A0A093HTZ2_STRCA Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A093HTZ2, Species STRCA (Struthio camelus australis), Gene n/a, Length 1,000 aa.

						>A0A093HTZ2_STRCA|A0A093HTZ2
MDSNVAISARRVAGMGWLWMVCFFHLVTSLEEILLDTTGETSEIGWTSHPPDGWDEVSVLDDKKRLIRTFEVCNVAEPGQNNWLRTHFIERHGAHRVHVRLRFSVRDCASMRTVASSCKETFTLYYHQAEADVASQELPEWHEGPWTKVDTIAADESFSQVDSTGKVVKMNVKVRSFGPLTQRGFYLAFQDSGACMSLVAVQVFFYKCPAVVKGFASFPETFAGGERTSLVESPGTCVANAEEASTTGSSGVRLHCNGEGEWMVAIGRCTCKAGYQPVDDERACQPCPLGSFKLSVGDDPCHLCPAHSHAPVPGSSECVCQNRYYRSASDTSDAPCTGIPSAPRDLSYEIVGSNVLLTWRLPKDLGGRKDVFFNVICKVCPAGSPGPCVRCGDSVQFEPRQVGLTESRVLVSNLLARVQYTFEIQAVNLVTELSSEAPYYATINVSTSQSVPSAVPMMHQVSRTSSSITLSWPQPDQPNGIILDYQLRYFDKADEEDNSLTLTSETNMATISNLSPGKIYAFQVRARTAVGYGPYSGKMYFQTLMGGERSEMVQDRLPLIVGSALGGLAFLVIAAIAILAIIFKSKRRETPYTDRLQQYISARGLGVKYYIDPSTYEDPNEAIREFAKEIDVSLIKIEEVIGSGEFGEVCFGRLKPPGKREYTVAIKTLKSGYTDEQRREFLSEASIMGQFEHPNVIHLEGVVTKSRPVMIVTEFMENGSLDSFLRQKEGQFSVLQLVGMLRGIAAGMRYLSDMNYVHRDLAARNILVNSNLVCKVSDFGLSRFLEDDASNPTYTGALGCKIPIRWTAPEAVQYRKFTSSSDVWSYGIVMWEVMSYGERPYWDMSNQDVINAIDQDYRLPPPPDCPTVLHLLMLDCWQKERVQRPKFEQIVSALDKMIRKPSALKATGTGSGRPSQPLLSNSPPDFPSLSSAHEWLDAIKMGRYKENFDQAGLIAFDVISRMTLEDIQRIGITLVGHQKKILNSIQLMRVHLNQLEPVEV
					

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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	31.6	Very low	29.3	Very low	227 Å²	227	155.8 Å²	155.8	100%	1.118	84%	0.839	S	S	*	*				0	96.5	0	-70.7	-173.5	176.6	0	0	109.2
2	D	29	Very low	29.9	Very low	138 Å²	138	155.4 Å²	155.4	74%	0.738	85%	0.845	S	S	*	*			cis	177.7	132.4	-21.3	-99.2	3.4	0	0	0	103.1
3	S	25.3	Very low	30.3	Very low	90 Å²	90	151.8 Å²	151.8	63%	0.629	85%	0.849	S	S	*	*			trans	68.4	124.3	137.1	-44.3	0	0	0	0	120.7
4	N	27.2	Very low	30.5	Very low	153 Å²	153	146.6 Å²	146.6	82%	0.818	85%	0.847	S	S	*	*			trans	76.7	122.9	147.6	-51.6	-28.6	0	0	0	115.1
5	V	28.6	Very low	30.7	Very low	138 Å²	138	150.5 Å²	150.5	84%	0.836	86%	0.858	S	S	*	*				-157.3	121.7	61.6	167.9	0	0	0	0	109.4
6	A	28.9	Very low	30.8	Very low	84 Å²	84	144.8 Å²	144.8	69%	0.694	84%	0.842	S	S	*	*			trans	-91.4	156.8	158.4	0	0	0	0	0	109
7	I	32.1	Very low	31	Very low	169 Å²	169	151.2 Å²	151.2	87%	0.867	85%	0.849	S	S	*	*			trans	91.7	84.1	172.6	-45.4	161.7	0	0	0	114.5
8	S	28.8	Very low	31.1	Very low	123 Å²	123	152.2 Å²	152.2	86%	0.86	85%	0.851	S	S	*	*			trans	177.3	83.1	133.3	-175.2	0	0	0	0	109.7
9	A	27.3	Very low	31.2	Very low	96 Å²	96	156.6 Å²	156.6	79%	0.793	85%	0.854	S	S	*	*			trans	-155.2	87.8	168.5	0	0	0	0	0	110
10	R	27.3	Very low	31.3	Very low	253 Å²	253	157 Å²	157	96%	0.955	85%	0.851	S	S	*	*			trans	175.8	72.2	149.5	-96.9	171.4	-171.2	-160.6	3.2	108.6
11	R	36.2	Very low	31.6	Very low	243 Å²	243	156.3 Å²	156.3	92%	0.917	85%	0.852	S	S	*	*			trans	-102	147.6	151.3	-86.6	-176	179.9	-178.2	0.3	106.5
12	V	36.3	Very low	31.7	Very low	151 Å²	151	150.8 Å²	150.8	92%	0.915	83%	0.834	S	S	*	*	S	Bend	trans	85.2	61.7	-176.1	-158	0	0	0	0	114.9
13	A	34.9	Very low	31.8	Very low	108 Å²	108	152 Å²	152	89%	0.893	83%	0.833	S	S	*	*	S	Bend	trans	-168.3	82.4	146.1	0	0	0	0	0	107.8
14	G	33.4	Very low	32.2	Very low	80 Å²	80	156 Å²	156	83%	0.825	84%	0.839	S	S	*	*			trans	174.9	46.4	-175.7	0	0	0	0	0	112.4
15	M	33.2	Very low	32.5	Very low	204 Å²	204	155.1 Å²	155.1	100%	1.005	83%	0.831	S	S	*	*	S	Bend	trans	-137.4	34.2	176.5	-129.7	162.7	87.4	0	0	111.4
16	G	33.1	Very low	33	Very low	59 Å²	59	154.8 Å²	154.8	61%	0.608	82%	0.823	S	S	*	*	S	Bend	trans	-130.9	6.7	-179.8	0	0	0	0	0	115.3
17	W	33.5	Very low	34.1	Very low	254 Å²	254	153.5 Å²	153.5	96%	0.962	81%	0.807	S	S	*	*	S	Bend	trans	-134.6	40	-176	-81.9	64.2	0	0	0	111.9
18	L	34	Very low	35.4	Very low	170 Å²	170	150.6 Å²	150.6	89%	0.89	80%	0.797	S	S	*	*	S	Bend	trans	-137.1	24.1	170.9	-119.1	134.3	0	0	0	111.7
19	W	31.7	Very low	37.5	Very low	236 Å²	236	146.5 Å²	146.5	89%	0.894	77%	0.768	S	S	*	*	S	Bend	trans	-124.7	22.1	179.5	-96.9	63	0	0	0	112.4
20	M	33.8	Very low	40.2	Very low	163 Å²	163	145.2 Å²	145.2	80%	0.803	75%	0.748	S	S	*	*	S	Bend	trans	-146.3	40.9	-176	-93.9	-100.9	-81	0	0	112.8
21	V	37.6	Very low	43.2	Very low	144 Å²	144	136.6 Å²	136.6	87%	0.873	72%	0.718	S	S	*	*	S	Bend	trans	-149.6	74.6	157.7	-169.8	0	0	0	0	108.5
22	C	34.7	Very low	45.8	Very low	110 Å²	110	127.9 Å²	127.9	74%	0.743	69%	0.688	S	S	*	*			trans	175	49.4	155.9	-97.1	0	0	0	0	108	F24	C22-F24 PolarHBondContact O-N 3.02Å
23	F	29.8	Very low	48.5	Very low	163 Å²	163	124.2 Å²	124.2	72%	0.715	66%	0.662	S	S	*	*			trans	-91.5	73.1	149.9	-82.9	-83.8	0	0	0	105.8	H25	F23-H25 VanDerWaalsContact C-N 3.27Å; F23-H25 PolarHBondContact O-N 3.47Å; F23-H25 VanDerWaalsContact O-N 3.13Å
24	F	33.6	Very low	51.3	Low	174 Å²	174	120.6 Å²	120.6	76%	0.763	63%	0.628	S	S	*	*			trans	-57.8	114.6	137.5	-83.1	-82.5	0	0	0	103	C22 L26	C22-F24 PolarHBondContact O-N 3.02Å; F24-L26 PolarHBondContact O-N 3.49Å
25	H	34.6	Very low	54.3	Low	136 Å²	136	117.5 Å²	117.5	63%	0.63	59%	0.592	S	S	*	*			trans	-57	92.5	158.1	-84.8	-68.5	0	0	0	105.1	F23 V27	F23-H25 VanDerWaalsContact C-N 3.27Å; F23-H25 PolarHBondContact O-N 3.47Å; F23-H25 VanDerWaalsContact O-N 3.13Å; H25-V27 PolarHBondContact O-N 2.81Å
26	L	38.2	Very low	57.2	Low	131 Å²	131	111 Å²	111	69%	0.686	56%	0.561	S	S	*	*			trans	-57.2	97	152.4	-95.8	94.2	0	0	0	102.9	F24 T28	F24-L26 PolarHBondContact O-N 3.49Å; L26-T28 PolarHBondContact O-N 3.47Å
27	V	51.6	Low	60	Low	57 Å²	57	108.6 Å²	108.6	35%	0.345	54%	0.535	S	S	.	.			trans	-63.1	98.2	162	175.1	0	0	0	0	103.3	H25 S29 P209 V211	H25-V27 PolarHBondContact O-N 2.81Å; V27-S29 PolarHBondContact O-N 3.49Å; V27-P209 HydrophobicContact CG1-CG 3.11Å; V27-V211 HydrophobicContact CG2-CG2 4.46Å
28	T	59.1	Low	62.5	Low	108 Å²	108	99.3 Å²	99.3	66%	0.663	51%	0.507	S	S	*	.			trans	-61.5	133.1	-179	44.5	0	0	0	0	107.8	L26 L30	L26-T28 PolarHBondContact O-N 3.47Å; T28-L30 PolarHBondContact O-N 2.88Å
29	S	74.5	Confident	64.7	Low	36 Å²	36	92.5 Å²	92.5	25%	0.252	48%	0.478	S	S	.	.			trans	-54.6	138.3	173.4	57	0	0	0	0	109.4	V27 Y206 E259 G260	V27-S29 PolarHBondContact O-N 3.49Å; S29-Y206 WeakPolarHBondContact OG-CE1 3.29Å; S29-E259 WeakPolarHBondContact CB-O 3.39Å; S29-E259 PolarHBondContact OG-O 3.02Å; S29-G260 WeakPolarHBondContact CB-O 3.42Å
30	L	82.8	Confident	67.2	Low	70 Å²	70	84.6 Å²	84.6	37%	0.366	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	115.1	-177	-173.1	60.3	0	0	0	107.8	T28 K207 P209	T28-L30 PolarHBondContact O-N 2.88Å; L30-K207 HydrophobicContact CB-CG 3.81Å; L30-K207 HydrophobicContact CD2-CD 4.15Å; L30-K207 HydrophobicContact CD2-CG 4.12Å; L30-K207 HydrophobicContact CG-CD 4.45Å; L30-K207 HydrophobicContact CG-CG 4.09Å; L30-K207 PolarHBondContact N-O 3.13Å; L30-K207 VanDerWaalsContact N-O 3.12Å; L30-K207 PolarHBondContact O-N 3Å; L30-P209 HydrophobicContact CD2-CB 4.41Å
31	E	90.4	Very high	69.4	Low	71 Å²	71	80.9 Å²	80.9	33%	0.332	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.5	175.5	-65.2	-172.9	176	0	0	109.5	R100 F204 Y206	E31-R100 VanDerWaalsContact CD-NH2 3.27Å; E31-R100 IonicContact OE1-CZ 2.64Å; E31-R100 IonicContact OE1-NH2 3.64Å; E31-R100 PolarHBondContact OE1-NH2 2.74Å; E31-R100 IonicContact OE2-CZ 3.71Å; E31-R100 IonicContact OE2-NH1 3.55Å; E31-R100 PolarHBondContact OE2-NH1 3.32Å; E31-R100 IonicContact OE2-NH2 3.63Å; E31-R100 PolarHBondContact OE2-NH2 2.89Å; E31-F204 HydrophobicContact CB-CD2 3.91Å; E31-F204 HydrophobicContact CB-CE2 4.47Å; E31-F204 HydrophobicContact CG-CD2 3.73Å; E31-F204 HydrophobicContact CG-CE2 3.79Å; E31-Y206 HydrophobicContact CG-CD1 4.08Å; E31-Y206 HydrophobicContact CG-CE1 3.63Å
32	E	90.6	Very high	71.5	Confident	60 Å²	60	77.2 Å²	77.2	28%	0.28	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.2	172.7	-171.6	163.4	163.5	0	0	109.7	F204 F205 K207	E32-F204 CarbonylContact O-C 3.55Å; E32-F204 WeakPolarHBondContact O-CA 3.28Å; E32-F204 VanDerWaalsContact O-CB 3.29Å; E32-F204 WeakPolarHBondContact O-CB 3.43Å; E32-F205 HydrophobicContact CB-CD1 4.03Å; E32-F205 HydrophobicContact CB-CE1 3.54Å; E32-F205 HydrophobicContact CB-CE2 4.26Å; E32-F205 HydrophobicContact CB-CZ 3.67Å; E32-F205 VanDerWaalsContact CD-CZ 3.46Å; E32-F205 HydrophobicContact CG-CD1 4.47Å; E32-F205 HydrophobicContact CG-CE1 3.58Å; E32-F205 HydrophobicContact CG-CZ 3.76Å; E32-F205 PolarHBondContact N-O 2.77Å; E32-F205 WeakPolarHBondContact O-CD1 3.47Å; E32-F205 PolarHBondContact O-N 3Å; E32-K207 WeakPolarHBondContact OE2-CD 3.31Å; E32-K207 WeakPolarHBondContact OE2-CE 3.46Å; E32-K207 IonicContact OE2-NZ 3.86Å; E32-K207 PolarHBondContact OE2-NZ 3.18Å
33	I	93.6	Very high	73.8	Confident	74 Å²	74	79.3 Å²	79.3	38%	0.379	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	127.9	-172.2	-54	-54.6	0	0	0	110.2	D36 Q202 F204	I33-D36 HydrophobicContact CG2-CB 3.85Å; I33-Q202 HydrophobicContact CD1-CG 4.05Å; I33-Q202 HydrophobicContact CG2-CG 4.41Å; I33-F204 HydrophobicContact CD1-CB 3.64Å; I33-F204 HydrophobicContact CD1-CG 4.39Å
34	L	94.3	Very high	76.6	Confident	32 Å²	32	72.8 Å²	72.8	17%	0.168	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-33.3	174.2	-58.9	180	0	0	0	112.2	I89 A94 V97 F185 V203 F205	L34-I89 HydrophobicContact CB-CG2 3.77Å; L34-I89 HydrophobicContact CD1-CG2 4.47Å; L34-A94 HydrophobicContact CD1-CB 4.43Å; L34-V97 HydrophobicContact CD1-CG1 4.26Å; L34-V97 HydrophobicContact CD1-CG2 3.72Å; L34-F185 HydrophobicContact CD1-CE1 4.26Å; L34-F185 HydrophobicContact CD1-CZ 4.16Å; L34-V203 HydrophobicContact CB-CB 4.42Å; L34-V203 HydrophobicContact CB-CG1 4.24Å; L34-V203 HydrophobicContact CD1-CG1 4.37Å; L34-V203 PolarHBondContact N-O 2.82Å; L34-F205 HydrophobicContact CD1-CD1 4.16Å; L34-F205 HydrophobicContact CD2-CD1 3.88Å; L34-F205 HydrophobicContact CD2-CE1 3.76Å; L34-F205 HydrophobicContact CG-CD1 3.98Å; L34-F205 HydrophobicContact CG-CE1 4.36Å
35	L	94.9	Very high	79.2	Confident	16 Å²	16	67.2 Å²	67.2	8%	0.084	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	139.2	177.6	171.1	64.4	0	0	0	109	T37 W46 T86 H87 I89 Q202 V203	L35-T37 HydrophobicContact CD1-CG2 4.5Å; L35-W46 HydrophobicContact CD2-CZ2 4.03Å; L35-T86 HydrophobicContact CD2-CG2 4.4Å; L35-H87 WeakPolarHBondContact CD1-CE1 3.44Å; L35-I89 HydrophobicContact CB-CD1 4.23Å; L35-I89 HydrophobicContact CD2-CD1 3.56Å; L35-I89 HydrophobicContact CD2-CG1 4.16Å; L35-Q202 CarbonylContact O-C 3.59Å; L35-Q202 WeakPolarHBondContact O-CA 3.18Å; L35-V203 HydrophobicContact CB-CB 3.9Å; L35-V203 HydrophobicContact CB-CG2 3.89Å; L35-V203 HydrophobicContact CD2-CG2 4Å; L35-V203 HydrophobicContact CG-CG2 4.31Å; L35-V203 PolarHBondContact N-O 3.23Å; L35-V203 PolarHBondContact O-N 3.31Å
36	D	93.9	Very high	82	Confident	66 Å²	66	61.6 Å²	61.6	35%	0.353	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	116.4	173.8	-165.7	-5.1	0	0	0	110.5	I33 T38 Q202	I33-D36 HydrophobicContact CG2-CB 3.85Å; D36-T38 WeakPolarHBondContact OD1-CA 3.43Å; D36-T38 WeakPolarHBondContact OD1-CB 3.27Å; D36-T38 PolarHBondContact OD1-N 3.41Å; D36-T38 PolarHBondContact OD1-OG1 2.91Å; D36-Q202 HydrophobicContact CB-CG 4.15Å; D36-Q202 PolarHBondContact OD2-NE2 3.24Å
37	T	92.4	Very high	84.6	Confident	9 Å²	9	57.2 Å²	57.2	6%	0.055	33%	0.333	C	S	.	.			trans	-95.3	4.3	173.5	70.4	0	0	0	0	112.7	L35 G39 E40 I44 W46 V201	L35-T37 HydrophobicContact CD1-CG2 4.5Å; T37-G39 PolarHBondContact O-N 2.97Å; T37-E40 WeakPolarHBondContact O-CB 3.19Å; T37-E40 PolarHBondContact O-N 3.12Å; T37-E40 VanDerWaalsContact O-N 3.16Å; T37-I44 HydrophobicContact CG2-CD1 4.29Å; T37-I44 HydrophobicContact CG2-CG2 4.23Å; T37-W46 HydrophobicContact CG2-CH2 4.11Å; T37-W46 HydrophobicContact CG2-CZ2 3.62Å; T37-V201 PolarHBondContact N-O 3.48Å; T37-V201 PolarHBondContact OG1-N 2.84Å; T37-V201 PolarHBondContact OG1-O 2.95Å
38	T	86.5	Confident	86.6	Confident	60 Å²	60	56 Å²	56	37%	0.368	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	109	-175	-55.2	0	0	0	0	111.3	D36 E40	D36-T38 WeakPolarHBondContact OD1-CA 3.43Å; D36-T38 WeakPolarHBondContact OD1-CB 3.27Å; D36-T38 PolarHBondContact OD1-N 3.41Å; D36-T38 PolarHBondContact OD1-OG1 2.91Å; T38-E40 VanDerWaalsContact C-N 3.34Å
39	G	80.2	Confident	88.2	Confident	27 Å²	27	54.3 Å²	54.3	28%	0.278	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	17.1	177.5	0	0	0	0	0	114	T37 T41	T37-G39 PolarHBondContact O-N 2.97Å; G39-T41 WeakPolarHBondContact O-CG2 3.26Å
40	E	84.3	Confident	89	Confident	69 Å²	69	55.2 Å²	55.2	32%	0.322	32%	0.316	S	S	.	.			trans	-64.1	136.5	172.1	-172.1	50.3	-103.9	0	0	110.4	T37 T38 S42 I44 I67 R68	T37-E40 WeakPolarHBondContact O-CB 3.19Å; T37-E40 PolarHBondContact O-N 3.12Å; T37-E40 VanDerWaalsContact O-N 3.16Å; T38-E40 VanDerWaalsContact C-N 3.34Å; E40-S42 PolarHBondContact OE1-N 3.38Å; E40-S42 PolarHBondContact OE1-OG 3.31Å; E40-I44 HydrophobicContact CB-CG1 4.33Å; E40-I44 HydrophobicContact CG-CG1 3.92Å; E40-I67 CarbonylContact O-C 3.59Å; E40-I67 WeakPolarHBondContact O-CA 3.29Å; E40-R68 PolarHBondContact O-N 3.18Å
41	T	79.1	Confident	89.2	Confident	86 Å²	86	56.1 Å²	56.1	53%	0.528	33%	0.326	S	S	.	.			trans	-117.1	-19.3	-174.1	67.2	0	0	0	0	112.3	G39 L66 R68	G39-T41 WeakPolarHBondContact O-CG2 3.26Å; T41-L66 WeakPolarHBondContact CG2-O 3.31Å; T41-R68 PolarHBondContact O-NE 3.32Å
42	S	81.8	Confident	88.9	Confident	67 Å²	67	59.1 Å²	59.1	47%	0.469	35%	0.345	S	S	.	.	S	Bend	trans	-90	163.2	173.8	64.7	0	0	0	0	111.5	E40 I44 R68	E40-S42 PolarHBondContact OE1-N 3.38Å; E40-S42 PolarHBondContact OE1-OG 3.31Å; S42-I44 PolarHBondContact O-N 3.05Å; S42-R68 VanDerWaalsContact O-CG 3.22Å; S42-R68 WeakPolarHBondContact O-CG 3.31Å
43	E	83.6	Confident	88.7	Confident	153 Å²	153	56.4 Å²	56.4	72%	0.715	33%	0.332	S	S	*	.			trans	-58.5	122.8	178.5	-70.1	174	-175.4	0	0	110.5	G45 E56	E43-G45 VanDerWaalsContact C-N 3.34Å; E43-E56 WeakPolarHBondContact CA-OE1 3.35Å
44	I	88.2	Confident	88.7	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.138	32%	0.315	C	S	.	.			trans	-74.5	-31.4	-179.2	-60.4	173.7	0	0	0	109.8	T37 E40 S42 W46 E56 R68 F70	T37-I44 HydrophobicContact CG2-CD1 4.29Å; T37-I44 HydrophobicContact CG2-CG2 4.23Å; E40-I44 HydrophobicContact CB-CG1 4.33Å; E40-I44 HydrophobicContact CG-CG1 3.92Å; S42-I44 PolarHBondContact O-N 3.05Å; I44-W46 HydrophobicContact CG2-CD2 4.02Å; I44-W46 HydrophobicContact CG2-CG 3.94Å; I44-W46 HydrophobicContact CG2-CZ2 4.22Å; I44-W46 VanDerWaalsContact CG2-NE1 3.32Å; I44-W46 PolarHBondContact O-N 2.84Å; I44-E56 PolarHBondContact N-OE1 3.49Å; I44-R68 HydrophobicContact CD1-CB 3.78Å; I44-R68 HydrophobicContact CG1-CB 4Å; I44-F70 HydrophobicContact CB-CE2 4.08Å; I44-F70 HydrophobicContact CB-CZ 4.02Å; I44-F70 HydrophobicContact CD1-CE2 3.85Å; I44-F70 HydrophobicContact CG2-CE2 4.04Å; I44-F70 HydrophobicContact CG2-CZ 4.19Å
45	G	87.8	Confident	88.6	Confident	56 Å²	56	55.9 Å²	55.9	58%	0.577	33%	0.33	S	S	*	.			trans	71.6	29.9	168.6	0	0	0	0	0	114.4	E43 E56	E43-G45 VanDerWaalsContact C-N 3.34Å; G45-E56 PolarHBondContact N-OE2 2.77Å
46	W	93.7	Very high	88.5	Confident	18 Å²	18	57.8 Å²	57.8	7%	0.068	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-74.1	153	173	-71.9	3.6	0	0	0	111.3	L35 T37 I44 F70 L84 R85 T86 H87 F189 L198 V201	L35-W46 HydrophobicContact CD2-CZ2 4.03Å; T37-W46 HydrophobicContact CG2-CH2 4.11Å; T37-W46 HydrophobicContact CG2-CZ2 3.62Å; I44-W46 HydrophobicContact CG2-CD2 4.02Å; I44-W46 HydrophobicContact CG2-CG 3.94Å; I44-W46 HydrophobicContact CG2-CZ2 4.22Å; I44-W46 VanDerWaalsContact CG2-NE1 3.32Å; I44-W46 PolarHBondContact O-N 2.84Å; W46-F70 HydrophobicContact CB-CE1 4.1Å; W46-F70 HydrophobicContact CB-CE2 4.34Å; W46-F70 HydrophobicContact CB-CZ 3.66Å; W46-F70 AromaticContact CD2-CE2 3.92Å; W46-F70 HydrophobicContact CD2-CE2 3.92Å; W46-F70 HydrophobicContact CD2-CZ 4.14Å; W46-F70 HydrophobicContact CE3-CD2 4.04Å; W46-F70 AromaticContact CE3-CE2 3.64Å; W46-F70 HydrophobicContact CE3-CE2 3.64Å; W46-F70 HydrophobicContact CE3-CZ 4.12Å; W46-F70 HydrophobicContact CG-CE2 4.27Å; W46-F70 AromaticContact CG-CZ 4Å; W46-F70 HydrophobicContact CG-CZ 4Å; W46-F70 HydrophobicContact CZ3-CD2 4.31Å; W46-F70 HydrophobicContact CZ3-CE2 4.17Å; W46-L84 HydrophobicContact CB-CD1 3.75Å; W46-L84 HydrophobicContact CE3-CD1 4.28Å; W46-L84 HydrophobicContact CE3-CD2 3.86Å; W46-L84 HydrophobicContact CE3-CG 3.92Å; W46-L84 HydrophobicContact CZ3-CD2 4.27Å; W46-R85 WeakPolarHBondContact CA-O 3.33Å; W46-R85 WeakPolarHBondContact CB-O 3.47Å; W46-T86 HydrophobicContact CD2-CG2 3.9Å; W46-T86 HydrophobicContact CE3-CG2 4.06Å; W46-T86 HydrophobicContact CH2-CG2 3.69Å; W46-T86 HydrophobicContact CZ2-CG2 3.54Å; W46-T86 HydrophobicContact CZ3-CG2 3.95Å; W46-H87 AromaticContact NE1-ND1 3.65Å; W46-F189 HydrophobicContact CE3-CE2 4.31Å; W46-F189 HydrophobicContact CH2-CE2 4.13Å; W46-F189 HydrophobicContact CZ3-CD2 4.21Å; W46-F189 AromaticContact CZ3-CE2 3.56Å; W46-F189 HydrophobicContact CZ3-CE2 3.56Å; W46-F189 HydrophobicContact CZ3-CZ 4.32Å; W46-L198 HydrophobicContact CZ3-CD2 4.29Å; W46-V201 HydrophobicContact CH2-CB 3.8Å; W46-V201 HydrophobicContact CH2-CG1 4.21Å; W46-V201 HydrophobicContact CH2-CG2 3.71Å; W46-V201 HydrophobicContact CZ3-CG2 4.13Å
47	T	93.7	Very high	88.3	Confident	40 Å²	40	56.7 Å²	56.7	25%	0.245	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125	-174.6	-46	0	0	0	0	110.5	L84 R85 W141	T47-L84 CarbonylContact O-C 3.44Å; T47-L84 WeakPolarHBondContact O-CA 3.49Å; T47-R85 PolarHBondContact N-O 2.87Å; T47-R85 PolarHBondContact O-N 3.04Å; T47-R85 PolarHBondContact OG1-NH2 3.13Å; T47-W141 HydrophobicContact CG2-CH2 4.16Å; T47-W141 HydrophobicContact CG2-CZ2 3.82Å
48	S	93.4	Very high	88	Confident	30 Å²	30	58.7 Å²	58.7	21%	0.21	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	146	174.4	58	0	0	0	0	112.2	P51 W83	S48-P51 PolarHBondContact OG-O 2.9Å; S48-W83 CarbonylContact C-O 3.59Å; S48-W83 VanDerWaalsContact CA-O 3.31Å; S48-W83 WeakPolarHBondContact CA-O 3.32Å
49	H	92.4	Very high	87.8	Confident	73 Å²	73	58.4 Å²	58.4	34%	0.338	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	125.5	171.7	-175.2	84.7	0	0	0	112.2	W83 W141	H49-W83 HydrophobicContact CB-CB 4.47Å; H49-W83 PolarHBondContact N-O 2.93Å; H49-W83 PolarHBondContact O-N 3.45Å; H49-W141 HydrophobicContact CB-CB 4.3Å; H49-W141 HydrophobicContact CB-CD2 3.34Å; H49-W141 VanDerWaalsContact CB-CE2 3.4Å; H49-W141 HydrophobicContact CB-CE3 3.82Å; H49-W141 HydrophobicContact CB-CG 3.58Å; H49-W141 HydrophobicContact CB-CH2 4.26Å; H49-W141 HydrophobicContact CB-CZ2 3.9Å; H49-W141 HydrophobicContact CB-CZ3 4.24Å; H49-W141 WeakPolarHBondContact CD2-CB 3.17Å; H49-W141 AromaticContact CD2-CD1 3.67Å; H49-W141 AromaticContact CD2-CG 3.46Å; H49-W141 VanDerWaalsContact CD2-CG 3.46Å; H49-W141 AromaticContact CE1-CD1 3.81Å; H49-W141 AromaticContact CG-CD1 3.33Å; H49-W141 AromaticContact CG-CD2 3.76Å; H49-W141 AromaticContact CG-CE2 3.92Å; H49-W141 AromaticContact CG-CG 3.37Å; H49-W141 AromaticContact CG-NE1 3.66Å; H49-W141 AromaticContact ND1-CD1 3.44Å; H49-W141 AromaticContact ND1-CG 3.97Å; H49-W141 AromaticContact ND1-NE1 3.7Å; H49-W141 AromaticContact NE2-CD1 3.96Å
50	P	91.3	Very high	87.8	Confident	56 Å²	56	62.6 Å²	62.6	36%	0.364	36%	0.362	S	S	.	.	S	Bend	cis	-58.3	162.3	-11.3	28.1	-35	0	0	0	111.2	D52 G53	P50-D52 PolarHBondContact O-N 2.86Å; P50-D52 VanDerWaalsContact O-N 3.11Å; P50-G53 WeakPolarHBondContact O-CA 3.33Å; P50-G53 PolarHBondContact O-N 2.87Å
51	P	86.9	Confident	87.2	Confident	89 Å²	89	60.9 Å²	60.9	58%	0.578	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-35.9	-175.8	-29.6	36.2	0	0	0	114.2	S48 G53	S48-P51 PolarHBondContact OG-O 2.9Å; P51-G53 VanDerWaalsContact C-N 3.29Å; P51-G53 PolarHBondContact O-N 2.87Å
52	D	84.4	Confident	86.8	Confident	134 Å²	134	63.5 Å²	63.5	72%	0.717	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	12.5	179.1	-51.1	-39.7	0	0	0	113.3	P50	P50-D52 PolarHBondContact O-N 2.86Å; P50-D52 VanDerWaalsContact O-N 3.11Å
53	G	86.6	Confident	86.5	Confident	2 Å²	2	68 Å²	68	2%	0.021	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-45.8	-178.3	0	0	0	0	0	113.1	P50 P51 V72	P50-G53 WeakPolarHBondContact O-CA 3.33Å; P50-G53 PolarHBondContact O-N 2.87Å; P51-G53 VanDerWaalsContact C-N 3.29Å; P51-G53 PolarHBondContact O-N 2.87Å; G53-V72 WeakPolarHBondContact O-CG2 3.48Å
