG2 4.25Å; S952-T958 WeakPolarHBondContact CA-OG1 3.47Å; S952-T958 WeakPolarHBondContact CB-OG1 3.38Å; S952-T958 PolarHBondContact O-OG1 3.32Å
959	S	87	Confident	78.7	Confident	2 Å²	2	15 Å²	15	1%	0.014	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.3	173.1	-162.2	0	0	0	0	111.7	M510 A877 L879 L961	M510-S959 WeakPolarHBondContact SD-CA 3.27Å; M510-S959 WeakPolarHBondContact SD-CB 3.48Å; M510-S959 PolarHBondContact SD-OG 3.1Å; A877-S959 PolarHBondContact O-N 2.96Å; L879-S959 WeakPolarHBondContact CG-O 3.44Å; L879-S959 PolarHBondContact N-O 3.29Å; S959-L961 VanDerWaalsContact C-N 3.27Å; S959-L961 PolarHBondContact OG-N 3.48Å; S959-L961 PolarHBondContact OG-O 2.99Å
960	K	81.3	Confident	80.6	Confident	35 Å²	35	13.9 Å²	13.9	15%	0.152	7%	0.073	C	C	.	.	S	Bend	trans	-80.4	-7.2	169.5	-66.1	-170.2	170.4	170.7	0	114.3	Y509 Y511 L879 A882 T943 V946	Y509-K960 PolarHBondContact O-N 3.35Å; Y509-K960 VanDerWaalsContact O-N 3.1Å; Y511-K960 HydrophobicContact CD2-CD 4.21Å; Y511-K960 HydrophobicContact CD2-CG 4.06Å; Y511-K960 HydrophobicContact CE2-CD 3.48Å; Y511-K960 VanDerWaalsContact CE2-CD 3.48Å; Y511-K960 HydrophobicContact CE2-CG 3.81Å; Y511-K960 VanDerWaalsContact CZ-NZ 3.34Å; Y511-K960 PolarHBondContact OH-NZ 3.01Å; L879-K960 HydrophobicContact CD1-CB 4.44Å; L879-K960 HydrophobicContact CD1-CG 4.18Å; A882-K960 VanDerWaalsContact CB-O 3.24Å; A882-K960 WeakPolarHBondContact CB-O 3.47Å; T943-K960 PolarHBondContact OG1-NZ 3.13Å; V946-K960 HydrophobicContact CG2-CD 4.16Å
961	L	83.1	Confident	82.6	Confident	36 Å²	36	13.4 Å²	13.4	19%	0.188	7%	0.071	C	C	.	.	S	Bend	trans	-105.9	150.6	176.3	-59.6	175.6	0	0	0	108.6	Y509 I886 S959 S963	Y509-L961 HydrophobicContact CD2-CD1 4.46Å; I886-L961 HydrophobicContact CG1-CD2 4.25Å; S959-L961 VanDerWaalsContact C-N 3.27Å; S959-L961 PolarHBondContact OG-N 3.48Å; S959-L961 PolarHBondContact OG-O 2.99Å; L961-S963 PolarHBondContact O-N 3.4Å
962	S	81.8	Confident	84.4	Confident	13 Å²	13	14 Å²	14	9%	0.091	7%	0.072	C	C	.	.	S	Bend	trans	-80.5	-1.5	173.9	51.2	0	0	0	0	113	K723 A882 E884	K723-S962 PolarHBondContact NZ-O 2.96Å; A882-S962 VanDerWaalsContact O-CB 3.32Å; A882-S962 WeakPolarHBondContact O-CB 3.37Å; A882-S962 PolarHBondContact O-OG 3.36Å; E884-S962 WeakPolarHBondContact CA-OG 3.3Å; E884-S962 WeakPolarHBondContact CG-OG 3.09Å; E884-S962 PolarHBondContact N-OG 3Å
963	S	87.1	Confident	85.9	Confident	21 Å²	21	14.3 Å²	14.3	15%	0.147	7%	0.073	C	C	.	.			trans	-74.6	139.2	179.7	172.5	0	0	0	0	112.6	D725 L961 Q965 C966	D725-S963 VanDerWaalsContact OD2-CA 3.28Å; D725-S963 WeakPolarHBondContact OD2-CA 3.42Å; D725-S963 VanDerWaalsContact OD2-CB 3.28Å; D725-S963 WeakPolarHBondContact OD2-CB 3.26Å; D725-S963 PolarHBondContact OD2-OG 3.18Å; L961-S963 PolarHBondContact O-N 3.4Å; S963-Q965 VanDerWaalsContact C-N 3.26Å; S963-Q965 PolarHBondContact O-N 2.97Å; S963-Q965 VanDerWaalsContact OG-CB 3.31Å; S963-Q965 WeakPolarHBondContact OG-CB 3.45Å; S963-Q965 PolarHBondContact OG-N 3.42Å; S963-C966 PolarHBondContact O-SG 3.38Å
964	I	90.2	Very high	87.2	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-12.3	-179.5	-46.1	-176.9	0	0	0	111.4	F529 T534 L535 D725 S726 V729 C966 I967	F529-I964 HydrophobicContact CD1-CG2 4.36Å; F529-I964 HydrophobicContact CE1-CG2 3.69Å; T534-I964 WeakPolarHBondContact O-CD1 3.28Å; L535-I964 HydrophobicContact CD2-CD1 3.79Å; D725-I964 PolarHBondContact OD2-N 2.97Å; S726-I964 WeakPolarHBondContact OG-CD1 3.37Å; V729-I964 HydrophobicContact CG1-CB 4.29Å; V729-I964 HydrophobicContact CG1-CG2 3.98Å; I964-C966 PolarHBondContact O-N 3.44Å; I964-I967 HydrophobicContact CG2-CD1 3.59Å; I964-I967 HydrophobicContact CG2-CG1 4.39Å; I964-I967 PolarHBondContact O-N 3.42Å
965	Q	90.9	Very high	88.5	Confident	56 Å²	56	12.8 Å²	12.8	26%	0.262	7%	0.065	S	C	.	.	H	α-helix	trans	-54.4	-25	175.8	-171.4	66.2	41	0	0	112.8	V729 S963 I967 C968 H969	V729-Q965 HydrophobicContact CG2-CB 4.25Å; V729-Q965 VanDerWaalsContact CG2-OE1 3.3Å; S963-Q965 VanDerWaalsContact C-N 3.26Å; S963-Q965 PolarHBondContact O-N 2.97Å; S963-Q965 VanDerWaalsContact OG-CB 3.31Å; S963-Q965 WeakPolarHBondContact OG-CB 3.45Å; S963-Q965 PolarHBondContact OG-N 3.42Å; Q965-I967 PolarHBondContact O-N 3Å; Q965-C968 WeakPolarHBondContact O-CB 3.4Å; Q965-C968 PolarHBondContact O-N 3.43Å; Q965-C968 VanDerWaalsContact O-N 3.12Å; Q965-H969 PolarHBondContact O-CD2 2.94Å; Q965-H969 VanDerWaalsContact O-CD2 3.23Å; Q965-H969 PolarHBondContact O-N 3.16Å
966	C	90.8	Very high	89.1	Confident	7 Å²	7	12.9 Å²	12.9	5%	0.047	7%	0.065	C	C	.	.	H	α-helix	trans	-50.8	-36.9	173.4	59	0	0	0	0	113.6	M510 L878 S963 I964 H969 V970	M510-C966 HydrophobicContact CE-CB 4.13Å; M510-C966 HydrophobicContact CG-CB 4.27Å; M510-C966 HydrophobicContact SD-CB 3.36Å; M510-C966 WeakPolarHBondContact SD-CB 3.33Å; L878-C966 VanDerWaalsContact CD2-SG 3.5Å; S963-C966 PolarHBondContact O-SG 3.38Å; I964-C966 PolarHBondContact O-N 3.44Å; C966-H969 WeakPolarHBondContact O-CB 3.34Å; C966-H969 PolarHBondContact O-N 3.18Å; C966-H969 VanDerWaalsContact O-N 3.15Å; C966-V970 WeakPolarHBondContact O-CG2 3.44Å; C966-V970 PolarHBondContact O-N 3.1Å
967	I	93.3	Very high	89.7	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-65.4	-43.9	-179.4	-61.5	172.3	0	0	0	110.4	F529 I733 L857 C859 V876 I964 Q965 H969 V970 I971	F529-I967 HydrophobicContact CD1-CD1 4.04Å; F529-I967 HydrophobicContact CE1-CD1 3.14Å; F529-I967 HydrophobicContact CZ-CD1 3.64Å; I733-I967 HydrophobicContact CD1-CG2 4.09Å; L857-I967 HydrophobicContact CD1-CG2 4.01Å; L857-I967 HydrophobicContact CD2-CD1 4.46Å; L857-I967 HydrophobicContact CD2-CG2 4.03Å; C859-I967 HydrophobicContact CB-CD1 3.54Å; C859-I967 HydrophobicContact CB-CG1 4.31Å; V876-I967 HydrophobicContact CG1-CG1 4.49Å; I964-I967 HydrophobicContact CG2-CD1 3.59Å; I964-I967 HydrophobicContact CG2-CG1 4.39Å; I964-I967 PolarHBondContact O-N 3.42Å; Q965-I967 PolarHBondContact O-N 3Å; I967-H969 VanDerWaalsContact C-N 3.26Å; I967-H969 PolarHBondContact O-N 3.45Å; I967-V970 PolarHBondContact O-N 3.4Å; I967-I971 HydrophobicContact CG2-CD1 3.85Å; I967-I971 HydrophobicContact CG2-CG1 4.4Å; I967-I971 WeakPolarHBondContact O-CG1 3.44Å; I967-I971 PolarHBondContact O-N 3.01Å
968	C	92.5	Very high	89.7	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.6	-38.9	174.7	-67.4	0	0	0	0	111.1	Q965 K972	Q965-C968 WeakPolarHBondContact O-CB 3.4Å; Q965-C968 PolarHBondContact O-N 3.43Å; Q965-C968 VanDerWaalsContact O-N 3.12Å; C968-K972 VanDerWaalsContact O-CB 3.26Å; C968-K972 WeakPolarHBondContact O-CB 3.41Å; C968-K972 WeakPolarHBondContact O-CD 3.3Å; C968-K972 WeakPolarHBondContact O-CG 3.24Å; C968-K972 PolarHBondContact O-N 2.84Å
969	H	92.5	Very high	89.9	Confident	59 Å²	59	13.9 Å²	13.9	27%	0.273	7%	0.071	S	C	.	.	H	α-helix	trans	-64.7	-43.8	175.4	-66.6	-56.7	0	0	0	112.6	L508 Q965 C966 I967 K972 Q973	L508-H969 HydrophobicContact CD1-CB 3.95Å; Q965-H969 PolarHBondContact O-CD2 2.94Å; Q965-H969 VanDerWaalsContact O-CD2 3.23Å; Q965-H969 PolarHBondContact O-N 3.16Å; C966-H969 WeakPolarHBondContact O-CB 3.34Å; C966-H969 PolarHBondContact O-N 3.18Å; C966-H969 VanDerWaalsContact O-N 3.15Å; I967-H969 VanDerWaalsContact C-N 3.26Å; I967-H969 PolarHBondContact O-N 3.45Å; H969-K972 PolarHBondContact O-N 3.16Å; H969-Q973 WeakPolarHBondContact O-CB 3.16Å; H969-Q973 PolarHBondContact O-N 3.47Å
970	V	93.6	Very high	90	Very high	1 Å²	1	14 Å²	14	1%	0.006	7%	0.072	C	C	.	.	H	α-helix	trans	-62.3	-45.7	177.1	171.2	0	0	0	0	111.2	L505 M510 A521 V874 F957 C966 I967 G974	L505-V970 HydrophobicContact CD2-CG2 4.39Å; M510-V970 HydrophobicContact CE-CG2 3.95Å; A521-V970 HydrophobicContact CB-CG1 3.69Å; V874-V970 HydrophobicContact CG1-CG1 4.02Å; F957-V970 HydrophobicContact CD1-CG2 4.31Å; F957-V970 HydrophobicContact CE1-CG1 4.45Å; F957-V970 HydrophobicContact CZ-CG1 4.45Å; C966-V970 WeakPolarHBondContact O-CG2 3.44Å; C966-V970 PolarHBondContact O-N 3.1Å; I967-V970 PolarHBondContact O-N 3.4Å; V970-G974 PolarHBondContact O-N 3.04Å
971	I	93.6	Very high	90.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-66.5	-44.7	177.9	-62.3	171	0	0	0	110.9	L857 I967 Q973 G974 R975 L1037	L857-I971 HydrophobicContact CD1-CD1 4.4Å; L857-I971 HydrophobicContact CD1-CG1 4.26Å; I967-I971 HydrophobicContact CG2-CD1 3.85Å; I967-I971 HydrophobicContact CG2-CG1 4.4Å; I967-I971 WeakPolarHBondContact O-CG1 3.44Å; I967-I971 PolarHBondContact O-N 3.01Å; I971-Q973 PolarHBondContact O-N 3.45Å; I971-G974 PolarHBondContact O-N 3.48Å; I971-R975 HydrophobicContact CG2-CG 4.29Å; I971-R975 WeakPolarHBondContact O-CB 3.46Å; I971-R975 WeakPolarHBondContact O-CG 3.1Å; I971-R975 PolarHBondContact O-N 2.96Å; I971-L1037 HydrophobicContact CB-CD1 4.38Å; I971-L1037 HydrophobicContact CG2-CD1 3.75Å; I971-L1037 HydrophobicContact CG2-CD2 4.47Å
972	K	92.8	Very high	90.3	Very high	18 Å²	18	12.4 Å²	12.4	8%	0.078	7%	0.066	C	C	.	.	H	α-helix	trans	-58.6	-49	177.9	-75.6	167.8	-169.8	174.5	0	111.3	E732 C968 H969 R975 C976 P1033 K1035 L1037	E732-K972 WeakPolarHBondContact OE1-CE 3.4Å; E732-K972 IonicContact OE1-NZ 2.94Å; E732-K972 PolarHBondContact OE1-NZ 3.32Å; E732-K972 IonicContact OE2-NZ 2.72Å; C968-K972 VanDerWaalsContact O-CB 3.26Å; C968-K972 WeakPolarHBondContact O-CB 3.41Å; C968-K972 WeakPolarHBondContact O-CD 3.3Å; C968-K972 WeakPolarHBondContact O-CG 3.24Å; C968-K972 PolarHBondContact O-N 2.84Å; H969-K972 PolarHBondContact O-N 3.16Å; K972-R975 PolarHBondContact O-N 3.33Å; K972-C976 PolarHBondContact O-N 3.03Å; K972-C976 VanDerWaalsContact O-N 3.07Å; K972-P1033 HydrophobicContact CB-CB 4.23Å; K972-K1035 WeakPolarHBondContact CE-O 3.41Å; K972-K1035 PolarHBondContact NZ-O 2.92Å; K972-L1037 HydrophobicContact CG-CD1 3.77Å
973	Q	92.9	Very high	90.6	Very high	11 Å²	11	12.1 Å²	12.1	5%	0.051	6%	0.063	C	C	.	.	H	α-helix	trans	-63.7	-45.7	177.3	-167.9	66.8	28.8	0	0	110.9	S501 L505 I518 H969 I971 R975 C976 T977	S501-Q973 PolarHBondContact OG-NE2 3.05Å; L505-Q973 HydrophobicContact CD1-CB 4.44Å; L505-Q973 HydrophobicContact CD1-CG 4.22Å; L505-Q973 HydrophobicContact CD2-CB 3.91Å; L505-Q973 HydrophobicContact CD2-CG 4.28Å; L505-Q973 HydrophobicContact CG-CB 4.18Å; L505-Q973 HydrophobicContact CG-CG 3.99Å; I518-Q973 HydrophobicContact CG2-CG 4.43Å; H969-Q973 WeakPolarHBondContact O-CB 3.16Å; H969-Q973 PolarHBondContact O-N 3.47Å; I971-Q973 PolarHBondContact O-N 3.45Å; Q973-R975 VanDerWaalsContact C-N 3.35Å; Q973-R975 PolarHBondContact O-N 2.93Å; Q973-C976 WeakPolarHBondContact O-CB 3.21Å; Q973-C976 PolarHBondContact O-N 3.01Å; Q973-C976 VanDerWaalsContact O-N 3.15Å; Q973-T977 PolarHBondContact O-N 3.06Å; Q973-T977 PolarHBondContact O-OG1 3.02Å
974	G	92.4	Very high	90.6	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60	-40.4	179	0	0	0	0	0	113.7	I518 V970 I971 L978	I518-G974 WeakPolarHBondContact O-CA 3.29Å; V970-G974 PolarHBondContact O-N 3.04Å; I971-G974 PolarHBondContact O-N 3.48Å; G974-L978 VanDerWaalsContact O-CB 3.23Å; G974-L978 WeakPolarHBondContact O-CB 3.28Å; G974-L978 PolarHBondContact O-N 2.77Å
975	R	91	Very high	90.4	Very high	3 Å²	3	12 Å²	12	1%	0.011	6%	0.06	C	C	.	.	H	α-helix	trans	-63.8	-44.5	173.6	-71.8	-177.3	179.4	-165.7	2.8	111.4	A736 H738 I971 K972 Q973 L978 V979 S1038 E1040 P1042 F1121	A736-R975 PolarHBondContact O-NH2 3.13Å; H738-R975 PolarHBondContact NE2-NH2 3.26Å; I971-R975 HydrophobicContact CG2-CG 4.29Å; I971-R975 WeakPolarHBondContact O-CB 3.46Å; I971-R975 WeakPolarHBondContact O-CG 3.1Å; I971-R975 PolarHBondContact O-N 2.96Å; K972-R975 PolarHBondContact O-N 3.33Å; Q973-R975 VanDerWaalsContact C-N 3.35Å; Q973-R975 PolarHBondContact O-N 2.93Å; R975-L978 PolarHBondContact O-N 3.02Å; R975-V979 VanDerWaalsContact O-CG2 3.26Å; R975-V979 WeakPolarHBondContact O-CG2 3.26Å; R975-V979 PolarHBondContact O-N 2.99Å; R975-S1038 PolarHBondContact NH1-O 3.25Å; R975-S1038 PolarHBondContact NH1-OG 3.47Å; R975-E1040 PolarHBondContact NH1-O 3.16Å; R975-P1042 HydrophobicContact CB-CG 4.43Å; R975-P1042 HydrophobicContact CG-CG 4.09Å; R975-F1121 HydrophobicContact CB-CD1 4.14Å
976	C	91.6	Very high	90.2	Very high	2 Å²	2	10 Å²	10	1%	0.014	5%	0.051	C	C	.	.	H	α-helix	trans	-58.9	-54.8	175.8	-175.5	0	0	0	0	110.9	K972 Q973 L978 V979 T980 P1033	K972-C976 PolarHBondContact O-N 3.03Å; K972-C976 VanDerWaalsContact O-N 3.07Å; Q973-C976 WeakPolarHBondContact O-CB 3.21Å; Q973-C976 PolarHBondContact O-N 3.01Å; Q973-C976 VanDerWaalsContact O-N 3.15Å; C976-L978 VanDerWaalsContact C-N 3.33Å; C976-L978 PolarHBondContact O-N 3.26Å; C976-V979 PolarHBondContact O-N 3.05Å; C976-T980 WeakPolarHBondContact O-CB 3.5Å; C976-T980 PolarHBondContact O-N 3.27Å; C976-T980 PolarHBondContact O-OG1 3.39Å; C976-P1033 HydrophobicContact CB-CB 3.89Å
977	T	90.7	Very high	90.1	Very high	2 Å²	2	9.7 Å²	9.7	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-58	-44	-179.9	-46.1	0	0	0	0	111.7	V498 S501 I518 P519 Q973 T980 T981	V498-T977 HydrophobicContact CG2-CG2 4.44Å; S501-T977 WeakPolarHBondContact CB-OG1 3.32Å; S501-T977 PolarHBondContact OG-OG1 3.01Å; I518-T977 HydrophobicContact CG2-CG2 4.4Å; P519-T977 HydrophobicContact CG-CG2 4.13Å; Q973-T977 PolarHBondContact O-N 3.06Å; Q973-T977 PolarHBondContact O-OG1 3.02Å; T977-T980 PolarHBondContact O-N 3.21Å; T977-T981 WeakPolarHBondContact O-CB 3.43Å; T977-T981 PolarHBondContact O-N 3.24Å; T977-T981 PolarHBondContact O-OG1 2.91Å; T977-T981 VanDerWaalsContact O-OG1 3.05Å
978	L	88.9	Confident	89.7	Confident	8 Å²	8	10.1 Å²	10.1	4%	0.042	5%	0.05	C	C	.	.	H	α-helix	trans	-62	-46.2	179.1	178.4	61.8	0	0	0	111.9	P519 K523 G974 R975 C976 T981 L982 P1042	P519-L978 HydrophobicContact CB-CD1 4.45Å; K523-L978 HydrophobicContact CD-CD2 4.45Å; K523-L978 HydrophobicContact CG-CD2 3.59Å; G974-L978 VanDerWaalsContact O-CB 3.23Å; G974-L978 WeakPolarHBondContact O-CB 3.28Å; G974-L978 PolarHBondContact O-N 2.77Å; R975-L978 PolarHBondContact O-N 3.02Å; C976-L978 VanDerWaalsContact C-N 3.33Å; C976-L978 PolarHBondContact O-N 3.26Å; L978-T981 PolarHBondContact O-N 3.39Å; L978-L982 HydrophobicContact CD1-CD1 4.41Å; L978-L982 HydrophobicContact CD1-CG 4.44Å; L978-L982 HydrophobicContact CG-CD1 4.28Å; L978-L982 VanDerWaalsContact O-CG 3.32Å; L978-L982 WeakPolarHBondContact O-CG 3.2Å; L978-L982 PolarHBondContact O-N 3.24Å; L978-P1042 HydrophobicContact CD2-CB 4.06Å; L978-P1042 HydrophobicContact CD2-CG 3.71Å
979	V	89.1	Confident	89.4	Confident	17 Å²	17	10.2 Å²	10.2	10%	0.103	5%	0.051	C	C	.	.	H	α-helix	trans	-66.4	-42.1	178.9	-179.8	0	0	0	0	110.8	R975 C976 T981 L982 Q983 P1042 F1121 M1122	R975-V979 VanDerWaalsContact O-CG2 3.26Å; R975-V979 WeakPolarHBondContact O-CG2 3.26Å; R975-V979 PolarHBondContact O-N 2.99Å; C976-V979 PolarHBondContact O-N 3.05Å; V979-T981 VanDerWaalsContact C-N 3.34Å; V979-T981 PolarHBondContact O-N 3.37Å; V979-L982 PolarHBondContact O-N 3.2Å; V979-Q983 HydrophobicContact CG1-CG 4.35Å; V979-Q983 VanDerWaalsContact O-CG 3.26Å; V979-Q983 WeakPolarHBondContact O-CG 3.22Å; V979-Q983 PolarHBondContact O-N 3.04Å; V979-P1042 HydrophobicContact CG2-CB 3.56Å; V979-F1121 HydrophobicContact CG2-CB 4.26Å; V979-F1121 HydrophobicContact CG2-CD2 3.73Å; V979-F1121 HydrophobicContact CG2-CE2 4.35Å; V979-F1121 HydrophobicContact CG2-CG 4.08Å; V979-M1122 HydrophobicContact CB-CE 3.47Å; V979-M1122 VanDerWaalsContact CB-CE 3.47Å; V979-M1122 HydrophobicContact CG1-CE 3.24Å
980	T	89.5	Confident	89.2	Confident	4 Å²	4	7.4 Å²	7.4	3%	0.025	4%	0.038	C	C	.	.	H	α-helix	trans	-56.9	-47.8	174.2	-58.1	0	0	0	0	110.7	C976 T977 L982 Q983 M984 I1028	C976-T980 WeakPolarHBondContact O-CB 3.5Å; C976-T980 PolarHBondContact O-N 3.27Å; C976-T980 PolarHBondContact O-OG1 3.39Å; T977-T980 PolarHBondContact O-N 3.21Å; T980-L982 PolarHBondContact O-N 3.1Å; T980-Q983 PolarHBondContact O-N 3.45Å; T980-M984 HydrophobicContact CG2-SD 4.06Å; T980-M984 WeakPolarHBondContact O-CG 3.21Å; T980-M984 PolarHBondContact O-N 3.12Å; T980-I1028 HydrophobicContact CG2-CG2 3.7Å
981	T	86.3	Confident	88.9	Confident	17 Å²	17	8 Å²	8	10%	0.104	4%	0.042	C	C	.	.	H	α-helix	trans	-59	-45.5	176.2	-65.4	0	0	0	0	112.5	L494 T977 L978 V979 Q983 M984 F985	L494-T981 HydrophobicContact CD2-CG2 3.42Å; L494-T981 VanDerWaalsContact CD2-CG2 3.42Å; T977-T981 WeakPolarHBondContact O-CB 3.43Å; T977-T981 PolarHBondContact O-N 3.24Å; T977-T981 PolarHBondContact O-OG1 2.91Å; T977-T981 VanDerWaalsContact O-OG1 3.05Å; L978-T981 PolarHBondContact O-N 3.39Å; V979-T981 VanDerWaalsContact C-N 3.34Å; V979-T981 PolarHBondContact O-N 3.37Å; T981-Q983 VanDerWaalsContact C-N 3.34Å; T981-Q983 PolarHBondContact O-N 3.37Å; T981-M984 PolarHBondContact O-N 3.31Å; T981-F985 HydrophobicContact CG2-CD2 3.85Å; T981-F985 HydrophobicContact CG2-CE2 3.51Å; T981-F985 WeakPolarHBondContact O-CD2 3.45Å; T981-F985 PolarHBondContact O-N 3.31Å; T981-F985 VanDerWaalsContact O-N 3.1Å
982	L	85.3	Confident	88.5	Confident	21 Å²	21	8.3 Å²	8.3	11%	0.11	4%	0.044	C	C	.	.	H	α-helix	trans	-64.5	-37	178.3	-69.8	171.6	0	0	0	112.8	L978 V979 T980 K986 L1043 I1046	L978-L982 HydrophobicContact CD1-CD1 4.41Å; L978-L982 HydrophobicContact CD1-CG 4.44Å; L978-L982 HydrophobicContact CG-CD1 4.28Å; L978-L982 VanDerWaalsContact O-CG 3.32Å; L978-L982 WeakPolarHBondContact O-CG 3.2Å; L978-L982 PolarHBondContact O-N 3.24Å; V979-L982 PolarHBondContact O-N 3.2Å; T980-L982 PolarHBondContact O-N 3.1Å; L982-K986 WeakPolarHBondContact O-CG 3.48Å; L982-K986 PolarHBondContact O-N 3.22Å; L982-L1043 HydrophobicContact CD1-CB 4.26Å; L982-L1043 VanDerWaalsContact CD1-O 3.25Å; L982-L1043 WeakPolarHBondContact CD1-O 3.43Å; L982-I1046 HydrophobicContact CD2-CB 4.34Å; L982-I1046 HydrophobicContact CD2-CG1 3.65Å
983	Q	88.1	Confident	88.1	Confident	8 Å²	8	7.8 Å²	7.8	4%	0.037	4%	0.042	C	C	.	.	H	α-helix	trans	-65.7	-43.1	175.3	-71.8	167.9	-5.2	0	0	111.4	V979 T980 T981 F985 K986 I987 K1117	V979-Q983 HydrophobicContact CG1-CG 4.35Å; V979-Q983 VanDerWaalsContact O-CG 3.26Å; V979-Q983 WeakPolarHBondContact O-CG 3.22Å; V979-Q983 PolarHBondContact O-N 3.04Å; T980-Q983 PolarHBondContact O-N 3.45Å; T981-Q983 VanDerWaalsContact C-N 3.34Å; T981-Q983 PolarHBondContact O-N 3.37Å; Q983-F985 VanDerWaalsContact C-N 3.34Å; Q983-F985 PolarHBondContact O-N 3.33Å; Q983-K986 WeakPolarHBondContact O-CB 3.19Å; Q983-K986 PolarHBondContact O-N 3.32Å; Q983-K986 VanDerWaalsContact O-N 3.12Å; Q983-I987 WeakPolarHBondContact O-CD1 3.08Å; Q983-I987 WeakPolarHBondContact O-CG1 3.49Å; Q983-I987 PolarHBondContact O-N 2.96Å; Q983-K1117 VanDerWaalsContact NE2-CA 3.34Å; Q983-K1117 VanDerWaalsContact NE2-CB 3.3Å; Q983-K1117 PolarHBondContact NE2-O 3.46Å
984	M	86.9	Confident	87.7	Confident	5 Å²	5	7.8 Å²	7.8	3%	0.025	4%	0.042	C	C	.	.	H	α-helix	trans	-58	-47.2	176.4	-66.4	170.9	88.9	0	0	110.6	E493 A497 T980 T981 K986 I987 L988 F1025 I1028	E493-M984 HydrophobicContact CB-CE 3.36Å; E493-M984 HydrophobicContact CG-CE 3.54Å; E493-M984 WeakPolarHBondContact OE2-CE 3.29Å; A497-M984 HydrophobicContact CB-SD 4.44Å; T980-M984 HydrophobicContact CG2-SD 4.06Å; T980-M984 WeakPolarHBondContact O-CG 3.21Å; T980-M984 PolarHBondContact O-N 3.12Å; T981-M984 PolarHBondContact O-N 3.31Å; M984-K986 VanDerWaalsContact C-N 3.32Å; M984-K986 PolarHBondContact O-N 2.94Å; M984-I987 PolarHBondContact O-N 2.84Å; M984-L988 VanDerWaalsContact O-CB 3.24Å; M984-L988 WeakPolarHBondContact O-CB 3.31Å; M984-L988 PolarHBondContact O-N 2.78Å; M984-F1025 HydrophobicContact CE-CD1 4.08Å; M984-F1025 HydrophobicContact CG-CD1 4.49Å; M984-I1028 HydrophobicContact CG-CG2 4.05Å
985	F	85.1	Confident	87.1	Confident	13 Å²	13	10.2 Å²	10.2	6%	0.057	6%	0.055	C	C	.	.	H	α-helix	trans	-57.9	-39.7	174.8	-78.8	-65.8	0	0	0	113.6	T441 F444 L490 L494 T981 Q983 A989 I1046	T441-F985 HydrophobicContact CG2-CE1 4.4Å; F444-F985 HydrophobicContact CD1-CD1 4.03Å; F444-F985 HydrophobicContact CD1-CE1 4.34Å; F444-F985 AromaticContact CE1-CD1 3.9Å; F444-F985 HydrophobicContact CE1-CD1 3.9Å; F444-F985 HydrophobicContact CZ-CD1 4.32Å; F444-F985 WeakPolarHBondContact CZ-O 3.39Å; L490-F985 HydrophobicContact CD1-CD1 4.14Å; L490-F985 HydrophobicContact CD1-CE1 3.72Å; L490-F985 HydrophobicContact CG-CE1 4.4Å; L494-F985 HydrophobicContact CD1-CZ 4.02Å; L494-F985 HydrophobicContact CD2-CE2 3.99Å; L494-F985 HydrophobicContact CD2-CZ 4.13Å; T981-F985 HydrophobicContact CG2-CD2 3.85Å; T981-F985 HydrophobicContact CG2-CE2 3.51Å; T981-F985 WeakPolarHBondContact O-CD2 3.45Å; T981-F985 PolarHBondContact O-N 3.31Å; T981-F985 VanDerWaalsContact O-N 3.1Å; Q983-F985 VanDerWaalsContact C-N 3.34Å; Q983-F985 PolarHBondContact O-N 3.33Å; F985-A989 WeakPolarHBondContact O-CB 3.12Å; F985-A989 PolarHBondContact O-N 3.46Å; F985-I1046 HydrophobicContact CB-CG2 4.38Å; F985-I1046 HydrophobicContact CD1-CD1 4.16Å; F985-I1046 HydrophobicContact CD2-CD1 3.47Å; F985-I1046 VanDerWaalsContact CD2-CD1 3.47Å; F985-I1046 HydrophobicContact CD2-CG1 3.92Å; F985-I1046 HydrophobicContact CE1-CD1 4.11Å; F985-I1046 HydrophobicContact CE2-CD1 3.44Å; F985-I1046 VanDerWaalsContact CE2-CD1 3.44Å; F985-I1046 HydrophobicContact CE2-CG1 4.27Å; F985-I1046 HydrophobicContact CG-CD1 3.86Å; F985-I1046 HydrophobicContact CG-CG1 4.36Å; F985-I1046 HydrophobicContact CZ-CD1 3.78Å