54	W	93.6	Very high	86.1	Confident	5 Å²	5	69.1 Å²	69.1	2%	0.019	38%	0.38	C	S	.	.	S	Bend	trans	-125.1	126	176.7	-78.1	91.1	0	0	0	109.4	F70 V72 N82 L84 F189 D191 M196 L198	W54-F70 HydrophobicContact CE3-CB 3.91Å; W54-F70 HydrophobicContact CZ3-CB 4.29Å; W54-V72 HydrophobicContact CD2-CB 3.95Å; W54-V72 HydrophobicContact CD2-CG1 3.97Å; W54-V72 HydrophobicContact CE3-CB 3.91Å; W54-V72 HydrophobicContact CE3-CG1 3.8Å; W54-V72 HydrophobicContact CG-CB 4.48Å; W54-V72 HydrophobicContact CH2-CG1 3.53Å; W54-V72 HydrophobicContact CZ2-CG1 3.68Å; W54-V72 HydrophobicContact CZ3-CB 4.21Å; W54-V72 HydrophobicContact CZ3-CG1 3.58Å; W54-N82 PolarHBondContact NE1-O 3.49Å; W54-L84 HydrophobicContact CB-CB 4.22Å; W54-L84 HydrophobicContact CB-CD1 4.29Å; W54-L84 HydrophobicContact CD2-CB 4.03Å; W54-L84 HydrophobicContact CD2-CD2 4.14Å; W54-L84 HydrophobicContact CE3-CD2 4.13Å; W54-L84 HydrophobicContact CG-CB 3.74Å; W54-L84 HydrophobicContact CG-CD2 4.4Å; W54-L84 HydrophobicContact CG-CG 4.49Å; W54-F189 HydrophobicContact CZ2-CB 4.36Å; W54-D191 HydrophobicContact CZ2-CB 3.87Å; W54-M196 HydrophobicContact CH2-CE 3.7Å; W54-M196 HydrophobicContact CH2-CG 3.97Å; W54-M196 HydrophobicContact CH2-SD 3.71Å; W54-M196 HydrophobicContact CZ2-SD 4.37Å; W54-M196 HydrophobicContact CZ3-CE 4.41Å; W54-M196 HydrophobicContact CZ3-CG 4.42Å; W54-L198 HydrophobicContact CZ3-CB 4.24Å
55	D	92.7	Very high	85.6	Confident	90 Å²	90	73.9 Å²	73.9	48%	0.481	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.9	-178.7	-71.2	-38.4	0	0	0	111.2	V57 F70 E71	D55-V57 HydrophobicContact CB-CG1 4.18Å; D55-F70 CarbonylContact O-C 3.57Å; D55-F70 WeakPolarHBondContact O-CA 3.27Å; D55-E71 PolarHBondContact N-O 2.88Å; D55-E71 PolarHBondContact O-N 2.93Å
56	E	91.9	Very high	85.4	Confident	56 Å²	56	75.4 Å²	75.4	26%	0.262	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	113.7	170.7	-167.4	176.8	163.2	0	0	110	E43 I44 G45 F70	E43-E56 WeakPolarHBondContact CA-OE1 3.35Å; I44-E56 PolarHBondContact N-OE1 3.49Å; G45-E56 PolarHBondContact N-OE2 2.77Å; E56-F70 HydrophobicContact CB-CD1 4Å; E56-F70 HydrophobicContact CB-CE1 3.67Å; E56-F70 HydrophobicContact CB-CZ 4.35Å; E56-F70 HydrophobicContact CG-CD1 4.3Å; E56-F70 HydrophobicContact CG-CE1 3.8Å; E56-F70 HydrophobicContact CG-CZ 3.99Å
57	V	89.1	Confident	85.1	Confident	43 Å²	43	75.2 Å²	75.2	26%	0.261	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	158.3	-174.5	-60	0	0	0	0	112	D55 V59 R68 T69 E71	D55-V57 HydrophobicContact CB-CG1 4.18Å; V57-V59 HydrophobicContact CG2-CG2 4.09Å; V57-R68 WeakPolarHBondContact O-CA 3.33Å; V57-T69 WeakPolarHBondContact CG2-OG1 3.47Å; V57-T69 PolarHBondContact N-O 3.47Å; V57-T69 PolarHBondContact O-N 2.85Å; V57-T69 PolarHBondContact O-OG1 2.99Å; V57-E71 HydrophobicContact CG2-CB 4.16Å; V57-E71 VanDerWaalsContact CG2-CD 3.42Å; V57-E71 HydrophobicContact CG2-CG 3.52Å
58	S	87.1	Confident	84.8	Confident	52 Å²	52	76 Å²	76	36%	0.364	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	118.3	178.3	-61.4	0	0	0	0	110.8	I67 R68	S58-I67 CarbonylContact C-O 3.48Å; S58-I67 WeakPolarHBondContact CA-O 3.48Å; S58-R68 WeakPolarHBondContact OG-CD 3.46Å; S58-R68 PolarHBondContact OG-NE 3.42Å; S58-R68 PolarHBondContact OG-NH1 2.86Å
59	V	82.4	Confident	84.7	Confident	53 Å²	53	74.6 Å²	74.6	32%	0.321	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	150.7	-178	-178.4	0	0	0	0	110.1	V57 I67 T69	V57-V59 HydrophobicContact CG2-CG2 4.09Å; V59-I67 PolarHBondContact N-O 2.98Å; V59-I67 VanDerWaalsContact O-CG1 3.25Å; V59-I67 WeakPolarHBondContact O-CG1 3.11Å; V59-I67 PolarHBondContact O-N 3.36Å; V59-T69 HydrophobicContact CB-CG2 4.27Å; V59-T69 HydrophobicContact CG2-CG2 4.37Å; V59-T69 VanDerWaalsContact CG2-OG1 3.31Å; V59-T69 WeakPolarHBondContact CG2-OG1 3.35Å
60	L	79.8	Confident	84.8	Confident	115 Å²	115	71.5 Å²	71.5	60%	0.602	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.9	173.4	-77.3	159.2	0	0	0	110.1	K64 R65	L60-K64 HydrophobicContact CD2-CB 4.41Å; L60-K64 VanDerWaalsContact CD2-O 3.3Å; L60-K64 WeakPolarHBondContact CD2-O 3.32Å; L60-R65 WeakPolarHBondContact CA-O 3.33Å
61	D	72.4	Confident	84.9	Confident	33 Å²	33	72.4 Å²	72.4	18%	0.176	36%	0.364	C	S	.	.			trans	-69.9	173.8	172.2	81.7	-3.9	0	0	0	112.1	K63 K64 R65 I67	D61-K63 PolarHBondContact O-N 2.81Å; D61-K63 WeakPolarHBondContact OD1-CA 3.05Å; D61-K63 WeakPolarHBondContact OD1-CB 3.18Å; D61-K63 PolarHBondContact OD1-N 3.15Å; D61-K64 WeakPolarHBondContact O-CA 3.42Å; D61-K64 PolarHBondContact O-N 2.62Å; D61-K64 PolarHBondContact OD1-N 3.46Å; D61-R65 PolarHBondContact N-O 3.17Å; D61-R65 WeakPolarHBondContact OD1-CB 3.35Å; D61-R65 PolarHBondContact OD1-N 2.96Å; D61-R65 IonicContact OD1-NE 3.53Å; D61-R65 IonicContact OD2-CZ 2.68Å; D61-R65 VanDerWaalsContact OD2-CZ 3.26Å; D61-R65 IonicContact OD2-NE 3.5Å; D61-R65 PolarHBondContact OD2-NE 2.89Å; D61-R65 IonicContact OD2-NH2 3.46Å; D61-R65 PolarHBondContact OD2-NH2 2.92Å; D61-I67 HydrophobicContact CB-CD1 4.02Å; D61-I67 HydrophobicContact CB-CG1 4.27Å; D61-I67 HydrophobicContact CB-CG2 4.03Å
62	D	70.9	Confident	85.1	Confident	142 Å²	142	68.4 Å²	68.4	76%	0.759	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.5	178	-70.9	-41.6	0	0	0	113.9
63	K	74.6	Confident	85.3	Confident	160 Å²	160	65 Å²	65	70%	0.696	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	10.6	177.8	-57.1	-177.3	-178.4	178.4	0	112.3	D61 R65	D61-K63 PolarHBondContact O-N 2.81Å; D61-K63 WeakPolarHBondContact OD1-CA 3.05Å; D61-K63 WeakPolarHBondContact OD1-CB 3.18Å; D61-K63 PolarHBondContact OD1-N 3.15Å; K63-R65 HydrophobicContact CB-CG 4.33Å; K63-R65 PolarHBondContact O-N 3.36Å
64	K	74.8	Confident	85.3	Confident	178 Å²	178	67.6 Å²	67.6	77%	0.774	34%	0.337	S	S	*	.	S	Bend	trans	59.5	28.8	-177.2	-54.5	-178.1	179	-178.6	0	113.9	L60 D61	L60-K64 HydrophobicContact CD2-CB 4.41Å; L60-K64 VanDerWaalsContact CD2-O 3.3Å; L60-K64 WeakPolarHBondContact CD2-O 3.32Å; D61-K64 WeakPolarHBondContact O-CA 3.42Å; D61-K64 PolarHBondContact O-N 2.62Å; D61-K64 PolarHBondContact OD1-N 3.46Å
65	R	78.8	Confident	84.8	Confident	126 Å²	126	68.2 Å²	68.2	48%	0.475	34%	0.341	S	S	.	.			trans	-92.1	138.7	171.5	-57.7	180	-62.2	163.5	8.7	108.6	L60 D61 K63 I67	L60-R65 WeakPolarHBondContact CA-O 3.33Å; D61-R65 PolarHBondContact N-O 3.17Å; D61-R65 WeakPolarHBondContact OD1-CB 3.35Å; D61-R65 PolarHBondContact OD1-N 2.96Å; D61-R65 IonicContact OD1-NE 3.53Å; D61-R65 IonicContact OD2-CZ 2.68Å; D61-R65 VanDerWaalsContact OD2-CZ 3.26Å; D61-R65 IonicContact OD2-NE 3.5Å; D61-R65 PolarHBondContact OD2-NE 2.89Å; D61-R65 IonicContact OD2-NH2 3.46Å; D61-R65 PolarHBondContact OD2-NH2 2.92Å; K63-R65 HydrophobicContact CB-CG 4.33Å; K63-R65 PolarHBondContact O-N 3.36Å; R65-I67 PolarHBondContact O-N 2.85Å
66	L	83.2	Confident	84	Confident	89 Å²	89	67.9 Å²	67.9	47%	0.466	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	120.6	174	-163.8	72.6	0	0	0	108.3	T41	T41-L66 WeakPolarHBondContact CG2-O 3.31Å
67	I	86.2	Confident	83.4	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.072	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.7	176.6	60.9	164.4	0	0	0	109.6	E40 S58 V59 D61 R65 T69 V199	E40-I67 CarbonylContact O-C 3.59Å; E40-I67 WeakPolarHBondContact O-CA 3.29Å; S58-I67 CarbonylContact C-O 3.48Å; S58-I67 WeakPolarHBondContact CA-O 3.48Å; V59-I67 PolarHBondContact N-O 2.98Å; V59-I67 VanDerWaalsContact O-CG1 3.25Å; V59-I67 WeakPolarHBondContact O-CG1 3.11Å; V59-I67 PolarHBondContact O-N 3.36Å; D61-I67 HydrophobicContact CB-CD1 4.02Å; D61-I67 HydrophobicContact CB-CG1 4.27Å; D61-I67 HydrophobicContact CB-CG2 4.03Å; R65-I67 PolarHBondContact O-N 2.85Å; I67-T69 HydrophobicContact CD1-CG2 3.92Å; I67-T69 HydrophobicContact CG1-CG2 4.1Å; I67-V199 HydrophobicContact CD1-CG1 3.76Å
68	R	89.1	Confident	82.8	Confident	55 Å²	55	74.3 Å²	74.3	21%	0.208	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	132.5	172.5	-66	-56.5	-173.3	145	7.3	111.1	E40 T41 S42 I44 V57 S58	E40-R68 PolarHBondContact O-N 3.18Å; T41-R68 PolarHBondContact O-NE 3.32Å; S42-R68 VanDerWaalsContact O-CG 3.22Å; S42-R68 WeakPolarHBondContact O-CG 3.31Å; I44-R68 HydrophobicContact CD1-CB 3.78Å; I44-R68 HydrophobicContact CG1-CB 4Å; V57-R68 WeakPolarHBondContact O-CA 3.33Å; S58-R68 WeakPolarHBondContact OG-CD 3.46Å; S58-R68 PolarHBondContact OG-NE 3.42Å; S58-R68 PolarHBondContact OG-NH1 2.86Å
69	T	90.2	Very high	82.5	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	158.8	-178.6	62.7	0	0	0	0	110	V57 V59 I67 L198 V199	V57-T69 WeakPolarHBondContact CG2-OG1 3.47Å; V57-T69 PolarHBondContact N-O 3.47Å; V57-T69 PolarHBondContact O-N 2.85Å; V57-T69 PolarHBondContact O-OG1 2.99Å; V59-T69 HydrophobicContact CB-CG2 4.27Å; V59-T69 HydrophobicContact CG2-CG2 4.37Å; V59-T69 VanDerWaalsContact CG2-OG1 3.31Å; V59-T69 WeakPolarHBondContact CG2-OG1 3.35Å; I67-T69 HydrophobicContact CD1-CG2 3.92Å; I67-T69 HydrophobicContact CG1-CG2 4.1Å; T69-L198 WeakPolarHBondContact CB-O 3.41Å; T69-V199 HydrophobicContact CG2-CB 4.29Å; T69-V199 HydrophobicContact CG2-CG1 4.11Å; T69-V199 HydrophobicContact CG2-CG2 4.35Å
70	F	94.1	Very high	82.8	Confident	9 Å²	9	74.2 Å²	74.2	4%	0.039	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.4	175.2	-68.7	-85.4	0	0	0	110.6	I44 W46 W54 D55 E56 L84 S197 L198	I44-F70 HydrophobicContact CB-CE2 4.08Å; I44-F70 HydrophobicContact CB-CZ 4.02Å; I44-F70 HydrophobicContact CD1-CE2 3.85Å; I44-F70 HydrophobicContact CG2-CE2 4.04Å; I44-F70 HydrophobicContact CG2-CZ 4.19Å; W46-F70 HydrophobicContact CB-CE1 4.1Å; W46-F70 HydrophobicContact CB-CE2 4.34Å; W46-F70 HydrophobicContact CB-CZ 3.66Å; W46-F70 AromaticContact CD2-CE2 3.92Å; W46-F70 HydrophobicContact CD2-CE2 3.92Å; W46-F70 HydrophobicContact CD2-CZ 4.14Å; W46-F70 HydrophobicContact CE3-CD2 4.04Å; W46-F70 AromaticContact CE3-CE2 3.64Å; W46-F70 HydrophobicContact CE3-CE2 3.64Å; W46-F70 HydrophobicContact CE3-CZ 4.12Å; W46-F70 HydrophobicContact CG-CE2 4.27Å; W46-F70 AromaticContact CG-CZ 4Å; W46-F70 HydrophobicContact CG-CZ 4Å; W46-F70 HydrophobicContact CZ3-CD2 4.31Å; W46-F70 HydrophobicContact CZ3-CE2 4.17Å; W54-F70 HydrophobicContact CE3-CB 3.91Å; W54-F70 HydrophobicContact CZ3-CB 4.29Å; D55-F70 CarbonylContact O-C 3.57Å; D55-F70 WeakPolarHBondContact O-CA 3.27Å; E56-F70 HydrophobicContact CB-CD1 4Å; E56-F70 HydrophobicContact CB-CE1 3.67Å; E56-F70 HydrophobicContact CB-CZ 4.35Å; E56-F70 HydrophobicContact CG-CD1 4.3Å; E56-F70 HydrophobicContact CG-CE1 3.8Å; E56-F70 HydrophobicContact CG-CZ 3.99Å; F70-L84 HydrophobicContact CB-CD2 3.64Å; F70-L84 HydrophobicContact CD1-CD1 3.7Å; F70-L84 HydrophobicContact CD1-CD2 3.82Å; F70-L84 HydrophobicContact CD1-CG 4.42Å; F70-L84 HydrophobicContact CD2-CD2 3.95Å; F70-L84 HydrophobicContact CE1-CD1 3.75Å; F70-L84 HydrophobicContact CE1-CD2 4.47Å; F70-L84 HydrophobicContact CG-CD1 4.27Å; F70-L84 HydrophobicContact CG-CD2 3.52Å; F70-L84 HydrophobicContact CZ-CD1 4.37Å; F70-S197 CarbonylContact O-C 3.57Å; F70-S197 WeakPolarHBondContact O-CA 3.38Å; F70-L198 HydrophobicContact CB-CB 4.35Å; F70-L198 PolarHBondContact N-O 2.95Å; F70-L198 PolarHBondContact O-N 2.74Å
71	E	93	Very high	83.3	Confident	74 Å²	74	72 Å²	72	35%	0.346	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.8	-176.5	-65.3	-168.2	167.9	0	0	112.1	D55 V57 S197	D55-E71 PolarHBondContact N-O 2.88Å; D55-E71 PolarHBondContact O-N 2.93Å; V57-E71 HydrophobicContact CG2-CB 4.16Å; V57-E71 VanDerWaalsContact CG2-CD 3.42Å; V57-E71 HydrophobicContact CG2-CG 3.52Å; E71-S197 WeakPolarHBondContact CG-OG 3.09Å; E71-S197 WeakPolarHBondContact OE1-CB 3.34Å; E71-S197 PolarHBondContact OE1-OG 3.5Å
72	V	92.7	Very high	84.3	Confident	6 Å²	6	70.6 Å²	70.6	4%	0.036	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	137.6	174.1	60.5	0	0	0	0	109.5	G53 W54 N82 D191 C195 M196	G53-V72 WeakPolarHBondContact O-CG2 3.48Å; W54-V72 HydrophobicContact CD2-CB 3.95Å; W54-V72 HydrophobicContact CD2-CG1 3.97Å; W54-V72 HydrophobicContact CE3-CB 3.91Å; W54-V72 HydrophobicContact CE3-CG1 3.8Å; W54-V72 HydrophobicContact CG-CB 4.48Å; W54-V72 HydrophobicContact CH2-CG1 3.53Å; W54-V72 HydrophobicContact CZ2-CG1 3.68Å; W54-V72 HydrophobicContact CZ3-CB 4.21Å; W54-V72 HydrophobicContact CZ3-CG1 3.58Å; V72-N82 HydrophobicContact CG2-CB 4.44Å; V72-D191 HydrophobicContact CG1-CB 4.01Å; V72-D191 HydrophobicContact CG2-CB 4.37Å; V72-D191 WeakPolarHBondContact CG2-OD2 3.37Å; V72-C195 CarbonylContact O-C 3.38Å; V72-C195 WeakPolarHBondContact O-CA 3.45Å; V72-M196 HydrophobicContact CG1-CG 3.58Å; V72-M196 HydrophobicContact CG1-SD 4.5Å; V72-M196 PolarHBondContact N-O 2.94Å; V72-M196 PolarHBondContact O-N 2.86Å
73	C	88.9	Confident	85.5	Confident	61 Å²	61	63.9 Å²	63.9	41%	0.412	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	48.4	179	-163.5	0	0	0	0	113.1	V75 C195	C73-V75 VanDerWaalsContact C-N 3.26Å; C73-V75 PolarHBondContact O-N 2.98Å; C73-V75 VanDerWaalsContact O-N 3.11Å; C73-C195 HydrophobicContact CB-CB 3.96Å; C73-C195 WeakPolarHBondContact CB-SG 3.31Å; C73-C195 WeakPolarHBondContact SG-CB 3.47Å; C73-C195 CovalentContact SG-SG 2.05Å; C73-C195 PolarHBondContact SG-SG 3.29Å
74	N	85.5	Confident	86.5	Confident	57 Å²	57	56.3 Å²	56.3	31%	0.305	31%	0.312	S	S	.	.			trans	-89.5	48.4	-176.9	-64.4	-16.5	0	0	0	112.8	A76 Q80	N74-A76 PolarHBondContact O-N 3.45Å; N74-Q80 HydrophobicContact CB-CG 4.22Å; N74-Q80 WeakPolarHBondContact O-CG 3.36Å
75	V	83.4	Confident	87.5	Confident	18 Å²	18	48.3 Å²	48.3	11%	0.109	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-18.6	-169.7	-63.9	0	0	0	0	115.1	C73 M111 A115 S117 C195	C73-V75 VanDerWaalsContact C-N 3.26Å; C73-V75 PolarHBondContact O-N 2.98Å; C73-V75 VanDerWaalsContact O-N 3.11Å; V75-M111 HydrophobicContact CB-CE 3.62Å; V75-M111 HydrophobicContact CG1-CE 3.85Å; V75-M111 HydrophobicContact CG2-CE 3.4Å; V75-M111 VanDerWaalsContact CG2-CE 3.4Å; V75-M111 HydrophobicContact CG2-SD 3.93Å; V75-A115 WeakPolarHBondContact O-CB 3.43Å; V75-S117 PolarHBondContact O-OG 2.76Å; V75-C195 HydrophobicContact CG1-CB 3.79Å
76	A	76.8	Confident	88.3	Confident	83 Å²	83	42.3 Å²	42.3	69%	0.686	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-20.6	-173.5	0	0	0	0	0	113.7	N74	N74-A76 PolarHBondContact O-N 3.45Å
77	E	78.1	Confident	88.8	Confident	124 Å²	124	42.4 Å²	42.4	58%	0.579	25%	0.252	S	S	*	.	S	Bend	trans	-104.2	133.9	-173.7	-70	-179.7	-178.5	0	0	110.9	Q80	E77-Q80 PolarHBondContact OE2-NE2 2.88Å
78	P	77.1	Confident	89.2	Confident	111 Å²	111	43.1 Å²	43.1	72%	0.721	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	148.2	174.2	31	-33.4	0	0	0	111.4
79	G	80.7	Confident	89.6	Confident	78 Å²	78	40.7 Å²	40.7	80%	0.804	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	81	25.1	172.2	0	0	0	0	0	115.8
80	Q	87.9	Confident	89.8	Confident	25 Å²	25	44.2 Å²	44.2	12%	0.117	26%	0.262	C	S	.	.			trans	-58.2	144.7	176	-68.1	-64.7	-55.9	0	0	112.8	N74 E77 N82 S192	N74-Q80 HydrophobicContact CB-CG 4.22Å; N74-Q80 WeakPolarHBondContact O-CG 3.36Å; E77-Q80 PolarHBondContact OE2-NE2 2.88Å; Q80-N82 PolarHBondContact OE1-ND2 3.49Å; Q80-S192 WeakPolarHBondContact O-CA 3.47Å
81	N	91.3	Very high	89.7	Confident	68 Å²	68	45.6 Å²	45.6	36%	0.364	27%	0.267	S	S	.	.			trans	-152	68.1	179.1	-174	38.3	0	0	0	110.1	W83 Q190 D191	N81-W83 VanDerWaalsContact CG-NE1 3.29Å; N81-W83 PolarHBondContact ND2-NE1 3.44Å; N81-W83 PolarHBondContact OD1-NE1 3.28Å; N81-Q190 PolarHBondContact OD1-NE2 2.91Å; N81-D191 WeakPolarHBondContact CA-O 3.39Å
82	N	94.1	Very high	89.5	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.4	-173.3	-54.9	-52.2	0	0	0	110.2	W54 V72 Q80 Q190 D191	W54-N82 PolarHBondContact NE1-O 3.49Å; V72-N82 HydrophobicContact CG2-CB 4.44Å; Q80-N82 PolarHBondContact OE1-ND2 3.49Å; N82-Q190 CarbonylContact O-C 3.56Å; N82-Q190 WeakPolarHBondContact O-CA 3.49Å; N82-D191 HydrophobicContact CB-CB 4.18Å; N82-D191 PolarHBondContact N-O 3Å; N82-D191 PolarHBondContact ND2-OD2 2.93Å; N82-D191 PolarHBondContact O-N 2.86Å
83	W	95.4	Very high	89	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.5	-178.7	-65.8	72.9	0	0	0	111.4	S48 H49 N81 Y125 W141 E143 W146 A188 F189 Q190	S48-W83 CarbonylContact C-O 3.59Å; S48-W83 VanDerWaalsContact CA-O 3.31Å; S48-W83 WeakPolarHBondContact CA-O 3.32Å; H49-W83 HydrophobicContact CB-CB 4.47Å; H49-W83 PolarHBondContact N-O 2.93Å; H49-W83 PolarHBondContact O-N 3.45Å; N81-W83 VanDerWaalsContact CG-NE1 3.29Å; N81-W83 PolarHBondContact ND2-NE1 3.44Å; N81-W83 PolarHBondContact OD1-NE1 3.28Å; W83-Y125 HydrophobicContact CH2-CD1 4.48Å; W83-Y125 HydrophobicContact CH2-CD2 4.05Å; W83-Y125 HydrophobicContact CH2-CE1 4.41Å; W83-Y125 AromaticContact CH2-CE2 3.97Å; W83-Y125 HydrophobicContact CH2-CE2 3.97Å; W83-Y125 HydrophobicContact CH2-CG 4.33Å; W83-Y125 AromaticContact CZ3-CD2 3.86Å; W83-Y125 HydrophobicContact CZ3-CD2 3.86Å; W83-Y125 HydrophobicContact CZ3-CE2 4.24Å; W83-Y125 HydrophobicContact CZ3-CG 4.06Å; W83-W141 HydrophobicContact CB-CD2 4.41Å; W83-W141 HydrophobicContact CB-CE3 3.37Å; W83-W141 HydrophobicContact CB-CZ3 3.58Å; W83-W141 HydrophobicContact CD2-CE3 4.3Å; W83-W141 HydrophobicContact CE3-CE3 4.47Å; W83-W141 AromaticContact CG-CE3 3.86Å; W83-W141 HydrophobicContact CG-CE3 3.86Å; W83-W141 HydrophobicContact CG-CZ3 4.47Å; W83-E143 HydrophobicContact CH2-CG 4.44Å; W83-E143 HydrophobicContact CZ2-CG 4.36Å; W83-W146 HydrophobicContact CH2-CG 4.33Å; W83-W146 HydrophobicContact CZ3-CB 4.32Å; W83-W146 AromaticContact CZ3-CD1 3.83Å; W83-W146 HydrophobicContact CZ3-CD2 4.21Å; W83-W146 AromaticContact CZ3-CG 3.85Å; W83-W146 HydrophobicContact CZ3-CG 3.85Å; W83-A188 HydrophobicContact CE3-CB 4.03Å; W83-A188 HydrophobicContact CZ3-CB 4.29Å; W83-F189 CarbonylContact C-O 3.56Å; W83-F189 WeakPolarHBondContact CA-O 3.47Å; W83-Q190 HydrophobicContact CD2-CB 4.2Å; W83-Q190 HydrophobicContact CD2-CG 4.14Å; W83-Q190 HydrophobicContact CE3-CB 4.31Å; W83-Q190 HydrophobicContact CH2-CB 4.4Å; W83-Q190 HydrophobicContact CH2-CG 4.43Å; W83-Q190 HydrophobicContact CZ2-CB 4.3Å; W83-Q190 HydrophobicContact CZ2-CG 3.86Å; W83-Q190 VanDerWaalsContact CZ2-NE2 3.31Å; W83-Q190 HydrophobicContact CZ3-CB 4.41Å
84	L	96	Very high	89	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.4	171.5	174.1	68.2	0	0	0	108.7	W46 T47 W54 F70 A188 F189 L198	W46-L84 HydrophobicContact CB-CD1 3.75Å; W46-L84 HydrophobicContact CE3-CD1 4.28Å; W46-L84 HydrophobicContact CE3-CD2 3.86Å; W46-L84 HydrophobicContact CE3-CG 3.92Å; W46-L84 HydrophobicContact CZ3-CD2 4.27Å; T47-L84 CarbonylContact O-C 3.44Å; T47-L84 WeakPolarHBondContact O-CA 3.49Å; W54-L84 HydrophobicContact CB-CB 4.22Å; W54-L84 HydrophobicContact CB-CD1 4.29Å; W54-L84 HydrophobicContact CD2-CB 4.03Å; W54-L84 HydrophobicContact CD2-CD2 4.14Å; W54-L84 HydrophobicContact CE3-CD2 4.13Å; W54-L84 HydrophobicContact CG-CB 3.74Å; W54-L84 HydrophobicContact CG-CD2 4.4Å; W54-L84 HydrophobicContact CG-CG 4.49Å; F70-L84 HydrophobicContact CB-CD2 3.64Å; F70-L84 HydrophobicContact CD1-CD1 3.7Å; F70-L84 HydrophobicContact CD1-CD2 3.82Å; F70-L84 HydrophobicContact CD1-CG 4.42Å; F70-L84 HydrophobicContact CD2-CD2 3.95Å; F70-L84 HydrophobicContact CE1-CD1 3.75Å; F70-L84 HydrophobicContact CE1-CD2 4.47Å; F70-L84 HydrophobicContact CG-CD1 4.27Å; F70-L84 HydrophobicContact CG-CD2 3.52Å; F70-L84 HydrophobicContact CZ-CD1 4.37Å; L84-A188 CarbonylContact O-C 3.47Å; L84-A188 WeakPolarHBondContact O-CA 3.5Å; L84-F189 HydrophobicContact CB-CB 4.3Å; L84-F189 HydrophobicContact CB-CD2 4.47Å; L84-F189 HydrophobicContact CD2-CD2 4.23Å; L84-F189 HydrophobicContact CG-CD2 4.34Å; L84-F189 PolarHBondContact N-O 3.47Å; L84-F189 PolarHBondContact O-N 3Å; L84-L198 HydrophobicContact CD2-CD2 4.23Å
85	R	95.4	Very high	89.1	Confident	10 Å²	10	46.7 Å²	46.7	4%	0.038	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.2	-176.4	-173.7	-161.5	64.1	-155.1	-9	112.3	W46 T47 A134 S135 L138 W141 W146 L187	W46-R85 WeakPolarHBondContact CA-O 3.33Å; W46-R85 WeakPolarHBondContact CB-O 3.47Å; T47-R85 PolarHBondContact N-O 2.87Å; T47-R85 PolarHBondContact O-N 3.04Å; T47-R85 PolarHBondContact OG1-NH2 3.13Å; R85-A134 VanDerWaalsContact CZ-CB 3.45Å; R85-S135 PolarHBondContact NH1-O 2.67Å; R85-S135 PolarHBondContact NH2-O 2.93Å; R85-S135 VanDerWaalsContact NH2-O 3.09Å; R85-L138 PolarHBondContact NH1-O 2.78Å; R85-W141 HydrophobicContact CB-CH2 3.59Å; R85-W141 HydrophobicContact CB-CZ3 3.8Å; R85-W146 HydrophobicContact CG-CH2 3.63Å; R85-W146 HydrophobicContact CG-CZ2 4.35Å; R85-W146 HydrophobicContact CG-CZ3 4.46Å; R85-L187 WeakPolarHBondContact CA-O 3.26Å
86	T	95.6	Very high	89.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-69.1	170.1	173	69.9	0	0	0	0	112.9	L35 W46 L187 F189	L35-T86 HydrophobicContact CD2-CG2 4.4Å; W46-T86 HydrophobicContact CD2-CG2 3.9Å; W46-T86 HydrophobicContact CE3-CG2 4.06Å; W46-T86 HydrophobicContact CH2-CG2 3.69Å; W46-T86 HydrophobicContact CZ2-CG2 3.54Å; W46-T86 HydrophobicContact CZ3-CG2 3.95Å; T86-L187 HydrophobicContact CG2-CB 3.74Å; T86-L187 PolarHBondContact N-O 3.01Å; T86-L187 PolarHBondContact OG1-N 2.9Å; T86-F189 HydrophobicContact CG2-CE2 4.16Å
87	H	94.1	Very high	90.2	Very high	91 Å²	91	44.1 Å²	44.1	42%	0.421	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-68.4	172	160.9	57.8	-96.8	0	0	0	111.1	L35 W46 I89	L35-H87 WeakPolarHBondContact CD1-CE1 3.44Å; W46-H87 AromaticContact NE1-ND1 3.65Å; H87-I89 PolarHBondContact O-N 2.98Å
88	F	95.1	Very high	91	Very high	29 Å²	29	39.1 Å²	39.1	13%	0.127	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-66.7	122.4	176.3	-177.1	-108.8	0	0	0	111.3	E90 A129 D132 G184 Y186	F88-E90 HydrophobicContact CD1-CG 4.49Å; F88-E90 HydrophobicContact CE1-CG 4.14Å; F88-A129 HydrophobicContact CE2-CB 4.02Å; F88-A129 WeakPolarHBondContact CE2-O 3.4Å; F88-D132 HydrophobicContact CB-CB 3.89Å; F88-D132 HydrophobicContact CD1-CB 4.28Å; F88-D132 HydrophobicContact CG-CB 4.08Å; F88-G184 VanDerWaalsContact CZ-CA 3.42Å; F88-Y186 HydrophobicContact CB-CD1 4.29Å; F88-Y186 HydrophobicContact CB-CE1 3.56Å; F88-Y186 AromaticContact CD2-CE1 3.93Å; F88-Y186 HydrophobicContact CD2-CE1 3.93Å; F88-Y186 AromaticContact CD2-CE2 3.84Å; F88-Y186 HydrophobicContact CD2-CE2 3.84Å; F88-Y186 AromaticContact CD2-CZ 3.5Å; F88-Y186 WeakPolarHBondContact CD2-OH 3.25Å; F88-Y186 HydrophobicContact CE2-CE2 4.48Å; F88-Y186 HydrophobicContact CG-CE1 4.25Å
89	I	96.4	Very high	91.9	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.4	-179.7	-54.4	171.2	0	0	0	108.2	L34 L35 H87 R91 G184 F185 L187 V203	L34-I89 HydrophobicContact CB-CG2 3.77Å; L34-I89 HydrophobicContact CD1-CG2 4.47Å; L35-I89 HydrophobicContact CB-CD1 4.23Å; L35-I89 HydrophobicContact CD2-CD1 3.56Å; L35-I89 HydrophobicContact CD2-CG1 4.16Å; H87-I89 PolarHBondContact O-N 2.98Å; I89-R91 PolarHBondContact O-N 3.01Å; I89-G184 CarbonylContact O-C 3.47Å; I89-G184 WeakPolarHBondContact O-CA 3.44Å; I89-F185 HydrophobicContact CB-CD2 4.42Å; I89-F185 HydrophobicContact CB-CE1 4.34Å; I89-F185 HydrophobicContact CB-CE2 4.03Å; I89-F185 HydrophobicContact CB-CZ 3.97Å; I89-F185 WeakPolarHBondContact CB-O 3.38Å; I89-F185 HydrophobicContact CD1-CD2 4.39Å; I89-F185 HydrophobicContact CD1-CE2 3.77Å; I89-F185 HydrophobicContact CD1-CZ 4.33Å; I89-F185 HydrophobicContact CG1-CE2 4.46Å; I89-F185 HydrophobicContact CG2-CE1 4.11Å; I89-F185 HydrophobicContact CG2-CE2 4.17Å; I89-F185 HydrophobicContact CG2-CZ 3.68Å; I89-F185 PolarHBondContact N-O 2.9Å; I89-F185 PolarHBondContact O-N 3.02Å; I89-L187 HydrophobicContact CD1-CD1 4.29Å; I89-L187 HydrophobicContact CD1-CG 4.23Å; I89-V203 HydrophobicContact CD1-CG2 4.21Å
90	E	95.2	Very high	92.6	Very high	75 Å²	75	32.5 Å²	32.5	35%	0.35	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	132.9	173.2	-70.2	-157.9	142.5	0	0	110.3	F88 H92 R183	F88-E90 HydrophobicContact CD1-CG 4.49Å; F88-E90 HydrophobicContact CE1-CG 4.14Å; E90-H92 IonicContact OE2-CE1 3.25Å; E90-H92 PolarHBondContact OE2-CE1 2.84Å; E90-R183 IonicContact OE1-CZ 2.75Å; E90-R183 IonicContact OE1-NE 3.88Å; E90-R183 PolarHBondContact OE1-NE 3.13Å; E90-R183 IonicContact OE1-NH2 3.16Å; E90-R183 PolarHBondContact OE1-NH2 3.45Å
91	R	91.4	Very high	93	Very high	37 Å²	37	31.3 Å²	31.3	14%	0.14	15%	0.147	C	C	.	.			trans	-76.3	-26.9	-177.5	-180	176	75.4	81.7	-7.4	113.1	I89 G93 A94 L180 Q182 R183	I89-R91 PolarHBondContact O-N 3.01Å; R91-G93 PolarHBondContact O-N 2.79Å; R91-A94 WeakPolarHBondContact CD-O 3.41Å; R91-A94 HydrophobicContact CG-CB 4.09Å; R91-A94 WeakPolarHBondContact CG-O 3.5Å; R91-A94 PolarHBondContact NH1-O 2.79Å; R91-A94 WeakPolarHBondContact O-CB 3.46Å; R91-A94 PolarHBondContact O-N 2.82Å; R91-L180 HydrophobicContact CG-CB 4.26Å; R91-L180 HydrophobicContact CG-CD1 4.05Å; R91-Q182 WeakPolarHBondContact CD-O 3.48Å; R91-Q182 PolarHBondContact NE-O 3.47Å; R91-R183 VanDerWaalsContact CB-O 3.29Å; R91-R183 WeakPolarHBondContact CB-O 3.2Å; R91-R183 PolarHBondContact N-O 3.37Å
92	H	88.9	Confident	93	Very high	116 Å²	116	32.9 Å²	32.9	54%	0.537	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	-127.5	-166.4	-58.9	-61.9	0	0	0	111.3	E90	E90-H92 IonicContact OE2-CE1 3.25Å; E90-H92 PolarHBondContact OE2-CE1 2.84Å
93	G	82.4	Confident	92.9	Very high	19 Å²	19	32.7 Å²	32.7	20%	0.196	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	1.1	178.3	0	0	0	0	0	115	R91 H95	R91-G93 PolarHBondContact O-N 2.79Å; G93-H95 PolarHBondContact O-N 2.77Å
94	A	87.6	Confident	92.5	Very high	1 Å²	1	33 Å²	33	1%	0.008	15%	0.149	C	C	.	.			trans	-72.5	116.7	-171.1	0	0	0	0	0	111.9	L34 R91 V97 F205	L34-A94 HydrophobicContact CD1-CB 4.43Å; R91-A94 WeakPolarHBondContact CD-O 3.41Å; R91-A94 HydrophobicContact CG-CB 4.09Å; R91-A94 WeakPolarHBondContact CG-O 3.5Å; R91-A94 PolarHBondContact NH1-O 2.79Å; R91-A94 WeakPolarHBondContact O-CB 3.46Å; R91-A94 PolarHBondContact O-N 2.82Å; A94-V97 HydrophobicContact CB-CG2 3.86Å; A94-F205 HydrophobicContact CB-CB 3.64Å; A94-F205 HydrophobicContact CB-CD1 3.6Å; A94-F205 HydrophobicContact CB-CD2 3.85Å; A94-F205 HydrophobicContact CB-CE1 4.17Å; A94-F205 HydrophobicContact CB-CE2 4.4Å; A94-F205 HydrophobicContact CB-CG 3.41Å; A94-F205 VanDerWaalsContact CB-CG 3.41Å
95	H	88.3	Confident	92.2	Very high	85 Å²	85	33.1 Å²	33.1	39%	0.394	15%	0.15	S	C	.	.	S	Bend	trans	-84.5	-25.6	171.3	-70.2	-75.2	0	0	0	112.5	G93 P179 L180 G225	G93-H95 PolarHBondContact O-N 2.77Å; H95-P179 CarbonylContact O-C 3.6Å; H95-P179 VanDerWaalsContact O-CA 3.28Å; H95-P179 WeakPolarHBondContact O-CA 3.29Å; H95-L180 PolarHBondContact O-N 3.49Å; H95-G225 VanDerWaalsContact CB-CA 3.47Å
96	R	90.4	Very high	91.7	Very high	48 Å²	48	37.2 Å²	37.2	18%	0.181	17%	0.165	C	C	.	.	S	Bend	trans	-133.6	140.5	175	-168	-179.6	-154.1	107.2	6.9	108.5	S176 F177 F205 G225	R96-S176 PolarHBondContact NE-OG 2.9Å; R96-F177 WeakPolarHBondContact CG-O 3.25Å; R96-F205 VanDerWaalsContact O-CB 3.28Å; R96-F205 WeakPolarHBondContact O-CB 3.4Å; R96-G225 PolarHBondContact NH1-O 2.04Å
97	V	93.2	Very high	91.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145	-179.6	171.6	0	0	0	0	109.6	L34 A94 S176 F177 L180 F185 V203	L34-V97 HydrophobicContact CD1-CG1 4.26Å; L34-V97 HydrophobicContact CD1-CG2 3.72Å; A94-V97 HydrophobicContact CB-CG2 3.86Å; V97-S176 CarbonylContact O-C 3.56Å; V97-S176 WeakPolarHBondContact O-CA 3.5Å; V97-S176 WeakPolarHBondContact O-CB 3.37Å; V97-F177 HydrophobicContact CB-CE2 4.36Å; V97-F177 HydrophobicContact CB-CZ 4.13Å; V97-F177 HydrophobicContact CG1-CE1 4.4Å; V97-F177 HydrophobicContact CG1-CZ 4.11Å; V97-F177 PolarHBondContact N-O 2.85Å; V97-F177 PolarHBondContact O-N 3.17Å; V97-L180 HydrophobicContact CB-CD1 4.1Å; V97-L180 HydrophobicContact CG2-CD1 3.45Å; V97-L180 VanDerWaalsContact CG2-CD1 3.45Å; V97-F185 HydrophobicContact CB-CZ 4.31Å; V97-F185 HydrophobicContact CG1-CE2 4.43Å; V97-F185 HydrophobicContact CG1-CZ 3.85Å; V97-F185 HydrophobicContact CG2-CE1 3.98Å; V97-F185 HydrophobicContact CG2-CZ 4.03Å; V97-V203 HydrophobicContact CG1-CG1 3.16Å
98	H	93.8	Very high	90.5	Very high	19 Å²	19	35.4 Å²	35.4	9%	0.088	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.1	178.3	-62.9	-105.6	0	0	0	109.2	V174 R175 V203 F204 Y206	H98-V174 HydrophobicContact CB-CG1 4.39Å; H98-R175 CarbonylContact C-O 3.56Å; H98-R175 VanDerWaalsContact CA-O 3.27Å; H98-R175 WeakPolarHBondContact CA-O 3.38Å; H98-V203 CarbonylContact O-C 3.56Å; H98-V203 VanDerWaalsContact O-CA 3.3Å; H98-V203 WeakPolarHBondContact O-CA 3.46Å; H98-F204 HydrophobicContact CB-CD1 4.12Å; H98-F204 HydrophobicContact CB-CD2 4.14Å; H98-F204 HydrophobicContact CB-CE1 3.7Å; H98-F204 HydrophobicContact CB-CE2 3.73Å; H98-F204 HydrophobicContact CB-CG 4.32Å; H98-F204 HydrophobicContact CB-CZ 3.49Å; H98-F204 VanDerWaalsContact CB-CZ 3.49Å; H98-F204 PolarHBondContact N-O 3.15Å; H98-F204 PolarHBondContact O-N 2.79Å; H98-Y206 AromaticContact CD2-CD2 3.84Å; H98-Y206 AromaticContact CD2-CE2 3.93Å; H98-Y206 AromaticContact CE1-CD2 3.83Å; H98-Y206 AromaticContact CE1-CE2 3.53Å; H98-Y206 AromaticContact ND1-CE2 3.79Å; H98-Y206 AromaticContact NE2-CD2 3.48Å; H98-Y206 WeakPolarHBondContact NE2-CD2 3.47Å; H98-Y206 AromaticContact NE2-CE2 3.65Å
99	V	96.3	Very high	89.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	114.9	178.5	-173.3	0	0	0	0	108.1	L101 L124 V174 R175 F177 L187 V201 Q202 V203	V99-L101 HydrophobicContact CG1-CD2 3.56Å; V99-L101 HydrophobicContact CG1-CG 4.07Å; V99-L124 HydrophobicContact CB-CD2 4.34Å; V99-L124 HydrophobicContact CG1-CD2 4.44Å; V99-V174 CarbonylContact O-C 3.54Å; V99-V174 VanDerWaalsContact O-CA 3.29Å; V99-V174 WeakPolarHBondContact O-CA 3.48Å; V99-R175 PolarHBondContact N-O 2.88Å; V99-R175 PolarHBondContact O-N 2.84Å; V99-F177 HydrophobicContact CG2-CD1 4.34Å; V99-F177 HydrophobicContact CG2-CE1 3.57Å; V99-F177 HydrophobicContact CG2-CZ 4.48Å; V99-L187 HydrophobicContact CG1-CD1 4.03Å; V99-L187 HydrophobicContact CG2-CD1 3.79Å; V99-L187 HydrophobicContact CG2-CD2 4.22Å; V99-V201 HydrophobicContact CG1-CG1 3.92Å; V99-Q202 CarbonylContact C-O 3.54Å; V99-Q202 WeakPolarHBondContact CA-O 3.43Å; V99-V203 HydrophobicContact CG1-CG2 4.48Å; V99-V203 HydrophobicContact CG2-CG1 4.47Å; V99-V203 HydrophobicContact CG2-CG2 4.41Å
100	R	96.4	Very high	88.5	Confident	49 Å²	49	38.4 Å²	38.4	19%	0.185	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112.3	175.5	177.3	-177	-64	141.3	-2.3	108.3	E31 V172 K173 V174 Q202 F204	E31-R100 VanDerWaalsContact CD-NH2 3.27Å; E31-R100 IonicContact OE1-CZ 2.64Å; E31-R100 IonicContact OE1-NH2 3.64Å; E31-R100 PolarHBondContact OE1-NH2 2.74Å; E31-R100 IonicContact OE2-CZ 3.71Å; E31-R100 IonicContact OE2-NH1 3.55Å; E31-R100 PolarHBondContact OE2-NH1 3.32Å; E31-R100 IonicContact OE2-NH2 3.63Å; E31-R100 PolarHBondContact OE2-NH2 2.89Å; R100-V172 HydrophobicContact CG-CG1 4.36Å; R100-K173 WeakPolarHBondContact CA-O 3.32Å; R100-V174 HydrophobicContact CB-CG2 4.09Å; R100-V174 HydrophobicContact CG-CG2 4.1Å; R100-Q202 HydrophobicContact CB-CB 4.3Å; R100-Q202 PolarHBondContact N-O 2.89Å; R100-Q202 PolarHBondContact O-N 3.14Å; R100-F204 HydrophobicContact CB-CE1 3.99Å; R100-F204 VanDerWaalsContact NH2-CZ 3.29Å
101	L	95	Very high	87.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.7	-178.1	-56.5	176.1	0	0	0	109.6	V99 F103 F122 L124 I152 V172 K173 F189 L198 V201	V99-L101 HydrophobicContact CG1-CD2 3.56Å; V99-L101 HydrophobicContact CG1-CG 4.07Å; L101-F103 HydrophobicContact CB-CD1 4.15Å; L101-F122 HydrophobicContact CD1-CE2 4.07Å; L101-F122 HydrophobicContact CD1-CZ 3.97Å; L101-L124 HydrophobicContact CD1-CD2 4.48Å; L101-I152 HydrophobicContact CD1-CD1 4.35Å; L101-I152 HydrophobicContact CD1-CG1 4.09Å; L101-V172 CarbonylContact O-C 3.52Å; L101-V172 VanDerWaalsContact O-CA 3.27Å; L101-V172 WeakPolarHBondContact O-CA 3.48Å; L101-K173 PolarHBondContact N-O 2.94Å; L101-K173 PolarHBondContact O-N 3.01Å; L101-F189 HydrophobicContact CD1-CE1 4.46Å; L101-F189 HydrophobicContact CD2-CE1 3.64Å; L101-F189 HydrophobicContact CD2-CZ 4.1Å; L101-L198 HydrophobicContact CD2-CD1 4.4Å; L101-V201 HydrophobicContact CD2-CB 4.37Å; L101-V201 HydrophobicContact CD2-CG1 4.01Å; L101-V201 HydrophobicContact CD2-CG2 3.84Å
102	R	92.3	Very high	86	Confident	101 Å²	101	45.6 Å²	45.6	38%	0.381	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.5	165.3	-60.8	-169.7	172	153.7	0.8	108.5	M170 N171 V172 V199 A200	R102-M170 HydrophobicContact CB-CG 4.43Å; R102-M170 HydrophobicContact CB-SD 4.12Å; R102-N171 VanDerWaalsContact CA-O 3.31Å; R102-N171 WeakPolarHBondContact CA-O 3.3Å; R102-V172 HydrophobicContact CG-CG2 4.25Å; R102-V199 HydrophobicContact CB-CB 4.46Å; R102-V199 WeakPolarHBondContact O-CA 3.17Å; R102-V199 WeakPolarHBondContact O-CB 3.39Å; R102-V199 PolarHBondContact O-N 3.31Å; R102-A200 HydrophobicContact CB-CB 4.04Å; R102-A200 HydrophobicContact CG-CB 4.28Å; R102-A200 PolarHBondContact N-O 3Å; R102-A200 PolarHBondContact O-N 3.1Å; R102-A200 VanDerWaalsContact O-N 3.08Å
103	F	91.9	Very high	84.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	164.4	-174.9	67	-80.6	0	0	0	111.7	L101 V105 F122 I152 A154 N171 K173 M196 S197 L198	L101-F103 HydrophobicContact CB-CD1 4.15Å; F103-V105 HydrophobicContact CD2-CG2 3.58Å; F103-V105 HydrophobicContact CE2-CG2 3.56Å; F103-F122 HydrophobicContact CD1-CE1 4.25Å; F103-F122 HydrophobicContact CD1-CZ 4.21Å; F103-F122 AromaticContact CD2-CE1 3.7Å; F103-F122 HydrophobicContact CD2-CE1 3.7Å; F103-F122 HydrophobicContact CD2-CZ 4.41Å; F103-F122 HydrophobicContact CE1-CE1 4.28Å; F103-F122 HydrophobicContact CE1-CZ 4.39Å; F103-F122 AromaticContact CE2-CE1 3.74Å; F103-F122 HydrophobicContact CE2-CE1 3.74Å; F103-F122 AromaticContact CG-CE1 3.98Å; F103-F122 HydrophobicContact CG-CE1 3.98Å; F103-F122 HydrophobicContact CG-CZ 4.24Å; F103-F122 HydrophobicContact CZ-CE1 4.04Å; F103-I152 HydrophobicContact CE1-CG2 3.7Å; F103-I152 HydrophobicContact CE2-CG2 4.35Å; F103-I152 HydrophobicContact CZ-CG2 3.53Å; F103-A154 HydrophobicContact CE2-CB 4.18Å; F103-N171 HydrophobicContact CD1-CB 4.19Å; F103-N171 HydrophobicContact CD2-CB 4.27Å; F103-N171 HydrophobicContact CE1-CB 3.83Å; F103-N171 HydrophobicContact CE2-CB 3.91Å; F103-N171 HydrophobicContact CG-CB 4.4Å; F103-N171 HydrophobicContact CZ-CB 3.67Å; F103-N171 PolarHBondContact N-O 3.12Å; F103-N171 WeakPolarHBondContact O-CA 3.37Å; F103-N171 WeakPolarHBondContact O-CB 3.36Å; F103-N171 PolarHBondContact O-N 2.72Å; F103-K173 HydrophobicContact CE1-CB 4.08Å; F103-K173 HydrophobicContact CE1-CG 3.71Å; F103-K173 HydrophobicContact CZ-CG 4.04Å; F103-M196 HydrophobicContact CB-CE 4.42Å; F103-M196 HydrophobicContact CD2-CE 4.48Å; F103-S197 CarbonylContact C-O 3.36Å; F103-S197 WeakPolarHBondContact CA-O 3.26Å; F103-S197 WeakPolarHBondContact CB-O 3.28Å; F103-L198 HydrophobicContact CB-CD1 4.12Å
104	S	88	Confident	83.3	Confident	9 Å²	9	50.4 Å²	50.4	6%	0.063	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145	170.6	64.7	0	0	0	0	110.2	K169 M196 S197	S104-K169 WeakPolarHBondContact CB-O 3.24Å; S104-M196 CarbonylContact O-C 3.55Å; S104-M196 WeakPolarHBondContact O-CA 3.22Å; S104-M196 VanDerWaalsContact O-CB 3.29Å; S104-M196 WeakPolarHBondContact O-CB 3.4Å; S104-S197 PolarHBondContact N-O 3.14Å; S104-S197 PolarHBondContact O-N 3.47Å
105	V	88.3	Confident	82	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.2	179.2	-175.4	0	0	0	0	108.7	F103 E120 A154 F158 M196	F103-V105 HydrophobicContact CD2-CG2 3.58Å; F103-V105 HydrophobicContact CE2-CG2 3.56Å; V105-E120 HydrophobicContact CG1-CB 4.16Å; V105-A154 HydrophobicContact CB-CB 4.02Å; V105-A154 HydrophobicContact CG2-CB 4Å; V105-F158 VanDerWaalsContact C-CE1 3.5Å; V105-F158 WeakPolarHBondContact O-CD1 3.33Å; V105-F158 WeakPolarHBondContact O-CE1 3.43Å; V105-F158 PolarHBondContact O-N 2.04Å; V105-M196 HydrophobicContact CG2-CB 3.99Å
106	R	85.3	Confident	80.8	Confident	96 Å²	96	53.8 Å²	53.8	36%	0.362	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-85.6	137.9	176.3	-171.8	174	-179.2	172	1.3	110.9	C108 S110 F158 C195	R106-C108 PolarHBondContact O-N 3.14Å; R106-S110 PolarHBondContact NE-OG 2.76Å; R106-F158 HydrophobicContact CB-CE1 3.91Å; R106-F158 HydrophobicContact CB-CE2 3.98Å; R106-F158 HydrophobicContact CB-CZ 3.54Å; R106-F158 HydrophobicContact CG-CD2 4.31Å; R106-F158 HydrophobicContact CG-CE2 3.72Å; R106-F158 HydrophobicContact CG-CZ 3.84Å; R106-C195 HydrophobicContact CB-CB 4.12Å; R106-C195 PolarHBondContact N-O 3.12Å
107	D	82.4	Confident	80.1	Confident	33 Å²	33	52.9 Å²	52.9	18%	0.176	28%	0.284	C	S	.	.			trans	-64.9	125.8	177.2	178.8	-1.4	0	0	0	111	A109 S110 E120 F158	D107-A109 PolarHBondContact O-N 3.04Å; D107-A109 VanDerWaalsContact OD1-CB 3.28Å; D107-A109 WeakPolarHBondContact OD1-CB 3.37Å; D107-A109 PolarHBondContact OD1-N 3.38Å; D107-S110 WeakPolarHBondContact O-CB 3.38Å; D107-S110 PolarHBondContact O-N 3.2Å; D107-S110 VanDerWaalsContact O-N 3.11Å; D107-S110 PolarHBondContact O-OG 3.33Å; D107-E120 VanDerWaalsContact CA-OE1 3.28Å; D107-E120 WeakPolarHBondContact CA-OE1 3.12Å; D107-F158 WeakPolarHBondContact CB-O 3.48Å; D107-F158 PolarHBondContact N-O 2.92Å
108	C	81.4	Confident	79.7	Confident	21 Å²	21	54.1 Å²	54.1	14%	0.142	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-62	-32.8	177.5	-75.2	0	0	0	0	112.1	R106 S110 M111 C118 E120	R106-C108 PolarHBondContact O-N 3.14Å; C108-S110 PolarHBondContact O-N 2.96Å; C108-M111 PolarHBondContact O-N 3.42Å; C108-C118 HydrophobicContact CB-CB 3.87Å; C108-C118 WeakPolarHBondContact CB-SG 2.98Å; C108-C118 WeakPolarHBondContact SG-CB 3.49Å; C108-C118 CovalentContact SG-SG 2.04Å; C108-C118 PolarHBondContact SG-SG 2.03Å; C108-E120 HydrophobicContact CB-CG 4.28Å; C108-E120 PolarHBondContact N-OE1 3.03Å
109	A	76.9	Confident	79.4	Confident	81 Å²	81	57.8 Å²	57.8	67%	0.669	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-68.5	-20.6	177.7	0	0	0	0	0	112.8	D107 M111	D107-A109 PolarHBondContact O-N 3.04Å; D107-A109 VanDerWaalsContact OD1-CB 3.28Å; D107-A109 WeakPolarHBondContact OD1-CB 3.37Å; D107-A109 PolarHBondContact OD1-N 3.38Å; A109-M111 VanDerWaalsContact C-N 3.28Å; A109-M111 PolarHBondContact O-N 2.78Å
110	S	73	Confident	79	Confident	16 Å²	16	61.1 Å²	61.1	11%	0.112	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-78.3	-10	177.9	77.1	0	0	0	0	114.8	R106 D107 C108 S159	R106-S110 PolarHBondContact NE-OG 2.76Å; D107-S110 WeakPolarHBondContact O-CB 3.38Å; D107-S110 PolarHBondContact O-N 3.2Å; D107-S110 VanDerWaalsContact O-N 3.11Å; D107-S110 PolarHBondContact O-OG 3.33Å; C108-S110 PolarHBondContact O-N 2.96Å; S110-S159 WeakPolarHBondContact CB-O 3.37Å
111	M	71.4	Confident	78.7	Confident	20 Å²	20	61 Å²	61	10%	0.099	33%	0.328	C	S	.	.			trans	-88.7	131	-173.6	-61.2	-150.2	-58.7	0	0	111.2	V75 C108 A109 T113 C118	V75-M111 HydrophobicContact CB-CE 3.62Å; V75-M111 HydrophobicContact CG1-CE 3.85Å; V75-M111 HydrophobicContact CG2-CE 3.4Å; V75-M111 VanDerWaalsContact CG2-CE 3.4Å; V75-M111 HydrophobicContact CG2-SD 3.93Å; C108-M111 PolarHBondContact O-N 3.42Å; A109-M111 VanDerWaalsContact C-N 3.28Å; A109-M111 PolarHBondContact O-N 2.78Å; M111-T113 PolarHBondContact O-N 3.35Å; M111-C118 HydrophobicContact CE-CB 4.31Å; M111-C118 WeakPolarHBondContact CE-SG 3.46Å
112	R	62.8	Low	78.7	Confident	242 Å²	242	61 Å²	61	91%	0.913	33%	0.329	S	S	*	.	S	Bend	trans	-65.3	-24	-174.7	-63	-173.7	-173.9	-164.8	2	113.1
113	T	58.9	Low	78.8	Confident	119 Å²	119	56.8 Å²	56.8	73%	0.73	31%	0.314	S	S	*	.	S	Bend	trans	-111.8	93.4	171.8	22.6	0	0	0	0	107.7	M111 A115	M111-T113 PolarHBondContact O-N 3.35Å; T113-A115 VanDerWaalsContact C-N 3.28Å; T113-A115 PolarHBondContact O-N 3.25Å
114	V	56.2	Low	79.1	Confident	117 Å²	117	56.8 Å²	56.8	71%	0.709	31%	0.314	S	S	*	.			trans	-70.4	89.8	173.9	-177.1	0	0	0	0	107.7	S116	V114-S116 PolarHBondContact O-N 2.97Å
115	A	58.9	Low	79.5	Confident	23 Å²	23	56.6 Å²	56.6	19%	0.19	31%	0.312	C	S	.	.			trans	-69.4	126.8	166.6	0	0	0	0	0	107.2	V75 T113 S117 C118	V75-A115 WeakPolarHBondContact O-CB 3.43Å; T113-A115 VanDerWaalsContact C-N 3.28Å; T113-A115 PolarHBondContact O-N 3.25Å; A115-S117 PolarHBondContact O-N 3.07Å; A115-C118 PolarHBondContact O-N 3.25Å; A115-C118 VanDerWaalsContact O-N 3.1Å
116	S	64.6	Low	79.9	Confident	135 Å²	135	57.9 Å²	57.9	94%	0.944	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-6.4	175.6	52.9	0	0	0	0	113.5	V114	V114-S116 PolarHBondContact O-N 2.97Å
117	S	75.5	Confident	80.4	Confident	28 Å²	28	55.4 Å²	55.4	20%	0.196	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-4.9	179.2	48.6	0	0	0	0	115	V75 A115	V75-S117 PolarHBondContact O-OG 2.76Å; A115-S117 PolarHBondContact O-N 3.07Å
118	C	84.6	Confident	81	Confident	27 Å²	27	55.4 Å²	55.4	18%	0.182	31%	0.308	C	S	.	.			trans	-66.3	136	-177.6	-173.8	0	0	0	0	112.2	C108 M111 A115 G193	C108-C118 HydrophobicContact CB-CB 3.87Å; C108-C118 WeakPolarHBondContact CB-SG 2.98Å; C108-C118 WeakPolarHBondContact SG-CB 3.49Å; C108-C118 CovalentContact SG-SG 2.04Å; C108-C118 PolarHBondContact SG-SG 2.03Å; M111-C118 HydrophobicContact CE-CB 4.31Å; M111-C118 WeakPolarHBondContact CE-SG 3.46Å; A115-C118 PolarHBondContact O-N 3.25Å; A115-C118 VanDerWaalsContact O-N 3.1Å; C118-G193 WeakPolarHBondContact CA-O 3.37Å
119	K	87.4	Confident	81.5	Confident	95 Å²	95	54.7 Å²	54.7	41%	0.413	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-124.8	159.2	175.3	-62.4	-172.9	-175.1	178.7	0	111.7	G193 A194	K119-G193 PolarHBondContact N-O 3.42Å; K119-A194 WeakPolarHBondContact O-CA 3.43Å; K119-A194 WeakPolarHBondContact O-CB 3.19Å