986	K	87.3	Confident	86.8	Confident	15 Å²	15	10.3 Å²	10.3	7%	0.065	6%	0.056	C	C	.	.	H	α-helix	trans	-65.3	-48.4	177.2	-74.9	-179.4	177.1	-169	0	112.3	L982 Q983 M984 L988 A989 L990 Y1050 T1051 T1054 V1055	L982-K986 WeakPolarHBondContact O-CG 3.48Å; L982-K986 PolarHBondContact O-N 3.22Å; Q983-K986 WeakPolarHBondContact O-CB 3.19Å; Q983-K986 PolarHBondContact O-N 3.32Å; Q983-K986 VanDerWaalsContact O-N 3.12Å; M984-K986 VanDerWaalsContact C-N 3.32Å; M984-K986 PolarHBondContact O-N 2.94Å; K986-L988 VanDerWaalsContact C-N 3.28Å; K986-L988 PolarHBondContact O-N 3.01Å; K986-A989 PolarHBondContact O-N 3.3Å; K986-L990 WeakPolarHBondContact O-CG 3.25Å; K986-L990 PolarHBondContact O-N 2.9Å; K986-L990 VanDerWaalsContact O-N 3.09Å; K986-Y1050 PolarHBondContact NZ-OH 2.93Å; K986-T1051 HydrophobicContact CD-CG2 4.36Å; K986-T1051 WeakPolarHBondContact CE-OG1 3.35Å; K986-T1051 HydrophobicContact CG-CG2 3.86Å; K986-T1054 HydrophobicContact CD-CG2 4.25Å; K986-V1055 HydrophobicContact CB-CG2 4.43Å; K986-V1055 HydrophobicContact CG-CG2 4.33Å
987	I	88.6	Confident	86.4	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.2	-44.3	179.9	-66.8	159.2	0	0	0	109.5	Q983 M984 A989 L990 N991 F1025 I1028 F1112 N1115	Q983-I987 WeakPolarHBondContact O-CD1 3.08Å; Q983-I987 WeakPolarHBondContact O-CG1 3.49Å; Q983-I987 PolarHBondContact O-N 2.96Å; M984-I987 PolarHBondContact O-N 2.84Å; I987-A989 PolarHBondContact O-N 3.5Å; I987-L990 PolarHBondContact O-N 3.27Å; I987-N991 WeakPolarHBondContact O-CB 3.31Å; I987-N991 VanDerWaalsContact O-CG 3.3Å; I987-N991 PolarHBondContact O-N 2.65Å; I987-F1025 HydrophobicContact CB-CE1 4.39Å; I987-F1025 HydrophobicContact CB-CZ 4.49Å; I987-F1025 HydrophobicContact CG2-CE1 4.04Å; I987-F1025 HydrophobicContact CG2-CZ 3.78Å; I987-I1028 HydrophobicContact CD1-CD1 3.88Å; I987-F1112 HydrophobicContact CD1-CD1 3.74Å; I987-F1112 HydrophobicContact CD1-CE1 4.13Å; I987-F1112 HydrophobicContact CG1-CD1 4.42Å; I987-F1112 HydrophobicContact CG2-CD1 3.9Å; I987-F1112 HydrophobicContact CG2-CE1 3.64Å; I987-F1112 HydrophobicContact CG2-CG 4.49Å; I987-F1112 HydrophobicContact CG2-CZ 3.99Å; I987-N1115 HydrophobicContact CD1-CB 4.38Å; I987-N1115 HydrophobicContact CG1-CB 3.85Å
988	L	85.5	Confident	86	Confident	8 Å²	8	12 Å²	12	4%	0.042	7%	0.065	C	C	.	.	H	α-helix	trans	-60.4	-44.8	177.6	-158.8	96.7	0	0	0	112.5	F444 P487 L490 M984 K986 L990 N991 A992 F1025	F444-L988 HydrophobicContact CE1-CD2 4.06Å; P487-L988 HydrophobicContact CB-CD1 4.13Å; P487-L988 HydrophobicContact CG-CD1 3.38Å; P487-L988 HydrophobicContact CG-CD2 3.38Å; P487-L988 HydrophobicContact CG-CG 3.4Å; P487-L988 VanDerWaalsContact CG-CG 3.4Å; L490-L988 HydrophobicContact CB-CD2 4.35Å; L490-L988 HydrophobicContact CD1-CD2 3.33Å; L490-L988 HydrophobicContact CG-CD2 4.38Å; M984-L988 VanDerWaalsContact O-CB 3.24Å; M984-L988 WeakPolarHBondContact O-CB 3.31Å; M984-L988 PolarHBondContact O-N 2.78Å; K986-L988 VanDerWaalsContact C-N 3.28Å; K986-L988 PolarHBondContact O-N 3.01Å; L988-L990 VanDerWaalsContact C-N 3.34Å; L988-L990 PolarHBondContact O-N 3Å; L988-N991 PolarHBondContact O-N 3.42Å; L988-A992 VanDerWaalsContact O-CB 3.29Å; L988-A992 WeakPolarHBondContact O-CB 3.3Å; L988-A992 PolarHBondContact O-N 2.98Å; L988-F1025 HydrophobicContact CD1-CZ 4.37Å
989	A	86.3	Confident	85.4	Confident	2 Å²	2	13.9 Å²	13.9	2%	0.017	7%	0.073	C	C	.	.	H	α-helix	trans	-59.4	-46	177.2	0	0	0	0	0	111.7	F444 L448 F985 K986 I987 A992 L993 V1055	F444-A989 HydrophobicContact CE2-CB 3.81Å; F444-A989 HydrophobicContact CZ-CB 3.71Å; L448-A989 HydrophobicContact CD2-CB 4.19Å; F985-A989 WeakPolarHBondContact O-CB 3.12Å; F985-A989 PolarHBondContact O-N 3.46Å; K986-A989 PolarHBondContact O-N 3.3Å; I987-A989 PolarHBondContact O-N 3.5Å; A989-A992 PolarHBondContact O-N 3.04Å; A989-L993 VanDerWaalsContact O-CG 3.28Å; A989-L993 WeakPolarHBondContact O-CG 3.44Å; A989-L993 PolarHBondContact O-N 3.34Å; A989-V1055 HydrophobicContact CB-CG1 3.91Å; A989-V1055 HydrophobicContact CB-CG2 4.3Å
990	L	88.7	Confident	85.1	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-64.1	-47	179.5	-74.4	162	0	0	0	111.5	K986 I987 L988 A992 L993 I994 V1055 Q1058 F1059 T1111 N1115	K986-L990 WeakPolarHBondContact O-CG 3.25Å; K986-L990 PolarHBondContact O-N 2.9Å; K986-L990 VanDerWaalsContact O-N 3.09Å; I987-L990 PolarHBondContact O-N 3.27Å; L988-L990 VanDerWaalsContact C-N 3.34Å; L988-L990 PolarHBondContact O-N 3Å; L990-A992 VanDerWaalsContact C-N 3.33Å; L990-A992 PolarHBondContact O-N 3.18Å; L990-L993 PolarHBondContact O-N 3.18Å; L990-I994 VanDerWaalsContact O-CG1 3.3Å; L990-I994 WeakPolarHBondContact O-CG1 3.32Å; L990-I994 PolarHBondContact O-N 3.43Å; L990-V1055 HydrophobicContact CD2-CB 4.5Å; L990-V1055 HydrophobicContact CD2-CG1 4.08Å; L990-V1055 VanDerWaalsContact CD2-O 3.27Å; L990-V1055 WeakPolarHBondContact CD2-O 3.49Å; L990-V1055 HydrophobicContact CG-CG1 4.19Å; L990-V1055 HydrophobicContact CG-CG2 4.44Å; L990-Q1058 HydrophobicContact CD1-CB 4.46Å; L990-Q1058 HydrophobicContact CD2-CB 3.79Å; L990-F1059 HydrophobicContact CD2-CB 4.17Å; L990-T1111 HydrophobicContact CB-CG2 4.09Å; L990-T1111 HydrophobicContact CD1-CG2 4.09Å; L990-N1115 VanDerWaalsContact CD1-ND2 3.29Å; L990-N1115 WeakPolarHBondContact CD1-ND2 3.44Å
991	N	86.2	Confident	84.7	Confident	15 Å²	15	14.6 Å²	14.6	8%	0.08	8%	0.078	C	C	.	.	H	α-helix	trans	-63.2	-40.9	178.8	-70.5	-7.8	0	0	0	111.4	I987 L988 I994 L995 T1111	I987-N991 WeakPolarHBondContact O-CB 3.31Å; I987-N991 VanDerWaalsContact O-CG 3.3Å; I987-N991 PolarHBondContact O-N 2.65Å; L988-N991 PolarHBondContact O-N 3.42Å; N991-I994 PolarHBondContact O-N 2.88Å; N991-L995 WeakPolarHBondContact O-CB 3.41Å; N991-L995 PolarHBondContact O-N 3.4Å; N991-T1111 PolarHBondContact OD1-OG1 2.99Å
992	A	84.6	Confident	84.4	Confident	6 Å²	6	13.9 Å²	13.9	5%	0.05	7%	0.073	C	C	.	.	H	α-helix	trans	-63.2	-41.1	176.3	0	0	0	0	0	112.3	L448 L988 A989 L990 L995 A996	L448-A992 HydrophobicContact CD1-CB 4.35Å; L988-A992 VanDerWaalsContact O-CB 3.29Å; L988-A992 WeakPolarHBondContact O-CB 3.3Å; L988-A992 PolarHBondContact O-N 2.98Å; A989-A992 PolarHBondContact O-N 3.04Å; L990-A992 VanDerWaalsContact C-N 3.33Å; L990-A992 PolarHBondContact O-N 3.18Å; A992-L995 PolarHBondContact O-N 3.33Å; A992-A996 VanDerWaalsContact O-CB 3.31Å; A992-A996 WeakPolarHBondContact O-CB 3.16Å; A992-A996 PolarHBondContact O-N 3.17Å
993	L	85.1	Confident	84.1	Confident	7 Å²	7	14.6 Å²	14.6	4%	0.037	7%	0.074	C	C	.	.	H	α-helix	trans	-68.4	-42	177.6	-70.4	169.8	0	0	0	112.4	L448 F451 A989 L990 L995 A996 Y997 V1055 M1056 F1059	L448-L993 HydrophobicContact CD2-CG 4.45Å; F451-L993 HydrophobicContact CB-CD2 3.75Å; F451-L993 HydrophobicContact CD1-CD2 4.14Å; F451-L993 HydrophobicContact CD2-CD2 3.86Å; F451-L993 HydrophobicContact CG-CD2 3.64Å; A989-L993 VanDerWaalsContact O-CG 3.28Å; A989-L993 WeakPolarHBondContact O-CG 3.44Å; A989-L993 PolarHBondContact O-N 3.34Å; L990-L993 PolarHBondContact O-N 3.18Å; L993-L995 VanDerWaalsContact C-N 3.34Å; L993-A996 PolarHBondContact O-N 3.4Å; L993-Y997 PolarHBondContact O-N 2.82Å; L993-V1055 HydrophobicContact CD1-CG1 3.91Å; L993-M1056 HydrophobicContact CD1-CE 3.59Å; L993-F1059 HydrophobicContact CB-CD2 3.55Å; L993-F1059 HydrophobicContact CB-CE2 3.71Å; L993-F1059 HydrophobicContact CB-CG 4.21Å; L993-F1059 HydrophobicContact CB-CZ 4.48Å; L993-F1059 HydrophobicContact CD1-CB 4.31Å; L993-F1059 HydrophobicContact CD1-CD2 4.35Å; L993-F1059 HydrophobicContact CD1-CG 4.18Å
994	I	84.5	Confident	83.5	Confident	10 Å²	10	14.9 Å²	14.9	5%	0.051	8%	0.076	C	C	.	.	H	α-helix	trans	-63.1	-43.9	175.2	-66.9	166.6	0	0	0	110	L990 N991 Y997 S998 F1059 H1062	L990-I994 VanDerWaalsContact O-CG1 3.3Å; L990-I994 WeakPolarHBondContact O-CG1 3.32Å; L990-I994 PolarHBondContact O-N 3.43Å; N991-I994 PolarHBondContact O-N 2.88Å; I994-Y997 PolarHBondContact O-N 2.87Å; I994-S998 PolarHBondContact O-N 3.27Å; I994-F1059 HydrophobicContact CG1-CD2 4.46Å; I994-H1062 HydrophobicContact CD1-CB 4.28Å
995	L	81.1	Confident	83	Confident	51 Å²	51	17.9 Å²	17.9	27%	0.267	9%	0.09	S	C	.	.	H	α-helix	trans	-63.5	-43.2	177.7	-173.8	66.2	0	0	0	111.7	N991 A992 L993 Y997 S998 Q999	N991-L995 WeakPolarHBondContact O-CB 3.41Å; N991-L995 PolarHBondContact O-N 3.4Å; A992-L995 PolarHBondContact O-N 3.33Å; L993-L995 VanDerWaalsContact C-N 3.34Å; L995-Y997 VanDerWaalsContact C-N 3.28Å; L995-Y997 PolarHBondContact O-N 2.95Å; L995-S998 PolarHBondContact O-N 2.89Å; L995-Q999 HydrophobicContact CD1-CG 4.14Å; L995-Q999 HydrophobicContact CG-CG 4.31Å; L995-Q999 WeakPolarHBondContact O-CB 3.41Å; L995-Q999 WeakPolarHBondContact O-CG 3.24Å; L995-Q999 PolarHBondContact O-N 3.48Å
996	A	83.5	Confident	82.4	Confident	5 Å²	5	18.7 Å²	18.7	4%	0.041	10%	0.103	C	C	.	.	H	α-helix	trans	-59.8	-37.5	177.5	0	0	0	0	0	112.4	V485 A992 L993 S1000	V485-A996 HydrophobicContact CG2-CB 4.02Å; A992-A996 VanDerWaalsContact O-CB 3.31Å; A992-A996 WeakPolarHBondContact O-CB 3.16Å; A992-A996 PolarHBondContact O-N 3.17Å; L993-A996 PolarHBondContact O-N 3.4Å; A996-S1000 VanDerWaalsContact O-CB 3.29Å; A996-S1000 WeakPolarHBondContact O-CB 3.43Å; A996-S1000 PolarHBondContact O-N 3.06Å; A996-S1000 PolarHBondContact O-OG 3.41Å
997	Y	83.2	Confident	82	Confident	27 Å²	27	18.5 Å²	18.5	11%	0.106	10%	0.103	C	C	.	.	H	α-helix	trans	-69	-46.2	173.7	176.5	-105.3	0	0	0	112.4	L993 I994 L995 Q999 S1000 V1001 L1002 F1063 L1066 V1067	L993-Y997 PolarHBondContact O-N 2.82Å; I994-Y997 PolarHBondContact O-N 2.87Å; L995-Y997 VanDerWaalsContact C-N 3.28Å; L995-Y997 PolarHBondContact O-N 2.95Å; Y997-Q999 VanDerWaalsContact C-N 3.29Å; Y997-Q999 PolarHBondContact O-N 2.83Å; Y997-S1000 WeakPolarHBondContact CA-OG 3.4Å; Y997-S1000 PolarHBondContact O-N 3.42Å; Y997-S1000 VanDerWaalsContact O-N 3.12Å; Y997-S1000 PolarHBondContact O-OG 3.22Å; Y997-S1000 VanDerWaalsContact O-OG 3.11Å; Y997-V1001 HydrophobicContact CD2-CB 4.05Å; Y997-V1001 HydrophobicContact CD2-CG2 3.79Å; Y997-V1001 HydrophobicContact CE2-CB 3.53Å; Y997-V1001 HydrophobicContact CE2-CG1 4.06Å; Y997-V1001 HydrophobicContact CE2-CG2 3.49Å; Y997-V1001 VanDerWaalsContact CE2-CG2 3.49Å; Y997-V1001 PolarHBondContact O-N 2.62Å; Y997-L1002 HydrophobicContact CD1-CD1 4.34Å; Y997-L1002 HydrophobicContact CD1-CG 4.39Å; Y997-L1002 HydrophobicContact CE1-CD1 4.01Å; Y997-L1002 HydrophobicContact CE1-CD2 4.17Å; Y997-L1002 HydrophobicContact CE1-CG 3.87Å; Y997-F1063 HydrophobicContact CD1-CD2 4.31Å; Y997-F1063 HydrophobicContact CD1-CE2 4.38Å; Y997-F1063 AromaticContact CD2-CD2 3.98Å; Y997-F1063 HydrophobicContact CD2-CD2 3.98Å; Y997-F1063 AromaticContact CD2-CE2 3.36Å; Y997-F1063 HydrophobicContact CD2-CE2 3.36Å; Y997-F1063 HydrophobicContact CD2-CZ 4.4Å; Y997-F1063 HydrophobicContact CE1-CD2 4.48Å; Y997-F1063 HydrophobicContact CE1-CE2 4.34Å; Y997-F1063 HydrophobicContact CE2-CD2 4.13Å; Y997-F1063 AromaticContact CE2-CE2 3.29Å; Y997-F1063 HydrophobicContact CE2-CE2 3.29Å; Y997-F1063 AromaticContact CE2-CZ 3.98Å; Y997-F1063 HydrophobicContact CE2-CZ 3.98Å; Y997-F1063 HydrophobicContact CG-CD2 4.03Å; Y997-F1063 AromaticContact CG-CE2 3.9Å; Y997-F1063 HydrophobicContact CG-CE2 3.9Å; Y997-F1063 AromaticContact CZ-CE2 3.82Å; Y997-L1066 HydrophobicContact CD1-CD2 3.41Å; Y997-L1066 VanDerWaalsContact CD1-CD2 3.41Å; Y997-L1066 HydrophobicContact CD1-CG 4.26Å; Y997-L1066 HydrophobicContact CE1-CD2 3.55Å; Y997-L1066 HydrophobicContact CE1-CG 3.87Å; Y997-V1067 WeakPolarHBondContact OH-CG2 3.29Å
998	S	81.6	Confident	81.4	Confident	14 Å²	14	21.4 Å²	21.4	10%	0.098	12%	0.115	C	C	.	.	I	π-helix	trans	-59	-42	178.3	-170.5	0	0	0	0	111.9	I994 L995 S1000 L1002 Y1003	I994-S998 PolarHBondContact O-N 3.27Å; L995-S998 PolarHBondContact O-N 2.89Å; S998-S1000 VanDerWaalsContact C-N 3.3Å; S998-S1000 PolarHBondContact O-N 2.9Å; S998-L1002 WeakPolarHBondContact O-CB 3.42Å; S998-Y1003 PolarHBondContact O-N 3.4Å
999	Q	77.6	Confident	81	Confident	47 Å²	47	23.5 Å²	23.5	22%	0.22	12%	0.124	C	C	.	.	I	π-helix	trans	-80.1	-8	-179.8	-68.6	-177.3	-31.3	0	0	113.6	I481 S484 L995 Y997 Y1003	I481-Q999 WeakPolarHBondContact CD1-O 3.47Å; I481-Q999 HydrophobicContact CG1-CB 3.99Å; S484-Q999 PolarHBondContact OG-OE1 2.92Å; L995-Q999 HydrophobicContact CD1-CG 4.14Å; L995-Q999 HydrophobicContact CG-CG 4.31Å; L995-Q999 WeakPolarHBondContact O-CB 3.41Å; L995-Q999 WeakPolarHBondContact O-CG 3.24Å; L995-Q999 PolarHBondContact O-N 3.48Å; Y997-Q999 VanDerWaalsContact C-N 3.29Å; Y997-Q999 PolarHBondContact O-N 2.83Å; Q999-Y1003 WeakPolarHBondContact O-CB 3.45Å
1000	S	82.2	Confident	80.7	Confident	5 Å²	5	24.8 Å²	24.8	4%	0.035	13%	0.133	C	C	.	.	I	π-helix	trans	-103.7	-72.1	177.4	53.1	0	0	0	0	112.8	V459 A996 Y997 S998 L1004	V459-S1000 VanDerWaalsContact CG2-CA 3.44Å; A996-S1000 VanDerWaalsContact O-CB 3.29Å; A996-S1000 WeakPolarHBondContact O-CB 3.43Å; A996-S1000 PolarHBondContact O-N 3.06Å; A996-S1000 PolarHBondContact O-OG 3.41Å; Y997-S1000 WeakPolarHBondContact CA-OG 3.4Å; Y997-S1000 PolarHBondContact O-N 3.42Å; Y997-S1000 VanDerWaalsContact O-N 3.12Å; Y997-S1000 PolarHBondContact O-OG 3.22Å; Y997-S1000 VanDerWaalsContact O-OG 3.11Å; S998-S1000 VanDerWaalsContact C-N 3.3Å; S998-S1000 PolarHBondContact O-N 2.9Å; S1000-L1004 WeakPolarHBondContact O-CG 3.44Å; S1000-L1004 PolarHBondContact O-N 2.87Å
1001	V	80.9	Confident	80.2	Confident	31 Å²	31	28.2 Å²	28.2	19%	0.188	15%	0.151	C	C	.	.	I	π-helix	trans	-76.8	-48.5	-172	-177.5	0	0	0	0	111.1	Y458 Y997 Y1003 L1004 E1005	Y458-V1001 HydrophobicContact CD1-CG2 4.07Å; Y458-V1001 HydrophobicContact CE1-CB 4.42Å; Y458-V1001 HydrophobicContact CE1-CG2 3.7Å; Y997-V1001 HydrophobicContact CD2-CB 4.05Å; Y997-V1001 HydrophobicContact CD2-CG2 3.79Å; Y997-V1001 HydrophobicContact CE2-CB 3.53Å; Y997-V1001 HydrophobicContact CE2-CG1 4.06Å; Y997-V1001 HydrophobicContact CE2-CG2 3.49Å; Y997-V1001 VanDerWaalsContact CE2-CG2 3.49Å; Y997-V1001 PolarHBondContact O-N 2.62Å; V1001-Y1003 VanDerWaalsContact C-N 3.32Å; V1001-Y1003 PolarHBondContact O-N 3.33Å; V1001-L1004 PolarHBondContact O-N 3.44Å; V1001-E1005 WeakPolarHBondContact O-CG 3.46Å; V1001-E1005 PolarHBondContact O-N 3.2Å
1002	L	80.1	Confident	79.8	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.169	C	C	.	.	I	π-helix	trans	-69.7	-33.1	-176.6	-58.7	-178.8	0	0	0	112.1	Y997 S998 E1005 G1006 V1007 L1066 Y1070 V1100	Y997-L1002 HydrophobicContact CD1-CD1 4.34Å; Y997-L1002 HydrophobicContact CD1-CG 4.39Å; Y997-L1002 HydrophobicContact CE1-CD1 4.01Å; Y997-L1002 HydrophobicContact CE1-CD2 4.17Å; Y997-L1002 HydrophobicContact CE1-CG 3.87Å; S998-L1002 WeakPolarHBondContact O-CB 3.42Å; L1002-E1005 PolarHBondContact O-N 2.93Å; L1002-G1006 PolarHBondContact O-N 3.21Å; L1002-V1007 HydrophobicContact CB-CB 4.18Å; L1002-V1007 HydrophobicContact CB-CG2 4.46Å; L1002-V1007 WeakPolarHBondContact O-CB 3.46Å; L1002-V1007 PolarHBondContact O-N 3.01Å; L1002-L1066 HydrophobicContact CD1-CD1 4.09Å; L1002-L1066 HydrophobicContact CD1-CD2 4.25Å; L1002-L1066 HydrophobicContact CD1-CG 4.36Å; L1002-Y1070 HydrophobicContact CD2-CD2 3.65Å; L1002-Y1070 HydrophobicContact CD2-CE2 3.95Å; L1002-Y1070 HydrophobicContact CD2-CG 3.98Å; L1002-V1100 HydrophobicContact CD1-CG1 3.65Å; L1002-V1100 HydrophobicContact CD1-CG2 4.31Å
1003	Y	78.3	Confident	79.8	Confident	36 Å²	36	32 Å²	32	14%	0.141	17%	0.166	C	C	.	.	H	α-helix	trans	-60.4	-47.6	172.7	-179.7	-99.7	0	0	0	112	E477 S998 Q999 V1001 E1005 G1006 K1008 L1087	E477-Y1003 HydrophobicContact CB-CE1 4.47Å; E477-Y1003 VanDerWaalsContact CD-CZ 3.44Å; E477-Y1003 VanDerWaalsContact CD-OH 3.25Å; E477-Y1003 HydrophobicContact CG-CE1 3.75Å; E477-Y1003 PolarHBondContact OE1-OH 3.49Å; S998-Y1003 PolarHBondContact O-N 3.4Å; Q999-Y1003 WeakPolarHBondContact O-CB 3.45Å; V1001-Y1003 VanDerWaalsContact C-N 3.32Å; V1001-Y1003 PolarHBondContact O-N 3.33Å; Y1003-E1005 PolarHBondContact O-N 3.01Å; Y1003-E1005 VanDerWaalsContact O-N 3.16Å; Y1003-G1006 PolarHBondContact O-N 3.07Å; Y1003-K1008 HydrophobicContact CE2-CG 4.4Å; Y1003-L1087 HydrophobicContact CD1-CD1 4.47Å; Y1003-L1087 HydrophobicContact CE1-CD1 3.99Å; Y1003-L1087 WeakPolarHBondContact O-CD2 3.47Å
1004	L	77.1	Confident	79.5	Confident	15 Å²	15	34 Å²	34	8%	0.079	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-25.3	178	-76.2	172.6	0	0	0	113.7	Y458 V459 E462 S1000 V1001 G1006 L1087	Y458-L1004 HydrophobicContact CD1-CD1 4.2Å; Y458-L1004 HydrophobicContact CE1-CD1 3.82Å; V459-L1004 HydrophobicContact CB-CD1 4.46Å; V459-L1004 HydrophobicContact CG1-CD2 4.34Å; V459-L1004 HydrophobicContact CG2-CD1 4.11Å; V459-L1004 HydrophobicContact CG2-CG 4.44Å; E462-L1004 HydrophobicContact CB-CD1 3.79Å; E462-L1004 HydrophobicContact CG-CD1 4.18Å; S1000-L1004 WeakPolarHBondContact O-CG 3.44Å; S1000-L1004 PolarHBondContact O-N 2.87Å; V1001-L1004 PolarHBondContact O-N 3.44Å; L1004-G1006 VanDerWaalsContact C-N 3.28Å; L1004-L1087 HydrophobicContact CD2-CD1 4.42Å
1005	E	75.3	Confident	79.3	Confident	67 Å²	67	37.7 Å²	37.7	31%	0.313	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0	176.3	-68.4	-71.6	161.5	0	0	113.2	V1001 L1002 Y1003 Y1070 K1080	V1001-E1005 WeakPolarHBondContact O-CG 3.46Å; V1001-E1005 PolarHBondContact O-N 3.2Å; L1002-E1005 PolarHBondContact O-N 2.93Å; Y1003-E1005 PolarHBondContact O-N 3.01Å; Y1003-E1005 VanDerWaalsContact O-N 3.16Å; E1005-Y1070 HydrophobicContact CB-CE2 4.44Å; E1005-Y1070 VanDerWaalsContact CB-OH 3.26Å; E1005-Y1070 WeakPolarHBondContact CB-OH 3.4Å; E1005-Y1070 VanDerWaalsContact CD-OH 3.29Å; E1005-Y1070 WeakPolarHBondContact CG-OH 3.27Å; E1005-Y1070 PolarHBondContact OE2-OH 2.81Å; E1005-K1080 IonicContact OE2-NZ 3.95Å; E1005-K1080 PolarHBondContact OE2-NZ 3.5Å
1006	G	73.8	Confident	79.4	Confident	31 Å²	31	37.3 Å²	37.3	32%	0.32	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	14.2	177.4	0	0	0	0	0	115.1	L1002 Y1003 L1004 K1008	L1002-G1006 PolarHBondContact O-N 3.21Å; Y1003-G1006 PolarHBondContact O-N 3.07Å; L1004-G1006 VanDerWaalsContact C-N 3.28Å; G1006-K1008 PolarHBondContact O-N 3.08Å
1007	V	77.6	Confident	79.4	Confident	11 Å²	11	38.1 Å²	38.1	7%	0.067	21%	0.208	C	C	.	.			trans	-85.9	112.9	177.7	-174.7	0	0	0	0	109.8	L1002 Y1070 V1096 N1097 V1100	L1002-V1007 HydrophobicContact CB-CB 4.18Å; L1002-V1007 HydrophobicContact CB-CG2 4.46Å; L1002-V1007 WeakPolarHBondContact O-CB 3.46Å; L1002-V1007 PolarHBondContact O-N 3.01Å; V1007-Y1070 HydrophobicContact CG2-CE2 4.27Å; V1007-V1096 HydrophobicContact CG2-CG1 3.68Å; V1007-N1097 HydrophobicContact CG1-CB 4.47Å; V1007-V1100 HydrophobicContact CG1-CB 4.04Å; V1007-V1100 HydrophobicContact CG1-CG1 4Å; V1007-V1100 HydrophobicContact CG1-CG2 4.28Å
1008	K	75.6	Confident	79.3	Confident	60 Å²	60	38.7 Å²	38.7	26%	0.261	22%	0.222	S	C	.	.			trans	-126.6	137.6	178.4	-65.1	-177.5	-179.2	178.9	0	111.3	Y1003 G1006 L1087 K1089 F1091 N1097	Y1003-K1008 HydrophobicContact CE2-CG 4.4Å; G1006-K1008 PolarHBondContact O-N 3.08Å; K1008-L1087 WeakPolarHBondContact CE-O 3.39Å; K1008-L1087 PolarHBondContact NZ-O 2.74Å; K1008-K1089 PolarHBondContact NZ-O 3.39Å; K1008-K1089 VanDerWaalsContact NZ-O 3.1Å; K1008-F1091 WeakPolarHBondContact O-CD2 3.34Å; K1008-F1091 WeakPolarHBondContact O-CE2 3.34Å; K1008-N1097 PolarHBondContact O-ND2 3.39Å; K1008-N1097 PolarHBondContact O-OD1 3.11Å
1009	F	78.3	Confident	79.4	Confident	53 Å²	53	44 Å²	44	23%	0.232	25%	0.248	C	C	.	.			trans	-82.8	149.6	172.9	-55.1	-41.2	0	0	0	111.6	V1100 Y1101 A1104	F1009-V1100 HydrophobicContact CE1-CG1 4.03Å; F1009-V1100 HydrophobicContact CZ-CG1 4.11Å; F1009-Y1101 HydrophobicContact CD1-CD2 4.1Å; F1009-Y1101 HydrophobicContact CE1-CD2 4.35Å; F1009-A1104 HydrophobicContact CZ-CB 4.48Å
1010	S	80.4	Confident	79.6	Confident	29 Å²	29	43 Å²	43	20%	0.203	24%	0.244	C	C	.	.			trans	-74.7	150.3	170.5	172.6	0	0	0	0	110.9	F1012 Q1013 A1014	S1010-F1012 PolarHBondContact O-N 2.96Å; S1010-Q1013 WeakPolarHBondContact O-CA 3.23Å; S1010-Q1013 VanDerWaalsContact O-CB 3.3Å; S1010-Q1013 WeakPolarHBondContact O-CB 3.35Å; S1010-Q1013 PolarHBondContact O-N 2.73Å; S1010-A1014 PolarHBondContact O-N 3.05Å
1011	D	76.7	Confident	79.7	Confident	72 Å²	72	44.5 Å²	44.5	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-52.8	-38.6	176.2	-72.4	9.6	0	0	0	112.7	Y261 Y262 T1015	Y261-D1011 PolarHBondContact OH-OD2 2.73Å; Y262-D1011 VanDerWaalsContact OH-CG 3.24Å; Y262-D1011 PolarHBondContact OH-OD2 3.15Å; D1011-T1015 WeakPolarHBondContact O-CB 3.42Å; D1011-T1015 PolarHBondContact O-N 2.82Å; D1011-T1015 PolarHBondContact O-OG1 3.44Å