120	E	87.6	Confident	82.2	Confident	70 Å²	70	56.6 Å²	56.6	33%	0.327	30%	0.299	S	S	.	.	S	Bend	trans	-116.9	20.7	178.1	-57.7	-176.8	147.5	0	0	112.2	V105 D107 C108	V105-E120 HydrophobicContact CG1-CB 4.16Å; D107-E120 VanDerWaalsContact CA-OE1 3.28Å; D107-E120 WeakPolarHBondContact CA-OE1 3.12Å; C108-E120 HydrophobicContact CB-CG 4.28Å; C108-E120 PolarHBondContact N-OE1 3.03Å
121	T	90.5	Very high	83.1	Confident	46 Å²	46	58 Å²	58	28%	0.282	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	145.6	-172.3	64.5	0	0	0	0	111.1	T151 I152 A153	T121-T151 HydrophobicContact CG2-CG2 4.36Å; T121-I152 WeakPolarHBondContact CA-O 3.36Å; T121-I152 WeakPolarHBondContact CB-O 3.46Å; T121-A153 HydrophobicContact CG2-CB 3.83Å
122	F	94.1	Very high	84.1	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	162.5	169.4	66.3	-79.4	0	0	0	109.7	L101 F103 T151 I152 F189 Q190 M196	L101-F122 HydrophobicContact CD1-CE2 4.07Å; L101-F122 HydrophobicContact CD1-CZ 3.97Å; F103-F122 HydrophobicContact CD1-CE1 4.25Å; F103-F122 HydrophobicContact CD1-CZ 4.21Å; F103-F122 AromaticContact CD2-CE1 3.7Å; F103-F122 HydrophobicContact CD2-CE1 3.7Å; F103-F122 HydrophobicContact CD2-CZ 4.41Å; F103-F122 HydrophobicContact CE1-CE1 4.28Å; F103-F122 HydrophobicContact CE1-CZ 4.39Å; F103-F122 AromaticContact CE2-CE1 3.74Å; F103-F122 HydrophobicContact CE2-CE1 3.74Å; F103-F122 AromaticContact CG-CE1 3.98Å; F103-F122 HydrophobicContact CG-CE1 3.98Å; F103-F122 HydrophobicContact CG-CZ 4.24Å; F103-F122 HydrophobicContact CZ-CE1 4.04Å; F122-T151 CarbonylContact O-C 3.59Å; F122-I152 HydrophobicContact CD1-CB 3.99Å; F122-I152 HydrophobicContact CD1-CG2 4.36Å; F122-I152 HydrophobicContact CD2-CB 4.31Å; F122-I152 HydrophobicContact CD2-CG1 4.32Å; F122-I152 HydrophobicContact CE1-CB 3.59Å; F122-I152 HydrophobicContact CE1-CG1 4.37Å; F122-I152 HydrophobicContact CE1-CG2 3.53Å; F122-I152 HydrophobicContact CE2-CB 3.93Å; F122-I152 HydrophobicContact CE2-CG1 3.8Å; F122-I152 HydrophobicContact CE2-CG2 4.35Å; F122-I152 HydrophobicContact CG-CB 4.35Å; F122-I152 HydrophobicContact CZ-CB 3.57Å; F122-I152 HydrophobicContact CZ-CG1 3.86Å; F122-I152 HydrophobicContact CZ-CG2 3.54Å; F122-I152 PolarHBondContact N-O 3.49Å; F122-I152 VanDerWaalsContact N-O 3.1Å; F122-I152 PolarHBondContact O-N 3.33Å; F122-F189 HydrophobicContact CD2-CD1 4.25Å; F122-F189 AromaticContact CE2-CD1 3.89Å; F122-F189 HydrophobicContact CE2-CD1 3.89Å; F122-Q190 CarbonylContact C-O 3.55Å; F122-Q190 WeakPolarHBondContact CA-O 3.23Å; F122-Q190 WeakPolarHBondContact CB-O 3.46Å; F122-M196 HydrophobicContact CB-CE 4.34Å; F122-M196 HydrophobicContact CB-SD 3.56Å; F122-M196 VanDerWaalsContact CB-SD 3.56Å; F122-M196 HydrophobicContact CD1-CE 3.28Å; F122-M196 HydrophobicContact CD1-SD 3.34Å; F122-M196 WeakPolarHBondContact CD1-SD 3.45Å; F122-M196 HydrophobicContact CD2-CE 4.17Å; F122-M196 HydrophobicContact CD2-SD 4.48Å; F122-M196 HydrophobicContact CE1-CE 3.4Å; F122-M196 VanDerWaalsContact CE1-CE 3.4Å; F122-M196 HydrophobicContact CE1-SD 4.1Å; F122-M196 HydrophobicContact CE2-CE 4.28Å; F122-M196 HydrophobicContact CG-CE 3.68Å; F122-M196 HydrophobicContact CG-SD 3.55Å; F122-M196 VanDerWaalsContact CG-SD 3.55Å; F122-M196 HydrophobicContact CZ-CE 3.9Å
123	T	95.9	Very high	85.3	Confident	12 Å²	12	54.7 Å²	54.7	7%	0.074	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.2	-177.8	-56.2	0	0	0	0	111	Y125 K148 D150 T151 F189 Q190	T123-Y125 HydrophobicContact CG2-CD2 3.84Å; T123-Y125 HydrophobicContact CG2-CE2 3.19Å; T123-K148 HydrophobicContact CG2-CD 3.84Å; T123-K148 HydrophobicContact CG2-CG 3.72Å; T123-D150 WeakPolarHBondContact CG2-O 3.19Å; T123-T151 PolarHBondContact OG1-OG1 3.2Å; T123-F189 WeakPolarHBondContact O-CA 3.46Å; T123-Q190 PolarHBondContact N-O 2.89Å; T123-Q190 PolarHBondContact O-N 2.81Å
124	L	97.4	Very high	86.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	132	173.9	176.2	65.7	0	0	0	109.8	V99 L101 V149 D150 I152 R175 F189	V99-L124 HydrophobicContact CB-CD2 4.34Å; V99-L124 HydrophobicContact CG1-CD2 4.44Å; L101-L124 HydrophobicContact CD1-CD2 4.48Å; L124-V149 HydrophobicContact CB-CB 4.24Å; L124-V149 HydrophobicContact CD2-CB 4.03Å; L124-V149 HydrophobicContact CD2-CG1 3.94Å; L124-V149 HydrophobicContact CD2-CG2 4.31Å; L124-V149 HydrophobicContact CG-CB 3.93Å; L124-V149 HydrophobicContact CG-CG1 4.41Å; L124-V149 HydrophobicContact CG-CG2 4.05Å; L124-V149 WeakPolarHBondContact O-CA 3.4Å; L124-V149 WeakPolarHBondContact O-CB 3.37Å; L124-V149 PolarHBondContact O-N 2.84Å; L124-D150 PolarHBondContact N-O 3.04Å; L124-D150 PolarHBondContact O-N 2.86Å; L124-I152 HydrophobicContact CB-CG1 4.3Å; L124-R175 HydrophobicContact CD2-CB 4.22Å; L124-F189 HydrophobicContact CD1-CD1 3.95Å; L124-F189 HydrophobicContact CD1-CE1 3.57Å; L124-F189 HydrophobicContact CD1-CZ 4.06Å
125	Y	96.8	Very high	88.1	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	161.3	177.8	-71.8	-93.8	0	0	0	111.3	W83 T123 W146 T147 K148 L187 A188 Q190	W83-Y125 HydrophobicContact CH2-CD1 4.48Å; W83-Y125 HydrophobicContact CH2-CD2 4.05Å; W83-Y125 HydrophobicContact CH2-CE1 4.41Å; W83-Y125 AromaticContact CH2-CE2 3.97Å; W83-Y125 HydrophobicContact CH2-CE2 3.97Å; W83-Y125 HydrophobicContact CH2-CG 4.33Å; W83-Y125 AromaticContact CZ3-CD2 3.86Å; W83-Y125 HydrophobicContact CZ3-CD2 3.86Å; W83-Y125 HydrophobicContact CZ3-CE2 4.24Å; W83-Y125 HydrophobicContact CZ3-CG 4.06Å; T123-Y125 HydrophobicContact CG2-CD2 3.84Å; T123-Y125 HydrophobicContact CG2-CE2 3.19Å; Y125-W146 HydrophobicContact CD1-CB 3.61Å; Y125-W146 HydrophobicContact CE1-CB 4.42Å; Y125-W146 HydrophobicContact CG-CB 4.09Å; Y125-T147 CarbonylContact C-O 3.56Å; Y125-T147 WeakPolarHBondContact CA-O 3.1Å; Y125-K148 VanDerWaalsContact CD1-CA 3.45Å; Y125-K148 HydrophobicContact CD1-CB 3.94Å; Y125-K148 HydrophobicContact CE1-CB 3.55Å; Y125-K148 HydrophobicContact CE1-CG 4.09Å; Y125-L187 WeakPolarHBondContact O-CA 3.38Å; Y125-A188 PolarHBondContact N-O 2.88Å; Y125-A188 PolarHBondContact O-N 3.38Å; Y125-Q190 HydrophobicContact CD2-CB 4.16Å; Y125-Q190 HydrophobicContact CE2-CB 3.83Å; Y125-Q190 VanDerWaalsContact CE2-OE1 3.29Å; Y125-Q190 PolarHBondContact OH-OE1 3.13Å
126	Y	96.9	Very high	89.1	Confident	28 Å²	28	54.2 Å²	54.2	11%	0.11	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	155.6	168.1	79.6	-72.9	0	0	0	112.3	Q128 T147 V149 F177 L180 Y186	Y126-Q128 HydrophobicContact CD2-CG 4.1Å; Y126-Q128 HydrophobicContact CE2-CG 3.87Å; Y126-T147 HydrophobicContact CD1-CG2 4.25Å; Y126-T147 WeakPolarHBondContact CD1-O 3.31Å; Y126-T147 VanDerWaalsContact CE1-CB 3.43Å; Y126-T147 HydrophobicContact CE1-CG2 3.44Å; Y126-T147 VanDerWaalsContact CE1-CG2 3.44Å; Y126-T147 PolarHBondContact N-O 3.14Å; Y126-T147 PolarHBondContact O-N 3.4Å; Y126-V149 HydrophobicContact CD1-CG2 3.53Å; Y126-V149 HydrophobicContact CE1-CG2 4.28Å; Y126-V149 HydrophobicContact CG-CG2 4.36Å; Y126-F177 HydrophobicContact CD1-CB 4.3Å; Y126-F177 AromaticContact CD1-CD2 3.95Å; Y126-F177 HydrophobicContact CD1-CD2 3.95Å; Y126-F177 HydrophobicContact CD1-CG 4.07Å; Y126-F177 AromaticContact CD2-CD2 3.54Å; Y126-F177 HydrophobicContact CD2-CD2 3.54Å; Y126-F177 AromaticContact CD2-CE2 3.6Å; Y126-F177 HydrophobicContact CD2-CE2 3.6Å; Y126-F177 HydrophobicContact CD2-CG 4.45Å; Y126-F177 HydrophobicContact CE1-CB 4.08Å; Y126-F177 HydrophobicContact CE1-CD2 4.11Å; Y126-F177 HydrophobicContact CE1-CG 4.26Å; Y126-F177 AromaticContact CE2-CD2 3.72Å; Y126-F177 HydrophobicContact CE2-CD2 3.72Å; Y126-F177 HydrophobicContact CE2-CE2 4.17Å; Y126-F177 AromaticContact CG-CD2 3.66Å; Y126-F177 HydrophobicContact CG-CD2 3.66Å; Y126-F177 AromaticContact CG-CE2 3.8Å; Y126-F177 HydrophobicContact CG-CE2 3.8Å; Y126-F177 HydrophobicContact CG-CG 4.16Å; Y126-F177 HydrophobicContact CG-CZ 4.39Å; Y126-L180 HydrophobicContact CD2-CD2 4.21Å; Y126-L180 HydrophobicContact CE2-CD2 3.85Å; Y126-Y186 CarbonylContact C-O 3.52Å; Y126-Y186 WeakPolarHBondContact CA-O 3.39Å
127	H	95.1	Very high	89.9	Confident	44 Å²	44	55 Å²	55	20%	0.204	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	125.9	174.6	179.8	81.4	0	0	0	109.5	P145 W146 F185 Y186	H127-P145 PolarHBondContact ND1-O 2.79Å; H127-W146 HydrophobicContact CB-CD2 4.25Å; H127-W146 HydrophobicContact CB-CE3 3.63Å; H127-W146 HydrophobicContact CB-CH2 4.16Å; H127-W146 HydrophobicContact CB-CZ3 3.58Å; H127-F185 CarbonylContact O-C 3.51Å; H127-F185 WeakPolarHBondContact O-CA 3.34Å; H127-F185 WeakPolarHBondContact O-CB 3.27Å; H127-Y186 HydrophobicContact CB-CD2 4.49Å; H127-Y186 PolarHBondContact N-O 3.28Å; H127-Y186 PolarHBondContact O-N 3.17Å
128	Q	94.6	Very high	90.3	Very high	33 Å²	33	58 Å²	58	15%	0.154	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	139.4	178.3	-66.6	-175.7	73.1	0	0	110.2	Y126 L180 Q182 G184 F185	Y126-Q128 HydrophobicContact CD2-CG 4.1Å; Y126-Q128 HydrophobicContact CE2-CG 3.87Å; Q128-L180 VanDerWaalsContact CD-CD2 3.43Å; Q128-L180 HydrophobicContact CG-CD2 3.76Å; Q128-Q182 HydrophobicContact CB-CB 4.08Å; Q128-Q182 HydrophobicContact CB-CG 3.97Å; Q128-Q182 PolarHBondContact O-OE1 3.43Å; Q128-G184 WeakPolarHBondContact CA-O 3.41Å; Q128-F185 HydrophobicContact CG-CB 4.31Å
129	A	92.4	Very high	90.3	Very high	7 Å²	7	57.2 Å²	57.2	6%	0.058	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.7	174.2	0	0	0	0	0	111.4	F88 A131 V133 G184 Y186	F88-A129 HydrophobicContact CE2-CB 4.02Å; F88-A129 WeakPolarHBondContact CE2-O 3.4Å; A129-A131 VanDerWaalsContact C-N 3.3Å; A129-A131 WeakPolarHBondContact CB-O 3.41Å; A129-V133 HydrophobicContact CB-CG2 4.04Å; A129-G184 PolarHBondContact N-O 3.14Å; A129-G184 PolarHBondContact O-N 3.36Å; A129-G184 VanDerWaalsContact O-N 3.07Å; A129-G184 VanDerWaalsContact O-O 3.09Å; A129-Y186 HydrophobicContact CB-CE2 3.81Å
130	E	92.4	Very high	90.4	Very high	120 Å²	120	57.9 Å²	57.9	56%	0.561	31%	0.306	S	S	*	.	S	Bend	trans	-76.8	-16.5	174.8	-68.8	-60.5	160.5	0	0	113.4	Q182 R183	E130-Q182 WeakPolarHBondContact OE1-CA 3.05Å; E130-Q182 WeakPolarHBondContact OE1-CB 3.38Å; E130-Q182 WeakPolarHBondContact OE1-CG 3.07Å; E130-R183 WeakPolarHBondContact O-CB 3.23Å; E130-R183 WeakPolarHBondContact O-CD 3.04Å; E130-R183 PolarHBondContact OE2-N 3.05Å
131	A	91.4	Very high	90.4	Very high	47 Å²	47	55.7 Å²	55.7	39%	0.388	30%	0.295	S	S	.	.	S	Bend	trans	-155.1	171.6	178.3	0	0	0	0	0	111	A129 V133 Y186	A129-A131 VanDerWaalsContact C-N 3.3Å; A129-A131 WeakPolarHBondContact CB-O 3.41Å; A131-V133 PolarHBondContact O-N 2.81Å; A131-V133 VanDerWaalsContact O-N 3.09Å; A131-Y186 PolarHBondContact O-OH 2.83Å
132	D	91.3	Very high	90.3	Very high	107 Å²	107	57.4 Å²	57.4	57%	0.572	30%	0.299	S	S	*	.			trans	-69.9	102.9	169.5	-165.8	-2.3	0	0	0	110	F88 A134 Y186	F88-D132 HydrophobicContact CB-CB 3.89Å; F88-D132 HydrophobicContact CD1-CB 4.28Å; F88-D132 HydrophobicContact CG-CB 4.08Å; D132-A134 PolarHBondContact OD1-N 2.78Å; D132-Y186 VanDerWaalsContact CA-OH 3.26Å; D132-Y186 WeakPolarHBondContact CA-OH 3.47Å; D132-Y186 PolarHBondContact OD1-OH 3.02Å; D132-Y186 VanDerWaalsContact OD1-OH 3.1Å
133	V	88.2	Confident	89.7	Confident	84 Å²	84	63 Å²	63	51%	0.509	33%	0.326	S	S	.	.			trans	-117.3	4.4	-177.4	-63.4	0	0	0	0	111.3	A129 A131 S135 Y186	A129-V133 HydrophobicContact CB-CG2 4.04Å; A131-V133 PolarHBondContact O-N 2.81Å; A131-V133 VanDerWaalsContact O-N 3.09Å; V133-S135 PolarHBondContact O-N 2.93Å; V133-Y186 HydrophobicContact CG2-CE2 4.49Å; V133-Y186 PolarHBondContact N-OH 3.14Å
134	A	86.9	Confident	89.4	Confident	31 Å²	31	65.3 Å²	65.3	26%	0.256	35%	0.351	S	S	.	.			trans	-68.9	128.5	-175.3	0	0	0	0	0	111.5	R85 D132 L138 Y186	R85-A134 VanDerWaalsContact CZ-CB 3.45Å; D132-A134 PolarHBondContact OD1-N 2.78Å; A134-L138 WeakPolarHBondContact CA-O 3.47Å; A134-Y186 HydrophobicContact CB-CD1 4.32Å; A134-Y186 HydrophobicContact CB-CE1 3.49Å; A134-Y186 VanDerWaalsContact CB-CE1 3.49Å; A134-Y186 PolarHBondContact N-OH 2.85Å
135	S	86.6	Confident	89	Confident	52 Å²	52	67.2 Å²	67.2	36%	0.364	36%	0.363	S	S	.	.			trans	-121.3	-172.7	168.1	79	0	0	0	0	110.1	R85 V133 E137 L138	R85-S135 PolarHBondContact NH1-O 2.67Å; R85-S135 PolarHBondContact NH2-O 2.93Å; R85-S135 VanDerWaalsContact NH2-O 3.09Å; V133-S135 PolarHBondContact O-N 2.93Å; S135-E137 PolarHBondContact O-N 2.97Å; S135-E137 PolarHBondContact OG-N 3.3Å; S135-E137 VanDerWaalsContact OG-N 3.16Å; S135-L138 PolarHBondContact N-O 2.71Å; S135-L138 PolarHBondContact OG-N 3.48Å
136	Q	81.6	Confident	88.9	Confident	166 Å²	166	67.4 Å²	67.4	78%	0.776	36%	0.364	S	S	*	.	S	Bend	trans	-66.9	-20.7	171.1	-77.2	-172	-13.7	0	0	112.9	W141	Q136-W141 PolarHBondContact O-NE1 2.97Å
137	E	80.3	Confident	88.8	Confident	153 Å²	153	69.5 Å²	69.5	72%	0.715	38%	0.38	S	S	*	.	S	Bend	trans	-115.9	-18	-176.2	-64.2	-178.3	174.9	0	0	113.4	S135 E140	S135-E137 PolarHBondContact O-N 2.97Å; S135-E137 PolarHBondContact OG-N 3.3Å; S135-E137 VanDerWaalsContact OG-N 3.16Å; E137-E140 WeakPolarHBondContact O-CA 3.27Å
138	L	83.6	Confident	88.8	Confident	91 Å²	91	72.7 Å²	72.7	48%	0.476	39%	0.393	S	S	.	.			trans	-120.8	142	-176.7	-68.1	168.4	0	0	0	112	R85 A134 S135 E140	R85-L138 PolarHBondContact NH1-O 2.78Å; A134-L138 WeakPolarHBondContact CA-O 3.47Å; S135-L138 PolarHBondContact N-O 2.71Å; S135-L138 PolarHBondContact OG-N 3.48Å; L138-E140 HydrophobicContact CD2-CG 4.03Å
139	P	86.1	Confident	88.8	Confident	10 Å²	10	72.7 Å²	72.7	7%	0.065	40%	0.396	C	S	.	.	S	Bend	cis	-58	147.8	-12.8	-18.9	31.2	0	0	0	111.3	P145 W146	P139-P145 HydrophobicContact CB-CB 4.11Å; P139-P145 HydrophobicContact CB-CG 4.29Å; P139-W146 HydrophobicContact CB-CZ2 3.88Å; P139-W146 HydrophobicContact CG-CH2 4.25Å; P139-W146 HydrophobicContact CG-CZ2 3.98Å
140	E	88.4	Confident	88.9	Confident	109 Å²	109	75.1 Å²	75.1	51%	0.509	41%	0.407	S	S	.	.			trans	-57.5	142.4	-172.8	-57.1	-178.2	-177.3	0	0	111.9	E137 L138 H142 P145 W146	E137-E140 WeakPolarHBondContact O-CA 3.27Å; L138-E140 HydrophobicContact CD2-CG 4.03Å; E140-H142 WeakPolarHBondContact CB-CD2 3.49Å; E140-H142 WeakPolarHBondContact CB-NE2 3.2Å; E140-H142 PolarHBondContact O-N 2.65Å; E140-H142 IonicContact OE2-CD2 3.07Å; E140-H142 IonicContact OE2-NE2 3.32Å; E140-H142 PolarHBondContact OE2-NE2 2.68Å; E140-P145 HydrophobicContact CB-CG 4.23Å; E140-P145 VanDerWaalsContact O-CG 3.28Å; E140-P145 WeakPolarHBondContact O-CG 3.48Å; E140-W146 PolarHBondContact O-NE1 3.35Å
141	W	88.6	Confident	89	Confident	23 Å²	23	71.7 Å²	71.7	9%	0.087	40%	0.395	C	S	.	.	S	Bend	trans	-81.2	51.6	-173.7	-58.5	107.3	0	0	0	113.6	T47 H49 W83 R85 Q136	T47-W141 HydrophobicContact CG2-CH2 4.16Å; T47-W141 HydrophobicContact CG2-CZ2 3.82Å; H49-W141 HydrophobicContact CB-CB 4.3Å; H49-W141 HydrophobicContact CB-CD2 3.34Å; H49-W141 VanDerWaalsContact CB-CE2 3.4Å; H49-W141 HydrophobicContact CB-CE3 3.82Å; H49-W141 HydrophobicContact CB-CG 3.58Å; H49-W141 HydrophobicContact CB-CH2 4.26Å; H49-W141 HydrophobicContact CB-CZ2 3.9Å; H49-W141 HydrophobicContact CB-CZ3 4.24Å; H49-W141 WeakPolarHBondContact CD2-CB 3.17Å; H49-W141 AromaticContact CD2-CD1 3.67Å; H49-W141 AromaticContact CD2-CG 3.46Å; H49-W141 VanDerWaalsContact CD2-CG 3.46Å; H49-W141 AromaticContact CE1-CD1 3.81Å; H49-W141 AromaticContact CG-CD1 3.33Å; H49-W141 AromaticContact CG-CD2 3.76Å; H49-W141 AromaticContact CG-CE2 3.92Å; H49-W141 AromaticContact CG-CG 3.37Å; H49-W141 AromaticContact CG-NE1 3.66Å; H49-W141 AromaticContact ND1-CD1 3.44Å; H49-W141 AromaticContact ND1-CG 3.97Å; H49-W141 AromaticContact ND1-NE1 3.7Å; H49-W141 AromaticContact NE2-CD1 3.96Å; W83-W141 HydrophobicContact CB-CD2 4.41Å; W83-W141 HydrophobicContact CB-CE3 3.37Å; W83-W141 HydrophobicContact CB-CZ3 3.58Å; W83-W141 HydrophobicContact CD2-CE3 4.3Å; W83-W141 HydrophobicContact CE3-CE3 4.47Å; W83-W141 AromaticContact CG-CE3 3.86Å; W83-W141 HydrophobicContact CG-CE3 3.86Å; W83-W141 HydrophobicContact CG-CZ3 4.47Å; R85-W141 HydrophobicContact CB-CH2 3.59Å; R85-W141 HydrophobicContact CB-CZ3 3.8Å; Q136-W141 PolarHBondContact O-NE1 2.97Å
142	H	86.9	Confident	89.1	Confident	83 Å²	83	69.5 Å²	69.5	38%	0.384	38%	0.377	S	S	.	.	S	Bend	trans	-143.7	165.2	173.7	70.1	95.3	0	0	0	109.8	E140 G144 P145	E140-H142 WeakPolarHBondContact CB-CD2 3.49Å; E140-H142 WeakPolarHBondContact CB-NE2 3.2Å; E140-H142 PolarHBondContact O-N 2.65Å; E140-H142 IonicContact OE2-CD2 3.07Å; E140-H142 IonicContact OE2-NE2 3.32Å; E140-H142 PolarHBondContact OE2-NE2 2.68Å; H142-G144 PolarHBondContact ND1-N 2.82Å; H142-G144 VanDerWaalsContact ND1-N 3.15Å; H142-G144 PolarHBondContact O-N 2.84Å; H142-P145 WeakPolarHBondContact CE1-CD 3.2Å; H142-P145 WeakPolarHBondContact NE2-CD 3.5Å; H142-P145 VanDerWaalsContact O-CD 3.31Å; H142-P145 WeakPolarHBondContact O-CD 3.28Å
143	E	82.9	Confident	89	Confident	120 Å²	120	66.5 Å²	66.5	56%	0.561	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.1	-170.5	-61.2	-179.6	-174.9	0	0	115.9	W83	W83-E143 HydrophobicContact CH2-CG 4.44Å; W83-E143 HydrophobicContact CZ2-CG 4.36Å
144	G	88.8	Confident	88.7	Confident	59 Å²	59	63.7 Å²	63.7	61%	0.608	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-57.7	-173.9	0	0	0	0	0	114.6	H142 W146	H142-G144 PolarHBondContact ND1-N 2.82Å; H142-G144 VanDerWaalsContact ND1-N 3.15Å; H142-G144 PolarHBondContact O-N 2.84Å; G144-W146 PolarHBondContact O-N 2.88Å
145	P	89.6	Confident	88.2	Confident	40 Å²	40	67.7 Å²	67.7	26%	0.26	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-14.9	178.2	24.8	-34.4	0	0	0	114	H127 P139 E140 H142	H127-P145 PolarHBondContact ND1-O 2.79Å; P139-P145 HydrophobicContact CB-CB 4.11Å; P139-P145 HydrophobicContact CB-CG 4.29Å; E140-P145 HydrophobicContact CB-CG 4.23Å; E140-P145 VanDerWaalsContact O-CG 3.28Å; E140-P145 WeakPolarHBondContact O-CG 3.48Å; H142-P145 WeakPolarHBondContact CE1-CD 3.2Å; H142-P145 WeakPolarHBondContact NE2-CD 3.5Å; H142-P145 VanDerWaalsContact O-CD 3.31Å; H142-P145 WeakPolarHBondContact O-CD 3.28Å
146	W	93.5	Very high	87.3	Confident	9 Å²	9	70.4 Å²	70.4	3%	0.034	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-100.4	135.8	-173.2	-62.9	91.5	0	0	0	111.8	W83 R85 Y125 H127 P139 E140 G144 A188	W83-W146 HydrophobicContact CH2-CG 4.33Å; W83-W146 HydrophobicContact CZ3-CB 4.32Å; W83-W146 AromaticContact CZ3-CD1 3.83Å; W83-W146 HydrophobicContact CZ3-CD2 4.21Å; W83-W146 AromaticContact CZ3-CG 3.85Å; W83-W146 HydrophobicContact CZ3-CG 3.85Å; R85-W146 HydrophobicContact CG-CH2 3.63Å; R85-W146 HydrophobicContact CG-CZ2 4.35Å; R85-W146 HydrophobicContact CG-CZ3 4.46Å; Y125-W146 HydrophobicContact CD1-CB 3.61Å; Y125-W146 HydrophobicContact CE1-CB 4.42Å; Y125-W146 HydrophobicContact CG-CB 4.09Å; H127-W146 HydrophobicContact CB-CD2 4.25Å; H127-W146 HydrophobicContact CB-CE3 3.63Å; H127-W146 HydrophobicContact CB-CH2 4.16Å; H127-W146 HydrophobicContact CB-CZ3 3.58Å; P139-W146 HydrophobicContact CB-CZ2 3.88Å; P139-W146 HydrophobicContact CG-CH2 4.25Å; P139-W146 HydrophobicContact CG-CZ2 3.98Å; E140-W146 PolarHBondContact O-NE1 3.35Å; G144-W146 PolarHBondContact O-N 2.88Å; W146-A188 HydrophobicContact CD2-CB 4.15Å; W146-A188 HydrophobicContact CE3-CB 3.65Å; W146-A188 HydrophobicContact CH2-CB 3.88Å; W146-A188 HydrophobicContact CZ2-CB 4.3Å; W146-A188 HydrophobicContact CZ3-CB 3.5Å; W146-A188 VanDerWaalsContact CZ3-CB 3.5Å
147	T	95.6	Very high	86.7	Confident	72 Å²	72	64.4 Å²	64.4	44%	0.442	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.8	171.7	-55.7	0	0	0	0	109.7	Y125 Y126 V149	Y125-T147 CarbonylContact C-O 3.56Å; Y125-T147 WeakPolarHBondContact CA-O 3.1Å; Y126-T147 HydrophobicContact CD1-CG2 4.25Å; Y126-T147 WeakPolarHBondContact CD1-O 3.31Å; Y126-T147 VanDerWaalsContact CE1-CB 3.43Å; Y126-T147 HydrophobicContact CE1-CG2 3.44Å; Y126-T147 VanDerWaalsContact CE1-CG2 3.44Å; Y126-T147 PolarHBondContact N-O 3.14Å; Y126-T147 PolarHBondContact O-N 3.4Å; T147-V149 PolarHBondContact O-N 3.33Å
148	K	95.9	Very high	86.1	Confident	110 Å²	110	59.6 Å²	59.6	48%	0.478	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	127.3	177.7	-176	170	173.6	166.2	0	110.9	T123 Y125 T151	T123-K148 HydrophobicContact CG2-CD 3.84Å; T123-K148 HydrophobicContact CG2-CG 3.72Å; Y125-K148 VanDerWaalsContact CD1-CA 3.45Å; Y125-K148 HydrophobicContact CD1-CB 3.94Å; Y125-K148 HydrophobicContact CE1-CB 3.55Å; Y125-K148 HydrophobicContact CE1-CG 4.09Å; K148-T151 VanDerWaalsContact CE-OG1 3.23Å; K148-T151 WeakPolarHBondContact CE-OG1 3.31Å; K148-T151 PolarHBondContact NZ-OG1 3.03Å
149	V	94.4	Very high	84.8	Confident	34 Å²	34	58.6 Å²	58.6	21%	0.206	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-61.5	173.8	-178.5	0	0	0	0	110.3	L124 Y126 T147 R175 F177	L124-V149 HydrophobicContact CB-CB 4.24Å; L124-V149 HydrophobicContact CD2-CB 4.03Å; L124-V149 HydrophobicContact CD2-CG1 3.94Å; L124-V149 HydrophobicContact CD2-CG2 4.31Å; L124-V149 HydrophobicContact CG-CB 3.93Å; L124-V149 HydrophobicContact CG-CG1 4.41Å; L124-V149 HydrophobicContact CG-CG2 4.05Å; L124-V149 WeakPolarHBondContact O-CA 3.4Å; L124-V149 WeakPolarHBondContact O-CB 3.37Å; L124-V149 PolarHBondContact O-N 2.84Å; Y126-V149 HydrophobicContact CD1-CG2 3.53Å; Y126-V149 HydrophobicContact CE1-CG2 4.28Å; Y126-V149 HydrophobicContact CG-CG2 4.36Å; T147-V149 PolarHBondContact O-N 3.33Å; V149-R175 HydrophobicContact CG1-CB 4.08Å; V149-F177 HydrophobicContact CG1-CB 4.34Å; V149-F177 HydrophobicContact CG1-CD1 4.28Å; V149-F177 HydrophobicContact CG2-CB 4.21Å; V149-F177 HydrophobicContact CG2-CD1 3.9Å; V149-F177 HydrophobicContact CG2-CG 4.18Å
150	D	94.6	Very high	83.2	Confident	57 Å²	57	65.4 Å²	65.4	31%	0.305	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	160.1	178	-163.7	15	0	0	0	111.1	T123 L124 I152 R175	T123-D150 WeakPolarHBondContact CG2-O 3.19Å; L124-D150 PolarHBondContact N-O 3.04Å; L124-D150 PolarHBondContact O-N 2.86Å; D150-I152 HydrophobicContact CB-CD1 4.1Å; D150-R175 HydrophobicContact CB-CG 4.32Å; D150-R175 IonicContact OD2-CZ 2.88Å; D150-R175 IonicContact OD2-NE 2.77Å; D150-R175 PolarHBondContact OD2-NE 3.22Å; D150-R175 IonicContact OD2-NH2 3.89Å; D150-R175 PolarHBondContact OD2-NH2 2.99Å; D150-R175 VanDerWaalsContact OD2-NH2 3.07Å
151	T	93.8	Very high	81.5	Confident	49 Å²	49	65.1 Å²	65.1	30%	0.301	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.8	166.2	-66.2	0	0	0	0	108.9	T121 F122 T123 K148	T121-T151 HydrophobicContact CG2-CG2 4.36Å; F122-T151 CarbonylContact O-C 3.59Å; T123-T151 PolarHBondContact OG1-OG1 3.2Å; K148-T151 VanDerWaalsContact CE-OG1 3.23Å; K148-T151 WeakPolarHBondContact CE-OG1 3.31Å; K148-T151 PolarHBondContact NZ-OG1 3.03Å
152	I	93.5	Very high	79.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	120	-173.7	-47.9	-57.5	0	0	0	109.7	L101 F103 T121 F122 L124 D150 K173 R175	L101-I152 HydrophobicContact CD1-CD1 4.35Å; L101-I152 HydrophobicContact CD1-CG1 4.09Å; F103-I152 HydrophobicContact CE1-CG2 3.7Å; F103-I152 HydrophobicContact CE2-CG2 4.35Å; F103-I152 HydrophobicContact CZ-CG2 3.53Å; T121-I152 WeakPolarHBondContact CA-O 3.36Å; T121-I152 WeakPolarHBondContact CB-O 3.46Å; F122-I152 HydrophobicContact CD1-CB 3.99Å; F122-I152 HydrophobicContact CD1-CG2 4.36Å; F122-I152 HydrophobicContact CD2-CB 4.31Å; F122-I152 HydrophobicContact CD2-CG1 4.32Å; F122-I152 HydrophobicContact CE1-CB 3.59Å; F122-I152 HydrophobicContact CE1-CG1 4.37Å; F122-I152 HydrophobicContact CE1-CG2 3.53Å; F122-I152 HydrophobicContact CE2-CB 3.93Å; F122-I152 HydrophobicContact CE2-CG1 3.8Å; F122-I152 HydrophobicContact CE2-CG2 4.35Å; F122-I152 HydrophobicContact CG-CB 4.35Å; F122-I152 HydrophobicContact CZ-CB 3.57Å; F122-I152 HydrophobicContact CZ-CG1 3.86Å; F122-I152 HydrophobicContact CZ-CG2 3.54Å; F122-I152 PolarHBondContact N-O 3.49Å; F122-I152 VanDerWaalsContact N-O 3.1Å; F122-I152 PolarHBondContact O-N 3.33Å; L124-I152 HydrophobicContact CB-CG1 4.3Å; D150-I152 HydrophobicContact CB-CD1 4.1Å; I152-K173 HydrophobicContact CG2-CB 4.28Å; I152-K173 HydrophobicContact CG2-CG 4.05Å; I152-R175 HydrophobicContact CD1-CG 3.74Å
153	A	88.9	Confident	77.1	Confident	45 Å²	45	71.6 Å²	71.6	37%	0.372	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	149.9	171.1	0	0	0	0	0	110.7	T121 K173	T121-A153 HydrophobicContact CG2-CB 3.83Å; A153-K173 VanDerWaalsContact O-CE 3.28Å; A153-K173 WeakPolarHBondContact O-CE 3.49Å
154	A	82.4	Confident	75.4	Confident	24 Å²	24	71.7 Å²	71.7	20%	0.198	43%	0.425	C	S	.	.			trans	-72.3	142.8	169.5	0	0	0	0	0	110.8	F103 V105	F103-A154 HydrophobicContact CE2-CB 4.18Å; V105-A154 HydrophobicContact CB-CB 4.02Å; V105-A154 HydrophobicContact CG2-CB 4Å
155	D	75.8	Confident	73.5	Confident	116 Å²	116	71.8 Å²	71.8	62%	0.62	43%	0.426	S	S	*	.	S	Bend	trans	-77.7	-33.6	169.4	-69.7	-38.7	0	0	0	110.6	N171 K173	D155-N171 PolarHBondContact N-OD1 2.89Å; D155-K173 IonicContact OD1-NZ 3.87Å; D155-K173 PolarHBondContact OD1-NZ 2.79Å; D155-K173 WeakPolarHBondContact OD2-CE 3.36Å; D155-K173 IonicContact OD2-NZ 2.67Å; D155-K173 PolarHBondContact OD2-NZ 2.82Å
156	E	68.8	Low	71.8	Confident	108 Å²	108	77.1 Å²	77.1	51%	0.505	45%	0.445	S	S	.	.	S	Bend	trans	-134	122.1	173.7	-61.6	-171.9	-172.6	0	0	109.8	K169 N171	E156-K169 HydrophobicContact CB-CD 4.13Å; E156-K169 VanDerWaalsContact OE2-CD 3.32Å; E156-K169 WeakPolarHBondContact OE2-CD 3.22Å; E156-K169 WeakPolarHBondContact OE2-CE 3.41Å; E156-K169 IonicContact OE2-NZ 2.71Å; E156-K169 PolarHBondContact OE2-NZ 3.04Å; E156-N171 PolarHBondContact N-OD1 2.94Å; E156-N171 PolarHBondContact O-ND2 3.19Å; E156-N171 PolarHBondContact O-OD1 2.9Å
157	S	68.8	Low	69.8	Low	40 Å²	40	79.9 Å²	79.9	28%	0.28	46%	0.463	S	S	.	.			trans	-92.5	153.9	168.1	57.6	0	0	0	0	110.3
158	F	66.9	Low	68	Low	53 Å²	53	81.3 Å²	81.3	23%	0.232	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-103.7	134.3	178.3	68.2	-90.8	0	0	0	111.6	V105 R106 D107	V105-F158 VanDerWaalsContact C-CE1 3.5Å; V105-F158 WeakPolarHBondContact O-CD1 3.33Å; V105-F158 WeakPolarHBondContact O-CE1 3.43Å; V105-F158 PolarHBondContact O-N 2.04Å; R106-F158 HydrophobicContact CB-CE1 3.91Å; R106-F158 HydrophobicContact CB-CE2 3.98Å; R106-F158 HydrophobicContact CB-CZ 3.54Å; R106-F158 HydrophobicContact CG-CD2 4.31Å; R106-F158 HydrophobicContact CG-CE2 3.72Å; R106-F158 HydrophobicContact CG-CZ 3.84Å; D107-F158 WeakPolarHBondContact CB-O 3.48Å; D107-F158 PolarHBondContact N-O 2.92Å
159	S	55.9	Low	66.7	Low	70 Å²	70	80.1 Å²	80.1	49%	0.49	47%	0.466	S	S	.	.			trans	-114.6	-15.6	-167.6	55.6	0	0	0	0	116	S110	S110-S159 WeakPolarHBondContact CB-O 3.37Å
160	Q	52.8	Low	66	Low	152 Å²	152	82.7 Å²	82.7	71%	0.71	48%	0.477	S	S	*	.			trans	-174.8	153	163.7	-112.7	166.2	27.3	0	0	110.7	D162	Q160-D162 PolarHBondContact O-N 2.92Å
161	V	53.5	Low	65.6	Low	103 Å²	103	80.3 Å²	80.3	62%	0.624	47%	0.465	S	S	*	.			trans	-74.1	119.3	176.3	-176.2	0	0	0	0	108.9
162	D	40.1	Very low	65.5	Low	109 Å²	109	81.6 Å²	81.6	58%	0.583	47%	0.472	S	S	*	.			trans	-62.8	153.4	168.5	-91	-23.2	0	0	0	111	Q160 T164 G165	Q160-D162 PolarHBondContact O-N 2.92Å; D162-T164 PolarHBondContact O-N 2.86Å; D162-G165 PolarHBondContact O-N 2.85Å
163	S	41.9	Very low	65.5	Low	134 Å²	134	83.2 Å²	83.2	94%	0.937	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	2.9	-173.2	-26.1	0	0	0	0	117.1
164	T	48.6	Very low	65.7	Low	122 Å²	122	83.9 Å²	83.9	75%	0.748	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	1.3	178.3	57.8	0	0	0	0	113.6	D162 K166	D162-T164 PolarHBondContact O-N 2.86Å; T164-K166 PolarHBondContact O-N 2.81Å
165	G	49	Very low	66.2	Low	61 Å²	61	86.2 Å²	86.2	63%	0.629	48%	0.482	S	S	*	.	S	Bend	trans	74.5	19.4	169.1	0	0	0	0	0	115.5	D162	D162-G165 PolarHBondContact O-N 2.85Å
166	K	53	Low	67	Low	152 Å²	152	82.7 Å²	82.7	66%	0.661	47%	0.467	S	S	*	.			trans	-145.6	90.2	-176.5	-144	-169.9	-168.9	-158.3	0	113.4	T164	T164-K166 PolarHBondContact O-N 2.81Å
167	V	51	Low	68.2	Low	66 Å²	66	78 Å²	78	40%	0.4	45%	0.445	S	S	.	.			trans	-151.6	95.7	152.5	-167.2	0	0	0	0	110.1	K169	V167-K169 HydrophobicContact CG1-CG 3.74Å
168	V	58.2	Low	69.1	Low	103 Å²	103	77.1 Å²	77.1	62%	0.624	44%	0.442	S	S	*	.			trans	-95.4	111.4	156.4	178.1	0	0	0	0	105.7	M170	V168-M170 PolarHBondContact O-N 2.9Å
169	K	68.7	Low	70.2	Confident	85 Å²	85	78 Å²	78	37%	0.37	45%	0.453	S	S	.	.			trans	-81.1	114.3	174.4	-71.7	-169.3	170.1	-166.4	0	109	S104 E156 V167	S104-K169 WeakPolarHBondContact CB-O 3.24Å; E156-K169 HydrophobicContact CB-CD 4.13Å; E156-K169 VanDerWaalsContact OE2-CD 3.32Å; E156-K169 WeakPolarHBondContact OE2-CD 3.22Å; E156-K169 WeakPolarHBondContact OE2-CE 3.41Å; E156-K169 IonicContact OE2-NZ 2.71Å; E156-K169 PolarHBondContact OE2-NZ 3.04Å; V167-K169 HydrophobicContact CG1-CG 3.74Å
170	M	80	Confident	71.8	Confident	87 Å²	87	74.8 Å²	74.8	43%	0.429	43%	0.43	S	S	.	.			trans	-88.2	121.1	-177.9	-166.5	68.1	60.8	0	0	110.5	R102 V168 V199	R102-M170 HydrophobicContact CB-CG 4.43Å; R102-M170 HydrophobicContact CB-SD 4.12Å; V168-M170 PolarHBondContact O-N 2.9Å; M170-V199 HydrophobicContact CE-CB 4.13Å; M170-V199 HydrophobicContact CE-CG1 3.88Å; M170-V199 HydrophobicContact CE-CG2 3.84Å; M170-V199 HydrophobicContact SD-CB 3.91Å; M170-V199 HydrophobicContact SD-CG1 4.19Å; M170-V199 HydrophobicContact SD-CG2 3.8Å
171	N	86.6	Confident	73.6	Confident	8 Å²	8	72.4 Å²	72.4	4%	0.043	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	140.7	173.3	-68.3	-90.8	0	0	0	109.7	R102 F103 D155 E156	R102-N171 VanDerWaalsContact CA-O 3.31Å; R102-N171 WeakPolarHBondContact CA-O 3.3Å; F103-N171 HydrophobicContact CD1-CB 4.19Å; F103-N171 HydrophobicContact CD2-CB 4.27Å; F103-N171 HydrophobicContact CE1-CB 3.83Å; F103-N171 HydrophobicContact CE2-CB 3.91Å; F103-N171 HydrophobicContact CG-CB 4.4Å; F103-N171 HydrophobicContact CZ-CB 3.67Å; F103-N171 PolarHBondContact N-O 3.12Å; F103-N171 WeakPolarHBondContact O-CA 3.37Å; F103-N171 WeakPolarHBondContact O-CB 3.36Å; F103-N171 PolarHBondContact O-N 2.72Å; D155-N171 PolarHBondContact N-OD1 2.89Å; E156-N171 PolarHBondContact N-OD1 2.94Å; E156-N171 PolarHBondContact O-ND2 3.19Å; E156-N171 PolarHBondContact O-OD1 2.9Å
172	V	91	Very high	75.5	Confident	76 Å²	76	70.4 Å²	70.4	46%	0.461	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120.2	174.7	-175.5	0	0	0	0	109.1	R100 L101 R102	R100-V172 HydrophobicContact CG-CG1 4.36Å; L101-V172 CarbonylContact O-C 3.52Å; L101-V172 VanDerWaalsContact O-CA 3.27Å; L101-V172 WeakPolarHBondContact O-CA 3.48Å; R102-V172 HydrophobicContact CG-CG2 4.25Å
173	K	92.6	Very high	78.1	Confident	33 Å²	33	72.1 Å²	72.1	14%	0.143	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.4	177.2	-69.3	-65.6	-168.2	-169.3	0	110.8	R100 L101 F103 I152 A153 D155	R100-K173 WeakPolarHBondContact CA-O 3.32Å; L101-K173 PolarHBondContact N-O 2.94Å; L101-K173 PolarHBondContact O-N 3.01Å; F103-K173 HydrophobicContact CE1-CB 4.08Å; F103-K173 HydrophobicContact CE1-CG 3.71Å; F103-K173 HydrophobicContact CZ-CG 4.04Å; I152-K173 HydrophobicContact CG2-CB 4.28Å; I152-K173 HydrophobicContact CG2-CG 4.05Å; A153-K173 VanDerWaalsContact O-CE 3.28Å; A153-K173 WeakPolarHBondContact O-CE 3.49Å; D155-K173 IonicContact OD1-NZ 3.87Å; D155-K173 PolarHBondContact OD1-NZ 2.79Å; D155-K173 WeakPolarHBondContact OD2-CE 3.36Å; D155-K173 IonicContact OD2-NZ 2.67Å; D155-K173 PolarHBondContact OD2-NZ 2.82Å
174	V	93.6	Very high	80.6	Confident	60 Å²	60	65.8 Å²	65.8	36%	0.364	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131	171.7	-175	0	0	0	0	109.1	H98 V99 R100	H98-V174 HydrophobicContact CB-CG1 4.39Å; V99-V174 CarbonylContact O-C 3.54Å; V99-V174 VanDerWaalsContact O-CA 3.29Å; V99-V174 WeakPolarHBondContact O-CA 3.48Å; R100-V174 HydrophobicContact CB-CG2 4.09Å; R100-V174 HydrophobicContact CG-CG2 4.1Å
175	R	94.3	Very high	82.8	Confident	72 Å²	72	60 Å²	60	27%	0.272	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	157.4	171.9	-68	-59.7	-179.9	-98.9	7.7	110.3	H98 V99 L124 V149 D150 I152	H98-R175 CarbonylContact C-O 3.56Å; H98-R175 VanDerWaalsContact CA-O 3.27Å; H98-R175 WeakPolarHBondContact CA-O 3.38Å; V99-R175 PolarHBondContact N-O 2.88Å; V99-R175 PolarHBondContact O-N 2.84Å; L124-R175 HydrophobicContact CD2-CB 4.22Å; V149-R175 HydrophobicContact CG1-CB 4.08Å; D150-R175 HydrophobicContact CB-CG 4.32Å; D150-R175 IonicContact OD2-CZ 2.88Å; D150-R175 IonicContact OD2-NE 2.77Å; D150-R175 PolarHBondContact OD2-NE 3.22Å; D150-R175 IonicContact OD2-NH2 3.89Å; D150-R175 PolarHBondContact OD2-NH2 2.99Å; D150-R175 VanDerWaalsContact OD2-NH2 3.07Å; I152-R175 HydrophobicContact CD1-CG 3.74Å
176	S	92.6	Very high	85.1	Confident	42 Å²	42	57.1 Å²	57.1	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149.4	177.2	70.3	0	0	0	0	110.9	R96 V97	R96-S176 PolarHBondContact NE-OG 2.9Å; V97-S176 CarbonylContact O-C 3.56Å; V97-S176 WeakPolarHBondContact O-CA 3.5Å; V97-S176 WeakPolarHBondContact O-CB 3.37Å
177	F	92.6	Very high	87.2	Confident	10 Å²	10	49.9 Å²	49.9	4%	0.044	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	158.5	176.5	60.6	-90.8	0	0	0	110.8	R96 V97 V99 Y126 V149 L180 F185 L187	R96-F177 WeakPolarHBondContact CG-O 3.25Å; V97-F177 HydrophobicContact CB-CE2 4.36Å; V97-F177 HydrophobicContact CB-CZ 4.13Å; V97-F177 HydrophobicContact CG1-CE1 4.4Å; V97-F177 HydrophobicContact CG1-CZ 4.11Å; V97-F177 PolarHBondContact N-O 2.85Å; V97-F177 PolarHBondContact O-N 3.17Å; V99-F177 HydrophobicContact CG2-CD1 4.34Å; V99-F177 HydrophobicContact CG2-CE1 3.57Å; V99-F177 HydrophobicContact CG2-CZ 4.48Å; Y126-F177 HydrophobicContact CD1-CB 4.3Å; Y126-F177 AromaticContact CD1-CD2 3.95Å; Y126-F177 HydrophobicContact CD1-CD2 3.95Å; Y126-F177 HydrophobicContact CD1-CG 4.07Å; Y126-F177 AromaticContact CD2-CD2 3.54Å; Y126-F177 HydrophobicContact CD2-CD2 3.54Å; Y126-F177 AromaticContact CD2-CE2 3.6Å; Y126-F177 HydrophobicContact CD2-CE2 3.6Å; Y126-F177 HydrophobicContact CD2-CG 4.45Å; Y126-F177 HydrophobicContact CE1-CB 4.08Å; Y126-F177 HydrophobicContact CE1-CD2 4.11Å; Y126-F177 HydrophobicContact CE1-CG 4.26Å; Y126-F177 AromaticContact CE2-CD2 3.72Å; Y126-F177 HydrophobicContact CE2-CD2 3.72Å; Y126-F177 HydrophobicContact CE2-CE2 4.17Å; Y126-F177 AromaticContact CG-CD2 3.66Å; Y126-F177 HydrophobicContact CG-CD2 3.66Å; Y126-F177 AromaticContact CG-CE2 3.8Å; Y126-F177 HydrophobicContact CG-CE2 3.8Å; Y126-F177 HydrophobicContact CG-CG 4.16Å; Y126-F177 HydrophobicContact CG-CZ 4.39Å; V149-F177 HydrophobicContact CG1-CB 4.34Å; V149-F177 HydrophobicContact CG1-CD1 4.28Å; V149-F177 HydrophobicContact CG2-CB 4.21Å; V149-F177 HydrophobicContact CG2-CD1 3.9Å; V149-F177 HydrophobicContact CG2-CG 4.18Å; F177-L180 HydrophobicContact CD2-CD2 3.87Å; F177-L180 HydrophobicContact CD2-CG 4.44Å; F177-L180 HydrophobicContact CE2-CD1 4.1Å; F177-L180 HydrophobicContact CE2-CD2 3.78Å; F177-L180 HydrophobicContact CE2-CG 4.34Å; F177-F185 HydrophobicContact CE2-CD2 4.08Å; F177-F185 HydrophobicContact CE2-CE2 4.23Å; F177-F185 HydrophobicContact CE2-CG 4.4Å; F177-F185 AromaticContact CZ-CD2 3.82Å; F177-F185 HydrophobicContact CZ-CD2 3.82Å; F177-F185 AromaticContact CZ-CE2 3.64Å; F177-F185 HydrophobicContact CZ-CE2 3.64Å; F177-F185 HydrophobicContact CZ-CZ 4.24Å; F177-L187 HydrophobicContact CE1-CD2 3.57Å; F177-L187 HydrophobicContact CZ-CD2 3.55Å
178	G	87.8	Confident	89.4	Confident	22 Å²	22	46.7 Å²	46.7	23%	0.227	25%	0.248	C	C	.	.			trans	153.4	179.3	-173.2	0	0	0	0	0	110.2
179	P	89.8	Confident	91.2	Very high	72 Å²	72	41.8 Å²	41.8	47%	0.468	22%	0.219	S	C	.	.			cis	-71.8	136.7	-0.5	29.5	-34.3	0	0	0	112	H95	H95-P179 CarbonylContact O-C 3.6Å; H95-P179 VanDerWaalsContact O-CA 3.28Å; H95-P179 WeakPolarHBondContact O-CA 3.29Å
180	L	90.8	Very high	92.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.203	C	C	.	.			trans	-89.7	132.6	175.3	-65	179.5	0	0	0	110.3	R91 H95 V97 Y126 Q128 F177 F185	R91-L180 HydrophobicContact CG-CB 4.26Å; R91-L180 HydrophobicContact CG-CD1 4.05Å; H95-L180 PolarHBondContact O-N 3.49Å; V97-L180 HydrophobicContact CB-CD1 4.1Å; V97-L180 HydrophobicContact CG2-CD1 3.45Å; V97-L180 VanDerWaalsContact CG2-CD1 3.45Å; Y126-L180 HydrophobicContact CD2-CD2 4.21Å; Y126-L180 HydrophobicContact CE2-CD2 3.85Å; Q128-L180 VanDerWaalsContact CD-CD2 3.43Å; Q128-L180 HydrophobicContact CG-CD2 3.76Å; F177-L180 HydrophobicContact CD2-CD2 3.87Å; F177-L180 HydrophobicContact CD2-CG 4.44Å; F177-L180 HydrophobicContact CE2-CD1 4.1Å; F177-L180 HydrophobicContact CE2-CD2 3.78Å; F177-L180 HydrophobicContact CE2-CG 4.34Å; L180-F185 HydrophobicContact CD1-CD1 3.76Å; L180-F185 HydrophobicContact CD1-CE1 3.79Å
181	T	90.5	Very high	93.2	Very high	101 Å²	101	34 Å²	34	62%	0.62	18%	0.183	S	C	*	.			trans	-117.7	-34.6	-172.7	50.9	0	0	0	0	112.5
182	Q	93.4	Very high	93.4	Very high	62 Å²	62	35.1 Å²	35.1	29%	0.29	19%	0.191	S	C	.	.	S	Bend	trans	-82.9	171.7	-177.4	-53.4	-170.2	6.9	0	0	112.3	R91 Q128 E130 G184	R91-Q182 WeakPolarHBondContact CD-O 3.48Å; R91-Q182 PolarHBondContact NE-O 3.47Å; Q128-Q182 HydrophobicContact CB-CB 4.08Å; Q128-Q182 HydrophobicContact CB-CG 3.97Å; Q128-Q182 PolarHBondContact O-OE1 3.43Å; E130-Q182 WeakPolarHBondContact OE1-CA 3.05Å; E130-Q182 WeakPolarHBondContact OE1-CB 3.38Å; E130-Q182 WeakPolarHBondContact OE1-CG 3.07Å; Q182-G184 VanDerWaalsContact C-N 3.31Å; Q182-G184 PolarHBondContact O-N 2.75Å
183	R	93.5	Very high	93.2	Very high	144 Å²	144	31.6 Å²	31.6	54%	0.543	17%	0.169	S	C	.	.	S	Bend	trans	-59.9	-33.7	-177.6	-173.5	176.8	172.1	168.7	-4.1	114.6	E90 R91 E130	E90-R183 IonicContact OE1-CZ 2.75Å; E90-R183 IonicContact OE1-NE 3.88Å; E90-R183 PolarHBondContact OE1-NE 3.13Å; E90-R183 IonicContact OE1-NH2 3.16Å; E90-R183 PolarHBondContact OE1-NH2 3.45Å; R91-R183 VanDerWaalsContact CB-O 3.29Å; R91-R183 WeakPolarHBondContact CB-O 3.2Å; R91-R183 PolarHBondContact N-O 3.37Å; E130-R183 WeakPolarHBondContact O-CB 3.23Å; E130-R183 WeakPolarHBondContact O-CD 3.04Å; E130-R183 PolarHBondContact OE2-N 3.05Å
184	G	94.8	Very high	93.1	Very high	1 Å²	1	30 Å²	30	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	-171.9	179.4	0	0	0	0	0	112.7	F88 I89 Q128 A129 Q182	F88-G184 VanDerWaalsContact CZ-CA 3.42Å; I89-G184 CarbonylContact O-C 3.47Å; I89-G184 WeakPolarHBondContact O-CA 3.44Å; Q128-G184 WeakPolarHBondContact CA-O 3.41Å; A129-G184 PolarHBondContact N-O 3.14Å; A129-G184 PolarHBondContact O-N 3.36Å; A129-G184 VanDerWaalsContact O-N 3.07Å; A129-G184 VanDerWaalsContact O-O 3.09Å; Q182-G184 VanDerWaalsContact C-N 3.31Å; Q182-G184 PolarHBondContact O-N 2.75Å
185	F	96.2	Very high	92.8	Very high	1 Å²	1	28 Å²	28	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	164.4	-176.3	60.2	-85.2	0	0	0	112.2	L34 I89 V97 H127 Q128 F177 L180 L187 V203	L34-F185 HydrophobicContact CD1-CE1 4.26Å; L34-F185 HydrophobicContact CD1-CZ 4.16Å; I89-F185 HydrophobicContact CB-CD2 4.42Å; I89-F185 HydrophobicContact CB-CE1 4.34Å; I89-F185 HydrophobicContact CB-CE2 4.03Å; I89-F185 HydrophobicContact CB-CZ 3.97Å; I89-F185 WeakPolarHBondContact CB-O 3.38Å; I89-F185 HydrophobicContact CD1-CD2 4.39Å; I89-F185 HydrophobicContact CD1-CE2 3.77Å; I89-F185 HydrophobicContact CD1-CZ 4.33Å; I89-F185 HydrophobicContact CG1-CE2 4.46Å; I89-F185 HydrophobicContact CG2-CE1 4.11Å; I89-F185 HydrophobicContact CG2-CE2 4.17Å; I89-F185 HydrophobicContact CG2-CZ 3.68Å; I89-F185 PolarHBondContact N-O 2.9Å; I89-F185 PolarHBondContact O-N 3.02Å; V97-F185 HydrophobicContact CB-CZ 4.31Å; V97-F185 HydrophobicContact CG1-CE2 4.43Å; V97-F185 HydrophobicContact CG1-CZ 3.85Å; V97-F185 HydrophobicContact CG2-CE1 3.98Å; V97-F185 HydrophobicContact CG2-CZ 4.03Å; H127-F185 CarbonylContact O-C 3.51Å; H127-F185 WeakPolarHBondContact O-CA 3.34Å; H127-F185 WeakPolarHBondContact O-CB 3.27Å; Q128-F185 HydrophobicContact CG-CB 4.31Å; F177-F185 HydrophobicContact CE2-CD2 4.08Å; F177-F185 HydrophobicContact CE2-CE2 4.23Å; F177-F185 HydrophobicContact CE2-CG 4.4Å; F177-F185 AromaticContact CZ-CD2 3.82Å; F177-F185 HydrophobicContact CZ-CD2 3.82Å; F177-F185 AromaticContact CZ-CE2 3.64Å; F177-F185 HydrophobicContact CZ-CE2 3.64Å; F177-F185 HydrophobicContact CZ-CZ 4.24Å; L180-F185 HydrophobicContact CD1-CD1 3.76Å; L180-F185 HydrophobicContact CD1-CE1 3.79Å; F185-L187 HydrophobicContact CD2-CD2 4.15Å; F185-L187 HydrophobicContact CD2-CG 4.41Å; F185-L187 HydrophobicContact CE2-CD2 4.09Å; F185-L187 HydrophobicContact CE2-CG 4.21Å; F185-V203 HydrophobicContact CE2-CG1 4.17Å; F185-V203 HydrophobicContact CZ-CG1 3.91Å
186	Y	96.3	Very high	92.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	149.7	168.5	-50.6	-91.1	0	0	0	109.4	F88 Y126 H127 A129 A131 D132 V133 A134	F88-Y186 HydrophobicContact CB-CD1 4.29Å; F88-Y186 HydrophobicContact CB-CE1 3.56Å; F88-Y186 AromaticContact CD2-CE1 3.93Å; F88-Y186 HydrophobicContact CD2-CE1 3.93Å; F88-Y186 AromaticContact CD2-CE2 3.84Å; F88-Y186 HydrophobicContact CD2-CE2 3.84Å; F88-Y186 AromaticContact CD2-CZ 3.5Å; F88-Y186 WeakPolarHBondContact CD2-OH 3.25Å; F88-Y186 HydrophobicContact CE2-CE2 4.48Å; F88-Y186 HydrophobicContact CG-CE1 4.25Å; Y126-Y186 CarbonylContact C-O 3.52Å; Y126-Y186 WeakPolarHBondContact CA-O 3.39Å; H127-Y186 HydrophobicContact CB-CD2 4.49Å; H127-Y186 PolarHBondContact N-O 3.28Å; H127-Y186 PolarHBondContact O-N 3.17Å; A129-Y186 HydrophobicContact CB-CE2 3.81Å; A131-Y186 PolarHBondContact O-OH 2.83Å; D132-Y186 VanDerWaalsContact CA-OH 3.26Å; D132-Y186 WeakPolarHBondContact CA-OH 3.47Å; D132-Y186 PolarHBondContact OD1-OH 3.02Å; D132-Y186 VanDerWaalsContact OD1-OH 3.1Å; V133-Y186 HydrophobicContact CG2-CE2 4.49Å; V133-Y186 PolarHBondContact N-OH 3.14Å; A134-Y186 HydrophobicContact CB-CD1 4.32Å; A134-Y186 HydrophobicContact CB-CE1 3.49Å; A134-Y186 VanDerWaalsContact CB-CE1 3.49Å; A134-Y186 PolarHBondContact N-OH 2.85Å