1012	F	79.1	Confident	79.7	Confident	101 Å²	101	45.8 Å²	45.8	44%	0.443	27%	0.265	S	S	.	.	H	α-helix	trans	-70.8	-38.5	178.2	-168.4	-115	0	0	0	112.2	S1010 T1015 L1016 F1157	S1010-F1012 PolarHBondContact O-N 2.96Å; F1012-T1015 PolarHBondContact O-N 3.44Å; F1012-L1016 PolarHBondContact O-N 3.03Å; F1012-F1157 AromaticContact CD1-CD1 3.95Å; F1012-F1157 HydrophobicContact CD1-CD1 3.95Å; F1012-F1157 HydrophobicContact CD1-CD2 4.37Å; F1012-F1157 AromaticContact CD1-CE1 3.75Å; F1012-F1157 HydrophobicContact CD1-CE1 3.75Å; F1012-F1157 HydrophobicContact CD1-CE2 4.2Å; F1012-F1157 HydrophobicContact CD1-CG 4.27Å; F1012-F1157 AromaticContact CD1-CZ 3.9Å; F1012-F1157 HydrophobicContact CD1-CZ 3.9Å; F1012-F1157 HydrophobicContact CE1-CD1 4.16Å; F1012-F1157 HydrophobicContact CE1-CD2 4.01Å; F1012-F1157 AromaticContact CE1-CE1 3.64Å; F1012-F1157 HydrophobicContact CE1-CE1 3.64Å; F1012-F1157 AromaticContact CE1-CE2 3.47Å; F1012-F1157 HydrophobicContact CE1-CE2 3.47Å; F1012-F1157 VanDerWaalsContact CE1-CE2 3.47Å; F1012-F1157 HydrophobicContact CE1-CG 4.34Å; F1012-F1157 AromaticContact CE1-CZ 3.28Å; F1012-F1157 HydrophobicContact CE1-CZ 3.28Å; F1012-F1157 HydrophobicContact CZ-CE2 4.44Å; F1012-F1157 HydrophobicContact CZ-CZ 4.17Å
1013	Q	83.8	Confident	79.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-46	175.4	-73.3	174.1	-8.4	0	0	111.2	S1010 Q1017 Y1101 F1157	S1010-Q1013 WeakPolarHBondContact O-CA 3.23Å; S1010-Q1013 VanDerWaalsContact O-CB 3.3Å; S1010-Q1013 WeakPolarHBondContact O-CB 3.35Å; S1010-Q1013 PolarHBondContact O-N 2.73Å; Q1013-Q1017 VanDerWaalsContact O-CB 3.31Å; Q1013-Q1017 WeakPolarHBondContact O-CB 3.31Å; Q1013-Q1017 PolarHBondContact O-N 3.39Å; Q1013-Q1017 VanDerWaalsContact O-N 3.13Å; Q1013-Y1101 HydrophobicContact CB-CD2 3.95Å; Q1013-Y1101 HydrophobicContact CB-CE1 4.3Å; Q1013-Y1101 HydrophobicContact CB-CE2 3.49Å; Q1013-Y1101 VanDerWaalsContact CB-CE2 3.49Å; Q1013-Y1101 HydrophobicContact CG-CD1 4.28Å; Q1013-Y1101 HydrophobicContact CG-CD2 4.31Å; Q1013-Y1101 HydrophobicContact CG-CE1 4.02Å; Q1013-Y1101 HydrophobicContact CG-CE2 4.08Å; Q1013-Y1101 HydrophobicContact CG-CG 4.4Å; Q1013-Y1101 PolarHBondContact O-OH 3.05Å; Q1013-F1157 HydrophobicContact CG-CD1 4.39Å; Q1013-F1157 PolarHBondContact NE2-O 2.74Å
1014	A	78.5	Confident	80.3	Confident	49 Å²	49	45 Å²	45	41%	0.405	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-39.6	177.6	0	0	0	0	0	112.5	S1010 Q1017 G1018	S1010-A1014 PolarHBondContact O-N 3.05Å; A1014-Q1017 PolarHBondContact O-N 2.72Å; A1014-G1018 PolarHBondContact O-N 3.4Å
1015	T	81.4	Confident	80.7	Confident	86 Å²	86	44.9 Å²	44.9	53%	0.528	27%	0.268	S	S	.	.	H	α-helix	trans	-64.7	-46.7	178.4	-58.9	0	0	0	0	112	D1011 F1012 G1018 L1019	D1011-T1015 WeakPolarHBondContact O-CB 3.42Å; D1011-T1015 PolarHBondContact O-N 2.82Å; D1011-T1015 PolarHBondContact O-OG1 3.44Å; F1012-T1015 PolarHBondContact O-N 3.44Å; T1015-G1018 PolarHBondContact O-N 3.07Å; T1015-L1019 PolarHBondContact O-N 2.9Å
1016	L	82.7	Confident	81.1	Confident	44 Å²	44	45 Å²	45	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-44	178.1	-179.7	67.9	0	0	0	111.3	F1012 G1018 L1019 L1020 F1157	F1012-L1016 PolarHBondContact O-N 3.03Å; L1016-G1018 VanDerWaalsContact C-N 3.34Å; L1016-G1018 PolarHBondContact O-N 2.84Å; L1016-L1019 PolarHBondContact O-N 3.39Å; L1016-L1020 HydrophobicContact CD1-CD1 4.2Å; L1016-L1020 HydrophobicContact CD1-CG 4.26Å; L1016-L1020 HydrophobicContact CD2-CD1 4.45Å; L1016-L1020 HydrophobicContact CG-CD1 3.99Å; L1016-L1020 HydrophobicContact CG-CG 4.41Å; L1016-L1020 WeakPolarHBondContact O-CG 3.15Å; L1016-L1020 PolarHBondContact O-N 3.06Å; L1016-F1157 HydrophobicContact CB-CE1 4.48Å; L1016-F1157 HydrophobicContact CD2-CE1 3.48Å; L1016-F1157 VanDerWaalsContact CD2-CE1 3.48Å; L1016-F1157 HydrophobicContact CD2-CZ 3.65Å
1017	Q	82.8	Confident	81.9	Confident	22 Å²	22	46.1 Å²	46.1	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-55.7	-49.4	175.8	176.6	169	10.8	0	0	111.2	Q1013 A1014 L1019 L1020 L1021 M1105	Q1013-Q1017 VanDerWaalsContact O-CB 3.31Å; Q1013-Q1017 WeakPolarHBondContact O-CB 3.31Å; Q1013-Q1017 PolarHBondContact O-N 3.39Å; Q1013-Q1017 VanDerWaalsContact O-N 3.13Å; A1014-Q1017 PolarHBondContact O-N 2.72Å; Q1017-L1019 PolarHBondContact O-N 3.29Å; Q1017-L1020 PolarHBondContact O-N 3.27Å; Q1017-L1021 WeakPolarHBondContact O-CB 3.35Å; Q1017-L1021 PolarHBondContact O-N 2.92Å; Q1017-M1105 HydrophobicContact CB-CE 4.4Å; Q1017-M1105 HydrophobicContact CB-SD 3.41Å; Q1017-M1105 WeakPolarHBondContact CB-SD 3.12Å; Q1017-M1105 HydrophobicContact CG-SD 3.38Å; Q1017-M1105 WeakPolarHBondContact CG-SD 3.39Å
1018	G	81.1	Confident	82.4	Confident	39 Å²	39	45.7 Å²	45.7	40%	0.402	26%	0.264	S	S	.	.	H	α-helix	trans	-60.2	-43.2	176.9	0	0	0	0	0	113.2	A1014 T1015 L1016 L1021 A1022	A1014-G1018 PolarHBondContact O-N 3.4Å; T1015-G1018 PolarHBondContact O-N 3.07Å; L1016-G1018 VanDerWaalsContact C-N 3.34Å; L1016-G1018 PolarHBondContact O-N 2.84Å; G1018-L1021 PolarHBondContact O-N 2.94Å; G1018-A1022 VanDerWaalsContact O-CB 3.31Å; G1018-A1022 WeakPolarHBondContact O-CB 3.41Å; G1018-A1022 PolarHBondContact O-N 3.39Å
1019	L	83.1	Confident	82.8	Confident	124 Å²	124	43.1 Å²	43.1	65%	0.649	25%	0.253	S	S	*	.	H	α-helix	trans	-64.5	-44.1	179.6	-175.4	67	0	0	0	112.5	T1015 L1016 Q1017 A1022 G1023	T1015-L1019 PolarHBondContact O-N 2.9Å; L1016-L1019 PolarHBondContact O-N 3.39Å; Q1017-L1019 PolarHBondContact O-N 3.29Å; L1019-A1022 PolarHBondContact O-N 2.98Å; L1019-G1023 PolarHBondContact O-N 2.64Å
1020	L	83.8	Confident	83.1	Confident	26 Å²	26	47.7 Å²	47.7	14%	0.136	27%	0.269	C	S	.	.	H	α-helix	trans	-66.8	-40.4	178.4	-69.5	174.5	0	0	0	111.5	L1016 Q1017 G1023 C1024 M1105	L1016-L1020 HydrophobicContact CD1-CD1 4.2Å; L1016-L1020 HydrophobicContact CD1-CG 4.26Å; L1016-L1020 HydrophobicContact CD2-CD1 4.45Å; L1016-L1020 HydrophobicContact CG-CD1 3.99Å; L1016-L1020 HydrophobicContact CG-CG 4.41Å; L1016-L1020 WeakPolarHBondContact O-CG 3.15Å; L1016-L1020 PolarHBondContact O-N 3.06Å; Q1017-L1020 PolarHBondContact O-N 3.27Å; L1020-G1023 PolarHBondContact O-N 2.95Å; L1020-C1024 PolarHBondContact O-N 3.01Å; L1020-C1024 VanDerWaalsContact O-N 3.09Å; L1020-C1024 PolarHBondContact O-SG 3.18Å; L1020-M1105 HydrophobicContact CD1-CE 3.63Å
1021	L	82.6	Confident	83.4	Confident	37 Å²	37	46.6 Å²	46.6	19%	0.194	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-49.5	175	-163.8	82.9	0	0	0	111.1	Q1017 G1018 G1023 C1024 F1025 M1109 F1112	Q1017-L1021 WeakPolarHBondContact O-CB 3.35Å; Q1017-L1021 PolarHBondContact O-N 2.92Å; G1018-L1021 PolarHBondContact O-N 2.94Å; L1021-G1023 VanDerWaalsContact C-N 3.32Å; L1021-G1023 PolarHBondContact O-N 3.46Å; L1021-C1024 PolarHBondContact O-N 2.93Å; L1021-F1025 HydrophobicContact CD1-CE2 4.28Å; L1021-F1025 HydrophobicContact CD2-CD2 4.49Å; L1021-F1025 HydrophobicContact CD2-CE2 3.94Å; L1021-F1025 HydrophobicContact CG-CD2 4.02Å; L1021-F1025 HydrophobicContact CG-CE2 3.74Å; L1021-F1025 VanDerWaalsContact O-CD2 3.3Å; L1021-F1025 WeakPolarHBondContact O-CD2 3.31Å; L1021-F1025 PolarHBondContact O-N 2.79Å; L1021-M1109 HydrophobicContact CD1-CE 4.36Å; L1021-F1112 HydrophobicContact CD1-CE2 3.36Å; L1021-F1112 HydrophobicContact CD1-CZ 3.68Å; L1021-F1112 HydrophobicContact CG-CE2 4.2Å; L1021-F1112 HydrophobicContact CG-CZ 4.12Å
1022	A	82.5	Confident	83.9	Confident	58 Å²	58	49.1 Å²	49.1	48%	0.479	27%	0.269	S	S	.	.	H	α-helix	trans	-60.7	-40.3	178.6	0	0	0	0	0	112.2	G1018 L1019 F1025 L1026	G1018-A1022 VanDerWaalsContact O-CB 3.31Å; G1018-A1022 WeakPolarHBondContact O-CB 3.41Å; G1018-A1022 PolarHBondContact O-N 3.39Å; L1019-A1022 PolarHBondContact O-N 2.98Å; A1022-F1025 PolarHBondContact O-N 3.42Å; A1022-L1026 WeakPolarHBondContact O-CB 3.44Å; A1022-L1026 PolarHBondContact O-N 3.47Å
1023	G	83.8	Confident	84.5	Confident	22 Å²	22	46 Å²	46	23%	0.227	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-46.6	173.4	0	0	0	0	0	112.5	L1019 L1020 L1021 F1025 L1026 F1027	L1019-G1023 PolarHBondContact O-N 2.64Å; L1020-G1023 PolarHBondContact O-N 2.95Å; L1021-G1023 VanDerWaalsContact C-N 3.32Å; L1021-G1023 PolarHBondContact O-N 3.46Å; G1023-F1025 PolarHBondContact O-N 2.95Å; G1023-L1026 PolarHBondContact O-N 3.33Å; G1023-F1027 WeakPolarHBondContact O-CD2 3.29Å; G1023-F1027 WeakPolarHBondContact O-CG 3.43Å; G1023-F1027 PolarHBondContact O-N 3.47Å; G1023-F1027 VanDerWaalsContact O-N 3.07Å
1024	C	87.2	Confident	84.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-44.8	178.7	-66.2	0	0	0	0	112.1	L1020 L1021 L1026 F1027 I1028 F1112 S1134	L1020-C1024 PolarHBondContact O-N 3.01Å; L1020-C1024 VanDerWaalsContact O-N 3.09Å; L1020-C1024 PolarHBondContact O-SG 3.18Å; L1021-C1024 PolarHBondContact O-N 2.93Å; C1024-L1026 PolarHBondContact O-N 2.81Å; C1024-F1027 PolarHBondContact O-N 2.89Å; C1024-I1028 WeakPolarHBondContact O-CG1 3.48Å; C1024-I1028 PolarHBondContact O-N 2.84Å; C1024-F1112 HydrophobicContact CB-CD1 4.09Å; C1024-F1112 HydrophobicContact CB-CD2 3.96Å; C1024-F1112 HydrophobicContact CB-CE1 3.86Å; C1024-F1112 HydrophobicContact CB-CE2 3.72Å; C1024-F1112 HydrophobicContact CB-CG 4.14Å; C1024-F1112 HydrophobicContact CB-CZ 3.68Å; C1024-S1134 PolarHBondContact SG-OG 3.01Å
1025	F	85.1	Confident	85.1	Confident	11 Å²	11	55.1 Å²	55.1	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-41.5	176.3	-81.5	-65	0	0	0	112.8	E493 M984 I987 L988 L1021 A1022 G1023 F1027 I1028 S1029 F1112	E493-F1025 HydrophobicContact CG-CB 4.34Å; E493-F1025 HydrophobicContact CG-CD1 4.44Å; E493-F1025 HydrophobicContact CG-CG 4.43Å; E493-F1025 WeakPolarHBondContact OE1-CD1 3.28Å; E493-F1025 VanDerWaalsContact OE1-CD2 3.24Å; E493-F1025 WeakPolarHBondContact OE1-CD2 3.46Å; E493-F1025 WeakPolarHBondContact OE1-CG 3.41Å; M984-F1025 HydrophobicContact CE-CD1 4.08Å; M984-F1025 HydrophobicContact CG-CD1 4.49Å; I987-F1025 HydrophobicContact CB-CE1 4.39Å; I987-F1025 HydrophobicContact CB-CZ 4.49Å; I987-F1025 HydrophobicContact CG2-CE1 4.04Å; I987-F1025 HydrophobicContact CG2-CZ 3.78Å; L988-F1025 HydrophobicContact CD1-CZ 4.37Å; L1021-F1025 HydrophobicContact CD1-CE2 4.28Å; L1021-F1025 HydrophobicContact CD2-CD2 4.49Å; L1021-F1025 HydrophobicContact CD2-CE2 3.94Å; L1021-F1025 HydrophobicContact CG-CD2 4.02Å; L1021-F1025 HydrophobicContact CG-CE2 3.74Å; L1021-F1025 VanDerWaalsContact O-CD2 3.3Å; L1021-F1025 WeakPolarHBondContact O-CD2 3.31Å; L1021-F1025 PolarHBondContact O-N 2.79Å; A1022-F1025 PolarHBondContact O-N 3.42Å; G1023-F1025 PolarHBondContact O-N 2.95Å; F1025-F1027 VanDerWaalsContact C-N 3.32Å; F1025-F1027 PolarHBondContact O-N 3.4Å; F1025-I1028 PolarHBondContact O-N 2.9Å; F1025-S1029 PolarHBondContact O-N 3.41Å; F1025-F1112 AromaticContact CD1-CE1 3.94Å; F1025-F1112 HydrophobicContact CD1-CE1 3.94Å; F1025-F1112 HydrophobicContact CD1-CZ 4.36Å; F1025-F1112 HydrophobicContact CD2-CE1 4.16Å; F1025-F1112 AromaticContact CD2-CZ 3.75Å; F1025-F1112 HydrophobicContact CD2-CZ 3.75Å; F1025-F1112 AromaticContact CE1-CE1 3.86Å; F1025-F1112 HydrophobicContact CE1-CE1 3.86Å; F1025-F1112 HydrophobicContact CE1-CZ 4.23Å; F1025-F1112 HydrophobicContact CE2-CE1 4.09Å; F1025-F1112 AromaticContact CE2-CZ 3.6Å; F1025-F1112 HydrophobicContact CE2-CZ 3.6Å; F1025-F1112 HydrophobicContact CG-CE1 4.08Å; F1025-F1112 HydrophobicContact CG-CZ 4.14Å; F1025-F1112 AromaticContact CZ-CE1 3.94Å; F1025-F1112 HydrophobicContact CZ-CE1 3.94Å; F1025-F1112 AromaticContact CZ-CZ 3.85Å; F1025-F1112 HydrophobicContact CZ-CZ 3.85Å
1026	L	84.1	Confident	85.2	Confident	69 Å²	69	56 Å²	56	36%	0.361	30%	0.297	S	S	.	.	H	α-helix	trans	-59.9	-42.9	175.3	-173.7	154	0	0	0	111.1	A1022 G1023 C1024 S1029	A1022-L1026 WeakPolarHBondContact O-CB 3.44Å; A1022-L1026 PolarHBondContact O-N 3.47Å; G1023-L1026 PolarHBondContact O-N 3.33Å; C1024-L1026 PolarHBondContact O-N 2.81Å; L1026-S1029 PolarHBondContact O-N 2.98Å; L1026-S1029 PolarHBondContact O-OG 2.99Å
1027	F	89	Confident	85.4	Confident	56 Å²	56	54.9 Å²	54.9	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-75.9	-27	-179.2	-61.5	-49.2	0	0	0	114	G1023 C1024 F1025 R1030 N1128 P1130 L1131	G1023-F1027 WeakPolarHBondContact O-CD2 3.29Å; G1023-F1027 WeakPolarHBondContact O-CG 3.43Å; G1023-F1027 PolarHBondContact O-N 3.47Å; G1023-F1027 VanDerWaalsContact O-N 3.07Å; C1024-F1027 PolarHBondContact O-N 2.89Å; F1025-F1027 VanDerWaalsContact C-N 3.32Å; F1025-F1027 PolarHBondContact O-N 3.4Å; F1027-R1030 PolarHBondContact O-N 3.23Å; F1027-N1128 PolarHBondContact O-ND2 3.46Å; F1027-P1130 HydrophobicContact CB-CB 4.36Å; F1027-P1130 HydrophobicContact CD1-CB 3.47Å; F1027-P1130 VanDerWaalsContact CD1-CB 3.47Å; F1027-P1130 HydrophobicContact CE1-CB 3.85Å; F1027-P1130 HydrophobicContact CG-CB 3.9Å; F1027-L1131 HydrophobicContact CB-CB 3.96Å; F1027-L1131 HydrophobicContact CB-CD1 4.13Å
1028	I	88.3	Confident	85.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-44.9	170.5	-76.8	165.8	0	0	0	111	T980 M984 I987 C1024 F1025 R1030 S1031 F1112 Y1116 L1131	T980-I1028 HydrophobicContact CG2-CG2 3.7Å; M984-I1028 HydrophobicContact CG-CG2 4.05Å; I987-I1028 HydrophobicContact CD1-CD1 3.88Å; C1024-I1028 WeakPolarHBondContact O-CG1 3.48Å; C1024-I1028 PolarHBondContact O-N 2.84Å; F1025-I1028 PolarHBondContact O-N 2.9Å; I1028-R1030 PolarHBondContact O-N 2.94Å; I1028-R1030 VanDerWaalsContact O-N 3.11Å; I1028-S1031 WeakPolarHBondContact O-CB 3.36Å; I1028-S1031 PolarHBondContact O-N 3.22Å; I1028-S1031 VanDerWaalsContact O-N 3.15Å; I1028-S1031 PolarHBondContact O-OG 3.24Å; I1028-F1112 HydrophobicContact CD1-CD1 3.33Å; I1028-F1112 HydrophobicContact CD1-CE1 3.6Å; I1028-Y1116 HydrophobicContact CG1-CD2 4.14Å; I1028-Y1116 HydrophobicContact CG1-CE2 4.47Å; I1028-L1131 HydrophobicContact CG1-CD1 4.04Å; I1028-L1131 HydrophobicContact CG1-CD2 3.91Å
1029	S	84.3	Confident	85.7	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-20.4	180	79.9	0	0	0	0	114	L496 F1025 L1026	L496-S1029 WeakPolarHBondContact CD2-OG 3.44Å; F1025-S1029 PolarHBondContact O-N 3.41Å; L1026-S1029 PolarHBondContact O-N 2.98Å; L1026-S1029 PolarHBondContact O-OG 2.99Å
1030	R	85.1	Confident	85.8	Confident	149 Å²	149	61.4 Å²	61.4	56%	0.562	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	10	-179.5	-76.4	-174.2	154.1	173.9	-3.5	114.4	T500 F1027 I1028	T500-R1030 HydrophobicContact CG2-CG 4.05Å; F1027-R1030 PolarHBondContact O-N 3.23Å; I1028-R1030 PolarHBondContact O-N 2.94Å; I1028-R1030 VanDerWaalsContact O-N 3.11Å
1031	S	85.7	Confident	85.7	Confident	7 Å²	7	62.5 Å²	62.5	5%	0.049	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-61.3	141.2	175.6	-59.3	0	0	0	0	111.5	I1028 Y1116 N1128	I1028-S1031 WeakPolarHBondContact O-CB 3.36Å; I1028-S1031 PolarHBondContact O-N 3.22Å; I1028-S1031 VanDerWaalsContact O-N 3.15Å; I1028-S1031 PolarHBondContact O-OG 3.24Å; S1031-Y1116 WeakPolarHBondContact OG-CE2 3.4Å; S1031-Y1116 PolarHBondContact OG-OH 3.42Å; S1031-N1128 PolarHBondContact OG-ND2 3.49Å
1032	K	88.4	Confident	85.7	Confident	125 Å²	125	61.3 Å²	61.3	54%	0.543	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-101.6	148.1	-179.5	-63.5	175.4	-174.7	165.8	0	111.5	M1122 E1123	K1032-M1122 VanDerWaalsContact O-CA 3.3Å; K1032-M1122 WeakPolarHBondContact O-CA 3.4Å; K1032-M1122 WeakPolarHBondContact O-CB 3.44Å; K1032-E1123 HydrophobicContact CB-CG 4.2Å; K1032-E1123 PolarHBondContact O-N 2.99Å
1033	P	91	Very high	85.7	Confident	36 Å²	36	59.7 Å²	59.7	23%	0.234	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-71.4	151.9	173.6	31.2	-36.9	0	0	0	111.8	K972 C976	K972-P1033 HydrophobicContact CB-CB 4.23Å; C976-P1033 HydrophobicContact CB-CB 3.89Å
1034	L	88.7	Confident	85.1	Confident	46 Å²	46	61.7 Å²	61.7	24%	0.241	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-69.1	154.3	169.3	-67.5	176.1	0	0	0	111.8	T1036 F1121	L1034-T1036 VanDerWaalsContact C-N 3.32Å; L1034-T1036 PolarHBondContact O-N 3.34Å; L1034-F1121 PolarHBondContact N-O 2.79Å; L1034-F1121 VanDerWaalsContact N-O 3.14Å
1035	K	85.7	Confident	84.7	Confident	194 Å²	194	65.3 Å²	65.3	84%	0.843	31%	0.31	S	S	*	.	S	Bend	trans	-69.5	-27.1	-177.6	-67.6	-176.5	-179.2	177.7	0	113.6	K972	K972-K1035 WeakPolarHBondContact CE-O 3.41Å; K972-K1035 PolarHBondContact NZ-O 2.92Å
1036	T	84.6	Confident	84.3	Confident	104 Å²	104	65.3 Å²	65.3	64%	0.638	31%	0.31	S	S	*	.	S	Bend	trans	-106	141.1	-177	49.5	0	0	0	0	110.9	L1034	L1034-T1036 VanDerWaalsContact C-N 3.32Å; L1034-T1036 PolarHBondContact O-N 3.34Å
1037	L	86.3	Confident	84	Confident	21 Å²	21	65.4 Å²	65.4	11%	0.11	31%	0.308	C	S	.	.			trans	-79.7	123.8	174.9	-162.9	69.8	0	0	0	109.8	E732 A736 I971 K972	E732-L1037 HydrophobicContact CG-CB 4.04Å; E732-L1037 WeakPolarHBondContact OE1-CB 3.42Å; E732-L1037 PolarHBondContact OE1-N 3.46Å; A736-L1037 HydrophobicContact CB-CB 4.06Å; A736-L1037 HydrophobicContact CB-CD2 3.1Å; A736-L1037 HydrophobicContact CB-CG 3.4Å; A736-L1037 VanDerWaalsContact CB-CG 3.4Å; I971-L1037 HydrophobicContact CB-CD1 4.38Å; I971-L1037 HydrophobicContact CG2-CD1 3.75Å; I971-L1037 HydrophobicContact CG2-CD2 4.47Å; K972-L1037 HydrophobicContact CG-CD1 3.77Å
1038	S	86.3	Confident	83.6	Confident	20 Å²	20	65.2 Å²	65.2	14%	0.14	31%	0.309	C	S	.	.			trans	-81.2	154.2	179.7	49.2	0	0	0	0	112.5	A736 R975 E1040 P1120 F1121	A736-S1038 WeakPolarHBondContact CB-O 3.46Å; R975-S1038 PolarHBondContact NH1-O 3.25Å; R975-S1038 PolarHBondContact NH1-OG 3.47Å; S1038-E1040 VanDerWaalsContact C-N 3.35Å; S1038-P1120 WeakPolarHBondContact CB-O 3.42Å; S1038-P1120 PolarHBondContact OG-O 2.98Å; S1038-P1120 VanDerWaalsContact OG-O 3.07Å; S1038-F1121 WeakPolarHBondContact OG-CD1 3.03Å; S1038-F1121 WeakPolarHBondContact OG-CE1 3.31Å
1039	R	85.3	Confident	83.3	Confident	199 Å²	199	70.6 Å²	70.6	75%	0.751	34%	0.338	S	S	*	.	S	Bend	trans	-71.8	-31.4	174.5	-171.9	175.7	177.2	-179.6	1.3	112.6	S737	S737-R1039 PolarHBondContact OG-O 3.34Å
1040	E	84	Confident	83.4	Confident	103 Å²	103	70.8 Å²	70.8	48%	0.481	34%	0.337	S	S	.	.	S	Bend	trans	-68.3	148.3	176	-65.2	-178.4	-173.1	0	0	110.6	R975 S1038 P1120 F1121	R975-E1040 PolarHBondContact NH1-O 3.16Å; S1038-E1040 VanDerWaalsContact C-N 3.35Å; E1040-P1120 HydrophobicContact CB-CG 4.24Å; E1040-F1121 HydrophobicContact CB-CZ 4.1Å; E1040-F1121 VanDerWaalsContact O-CE1 3.24Å; E1040-F1121 WeakPolarHBondContact O-CE1 3.37Å
1041	R	81.4	Confident	83.4	Confident	49 Å²	49	64.2 Å²	64.2	19%	0.185	31%	0.314	C	S	.	.			trans	-110.3	144.5	175.1	-64.1	-175.1	-174.7	-175.2	-1.6	109.6	E525 S737	E525-R1041 VanDerWaalsContact CG-NH1 3.3Å; E525-R1041 IonicContact OE1-NH1 3.5Å; S737-R1041 PolarHBondContact O-NH2 3.39Å; S737-R1041 PolarHBondContact OG-NE 2.86Å
1042	P	83.6	Confident	83.4	Confident	12 Å²	12	66.9 Å²	66.9	8%	0.078	33%	0.327	C	S	.	.			trans	-64.2	156.1	172.5	30	-36.3	0	0	0	110.5	G522 R975 L978 V979 F1121	G522-P1042 WeakPolarHBondContact O-CG 3.45Å; R975-P1042 HydrophobicContact CB-CG 4.43Å; R975-P1042 HydrophobicContact CG-CG 4.09Å; L978-P1042 HydrophobicContact CD2-CB 4.06Å; L978-P1042 HydrophobicContact CD2-CG 3.71Å; V979-P1042 HydrophobicContact CG2-CB 3.56Å; P1042-F1121 HydrophobicContact CB-CE2 4.45Å; P1042-F1121 HydrophobicContact CB-CZ 4.41Å
1043	L	81.3	Confident	83.4	Confident	23 Å²	23	64.4 Å²	64.4	12%	0.12	32%	0.319	C	S	.	.			trans	-62.9	133.3	175.3	-66.6	173.1	0	0	0	109.5	L982 N1048 Y1050 P1195	L982-L1043 HydrophobicContact CD1-CB 4.26Å; L982-L1043 VanDerWaalsContact CD1-O 3.25Å; L982-L1043 WeakPolarHBondContact CD1-O 3.43Å; L1043-N1048 VanDerWaalsContact CD2-ND2 3.3Å; L1043-N1048 WeakPolarHBondContact CD2-ND2 3.32Å; L1043-Y1050 HydrophobicContact CD1-CD1 3.6Å; L1043-Y1050 HydrophobicContact CD1-CE1 4.2Å; L1043-P1195 HydrophobicContact CD2-CB 4.5Å; L1043-P1195 HydrophobicContact CD2-CG 4.36Å
1044	P	72.7	Confident	83.4	Confident	65 Å²	65	62.7 Å²	62.7	42%	0.422	31%	0.308	S	S	.	.	S	Bend	trans	-74.8	-32.3	-174.4	27.4	-33.7	0	0	0	112.4	K523	K523-P1044 HydrophobicContact CD-CB 4.35Å; K523-P1044 WeakPolarHBondContact CE-O 3.37Å; K523-P1044 PolarHBondContact NZ-O 3.25Å
1045	N	78.2	Confident	83.4	Confident	75 Å²	75	60.9 Å²	60.9	40%	0.401	30%	0.299	S	S	.	.			trans	-127.5	152.8	-170.4	-60.4	-7.2	0	0	0	111.3	E440 F1047	E440-N1045 PolarHBondContact OE1-OD1 3.37Å; N1045-F1047 VanDerWaalsContact C-N 3.34Å
1046	I	76.7	Confident	83.6	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.062	27%	0.269	C	S	.	.	S	Bend	trans	-64.6	-41.5	175.1	-58.8	163.8	0	0	0	110.3	E440 F444 L982 F985 N1048 T1051	E440-I1046 HydrophobicContact CB-CD1 4.29Å; E440-I1046 PolarHBondContact OE2-N 2.85Å; F444-I1046 HydrophobicContact CD2-CG2 4.22Å; L982-I1046 HydrophobicContact CD2-CB 4.34Å; L982-I1046 HydrophobicContact CD2-CG1 3.65Å; F985-I1046 HydrophobicContact CB-CG2 4.38Å; F985-I1046 HydrophobicContact CD1-CD1 4.16Å; F985-I1046 HydrophobicContact CD2-CD1 3.47Å; F985-I1046 VanDerWaalsContact CD2-CD1 3.47Å; F985-I1046 HydrophobicContact CD2-CG1 3.92Å; F985-I1046 HydrophobicContact CE1-CD1 4.11Å; F985-I1046 HydrophobicContact CE2-CD1 3.44Å; F985-I1046 VanDerWaalsContact CE2-CD1 3.44Å; F985-I1046 HydrophobicContact CE2-CG1 4.27Å; F985-I1046 HydrophobicContact CG-CD1 3.86Å; F985-I1046 HydrophobicContact CG-CG1 4.36Å; F985-I1046 HydrophobicContact CZ-CD1 3.78Å; I1046-N1048 VanDerWaalsContact C-N 3.31Å; I1046-N1048 PolarHBondContact O-N 3.15Å; I1046-T1051 WeakPolarHBondContact O-CB 3.33Å; I1046-T1051 VanDerWaalsContact O-CG2 3.25Å; I1046-T1051 WeakPolarHBondContact O-CG2 3.38Å; I1046-T1051 PolarHBondContact O-OG1 3.21Å