187	L	97.4	Very high	92.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	146.4	164.1	-58.7	177.3	0	0	0	109.5	R85 T86 I89 V99 Y125 F177 F185 F189 V201 V203	R85-L187 WeakPolarHBondContact CA-O 3.26Å; T86-L187 HydrophobicContact CG2-CB 3.74Å; T86-L187 PolarHBondContact N-O 3.01Å; T86-L187 PolarHBondContact OG1-N 2.9Å; I89-L187 HydrophobicContact CD1-CD1 4.29Å; I89-L187 HydrophobicContact CD1-CG 4.23Å; V99-L187 HydrophobicContact CG1-CD1 4.03Å; V99-L187 HydrophobicContact CG2-CD1 3.79Å; V99-L187 HydrophobicContact CG2-CD2 4.22Å; Y125-L187 WeakPolarHBondContact O-CA 3.38Å; F177-L187 HydrophobicContact CE1-CD2 3.57Å; F177-L187 HydrophobicContact CZ-CD2 3.55Å; F185-L187 HydrophobicContact CD2-CD2 4.15Å; F185-L187 HydrophobicContact CD2-CG 4.41Å; F185-L187 HydrophobicContact CE2-CD2 4.09Å; F185-L187 HydrophobicContact CE2-CG 4.21Å; L187-F189 HydrophobicContact CB-CE2 4.46Å; L187-V201 HydrophobicContact CD1-CG1 4.49Å; L187-V203 HydrophobicContact CD1-CG2 3.56Å
188	A	96.7	Very high	92.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146	170.9	0	0	0	0	0	112.1	W83 L84 Y125 W146	W83-A188 HydrophobicContact CE3-CB 4.03Å; W83-A188 HydrophobicContact CZ3-CB 4.29Å; L84-A188 CarbonylContact O-C 3.47Å; L84-A188 WeakPolarHBondContact O-CA 3.5Å; Y125-A188 PolarHBondContact N-O 2.88Å; Y125-A188 PolarHBondContact O-N 3.38Å; W146-A188 HydrophobicContact CD2-CB 4.15Å; W146-A188 HydrophobicContact CE3-CB 3.65Å; W146-A188 HydrophobicContact CH2-CB 3.88Å; W146-A188 HydrophobicContact CZ2-CB 4.3Å; W146-A188 HydrophobicContact CZ3-CB 3.5Å; W146-A188 VanDerWaalsContact CZ3-CB 3.5Å
189	F	96.9	Very high	92.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.2	-179.7	-53.8	-89	0	0	0	108.3	W46 W54 W83 L84 T86 L101 F122 T123 L124 L187 L198 V201	W46-F189 HydrophobicContact CE3-CE2 4.31Å; W46-F189 HydrophobicContact CH2-CE2 4.13Å; W46-F189 HydrophobicContact CZ3-CD2 4.21Å; W46-F189 AromaticContact CZ3-CE2 3.56Å; W46-F189 HydrophobicContact CZ3-CE2 3.56Å; W46-F189 HydrophobicContact CZ3-CZ 4.32Å; W54-F189 HydrophobicContact CZ2-CB 4.36Å; W83-F189 CarbonylContact C-O 3.56Å; W83-F189 WeakPolarHBondContact CA-O 3.47Å; L84-F189 HydrophobicContact CB-CB 4.3Å; L84-F189 HydrophobicContact CB-CD2 4.47Å; L84-F189 HydrophobicContact CD2-CD2 4.23Å; L84-F189 HydrophobicContact CG-CD2 4.34Å; L84-F189 PolarHBondContact N-O 3.47Å; L84-F189 PolarHBondContact O-N 3Å; T86-F189 HydrophobicContact CG2-CE2 4.16Å; L101-F189 HydrophobicContact CD1-CE1 4.46Å; L101-F189 HydrophobicContact CD2-CE1 3.64Å; L101-F189 HydrophobicContact CD2-CZ 4.1Å; F122-F189 HydrophobicContact CD2-CD1 4.25Å; F122-F189 AromaticContact CE2-CD1 3.89Å; F122-F189 HydrophobicContact CE2-CD1 3.89Å; T123-F189 WeakPolarHBondContact O-CA 3.46Å; L124-F189 HydrophobicContact CD1-CD1 3.95Å; L124-F189 HydrophobicContact CD1-CE1 3.57Å; L124-F189 HydrophobicContact CD1-CZ 4.06Å; L187-F189 HydrophobicContact CB-CE2 4.46Å; F189-L198 HydrophobicContact CD1-CD2 4.03Å; F189-L198 HydrophobicContact CD2-CD2 4.09Å; F189-L198 HydrophobicContact CE1-CD2 4.02Å; F189-L198 HydrophobicContact CE2-CD2 4.1Å; F189-L198 HydrophobicContact CG-CD2 4.06Å; F189-L198 HydrophobicContact CZ-CD2 4.07Å; F189-V201 HydrophobicContact CE1-CG2 4.42Å; F189-V201 HydrophobicContact CE2-CG2 4.48Å; F189-V201 HydrophobicContact CZ-CG1 4.11Å; F189-V201 HydrophobicContact CZ-CG2 3.82Å
190	Q	95.6	Very high	92.8	Very high	9 Å²	9	20 Å²	20	4%	0.042	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.8	-179.6	-173.5	-163.5	32	0	0	109.8	N81 N82 W83 F122 T123 Y125	N81-Q190 PolarHBondContact OD1-NE2 2.91Å; N82-Q190 CarbonylContact O-C 3.56Å; N82-Q190 WeakPolarHBondContact O-CA 3.49Å; W83-Q190 HydrophobicContact CD2-CB 4.2Å; W83-Q190 HydrophobicContact CD2-CG 4.14Å; W83-Q190 HydrophobicContact CE3-CB 4.31Å; W83-Q190 HydrophobicContact CH2-CB 4.4Å; W83-Q190 HydrophobicContact CH2-CG 4.43Å; W83-Q190 HydrophobicContact CZ2-CB 4.3Å; W83-Q190 HydrophobicContact CZ2-CG 3.86Å; W83-Q190 VanDerWaalsContact CZ2-NE2 3.31Å; W83-Q190 HydrophobicContact CZ3-CB 4.41Å; F122-Q190 CarbonylContact C-O 3.55Å; F122-Q190 WeakPolarHBondContact CA-O 3.23Å; F122-Q190 WeakPolarHBondContact CB-O 3.46Å; T123-Q190 PolarHBondContact N-O 2.89Å; T123-Q190 PolarHBondContact O-N 2.81Å; Y125-Q190 HydrophobicContact CD2-CB 4.16Å; Y125-Q190 HydrophobicContact CE2-CB 3.83Å; Y125-Q190 VanDerWaalsContact CE2-OE1 3.29Å; Y125-Q190 PolarHBondContact OH-OE1 3.13Å
191	D	94.1	Very high	93	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141.5	168	166.3	57	0	0	0	110.6	W54 V72 N81 N82 G193 A194	W54-D191 HydrophobicContact CZ2-CB 3.87Å; V72-D191 HydrophobicContact CG1-CB 4.01Å; V72-D191 HydrophobicContact CG2-CB 4.37Å; V72-D191 WeakPolarHBondContact CG2-OD2 3.37Å; N81-D191 WeakPolarHBondContact CA-O 3.39Å; N82-D191 HydrophobicContact CB-CB 4.18Å; N82-D191 PolarHBondContact N-O 3Å; N82-D191 PolarHBondContact ND2-OD2 2.93Å; N82-D191 PolarHBondContact O-N 2.86Å; D191-G193 PolarHBondContact OD1-N 3.35Å; D191-G193 PolarHBondContact OD2-N 3.16Å; D191-A194 WeakPolarHBondContact OD1-CA 3.33Å; D191-A194 VanDerWaalsContact OD1-CB 3.29Å; D191-A194 WeakPolarHBondContact OD1-CB 3.5Å; D191-A194 PolarHBondContact OD1-N 2.91Å
192	S	90.3	Very high	93.3	Very high	31 Å²	31	16.4 Å²	16.4	22%	0.217	8%	0.08	C	C	.	.	S	Bend	trans	-125.7	27.9	178	-48.2	0	0	0	0	112.8	Q80	Q80-S192 WeakPolarHBondContact O-CA 3.47Å
193	G	88.1	Confident	93.4	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.01	7%	0.066	C	C	.	.	S	Bend	trans	116.2	35.7	177	0	0	0	0	0	114.4	C118 K119 D191	C118-G193 WeakPolarHBondContact CA-O 3.37Å; K119-G193 PolarHBondContact N-O 3.42Å; D191-G193 PolarHBondContact OD1-N 3.35Å; D191-G193 PolarHBondContact OD2-N 3.16Å
194	A	89.1	Confident	93.5	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.04	C	C	.	.	B	Isolated β-bridge	trans	-97.3	162.8	172.1	0	0	0	0	0	112.2	K119 D191	K119-A194 WeakPolarHBondContact O-CA 3.43Å; K119-A194 WeakPolarHBondContact O-CB 3.19Å; D191-A194 WeakPolarHBondContact OD1-CA 3.33Å; D191-A194 VanDerWaalsContact OD1-CB 3.29Å; D191-A194 WeakPolarHBondContact OD1-CB 3.5Å; D191-A194 PolarHBondContact OD1-N 2.91Å
195	C	88.8	Confident	93.3	Very high	17 Å²	17	6.7 Å²	6.7	12%	0.115	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	101.2	168.8	-168.9	0	0	0	0	108.9	V72 C73 V75 R106	V72-C195 CarbonylContact O-C 3.38Å; V72-C195 WeakPolarHBondContact O-CA 3.45Å; C73-C195 HydrophobicContact CB-CB 3.96Å; C73-C195 WeakPolarHBondContact CB-SG 3.31Å; C73-C195 WeakPolarHBondContact SG-CB 3.47Å; C73-C195 CovalentContact SG-SG 2.05Å; C73-C195 PolarHBondContact SG-SG 3.29Å; V75-C195 HydrophobicContact CG1-CB 3.79Å; R106-C195 HydrophobicContact CB-CB 4.12Å; R106-C195 PolarHBondContact N-O 3.12Å
196	M	90.8	Very high	93.1	Very high	9 Å²	9	8.5 Å²	8.5	4%	0.044	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	158.1	-170.2	66	171.7	-73	0	0	113.7	W54 V72 F103 S104 V105 F122 L198	W54-M196 HydrophobicContact CH2-CE 3.7Å; W54-M196 HydrophobicContact CH2-CG 3.97Å; W54-M196 HydrophobicContact CH2-SD 3.71Å; W54-M196 HydrophobicContact CZ2-SD 4.37Å; W54-M196 HydrophobicContact CZ3-CE 4.41Å; W54-M196 HydrophobicContact CZ3-CG 4.42Å; V72-M196 HydrophobicContact CG1-CG 3.58Å; V72-M196 HydrophobicContact CG1-SD 4.5Å; V72-M196 PolarHBondContact N-O 2.94Å; V72-M196 PolarHBondContact O-N 2.86Å; F103-M196 HydrophobicContact CB-CE 4.42Å; F103-M196 HydrophobicContact CD2-CE 4.48Å; S104-M196 CarbonylContact O-C 3.55Å; S104-M196 WeakPolarHBondContact O-CA 3.22Å; S104-M196 VanDerWaalsContact O-CB 3.29Å; S104-M196 WeakPolarHBondContact O-CB 3.4Å; V105-M196 HydrophobicContact CG2-CB 3.99Å; F122-M196 HydrophobicContact CB-CE 4.34Å; F122-M196 HydrophobicContact CB-SD 3.56Å; F122-M196 VanDerWaalsContact CB-SD 3.56Å; F122-M196 HydrophobicContact CD1-CE 3.28Å; F122-M196 HydrophobicContact CD1-SD 3.34Å; F122-M196 WeakPolarHBondContact CD1-SD 3.45Å; F122-M196 HydrophobicContact CD2-CE 4.17Å; F122-M196 HydrophobicContact CD2-SD 4.48Å; F122-M196 HydrophobicContact CE1-CE 3.4Å; F122-M196 VanDerWaalsContact CE1-CE 3.4Å; F122-M196 HydrophobicContact CE1-SD 4.1Å; F122-M196 HydrophobicContact CE2-CE 4.28Å; F122-M196 HydrophobicContact CG-CE 3.68Å; F122-M196 HydrophobicContact CG-SD 3.55Å; F122-M196 VanDerWaalsContact CG-SD 3.55Å; F122-M196 HydrophobicContact CZ-CE 3.9Å; M196-L198 HydrophobicContact CE-CB 4.49Å
197	S	91.1	Very high	92.8	Very high	12 Å²	12	10 Å²	10	8%	0.084	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	118.2	174.5	-179.5	0	0	0	0	109.2	F70 E71 F103 S104	F70-S197 CarbonylContact O-C 3.57Å; F70-S197 WeakPolarHBondContact O-CA 3.38Å; E71-S197 WeakPolarHBondContact CG-OG 3.09Å; E71-S197 WeakPolarHBondContact OE1-CB 3.34Å; E71-S197 PolarHBondContact OE1-OG 3.5Å; F103-S197 CarbonylContact C-O 3.36Å; F103-S197 WeakPolarHBondContact CA-O 3.26Å; F103-S197 WeakPolarHBondContact CB-O 3.28Å; S104-S197 PolarHBondContact N-O 3.14Å; S104-S197 PolarHBondContact O-N 3.47Å
198	L	92.9	Very high	92.4	Very high	3 Å²	3	10 Å²	10	2%	0.016	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	106.6	174.1	-176.4	63.9	0	0	0	108.8	W46 W54 T69 F70 L84 L101 F103 F189 M196 V201	W46-L198 HydrophobicContact CZ3-CD2 4.29Å; W54-L198 HydrophobicContact CZ3-CB 4.24Å; T69-L198 WeakPolarHBondContact CB-O 3.41Å; F70-L198 HydrophobicContact CB-CB 4.35Å; F70-L198 PolarHBondContact N-O 2.95Å; F70-L198 PolarHBondContact O-N 2.74Å; L84-L198 HydrophobicContact CD2-CD2 4.23Å; L101-L198 HydrophobicContact CD2-CD1 4.4Å; F103-L198 HydrophobicContact CB-CD1 4.12Å; F189-L198 HydrophobicContact CD1-CD2 4.03Å; F189-L198 HydrophobicContact CD2-CD2 4.09Å; F189-L198 HydrophobicContact CE1-CD2 4.02Å; F189-L198 HydrophobicContact CE2-CD2 4.1Å; F189-L198 HydrophobicContact CG-CD2 4.06Å; F189-L198 HydrophobicContact CZ-CD2 4.07Å; M196-L198 HydrophobicContact CE-CB 4.49Å; L198-V201 HydrophobicContact CD1-CG2 3.95Å; L198-V201 HydrophobicContact CD2-CG2 3.82Å; L198-V201 HydrophobicContact CG-CG2 3.97Å
199	V	90.1	Very high	92.2	Very high	22 Å²	22	11 Å²	11	13%	0.133	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-38.9	-165.6	177.9	0	0	0	0	112.4	I67 T69 R102 M170	I67-V199 HydrophobicContact CD1-CG1 3.76Å; T69-V199 HydrophobicContact CG2-CB 4.29Å; T69-V199 HydrophobicContact CG2-CG1 4.11Å; T69-V199 HydrophobicContact CG2-CG2 4.35Å; R102-V199 HydrophobicContact CB-CB 4.46Å; R102-V199 WeakPolarHBondContact O-CA 3.17Å; R102-V199 WeakPolarHBondContact O-CB 3.39Å; R102-V199 PolarHBondContact O-N 3.31Å; M170-V199 HydrophobicContact CE-CB 4.13Å; M170-V199 HydrophobicContact CE-CG1 3.88Å; M170-V199 HydrophobicContact CE-CG2 3.84Å; M170-V199 HydrophobicContact SD-CB 3.91Å; M170-V199 HydrophobicContact SD-CG1 4.19Å; M170-V199 HydrophobicContact SD-CG2 3.8Å
200	A	91.7	Very high	91.9	Very high	4 Å²	4	14 Å²	14	3%	0.033	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	145.9	174.1	0	0	0	0	0	111.4	R102	R102-A200 HydrophobicContact CB-CB 4.04Å; R102-A200 HydrophobicContact CG-CB 4.28Å; R102-A200 PolarHBondContact N-O 3Å; R102-A200 PolarHBondContact O-N 3.1Å; R102-A200 VanDerWaalsContact O-N 3.08Å
201	V	95.3	Very high	91.6	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.006	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.7	173.9	-179.6	0	0	0	0	107.6	T37 W46 V99 L101 L187 F189 L198 V203	T37-V201 PolarHBondContact N-O 3.48Å; T37-V201 PolarHBondContact OG1-N 2.84Å; T37-V201 PolarHBondContact OG1-O 2.95Å; W46-V201 HydrophobicContact CH2-CB 3.8Å; W46-V201 HydrophobicContact CH2-CG1 4.21Å; W46-V201 HydrophobicContact CH2-CG2 3.71Å; W46-V201 HydrophobicContact CZ3-CG2 4.13Å; V99-V201 HydrophobicContact CG1-CG1 3.92Å; L101-V201 HydrophobicContact CD2-CB 4.37Å; L101-V201 HydrophobicContact CD2-CG1 4.01Å; L101-V201 HydrophobicContact CD2-CG2 3.84Å; L187-V201 HydrophobicContact CD1-CG1 4.49Å; F189-V201 HydrophobicContact CE1-CG2 4.42Å; F189-V201 HydrophobicContact CE2-CG2 4.48Å; F189-V201 HydrophobicContact CZ-CG1 4.11Å; F189-V201 HydrophobicContact CZ-CG2 3.82Å; L198-V201 HydrophobicContact CD1-CG2 3.95Å; L198-V201 HydrophobicContact CD2-CG2 3.82Å; L198-V201 HydrophobicContact CG-CG2 3.97Å; V201-V203 HydrophobicContact CG1-CG2 4.17Å
202	Q	96.6	Very high	91.3	Very high	27 Å²	27	17.2 Å²	17.2	13%	0.126	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.8	174.5	-170.4	179.6	47.7	0	0	109.2	I33 L35 D36 V99 R100	I33-Q202 HydrophobicContact CD1-CG 4.05Å; I33-Q202 HydrophobicContact CG2-CG 4.41Å; L35-Q202 CarbonylContact O-C 3.59Å; L35-Q202 WeakPolarHBondContact O-CA 3.18Å; D36-Q202 HydrophobicContact CB-CG 4.15Å; D36-Q202 PolarHBondContact OD2-NE2 3.24Å; V99-Q202 CarbonylContact C-O 3.54Å; V99-Q202 WeakPolarHBondContact CA-O 3.43Å; R100-Q202 HydrophobicContact CB-CB 4.3Å; R100-Q202 PolarHBondContact N-O 2.89Å; R100-Q202 PolarHBondContact O-N 3.14Å
203	V	96.1	Very high	91	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.5	-177.5	-172.2	0	0	0	0	107.7	L34 L35 I89 V97 H98 V99 F185 L187 V201	L34-V203 HydrophobicContact CB-CB 4.42Å; L34-V203 HydrophobicContact CB-CG1 4.24Å; L34-V203 HydrophobicContact CD1-CG1 4.37Å; L34-V203 PolarHBondContact N-O 2.82Å; L35-V203 HydrophobicContact CB-CB 3.9Å; L35-V203 HydrophobicContact CB-CG2 3.89Å; L35-V203 HydrophobicContact CD2-CG2 4Å; L35-V203 HydrophobicContact CG-CG2 4.31Å; L35-V203 PolarHBondContact N-O 3.23Å; L35-V203 PolarHBondContact O-N 3.31Å; I89-V203 HydrophobicContact CD1-CG2 4.21Å; V97-V203 HydrophobicContact CG1-CG1 3.16Å; H98-V203 CarbonylContact O-C 3.56Å; H98-V203 VanDerWaalsContact O-CA 3.3Å; H98-V203 WeakPolarHBondContact O-CA 3.46Å; V99-V203 HydrophobicContact CG1-CG2 4.48Å; V99-V203 HydrophobicContact CG2-CG1 4.47Å; V99-V203 HydrophobicContact CG2-CG2 4.41Å; F185-V203 HydrophobicContact CE2-CG1 4.17Å; F185-V203 HydrophobicContact CZ-CG1 3.91Å; L187-V203 HydrophobicContact CD1-CG2 3.56Å; V201-V203 HydrophobicContact CG1-CG2 4.17Å
204	F	93.9	Very high	90.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	166.3	-174.6	67.8	-83.5	0	0	0	111.9	E31 E32 I33 H98 R100 Y206	E31-F204 HydrophobicContact CB-CD2 3.91Å; E31-F204 HydrophobicContact CB-CE2 4.47Å; E31-F204 HydrophobicContact CG-CD2 3.73Å; E31-F204 HydrophobicContact CG-CE2 3.79Å; E32-F204 CarbonylContact O-C 3.55Å; E32-F204 WeakPolarHBondContact O-CA 3.28Å; E32-F204 VanDerWaalsContact O-CB 3.29Å; E32-F204 WeakPolarHBondContact O-CB 3.43Å; I33-F204 HydrophobicContact CD1-CB 3.64Å; I33-F204 HydrophobicContact CD1-CG 4.39Å; H98-F204 HydrophobicContact CB-CD1 4.12Å; H98-F204 HydrophobicContact CB-CD2 4.14Å; H98-F204 HydrophobicContact CB-CE1 3.7Å; H98-F204 HydrophobicContact CB-CE2 3.73Å; H98-F204 HydrophobicContact CB-CG 4.32Å; H98-F204 HydrophobicContact CB-CZ 3.49Å; H98-F204 VanDerWaalsContact CB-CZ 3.49Å; H98-F204 PolarHBondContact N-O 3.15Å; H98-F204 PolarHBondContact O-N 2.79Å; R100-F204 HydrophobicContact CB-CE1 3.99Å; R100-F204 VanDerWaalsContact NH2-CZ 3.29Å; F204-Y206 AromaticContact CE2-CE1 3.9Å; F204-Y206 HydrophobicContact CE2-CE1 3.9Å; F204-Y206 HydrophobicContact CE2-CE2 4.08Å; F204-Y206 AromaticContact CE2-CZ 3.62Å
205	F	92.3	Very high	90.9	Very high	4 Å²	4	22 Å²	22	2%	0.018	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	162	171.4	70.7	-81	0	0	0	111.1	E32 L34 A94 R96 F222	E32-F205 HydrophobicContact CB-CD1 4.03Å; E32-F205 HydrophobicContact CB-CE1 3.54Å; E32-F205 HydrophobicContact CB-CE2 4.26Å; E32-F205 HydrophobicContact CB-CZ 3.67Å; E32-F205 VanDerWaalsContact CD-CZ 3.46Å; E32-F205 HydrophobicContact CG-CD1 4.47Å; E32-F205 HydrophobicContact CG-CE1 3.58Å; E32-F205 HydrophobicContact CG-CZ 3.76Å; E32-F205 PolarHBondContact N-O 2.77Å; E32-F205 WeakPolarHBondContact O-CD1 3.47Å; E32-F205 PolarHBondContact O-N 3Å; L34-F205 HydrophobicContact CD1-CD1 4.16Å; L34-F205 HydrophobicContact CD2-CD1 3.88Å; L34-F205 HydrophobicContact CD2-CE1 3.76Å; L34-F205 HydrophobicContact CG-CD1 3.98Å; L34-F205 HydrophobicContact CG-CE1 4.36Å; A94-F205 HydrophobicContact CB-CB 3.64Å; A94-F205 HydrophobicContact CB-CD1 3.6Å; A94-F205 HydrophobicContact CB-CD2 3.85Å; A94-F205 HydrophobicContact CB-CE1 4.17Å; A94-F205 HydrophobicContact CB-CE2 4.4Å; A94-F205 HydrophobicContact CB-CG 3.41Å; A94-F205 VanDerWaalsContact CB-CG 3.41Å; R96-F205 VanDerWaalsContact O-CB 3.28Å; R96-F205 WeakPolarHBondContact O-CB 3.4Å; F205-F222 AromaticContact CE2-CD1 3.74Å; F205-F222 HydrophobicContact CE2-CD1 3.74Å; F205-F222 HydrophobicContact CE2-CE1 4.07Å; F205-F222 HydrophobicContact CZ-CD1 4.44Å; F205-F222 HydrophobicContact CZ-CE1 4.33Å
206	Y	90.4	Very high	90.9	Very high	39 Å²	39	21.2 Å²	21.2	15%	0.153	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	141.8	-179.1	-70.8	-63	0	0	0	112	S29 E31 H98 F204 A223	S29-Y206 WeakPolarHBondContact OG-CE1 3.29Å; E31-Y206 HydrophobicContact CG-CD1 4.08Å; E31-Y206 HydrophobicContact CG-CE1 3.63Å; H98-Y206 AromaticContact CD2-CD2 3.84Å; H98-Y206 AromaticContact CD2-CE2 3.93Å; H98-Y206 AromaticContact CE1-CD2 3.83Å; H98-Y206 AromaticContact CE1-CE2 3.53Å; H98-Y206 AromaticContact ND1-CE2 3.79Å; H98-Y206 AromaticContact NE2-CD2 3.48Å; H98-Y206 WeakPolarHBondContact NE2-CD2 3.47Å; H98-Y206 AromaticContact NE2-CE2 3.65Å; F204-Y206 AromaticContact CE2-CE1 3.9Å; F204-Y206 HydrophobicContact CE2-CE1 3.9Å; F204-Y206 HydrophobicContact CE2-CE2 4.08Å; F204-Y206 AromaticContact CE2-CZ 3.62Å; Y206-A223 WeakPolarHBondContact O-CB 3.44Å; Y206-A223 PolarHBondContact O-N 3.34Å; Y206-A223 VanDerWaalsContact O-N 3.16Å
207	K	90.2	Very high	90.9	Very high	30 Å²	30	23.4 Å²	23.4	13%	0.13	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.4	165.1	63.6	-176.8	171.3	177.4	0	111.1	L30 E32 E220 F222	L30-K207 HydrophobicContact CB-CG 3.81Å; L30-K207 HydrophobicContact CD2-CD 4.15Å; L30-K207 HydrophobicContact CD2-CG 4.12Å; L30-K207 HydrophobicContact CG-CD 4.45Å; L30-K207 HydrophobicContact CG-CG 4.09Å; L30-K207 PolarHBondContact N-O 3.13Å; L30-K207 VanDerWaalsContact N-O 3.12Å; L30-K207 PolarHBondContact O-N 3Å; E32-K207 WeakPolarHBondContact OE2-CD 3.31Å; E32-K207 WeakPolarHBondContact OE2-CE 3.46Å; E32-K207 IonicContact OE2-NZ 3.86Å; E32-K207 PolarHBondContact OE2-NZ 3.18Å; K207-E220 IonicContact NZ-OE2 3.57Å; K207-F222 HydrophobicContact CB-CD1 4.33Å
208	C	90.6	Very high	91	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.3	169.6	-67	0	0	0	0	108.9	E220 T221 C256 G260 E261 W262	C208-E220 WeakPolarHBondContact O-CA 3.47Å; C208-T221 PolarHBondContact N-O 2.88Å; C208-T221 PolarHBondContact O-N 3.19Å; C208-C256 HydrophobicContact CB-CB 3.84Å; C208-C256 WeakPolarHBondContact CB-SG 3.4Å; C208-C256 WeakPolarHBondContact SG-CA 3.34Å; C208-C256 WeakPolarHBondContact SG-CB 3.45Å; C208-C256 CovalentContact SG-SG 2.03Å; C208-C256 PolarHBondContact SG-SG 3.45Å; C208-G260 PolarHBondContact SG-O 2.67Å; C208-G260 VanDerWaalsContact SG-O 3.37Å; C208-E261 VanDerWaalsContact SG-C 3.56Å; C208-W262 HydrophobicContact CB-CD2 3.81Å; C208-W262 VanDerWaalsContact CB-CE2 3.45Å; C208-W262 HydrophobicContact CB-CE3 4.23Å; C208-W262 HydrophobicContact CB-CG 4.34Å; C208-W262 HydrophobicContact CB-CH2 4.09Å; C208-W262 HydrophobicContact CB-CZ2 3.61Å; C208-W262 HydrophobicContact CB-CZ3 4.37Å
209	P	91.1	Very high	90.9	Very high	23 Å²	23	26.2 Å²	26.2	15%	0.149	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-74.5	158	-178.1	32.5	-36.9	0	0	0	111.3	V27 L30 V211 W262	V27-P209 HydrophobicContact CG1-CG 3.11Å; L30-P209 HydrophobicContact CD2-CB 4.41Å; P209-V211 PolarHBondContact O-N 3.02Å; P209-W262 PolarHBondContact O-NE1 3.25Å
210	A	90.4	Very high	91	Very high	63 Å²	63	30.5 Å²	30.5	52%	0.521	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-60.1	131.8	176.9	0	0	0	0	0	110.7	F218 E220	A210-F218 VanDerWaalsContact CA-O 3.31Å; A210-F218 WeakPolarHBondContact CA-O 3.31Å; A210-E220 HydrophobicContact CB-CG 3.93Å
211	V	89.4	Confident	90.9	Very high	27 Å²	27	31.1 Å²	31.1	16%	0.164	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	147.3	-174.8	70	0	0	0	0	111	V27 P209 F218 L254 W262	V27-V211 HydrophobicContact CG2-CG2 4.46Å; P209-V211 PolarHBondContact O-N 3.02Å; V211-F218 HydrophobicContact CG1-CB 4.15Å; V211-F218 HydrophobicContact CG1-CD2 4.2Å; V211-F218 PolarHBondContact N-O 3.11Å; V211-F218 PolarHBondContact O-N 3.5Å; V211-L254 HydrophobicContact CG1-CD1 4.03Å; V211-W262 HydrophobicContact CG1-CD2 4.38Å; V211-W262 HydrophobicContact CG1-CG 4.3Å; V211-W262 HydrophobicContact CG1-CZ2 4.39Å
212	V	88.3	Confident	90.7	Very high	49 Å²	49	35.8 Å²	35.8	30%	0.297	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.3	165.1	-177.5	0	0	0	0	107.4	A216 V238 R282	V212-A216 CarbonylContact C-O 3.54Å; V212-A216 VanDerWaalsContact CA-O 3.27Å; V212-A216 WeakPolarHBondContact CA-O 3.24Å; V212-V238 HydrophobicContact CG1-CG1 3.79Å; V212-R282 HydrophobicContact CB-CG 4.45Å; V212-R282 HydrophobicContact CG1-CB 4.22Å; V212-R282 HydrophobicContact CG1-CG 4.36Å
213	K	83.3	Confident	90.2	Very high	114 Å²	114	34.9 Å²	34.9	50%	0.496	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	133.5	-177.9	-167.4	173.8	-177.4	179	0	109.9	F215 A216 F218	K213-F215 VanDerWaalsContact C-N 3.33Å; K213-F215 PolarHBondContact O-N 2.79Å; K213-A216 PolarHBondContact N-O 3.22Å; K213-A216 PolarHBondContact O-N 2.75Å; K213-A216 VanDerWaalsContact O-N 3.13Å; K213-F218 HydrophobicContact CB-CE2 4.35Å
214	G	85.6	Confident	89.6	Confident	15 Å²	15	35.1 Å²	35.1	16%	0.155	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	45.2	-179.3	0	0	0	0	0	113.1	A216 C269	G214-A216 PolarHBondContact O-N 3.46Å; G214-A216 VanDerWaalsContact O-N 3.09Å; G214-C269 PolarHBondContact O-N 2.66Å
215	F	89.6	Confident	88.8	Confident	3 Å²	3	35.7 Å²	35.7	1%	0.013	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	21	-177.2	-50.5	-81.5	0	0	0	115.2	K213 C237 V238 A241 C269 P277 E281	K213-F215 VanDerWaalsContact C-N 3.33Å; K213-F215 PolarHBondContact O-N 2.79Å; F215-C237 WeakPolarHBondContact O-CA 3.26Å; F215-V238 HydrophobicContact CB-CG2 3.95Å; F215-V238 HydrophobicContact CD1-CG2 4.39Å; F215-V238 WeakPolarHBondContact O-CG1 3.37Å; F215-V238 WeakPolarHBondContact O-CG2 3.15Å; F215-V238 PolarHBondContact O-N 2.89Å; F215-A241 HydrophobicContact CB-CB 4.17Å; F215-C269 HydrophobicContact CB-CB 3.82Å; F215-C269 VanDerWaalsContact CD2-O 3.24Å; F215-C269 WeakPolarHBondContact CD2-O 3.12Å; F215-C269 WeakPolarHBondContact O-CB 3.12Å; F215-P277 HydrophobicContact CE1-CB 3.6Å; F215-P277 HydrophobicContact CE2-CB 4.46Å; F215-P277 HydrophobicContact CZ-CB 3.31Å; F215-E281 WeakPolarHBondContact CD1-O 2.97Å; F215-E281 HydrophobicContact CD2-CB 4.31Å; F215-E281 VanDerWaalsContact CE1-CA 3.44Å; F215-E281 HydrophobicContact CE1-CB 4.04Å; F215-E281 HydrophobicContact CE2-CB 3.76Å; F215-E281 HydrophobicContact CE2-CG 3.87Å; F215-E281 VanDerWaalsContact CZ-CA 3.44Å; F215-E281 HydrophobicContact CZ-CB 3.57Å; F215-E281 HydrophobicContact CZ-CG 3.73Å; F215-E281 PolarHBondContact N-O 2.85Å; F215-E281 VanDerWaalsContact N-O 3.07Å
216	A	89.8	Confident	88.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.1	173.3	0	0	0	0	0	110.7	V212 K213 G214 F218 T236 V252	V212-A216 CarbonylContact C-O 3.54Å; V212-A216 VanDerWaalsContact CA-O 3.27Å; V212-A216 WeakPolarHBondContact CA-O 3.24Å; K213-A216 PolarHBondContact N-O 3.22Å; K213-A216 PolarHBondContact O-N 2.75Å; K213-A216 VanDerWaalsContact O-N 3.13Å; G214-A216 PolarHBondContact O-N 3.46Å; G214-A216 VanDerWaalsContact O-N 3.09Å; A216-F218 HydrophobicContact CB-CD2 4.48Å; A216-F218 HydrophobicContact CB-CE2 3.64Å; A216-F218 HydrophobicContact CB-CZ 3.74Å; A216-F218 WeakPolarHBondContact O-CD2 3.16Å; A216-F218 VanDerWaalsContact O-CE2 3.31Å; A216-F218 WeakPolarHBondContact O-CE2 3.5Å; A216-T236 CarbonylContact C-O 3.56Å; A216-T236 WeakPolarHBondContact CA-O 3.07Å; A216-V252 HydrophobicContact CB-CB 4.32Å; A216-V252 HydrophobicContact CB-CG1 3.64Å
217	S	91.2	Very high	86.9	Confident	56 Å²	56	47.8 Å²	47.8	39%	0.392	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132	174.4	-178.3	0	0	0	0	110.2	G235 T236	S217-G235 WeakPolarHBondContact O-CA 3.42Å; S217-T236 PolarHBondContact N-O 3.49Å; S217-T236 PolarHBondContact O-N 3.14Å
218	F	91.6	Very high	86.2	Confident	3 Å²	3	52.2 Å²	52.2	1%	0.013	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131	-179.2	-56.7	-93.5	0	0	0	109.8	A210 V211 K213 A216 G235 V252 L254 W262	A210-F218 VanDerWaalsContact CA-O 3.31Å; A210-F218 WeakPolarHBondContact CA-O 3.31Å; V211-F218 HydrophobicContact CG1-CB 4.15Å; V211-F218 HydrophobicContact CG1-CD2 4.2Å; V211-F218 PolarHBondContact N-O 3.11Å; V211-F218 PolarHBondContact O-N 3.5Å; K213-F218 HydrophobicContact CB-CE2 4.35Å; A216-F218 HydrophobicContact CB-CD2 4.48Å; A216-F218 HydrophobicContact CB-CE2 3.64Å; A216-F218 HydrophobicContact CB-CZ 3.74Å; A216-F218 WeakPolarHBondContact O-CD2 3.16Å; A216-F218 VanDerWaalsContact O-CE2 3.31Å; A216-F218 WeakPolarHBondContact O-CE2 3.5Å; F218-G235 VanDerWaalsContact CD1-CA 3.42Å; F218-G235 VanDerWaalsContact CE1-CA 3.42Å; F218-V252 HydrophobicContact CE1-CG1 4.14Å; F218-V252 HydrophobicContact CZ-CG1 3.68Å; F218-L254 HydrophobicContact CB-CD1 4.2Å; F218-L254 HydrophobicContact CD1-CB 3.69Å; F218-L254 HydrophobicContact CD1-CD1 3.69Å; F218-L254 HydrophobicContact CD1-CG 3.91Å; F218-L254 HydrophobicContact CD2-CD1 3.25Å; F218-L254 HydrophobicContact CD2-CG 4.22Å; F218-L254 HydrophobicContact CE1-CB 3.66Å; F218-L254 HydrophobicContact CE1-CD1 3.71Å; F218-L254 HydrophobicContact CE1-CG 3.58Å; F218-L254 HydrophobicContact CE2-CD1 3.26Å; F218-L254 HydrophobicContact CE2-CG 3.92Å; F218-L254 HydrophobicContact CG-CB 4.25Å; F218-L254 HydrophobicContact CG-CD1 3.45Å; F218-L254 VanDerWaalsContact CG-CD1 3.45Å; F218-L254 HydrophobicContact CG-CG 4.2Å; F218-L254 HydrophobicContact CZ-CB 4.19Å; F218-L254 HydrophobicContact CZ-CD1 3.47Å; F218-L254 VanDerWaalsContact CZ-CD1 3.47Å; F218-L254 HydrophobicContact CZ-CG 3.56Å; F218-W262 HydrophobicContact CB-CH2 4.34Å; F218-W262 HydrophobicContact CB-CZ2 4.3Å
219	P	92.3	Very high	85.6	Confident	71 Å²	71	53.5 Å²	53.5	46%	0.461	29%	0.292	S	S	.	.			trans	-75	166.6	-178.7	32.2	-35.9	0	0	0	112.5	T221 W262	P219-T221 PolarHBondContact O-N 3.41Å; P219-T221 PolarHBondContact O-OG1 3.09Å; P219-T221 VanDerWaalsContact O-OG1 3.12Å; P219-W262 WeakPolarHBondContact O-CZ2 3.26Å
220	E	91.6	Very high	85.3	Confident	111 Å²	111	56.7 Å²	56.7	52%	0.519	31%	0.307	S	S	.	.			trans	-56.6	133.2	168.5	-64.6	-171	179.6	0	0	110.3	K207 C208 A210	K207-E220 IonicContact NZ-OE2 3.57Å; C208-E220 WeakPolarHBondContact O-CA 3.47Å; A210-E220 HydrophobicContact CB-CG 3.93Å
221	T	90.4	Very high	85.1	Confident	18 Å²	18	56 Å²	56	11%	0.11	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.2	-174.3	-56.7	0	0	0	0	110.3	C208 P219 V231 S233 C256 W262	C208-T221 PolarHBondContact N-O 2.88Å; C208-T221 PolarHBondContact O-N 3.19Å; P219-T221 PolarHBondContact O-N 3.41Å; P219-T221 PolarHBondContact O-OG1 3.09Å; P219-T221 VanDerWaalsContact O-OG1 3.12Å; T221-V231 HydrophobicContact CG2-CB 4.32Å; T221-V231 HydrophobicContact CG2-CG1 3.71Å; T221-S233 WeakPolarHBondContact OG1-CB 3.37Å; T221-S233 PolarHBondContact OG1-OG 2.96Å; T221-C256 HydrophobicContact CG2-CB 4.11Å; T221-W262 WeakPolarHBondContact OG1-CH2 3.45Å
222	F	90	Very high	85	Confident	98 Å²	98	59.6 Å²	59.6	43%	0.43	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	138.8	178.2	-58.7	-50.5	0	0	0	111.4	F205 K207	F205-F222 AromaticContact CE2-CD1 3.74Å; F205-F222 HydrophobicContact CE2-CD1 3.74Å; F205-F222 HydrophobicContact CE2-CE1 4.07Å; F205-F222 HydrophobicContact CZ-CD1 4.44Å; F205-F222 HydrophobicContact CZ-CE1 4.33Å; K207-F222 HydrophobicContact CB-CD1 4.33Å
223	A	87.2	Confident	85.1	Confident	9 Å²	9	57.3 Å²	57.3	7%	0.074	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-66.8	145.2	174.9	0	0	0	0	0	111	Y206 N257	Y206-A223 WeakPolarHBondContact O-CB 3.44Å; Y206-A223 PolarHBondContact O-N 3.34Å; Y206-A223 VanDerWaalsContact O-N 3.16Å; A223-N257 VanDerWaalsContact CB-O 3.31Å; A223-N257 WeakPolarHBondContact CB-O 3.43Å
224	G	83.6	Confident	85.4	Confident	5 Å²	5	56 Å²	56	5%	0.052	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-73.4	165.5	-176.9	0	0	0	0	0	113.9	E226 S229	G224-E226 PolarHBondContact O-N 2.76Å; G224-S229 WeakPolarHBondContact CA-OG 3.3Å
225	G	75.6	Confident	85.6	Confident	11 Å²	11	55.9 Å²	55.9	11%	0.113	30%	0.3	C	S	.	.	S	Bend	trans	-71.6	-26.7	-174.4	0	0	0	0	0	114.8	H95 R96	H95-G225 VanDerWaalsContact CB-CA 3.47Å; R96-G225 PolarHBondContact NH1-O 2.04Å
226	E	77.9	Confident	85.6	Confident	118 Å²	118	60.7 Å²	60.7	55%	0.551	33%	0.329	S	S	*	.	S	Bend	trans	-101.5	151	-178.8	-59.7	-176.5	170.2	0	0	111.5	G224 T228 S229	G224-E226 PolarHBondContact O-N 2.76Å; E226-T228 PolarHBondContact O-N 2.88Å; E226-S229 PolarHBondContact N-OG 2.95Å; E226-S229 WeakPolarHBondContact O-CB 3.03Å; E226-S229 PolarHBondContact O-N 3.37Å; E226-S229 PolarHBondContact O-OG 2.82Å
227	R	66.4	Low	85.7	Confident	180 Å²	180	62.3 Å²	62.3	68%	0.679	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-28.9	-174.9	-163	175.8	-177	-172.6	-0.8	112.3	E259	R227-E259 IonicContact NE-OE1 3.91Å; R227-E259 IonicContact NH2-OE1 2.96Å
228	T	74.7	Confident	85.7	Confident	123 Å²	123	60.9 Å²	60.9	76%	0.755	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	0.7	176.6	48.2	0	0	0	0	113.2	E226	E226-T228 PolarHBondContact O-N 2.88Å
229	S	77.5	Confident	85.6	Confident	26 Å²	26	64.4 Å²	64.4	18%	0.182	36%	0.359	C	S	.	.			trans	-67.8	137.4	-179.8	62	0	0	0	0	111.1	G224 E226 G258	G224-S229 WeakPolarHBondContact CA-OG 3.3Å; E226-S229 PolarHBondContact N-OG 2.95Å; E226-S229 WeakPolarHBondContact O-CB 3.03Å; E226-S229 PolarHBondContact O-N 3.37Å; E226-S229 PolarHBondContact O-OG 2.82Å; S229-G258 PolarHBondContact O-N 2.87Å
230	L	84.1	Confident	85.6	Confident	91 Å²	91	64 Å²	64	48%	0.476	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	112.5	173.4	-70.5	176.1	0	0	0	107.3	H255 C256 N257 M263	L230-H255 HydrophobicContact CB-CB 4.14Å; L230-H255 HydrophobicContact CD2-CB 4.19Å; L230-C256 WeakPolarHBondContact CA-O 3.45Å; L230-N257 HydrophobicContact CD2-CB 3.98Å; L230-M263 HydrophobicContact CD2-CB 4.19Å; L230-M263 HydrophobicContact CD2-CG 4.05Å
231	V	87.1	Confident	85.5	Confident	47 Å²	47	59.1 Å²	59.1	29%	0.285	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.4	176.9	-178.4	0	0	0	0	108.4	T221 H255 C256	T221-V231 HydrophobicContact CG2-CB 4.32Å; T221-V231 HydrophobicContact CG2-CG1 3.71Å; V231-H255 CarbonylContact O-C 3.49Å; V231-H255 WeakPolarHBondContact O-CA 3.35Å; V231-C256 HydrophobicContact CB-CB 4.42Å; V231-C256 PolarHBondContact N-O 2.98Å; V231-C256 PolarHBondContact O-N 3.49Å
232	E	87.7	Confident	85.5	Confident	103 Å²	103	61.9 Å²	61.9	48%	0.481	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	128.7	176.6	-175.8	178.4	142.3	0	0	110.5	R253	E232-R253 HydrophobicContact CG-CB 4.38Å; E232-R253 HydrophobicContact CG-CG 4.26Å; E232-R253 WeakPolarHBondContact OE1-CD 3.46Å; E232-R253 IonicContact OE1-NE 2.71Å; E232-R253 IonicContact OE1-NH1 3.89Å; E232-R253 PolarHBondContact OE1-NH1 2.84Å; E232-R253 IonicContact OE2-NH1 3.66Å
233	S	89.3	Confident	85.3	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.014	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.9	174.1	-166.5	0	0	0	0	109.8	T221 R253 L254	T221-S233 WeakPolarHBondContact OG1-CB 3.37Å; T221-S233 PolarHBondContact OG1-OG 2.96Å; S233-R253 WeakPolarHBondContact O-CA 3.41Å; S233-L254 PolarHBondContact N-O 3.04Å; S233-L254 PolarHBondContact O-N 2.84Å
234	P	90.4	Very high	84.7	Confident	86 Å²	86	62.6 Å²	62.6	56%	0.558	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	133.6	178.9	28.8	-33.1	0	0	0	110.9
235	G	89.2	Confident	83.5	Confident	13 Å²	13	68.2 Å²	68.2	13%	0.134	39%	0.389	C	S	.	.			trans	-96.2	147.8	175.8	0	0	0	0	0	112.1	S217 F218 V252	S217-G235 WeakPolarHBondContact O-CA 3.42Å; F218-G235 VanDerWaalsContact CD1-CA 3.42Å; F218-G235 VanDerWaalsContact CE1-CA 3.42Å; G235-V252 WeakPolarHBondContact CA-O 3.39Å; G235-V252 PolarHBondContact N-O 3.29Å
236	T	90.8	Very high	82.4	Confident	103 Å²	103	73.8 Å²	73.8	63%	0.632	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.3	172.3	-56.5	0	0	0	0	109.7	A216 S217 V238	A216-T236 CarbonylContact C-O 3.56Å; A216-T236 WeakPolarHBondContact CA-O 3.07Å; S217-T236 PolarHBondContact N-O 3.49Å; S217-T236 PolarHBondContact O-N 3.14Å; T236-V238 PolarHBondContact O-N 2.79Å
237	C	90.8	Very high	80.9	Confident	34 Å²	34	72.5 Å²	72.5	23%	0.23	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	137.5	176.4	-63.9	0	0	0	0	111.3	F215 A241 C269	F215-C237 WeakPolarHBondContact O-CA 3.26Å; C237-A241 HydrophobicContact CB-CB 4.22Å; C237-C269 WeakPolarHBondContact CA-SG 3.41Å; C237-C269 HydrophobicContact CB-CB 3.74Å; C237-C269 WeakPolarHBondContact CB-SG 3.48Å; C237-C269 WeakPolarHBondContact SG-CB 3.31Å; C237-C269 CovalentContact SG-SG 2.03Å; C237-C269 PolarHBondContact SG-SG 3.02Å
238	V	91.4	Very high	80.1	Confident	26 Å²	26	68.7 Å²	68.7	16%	0.158	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-63.9	162.5	174	-59.3	0	0	0	0	110.6	V212 F215 T236 N240 A241	V212-V238 HydrophobicContact CG1-CG1 3.79Å; F215-V238 HydrophobicContact CB-CG2 3.95Å; F215-V238 HydrophobicContact CD1-CG2 4.39Å; F215-V238 WeakPolarHBondContact O-CG1 3.37Å; F215-V238 WeakPolarHBondContact O-CG2 3.15Å; F215-V238 PolarHBondContact O-N 2.89Å; T236-V238 PolarHBondContact O-N 2.79Å; V238-N240 PolarHBondContact O-N 3.02Å; V238-A241 HydrophobicContact CG2-CB 3.9Å; V238-A241 WeakPolarHBondContact O-CB 3.33Å; V238-A241 PolarHBondContact O-N 2.71Å
239	A	90.4	Very high	79	Confident	77 Å²	77	64.9 Å²	64.9	64%	0.636	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	136.9	179.6	0	0	0	0	0	111.5	A241	A239-A241 PolarHBondContact O-N 3.38Å
240	N	91.5	Very high	78	Confident	63 Å²	63	68.9 Å²	68.9	34%	0.337	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	17.3	-177.4	-42	-58.4	0	0	0	115.4	V238 K272 Y275 C284	V238-N240 PolarHBondContact O-N 3.02Å; N240-K272 WeakPolarHBondContact O-CB 3.41Å; N240-K272 WeakPolarHBondContact O-CG 3.41Å; N240-K272 PolarHBondContact O-N 2.86Å; N240-Y275 HydrophobicContact CB-CD1 3.44Å; N240-Y275 VanDerWaalsContact CB-CD1 3.44Å; N240-Y275 HydrophobicContact CB-CD2 4.06Å; N240-Y275 HydrophobicContact CB-CE1 3.55Å; N240-Y275 HydrophobicContact CB-CE2 4.16Å; N240-Y275 HydrophobicContact CB-CG 3.72Å; N240-Y275 WeakPolarHBondContact ND2-CE1 3.39Å; N240-C284 HydrophobicContact CB-CB 4.1Å
241	A	90.6	Very high	77.3	Confident	9 Å²	9	65.4 Å²	65.4	7%	0.074	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	160	165.8	0	0	0	0	0	111.2	F215 C237 V238 A239 C269 T270 K272	F215-A241 HydrophobicContact CB-CB 4.17Å; C237-A241 HydrophobicContact CB-CB 4.22Å; V238-A241 HydrophobicContact CG2-CB 3.9Å; V238-A241 WeakPolarHBondContact O-CB 3.33Å; V238-A241 PolarHBondContact O-N 2.71Å; A239-A241 PolarHBondContact O-N 3.38Å; A241-C269 HydrophobicContact CB-CB 4.05Å; A241-T270 CarbonylContact C-O 3.45Å; A241-T270 WeakPolarHBondContact CA-O 3.46Å; A241-T270 WeakPolarHBondContact CB-O 2.92Å; A241-K272 WeakPolarHBondContact O-CE 3.32Å
242	E	89.4	Confident	77.3	Confident	76 Å²	76	63.4 Å²	63.4	36%	0.355	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161.2	172	60.1	-176.3	-142.4	0	0	111.7	A244 C269 T270 K272 V296	E242-A244 PolarHBondContact O-N 3.19Å; E242-C269 CarbonylContact O-C 3.59Å; E242-C269 VanDerWaalsContact O-CA 3.24Å; E242-C269 WeakPolarHBondContact O-CA 3.32Å; E242-T270 PolarHBondContact N-O 2.85Å; E242-T270 PolarHBondContact O-N 3.35Å; E242-K272 HydrophobicContact CB-CG 4.24Å; E242-K272 HydrophobicContact CG-CG 3.92Å; E242-K272 WeakPolarHBondContact OE2-CE 3.48Å; E242-V296 HydrophobicContact CG-CG1 3.66Å; E242-V296 HydrophobicContact CG-CG2 4.28Å; E242-V296 WeakPolarHBondContact OE1-CG1 3.47Å; E242-V296 WeakPolarHBondContact OE1-CG2 3.46Å
243	E	86.6	Confident	77.3	Confident	98 Å²	98	61.5 Å²	61.5	46%	0.458	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129	179.5	-63.6	-173.2	178.7	0	0	110.4	S245 V252	E243-S245 PolarHBondContact O-N 3.34Å; E243-V252 HydrophobicContact CG-CG2 4.39Å
244	A	73.6	Confident	77.3	Confident	23 Å²	23	61.5 Å²	61.5	19%	0.19	41%	0.406	C	S	.	.			trans	-68.4	105.4	176.7	0	0	0	0	0	109.9	E242 T246 R268 T270	E242-A244 PolarHBondContact O-N 3.19Å; A244-T246 PolarHBondContact O-N 3.09Å; A244-R268 HydrophobicContact CB-CG 4.07Å; A244-R268 PolarHBondContact N-O 3.12Å; A244-R268 VanDerWaalsContact N-O 3.1Å; A244-T270 HydrophobicContact CB-CG2 4.12Å
245	S	58.1	Low	77.2	Confident	123 Å²	123	58.5 Å²	58.5	86%	0.86	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	43	-172	60.4	0	0	0	0	114.7	E243	E243-S245 PolarHBondContact O-N 3.34Å
246	T	53.5	Low	77.2	Confident	128 Å²	128	57.9 Å²	57.9	79%	0.785	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	-13.6	-172.1	-27.3	0	0	0	0	113.6	A244	A244-T246 PolarHBondContact O-N 3.09Å
247	T	46.8	Very low	77	Confident	92 Å²	92	54 Å²	54	56%	0.564	35%	0.354	S	S	*	.	S	Bend	trans	-128.1	128.3	177.3	53	0	0	0	0	109	S249	T247-S249 PolarHBondContact O-N 3.34Å
248	G	48.3	Very low	76.5	Confident	100 Å²	100	52.6 Å²	52.6	100%	1.031	35%	0.345	S	S	*	.	S	Bend	trans	-63.4	26.8	-178.5	0	0	0	0	0	116.4
249	S	51.4	Low	76.1	Confident	43 Å²	43	55.4 Å²	55.4	30%	0.301	36%	0.356	S	S	.	.			trans	-95.4	118.3	170.4	65.9	0	0	0	0	109.6	T247 G251	T247-S249 PolarHBondContact O-N 3.34Å; S249-G251 PolarHBondContact O-N 2.96Å
250	S	57.5	Low	75.8	Confident	109 Å²	109	51.7 Å²	51.7	76%	0.762	33%	0.326	S	S	*	.			trans	-65.1	124.3	169.4	-179.4	0	0	0	0	110.3	R253	S250-R253 PolarHBondContact O-NH2 3.33Å
251	G	70.1	Confident	75.5	Confident	18 Å²	18	52.6 Å²	52.6	19%	0.186	33%	0.328	C	S	.	.	S	Bend	trans	84.2	146.2	166.5	0	0	0	0	0	117.1	S249	S249-G251 PolarHBondContact O-N 2.96Å
252	V	85.5	Confident	75.4	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.036	33%	0.33	C	S	.	.			trans	-85.1	130.4	174.3	-178.1	0	0	0	0	110.4	A216 F218 G235 E243 I266	A216-V252 HydrophobicContact CB-CB 4.32Å; A216-V252 HydrophobicContact CB-CG1 3.64Å; F218-V252 HydrophobicContact CE1-CG1 4.14Å; F218-V252 HydrophobicContact CZ-CG1 3.68Å; G235-V252 WeakPolarHBondContact CA-O 3.39Å; G235-V252 PolarHBondContact N-O 3.29Å; E243-V252 HydrophobicContact CG-CG2 4.39Å; V252-I266 CarbonylContact C-O 3.5Å; V252-I266 WeakPolarHBondContact CA-O 3.46Å
253	R	88.1	Confident	75.1	Confident	63 Å²	63	54.1 Å²	54.1	24%	0.238	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	145.2	-172.9	-69.5	173.1	-80.6	-169.5	-3.9	112.4	E232 S233 S250 A265 I266	E232-R253 HydrophobicContact CG-CB 4.38Å; E232-R253 HydrophobicContact CG-CG 4.26Å; E232-R253 WeakPolarHBondContact OE1-CD 3.46Å; E232-R253 IonicContact OE1-NE 2.71Å; E232-R253 IonicContact OE1-NH1 3.89Å; E232-R253 PolarHBondContact OE1-NH1 2.84Å; E232-R253 IonicContact OE2-NH1 3.66Å; S233-R253 WeakPolarHBondContact O-CA 3.41Å; S250-R253 PolarHBondContact O-NH2 3.33Å; R253-A265 CarbonylContact O-C 3.55Å; R253-A265 WeakPolarHBondContact O-CA 3.42Å; R253-I266 HydrophobicContact CB-CB 4.49Å; R253-I266 PolarHBondContact N-O 2.82Å; R253-I266 PolarHBondContact O-N 3.37Å
254	L	88.8	Confident	74.6	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153.5	170	-91.3	171	0	0	0	109.6	V211 F218 S233 W262 A265	V211-L254 HydrophobicContact CG1-CD1 4.03Å; F218-L254 HydrophobicContact CB-CD1 4.2Å; F218-L254 HydrophobicContact CD1-CB 3.69Å; F218-L254 HydrophobicContact CD1-CD1 3.69Å; F218-L254 HydrophobicContact CD1-CG 3.91Å; F218-L254 HydrophobicContact CD2-CD1 3.25Å; F218-L254 HydrophobicContact CD2-CG 4.22Å; F218-L254 HydrophobicContact CE1-CB 3.66Å; F218-L254 HydrophobicContact CE1-CD1 3.71Å; F218-L254 HydrophobicContact CE1-CG 3.58Å; F218-L254 HydrophobicContact CE2-CD1 3.26Å; F218-L254 HydrophobicContact CE2-CG 3.92Å; F218-L254 HydrophobicContact CG-CB 4.25Å; F218-L254 HydrophobicContact CG-CD1 3.45Å; F218-L254 VanDerWaalsContact CG-CD1 3.45Å; F218-L254 HydrophobicContact CG-CG 4.2Å; F218-L254 HydrophobicContact CZ-CB 4.19Å; F218-L254 HydrophobicContact CZ-CD1 3.47Å; F218-L254 VanDerWaalsContact CZ-CD1 3.47Å; F218-L254 HydrophobicContact CZ-CG 3.56Å; S233-L254 PolarHBondContact N-O 3.04Å; S233-L254 PolarHBondContact O-N 2.84Å; L254-W262 HydrophobicContact CB-CD2 4.45Å; L254-W262 HydrophobicContact CB-CE3 3.61Å; L254-W262 HydrophobicContact CB-CZ3 3.67Å; L254-W262 HydrophobicContact CD1-CD2 4.31Å; L254-W262 HydrophobicContact CD1-CE3 4.28Å; L254-W262 HydrophobicContact CG-CE3 4.39Å; L254-A265 HydrophobicContact CD2-CB 3.78Å; L254-A265 HydrophobicContact CG-CB 4.43Å