1047	F	78.4	Confident	84	Confident	71 Å²	71	52 Å²	52	31%	0.311	26%	0.256	S	S	.	.			trans	-81	72.7	179.8	-70.3	-78.5	0	0	0	112.6	E440 I443 F444 F447 N1045 I1052	E440-F1047 WeakPolarHBondContact O-CE2 3.39Å; I443-F1047 VanDerWaalsContact C-CZ 3.47Å; I443-F1047 HydrophobicContact CB-CE2 3.66Å; I443-F1047 HydrophobicContact CB-CZ 3.84Å; I443-F1047 HydrophobicContact CG2-CD2 4.31Å; I443-F1047 HydrophobicContact CG2-CE1 4Å; I443-F1047 HydrophobicContact CG2-CE2 3.55Å; I443-F1047 HydrophobicContact CG2-CZ 3.36Å; F444-F1047 VanDerWaalsContact CA-CZ 3.46Å; F444-F1047 HydrophobicContact CB-CE2 4.08Å; F444-F1047 HydrophobicContact CB-CZ 3.94Å; F444-F1047 VanDerWaalsContact N-CZ 3.33Å; F447-F1047 HydrophobicContact CB-CE1 4.49Å; N1045-F1047 VanDerWaalsContact C-N 3.34Å; F1047-I1052 HydrophobicContact CD1-CD1 4.18Å
1048	N	79.4	Confident	84.3	Confident	52 Å²	52	51 Å²	51	28%	0.278	25%	0.25	S	S	.	.			trans	-108.8	148.5	163.6	-172.3	7.5	0	0	0	109.3	L1043 I1046 Y1050 T1051 I1052	L1043-N1048 VanDerWaalsContact CD2-ND2 3.3Å; L1043-N1048 WeakPolarHBondContact CD2-ND2 3.32Å; I1046-N1048 VanDerWaalsContact C-N 3.31Å; I1046-N1048 PolarHBondContact O-N 3.15Å; N1048-Y1050 PolarHBondContact O-N 3.2Å; N1048-T1051 PolarHBondContact O-N 3.09Å; N1048-I1052 PolarHBondContact O-N 3.02Å
1049	L	83.3	Confident	84.5	Confident	114 Å²	114	51.9 Å²	51.9	60%	0.597	25%	0.252	S	S	*	.	H	α-helix	trans	-50.4	-40.6	173.5	-177.6	64	0	0	0	111.3	L1053 L1192	L1049-L1053 WeakPolarHBondContact O-CB 3.3Å; L1049-L1053 PolarHBondContact O-N 3.49Å; L1049-L1192 HydrophobicContact CD2-CD1 4.44Å; L1049-L1192 HydrophobicContact CG-CD1 4.41Å
1050	Y	86	Confident	84.9	Confident	9 Å²	9	44.9 Å²	44.9	4%	0.035	23%	0.233	C	C	.	.	H	α-helix	trans	-58.2	-48	174.5	168.5	-113.8	0	0	0	113.1	K986 L1043 N1048 T1054 K1117 D1185 L1188 Q1189 L1192	K986-Y1050 PolarHBondContact NZ-OH 2.93Å; L1043-Y1050 HydrophobicContact CD1-CD1 3.6Å; L1043-Y1050 HydrophobicContact CD1-CE1 4.2Å; N1048-Y1050 PolarHBondContact O-N 3.2Å; Y1050-T1054 WeakPolarHBondContact O-CB 3.22Å; Y1050-T1054 WeakPolarHBondContact O-CG2 3.46Å; Y1050-T1054 PolarHBondContact O-N 3.05Å; Y1050-K1117 WeakPolarHBondContact OH-CE 3.16Å; Y1050-K1117 PolarHBondContact OH-NZ 3.42Å; Y1050-D1185 PolarHBondContact OH-OD1 2.8Å; Y1050-L1188 HydrophobicContact CD2-CB 4.12Å; Y1050-L1188 HydrophobicContact CE2-CB 4.02Å; Y1050-Q1189 HydrophobicContact CE2-CB 4.09Å; Y1050-L1192 HydrophobicContact CD2-CB 4.26Å; Y1050-L1192 HydrophobicContact CG-CB 4.47Å
1051	T	84.1	Confident	85.3	Confident	12 Å²	12	41 Å²	41	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-43.3	-178.1	-63.1	0	0	0	0	111.7	K986 I1046 N1048 T1054 V1055	K986-T1051 HydrophobicContact CD-CG2 4.36Å; K986-T1051 WeakPolarHBondContact CE-OG1 3.35Å; K986-T1051 HydrophobicContact CG-CG2 3.86Å; I1046-T1051 WeakPolarHBondContact O-CB 3.33Å; I1046-T1051 VanDerWaalsContact O-CG2 3.25Å; I1046-T1051 WeakPolarHBondContact O-CG2 3.38Å; I1046-T1051 PolarHBondContact O-OG1 3.21Å; N1048-T1051 PolarHBondContact O-N 3.09Å; T1051-T1054 VanDerWaalsContact O-CG2 3.27Å; T1051-T1054 WeakPolarHBondContact O-CG2 3.48Å; T1051-V1055 VanDerWaalsContact O-CG2 3.3Å; T1051-V1055 WeakPolarHBondContact O-CG2 3.3Å; T1051-V1055 PolarHBondContact O-N 3.12Å
1052	I	86.6	Confident	85.8	Confident	63 Å²	63	38.7 Å²	38.7	32%	0.323	21%	0.208	S	C	.	.	H	α-helix	trans	-65.8	-47.9	179.2	-62	170.4	0	0	0	109.9	F1047 N1048 T1054 V1055 M1056	F1047-I1052 HydrophobicContact CD1-CD1 4.18Å; N1048-I1052 PolarHBondContact O-N 3.02Å; I1052-T1054 PolarHBondContact O-N 3.06Å; I1052-V1055 PolarHBondContact O-N 3.37Å; I1052-M1056 HydrophobicContact CG2-CG 4.28Å; I1052-M1056 VanDerWaalsContact O-CG 3.29Å; I1052-M1056 WeakPolarHBondContact O-CG 3.33Å; I1052-M1056 PolarHBondContact O-N 3.19Å
1053	L	88.6	Confident	86.1	Confident	72 Å²	72	41.4 Å²	41.4	38%	0.377	22%	0.218	S	C	.	.	H	α-helix	trans	-66.6	-37.4	-176.3	-169.8	58	0	0	0	112.1	L1049 M1056 L1057 L1188 L1192	L1049-L1053 WeakPolarHBondContact O-CB 3.3Å; L1049-L1053 PolarHBondContact O-N 3.49Å; L1053-M1056 PolarHBondContact O-N 3.32Å; L1053-L1057 VanDerWaalsContact O-CB 3.28Å; L1053-L1057 WeakPolarHBondContact O-CB 3.4Å; L1053-L1057 PolarHBondContact O-N 3.49Å; L1053-L1188 HydrophobicContact CB-CD1 4.23Å; L1053-L1188 HydrophobicContact CD2-CD1 4.31Å; L1053-L1188 HydrophobicContact CD2-CD2 3.43Å; L1053-L1188 VanDerWaalsContact CD2-CD2 3.43Å; L1053-L1188 HydrophobicContact CG-CD1 3.82Å; L1053-L1188 HydrophobicContact CG-CD2 3.89Å; L1053-L1192 HydrophobicContact CD2-CD1 4.01Å
1054	T	90.1	Very high	86.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-38.7	175.5	-165.8	0	0	0	0	112.3	K986 Y1050 T1051 I1052 Q1058 D1185	K986-T1054 HydrophobicContact CD-CG2 4.25Å; Y1050-T1054 WeakPolarHBondContact O-CB 3.22Å; Y1050-T1054 WeakPolarHBondContact O-CG2 3.46Å; Y1050-T1054 PolarHBondContact O-N 3.05Å; T1051-T1054 VanDerWaalsContact O-CG2 3.27Å; T1051-T1054 WeakPolarHBondContact O-CG2 3.48Å; I1052-T1054 PolarHBondContact O-N 3.06Å; T1054-Q1058 VanDerWaalsContact O-CB 3.29Å; T1054-Q1058 WeakPolarHBondContact O-CB 3.26Å; T1054-Q1058 VanDerWaalsContact O-CG 3.27Å; T1054-Q1058 WeakPolarHBondContact O-CG 3.5Å; T1054-Q1058 PolarHBondContact O-N 2.84Å; T1054-Q1058 PolarHBondContact OG1-NE2 3.11Å; T1054-Q1058 VanDerWaalsContact OG1-NE2 3.13Å; T1054-D1185 PolarHBondContact OG1-OD1 2.67Å
1055	V	89.8	Confident	87.5	Confident	7 Å²	7	43.4 Å²	43.4	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-45.8	176.7	170	0	0	0	0	110.1	K986 A989 L990 L993 T1051 I1052 F1059	K986-V1055 HydrophobicContact CB-CG2 4.43Å; K986-V1055 HydrophobicContact CG-CG2 4.33Å; A989-V1055 HydrophobicContact CB-CG1 3.91Å; A989-V1055 HydrophobicContact CB-CG2 4.3Å; L990-V1055 HydrophobicContact CD2-CB 4.5Å; L990-V1055 HydrophobicContact CD2-CG1 4.08Å; L990-V1055 VanDerWaalsContact CD2-O 3.27Å; L990-V1055 WeakPolarHBondContact CD2-O 3.49Å; L990-V1055 HydrophobicContact CG-CG1 4.19Å; L990-V1055 HydrophobicContact CG-CG2 4.44Å; L993-V1055 HydrophobicContact CD1-CG1 3.91Å; T1051-V1055 VanDerWaalsContact O-CG2 3.3Å; T1051-V1055 WeakPolarHBondContact O-CG2 3.3Å; T1051-V1055 PolarHBondContact O-N 3.12Å; I1052-V1055 PolarHBondContact O-N 3.37Å; V1055-F1059 WeakPolarHBondContact O-CB 3.33Å; V1055-F1059 PolarHBondContact O-N 3.2Å
1056	M	89.8	Confident	88	Confident	44 Å²	44	40.1 Å²	40.1	22%	0.217	21%	0.209	C	C	.	.	H	α-helix	trans	-65.7	-41.9	-179.9	-66.3	-67.4	98.1	0	0	113	F447 F451 L993 I1052 L1053 S1060	F447-M1056 HydrophobicContact CE1-CE 4.19Å; F447-M1056 HydrophobicContact CZ-CE 3.83Å; F447-M1056 HydrophobicContact CZ-SD 4.4Å; F451-M1056 HydrophobicContact CE1-SD 4.45Å; F451-M1056 HydrophobicContact CE2-CE 4.26Å; F451-M1056 HydrophobicContact CZ-CE 3.99Å; F451-M1056 HydrophobicContact CZ-SD 3.82Å; L993-M1056 HydrophobicContact CD1-CE 3.59Å; I1052-M1056 HydrophobicContact CG2-CG 4.28Å; I1052-M1056 VanDerWaalsContact O-CG 3.29Å; I1052-M1056 WeakPolarHBondContact O-CG 3.33Å; I1052-M1056 PolarHBondContact O-N 3.19Å; L1053-M1056 PolarHBondContact O-N 3.32Å; M1056-S1060 WeakPolarHBondContact O-CB 3.44Å; M1056-S1060 PolarHBondContact O-N 3.28Å; M1056-S1060 PolarHBondContact O-OG 3.45Å
1057	L	91.9	Very high	88.6	Confident	68 Å²	68	41.1 Å²	41.1	36%	0.356	22%	0.215	S	C	.	.	H	α-helix	trans	-72.8	-42.5	-178.1	-171.8	60.3	0	0	0	111.8	L1053 S1060 V1061 A1184 L1188	L1053-L1057 VanDerWaalsContact O-CB 3.28Å; L1053-L1057 WeakPolarHBondContact O-CB 3.4Å; L1053-L1057 PolarHBondContact O-N 3.49Å; L1057-S1060 WeakPolarHBondContact O-CB 3.49Å; L1057-S1060 PolarHBondContact O-N 3.39Å; L1057-V1061 WeakPolarHBondContact O-CG2 3.46Å; L1057-V1061 PolarHBondContact O-N 3.17Å; L1057-A1184 HydrophobicContact CD2-CB 3.48Å; L1057-A1184 VanDerWaalsContact CD2-CB 3.48Å; L1057-A1184 HydrophobicContact CG-CB 3.76Å; L1057-L1188 HydrophobicContact CB-CD1 4.45Å; L1057-L1188 HydrophobicContact CD2-CD1 3.99Å; L1057-L1188 HydrophobicContact CD2-CG 4.48Å
1058	Q	92.9	Very high	89.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-44	173.1	-73	178.4	22.9	0	0	111.1	L990 T1054 S1060 V1061 H1062 N1115 A1181	L990-Q1058 HydrophobicContact CD1-CB 4.46Å; L990-Q1058 HydrophobicContact CD2-CB 3.79Å; T1054-Q1058 VanDerWaalsContact O-CB 3.29Å; T1054-Q1058 WeakPolarHBondContact O-CB 3.26Å; T1054-Q1058 VanDerWaalsContact O-CG 3.27Å; T1054-Q1058 WeakPolarHBondContact O-CG 3.5Å; T1054-Q1058 PolarHBondContact O-N 2.84Å; T1054-Q1058 PolarHBondContact OG1-NE2 3.11Å; T1054-Q1058 VanDerWaalsContact OG1-NE2 3.13Å; Q1058-S1060 VanDerWaalsContact C-N 3.29Å; Q1058-S1060 PolarHBondContact O-N 3.43Å; Q1058-V1061 PolarHBondContact O-N 2.81Å; Q1058-H1062 PolarHBondContact O-CD2 2.84Å; Q1058-H1062 PolarHBondContact O-N 3.01Å; Q1058-N1115 PolarHBondContact NE2-OD1 2.92Å; Q1058-N1115 PolarHBondContact OE1-ND2 3.22Å; Q1058-N1115 PolarHBondContact OE1-OD1 3.16Å; Q1058-A1181 HydrophobicContact CG-CB 4.42Å
1059	F	91.6	Very high	89.7	Confident	38 Å²	38	40.1 Å²	40.1	17%	0.167	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-44.5	173.5	170.5	-107.2	0	0	0	111.6	L990 L993 I994 V1055 V1061 H1062 F1063	L990-F1059 HydrophobicContact CD2-CB 4.17Å; L993-F1059 HydrophobicContact CB-CD2 3.55Å; L993-F1059 HydrophobicContact CB-CE2 3.71Å; L993-F1059 HydrophobicContact CB-CG 4.21Å; L993-F1059 HydrophobicContact CB-CZ 4.48Å; L993-F1059 HydrophobicContact CD1-CB 4.31Å; L993-F1059 HydrophobicContact CD1-CD2 4.35Å; L993-F1059 HydrophobicContact CD1-CG 4.18Å; I994-F1059 HydrophobicContact CG1-CD2 4.46Å; V1055-F1059 WeakPolarHBondContact O-CB 3.33Å; V1055-F1059 PolarHBondContact O-N 3.2Å; F1059-V1061 VanDerWaalsContact C-N 3.35Å; F1059-V1061 PolarHBondContact O-N 2.94Å; F1059-H1062 PolarHBondContact O-N 2.83Å; F1059-F1063 HydrophobicContact CE2-CB 4.41Å; F1059-F1063 HydrophobicContact CE2-CD2 4.48Å; F1059-F1063 HydrophobicContact CZ-CB 4.33Å; F1059-F1063 HydrophobicContact CZ-CD2 4.02Å; F1059-F1063 HydrophobicContact CZ-CG 4.41Å; F1059-F1063 WeakPolarHBondContact O-CB 3.45Å; F1059-F1063 PolarHBondContact O-N 3.39Å
1060	S	92	Very high	89.9	Confident	52 Å²	52	35.6 Å²	35.6	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-61.5	-41.3	179.1	-57.9	0	0	0	0	112.3	M1056 L1057 Q1058 L1064	M1056-S1060 WeakPolarHBondContact O-CB 3.44Å; M1056-S1060 PolarHBondContact O-N 3.28Å; M1056-S1060 PolarHBondContact O-OG 3.45Å; L1057-S1060 WeakPolarHBondContact O-CB 3.49Å; L1057-S1060 PolarHBondContact O-N 3.39Å; Q1058-S1060 VanDerWaalsContact C-N 3.29Å; Q1058-S1060 PolarHBondContact O-N 3.43Å; S1060-L1064 WeakPolarHBondContact O-CB 3.47Å; S1060-L1064 WeakPolarHBondContact O-CG 3.48Å; S1060-L1064 PolarHBondContact O-N 3.09Å
1061	V	93.6	Very high	90	Very high	22 Å²	22	40.5 Å²	40.5	13%	0.133	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-53.4	176.3	173.5	0	0	0	0	110.6	L1057 Q1058 F1059 F1063 L1064 S1065 L1180 A1181	L1057-V1061 WeakPolarHBondContact O-CG2 3.46Å; L1057-V1061 PolarHBondContact O-N 3.17Å; Q1058-V1061 PolarHBondContact O-N 2.81Å; F1059-V1061 VanDerWaalsContact C-N 3.35Å; F1059-V1061 PolarHBondContact O-N 2.94Å; V1061-F1063 VanDerWaalsContact C-N 3.28Å; V1061-F1063 PolarHBondContact O-N 3.41Å; V1061-L1064 PolarHBondContact O-N 3.43Å; V1061-S1065 PolarHBondContact O-N 2.93Å; V1061-S1065 PolarHBondContact O-OG 3.18Å; V1061-S1065 VanDerWaalsContact O-OG 3.05Å; V1061-L1180 HydrophobicContact CG1-CB 3.83Å; V1061-L1180 HydrophobicContact CG2-CB 4.36Å; V1061-A1181 HydrophobicContact CG1-CB 4.24Å
1062	H	91.3	Very high	90.1	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-58.9	-41.3	178.8	-64.8	-43.4	0	0	0	112.1	I994 Q1058 F1059 S1065 L1066 M1107 D1177	I994-H1062 HydrophobicContact CD1-CB 4.28Å; Q1058-H1062 PolarHBondContact O-CD2 2.84Å; Q1058-H1062 PolarHBondContact O-N 3.01Å; F1059-H1062 PolarHBondContact O-N 2.83Å; H1062-S1065 PolarHBondContact O-N 2.7Å; H1062-L1066 VanDerWaalsContact O-CB 3.24Å; H1062-L1066 WeakPolarHBondContact O-CB 3.43Å; H1062-L1066 PolarHBondContact O-N 3.27Å; H1062-M1107 HydrophobicContact CB-CE 4.44Å; H1062-M1107 HydrophobicContact CB-SD 4.14Å; H1062-M1107 WeakPolarHBondContact O-CE 3.38Å; H1062-D1177 WeakPolarHBondContact CA-OD1 3.18Å; H1062-D1177 IonicContact CE1-OD2 2.71Å; H1062-D1177 PolarHBondContact CE1-OD2 3.33Å; H1062-D1177 IonicContact CG-OD1 2.88Å; H1062-D1177 VanDerWaalsContact ND1-CG 3.33Å; H1062-D1177 IonicContact ND1-OD1 2.66Å; H1062-D1177 PolarHBondContact ND1-OD1 2.96Å; H1062-D1177 VanDerWaalsContact ND1-OD1 3.14Å; H1062-D1177 IonicContact ND1-OD2 2.58Å; H1062-D1177 PolarHBondContact ND1-OD2 3.2Å
1063	F	90	Very high	90.1	Very high	68 Å²	68	39.4 Å²	39.4	30%	0.298	20%	0.197	S	C	.	.	H	α-helix	trans	-62.3	-46.7	177.5	176.9	-94	0	0	0	112.2	Y997 F1059 V1061 L1066 V1067	Y997-F1063 HydrophobicContact CD1-CD2 4.31Å; Y997-F1063 HydrophobicContact CD1-CE2 4.38Å; Y997-F1063 AromaticContact CD2-CD2 3.98Å; Y997-F1063 HydrophobicContact CD2-CD2 3.98Å; Y997-F1063 AromaticContact CD2-CE2 3.36Å; Y997-F1063 HydrophobicContact CD2-CE2 3.36Å; Y997-F1063 HydrophobicContact CD2-CZ 4.4Å; Y997-F1063 HydrophobicContact CE1-CD2 4.48Å; Y997-F1063 HydrophobicContact CE1-CE2 4.34Å; Y997-F1063 HydrophobicContact CE2-CD2 4.13Å; Y997-F1063 AromaticContact CE2-CE2 3.29Å; Y997-F1063 HydrophobicContact CE2-CE2 3.29Å; Y997-F1063 AromaticContact CE2-CZ 3.98Å; Y997-F1063 HydrophobicContact CE2-CZ 3.98Å; Y997-F1063 HydrophobicContact CG-CD2 4.03Å; Y997-F1063 AromaticContact CG-CE2 3.9Å; Y997-F1063 HydrophobicContact CG-CE2 3.9Å; Y997-F1063 AromaticContact CZ-CE2 3.82Å; F1059-F1063 HydrophobicContact CE2-CB 4.41Å; F1059-F1063 HydrophobicContact CE2-CD2 4.48Å; F1059-F1063 HydrophobicContact CZ-CB 4.33Å; F1059-F1063 HydrophobicContact CZ-CD2 4.02Å; F1059-F1063 HydrophobicContact CZ-CG 4.41Å; F1059-F1063 WeakPolarHBondContact O-CB 3.45Å; F1059-F1063 PolarHBondContact O-N 3.39Å; V1061-F1063 VanDerWaalsContact C-N 3.28Å; V1061-F1063 PolarHBondContact O-N 3.41Å; F1063-L1066 PolarHBondContact O-N 3.28Å; F1063-V1067 HydrophobicContact CD1-CG2 4.29Å; F1063-V1067 HydrophobicContact CE1-CG2 3.93Å; F1063-V1067 HydrophobicContact CE2-CG2 4.35Å; F1063-V1067 HydrophobicContact CZ-CG2 3.97Å; F1063-V1067 VanDerWaalsContact O-CG2 3.3Å; F1063-V1067 WeakPolarHBondContact O-CG2 3.43Å; F1063-V1067 PolarHBondContact O-N 3.39Å
1064	L	91.9	Very high	89.9	Confident	114 Å²	114	39.1 Å²	39.1	60%	0.597	19%	0.194	S	C	*	.	H	α-helix	trans	-65.2	-41.8	179	-71.2	170.4	0	0	0	111.8	S1060 V1061 L1066 V1067 Y1068	S1060-L1064 WeakPolarHBondContact O-CB 3.47Å; S1060-L1064 WeakPolarHBondContact O-CG 3.48Å; S1060-L1064 PolarHBondContact O-N 3.09Å; V1061-L1064 PolarHBondContact O-N 3.43Å; L1064-L1066 VanDerWaalsContact C-N 3.31Å; L1064-L1066 PolarHBondContact O-N 3.09Å; L1064-V1067 PolarHBondContact O-N 3.22Å; L1064-Y1068 WeakPolarHBondContact O-CB 3.31Å; L1064-Y1068 PolarHBondContact O-N 3.32Å
1065	S	91.8	Very high	89.6	Confident	16 Å²	16	43 Å²	43	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-42.1	174.4	-58.7	0	0	0	0	111.6	V1061 H1062 Y1068 L1069 D1177	V1061-S1065 PolarHBondContact O-N 2.93Å; V1061-S1065 PolarHBondContact O-OG 3.18Å; V1061-S1065 VanDerWaalsContact O-OG 3.05Å; H1062-S1065 PolarHBondContact O-N 2.7Å; S1065-Y1068 PolarHBondContact O-N 3.01Å; S1065-L1069 PolarHBondContact O-N 3.47Å; S1065-D1177 WeakPolarHBondContact CB-OD1 3.48Å; S1065-D1177 PolarHBondContact OG-OD1 3.42Å
1066	L	89.1	Confident	89.3	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-46.9	178.3	179.5	57	0	0	0	112.2	Y997 L1002 H1062 F1063 L1064 Y1070 V1100 M1103 M1107	Y997-L1066 HydrophobicContact CD1-CD2 3.41Å; Y997-L1066 VanDerWaalsContact CD1-CD2 3.41Å; Y997-L1066 HydrophobicContact CD1-CG 4.26Å; Y997-L1066 HydrophobicContact CE1-CD2 3.55Å; Y997-L1066 HydrophobicContact CE1-CG 3.87Å; L1002-L1066 HydrophobicContact CD1-CD1 4.09Å; L1002-L1066 HydrophobicContact CD1-CD2 4.25Å; L1002-L1066 HydrophobicContact CD1-CG 4.36Å; H1062-L1066 VanDerWaalsContact O-CB 3.24Å; H1062-L1066 WeakPolarHBondContact O-CB 3.43Å; H1062-L1066 PolarHBondContact O-N 3.27Å; F1063-L1066 PolarHBondContact O-N 3.28Å; L1064-L1066 VanDerWaalsContact C-N 3.31Å; L1064-L1066 PolarHBondContact O-N 3.09Å; L1066-Y1070 VanDerWaalsContact O-CB 3.23Å; L1066-Y1070 WeakPolarHBondContact O-CB 3.31Å; L1066-Y1070 PolarHBondContact O-N 2.88Å; L1066-V1100 HydrophobicContact CD1-CG1 4.5Å; L1066-M1103 VanDerWaalsContact CA-SD 3.53Å; L1066-M1103 HydrophobicContact CB-CE 4.35Å; L1066-M1103 HydrophobicContact CB-SD 4.2Å; L1066-M1103 HydrophobicContact CD1-CE 3.19Å; L1066-M1103 HydrophobicContact CD1-CG 4.3Å; L1066-M1103 HydrophobicContact CD1-SD 3.92Å; L1066-M1103 HydrophobicContact CG-CE 4.29Å; L1066-M1107 HydrophobicContact CB-CE 4.01Å; L1066-M1107 HydrophobicContact CB-SD 4.32Å
1067	V	89.1	Confident	88.7	Confident	32 Å²	32	47.1 Å²	47.1	19%	0.194	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-43.8	176.8	172.1	0	0	0	0	111.2	Y997 F1063 L1064 Y1070 Q1071	Y997-V1067 WeakPolarHBondContact OH-CG2 3.29Å; F1063-V1067 HydrophobicContact CD1-CG2 4.29Å; F1063-V1067 HydrophobicContact CE1-CG2 3.93Å; F1063-V1067 HydrophobicContact CE2-CG2 4.35Å; F1063-V1067 HydrophobicContact CZ-CG2 3.97Å; F1063-V1067 VanDerWaalsContact O-CG2 3.3Å; F1063-V1067 WeakPolarHBondContact O-CG2 3.43Å; F1063-V1067 PolarHBondContact O-N 3.39Å; L1064-V1067 PolarHBondContact O-N 3.22Å; V1067-Y1070 PolarHBondContact O-N 2.98Å; V1067-Q1071 WeakPolarHBondContact O-CG 3.48Å; V1067-Q1071 PolarHBondContact O-N 3.29Å
1068	Y	91.8	Very high	87.9	Confident	102 Å²	102	49.7 Å²	49.7	40%	0.4	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-50.7	-179.9	175.5	-106.1	0	0	0	112	L1064 S1065 Y1070 Q1071 E1072 V1173	L1064-Y1068 WeakPolarHBondContact O-CB 3.31Å; L1064-Y1068 PolarHBondContact O-N 3.32Å; S1065-Y1068 PolarHBondContact O-N 3.01Å; Y1068-Y1070 VanDerWaalsContact C-N 3.31Å; Y1068-Y1070 PolarHBondContact O-N 3.03Å; Y1068-Q1071 PolarHBondContact O-N 3.07Å; Y1068-E1072 HydrophobicContact CD2-CG 4.47Å; Y1068-E1072 HydrophobicContact CE1-CG 4.1Å; Y1068-E1072 HydrophobicContact CE2-CG 3.97Å; Y1068-E1072 WeakPolarHBondContact O-CG 3.21Å; Y1068-E1072 PolarHBondContact O-N 2.91Å; Y1068-V1173 HydrophobicContact CD1-CG2 3.81Å; Y1068-V1173 HydrophobicContact CE1-CG2 3.67Å
1069	L	88.4	Confident	86.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-32.2	179.3	-79.1	174.6	0	0	0	112.6	S1065 A1073 T1099 M1103 F1166 V1169 I1170 V1173	S1065-L1069 PolarHBondContact O-N 3.47Å; L1069-A1073 VanDerWaalsContact O-CB 3.31Å; L1069-A1073 WeakPolarHBondContact O-CB 3.26Å; L1069-A1073 PolarHBondContact O-N 3.24Å; L1069-T1099 HydrophobicContact CB-CG2 4.49Å; L1069-M1103 HydrophobicContact CB-CE 3.49Å; L1069-M1103 VanDerWaalsContact CB-CE 3.49Å; L1069-M1103 HydrophobicContact CB-SD 3.85Å; L1069-M1103 HydrophobicContact CD1-CE 3.98Å; L1069-M1103 HydrophobicContact CD1-CG 4.47Å; L1069-M1103 HydrophobicContact CD1-SD 3.32Å; L1069-M1103 WeakPolarHBondContact CD1-SD 2.91Å; L1069-M1103 HydrophobicContact CG-CE 4.38Å; L1069-M1103 HydrophobicContact CG-SD 4.14Å; L1069-F1166 HydrophobicContact CD2-CE2 4.34Å; L1069-V1169 HydrophobicContact CD2-CG1 4.27Å; L1069-I1170 HydrophobicContact CD2-CG1 3.99Å; L1069-V1173 HydrophobicContact CD1-CB 3.83Å; L1069-V1173 HydrophobicContact CD1-CG1 3.59Å; L1069-V1173 HydrophobicContact CD1-CG2 4.49Å; L1069-V1173 HydrophobicContact CD2-CB 4.16Å; L1069-V1173 HydrophobicContact CD2-CG1 4.46Å; L1069-V1173 HydrophobicContact CD2-CG2 3.97Å; L1069-V1173 HydrophobicContact CG-CB 4.06Å; L1069-V1173 HydrophobicContact CG-CG1 3.83Å; L1069-V1173 HydrophobicContact CG-CG2 4.2Å
1070	Y	87.8	Confident	84.8	Confident	20 Å²	20	61.9 Å²	61.9	8%	0.078	32%	0.321	C	S	.	.	H	α-helix	trans	-61.7	-48.3	172	172.3	-97.9	0	0	0	111.7	L1002 E1005 V1007 L1066 V1067 Y1068 E1072 A1073 Q1074 V1096 V1100	L1002-Y1070 HydrophobicContact CD2-CD2 3.65Å; L1002-Y1070 HydrophobicContact CD2-CE2 3.95Å; L1002-Y1070 HydrophobicContact CD2-CG 3.98Å; E1005-Y1070 HydrophobicContact CB-CE2 4.44Å; E1005-Y1070 VanDerWaalsContact CB-OH 3.26Å; E1005-Y1070 WeakPolarHBondContact CB-OH 3.4Å; E1005-Y1070 VanDerWaalsContact CD-OH 3.29Å; E1005-Y1070 WeakPolarHBondContact CG-OH 3.27Å; E1005-Y1070 PolarHBondContact OE2-OH 2.81Å; V1007-Y1070 HydrophobicContact CG2-CE2 4.27Å; L1066-Y1070 VanDerWaalsContact O-CB 3.23Å; L1066-Y1070 WeakPolarHBondContact O-CB 3.31Å; L1066-Y1070 PolarHBondContact O-N 2.88Å; V1067-Y1070 PolarHBondContact O-N 2.98Å; Y1068-Y1070 VanDerWaalsContact C-N 3.31Å; Y1068-Y1070 PolarHBondContact O-N 3.03Å; Y1070-E1072 PolarHBondContact O-N 3.24Å; Y1070-A1073 PolarHBondContact O-N 3.11Å; Y1070-Q1074 WeakPolarHBondContact O-CB 3.36Å; Y1070-Q1074 PolarHBondContact O-N 2.86Å; Y1070-V1096 HydrophobicContact CD2-CG1 3.71Å; Y1070-V1096 HydrophobicContact CE2-CG1 3.58Å; Y1070-V1100 HydrophobicContact CD2-CG2 4.3Å
1071	Q	87.2	Confident	82.9	Confident	111 Å²	111	69 Å²	69	52%	0.519	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-42.3	177.8	-72.6	175.8	-3.3	0	0	112	V1067 Y1068 Q1074 A1075	V1067-Q1071 WeakPolarHBondContact O-CG 3.48Å; V1067-Q1071 PolarHBondContact O-N 3.29Å; Y1068-Q1071 PolarHBondContact O-N 3.07Å; Q1071-Q1074 PolarHBondContact O-N 3.03Å; Q1071-A1075 WeakPolarHBondContact O-CB 3.44Å; Q1071-A1075 PolarHBondContact O-N 3.17Å
1072	E	87.4	Confident	81.3	Confident	52 Å²	52	74.2 Å²	74.2	24%	0.243	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-37.5	176.4	-77.9	-69.6	151.6	0	0	112.6	Y1068 Y1070 R1076 F1166	Y1068-E1072 HydrophobicContact CD2-CG 4.47Å; Y1068-E1072 HydrophobicContact CE1-CG 4.1Å; Y1068-E1072 HydrophobicContact CE2-CG 3.97Å; Y1068-E1072 WeakPolarHBondContact O-CG 3.21Å; Y1068-E1072 PolarHBondContact O-N 2.91Å; Y1070-E1072 PolarHBondContact O-N 3.24Å; E1072-R1076 PolarHBondContact O-N 2.98Å; E1072-R1076 PolarHBondContact O-NH1 3.4Å; E1072-R1076 IonicContact OE2-CZ 3.8Å; E1072-R1076 IonicContact OE2-NH1 3.63Å; E1072-R1076 PolarHBondContact OE2-NH1 3.5Å; E1072-R1076 IonicContact OE2-NH2 2.79Å; E1072-R1076 PolarHBondContact OE2-NH2 3.24Å; E1072-F1166 HydrophobicContact CB-CE2 3.96Å; E1072-F1166 HydrophobicContact CB-CZ 4.49Å
1073	A	85.4	Confident	79.7	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-67.1	-40.5	173.3	0	0	0	0	0	111.3	L1069 Y1070 R1076 S1077 V1096 T1099 F1166	L1069-A1073 VanDerWaalsContact O-CB 3.31Å; L1069-A1073 WeakPolarHBondContact O-CB 3.26Å; L1069-A1073 PolarHBondContact O-N 3.24Å; Y1070-A1073 PolarHBondContact O-N 3.11Å; A1073-R1076 PolarHBondContact O-N 3.03Å; A1073-S1077 PolarHBondContact O-N 2.89Å; A1073-S1077 VanDerWaalsContact O-N 3.09Å; A1073-V1096 HydrophobicContact CB-CG2 4.09Å; A1073-T1099 HydrophobicContact CB-CG2 4.33Å; A1073-F1166 HydrophobicContact CB-CE1 4.04Å; A1073-F1166 HydrophobicContact CB-CZ 3.82Å
1074	Q	84.4	Confident	78.3	Confident	67 Å²	67	83.5 Å²	83.5	31%	0.313	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-42.3	178.1	-170.6	174.1	18.1	0	0	111.7	Y1070 Q1071 R1076 S1077	Y1070-Q1074 WeakPolarHBondContact O-CB 3.36Å; Y1070-Q1074 PolarHBondContact O-N 2.86Å; Q1071-Q1074 PolarHBondContact O-N 3.03Å; Q1074-R1076 PolarHBondContact O-N 3.09Å; Q1074-S1077 WeakPolarHBondContact CA-OG 3.33Å; Q1074-S1077 PolarHBondContact O-N 3.22Å; Q1074-S1077 VanDerWaalsContact O-N 3.09Å; Q1074-S1077 PolarHBondContact O-OG 3.5Å
1075	A	84.6	Confident	77.1	Confident	83 Å²	83	80.2 Å²	80.2	69%	0.686	40%	0.399	S	S	*	.	H	α-helix	trans	-62.3	-25.2	177.1	0	0	0	0	0	113.6	Q1071	Q1071-A1075 WeakPolarHBondContact O-CB 3.44Å; Q1071-A1075 PolarHBondContact O-N 3.17Å
1076	R	82.4	Confident	75.9	Confident	103 Å²	103	83.7 Å²	83.7	39%	0.389	42%	0.416	S	S	.	.	H	α-helix	trans	-96.2	-7.9	176.9	-66.5	-178.1	-174.9	77.4	4.3	113.5	E1072 A1073 Q1074 L1095	E1072-R1076 PolarHBondContact O-N 2.98Å; E1072-R1076 PolarHBondContact O-NH1 3.4Å; E1072-R1076 IonicContact OE2-CZ 3.8Å; E1072-R1076 IonicContact OE2-NH1 3.63Å; E1072-R1076 PolarHBondContact OE2-NH1 3.5Å; E1072-R1076 IonicContact OE2-NH2 2.79Å; E1072-R1076 PolarHBondContact OE2-NH2 3.24Å; A1073-R1076 PolarHBondContact O-N 3.03Å; Q1074-R1076 PolarHBondContact O-N 3.09Å; R1076-L1095 HydrophobicContact CB-CD2 4.02Å
1077	S	78.9	Confident	74.8	Confident	33 Å²	33	83.9 Å²	83.9	23%	0.231	42%	0.417	C	S	.	.	S	Bend	trans	-84.4	150.9	173.9	70.7	0	0	0	0	110.6	A1073 Q1074	A1073-S1077 PolarHBondContact O-N 2.89Å; A1073-S1077 VanDerWaalsContact O-N 3.09Å; Q1074-S1077 WeakPolarHBondContact CA-OG 3.33Å; Q1074-S1077 PolarHBondContact O-N 3.22Å; Q1074-S1077 VanDerWaalsContact O-N 3.09Å; Q1074-S1077 PolarHBondContact O-OG 3.5Å
1078	P	73.9	Confident	73.6	Confident	122 Å²	122	86.9 Å²	86.9	79%	0.792	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-57.5	145.2	176.5	22.7	-32.4	0	0	0	111.7	K1080	P1078-K1080 PolarHBondContact O-N 2.94Å
1079	E	60.5	Low	72.3	Confident	188 Å²	188	87.1 Å²	87.1	88%	0.879	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-54.5	133.6	-178.7	-76.1	-174	158.2	0	0	111.7	Q1081	E1079-Q1081 PolarHBondContact O-N 3.46Å; E1079-Q1081 VanDerWaalsContact O-N 3.16Å
1080	K	60.3	Low	71.2	Confident	107 Å²	107	95.5 Å²	95.5	47%	0.465	47%	0.468	S	S	.	.			trans	-62.4	115.3	179	-71.5	-174.8	176.8	-173.8	0	109.8	E1005 P1078 E1082	E1005-K1080 IonicContact OE2-NZ 3.95Å; E1005-K1080 PolarHBondContact OE2-NZ 3.5Å; P1078-K1080 PolarHBondContact O-N 2.94Å; K1080-E1082 VanDerWaalsContact C-N 3.31Å
1081	Q	51.4	Low	70.5	Confident	200 Å²	200	97.6 Å²	97.6	94%	0.935	48%	0.478	S	S	*	.	S	Bend	trans	-75.8	-18.1	177	-71.4	179.1	-14.4	0	0	113.2	E1079	E1079-Q1081 PolarHBondContact O-N 3.46Å; E1079-Q1081 VanDerWaalsContact O-N 3.16Å
1082	E	59.8	Low	69.8	Low	132 Å²	132	97.7 Å²	97.7	62%	0.617	48%	0.478	S	S	*	.	S	Bend	trans	-119.1	138.1	-179.8	-64.5	-178.4	166.5	0	0	111.3	K1080 F1084	K1080-E1082 VanDerWaalsContact C-N 3.31Å; E1082-F1084 VanDerWaalsContact C-N 3.26Å; E1082-F1084 PolarHBondContact O-N 3.18Å
1083	Q	57.9	Low	69.2	Low	183 Å²	183	98.7 Å²	98.7	86%	0.855	49%	0.489	S	S	*	.	S	Bend	trans	-70.6	-22	-177.9	-164.6	171.1	7	0	0	112.8
1084	F	61.3	Low	69	Low	81 Å²	81	100.9 Å²	100.9	36%	0.355	50%	0.504	S	S	.	.	S	Bend	trans	-130.8	136.1	173.8	-61	-76.5	0	0	0	109.1	D466 E1082	D466-F1084 HydrophobicContact CB-CD1 3.68Å; D466-F1084 HydrophobicContact CB-CD2 4.41Å; D466-F1084 HydrophobicContact CB-CE1 3.9Å; D466-F1084 HydrophobicContact CB-CG 3.95Å; D466-F1084 HydrophobicContact CB-CZ 4.36Å; D466-F1084 VanDerWaalsContact OD2-CB 3.27Å; D466-F1084 WeakPolarHBondContact OD2-CB 3.49Å; E1082-F1084 VanDerWaalsContact C-N 3.26Å; E1082-F1084 PolarHBondContact O-N 3.18Å
1085	V	66.4	Low	69	Low	46 Å²	46	98.9 Å²	98.9	28%	0.279	50%	0.495	S	S	.	.			trans	-80.2	134.2	179.3	-176.8	0	0	0	0	109.9	L1087	V1085-L1087 PolarHBondContact O-N 3.21Å
1086	D	66.1	Low	68.9	Low	88 Å²	88	95.6 Å²	95.6	47%	0.471	47%	0.467	S	S	.	.			trans	-71.4	98.6	170.4	-172.3	1.3	0	0	0	110.8	Y1088	D1086-Y1088 PolarHBondContact O-N 3.4Å; D1086-Y1088 WeakPolarHBondContact OD1-CB 3.44Å; D1086-Y1088 PolarHBondContact OD1-N 3.12Å
1087	L	66.1	Low	69	Low	11 Å²	11	90.9 Å²	90.9	6%	0.058	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-5.2	177.4	-61.6	175	0	0	0	113	Y1003 L1004 K1008 V1085	Y1003-L1087 HydrophobicContact CD1-CD1 4.47Å; Y1003-L1087 HydrophobicContact CE1-CD1 3.99Å; Y1003-L1087 WeakPolarHBondContact O-CD2 3.47Å; L1004-L1087 HydrophobicContact CD2-CD1 4.42Å; K1008-L1087 WeakPolarHBondContact CE-O 3.39Å; K1008-L1087 PolarHBondContact NZ-O 2.74Å; V1085-L1087 PolarHBondContact O-N 3.21Å
1088	Y	63.2	Low	69.3	Low	95 Å²	95	89.4 Å²	89.4	37%	0.373	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-4.6	179.7	-54.6	-59.8	0	0	0	113.8	K473 D1086	K473-Y1088 HydrophobicContact CB-CE1 3.98Å; K473-Y1088 HydrophobicContact CD-CD1 3.74Å; K473-Y1088 HydrophobicContact CD-CE1 3.1Å; K473-Y1088 HydrophobicContact CG-CE1 4.14Å; D1086-Y1088 PolarHBondContact O-N 3.4Å; D1086-Y1088 WeakPolarHBondContact OD1-CB 3.44Å; D1086-Y1088 PolarHBondContact OD1-N 3.12Å
1089	K	65.8	Low	69.9	Low	107 Å²	107	83.6 Å²	83.6	47%	0.465	40%	0.402	S	S	.	.	S	Bend	trans	-63.5	141.5	172.3	-154.2	178.1	-173	-165.2	0	110.7	K1008 E1092	K1008-K1089 PolarHBondContact NZ-O 3.39Å; K1008-K1089 VanDerWaalsContact NZ-O 3.1Å; K1089-E1092 VanDerWaalsContact CE-CD 3.41Å; K1089-E1092 WeakPolarHBondContact CE-OE1 3.46Å; K1089-E1092 WeakPolarHBondContact CE-OE2 3.4Å; K1089-E1092 IonicContact NZ-OE1 3.72Å; K1089-E1092 PolarHBondContact NZ-OE1 3.21Å; K1089-E1092 IonicContact NZ-OE2 2.8Å; K1089-E1092 PolarHBondContact NZ-OE2 3.48Å
1090	E	64.4	Low	71.2	Confident	176 Å²	176	74.7 Å²	74.7	82%	0.822	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-57.5	154.9	170.6	-74.3	-173.9	173.1	0	0	110.3	E1092	E1090-E1092 PolarHBondContact O-N 3.42Å; E1090-E1092 VanDerWaalsContact O-N 3.12Å
1091	F	73.9	Confident	72.5	Confident	65 Å²	65	69.6 Å²	69.6	29%	0.285	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-52.9	120.7	-179.7	170.4	-85.3	0	0	0	110.6	K1008 P1093 N1097	K1008-F1091 WeakPolarHBondContact O-CD2 3.34Å; K1008-F1091 WeakPolarHBondContact O-CE2 3.34Å; F1091-P1093 HydrophobicContact CE1-CB 4.49Å; F1091-N1097 WeakPolarHBondContact CE2-ND2 3.33Å
1092	E	71.2	Confident	74.2	Confident	112 Å²	112	60.3 Å²	60.3	52%	0.523	29%	0.294	S	S	.	.			trans	-115.2	134.4	170	-74.2	-176.9	168.5	0	0	109.9	K1089 E1090 S1094	K1089-E1092 VanDerWaalsContact CE-CD 3.41Å; K1089-E1092 WeakPolarHBondContact CE-OE1 3.46Å; K1089-E1092 WeakPolarHBondContact CE-OE2 3.4Å; K1089-E1092 IonicContact NZ-OE1 3.72Å; K1089-E1092 PolarHBondContact NZ-OE1 3.21Å; K1089-E1092 IonicContact NZ-OE2 2.8Å; K1089-E1092 PolarHBondContact NZ-OE2 3.48Å; E1090-E1092 PolarHBondContact O-N 3.42Å; E1090-E1092 VanDerWaalsContact O-N 3.12Å; E1092-S1094 PolarHBondContact O-N 3.45Å
1093	P	75.9	Confident	75.5	Confident	74 Å²	74	54 Å²	54	48%	0.481	27%	0.265	S	S	.	.			trans	-67.6	119.4	-179.7	29.6	-35.2	0	0	0	109.5	F1091 G1158 V1160	F1091-P1093 HydrophobicContact CE1-CB 4.49Å; P1093-G1158 WeakPolarHBondContact CB-O 3.44Å; P1093-V1160 HydrophobicContact CB-CG2 3.75Å; P1093-V1160 WeakPolarHBondContact O-CG2 3.35Å
1094	S	81.5	Confident	76.8	Confident	45 Å²	45	45.7 Å²	45.7	32%	0.315	23%	0.227	S	C	.	.			trans	-124.4	156.5	176.6	78.9	0	0	0	0	111.6	E1092 V1096 N1097 S1098	E1092-S1094 PolarHBondContact O-N 3.45Å; S1094-V1096 PolarHBondContact O-N 3.39Å; S1094-N1097 PolarHBondContact O-N 3.35Å; S1094-N1097 WeakPolarHBondContact OG-CB 3.46Å; S1094-N1097 PolarHBondContact OG-N 3.06Å; S1094-S1098 PolarHBondContact O-N 2.98Å; S1094-S1098 PolarHBondContact O-OG 3.43Å
1095	L	82.4	Confident	78	Confident	25 Å²	25	42.1 Å²	42.1	13%	0.131	21%	0.212	C	C	.	.	H	α-helix	trans	-59.4	-40.1	176.1	-176.2	67.8	0	0	0	111.1	R1076 T1099 I1162 F1166	R1076-L1095 HydrophobicContact CB-CD2 4.02Å; L1095-T1099 WeakPolarHBondContact O-CB 3.36Å; L1095-T1099 PolarHBondContact O-N 3.05Å; L1095-T1099 PolarHBondContact O-OG1 2.88Å; L1095-I1162 HydrophobicContact CD1-CB 4.39Å; L1095-I1162 HydrophobicContact CD1-CG1 4.12Å; L1095-I1162 HydrophobicContact CD1-CG2 4.32Å; L1095-F1166 HydrophobicContact CD1-CD1 4.4Å; L1095-F1166 HydrophobicContact CG-CE1 4.46Å
1096	V	84.2	Confident	79.1	Confident	15 Å²	15	40.7 Å²	40.7	9%	0.091	21%	0.205	C	C	.	.	H	α-helix	trans	-64.4	-46.5	177.6	180	0	0	0	0	110.4	V1007 Y1070 A1073 S1094 T1099 V1100	V1007-V1096 HydrophobicContact CG2-CG1 3.68Å; Y1070-V1096 HydrophobicContact CD2-CG1 3.71Å; Y1070-V1096 HydrophobicContact CE2-CG1 3.58Å; A1073-V1096 HydrophobicContact CB-CG2 4.09Å; S1094-V1096 PolarHBondContact O-N 3.39Å; V1096-T1099 PolarHBondContact O-N 3.49Å; V1096-V1100 HydrophobicContact CG1-CG2 4.3Å; V1096-V1100 WeakPolarHBondContact O-CB 3.46Å; V1096-V1100 VanDerWaalsContact O-CG2 3.28Å; V1096-V1100 WeakPolarHBondContact O-CG2 3.18Å; V1096-V1100 PolarHBondContact O-N 3.38Å
1097	N	83.8	Confident	80.2	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-45.5	-179.1	-168	10.5	0	0	0	112.6	V1007 K1008 F1091 S1094 T1099 V1100 Y1101	V1007-N1097 HydrophobicContact CG1-CB 4.47Å; K1008-N1097 PolarHBondContact O-ND2 3.39Å; K1008-N1097 PolarHBondContact O-OD1 3.11Å; F1091-N1097 WeakPolarHBondContact CE2-ND2 3.33Å; S1094-N1097 PolarHBondContact O-N 3.35Å; S1094-N1097 WeakPolarHBondContact OG-CB 3.46Å; S1094-N1097 PolarHBondContact OG-N 3.06Å; N1097-T1099 VanDerWaalsContact C-N 3.31Å; N1097-T1099 PolarHBondContact O-N 2.85Å; N1097-V1100 PolarHBondContact O-N 3.2Å; N1097-Y1101 WeakPolarHBondContact O-CB 3.13Å; N1097-Y1101 PolarHBondContact O-N 3.48Å
1098	S	86.1	Confident	81.3	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	18%	0.183	C	C	.	.	H	α-helix	trans	-60.6	-41.2	176.5	-54.9	0	0	0	0	111.7	S1094 I1102 V1160	S1094-S1098 PolarHBondContact O-N 2.98Å; S1094-S1098 PolarHBondContact O-OG 3.43Å; S1098-I1102 VanDerWaalsContact O-CG1 3.29Å; S1098-I1102 WeakPolarHBondContact O-CG1 3.42Å; S1098-I1102 PolarHBondContact O-N 3.29Å; S1098-I1102 VanDerWaalsContact O-N 3.16Å; S1098-V1160 PolarHBondContact OG-N 3.11Å
1099	T	86.6	Confident	82.5	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-68.6	-46.2	179	-55.9	0	0	0	0	112	L1069 A1073 L1095 V1096 N1097 M1103 F1166 I1170	L1069-T1099 HydrophobicContact CB-CG2 4.49Å; A1073-T1099 HydrophobicContact CB-CG2 4.33Å; L1095-T1099 WeakPolarHBondContact O-CB 3.36Å; L1095-T1099 PolarHBondContact O-N 3.05Å; L1095-T1099 PolarHBondContact O-OG1 2.88Å; V1096-T1099 PolarHBondContact O-N 3.49Å; N1097-T1099 VanDerWaalsContact C-N 3.31Å; N1097-T1099 PolarHBondContact O-N 2.85Å; T1099-M1103 VanDerWaalsContact O-CB 3.26Å; T1099-M1103 WeakPolarHBondContact O-CB 3.39Å; T1099-M1103 PolarHBondContact O-N 3.48Å; T1099-F1166 HydrophobicContact CG2-CE1 4.11Å; T1099-F1166 HydrophobicContact CG2-CZ 3.92Å; T1099-F1166 WeakPolarHBondContact OG1-CE1 3.19Å; T1099-I1170 HydrophobicContact CG2-CD1 3.91Å; T1099-I1170 HydrophobicContact CG2-CG1 4.21Å
1100	V	86.7	Confident	83.6	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-41.4	178.9	170.8	0	0	0	0	110.9	L1002 V1007 F1009 L1066 Y1070 V1096 N1097 M1103 A1104	L1002-V1100 HydrophobicContact CD1-CG1 3.65Å; L1002-V1100 HydrophobicContact CD1-CG2 4.31Å; V1007-V1100 HydrophobicContact CG1-CB 4.04Å; V1007-V1100 HydrophobicContact CG1-CG1 4Å; V1007-V1100 HydrophobicContact CG1-CG2 4.28Å; F1009-V1100 HydrophobicContact CE1-CG1 4.03Å; F1009-V1100 HydrophobicContact CZ-CG1 4.11Å; L1066-V1100 HydrophobicContact CD1-CG1 4.5Å; Y1070-V1100 HydrophobicContact CD2-CG2 4.3Å; V1096-V1100 HydrophobicContact CG1-CG2 4.3Å; V1096-V1100 WeakPolarHBondContact O-CB 3.46Å; V1096-V1100 VanDerWaalsContact O-CG2 3.28Å; V1096-V1100 WeakPolarHBondContact O-CG2 3.18Å; V1096-V1100 PolarHBondContact O-N 3.38Å; N1097-V1100 PolarHBondContact O-N 3.2Å; V1100-M1103 PolarHBondContact O-N 2.9Å; V1100-A1104 VanDerWaalsContact O-CB 3.28Å; V1100-A1104 WeakPolarHBondContact O-CB 3.18Å; V1100-A1104 PolarHBondContact O-N 3.03Å
1101	Y	86.8	Confident	84.9	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-51.7	177.9	175.9	-108.9	0	0	0	112.5	F1009 Q1013 N1097 M1103 A1104 M1105 L1145 L1159	F1009-Y1101 HydrophobicContact CD1-CD2 4.1Å; F1009-Y1101 HydrophobicContact CE1-CD2 4.35Å; Q1013-Y1101 HydrophobicContact CB-CD2 3.95Å; Q1013-Y1101 HydrophobicContact CB-CE1 4.3Å; Q1013-Y1101 HydrophobicContact CB-CE2 3.49Å; Q1013-Y1101 VanDerWaalsContact CB-CE2 3.49Å; Q1013-Y1101 HydrophobicContact CG-CD1 4.28Å; Q1013-Y1101 HydrophobicContact CG-CD2 4.31Å; Q1013-Y1101 HydrophobicContact CG-CE1 4.02Å; Q1013-Y1101 HydrophobicContact CG-CE2 4.08Å; Q1013-Y1101 HydrophobicContact CG-CG 4.4Å; Q1013-Y1101 PolarHBondContact O-OH 3.05Å; N1097-Y1101 WeakPolarHBondContact O-CB 3.13Å; N1097-Y1101 PolarHBondContact O-N 3.48Å; Y1101-M1103 PolarHBondContact O-N 2.97Å; Y1101-A1104 PolarHBondContact O-N 2.75Å; Y1101-M1105 HydrophobicContact CD2-CG 4.22Å; Y1101-M1105 HydrophobicContact CE1-CG 4.13Å; Y1101-M1105 HydrophobicContact CE2-CG 3.72Å; Y1101-M1105 HydrophobicContact CE2-SD 4.24Å; Y1101-M1105 WeakPolarHBondContact O-CB 3.21Å; Y1101-M1105 WeakPolarHBondContact O-CG 3.44Å; Y1101-M1105 PolarHBondContact O-N 3.34Å; Y1101-L1145 HydrophobicContact CE1-CD1 4.39Å; Y1101-L1159 HydrophobicContact CD1-CD2 4.36Å
1102	I	87.4	Confident	85.7	Confident	4 Å²	4	16.7 Å²	16.7	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-58.3	-40.2	179.1	-69.3	170.5	0	0	0	110.4	S1098 A1106 I1142 L1146 I1162	S1098-I1102 VanDerWaalsContact O-CG1 3.29Å; S1098-I1102 WeakPolarHBondContact O-CG1 3.42Å; S1098-I1102 PolarHBondContact O-N 3.29Å; S1098-I1102 VanDerWaalsContact O-N 3.16Å; I1102-A1106 VanDerWaalsContact O-CB 3.32Å; I1102-A1106 WeakPolarHBondContact O-CB 3.45Å; I1102-A1106 PolarHBondContact O-N 3.3Å; I1102-I1142 HydrophobicContact CG2-CG2 4.21Å; I1102-L1146 HydrophobicContact CG2-CD1 4.46Å; I1102-I1162 HydrophobicContact CD1-CD1 3.95Å
1103	M	87.1	Confident	86.5	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-70	-45.6	178.2	175.8	163.3	42.3	0	0	113	L1066 L1069 T1099 V1100 Y1101 M1105 A1106 M1107 L1174	L1066-M1103 VanDerWaalsContact CA-SD 3.53Å; L1066-M1103 HydrophobicContact CB-CE 4.35Å; L1066-M1103 HydrophobicContact CB-SD 4.2Å; L1066-M1103 HydrophobicContact CD1-CE 3.19Å; L1066-M1103 HydrophobicContact CD1-CG 4.3Å; L1066-M1103 HydrophobicContact CD1-SD 3.92Å; L1066-M1103 HydrophobicContact CG-CE 4.29Å; L1069-M1103 HydrophobicContact CB-CE 3.49Å; L1069-M1103 VanDerWaalsContact CB-CE 3.49Å; L1069-M1103 HydrophobicContact CB-SD 3.85Å; L1069-M1103 HydrophobicContact CD1-CE 3.98Å; L1069-M1103 HydrophobicContact CD1-CG 4.47Å; L1069-M1103 HydrophobicContact CD1-SD 3.32Å; L1069-M1103 WeakPolarHBondContact CD1-SD 2.91Å; L1069-M1103 HydrophobicContact CG-CE 4.38Å; L1069-M1103 HydrophobicContact CG-SD 4.14Å; T1099-M1103 VanDerWaalsContact O-CB 3.26Å; T1099-M1103 WeakPolarHBondContact O-CB 3.39Å; T1099-M1103 PolarHBondContact O-N 3.48Å; V1100-M1103 PolarHBondContact O-N 2.9Å; Y1101-M1103 PolarHBondContact O-N 2.97Å; M1103-M1105 VanDerWaalsContact C-N 3.27Å; M1103-M1105 PolarHBondContact O-N 3.46Å; M1103-A1106 PolarHBondContact O-N 3.23Å; M1103-A1106 VanDerWaalsContact O-N 3.14Å; M1103-M1107 HydrophobicContact CG-CE 3.41Å; M1103-M1107 VanDerWaalsContact CG-CE 3.41Å; M1103-M1107 HydrophobicContact CG-CG 4.19Å; M1103-M1107 HydrophobicContact CG-SD 3.66Å; M1103-M1107 WeakPolarHBondContact O-CB 3.22Å; M1103-M1107 VanDerWaalsContact O-CG 3.3Å; M1103-M1107 WeakPolarHBondContact O-CG 3.23Å; M1103-M1107 PolarHBondContact O-N 3.42Å; M1103-M1107 HydrophobicContact SD-CE 3.44Å; M1103-M1107 WeakPolarHBondContact SD-CE 3.35Å; M1103-M1107 HydrophobicContact SD-SD 4.33Å; M1103-L1174 HydrophobicContact CG-CD2 4.3Å
1104	A	86.3	Confident	87.2	Confident	8 Å²	8	9.1 Å²	9.1	7%	0.066	6%	0.061	C	C	.	.	H	α-helix	trans	-59.3	-42	176.9	0	0	0	0	0	111	F1009 V1100 Y1101 Q1108	F1009-A1104 HydrophobicContact CZ-CB 4.48Å; V1100-A1104 VanDerWaalsContact O-CB 3.28Å; V1100-A1104 WeakPolarHBondContact O-CB 3.18Å; V1100-A1104 PolarHBondContact O-N 3.03Å; Y1101-A1104 PolarHBondContact O-N 2.75Å; A1104-Q1108 WeakPolarHBondContact O-CB 3.39Å; A1104-Q1108 VanDerWaalsContact O-CG 3.29Å; A1104-Q1108 WeakPolarHBondContact O-CG 3.29Å; A1104-Q1108 PolarHBondContact O-N 2.98Å
1105	M	87.1	Confident	87.6	Confident	7 Å²	7	7 Å²	7	3%	0.034	5%	0.046	C	C	.	.	H	α-helix	trans	-60.8	-48	172.4	-76.8	-62.1	-66.5	0	0	112.1	Q1017 L1020 Y1101 M1103 Q1108 M1109 I1142	Q1017-M1105 HydrophobicContact CB-CE 4.4Å; Q1017-M1105 HydrophobicContact CB-SD 3.41Å; Q1017-M1105 WeakPolarHBondContact CB-SD 3.12Å; Q1017-M1105 HydrophobicContact CG-SD 3.38Å; Q1017-M1105 WeakPolarHBondContact CG-SD 3.39Å; L1020-M1105 HydrophobicContact CD1-CE 3.63Å; Y1101-M1105 HydrophobicContact CD2-CG 4.22Å; Y1101-M1105 HydrophobicContact CE1-CG 4.13Å; Y1101-M1105 HydrophobicContact CE2-CG 3.72Å; Y1101-M1105 HydrophobicContact CE2-SD 4.24Å; Y1101-M1105 WeakPolarHBondContact O-CB 3.21Å; Y1101-M1105 WeakPolarHBondContact O-CG 3.44Å; Y1101-M1105 PolarHBondContact O-N 3.34Å; M1103-M1105 VanDerWaalsContact C-N 3.27Å; M1103-M1105 PolarHBondContact O-N 3.46Å; M1105-Q1108 PolarHBondContact O-N 3.47Å; M1105-M1109 VanDerWaalsContact O-CG 3.31Å; M1105-M1109 WeakPolarHBondContact O-CG 3.43Å; M1105-M1109 PolarHBondContact O-N 2.94Å; M1105-M1109 VanDerWaalsContact O-N 3.07Å; M1105-I1142 HydrophobicContact CB-CG1 4.29Å
1106	A	89.4	Confident	87.9	Confident	16 Å²	16	6.2 Å²	6.2	13%	0.132	4%	0.041	C	C	.	.	H	α-helix	trans	-63.9	-43	179.6	0	0	0	0	0	112.9	I1102 M1103 M1109 A1110 I1142 L1174	I1102-A1106 VanDerWaalsContact O-CB 3.32Å; I1102-A1106 WeakPolarHBondContact O-CB 3.45Å; I1102-A1106 PolarHBondContact O-N 3.3Å; M1103-A1106 PolarHBondContact O-N 3.23Å; M1103-A1106 VanDerWaalsContact O-N 3.14Å; A1106-M1109 PolarHBondContact O-N 3.45Å; A1106-A1110 WeakPolarHBondContact O-CB 3.45Å; A1106-A1110 PolarHBondContact O-N 3.38Å; A1106-I1142 HydrophobicContact CB-CD1 4.3Å; A1106-I1142 HydrophobicContact CB-CG2 4.2Å; A1106-L1174 HydrophobicContact CB-CD1 3.9Å; A1106-L1174 HydrophobicContact CB-CD2 3.63Å; A1106-L1174 HydrophobicContact CB-CG 4.37Å
1107	M	89	Confident	87.8	Confident	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64	-43.2	177.8	-72.5	172.9	171.8	0	0	111.8	H1062 L1066 M1103 M1109 A1110 T1111	H1062-M1107 HydrophobicContact CB-CE 4.44Å; H1062-M1107 HydrophobicContact CB-SD 4.14Å; H1062-M1107 WeakPolarHBondContact O-CE 3.38Å; L1066-M1107 HydrophobicContact CB-CE 4.01Å; L1066-M1107 HydrophobicContact CB-SD 4.32Å; M1103-M1107 HydrophobicContact CG-CE 3.41Å; M1103-M1107 VanDerWaalsContact CG-CE 3.41Å; M1103-M1107 HydrophobicContact CG-CG 4.19Å; M1103-M1107 HydrophobicContact CG-SD 3.66Å; M1103-M1107 WeakPolarHBondContact O-CB 3.22Å; M1103-M1107 VanDerWaalsContact O-CG 3.3Å; M1103-M1107 WeakPolarHBondContact O-CG 3.23Å; M1103-M1107 PolarHBondContact O-N 3.42Å; M1103-M1107 HydrophobicContact SD-CE 3.44Å; M1103-M1107 WeakPolarHBondContact SD-CE 3.35Å; M1103-M1107 HydrophobicContact SD-SD 4.33Å; M1107-M1109 VanDerWaalsContact C-N 3.33Å; M1107-M1109 PolarHBondContact O-N 3.5Å; M1107-A1110 WeakPolarHBondContact O-CB 3.36Å; M1107-A1110 PolarHBondContact O-N 2.71Å; M1107-T1111 WeakPolarHBondContact O-CG2 3.4Å; M1107-T1111 PolarHBondContact O-N 2.74Å; M1107-T1111 PolarHBondContact O-OG1 3.29Å
1108	Q	87.7	Confident	87.7	Confident	13 Å²	13	7.3 Å²	7.3	6%	0.061	5%	0.046	C	C	.	.	H	α-helix	trans	-65.5	-34.4	176.1	-73.7	178.5	-2.2	0	0	112.7	A1104 M1105 T1111 F1112	A1104-Q1108 WeakPolarHBondContact O-CB 3.39Å; A1104-Q1108 VanDerWaalsContact O-CG 3.29Å; A1104-Q1108 WeakPolarHBondContact O-CG 3.29Å; A1104-Q1108 PolarHBondContact O-N 2.98Å; M1105-Q1108 PolarHBondContact O-N 3.47Å; Q1108-T1111 WeakPolarHBondContact CA-OG1 3.32Å; Q1108-T1111 PolarHBondContact O-OG1 2.9Å; Q1108-F1112 WeakPolarHBondContact O-CD2 3.46Å
1109	M	89.2	Confident	87.6	Confident	12 Å²	12	11.3 Å²	11.3	6%	0.059	7%	0.073	C	C	.	.	H	α-helix	trans	-73.7	-35.9	174	-64.8	-56.5	103	0	0	111.7	L1021 M1105 A1106 M1107 F1112 A1113 S1138 I1142	L1021-M1109 HydrophobicContact CD1-CE 4.36Å; M1105-M1109 VanDerWaalsContact O-CG 3.31Å; M1105-M1109 WeakPolarHBondContact O-CG 3.43Å; M1105-M1109 PolarHBondContact O-N 2.94Å; M1105-M1109 VanDerWaalsContact O-N 3.07Å; A1106-M1109 PolarHBondContact O-N 3.45Å; M1107-M1109 VanDerWaalsContact C-N 3.33Å; M1107-M1109 PolarHBondContact O-N 3.5Å; M1109-F1112 HydrophobicContact CE-CD2 4.08Å; M1109-F1112 HydrophobicContact CE-CE2 4.03Å; M1109-F1112 PolarHBondContact O-N 3.38Å; M1109-A1113 PolarHBondContact O-N 2.99Å; M1109-S1138 VanDerWaalsContact SD-CB 3.54Å; M1109-I1142 HydrophobicContact CB-CD1 4.25Å; M1109-I1142 HydrophobicContact CG-CD1 3.88Å
1110	A	89.8	Confident	87.5	Confident	11 Å²	11	13.1 Å²	13.1	9%	0.091	8%	0.084	C	C	.	.	H	α-helix	trans	-62.5	-42.1	174.4	0	0	0	0	0	111.9	A1106 M1107 F1112 A1113 I1114 F1178	A1106-A1110 WeakPolarHBondContact O-CB 3.45Å; A1106-A1110 PolarHBondContact O-N 3.38Å; M1107-A1110 WeakPolarHBondContact O-CB 3.36Å; M1107-A1110 PolarHBondContact O-N 2.71Å; A1110-F1112 VanDerWaalsContact C-N 3.28Å; A1110-F1112 PolarHBondContact O-N 3.09Å; A1110-A1113 PolarHBondContact O-N 3.28Å; A1110-A1113 VanDerWaalsContact O-N 3.16Å; A1110-I1114 HydrophobicContact CB-CD1 4.38Å; A1110-I1114 WeakPolarHBondContact O-CB 3.44Å; A1110-I1114 VanDerWaalsContact O-CG1 3.26Å; A1110-I1114 WeakPolarHBondContact O-CG1 3.35Å; A1110-I1114 PolarHBondContact O-N 2.99Å; A1110-F1178 HydrophobicContact CB-CD2 3.92Å
1111	T	90.5	Very high	87.6	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.4	-36.2	178.3	48.7	0	0	0	0	112.1	L990 N991 M1107 Q1108 N1115	L990-T1111 HydrophobicContact CB-CG2 4.09Å; L990-T1111 HydrophobicContact CD1-CG2 4.09Å; N991-T1111 PolarHBondContact OD1-OG1 2.99Å; M1107-T1111 WeakPolarHBondContact O-CG2 3.4Å; M1107-T1111 PolarHBondContact O-N 2.74Å; M1107-T1111 PolarHBondContact O-OG1 3.29Å; Q1108-T1111 WeakPolarHBondContact CA-OG1 3.32Å; Q1108-T1111 PolarHBondContact O-OG1 2.9Å; T1111-N1115 VanDerWaalsContact O-CB 3.25Å; T1111-N1115 WeakPolarHBondContact O-CB 3.38Å; T1111-N1115 PolarHBondContact O-N 3.42Å; T1111-N1115 PolarHBondContact O-ND2 2.58Å
1112	F	90.1	Very high	87.7	Confident	2 Å²	2	14.3 Å²	14.3	1%	0.009	9%	0.089	C	C	.	.	H	α-helix	trans	-65.1	-49.5	172.2	-76.3	-68.7	0	0	0	112.7	I987 L1021 C1024 F1025 I1028 Q1108 M1109 A1110 I1114 Y1116 L1135	I987-F1112 HydrophobicContact CD1-CD1 3.74Å; I987-F1112 HydrophobicContact CD1-CE1 4.13Å; I987-F1112 HydrophobicContact CG1-CD1 4.42Å; I987-F1112 HydrophobicContact CG2-CD1 3.9Å; I987-F1112 HydrophobicContact CG2-CE1 3.64Å; I987-F1112 HydrophobicContact CG2-CG 4.49Å; I987-F1112 HydrophobicContact CG2-CZ 3.99Å; L1021-F1112 HydrophobicContact CD1-CE2 3.36Å; L1021-F1112 HydrophobicContact CD1-CZ 3.68Å; L1021-F1112 HydrophobicContact CG-CE2 4.2Å; L1021-F1112 HydrophobicContact CG-CZ 4.12Å; C1024-F1112 HydrophobicContact CB-CD1 4.09Å; C1024-F1112 HydrophobicContact CB-CD2 3.96Å; C1024-F1112 HydrophobicContact CB-CE1 3.86Å; C1024-F1112 HydrophobicContact CB-CE2 3.72Å; C1024-F1112 HydrophobicContact CB-CG 4.14Å; C1024-F1112 HydrophobicContact CB-CZ 3.68Å; F1025-F1112 AromaticContact CD1-CE1 3.94Å; F1025-F1112 HydrophobicContact CD1-CE1 3.94Å; F1025-F1112 HydrophobicContact CD1-CZ 4.36Å; F1025-F1112 HydrophobicContact CD2-CE1 4.16Å; F1025-F1112 AromaticContact CD2-CZ 3.75Å; F1025-F1112 HydrophobicContact CD2-CZ 3.75Å; F1025-F1112 AromaticContact CE1-CE1 3.86Å; F1025-F1112 HydrophobicContact CE1-CE1 3.86Å; F1025-F1112 HydrophobicContact CE1-CZ 4.23Å; F1025-F1112 HydrophobicContact CE2-CE1 4.09Å; F1025-F1112 AromaticContact CE2-CZ 3.6Å; F1025-F1112 HydrophobicContact CE2-CZ 3.6Å; F1025-F1112 HydrophobicContact CG-CE1 4.08Å; F1025-F1112 HydrophobicContact CG-CZ 4.14Å; F1025-F1112 AromaticContact CZ-CE1 3.94Å; F1025-F1112 HydrophobicContact CZ-CE1 3.94Å; F1025-F1112 AromaticContact CZ-CZ 3.85Å; F1025-F1112 HydrophobicContact CZ-CZ 3.85Å; I1028-F1112 HydrophobicContact CD1-CD1 3.33Å; I1028-F1112 HydrophobicContact CD1-CE1 3.6Å; Q1108-F1112 WeakPolarHBondContact O-CD2 3.46Å; M1109-F1112 HydrophobicContact CE-CD2 4.08Å; M1109-F1112 HydrophobicContact CE-CE2 4.03Å; M1109-F1112 PolarHBondContact O-N 3.38Å; A1110-F1112 VanDerWaalsContact C-N 3.28Å; A1110-F1112 PolarHBondContact O-N 3.09Å; F1112-I1114 VanDerWaalsContact C-N 3.32Å; F1112-I1114 PolarHBondContact O-N 2.87Å; F1112-Y1116 WeakPolarHBondContact O-CB 3.37Å; F1112-Y1116 PolarHBondContact O-N 3.05Å; F1112-L1135 HydrophobicContact CB-CD2 4.03Å
1113	A	89.8	Confident	87.8	Confident	27 Å²	27	16.5 Å²	16.5	22%	0.223	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-36.6	-177.2	0	0	0	0	0	112.4	M1109 A1110 L1135 F1178	M1109-A1113 PolarHBondContact O-N 2.99Å; A1110-A1113 PolarHBondContact O-N 3.28Å; A1110-A1113 VanDerWaalsContact O-N 3.16Å; A1113-L1135 HydrophobicContact CB-CD1 4.33Å; A1113-F1178 HydrophobicContact CB-CE2 4.08Å
1114	I	90.3	Very high	87.9	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-76.6	-45.4	-179.5	-65	166.3	0	0	0	111.4	A1110 F1112 F1178 A1181 L1182 D1185	A1110-I1114 HydrophobicContact CB-CD1 4.38Å; A1110-I1114 WeakPolarHBondContact O-CB 3.44Å; A1110-I1114 VanDerWaalsContact O-CG1 3.26Å; A1110-I1114 WeakPolarHBondContact O-CG1 3.35Å; A1110-I1114 PolarHBondContact O-N 2.99Å; F1112-I1114 VanDerWaalsContact C-N 3.32Å; F1112-I1114 PolarHBondContact O-N 2.87Å; I1114-F1178 HydrophobicContact CD1-CD2 4.01Å; I1114-F1178 HydrophobicContact CD1-CE2 4.21Å; I1114-F1178 HydrophobicContact CG1-CD2 4.12Å; I1114-F1178 HydrophobicContact CG1-CE2 3.8Å; I1114-F1178 HydrophobicContact CG1-CZ 4.36Å; I1114-A1181 HydrophobicContact CD1-CB 3.64Å; I1114-L1182 HydrophobicContact CG1-CB 4.4Å; I1114-L1182 HydrophobicContact CG1-CD1 4.48Å; I1114-L1182 HydrophobicContact CG2-CD1 4.32Å; I1114-D1185 HydrophobicContact CG2-CB 4.23Å
1115	N	89.5	Confident	87.9	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-84.6	-11.7	-173	-68.3	-67.2	0	0	0	114	I987 L990 Q1058 T1111 K1117	I987-N1115 HydrophobicContact CD1-CB 4.38Å; I987-N1115 HydrophobicContact CG1-CB 3.85Å; L990-N1115 VanDerWaalsContact CD1-ND2 3.29Å; L990-N1115 WeakPolarHBondContact CD1-ND2 3.44Å; Q1058-N1115 PolarHBondContact NE2-OD1 2.92Å; Q1058-N1115 PolarHBondContact OE1-ND2 3.22Å; Q1058-N1115 PolarHBondContact OE1-OD1 3.16Å; T1111-N1115 VanDerWaalsContact O-CB 3.25Å; T1111-N1115 WeakPolarHBondContact O-CB 3.38Å; T1111-N1115 PolarHBondContact O-N 3.42Å; T1111-N1115 PolarHBondContact O-ND2 2.58Å; N1115-K1117 PolarHBondContact O-N 3.25Å
1116	Y	89.4	Confident	88	Confident	8 Å²	8	24 Å²	24	3%	0.031	15%	0.146	C	C	.	.			trans	-68.8	112.3	170.6	-172.4	-95.1	0	0	0	110.8	I1028 S1031 F1112 M1122 E1123 L1125 N1128 L1131	I1028-Y1116 HydrophobicContact CG1-CD2 4.14Å; I1028-Y1116 HydrophobicContact CG1-CE2 4.47Å; S1031-Y1116 WeakPolarHBondContact OG-CE2 3.4Å; S1031-Y1116 PolarHBondContact OG-OH 3.42Å; F1112-Y1116 WeakPolarHBondContact O-CB 3.37Å; F1112-Y1116 PolarHBondContact O-N 3.05Å; Y1116-M1122 HydrophobicContact CE2-SD 4.19Å; Y1116-E1123 PolarHBondContact OH-O 2.88Å; Y1116-L1125 HydrophobicContact CD1-CB 3.82Å; Y1116-L1125 HydrophobicContact CD1-CD1 3.51Å; Y1116-L1125 HydrophobicContact CD1-CG 4.26Å; Y1116-L1125 HydrophobicContact CE1-CB 4.12Å; Y1116-L1125 HydrophobicContact CE1-CD1 4.02Å; Y1116-L1125 HydrophobicContact CG-CD1 3.89Å; Y1116-N1128 PolarHBondContact OH-ND2 3.13Å; Y1116-L1131 HydrophobicContact CD1-CD2 4.38Å; Y1116-L1131 HydrophobicContact CD2-CD2 3.52Å; Y1116-L1131 HydrophobicContact CE1-CD2 4.41Å; Y1116-L1131 HydrophobicContact CE2-CD2 3.56Å; Y1116-L1131 HydrophobicContact CG-CD2 3.94Å
1117	K	82.1	Confident	88	Confident	34 Å²	34	28.3 Å²	28.3	15%	0.148	16%	0.163	C	C	.	.			trans	-115	119.6	178.9	-49.4	-169.3	175.9	-140.1	0	110.6	Q983 Y1050 N1115 M1122 D1185	Q983-K1117 VanDerWaalsContact NE2-CA 3.34Å; Q983-K1117 VanDerWaalsContact NE2-CB 3.3Å; Q983-K1117 PolarHBondContact NE2-O 3.46Å; Y1050-K1117 WeakPolarHBondContact OH-CE 3.16Å; Y1050-K1117 PolarHBondContact OH-NZ 3.42Å; N1115-K1117 PolarHBondContact O-N 3.25Å; K1117-M1122 WeakPolarHBondContact O-CE 3.49Å; K1117-M1122 WeakPolarHBondContact O-CG 3.46Å; K1117-D1185 VanDerWaalsContact CE-OD2 3.31Å; K1117-D1185 WeakPolarHBondContact CE-OD2 3.47Å; K1117-D1185 IonicContact NZ-OD1 2.79Å; K1117-D1185 PolarHBondContact NZ-OD1 2.94Å; K1117-D1185 IonicContact NZ-OD2 2.66Å; K1117-D1185 PolarHBondContact NZ-OD2 3.44Å
1118	G	81.8	Confident	87.9	Confident	7 Å²	7	28.7 Å²	28.7	7%	0.072	17%	0.165	C	C	.	.			trans	-88.6	-92.2	178.5	0	0	0	0	0	113.6	F1121 M1122 E1123	G1118-F1121 PolarHBondContact O-N 2.79Å; G1118-M1122 CarbonylContact C-O 3.54Å; G1118-M1122 VanDerWaalsContact CA-CG 3.5Å; G1118-M1122 WeakPolarHBondContact CA-O 3.48Å; G1118-M1122 PolarHBondContact O-N 3.09Å; G1118-E1123 WeakPolarHBondContact CA-O 3.49Å
1119	P	82.9	Confident	88	Confident	86 Å²	86	35 Å²	35	56%	0.558	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	141.2	-178.4	-22.3	33.3	0	0	0	112.1
1120	P	85.8	Confident	88	Confident	39 Å²	39	37.2 Å²	37.2	25%	0.253	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	cis	-101.2	18.8	13.9	40.3	-38.9	0	0	0	115.2	S1038 E1040	S1038-P1120 WeakPolarHBondContact CB-O 3.42Å; S1038-P1120 PolarHBondContact OG-O 2.98Å; S1038-P1120 VanDerWaalsContact OG-O 3.07Å; E1040-P1120 HydrophobicContact CB-CG 4.24Å
1121	F	87.7	Confident	88	Confident	26 Å²	26	36.8 Å²	36.8	11%	0.114	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-38	-172.5	-54.6	-65.3	0	0	0	114.2	R975 V979 L1034 S1038 E1040 P1042 G1118	R975-F1121 HydrophobicContact CB-CD1 4.14Å; V979-F1121 HydrophobicContact CG2-CB 4.26Å; V979-F1121 HydrophobicContact CG2-CD2 3.73Å; V979-F1121 HydrophobicContact CG2-CE2 4.35Å; V979-F1121 HydrophobicContact CG2-CG 4.08Å; L1034-F1121 PolarHBondContact N-O 2.79Å; L1034-F1121 VanDerWaalsContact N-O 3.14Å; S1038-F1121 WeakPolarHBondContact OG-CD1 3.03Å; S1038-F1121 WeakPolarHBondContact OG-CE1 3.31Å; E1040-F1121 HydrophobicContact CB-CZ 4.1Å; E1040-F1121 VanDerWaalsContact O-CE1 3.24Å; E1040-F1121 WeakPolarHBondContact O-CE1 3.37Å; P1042-F1121 HydrophobicContact CB-CE2 4.45Å; P1042-F1121 HydrophobicContact CB-CZ 4.41Å; G1118-F1121 PolarHBondContact O-N 2.79Å
1122	M	88.6	Confident	88.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-130	168.1	-177.3	73.5	-176.2	82	0	0	111	V979 K1032 Y1116 K1117 G1118	V979-M1122 HydrophobicContact CB-CE 3.47Å; V979-M1122 VanDerWaalsContact CB-CE 3.47Å; V979-M1122 HydrophobicContact CG1-CE 3.24Å; K1032-M1122 VanDerWaalsContact O-CA 3.3Å; K1032-M1122 WeakPolarHBondContact O-CA 3.4Å; K1032-M1122 WeakPolarHBondContact O-CB 3.44Å; Y1116-M1122 HydrophobicContact CE2-SD 4.19Å; K1117-M1122 WeakPolarHBondContact O-CE 3.49Å; K1117-M1122 WeakPolarHBondContact O-CG 3.46Å; G1118-M1122 CarbonylContact C-O 3.54Å; G1118-M1122 VanDerWaalsContact CA-CG 3.5Å; G1118-M1122 WeakPolarHBondContact CA-O 3.48Å; G1118-M1122 PolarHBondContact O-N 3.09Å
1123	E	89.6	Confident	88.1	Confident	49 Å²	49	47.1 Å²	47.1	23%	0.229	25%	0.248	C	C	.	.			trans	-53.4	145.5	174.2	-73.8	178.3	172.5	0	0	111.4	K1032 Y1116 G1118 E1127	K1032-E1123 HydrophobicContact CB-CG 4.2Å; K1032-E1123 PolarHBondContact O-N 2.99Å; Y1116-E1123 PolarHBondContact OH-O 2.88Å; G1118-E1123 WeakPolarHBondContact CA-O 3.49Å; E1123-E1127 WeakPolarHBondContact CA-OE2 3.43Å; E1123-E1127 HydrophobicContact CB-CB 3.93Å; E1123-E1127 HydrophobicContact CG-CB 4.36Å
1124	S	89.1	Confident	88.1	Confident	27 Å²	27	46.6 Å²	46.6	19%	0.189	24%	0.243	C	C	.	.			trans	-67.6	159.6	175.2	63.1	0	0	0	0	111.3	P1126 E1127 N1128	S1124-P1126 VanDerWaalsContact C-CD 3.49Å; S1124-E1127 PolarHBondContact N-OE2 3.13Å; S1124-E1127 WeakPolarHBondContact O-CB 3.38Å; S1124-E1127 PolarHBondContact O-N 2.58Å; S1124-E1127 WeakPolarHBondContact OG-CG 3.37Å; S1124-E1127 PolarHBondContact OG-OE2 3.35Å; S1124-N1128 PolarHBondContact O-N 3.48Å
1125	L	87.5	Confident	88.2	Confident	49 Å²	49	47.7 Å²	47.7	26%	0.257	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-48.3	-49.4	177.4	-170.4	68.3	0	0	0	112.9	Y1116 E1127 N1128 L1131 V1132 L1135	Y1116-L1125 HydrophobicContact CD1-CB 3.82Å; Y1116-L1125 HydrophobicContact CD1-CD1 3.51Å; Y1116-L1125 HydrophobicContact CD1-CG 4.26Å; Y1116-L1125 HydrophobicContact CE1-CB 4.12Å; Y1116-L1125 HydrophobicContact CE1-CD1 4.02Å; Y1116-L1125 HydrophobicContact CG-CD1 3.89Å; L1125-E1127 VanDerWaalsContact C-N 3.26Å; L1125-E1127 PolarHBondContact O-N 3.25Å; L1125-N1128 PolarHBondContact O-N 2.88Å; L1125-L1131 HydrophobicContact CD1-CD2 3.66Å; L1125-L1131 HydrophobicContact CD1-CG 4.05Å; L1125-V1132 HydrophobicContact CG-CG2 4.29Å; L1125-V1132 WeakPolarHBondContact O-CG2 3.38Å; L1125-L1135 HydrophobicContact CD1-CD1 4Å; L1125-L1135 HydrophobicContact CD2-CD1 4.34Å
1126	P	88.6	Confident	88.2	Confident	98 Å²	98	50.2 Å²	50.2	64%	0.636	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-65.7	-23	180	26	-35.9	0	0	0	114.8	S1124	S1124-P1126 VanDerWaalsContact C-CD 3.49Å
1127	E	88.2	Confident	88.3	Confident	106 Å²	106	53.7 Å²	53.7	50%	0.495	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-77.1	-30.6	177.1	-70.7	167.8	154.2	0	0	111.4	E1123 S1124 L1125 K1129	E1123-E1127 WeakPolarHBondContact CA-OE2 3.43Å; E1123-E1127 HydrophobicContact CB-CB 3.93Å; E1123-E1127 HydrophobicContact CG-CB 4.36Å; S1124-E1127 PolarHBondContact N-OE2 3.13Å; S1124-E1127 WeakPolarHBondContact O-CB 3.38Å; S1124-E1127 PolarHBondContact O-N 2.58Å; S1124-E1127 WeakPolarHBondContact OG-CG 3.37Å; S1124-E1127 PolarHBondContact OG-OE2 3.35Å; L1125-E1127 VanDerWaalsContact C-N 3.26Å; L1125-E1127 PolarHBondContact O-N 3.25Å; E1127-K1129 VanDerWaalsContact C-N 3.3Å; E1127-K1129 PolarHBondContact O-N 3.05Å
1128	N	88.8	Confident	88.6	Confident	7 Å²	7	52 Å²	52	4%	0.037	28%	0.278	C	S	.	.			trans	-78.9	74.6	173.4	-169.7	-9	0	0	0	111.5	F1027 S1031 Y1116 S1124 L1125 P1130 L1131 V1132	F1027-N1128 PolarHBondContact O-ND2 3.46Å; S1031-N1128 PolarHBondContact OG-ND2 3.49Å; Y1116-N1128 PolarHBondContact OH-ND2 3.13Å; S1124-N1128 PolarHBondContact O-N 3.48Å; L1125-N1128 PolarHBondContact O-N 2.88Å; N1128-P1130 VanDerWaalsContact C-CD 3.5Å; N1128-P1130 WeakPolarHBondContact OD1-CD 3.45Å; N1128-L1131 HydrophobicContact CB-CB 4.23Å; N1128-L1131 PolarHBondContact O-N 2.71Å; N1128-L1131 VanDerWaalsContact O-N 3.13Å; N1128-L1131 PolarHBondContact OD1-N 3.1Å; N1128-V1132 WeakPolarHBondContact O-CG2 3.35Å; N1128-V1132 PolarHBondContact O-N 3.33Å
1129	K	89.4	Confident	88.9	Confident	146 Å²	146	56.3 Å²	56.3	64%	0.635	30%	0.299	S	S	*	.	H	α-helix	trans	-51.1	-44.8	-177.7	-58.6	-174.3	179.5	-175.4	0	114.3	E1127 L1131 V1132 W1133	E1127-K1129 VanDerWaalsContact C-N 3.3Å; E1127-K1129 PolarHBondContact O-N 3.05Å; K1129-L1131 PolarHBondContact O-N 3.05Å; K1129-V1132 PolarHBondContact O-N 3.37Å; K1129-W1133 PolarHBondContact O-N 3.04Å
1130	P	89.6	Confident	89.2	Confident	59 Å²	59	57.6 Å²	57.6	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-58.5	-44.7	178.2	-25.1	34.1	0	0	0	113.4	F1027 N1128 W1133 S1134	F1027-P1130 HydrophobicContact CB-CB 4.36Å; F1027-P1130 HydrophobicContact CD1-CB 3.47Å; F1027-P1130 VanDerWaalsContact CD1-CB 3.47Å; F1027-P1130 HydrophobicContact CE1-CB 3.85Å; F1027-P1130 HydrophobicContact CG-CB 3.9Å; N1128-P1130 VanDerWaalsContact C-CD 3.5Å; N1128-P1130 WeakPolarHBondContact OD1-CD 3.45Å; P1130-W1133 PolarHBondContact O-N 3.37Å; P1130-S1134 PolarHBondContact O-N 3.34Å
1131	L	89.6	Confident	89.2	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-66.5	-41.3	178.8	-178.7	59	0	0	0	111.4	F1027 I1028 Y1116 L1125 N1128 K1129 S1134 L1135	F1027-L1131 HydrophobicContact CB-CB 3.96Å; F1027-L1131 HydrophobicContact CB-CD1 4.13Å; I1028-L1131 HydrophobicContact CG1-CD1 4.04Å; I1028-L1131 HydrophobicContact CG1-CD2 3.91Å; Y1116-L1131 HydrophobicContact CD1-CD2 4.38Å; Y1116-L1131 HydrophobicContact CD2-CD2 3.52Å; Y1116-L1131 HydrophobicContact CE1-CD2 4.41Å; Y1116-L1131 HydrophobicContact CE2-CD2 3.56Å; Y1116-L1131 HydrophobicContact CG-CD2 3.94Å; L1125-L1131 HydrophobicContact CD1-CD2 3.66Å; L1125-L1131 HydrophobicContact CD1-CG 4.05Å; N1128-L1131 HydrophobicContact CB-CB 4.23Å; N1128-L1131 PolarHBondContact O-N 2.71Å; N1128-L1131 VanDerWaalsContact O-N 3.13Å; N1128-L1131 PolarHBondContact OD1-N 3.1Å; K1129-L1131 PolarHBondContact O-N 3.05Å; L1131-S1134 WeakPolarHBondContact O-CB 3.47Å; L1131-S1134 PolarHBondContact O-N 3.26Å; L1131-L1135 HydrophobicContact CD1-CD1 4.48Å; L1131-L1135 HydrophobicContact CD1-CG 4.42Å; L1131-L1135 HydrophobicContact CG-CD1 4.27Å; L1131-L1135 WeakPolarHBondContact O-CG 3.31Å; L1131-L1135 PolarHBondContact O-N 3.4Å
1132	V	91.3	Very high	89.1	Confident	45 Å²	45	56.6 Å²	56.6	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-47.2	176.7	175	0	0	0	0	111.3	L1125 N1128 K1129 S1134 L1135 V1136	L1125-V1132 HydrophobicContact CG-CG2 4.29Å; L1125-V1132 WeakPolarHBondContact O-CG2 3.38Å; N1128-V1132 WeakPolarHBondContact O-CG2 3.35Å; N1128-V1132 PolarHBondContact O-N 3.33Å; K1129-V1132 PolarHBondContact O-N 3.37Å; V1132-S1134 VanDerWaalsContact C-N 3.27Å; V1132-S1134 PolarHBondContact O-N 2.66Å; V1132-L1135 PolarHBondContact O-N 2.88Å; V1132-V1136 HydrophobicContact CG1-CG2 4.1Å; V1132-V1136 WeakPolarHBondContact O-CB 2.98Å; V1132-V1136 VanDerWaalsContact O-CG2 3.26Å; V1132-V1136 WeakPolarHBondContact O-CG2 3.5Å; V1132-V1136 PolarHBondContact O-N 2.92Å
1133	W	91.1	Very high	89	Confident	175 Å²	175	60 Å²	60	66%	0.663	32%	0.317	S	S	*	.	H	α-helix	trans	-60.2	-40.2	176.7	-82	115.6	0	0	0	111.7	K1129 P1130 V1136 V1137	K1129-W1133 PolarHBondContact O-N 3.04Å; P1130-W1133 PolarHBondContact O-N 3.37Å; W1133-V1136 PolarHBondContact O-N 3.35Å; W1133-V1137 WeakPolarHBondContact O-CB 3.33Å; W1133-V1137 WeakPolarHBondContact O-CG2 3.35Å; W1133-V1137 PolarHBondContact O-N 3.15Å
1134	S	90.4	Very high	88.7	Confident	16 Å²	16	58.9 Å²	58.9	11%	0.112	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-48.3	174.2	-163.5	0	0	0	0	111.9	C1024 P1130 L1131 V1132 V1137 S1138	C1024-S1134 PolarHBondContact SG-OG 3.01Å; P1130-S1134 PolarHBondContact O-N 3.34Å; L1131-S1134 WeakPolarHBondContact O-CB 3.47Å; L1131-S1134 PolarHBondContact O-N 3.26Å; V1132-S1134 VanDerWaalsContact C-N 3.27Å; V1132-S1134 PolarHBondContact O-N 2.66Å; S1134-V1137 PolarHBondContact O-N 2.74Å; S1134-S1138 WeakPolarHBondContact O-CB 3.38Å; S1134-S1138 PolarHBondContact O-N 3.24Å; S1134-S1138 PolarHBondContact O-OG 2.98Å; S1134-S1138 VanDerWaalsContact O-OG 3.04Å
1135	L	90.3	Very high	88.4	Confident	22 Å²	22	58.2 Å²	58.2	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-39.2	178.8	-70	173.1	0	0	0	112.4	F1112 A1113 L1125 L1131 V1132 S1138 L1139	F1112-L1135 HydrophobicContact CB-CD2 4.03Å; A1113-L1135 HydrophobicContact CB-CD1 4.33Å; L1125-L1135 HydrophobicContact CD1-CD1 4Å; L1125-L1135 HydrophobicContact CD2-CD1 4.34Å; L1131-L1135 HydrophobicContact CD1-CD1 4.48Å; L1131-L1135 HydrophobicContact CD1-CG 4.42Å; L1131-L1135 HydrophobicContact CG-CD1 4.27Å; L1131-L1135 WeakPolarHBondContact O-CG 3.31Å; L1131-L1135 PolarHBondContact O-N 3.4Å; V1132-L1135 PolarHBondContact O-N 2.88Å; L1135-S1138 PolarHBondContact O-N 2.8Å; L1135-L1139 VanDerWaalsContact O-CB 3.25Å; L1135-L1139 WeakPolarHBondContact O-CB 3.27Å; L1135-L1139 PolarHBondContact O-N 3.18Å
1136	V	91.4	Very high	88.2	Confident	55 Å²	55	57 Å²	57	33%	0.333	31%	0.306	S	S	.	.	H	α-helix	trans	-66.7	-43.9	177.2	169.6	0	0	0	0	110.7	V1132 W1133 L1139 L1140	V1132-V1136 HydrophobicContact CG1-CG2 4.1Å; V1132-V1136 WeakPolarHBondContact O-CB 2.98Å; V1132-V1136 VanDerWaalsContact O-CG2 3.26Å; V1132-V1136 WeakPolarHBondContact O-CG2 3.5Å; V1132-V1136 PolarHBondContact O-N 2.92Å; W1133-V1136 PolarHBondContact O-N 3.35Å; V1136-L1139 PolarHBondContact O-N 3.06Å; V1136-L1140 HydrophobicContact CG1-CD1 3.91Å; V1136-L1140 HydrophobicContact CG1-CG 4.3Å; V1136-L1140 WeakPolarHBondContact O-CB 3.39Å; V1136-L1140 VanDerWaalsContact O-CG 3.26Å; V1136-L1140 WeakPolarHBondContact O-CG 3.3Å; V1136-L1140 PolarHBondContact O-N 3.41Å
1137	V	89.8	Confident	88	Confident	80 Å²	80	57.6 Å²	57.6	49%	0.485	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-45.1	176	168.8	0	0	0	0	110.6	W1133 S1134 L1139 L1140 A1141	W1133-V1137 WeakPolarHBondContact O-CB 3.33Å; W1133-V1137 WeakPolarHBondContact O-CG2 3.35Å; W1133-V1137 PolarHBondContact O-N 3.15Å; S1134-V1137 PolarHBondContact O-N 2.74Å; V1137-L1139 PolarHBondContact O-N 2.9Å; V1137-L1140 PolarHBondContact O-N 3.43Å; V1137-A1141 WeakPolarHBondContact O-CB 3.29Å; V1137-A1141 PolarHBondContact O-N 3.42Å
1138	S	88.4	Confident	87.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-41.7	175.3	-61.2	0	0	0	0	112.2	M1109 S1134 L1135 A1141 I1142	M1109-S1138 VanDerWaalsContact SD-CB 3.54Å; S1134-S1138 WeakPolarHBondContact O-CB 3.38Å; S1134-S1138 PolarHBondContact O-N 3.24Å; S1134-S1138 PolarHBondContact O-OG 2.98Å; S1134-S1138 VanDerWaalsContact O-OG 3.04Å; L1135-S1138 PolarHBondContact O-N 2.8Å; S1138-A1141 WeakPolarHBondContact O-CB 3.33Å; S1138-A1141 PolarHBondContact O-N 3.32Å; S1138-I1142 WeakPolarHBondContact O-CD1 3Å; S1138-I1142 VanDerWaalsContact O-CG1 3.28Å; S1138-I1142 WeakPolarHBondContact O-CG1 3.19Å; S1138-I1142 PolarHBondContact O-N 2.83Å
1139	L	88.9	Confident	86.5	Confident	97 Å²	97	58.3 Å²	58.3	51%	0.508	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-42.4	178	-177.8	64.1	0	0	0	111.8	L1135 V1136 V1137 A1141 I1142 I1143	L1135-L1139 VanDerWaalsContact O-CB 3.25Å; L1135-L1139 WeakPolarHBondContact O-CB 3.27Å; L1135-L1139 PolarHBondContact O-N 3.18Å; V1136-L1139 PolarHBondContact O-N 3.06Å; V1137-L1139 PolarHBondContact O-N 2.9Å; L1139-A1141 VanDerWaalsContact C-N 3.3Å; L1139-A1141 PolarHBondContact O-N 2.87Å; L1139-I1142 PolarHBondContact O-N 2.98Å; L1139-I1143 HydrophobicContact CD1-CD1 4.12Å; L1139-I1143 HydrophobicContact CD1-CG1 4.39Å; L1139-I1143 HydrophobicContact CG-CD1 3.9Å; L1139-I1143 WeakPolarHBondContact O-CB 3.49Å; L1139-I1143 VanDerWaalsContact O-CG1 3.31Å; L1139-I1143 WeakPolarHBondContact O-CG1 3.41Å; L1139-I1143 PolarHBondContact O-N 2.9Å
1140	L	88.9	Confident	85.9	Confident	112 Å²	112	53.6 Å²	53.6	59%	0.586	31%	0.31	S	S	*	.	H	α-helix	trans	-63.3	-37.9	174.4	-73.8	173.2	0	0	0	111.4	V1136 V1137 G1144	V1136-L1140 HydrophobicContact CG1-CD1 3.91Å; V1136-L1140 HydrophobicContact CG1-CG 4.3Å; V1136-L1140 WeakPolarHBondContact O-CB 3.39Å; V1136-L1140 VanDerWaalsContact O-CG 3.26Å; V1136-L1140 WeakPolarHBondContact O-CG 3.3Å; V1136-L1140 PolarHBondContact O-N 3.41Å; V1137-L1140 PolarHBondContact O-N 3.43Å; L1140-G1144 PolarHBondContact O-N 3.33Å
1141	A	85.5	Confident	85.1	Confident	35 Å²	35	55.5 Å²	55.5	29%	0.289	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-48.3	173.1	0	0	0	0	0	111	V1137 S1138 L1139 I1143 G1144 L1145	V1137-A1141 WeakPolarHBondContact O-CB 3.29Å; V1137-A1141 PolarHBondContact O-N 3.42Å; S1138-A1141 WeakPolarHBondContact O-CB 3.33Å; S1138-A1141 PolarHBondContact O-N 3.32Å; L1139-A1141 VanDerWaalsContact C-N 3.3Å; L1139-A1141 PolarHBondContact O-N 2.87Å; A1141-I1143 PolarHBondContact O-N 3.13Å; A1141-G1144 PolarHBondContact O-N 3.4Å; A1141-L1145 WeakPolarHBondContact O-CB 3.46Å; A1141-L1145 WeakPolarHBondContact O-CG 3.32Å; A1141-L1145 PolarHBondContact O-N 3Å
1142	I	86.3	Confident	84.5	Confident	10 Å²	10	61 Å²	61	5%	0.051	35%	0.351	C	S	.	.	H	α-helix	trans	-59.4	-46.7	177.5	-68.2	158.3	0	0	0	111.4	I1102 M1105 A1106 M1109 S1138 L1139 L1145 L1146	I1102-I1142 HydrophobicContact CG2-CG2 4.21Å; M1105-I1142 HydrophobicContact CB-CG1 4.29Å; A1106-I1142 HydrophobicContact CB-CD1 4.3Å; A1106-I1142 HydrophobicContact CB-CG2 4.2Å; M1109-I1142 HydrophobicContact CB-CD1 4.25Å; M1109-I1142 HydrophobicContact CG-CD1 3.88Å; S1138-I1142 WeakPolarHBondContact O-CD1 3Å; S1138-I1142 VanDerWaalsContact O-CG1 3.28Å; S1138-I1142 WeakPolarHBondContact O-CG1 3.19Å; S1138-I1142 PolarHBondContact O-N 2.83Å; L1139-I1142 PolarHBondContact O-N 2.98Å; I1142-L1145 PolarHBondContact O-N 2.79Å; I1142-L1146 WeakPolarHBondContact O-CB 3.46Å; I1142-L1146 PolarHBondContact O-N 2.99Å
1143	I	86	Confident	83.6	Confident	72 Å²	72	63.4 Å²	63.4	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-65.9	-40.3	178.5	-68.4	170.3	0	0	0	110.9	L1139 A1141 L1146 L1147	L1139-I1143 HydrophobicContact CD1-CD1 4.12Å; L1139-I1143 HydrophobicContact CD1-CG1 4.39Å; L1139-I1143 HydrophobicContact CG-CD1 3.9Å; L1139-I1143 WeakPolarHBondContact O-CB 3.49Å; L1139-I1143 VanDerWaalsContact O-CG1 3.31Å; L1139-I1143 WeakPolarHBondContact O-CG1 3.41Å; L1139-I1143 PolarHBondContact O-N 2.9Å; A1141-I1143 PolarHBondContact O-N 3.13Å; I1143-L1146 PolarHBondContact O-N 2.85Å; I1143-L1147 HydrophobicContact CG2-CD1 3.57Å; I1143-L1147 HydrophobicContact CG2-CG 4.22Å; I1143-L1147 WeakPolarHBondContact O-CB 3.39Å; I1143-L1147 WeakPolarHBondContact O-CG 3.48Å; I1143-L1147 PolarHBondContact O-N 3.35Å
1144	G	84.1	Confident	82.8	Confident	25 Å²	25	55.7 Å²	55.7	26%	0.258	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-42.3	176.8	0	0	0	0	0	112.6	L1140 A1141 G1148 S1149	L1140-G1144 PolarHBondContact O-N 3.33Å; A1141-G1144 PolarHBondContact O-N 3.4Å; G1144-G1148 PolarHBondContact O-N 3.34Å; G1144-S1149 PolarHBondContact O-N 3.15Å
1145	L	82.6	Confident	82	Confident	13 Å²	13	58.8 Å²	58.8	7%	0.068	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-41	174.3	-65.9	172.2	0	0	0	111.4	Y1101 A1141 I1142 G1148 F1153 F1157 L1159	Y1101-L1145 HydrophobicContact CE1-CD1 4.39Å; A1141-L1145 WeakPolarHBondContact O-CB 3.46Å; A1141-L1145 WeakPolarHBondContact O-CG 3.32Å; A1141-L1145 PolarHBondContact O-N 3Å; I1142-L1145 PolarHBondContact O-N 2.79Å; L1145-G1148 PolarHBondContact O-N 3.21Å; L1145-F1153 HydrophobicContact CD2-CD1 3.88Å; L1145-F1153 HydrophobicContact CD2-CE1 3.93Å; L1145-F1157 HydrophobicContact CD2-CD2 4.39Å; L1145-F1157 HydrophobicContact CD2-CG 4.31Å; L1145-L1159 HydrophobicContact CB-CD1 4.22Å; L1145-L1159 HydrophobicContact CD2-CD1 3.65Å; L1145-L1159 HydrophobicContact CG-CD1 4.37Å
1146	L	83.9	Confident	81.3	Confident	23 Å²	23	64 Å²	64	12%	0.12	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-41.7	177.9	-175.9	67.7	0	0	0	112.5	I1102 I1142 I1143 G1148 K1167 I1170	I1102-L1146 HydrophobicContact CG2-CD1 4.46Å; I1142-L1146 WeakPolarHBondContact O-CB 3.46Å; I1142-L1146 PolarHBondContact O-N 2.99Å; I1143-L1146 PolarHBondContact O-N 2.85Å; L1146-G1148 VanDerWaalsContact C-N 3.35Å; L1146-K1167 HydrophobicContact CD1-CG 4.47Å; L1146-K1167 VanDerWaalsContact O-CD 3.26Å; L1146-K1167 WeakPolarHBondContact O-CD 3.4Å; L1146-K1167 WeakPolarHBondContact O-CE 3.35Å; L1146-I1170 HydrophobicContact CD1-CB 4.17Å; L1146-I1170 HydrophobicContact CD1-CD1 4.25Å; L1146-I1170 HydrophobicContact CD1-CG2 3.83Å
1147	L	82.4	Confident	80.4	Confident	111 Å²	111	61.6 Å²	61.6	58%	0.581	36%	0.36	S	S	*	.	H	α-helix	trans	-74.9	-27.5	179.7	-72.5	169.5	0	0	0	112.1	I1143 K1167	I1143-L1147 HydrophobicContact CG2-CD1 3.57Å; I1143-L1147 HydrophobicContact CG2-CG 4.22Å; I1143-L1147 WeakPolarHBondContact O-CB 3.39Å; I1143-L1147 WeakPolarHBondContact O-CG 3.48Å; I1143-L1147 PolarHBondContact O-N 3.35Å; L1147-K1167 PolarHBondContact O-NZ 3.38Å
1148	G	76.2	Confident	79.5	Confident	23 Å²	23	58.5 Å²	58.5	24%	0.237	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	44.9	-172.7	0	0	0	0	0	111.8	G1144 L1145 L1146 S1150 N1154	G1144-G1148 PolarHBondContact O-N 3.34Å; L1145-G1148 PolarHBondContact O-N 3.21Å; L1146-G1148 VanDerWaalsContact C-N 3.35Å; G1148-S1150 PolarHBondContact O-N 3.5Å; G1148-N1154 VanDerWaalsContact CA-ND2 3.33Å; G1148-N1154 WeakPolarHBondContact CA-ND2 3.31Å
1149	S	70.6	Confident	79	Confident	104 Å²	104	59.3 Å²	59.3	73%	0.727	35%	0.349	S	S	*	.			trans	-65.3	-17.9	-174.2	-170.2	0	0	0	0	113.9	G1144	G1144-S1149 PolarHBondContact O-N 3.15Å
1150	S	76.3	Confident	78.6	Confident	48 Å²	48	57.1 Å²	57.1	34%	0.336	34%	0.34	S	S	.	.			trans	-140.7	118.2	172.6	175	0	0	0	0	110.8	G1148 D1152 F1153 N1154	G1148-S1150 PolarHBondContact O-N 3.5Å; S1150-D1152 VanDerWaalsContact C-N 3.32Å; S1150-D1152 PolarHBondContact O-N 3Å; S1150-F1153 PolarHBondContact O-N 3.32Å; S1150-F1153 PolarHBondContact OG-N 3.28Å; S1150-N1154 PolarHBondContact O-N 3.08Å
1151	P	73.6	Confident	78	Confident	98 Å²	98	57.8 Å²	57.8	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-68.5	-30.3	178.1	25.7	-31.6	0	0	0	112.6	F1153 N1154 S1155	P1151-F1153 VanDerWaalsContact C-N 3.3Å; P1151-F1153 PolarHBondContact O-N 2.89Å; P1151-N1154 PolarHBondContact O-N 3.39Å; P1151-S1155 WeakPolarHBondContact O-CB 3.14Å; P1151-S1155 PolarHBondContact O-N 3.12Å; P1151-S1155 PolarHBondContact O-OG 2.85Å
1152	D	76.3	Confident	77.8	Confident	116 Å²	116	56.8 Å²	56.8	62%	0.62	33%	0.333	S	S	*	.	H	α-helix	trans	-67.1	-34.8	174.6	-63.6	-37.2	0	0	0	111.3	S1150 S1155 Q1156	S1150-D1152 VanDerWaalsContact C-N 3.32Å; S1150-D1152 PolarHBondContact O-N 3Å; D1152-S1155 PolarHBondContact O-OG 3.07Å; D1152-Q1156 WeakPolarHBondContact O-CG 3.46Å; D1152-Q1156 PolarHBondContact O-N 3.28Å
1153	F	72.3	Confident	77.6	Confident	97 Å²	97	59.5 Å²	59.5	43%	0.425	35%	0.352	S	S	.	.	H	α-helix	trans	-72.6	-48.6	175.6	-154	-107.2	0	0	0	110.2	L1145 S1150 P1151 S1155 Q1156 F1157	L1145-F1153 HydrophobicContact CD2-CD1 3.88Å; L1145-F1153 HydrophobicContact CD2-CE1 3.93Å; S1150-F1153 PolarHBondContact O-N 3.32Å; S1150-F1153 PolarHBondContact OG-N 3.28Å; P1151-F1153 VanDerWaalsContact C-N 3.3Å; P1151-F1153 PolarHBondContact O-N 2.89Å; F1153-S1155 VanDerWaalsContact C-N 3.28Å; F1153-S1155 PolarHBondContact O-N 3.16Å; F1153-Q1156 PolarHBondContact O-N 2.64Å; F1153-Q1156 VanDerWaalsContact O-N 3.13Å; F1153-F1157 AromaticContact CD1-CD2 3.69Å; F1153-F1157 HydrophobicContact CD1-CD2 3.69Å; F1153-F1157 AromaticContact CD1-CE2 3.5Å; F1153-F1157 HydrophobicContact CD1-CE2 3.5Å; F1153-F1157 HydrophobicContact CD1-CZ 4.47Å; F1153-F1157 HydrophobicContact CD2-CE2 4.05Å; F1153-F1157 AromaticContact CE1-CD2 3.75Å; F1153-F1157 HydrophobicContact CE1-CD2 3.75Å; F1153-F1157 AromaticContact CE1-CE2 3.09Å; F1153-F1157 HydrophobicContact CE1-CE2 3.09Å; F1153-F1157 AromaticContact CE1-CZ 3.7Å; F1153-F1157 HydrophobicContact CE1-CZ 3.7Å; F1153-F1157 AromaticContact CE2-CE2 3.7Å; F1153-F1157 HydrophobicContact CE2-CE2 3.7Å; F1153-F1157 HydrophobicContact CE2-CZ 4.49Å; F1153-F1157 HydrophobicContact CG-CD2 4.13Å; F1153-F1157 AromaticContact CG-CE2 3.98Å; F1153-F1157 HydrophobicContact CG-CE2 3.98Å; F1153-F1157 HydrophobicContact CZ-CD2 4.22Å; F1153-F1157 AromaticContact CZ-CE2 3.21Å; F1153-F1157 HydrophobicContact CZ-CE2 3.21Å; F1153-F1157 AromaticContact CZ-CZ 3.72Å; F1153-F1157 HydrophobicContact CZ-CZ 3.72Å; F1153-F1157 VanDerWaalsContact O-CD2 3.25Å; F1153-F1157 WeakPolarHBondContact O-CD2 3.42Å; F1153-F1157 PolarHBondContact O-N 2.8Å
1154	N	75.6	Confident	77.4	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.064	37%	0.366	C	S	.	.	H	α-helix	trans	-59.2	-37.4	178.5	-81.3	5.7	0	0	0	113.4	G1148 S1150 P1151 F1157 G1158 L1159	G1148-N1154 VanDerWaalsContact CA-ND2 3.33Å; G1148-N1154 WeakPolarHBondContact CA-ND2 3.31Å; S1150-N1154 PolarHBondContact O-N 3.08Å; P1151-N1154 PolarHBondContact O-N 3.39Å; N1154-F1157 PolarHBondContact O-N 3.3Å; N1154-G1158 PolarHBondContact O-N 3.28Å; N1154-G1158 VanDerWaalsContact O-N 3.16Å; N1154-L1159 HydrophobicContact CB-CB 4.38Å; N1154-L1159 PolarHBondContact O-N 3.08Å
1155	S	73.4	Confident	77.5	Confident	82 Å²	82	67.9 Å²	67.9	57%	0.573	39%	0.39	S	S	*	.	H	α-helix	trans	-68.7	-38.2	176.1	59.3	0	0	0	0	112.8	P1151 D1152 F1153 F1157 G1158	P1151-S1155 WeakPolarHBondContact O-CB 3.14Å; P1151-S1155 PolarHBondContact O-N 3.12Å; P1151-S1155 PolarHBondContact O-OG 2.85Å; D1152-S1155 PolarHBondContact O-OG 3.07Å; F1153-S1155 VanDerWaalsContact C-N 3.28Å; F1153-S1155 PolarHBondContact O-N 3.16Å; S1155-F1157 VanDerWaalsContact C-N 3.31Å; S1155-F1157 PolarHBondContact O-N 2.89Å; S1155-G1158 PolarHBondContact O-N 2.69Å
1156	Q	74.2	Confident	77.6	Confident	132 Å²	132	67.2 Å²	67.2	62%	0.617	39%	0.386	S	S	*	.	H	α-helix	trans	-65	-31.9	172.1	-74.8	178.2	5.8	0	0	113.2	D1152 F1153 G1158	D1152-Q1156 WeakPolarHBondContact O-CG 3.46Å; D1152-Q1156 PolarHBondContact O-N 3.28Å; F1153-Q1156 PolarHBondContact O-N 2.64Å; F1153-Q1156 VanDerWaalsContact O-N 3.13Å; Q1156-G1158 VanDerWaalsContact C-N 3.32Å
1157	F	72.3	Confident	77.7	Confident	3 Å²	3	68.1 Å²	68.1	1%	0.013	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.8	176.4	-82.8	-93.5	0	0	0	113.9	F1012 Q1013 L1016 L1145 F1153 N1154 S1155 L1159	F1012-F1157 AromaticContact CD1-CD1 3.95Å; F1012-F1157 HydrophobicContact CD1-CD1 3.95Å; F1012-F1157 HydrophobicContact CD1-CD2 4.37Å; F1012-F1157 AromaticContact CD1-CE1 3.75Å; F1012-F1157 HydrophobicContact CD1-CE1 3.75Å; F1012-F1157 HydrophobicContact CD1-CE2 4.2Å; F1012-F1157 HydrophobicContact CD1-CG 4.27Å; F1012-F1157 AromaticContact CD1-CZ 3.9Å; F1012-F1157 HydrophobicContact CD1-CZ 3.9Å; F1012-F1157 HydrophobicContact CE1-CD1 4.16Å; F1012-F1157 HydrophobicContact CE1-CD2 4.01Å; F1012-F1157 AromaticContact CE1-CE1 3.64Å; F1012-F1157 HydrophobicContact CE1-CE1 3.64Å; F1012-F1157 AromaticContact CE1-CE2 3.47Å; F1012-F1157 HydrophobicContact CE1-CE2 3.47Å; F1012-F1157 VanDerWaalsContact CE1-CE2 3.47Å; F1012-F1157 HydrophobicContact CE1-CG 4.34Å; F1012-F1157 AromaticContact CE1-CZ 3.28Å; F1012-F1157 HydrophobicContact CE1-CZ 3.28Å; F1012-F1157 HydrophobicContact CZ-CE2 4.44Å; F1012-F1157 HydrophobicContact CZ-CZ 4.17Å; Q1013-F1157 HydrophobicContact CG-CD1 4.39Å; Q1013-F1157 PolarHBondContact NE2-O 2.74Å; L1016-F1157 HydrophobicContact CB-CE1 4.48Å; L1016-F1157 HydrophobicContact CD2-CE1 3.48Å; L1016-F1157 VanDerWaalsContact CD2-CE1 3.48Å; L1016-F1157 HydrophobicContact CD2-CZ 3.65Å; L1145-F1157 HydrophobicContact CD2-CD2 4.39Å; L1145-F1157 HydrophobicContact CD2-CG 4.31Å; F1153-F1157 AromaticContact CD1-CD2 3.69Å; F1153-F1157 HydrophobicContact CD1-CD2 3.69Å; F1153-F1157 AromaticContact CD1-CE2 3.5Å; F1153-F1157 HydrophobicContact CD1-CE2 3.5Å; F1153-F1157 HydrophobicContact CD1-CZ 4.47Å; F1153-F1157 HydrophobicContact CD2-CE2 4.05Å; F1153-F1157 AromaticContact CE1-CD2 3.75Å; F1153-F1157 HydrophobicContact CE1-CD2 3.75Å; F1153-F1157 AromaticContact CE1-CE2 3.09Å; F1153-F1157 HydrophobicContact CE1-CE2 3.09Å; F1153-F1157 AromaticContact CE1-CZ 3.7Å; F1153-F1157 HydrophobicContact CE1-CZ 3.7Å; F1153-F1157 AromaticContact CE2-CE2 3.7Å; F1153-F1157 HydrophobicContact CE2-CE2 3.7Å; F1153-F1157 HydrophobicContact CE2-CZ 4.49Å; F1153-F1157 HydrophobicContact CG-CD2 4.13Å; F1153-F1157 AromaticContact CG-CE2 3.98Å; F1153-F1157 HydrophobicContact CG-CE2 3.98Å; F1153-F1157 HydrophobicContact CZ-CD2 4.22Å; F1153-F1157 AromaticContact CZ-CE2 3.21Å; F1153-F1157 HydrophobicContact CZ-CE2 3.21Å; F1153-F1157 AromaticContact CZ-CZ 3.72Å; F1153-F1157 HydrophobicContact CZ-CZ 3.72Å; F1153-F1157 VanDerWaalsContact O-CD2 3.25Å; F1153-F1157 WeakPolarHBondContact O-CD2 3.42Å; F1153-F1157 PolarHBondContact O-N 2.8Å; N1154-F1157 PolarHBondContact O-N 3.3Å; S1155-F1157 VanDerWaalsContact C-N 3.31Å; S1155-F1157 PolarHBondContact O-N 2.89Å; F1157-L1159 VanDerWaalsContact C-N 3.27Å; F1157-L1159 HydrophobicContact CB-CD1 3.86Å; F1157-L1159 HydrophobicContact CB-CG 3.92Å; F1157-L1159 PolarHBondContact O-N 3.46Å
1158	G	71.6	Confident	78	Confident	16 Å²	16	68.3 Å²	68.3	17%	0.165	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	61	35.1	-175.7	0	0	0	0	0	112.9	P1093 N1154 S1155 Q1156	P1093-G1158 WeakPolarHBondContact CB-O 3.44Å; N1154-G1158 PolarHBondContact O-N 3.28Å; N1154-G1158 VanDerWaalsContact O-N 3.16Å; S1155-G1158 PolarHBondContact O-N 2.69Å; Q1156-G1158 VanDerWaalsContact C-N 3.32Å
1159	L	78.4	Confident	78.6	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.089	39%	0.388	C	S	.	.			trans	-93.8	135.8	179	-68	169.8	0	0	0	110.9	Y1101 L1145 N1154 F1157	Y1101-L1159 HydrophobicContact CD1-CD2 4.36Å; L1145-L1159 HydrophobicContact CB-CD1 4.22Å; L1145-L1159 HydrophobicContact CD2-CD1 3.65Å; L1145-L1159 HydrophobicContact CG-CD1 4.37Å; N1154-L1159 HydrophobicContact CB-CB 4.38Å; N1154-L1159 PolarHBondContact O-N 3.08Å; F1157-L1159 VanDerWaalsContact C-N 3.27Å; F1157-L1159 HydrophobicContact CB-CD1 3.86Å; F1157-L1159 HydrophobicContact CB-CG 3.92Å; F1157-L1159 PolarHBondContact O-N 3.46Å
1160	V	80	Confident	79.5	Confident	50 Å²	50	63.8 Å²	63.8	30%	0.303	35%	0.354	S	S	.	.			trans	-85.1	143.2	174.5	-178.2	0	0	0	0	109.7	P1093 S1098 I1162	P1093-V1160 HydrophobicContact CB-CG2 3.75Å; P1093-V1160 WeakPolarHBondContact O-CG2 3.35Å; S1098-V1160 PolarHBondContact OG-N 3.11Å; V1160-I1162 PolarHBondContact O-N 3.27Å; V1160-I1162 VanDerWaalsContact O-N 3.1Å
1161	D	76	Confident	80.1	Confident	127 Å²	127	63 Å²	63	68%	0.679	35%	0.353	S	S	*	.			trans	-62.6	113.1	174.6	-83.5	-37.4	0	0	0	111.6
1162	I	81	Confident	80.9	Confident	13 Å²	13	64.9 Å²	64.9	7%	0.067	35%	0.353	C	S	.	.			trans	-79.8	132.4	-179.9	-54.8	-179.7	0	0	0	109.4	L1095 I1102 V1160 F1166 K1167 I1170	L1095-I1162 HydrophobicContact CD1-CB 4.39Å; L1095-I1162 HydrophobicContact CD1-CG1 4.12Å; L1095-I1162 HydrophobicContact CD1-CG2 4.32Å; I1102-I1162 HydrophobicContact CD1-CD1 3.95Å; V1160-I1162 PolarHBondContact O-N 3.27Å; V1160-I1162 VanDerWaalsContact O-N 3.1Å; I1162-F1166 HydrophobicContact CG2-CB 4.1Å; I1162-F1166 HydrophobicContact CG2-CD1 3.61Å; I1162-F1166 HydrophobicContact CG2-CE1 4.45Å; I1162-F1166 HydrophobicContact CG2-CG 4.22Å; I1162-K1167 HydrophobicContact CB-CG 3.84Å; I1162-K1167 HydrophobicContact CG2-CG 3.7Å; I1162-K1167 WeakPolarHBondContact O-CE 3.35Å; I1162-I1170 HydrophobicContact CD1-CD1 4.14Å; I1162-I1170 HydrophobicContact CG2-CD1 4.08Å
1163	P	83.3	Confident	81.6	Confident	67 Å²	67	60.2 Å²	60.2	44%	0.435	33%	0.329	S	S	.	.			trans	-56.4	142.2	173.9	-25.3	34	0	0	0	112.4	E1165 F1166 K1167	P1163-E1165 VanDerWaalsContact C-N 3.3Å; P1163-E1165 PolarHBondContact O-N 2.93Å; P1163-F1166 HydrophobicContact CB-CB 4.36Å; P1163-F1166 WeakPolarHBondContact O-CA 3.26Å; P1163-F1166 PolarHBondContact O-N 3.2Å; P1163-K1167 PolarHBondContact O-N 3.39Å
1164	V	82	Confident	82.5	Confident	109 Å²	109	56.9 Å²	56.9	66%	0.661	32%	0.316	S	S	*	.	H	α-helix	trans	-58.7	-39.5	-175	-179.3	0	0	0	0	112.4	F1166 K1167 L1168	V1164-F1166 VanDerWaalsContact C-N 3.29Å; V1164-F1166 PolarHBondContact O-N 2.88Å; V1164-K1167 PolarHBondContact O-N 2.77Å; V1164-L1168 PolarHBondContact O-N 2.87Å
1165	E	84.9	Confident	83.2	Confident	164 Å²	164	59 Å²	59	77%	0.766	34%	0.335	S	S	*	.	H	α-helix	trans	-60.6	-40.8	175.4	-63	-177.8	177.2	0	0	111.6	P1163 L1168 V1169	P1163-E1165 VanDerWaalsContact C-N 3.3Å; P1163-E1165 PolarHBondContact O-N 2.93Å; E1165-L1168 PolarHBondContact O-N 3.39Å; E1165-V1169 WeakPolarHBondContact O-CG2 3.39Å; E1165-V1169 PolarHBondContact O-N 2.64Å
1166	F	86.2	Confident	84.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-75.8	-33.2	179.9	-170	-138.4	0	0	0	112.4	L1069 E1072 A1073 L1095 T1099 I1162 P1163 V1164 L1168 V1169 I1170	L1069-F1166 HydrophobicContact CD2-CE2 4.34Å; E1072-F1166 HydrophobicContact CB-CE2 3.96Å; E1072-F1166 HydrophobicContact CB-CZ 4.49Å; A1073-F1166 HydrophobicContact CB-CE1 4.04Å; A1073-F1166 HydrophobicContact CB-CZ 3.82Å; L1095-F1166 HydrophobicContact CD1-CD1 4.4Å; L1095-F1166 HydrophobicContact CG-CE1 4.46Å; T1099-F1166 HydrophobicContact CG2-CE1 4.11Å; T1099-F1166 HydrophobicContact CG2-CZ 3.92Å; T1099-F1166 WeakPolarHBondContact OG1-CE1 3.19Å; I1162-F1166 HydrophobicContact CG2-CB 4.1Å; I1162-F1166 HydrophobicContact CG2-CD1 3.61Å; I1162-F1166 HydrophobicContact CG2-CE1 4.45Å; I1162-F1166 HydrophobicContact CG2-CG 4.22Å; P1163-F1166 HydrophobicContact CB-CB 4.36Å; P1163-F1166 WeakPolarHBondContact O-CA 3.26Å; P1163-F1166 PolarHBondContact O-N 3.2Å; V1164-F1166 VanDerWaalsContact C-N 3.29Å; V1164-F1166 PolarHBondContact O-N 2.88Å; F1166-L1168 VanDerWaalsContact C-N 3.26Å; F1166-L1168 PolarHBondContact O-N 2.9Å; F1166-V1169 HydrophobicContact CD2-CB 4.2Å; F1166-V1169 HydrophobicContact CD2-CG1 4.46Å; F1166-V1169 PolarHBondContact O-N 3.04Å; F1166-I1170 HydrophobicContact CD1-CD1 4.02Å; F1166-I1170 HydrophobicContact CD2-CG1 4.4Å; F1166-I1170 HydrophobicContact CE1-CD1 3.87Å; F1166-I1170 HydrophobicContact CE1-CG1 4.41Å; F1166-I1170 HydrophobicContact CE2-CD1 4.45Å; F1166-I1170 HydrophobicContact CE2-CG1 4.14Å; F1166-I1170 HydrophobicContact CG-CD1 4.35Å; F1166-I1170 HydrophobicContact CZ-CD1 4.09Å; F1166-I1170 HydrophobicContact CZ-CG1 4.14Å; F1166-I1170 WeakPolarHBondContact O-CG1 3.35Å; F1166-I1170 PolarHBondContact O-N 3.3Å
1167	K	86.3	Confident	85.1	Confident	42 Å²	42	53.8 Å²	53.8	18%	0.183	30%	0.304	C	S	.	.	H	α-helix	trans	-56	-40.8	170.4	-71.1	178.8	173.3	175.7	0	111.7	L1146 L1147 I1162 P1163 V1164 G1171	L1146-K1167 HydrophobicContact CD1-CG 4.47Å; L1146-K1167 VanDerWaalsContact O-CD 3.26Å; L1146-K1167 WeakPolarHBondContact O-CD 3.4Å; L1146-K1167 WeakPolarHBondContact O-CE 3.35Å; L1147-K1167 PolarHBondContact O-NZ 3.38Å; I1162-K1167 HydrophobicContact CB-CG 3.84Å; I1162-K1167 HydrophobicContact CG2-CG 3.7Å; I1162-K1167 WeakPolarHBondContact O-CE 3.35Å; P1163-K1167 PolarHBondContact O-N 3.39Å; V1164-K1167 PolarHBondContact O-N 2.77Å; K1167-G1171 PolarHBondContact O-N 3.4Å
1168	L	87.4	Confident	86.1	Confident	114 Å²	114	57.3 Å²	57.3	60%	0.597	32%	0.319	S	S	*	.	H	α-helix	trans	-67.3	-41.8	176.8	-69.4	173.2	0	0	0	112.2	V1164 E1165 F1166 G1171 Q1172	V1164-L1168 PolarHBondContact O-N 2.87Å; E1165-L1168 PolarHBondContact O-N 3.39Å; F1166-L1168 VanDerWaalsContact C-N 3.26Å; F1166-L1168 PolarHBondContact O-N 2.9Å; L1168-G1171 PolarHBondContact O-N 3.42Å; L1168-Q1172 WeakPolarHBondContact O-CG 3.32Å; L1168-Q1172 PolarHBondContact O-N 3.28Å
1169	V	89.9	Confident	87.1	Confident	33 Å²	33	60.2 Å²	60.2	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-46.6	175.5	174.3	0	0	0	0	110.9	L1069 E1165 F1166 G1171 Q1172 V1173	L1069-V1169 HydrophobicContact CD2-CG1 4.27Å; E1165-V1169 WeakPolarHBondContact O-CG2 3.39Å; E1165-V1169 PolarHBondContact O-N 2.64Å; F1166-V1169 HydrophobicContact CD2-CB 4.2Å; F1166-V1169 HydrophobicContact CD2-CG1 4.46Å; F1166-V1169 PolarHBondContact O-N 3.04Å; V1169-G1171 VanDerWaalsContact C-N 3.34Å; V1169-G1171 PolarHBondContact O-N 3.28Å; V1169-Q1172 PolarHBondContact O-N 2.99Å; V1169-V1173 HydrophobicContact CG1-CG2 4.41Å; V1169-V1173 WeakPolarHBondContact O-CG2 3.27Å; V1169-V1173 PolarHBondContact O-N 3.33Å
1170	I	88.1	Confident	87.9	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-57.9	-47.6	176	-66.2	164.7	0	0	0	110.3	L1069 T1099 L1146 I1162 F1166 Q1172 V1173 L1174	L1069-I1170 HydrophobicContact CD2-CG1 3.99Å; T1099-I1170 HydrophobicContact CG2-CD1 3.91Å; T1099-I1170 HydrophobicContact CG2-CG1 4.21Å; L1146-I1170 HydrophobicContact CD1-CB 4.17Å; L1146-I1170 HydrophobicContact CD1-CD1 4.25Å; L1146-I1170 HydrophobicContact CD1-CG2 3.83Å; I1162-I1170 HydrophobicContact CD1-CD1 4.14Å; I1162-I1170 HydrophobicContact CG2-CD1 4.08Å; F1166-I1170 HydrophobicContact CD1-CD1 4.02Å; F1166-I1170 HydrophobicContact CD2-CG1 4.4Å; F1166-I1170 HydrophobicContact CE1-CD1 3.87Å; F1166-I1170 HydrophobicContact CE1-CG1 4.41Å; F1166-I1170 HydrophobicContact CE2-CD1 4.45Å; F1166-I1170 HydrophobicContact CE2-CG1 4.14Å; F1166-I1170 HydrophobicContact CG-CD1 4.35Å; F1166-I1170 HydrophobicContact CZ-CD1 4.09Å; F1166-I1170 HydrophobicContact CZ-CG1 4.14Å; F1166-I1170 WeakPolarHBondContact O-CG1 3.35Å; F1166-I1170 PolarHBondContact O-N 3.3Å; I1170-Q1172 VanDerWaalsContact C-N 3.35Å; I1170-Q1172 PolarHBondContact O-N 3.26Å; I1170-V1173 PolarHBondContact O-N 3.27Å; I1170-L1174 HydrophobicContact CG2-CD1 3.87Å; I1170-L1174 HydrophobicContact CG2-CG 4.27Å; I1170-L1174 WeakPolarHBondContact O-CB 3.36Å; I1170-L1174 VanDerWaalsContact O-CG 3.27Å; I1170-L1174 WeakPolarHBondContact O-CG 3.35Å; I1170-L1174 PolarHBondContact O-N 2.87Å
1171	G	88.5	Confident	88.5	Confident	31 Å²	31	60.6 Å²	60.6	32%	0.32	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-41.7	177.5	0	0	0	0	0	113.5	K1167 L1168 V1169 A1175	K1167-G1171 PolarHBondContact O-N 3.4Å; L1168-G1171 PolarHBondContact O-N 3.42Å; V1169-G1171 VanDerWaalsContact C-N 3.34Å; V1169-G1171 PolarHBondContact O-N 3.28Å; G1171-A1175 WeakPolarHBondContact O-CB 3.44Å; G1171-A1175 PolarHBondContact O-N 3.45Å; G1171-A1175 VanDerWaalsContact O-N 3.1Å
1172	Q	90.8	Very high	89.2	Confident	138 Å²	138	57.1 Å²	57.1	65%	0.645	32%	0.317	S	S	*	.	H	α-helix	trans	-66.1	-44.8	177.5	-74.1	176.5	0.4	0	0	112.3	L1168 V1169 I1170 A1175 L1176	L1168-Q1172 WeakPolarHBondContact O-CG 3.32Å; L1168-Q1172 PolarHBondContact O-N 3.28Å; V1169-Q1172 PolarHBondContact O-N 2.99Å; I1170-Q1172 VanDerWaalsContact C-N 3.35Å; I1170-Q1172 PolarHBondContact O-N 3.26Å; Q1172-A1175 PolarHBondContact O-N 3.44Å; Q1172-L1176 WeakPolarHBondContact O-CB 3.42Å; Q1172-L1176 PolarHBondContact O-N 2.92Å
1173	V	92.1	Very high	89.8	Confident	17 Å²	17	61.7 Å²	61.7	10%	0.103	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-42.3	179	175.3	0	0	0	0	110.9	Y1068 L1069 V1169 I1170 A1175 L1176 D1177	Y1068-V1173 HydrophobicContact CD1-CG2 3.81Å; Y1068-V1173 HydrophobicContact CE1-CG2 3.67Å; L1069-V1173 HydrophobicContact CD1-CB 3.83Å; L1069-V1173 HydrophobicContact CD1-CG1 3.59Å; L1069-V1173 HydrophobicContact CD1-CG2 4.49Å; L1069-V1173 HydrophobicContact CD2-CB 4.16Å; L1069-V1173 HydrophobicContact CD2-CG1 4.46Å; L1069-V1173 HydrophobicContact CD2-CG2 3.97Å; L1069-V1173 HydrophobicContact CG-CB 4.06Å; L1069-V1173 HydrophobicContact CG-CG1 3.83Å; L1069-V1173 HydrophobicContact CG-CG2 4.2Å; V1169-V1173 HydrophobicContact CG1-CG2 4.41Å; V1169-V1173 WeakPolarHBondContact O-CG2 3.27Å; V1169-V1173 PolarHBondContact O-N 3.33Å; I1170-V1173 PolarHBondContact O-N 3.27Å; V1173-A1175 VanDerWaalsContact C-N 3.32Å; V1173-A1175 PolarHBondContact O-N 3.34Å; V1173-L1176 PolarHBondContact O-N 2.96Å; V1173-D1177 VanDerWaalsContact O-CB 3.26Å; V1173-D1177 WeakPolarHBondContact O-CB 3.5Å; V1173-D1177 PolarHBondContact O-N 2.9Å
1174	L	90.4	Very high	90.2	Very high	28 Å²	28	59 Å²	59	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-38.8	176.4	-70.3	178	0	0	0	112.3	M1103 A1106 I1170 F1178	M1103-L1174 HydrophobicContact CG-CD2 4.3Å; A1106-L1174 HydrophobicContact CB-CD1 3.9Å; A1106-L1174 HydrophobicContact CB-CD2 3.63Å; A1106-L1174 HydrophobicContact CB-CG 4.37Å; I1170-L1174 HydrophobicContact CG2-CD1 3.87Å; I1170-L1174 HydrophobicContact CG2-CG 4.27Å; I1170-L1174 WeakPolarHBondContact O-CB 3.36Å; I1170-L1174 VanDerWaalsContact O-CG 3.27Å; I1170-L1174 WeakPolarHBondContact O-CG 3.35Å; I1170-L1174 PolarHBondContact O-N 2.87Å; L1174-F1178 WeakPolarHBondContact O-CB 3.34Å; L1174-F1178 PolarHBondContact O-N 2.89Å; L1174-F1178 VanDerWaalsContact O-N 3.11Å
1175	A	91	Very high	90.5	Very high	56 Å²	56	53.9 Å²	53.9	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-42	174.9	0	0	0	0	0	112	G1171 Q1172 V1173 C1179	G1171-A1175 WeakPolarHBondContact O-CB 3.44Å; G1171-A1175 PolarHBondContact O-N 3.45Å; G1171-A1175 VanDerWaalsContact O-N 3.1Å; Q1172-A1175 PolarHBondContact O-N 3.44Å; V1173-A1175 VanDerWaalsContact C-N 3.32Å; V1173-A1175 PolarHBondContact O-N 3.34Å; A1175-C1179 WeakPolarHBondContact O-CB 3.36Å; A1175-C1179 PolarHBondContact O-N 3.34Å; A1175-C1179 PolarHBondContact O-SG 3.41Å
1176	L	93.8	Very high	90.6	Very high	101 Å²	101	52.4 Å²	52.4	53%	0.529	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-45.2	177.2	-177.3	66.4	0	0	0	111.6	Q1172 V1173 F1178 C1179 L1180	Q1172-L1176 WeakPolarHBondContact O-CB 3.42Å; Q1172-L1176 PolarHBondContact O-N 2.92Å; V1173-L1176 PolarHBondContact O-N 2.96Å; L1176-F1178 PolarHBondContact O-N 3.46Å; L1176-C1179 PolarHBondContact O-N 3.31Å; L1176-L1180 HydrophobicContact CD1-CD1 4.04Å; L1176-L1180 HydrophobicContact CD1-CG 4.08Å; L1176-L1180 HydrophobicContact CD2-CD1 4.38Å; L1176-L1180 HydrophobicContact CG-CD1 3.84Å; L1176-L1180 HydrophobicContact CG-CG 4.25Å; L1176-L1180 WeakPolarHBondContact O-CB 3.42Å; L1176-L1180 WeakPolarHBondContact O-CG 3.42Å; L1176-L1180 PolarHBondContact O-N 2.8Å
1177	D	93.4	Very high	90.8	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-54.9	-52.1	176.3	-178.8	77.1	0	0	0	111.1	H1062 S1065 V1173 C1179 L1180 A1181	H1062-D1177 WeakPolarHBondContact CA-OD1 3.18Å; H1062-D1177 IonicContact CE1-OD2 2.71Å; H1062-D1177 PolarHBondContact CE1-OD2 3.33Å; H1062-D1177 IonicContact CG-OD1 2.88Å; H1062-D1177 VanDerWaalsContact ND1-CG 3.33Å; H1062-D1177 IonicContact ND1-OD1 2.66Å; H1062-D1177 PolarHBondContact ND1-OD1 2.96Å; H1062-D1177 VanDerWaalsContact ND1-OD1 3.14Å; H1062-D1177 IonicContact ND1-OD2 2.58Å; H1062-D1177 PolarHBondContact ND1-OD2 3.2Å; S1065-D1177 WeakPolarHBondContact CB-OD1 3.48Å; S1065-D1177 PolarHBondContact OG-OD1 3.42Å; V1173-D1177 VanDerWaalsContact O-CB 3.26Å; V1173-D1177 WeakPolarHBondContact O-CB 3.5Å; V1173-D1177 PolarHBondContact O-N 2.9Å; D1177-C1179 VanDerWaalsContact C-N 3.35Å; D1177-C1179 PolarHBondContact O-N 3.14Å; D1177-L1180 PolarHBondContact O-N 3.31Å; D1177-A1181 VanDerWaalsContact O-CB 3.25Å; D1177-A1181 WeakPolarHBondContact O-CB 3.39Å; D1177-A1181 PolarHBondContact O-N 3.01Å
1178	F	92.5	Very high	90.8	Very high	78 Å²	78	54.5 Å²	54.5	34%	0.342	30%	0.296	S	S	.	.	H	α-helix	trans	-57.8	-45.9	176.5	-178.1	-92.5	0	0	0	112	A1110 A1113 I1114 L1174 L1176 L1182	A1110-F1178 HydrophobicContact CB-CD2 3.92Å; A1113-F1178 HydrophobicContact CB-CE2 4.08Å; I1114-F1178 HydrophobicContact CD1-CD2 4.01Å; I1114-F1178 HydrophobicContact CD1-CE2 4.21Å; I1114-F1178 HydrophobicContact CG1-CD2 4.12Å; I1114-F1178 HydrophobicContact CG1-CE2 3.8Å; I1114-F1178 HydrophobicContact CG1-CZ 4.36Å; L1174-F1178 WeakPolarHBondContact O-CB 3.34Å; L1174-F1178 PolarHBondContact O-N 2.89Å; L1174-F1178 VanDerWaalsContact O-N 3.11Å; L1176-F1178 PolarHBondContact O-N 3.46Å; F1178-L1182 HydrophobicContact CE1-CD2 4.22Å; F1178-L1182 WeakPolarHBondContact O-CB 3.01Å; F1178-L1182 PolarHBondContact O-N 3.48Å
1179	C	94.3	Very high	90.7	Very high	76 Å²	76	52.4 Å²	52.4	51%	0.514	28%	0.284	S	S	.	.	H	α-helix	trans	-66.5	-43.3	-178.8	-68.8	0	0	0	0	112.7	A1175 L1176 D1177 L1183	A1175-C1179 WeakPolarHBondContact O-CB 3.36Å; A1175-C1179 PolarHBondContact O-N 3.34Å; A1175-C1179 PolarHBondContact O-SG 3.41Å; L1176-C1179 PolarHBondContact O-N 3.31Å; D1177-C1179 VanDerWaalsContact C-N 3.35Å; D1177-C1179 PolarHBondContact O-N 3.14Å; C1179-L1183 WeakPolarHBondContact O-CB 3.48Å; C1179-L1183 PolarHBondContact O-N 2.94Å
1180	L	93.9	Very high	90.4	Very high	76 Å²	76	58.7 Å²	58.7	40%	0.398	31%	0.308	S	S	.	.	H	α-helix	trans	-68.8	-43.7	179.6	-72	177.8	0	0	0	111.6	V1061 L1176 D1177 L1182 L1183 A1184	V1061-L1180 HydrophobicContact CG1-CB 3.83Å; V1061-L1180 HydrophobicContact CG2-CB 4.36Å; L1176-L1180 HydrophobicContact CD1-CD1 4.04Å; L1176-L1180 HydrophobicContact CD1-CG 4.08Å; L1176-L1180 HydrophobicContact CD2-CD1 4.38Å; L1176-L1180 HydrophobicContact CG-CD1 3.84Å; L1176-L1180 HydrophobicContact CG-CG 4.25Å; L1176-L1180 WeakPolarHBondContact O-CB 3.42Å; L1176-L1180 WeakPolarHBondContact O-CG 3.42Å; L1176-L1180 PolarHBondContact O-N 2.8Å; D1177-L1180 PolarHBondContact O-N 3.31Å; L1180-L1182 VanDerWaalsContact C-N 3.34Å; L1180-L1182 PolarHBondContact O-N 3.39Å; L1180-L1183 PolarHBondContact O-N 2.74Å; L1180-A1184 VanDerWaalsContact O-CB 3.31Å; L1180-A1184 WeakPolarHBondContact O-CB 3.25Å; L1180-A1184 PolarHBondContact O-N 2.94Å
1181	A	92.4	Very high	90.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-38.7	176.8	0	0	0	0	0	111.7	Q1058 V1061 I1114 D1177 D1185	Q1058-A1181 HydrophobicContact CG-CB 4.42Å; V1061-A1181 HydrophobicContact CG1-CB 4.24Å; I1114-A1181 HydrophobicContact CD1-CB 3.64Å; D1177-A1181 VanDerWaalsContact O-CB 3.25Å; D1177-A1181 WeakPolarHBondContact O-CB 3.39Å; D1177-A1181 PolarHBondContact O-N 3.01Å; A1181-D1185 PolarHBondContact O-N 3.33Å; A1181-D1185 VanDerWaalsContact O-N 3.16Å
1182	L	92.1	Very high	89.8	Confident	54 Å²	54	67.2 Å²	67.2	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-45.9	173.2	-178.2	65.8	0	0	0	111.7	I1114 F1178 L1180 A1184 D1185 R1186	I1114-L1182 HydrophobicContact CG1-CB 4.4Å; I1114-L1182 HydrophobicContact CG1-CD1 4.48Å; I1114-L1182 HydrophobicContact CG2-CD1 4.32Å; F1178-L1182 HydrophobicContact CE1-CD2 4.22Å; F1178-L1182 WeakPolarHBondContact O-CB 3.01Å; F1178-L1182 PolarHBondContact O-N 3.48Å; L1180-L1182 VanDerWaalsContact C-N 3.34Å; L1180-L1182 PolarHBondContact O-N 3.39Å; L1182-A1184 VanDerWaalsContact C-N 3.34Å; L1182-A1184 PolarHBondContact O-N 2.86Å; L1182-D1185 PolarHBondContact O-N 3.43Å; L1182-R1186 HydrophobicContact CD1-CG 4.25Å; L1182-R1186 HydrophobicContact CG-CG 4.45Å; L1182-R1186 VanDerWaalsContact O-CG 3.22Å; L1182-R1186 WeakPolarHBondContact O-CG 3.27Å; L1182-R1186 PolarHBondContact O-N 2.73Å
1183	L	92.6	Very high	88.6	Confident	108 Å²	108	61.5 Å²	61.5	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-60.5	-45.7	178.3	-175.9	70.3	0	0	0	111	C1179 L1180 D1185 R1186 V1187	C1179-L1183 WeakPolarHBondContact O-CB 3.48Å; C1179-L1183 PolarHBondContact O-N 2.94Å; L1180-L1183 PolarHBondContact O-N 2.74Å; L1183-D1185 PolarHBondContact O-N 2.9Å; L1183-R1186 PolarHBondContact O-N 3.36Å; L1183-V1187 HydrophobicContact CD1-CG2 4.17Å; L1183-V1187 HydrophobicContact CG-CG2 4.26Å; L1183-V1187 WeakPolarHBondContact O-CB 3.12Å; L1183-V1187 VanDerWaalsContact O-CG2 3.27Å; L1183-V1187 WeakPolarHBondContact O-CG2 3.28Å; L1183-V1187 PolarHBondContact O-N 3.22Å
1184	A	90.9	Very high	87.3	Confident	12 Å²	12	64.1 Å²	64.1	10%	0.099	33%	0.334	C	S	.	.	H	α-helix	trans	-54.2	-51.3	176.6	0	0	0	0	0	112.3	L1057 L1180 L1182 R1186 L1188	L1057-A1184 HydrophobicContact CD2-CB 3.48Å; L1057-A1184 VanDerWaalsContact CD2-CB 3.48Å; L1057-A1184 HydrophobicContact CG-CB 3.76Å; L1180-A1184 VanDerWaalsContact O-CB 3.31Å; L1180-A1184 WeakPolarHBondContact O-CB 3.25Å; L1180-A1184 PolarHBondContact O-N 2.94Å; L1182-A1184 VanDerWaalsContact C-N 3.34Å; L1182-A1184 PolarHBondContact O-N 2.86Å; A1184-R1186 PolarHBondContact O-N 3.14Å; A1184-L1188 WeakPolarHBondContact O-CB 3.36Å; A1184-L1188 VanDerWaalsContact O-CG 3.25Å; A1184-L1188 WeakPolarHBondContact O-CG 3.31Å; A1184-L1188 PolarHBondContact O-N 3.11Å; A1184-L1188 VanDerWaalsContact O-N 3.12Å
1185	D	88.4	Confident	85.8	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-42.9	177.9	177	58.3	0	0	0	112.4	Y1050 T1054 I1114 K1117 A1181 L1182 L1183 L1188 Q1189	Y1050-D1185 PolarHBondContact OH-OD1 2.8Å; T1054-D1185 PolarHBondContact OG1-OD1 2.67Å; I1114-D1185 HydrophobicContact CG2-CB 4.23Å; K1117-D1185 VanDerWaalsContact CE-OD2 3.31Å; K1117-D1185 WeakPolarHBondContact CE-OD2 3.47Å; K1117-D1185 IonicContact NZ-OD1 2.79Å; K1117-D1185 PolarHBondContact NZ-OD1 2.94Å; K1117-D1185 IonicContact NZ-OD2 2.66Å; K1117-D1185 PolarHBondContact NZ-OD2 3.44Å; A1181-D1185 PolarHBondContact O-N 3.33Å; A1181-D1185 VanDerWaalsContact O-N 3.16Å; L1182-D1185 PolarHBondContact O-N 3.43Å; L1183-D1185 PolarHBondContact O-N 2.9Å; D1185-L1188 PolarHBondContact O-N 3.45Å; D1185-Q1189 VanDerWaalsContact O-CB 3.25Å; D1185-Q1189 WeakPolarHBondContact O-CB 3.49Å; D1185-Q1189 PolarHBondContact O-N 2.91Å
1186	R	88.4	Confident	84	Confident	134 Å²	134	72.2 Å²	72.2	51%	0.506	37%	0.365	S	S	.	.	H	α-helix	trans	-68.8	-39.7	-176.3	-66.1	-65.2	169.5	130.6	0	112.6	L1182 L1183 A1184 Q1189 F1190	L1182-R1186 HydrophobicContact CD1-CG 4.25Å; L1182-R1186 HydrophobicContact CG-CG 4.45Å; L1182-R1186 VanDerWaalsContact O-CG 3.22Å; L1182-R1186 WeakPolarHBondContact O-CG 3.27Å; L1182-R1186 PolarHBondContact O-N 2.73Å; L1183-R1186 PolarHBondContact O-N 3.36Å; A1184-R1186 PolarHBondContact O-N 3.14Å; R1186-Q1189 PolarHBondContact O-N 3.21Å; R1186-F1190 PolarHBondContact O-N 3.42Å
1187	V	89.4	Confident	81.5	Confident	65 Å²	65	73 Å²	73	39%	0.394	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-47.9	174.8	171.8	0	0	0	0	110.3	L1183 Q1189 F1190 F1191	L1183-V1187 HydrophobicContact CD1-CG2 4.17Å; L1183-V1187 HydrophobicContact CG-CG2 4.26Å; L1183-V1187 WeakPolarHBondContact O-CB 3.12Å; L1183-V1187 VanDerWaalsContact O-CG2 3.27Å; L1183-V1187 WeakPolarHBondContact O-CG2 3.28Å; L1183-V1187 PolarHBondContact O-N 3.22Å; V1187-Q1189 VanDerWaalsContact C-N 3.31Å; V1187-Q1189 PolarHBondContact O-N 2.92Å; V1187-F1190 WeakPolarHBondContact O-CB 3.29Å; V1187-F1190 PolarHBondContact O-N 3.21Å; V1187-F1190 VanDerWaalsContact O-N 3.17Å; V1187-F1191 HydrophobicContact CG1-CD2 3.86Å; V1187-F1191 HydrophobicContact CG1-CE2 3.83Å; V1187-F1191 VanDerWaalsContact O-CD2 3.25Å; V1187-F1191 WeakPolarHBondContact O-CD2 3.46Å; V1187-F1191 PolarHBondContact O-N 3.34Å; V1187-F1191 VanDerWaalsContact O-N 3.15Å
1188	L	87.3	Confident	78.8	Confident	20 Å²	20	82.4 Å²	82.4	11%	0.105	41%	0.409	C	S	.	.	H	α-helix	trans	-63.8	-37	177.9	-70.2	178.2	0	0	0	112.5	Y1050 L1053 L1057 A1184 D1185 F1190 F1191 L1192	Y1050-L1188 HydrophobicContact CD2-CB 4.12Å; Y1050-L1188 HydrophobicContact CE2-CB 4.02Å; L1053-L1188 HydrophobicContact CB-CD1 4.23Å; L1053-L1188 HydrophobicContact CD2-CD1 4.31Å; L1053-L1188 HydrophobicContact CD2-CD2 3.43Å; L1053-L1188 VanDerWaalsContact CD2-CD2 3.43Å; L1053-L1188 HydrophobicContact CG-CD1 3.82Å; L1053-L1188 HydrophobicContact CG-CD2 3.89Å; L1057-L1188 HydrophobicContact CB-CD1 4.45Å; L1057-L1188 HydrophobicContact CD2-CD1 3.99Å; L1057-L1188 HydrophobicContact CD2-CG 4.48Å; A1184-L1188 WeakPolarHBondContact O-CB 3.36Å; A1184-L1188 VanDerWaalsContact O-CG 3.25Å; A1184-L1188 WeakPolarHBondContact O-CG 3.31Å; A1184-L1188 PolarHBondContact O-N 3.11Å; A1184-L1188 VanDerWaalsContact O-N 3.12Å; D1185-L1188 PolarHBondContact O-N 3.45Å; L1188-F1190 VanDerWaalsContact C-N 3.34Å; L1188-F1191 PolarHBondContact O-N 3.18Å; L1188-L1192 HydrophobicContact CD2-CD1 4.36Å; L1188-L1192 WeakPolarHBondContact O-CA 3.42Å; L1188-L1192 WeakPolarHBondContact O-CB 3.41Å; L1188-L1192 PolarHBondContact O-N 3.36Å
1189	Q	83.9	Confident	76	Confident	70 Å²	70	84 Å²	84	33%	0.327	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-41	174.5	-179.7	176.8	-5.4	0	0	111.4	Y1050 D1185 R1186 V1187 F1191 G1193	Y1050-Q1189 HydrophobicContact CE2-CB 4.09Å; D1185-Q1189 VanDerWaalsContact O-CB 3.25Å; D1185-Q1189 WeakPolarHBondContact O-CB 3.49Å; D1185-Q1189 PolarHBondContact O-N 2.91Å; R1186-Q1189 PolarHBondContact O-N 3.21Å; V1187-Q1189 VanDerWaalsContact C-N 3.31Å; V1187-Q1189 PolarHBondContact O-N 2.92Å; Q1189-F1191 PolarHBondContact O-N 2.9Å; Q1189-G1193 WeakPolarHBondContact O-CA 3.24Å; Q1189-G1193 PolarHBondContact O-N 3.23Å
1190	F	84.3	Confident	73.1	Confident	165 Å²	165	84 Å²	84	72%	0.724	42%	0.424	S	S	*	.	H	α-helix	trans	-62.9	-41.4	178	-178.3	-100.6	0	0	0	112.3	R1186 V1187 L1188	R1186-F1190 PolarHBondContact O-N 3.42Å; V1187-F1190 WeakPolarHBondContact O-CB 3.29Å; V1187-F1190 PolarHBondContact O-N 3.21Å; V1187-F1190 VanDerWaalsContact O-N 3.17Å; L1188-F1190 VanDerWaalsContact C-N 3.34Å
1191	F	83.8	Confident	70	Confident	148 Å²	148	87.6 Å²	87.6	65%	0.649	46%	0.456	S	S	*	.	H	α-helix	trans	-83.5	-37.8	-178.4	-73.9	-68.9	0	0	0	114.5	V1187 L1188 Q1189	V1187-F1191 HydrophobicContact CG1-CD2 3.86Å; V1187-F1191 HydrophobicContact CG1-CE2 3.83Å; V1187-F1191 VanDerWaalsContact O-CD2 3.25Å; V1187-F1191 WeakPolarHBondContact O-CD2 3.46Å; V1187-F1191 PolarHBondContact O-N 3.34Å; V1187-F1191 VanDerWaalsContact O-N 3.15Å; L1188-F1191 PolarHBondContact O-N 3.18Å; Q1189-F1191 PolarHBondContact O-N 2.9Å
1192	L	80.4	Confident	68.9	Low	63 Å²	63	92 Å²	92	33%	0.33	48%	0.479	S	S	.	.	H	α-helix	trans	-124.3	-6.9	-167.7	-58.2	173.9	0	0	0	114	L1049 Y1050 L1053 L1188	L1049-L1192 HydrophobicContact CD2-CD1 4.44Å; L1049-L1192 HydrophobicContact CG-CD1 4.41Å; Y1050-L1192 HydrophobicContact CD2-CB 4.26Å; Y1050-L1192 HydrophobicContact CG-CB 4.47Å; L1053-L1192 HydrophobicContact CD2-CD1 4.01Å; L1188-L1192 HydrophobicContact CD2-CD1 4.36Å; L1188-L1192 WeakPolarHBondContact O-CA 3.42Å; L1188-L1192 WeakPolarHBondContact O-CB 3.41Å; L1188-L1192 PolarHBondContact O-N 3.36Å
1193	G	65.4	Low	67.7	Low	18 Å²	18	94 Å²	94	19%	0.186	49%	0.489	C	S	.	.	S	Bend	trans	-80	-21.1	-171.4	0	0	0	0	0	115.1	Q1189 P1195	Q1189-G1193 WeakPolarHBondContact O-CA 3.24Å; Q1189-G1193 PolarHBondContact O-N 3.23Å; G1193-P1195 WeakPolarHBondContact O-CD 3.39Å
1194	T	65.1	Low	66.3	Low	71 Å²	71	93.2 Å²	93.2	44%	0.436	49%	0.485	S	S	.	.	S	Bend	trans	-94.8	116.1	176.2	54	0	0	0	0	110.8	K1196	T1194-K1196 PolarHBondContact O-N 3.45Å
1195	P	57.7	Low	64.9	Low	69 Å²	69	98 Å²	98	45%	0.448	51%	0.508	S	S	.	.			trans	-66.1	102.1	167.4	26.7	-30.5	0	0	0	108.2	L1043 G1193 L1197	L1043-P1195 HydrophobicContact CD2-CB 4.5Å; L1043-P1195 HydrophobicContact CD2-CG 4.36Å; G1193-P1195 WeakPolarHBondContact O-CD 3.39Å; P1195-L1197 PolarHBondContact O-N 2.93Å
1196	K	54	Low	63.4	Low	186 Å²	186	104.1 Å²	104.1	81%	0.809	54%	0.539	S	S	*	.			trans	-62.8	120.7	164.6	-73.3	-176.1	-179.6	177.5	0	106.6	T1194 K1198	T1194-K1196 PolarHBondContact O-N 3.45Å; K1196-K1198 PolarHBondContact O-N 3.45Å
1197	L	41.3	Very low	61.7	Low	117 Å²	117	102.1 Å²	102.1	61%	0.613	54%	0.542	S	S	*	.			trans	-49	100.4	173.1	-117.4	145.6	0	0	0	108.5	P1195 V1199	P1195-L1197 PolarHBondContact O-N 2.93Å; L1197-V1199 HydrophobicContact CD2-CG2 3.93Å; L1197-V1199 PolarHBondContact O-N 3.26Å
1198	K	37.5	Very low	59.8	Low	200 Å²	200	104.8 Å²	104.8	87%	0.87	55%	0.552	S	S	*	*			trans	-75.1	85	156.5	-81.9	-173.1	178.2	-179.4	0	104.8	K1196 P1200	K1196-K1198 PolarHBondContact O-N 3.45Å; K1198-P1200 WeakPolarHBondContact O-CD 3.41Å; K1198-P1200 VanDerWaalsContact O-N 3.16Å
1199	V	32.7	Very low	57.6	Low	111 Å²	111	111.3 Å²	111.3	67%	0.673	59%	0.587	S	S	*	*			trans	-53.2	120.5	156.9	-177.1	0	0	0	0	104.6	L1197 S1201	L1197-V1199 HydrophobicContact CD2-CG2 3.93Å; L1197-V1199 PolarHBondContact O-N 3.26Å; V1199-S1201 PolarHBondContact O-N 2.85Å
1200	P	34	Very low	55.5	Low	76 Å²	76	114.8 Å²	114.8	49%	0.494	61%	0.608	S	S	.	*			trans	-60.5	108.6	-178.1	19.5	-28.1	0	0	0	109	K798 K1198	K798-P1200 PolarHBondContact NZ-O 3.44Å; K1198-P1200 WeakPolarHBondContact O-CD 3.41Å; K1198-P1200 VanDerWaalsContact O-N 3.16Å
1201	S	29.3	Very low	52.8	Low	153 Å²	153	110.2 Å²	110.2	100%	1.07	60%	0.598	S	S	*	*			trans	-50.3	0	173.7	53.7	0	0	0	0	112.1	K798 V1199	K798-S1201 PolarHBondContact NZ-O 3.5Å; K798-S1201 PolarHBondContact NZ-OXT 2.86Å; V1199-S1201 PolarHBondContact O-N 2.85Å

Retrieved 1,201 of 1,201 residues in 1737.3 ms (Link to these results)

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