255	H	89.1	Confident	74.7	Confident	24 Å²	24	55.3 Å²	55.3	11%	0.111	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.2	179.7	-65.4	79.2	0	0	0	110.6	L230 V231 M263 V264	L230-H255 HydrophobicContact CB-CB 4.14Å; L230-H255 HydrophobicContact CD2-CB 4.19Å; V231-H255 CarbonylContact O-C 3.49Å; V231-H255 WeakPolarHBondContact O-CA 3.35Å; H255-M263 PolarHBondContact O-N 3.29Å; H255-V264 PolarHBondContact N-O 3.42Å; H255-V264 PolarHBondContact ND1-O 3.04Å
256	C	89.3	Confident	75.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125.3	173.9	-175.2	0	0	0	0	109.8	C208 T221 L230 V231 W262	C208-C256 HydrophobicContact CB-CB 3.84Å; C208-C256 WeakPolarHBondContact CB-SG 3.4Å; C208-C256 WeakPolarHBondContact SG-CA 3.34Å; C208-C256 WeakPolarHBondContact SG-CB 3.45Å; C208-C256 CovalentContact SG-SG 2.03Å; C208-C256 PolarHBondContact SG-SG 3.45Å; T221-C256 HydrophobicContact CG2-CB 4.11Å; L230-C256 WeakPolarHBondContact CA-O 3.45Å; V231-C256 HydrophobicContact CB-CB 4.42Å; V231-C256 PolarHBondContact N-O 2.98Å; V231-C256 PolarHBondContact O-N 3.49Å; C256-W262 HydrophobicContact CB-CE3 4.22Å; C256-W262 HydrophobicContact CB-CZ3 4.01Å
257	N	85.5	Confident	76.7	Confident	21 Å²	21	48 Å²	48	11%	0.112	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	173.5	178	73.4	12.7	0	0	0	112.7	A223 L230 E259 G260 E261 M263	A223-N257 VanDerWaalsContact CB-O 3.31Å; A223-N257 WeakPolarHBondContact CB-O 3.43Å; L230-N257 HydrophobicContact CD2-CB 3.98Å; N257-E259 PolarHBondContact O-N 2.97Å; N257-E259 VanDerWaalsContact O-N 3.09Å; N257-E259 WeakPolarHBondContact OD1-CA 3.47Å; N257-E259 PolarHBondContact OD1-N 3.17Å; N257-G260 PolarHBondContact O-N 3.49Å; N257-G260 PolarHBondContact OD1-N 3.11Å; N257-E261 PolarHBondContact N-O 2.86Å; N257-E261 PolarHBondContact OD1-N 2.85Å; N257-E261 PolarHBondContact OD1-O 3.16Å; N257-M263 HydrophobicContact CB-CG 3.77Å; N257-M263 PolarHBondContact ND2-SD 3.4Å
258	G	81.6	Confident	78.4	Confident	4 Å²	4	49.6 Å²	49.6	4%	0.041	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-7.9	177.8	0	0	0	0	0	115.9	S229	S229-G258 PolarHBondContact O-N 2.87Å
259	E	82.6	Confident	80.4	Confident	85 Å²	85	44.9 Å²	44.9	40%	0.397	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	6.1	179.8	-63.2	-178.1	176.2	0	0	112	S29 R227 N257	S29-E259 WeakPolarHBondContact CB-O 3.39Å; S29-E259 PolarHBondContact OG-O 3.02Å; R227-E259 IonicContact NE-OE1 3.91Å; R227-E259 IonicContact NH2-OE1 2.96Å; N257-E259 PolarHBondContact O-N 2.97Å; N257-E259 VanDerWaalsContact O-N 3.09Å; N257-E259 WeakPolarHBondContact OD1-CA 3.47Å; N257-E259 PolarHBondContact OD1-N 3.17Å
260	G	83.8	Confident	82.2	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	79.1	22	176.6	0	0	0	0	0	114.7	S29 C208 N257	S29-G260 WeakPolarHBondContact CB-O 3.42Å; C208-G260 PolarHBondContact SG-O 2.67Å; C208-G260 VanDerWaalsContact SG-O 3.37Å; N257-G260 PolarHBondContact O-N 3.49Å; N257-G260 PolarHBondContact OD1-N 3.11Å
261	E	86.4	Confident	83.9	Confident	81 Å²	81	37.8 Å²	37.8	38%	0.379	20%	0.202	S	C	.	.			trans	-104.3	141.1	176.6	-55.1	-175.5	148	0	0	111.9	C208 N257 M263	C208-E261 VanDerWaalsContact SG-C 3.56Å; N257-E261 PolarHBondContact N-O 2.86Å; N257-E261 PolarHBondContact OD1-N 2.85Å; N257-E261 PolarHBondContact OD1-O 3.16Å; E261-M263 PolarHBondContact O-N 3.22Å
262	W	87.4	Confident	85	Confident	33 Å²	33	40.9 Å²	40.9	13%	0.125	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.2	173.5	-73.3	118	0	0	0	111.1	C208 P209 V211 F218 P219 T221 L254 C256	C208-W262 HydrophobicContact CB-CD2 3.81Å; C208-W262 VanDerWaalsContact CB-CE2 3.45Å; C208-W262 HydrophobicContact CB-CE3 4.23Å; C208-W262 HydrophobicContact CB-CG 4.34Å; C208-W262 HydrophobicContact CB-CH2 4.09Å; C208-W262 HydrophobicContact CB-CZ2 3.61Å; C208-W262 HydrophobicContact CB-CZ3 4.37Å; P209-W262 PolarHBondContact O-NE1 3.25Å; V211-W262 HydrophobicContact CG1-CD2 4.38Å; V211-W262 HydrophobicContact CG1-CG 4.3Å; V211-W262 HydrophobicContact CG1-CZ2 4.39Å; F218-W262 HydrophobicContact CB-CH2 4.34Å; F218-W262 HydrophobicContact CB-CZ2 4.3Å; P219-W262 WeakPolarHBondContact O-CZ2 3.26Å; T221-W262 WeakPolarHBondContact OG1-CH2 3.45Å; L254-W262 HydrophobicContact CB-CD2 4.45Å; L254-W262 HydrophobicContact CB-CE3 3.61Å; L254-W262 HydrophobicContact CB-CZ3 3.67Å; L254-W262 HydrophobicContact CD1-CD2 4.31Å; L254-W262 HydrophobicContact CD1-CE3 4.28Å; L254-W262 HydrophobicContact CG-CE3 4.39Å; C256-W262 HydrophobicContact CB-CE3 4.22Å; C256-W262 HydrophobicContact CB-CZ3 4.01Å
263	M	84.2	Confident	85.2	Confident	85 Å²	85	42.2 Å²	42.2	42%	0.419	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-134.7	-178.1	-59.2	-57.3	-64.1	0	0	111.4	L230 H255 N257 E261 A265	L230-M263 HydrophobicContact CD2-CB 4.19Å; L230-M263 HydrophobicContact CD2-CG 4.05Å; H255-M263 PolarHBondContact O-N 3.29Å; N257-M263 HydrophobicContact CB-CG 3.77Å; N257-M263 PolarHBondContact ND2-SD 3.4Å; E261-M263 PolarHBondContact O-N 3.22Å; M263-A265 PolarHBondContact O-N 3.13Å
264	V	74.8	Confident	85.4	Confident	88 Å²	88	39.2 Å²	39.2	53%	0.533	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	121.2	-169.3	-174.9	0	0	0	0	111.4	H255 I266	H255-V264 PolarHBondContact N-O 3.42Å; H255-V264 PolarHBondContact ND1-O 3.04Å; V264-I266 HydrophobicContact CG1-CG1 4.21Å
265	A	75.4	Confident	85.6	Confident	58 Å²	58	42 Å²	42	48%	0.479	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.6	167.9	0	0	0	0	0	109.4	R253 L254 M263	R253-A265 CarbonylContact O-C 3.55Å; R253-A265 WeakPolarHBondContact O-CA 3.42Å; L254-A265 HydrophobicContact CD2-CB 3.78Å; L254-A265 HydrophobicContact CG-CB 4.43Å; M263-A265 PolarHBondContact O-N 3.13Å
266	I	78.5	Confident	85.8	Confident	63 Å²	63	43 Å²	43	32%	0.323	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.9	174.7	-56.1	-176.4	0	0	0	107.6	V252 R253 V264	V252-I266 CarbonylContact C-O 3.5Å; V252-I266 WeakPolarHBondContact CA-O 3.46Å; R253-I266 HydrophobicContact CB-CB 4.49Å; R253-I266 PolarHBondContact N-O 2.82Å; R253-I266 PolarHBondContact O-N 3.37Å; V264-I266 HydrophobicContact CG1-CG1 4.21Å
267	G	75.6	Confident	85.8	Confident	33 Å²	33	45 Å²	45	34%	0.34	24%	0.239	S	C	.	.			trans	77.7	165.9	-173.4	0	0	0	0	0	113
268	R	82.8	Confident	85.8	Confident	126 Å²	126	45.5 Å²	45.5	48%	0.475	24%	0.242	S	C	.	.			trans	-150.7	154.9	174.8	68.9	-177.8	-171.1	149.5	12.8	110.2	A244 T270 D298	A244-R268 HydrophobicContact CB-CG 4.07Å; A244-R268 PolarHBondContact N-O 3.12Å; A244-R268 VanDerWaalsContact N-O 3.1Å; R268-T270 HydrophobicContact CG-CG2 4.49Å; R268-D298 IonicContact CZ-OD2 3.55Å; R268-D298 IonicContact NH1-OD2 2.74Å; R268-D298 PolarHBondContact NH1-OD2 3.46Å; R268-D298 IonicContact NH2-OD2 3.4Å; R268-D298 PolarHBondContact NH2-OD2 2.99Å
269	C	89.2	Confident	85.7	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.007	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	154.9	167.9	-55.9	0	0	0	0	109.1	G214 F215 C237 A241 E242	G214-C269 PolarHBondContact O-N 2.66Å; F215-C269 HydrophobicContact CB-CB 3.82Å; F215-C269 VanDerWaalsContact CD2-O 3.24Å; F215-C269 WeakPolarHBondContact CD2-O 3.12Å; F215-C269 WeakPolarHBondContact O-CB 3.12Å; C237-C269 WeakPolarHBondContact CA-SG 3.41Å; C237-C269 HydrophobicContact CB-CB 3.74Å; C237-C269 WeakPolarHBondContact CB-SG 3.48Å; C237-C269 WeakPolarHBondContact SG-CB 3.31Å; C237-C269 CovalentContact SG-SG 2.03Å; C237-C269 PolarHBondContact SG-SG 3.02Å; A241-C269 HydrophobicContact CB-CB 4.05Å; E242-C269 CarbonylContact O-C 3.59Å; E242-C269 VanDerWaalsContact O-CA 3.24Å; E242-C269 WeakPolarHBondContact O-CA 3.32Å
270	T	90.9	Very high	85.3	Confident	4 Å²	4	52.9 Å²	52.9	3%	0.025	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.1	176.1	51.6	0	0	0	0	109.9	A241 E242 A244 R268 K272 V296 D298	A241-T270 CarbonylContact C-O 3.45Å; A241-T270 WeakPolarHBondContact CA-O 3.46Å; A241-T270 WeakPolarHBondContact CB-O 2.92Å; E242-T270 PolarHBondContact N-O 2.85Å; E242-T270 PolarHBondContact O-N 3.35Å; A244-T270 HydrophobicContact CB-CG2 4.12Å; R268-T270 HydrophobicContact CG-CG2 4.49Å; T270-K272 PolarHBondContact O-N 2.55Å; T270-V296 WeakPolarHBondContact OG1-CG1 3.48Å; T270-D298 WeakPolarHBondContact CG2-OD1 3.25Å
271	C	92.4	Very high	85	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	134.3	-178.2	-62.9	0	0	0	0	111.1	Y275 C284 K293 V296 G297	C271-Y275 VanDerWaalsContact CB-O 3.27Å; C271-Y275 WeakPolarHBondContact CB-O 3.3Å; C271-C284 WeakPolarHBondContact CA-SG 3.3Å; C271-C284 HydrophobicContact CB-CB 3.81Å; C271-C284 WeakPolarHBondContact CB-SG 3.44Å; C271-C284 VanDerWaalsContact SG-CA 3.57Å; C271-C284 WeakPolarHBondContact SG-CB 2.95Å; C271-C284 CovalentContact SG-SG 2.04Å; C271-C284 PolarHBondContact SG-SG 2.92Å; C271-K293 PolarHBondContact O-NZ 2.99Å; C271-V296 WeakPolarHBondContact O-CA 3.45Å; C271-G297 PolarHBondContact N-O 3.05Å; C271-G297 PolarHBondContact O-N 3.21Å; C271-G297 VanDerWaalsContact O-N 3.11Å
272	K	93.1	Very high	84.9	Confident	82 Å²	82	59.8 Å²	59.8	36%	0.357	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-60.2	164.4	178.1	-69.1	-179.6	176.2	-179.7	0	112.3	N240 A241 E242 T270 G274 Y275	N240-K272 WeakPolarHBondContact O-CB 3.41Å; N240-K272 WeakPolarHBondContact O-CG 3.41Å; N240-K272 PolarHBondContact O-N 2.86Å; A241-K272 WeakPolarHBondContact O-CE 3.32Å; E242-K272 HydrophobicContact CB-CG 4.24Å; E242-K272 HydrophobicContact CG-CG 3.92Å; E242-K272 WeakPolarHBondContact OE2-CE 3.48Å; T270-K272 PolarHBondContact O-N 2.55Å; K272-G274 PolarHBondContact O-N 2.87Å; K272-Y275 HydrophobicContact CB-CD2 4.22Å; K272-Y275 PolarHBondContact O-N 3.22Å
273	A	90.9	Very high	84.9	Confident	34 Å²	34	59.6 Å²	59.6	28%	0.281	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	137	169.7	0	0	0	0	0	110.5	Y275 K293 L294	A273-Y275 VanDerWaalsContact C-N 3.32Å; A273-Y275 WeakPolarHBondContact O-CD2 3.4Å; A273-K293 CarbonylContact C-O 3.52Å; A273-L294 VanDerWaalsContact CB-O 3.27Å; A273-L294 WeakPolarHBondContact CB-O 3.26Å
274	G	91.5	Very high	85.4	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-0.8	-172.5	0	0	0	0	0	115.7	K272 C287 K293 G314	K272-G274 PolarHBondContact O-N 2.87Å; G274-C287 PolarHBondContact O-N 2.94Å; G274-C287 PolarHBondContact O-SG 2.83Å; G274-K293 PolarHBondContact N-O 2.97Å; G274-G314 WeakPolarHBondContact CA-O 3.44Å; G274-G314 VanDerWaalsContact O-CA 3.28Å; G274-G314 WeakPolarHBondContact O-CA 3.33Å
275	Y	93.4	Very high	86.2	Confident	61 Å²	61	56 Å²	56	24%	0.239	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134	179.3	-64.4	-99.9	0	0	0	112	N240 C271 K272 A273 Q285 P286 K293	N240-Y275 HydrophobicContact CB-CD1 3.44Å; N240-Y275 VanDerWaalsContact CB-CD1 3.44Å; N240-Y275 HydrophobicContact CB-CD2 4.06Å; N240-Y275 HydrophobicContact CB-CE1 3.55Å; N240-Y275 HydrophobicContact CB-CE2 4.16Å; N240-Y275 HydrophobicContact CB-CG 3.72Å; N240-Y275 WeakPolarHBondContact ND2-CE1 3.39Å; C271-Y275 VanDerWaalsContact CB-O 3.27Å; C271-Y275 WeakPolarHBondContact CB-O 3.3Å; K272-Y275 HydrophobicContact CB-CD2 4.22Å; K272-Y275 PolarHBondContact O-N 3.22Å; A273-Y275 VanDerWaalsContact C-N 3.32Å; A273-Y275 WeakPolarHBondContact O-CD2 3.4Å; Y275-Q285 CarbonylContact C-O 3.53Å; Y275-Q285 VanDerWaalsContact CA-O 3.22Å; Y275-Q285 WeakPolarHBondContact CA-O 3.43Å; Y275-P286 HydrophobicContact CD1-CB 4.11Å; Y275-P286 HydrophobicContact CE1-CB 3.86Å; Y275-K293 WeakPolarHBondContact O-CD 3.37Å; Y275-K293 WeakPolarHBondContact O-CE 3.19Å; Y275-K293 PolarHBondContact O-NZ 3.4Å
276	Q	91.8	Very high	87.1	Confident	45 Å²	45	56.2 Å²	56.2	21%	0.21	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	152.8	176.2	57.6	178.1	27.6	0	0	112.2	V278 C284 Q285 C301	Q276-V278 HydrophobicContact CG-CG2 4.34Å; Q276-C284 WeakPolarHBondContact O-CA 3.2Å; Q276-Q285 PolarHBondContact N-O 3.48Å; Q276-Q285 PolarHBondContact O-N 3.47Å; Q276-C301 HydrophobicContact CB-CB 4.48Å; Q276-C301 WeakPolarHBondContact CB-SG 3.03Å; Q276-C301 VanDerWaalsContact CG-SG 3.58Å; Q276-C301 VanDerWaalsContact OE1-CB 3.24Å; Q276-C301 PolarHBondContact OE1-SG 3.47Å; Q276-C301 VanDerWaalsContact OE1-SG 3.34Å
277	P	91	Very high	87.8	Confident	41 Å²	41	53.2 Å²	53.2	27%	0.266	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	137	174.6	31.6	-38.2	0	0	0	111.8	F215 D298	F215-P277 HydrophobicContact CE1-CB 3.6Å; F215-P277 HydrophobicContact CE2-CB 4.46Å; F215-P277 HydrophobicContact CZ-CB 3.31Å; P277-D298 WeakPolarHBondContact CG-O 3.47Å
278	V	85.3	Confident	88.6	Confident	32 Å²	32	55.1 Å²	55.1	19%	0.194	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	160.1	177.1	-171.2	0	0	0	0	109.6	Q276 R282 A283 Q285	Q276-V278 HydrophobicContact CG-CG2 4.34Å; V278-R282 PolarHBondContact O-N 3.17Å; V278-A283 PolarHBondContact N-O 3.32Å; V278-A283 PolarHBondContact O-N 3.35Å; V278-Q285 HydrophobicContact CB-CG 3.94Å; V278-Q285 HydrophobicContact CG1-CG 4.42Å; V278-Q285 HydrophobicContact CG2-CB 3.68Å; V278-Q285 HydrophobicContact CG2-CG 3.63Å
279	D	77.8	Confident	89.1	Confident	104 Å²	104	55.3 Å²	55.3	56%	0.556	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	48	177	-58.1	-38.2	0	0	0	113.8	E281 R282	D279-E281 PolarHBondContact O-N 3.2Å; D279-R282 HydrophobicContact CB-CB 4.27Å; D279-R282 VanDerWaalsContact O-CB 3.27Å; D279-R282 WeakPolarHBondContact O-CB 3.27Å; D279-R282 WeakPolarHBondContact O-CD 3.07Å; D279-R282 WeakPolarHBondContact O-CG 3.1Å; D279-R282 PolarHBondContact O-N 3.4Å
280	D	75.6	Confident	89.1	Confident	139 Å²	139	56.4 Å²	56.4	74%	0.743	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	54.1	175.6	-159.8	36.2	0	0	0	112.4	R282	D280-R282 VanDerWaalsContact C-N 3.34Å; D280-R282 PolarHBondContact O-N 3.45Å
281	E	76.2	Confident	89.2	Confident	100 Å²	100	56.4 Å²	56.4	47%	0.467	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	22.5	-179.5	-51.9	-178.3	178.6	0	0	116.5	F215 D279	F215-E281 WeakPolarHBondContact CD1-O 2.97Å; F215-E281 HydrophobicContact CD2-CB 4.31Å; F215-E281 VanDerWaalsContact CE1-CA 3.44Å; F215-E281 HydrophobicContact CE1-CB 4.04Å; F215-E281 HydrophobicContact CE2-CB 3.76Å; F215-E281 HydrophobicContact CE2-CG 3.87Å; F215-E281 VanDerWaalsContact CZ-CA 3.44Å; F215-E281 HydrophobicContact CZ-CB 3.57Å; F215-E281 HydrophobicContact CZ-CG 3.73Å; F215-E281 PolarHBondContact N-O 2.85Å; F215-E281 VanDerWaalsContact N-O 3.07Å; D279-E281 PolarHBondContact O-N 3.2Å
282	R	84.3	Confident	89.2	Confident	126 Å²	126	56.7 Å²	56.7	48%	0.475	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-20.7	180	-63.5	178.7	-174.5	-168.6	3.7	114.5	V212 V278 D279 D280	V212-R282 HydrophobicContact CB-CG 4.45Å; V212-R282 HydrophobicContact CG1-CB 4.22Å; V212-R282 HydrophobicContact CG1-CG 4.36Å; V278-R282 PolarHBondContact O-N 3.17Å; D279-R282 HydrophobicContact CB-CB 4.27Å; D279-R282 VanDerWaalsContact O-CB 3.27Å; D279-R282 WeakPolarHBondContact O-CB 3.27Å; D279-R282 WeakPolarHBondContact O-CD 3.07Å; D279-R282 WeakPolarHBondContact O-CG 3.1Å; D279-R282 PolarHBondContact O-N 3.4Å; D280-R282 VanDerWaalsContact C-N 3.34Å; D280-R282 PolarHBondContact O-N 3.45Å
283	A	89.3	Confident	89.1	Confident	30 Å²	30	53 Å²	53	25%	0.248	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	153.5	-177.9	0	0	0	0	0	112.8	V278	V278-A283 PolarHBondContact N-O 3.32Å; V278-A283 PolarHBondContact O-N 3.35Å
284	C	92.9	Very high	88.9	Confident	10 Å²	10	55.7 Å²	55.7	7%	0.068	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.7	172	-66	0	0	0	0	109.7	N240 C271 Q276	N240-C284 HydrophobicContact CB-CB 4.1Å; C271-C284 WeakPolarHBondContact CA-SG 3.3Å; C271-C284 HydrophobicContact CB-CB 3.81Å; C271-C284 WeakPolarHBondContact CB-SG 3.44Å; C271-C284 VanDerWaalsContact SG-CA 3.57Å; C271-C284 WeakPolarHBondContact SG-CB 2.95Å; C271-C284 CovalentContact SG-SG 2.04Å; C271-C284 PolarHBondContact SG-SG 2.92Å; Q276-C284 WeakPolarHBondContact O-CA 3.2Å
285	Q	93.1	Very high	88.7	Confident	87 Å²	87	58.7 Å²	58.7	41%	0.407	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.6	179.4	-68.2	-173	-2.5	0	0	111.3	Y275 Q276 V278	Y275-Q285 CarbonylContact C-O 3.53Å; Y275-Q285 VanDerWaalsContact CA-O 3.22Å; Y275-Q285 WeakPolarHBondContact CA-O 3.43Å; Q276-Q285 PolarHBondContact N-O 3.48Å; Q276-Q285 PolarHBondContact O-N 3.47Å; V278-Q285 HydrophobicContact CB-CG 3.94Å; V278-Q285 HydrophobicContact CG1-CG 4.42Å; V278-Q285 HydrophobicContact CG2-CB 3.68Å; V278-Q285 HydrophobicContact CG2-CG 3.63Å
286	P	94.1	Very high	88.5	Confident	63 Å²	63	58.4 Å²	58.4	41%	0.409	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	144.5	179	27.7	-34.5	0	0	0	110.8	Y275	Y275-P286 HydrophobicContact CD1-CB 4.11Å; Y275-P286 HydrophobicContact CE1-CB 3.86Å
287	C	93.6	Very high	88.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-54.7	132.1	174.9	-70	0	0	0	0	110.9	G274 S291 C301 P313 G314	G274-C287 PolarHBondContact O-N 2.94Å; G274-C287 PolarHBondContact O-SG 2.83Å; C287-S291 WeakPolarHBondContact CB-OG 3.38Å; C287-C301 WeakPolarHBondContact CA-SG 3.36Å; C287-C301 HydrophobicContact CB-CB 3.72Å; C287-C301 WeakPolarHBondContact CB-SG 3.37Å; C287-C301 WeakPolarHBondContact SG-CB 3.09Å; C287-C301 CovalentContact SG-SG 2.02Å; C287-C301 PolarHBondContact SG-SG 3.06Å; C287-P313 CarbonylContact O-C 3.36Å; C287-P313 VanDerWaalsContact O-CA 3.24Å; C287-P313 WeakPolarHBondContact O-CA 3.44Å; C287-G314 PolarHBondContact O-N 3.34Å
288	P	92.1	Very high	87.8	Confident	73 Å²	73	57.4 Å²	57.4	47%	0.474	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-61	158.3	176.6	20.4	-28.6	0	0	0	111.9	G290 S291	P288-G290 PolarHBondContact O-N 3Å; P288-S291 WeakPolarHBondContact CD-OG 3.44Å; P288-S291 WeakPolarHBondContact CG-OG 3.26Å; P288-S291 WeakPolarHBondContact O-CB 3.49Å; P288-S291 PolarHBondContact O-N 3.08Å; P288-S291 PolarHBondContact O-OG 3.14Å
289	L	92.2	Very high	87.9	Confident	130 Å²	130	60.1 Å²	60.1	68%	0.681	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	133.7	-178.3	-166.8	148.8	0	0	0	111	S291	L289-S291 VanDerWaalsContact C-N 3.32Å
290	G	89.6	Confident	88.4	Confident	23 Å²	23	58.7 Å²	58.7	24%	0.237	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	4.9	-175	0	0	0	0	0	115.1	P288 C304 A310	P288-G290 PolarHBondContact O-N 3Å; G290-C304 PolarHBondContact O-N 3.23Å; G290-C304 PolarHBondContact O-SG 3.37Å; G290-A310 PolarHBondContact N-O 3.1Å
291	S	92.8	Very high	89.2	Confident	4 Å²	4	53 Å²	53	3%	0.028	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	160.8	172.4	72.7	0	0	0	0	111.7	C287 P288 L289 H302 A310	C287-S291 WeakPolarHBondContact CB-OG 3.38Å; P288-S291 WeakPolarHBondContact CD-OG 3.44Å; P288-S291 WeakPolarHBondContact CG-OG 3.26Å; P288-S291 WeakPolarHBondContact O-CB 3.49Å; P288-S291 PolarHBondContact O-N 3.08Å; P288-S291 PolarHBondContact O-OG 3.14Å; L289-S291 VanDerWaalsContact C-N 3.32Å; S291-H302 CarbonylContact C-O 3.5Å; S291-H302 WeakPolarHBondContact CA-O 3.27Å; S291-H302 WeakPolarHBondContact CB-O 3.29Å; S291-A310 WeakPolarHBondContact O-CB 3.31Å
292	F	92	Very high	90	Very high	7 Å²	7	53.1 Å²	53.1	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	164.1	-177	79.7	-67.7	0	0	0	111.9	L294 H302 S315 C318 D333	F292-L294 HydrophobicContact CE2-CB 4.48Å; F292-H302 HydrophobicContact CD1-CB 4.42Å; F292-H302 VanDerWaalsContact CD1-O 3.31Å; F292-H302 WeakPolarHBondContact CD1-O 3.25Å; F292-H302 HydrophobicContact CE1-CB 4Å; F292-H302 PolarHBondContact N-O 3.24Å; F292-H302 PolarHBondContact O-N 3.13Å; F292-S315 WeakPolarHBondContact CA-O 3.21Å; F292-S315 WeakPolarHBondContact CB-O 3.24Å; F292-C318 WeakPolarHBondContact CD1-SG 3.35Å; F292-C318 WeakPolarHBondContact CG-SG 3.45Å; F292-D333 HydrophobicContact CZ-CB 3.94Å
293	K	91.9	Very high	90.3	Very high	4 Å²	4	54 Å²	54	2%	0.017	31%	0.313	C	S	.	.			trans	-145.2	116.8	169.2	-176.9	-167.9	-176.5	-166.7	0	110.5	C271 A273 G274 Y275 S295 G297 D299 S315 S316	C271-K293 PolarHBondContact O-NZ 2.99Å; A273-K293 CarbonylContact C-O 3.52Å; G274-K293 PolarHBondContact N-O 2.97Å; Y275-K293 WeakPolarHBondContact O-CD 3.37Å; Y275-K293 WeakPolarHBondContact O-CE 3.19Å; Y275-K293 PolarHBondContact O-NZ 3.4Å; K293-S295 WeakPolarHBondContact CE-O 3.28Å; K293-G297 PolarHBondContact NZ-O 3.31Å; K293-D299 WeakPolarHBondContact CE-O 3.33Å; K293-S315 PolarHBondContact N-O 2.9Å; K293-S316 CarbonylContact C-O 3.43Å; K293-S316 VanDerWaalsContact O-CA 3.3Å; K293-S316 WeakPolarHBondContact O-CA 3.17Å
294	L	87.3	Confident	90.5	Very high	90 Å²	90	53.9 Å²	53.9	47%	0.471	31%	0.31	S	S	.	.			trans	-71.6	-50.7	-171.4	-170.2	77.1	0	0	0	113.8	A273 F292 S316 S332	A273-L294 VanDerWaalsContact CB-O 3.27Å; A273-L294 WeakPolarHBondContact CB-O 3.26Å; F292-L294 HydrophobicContact CE2-CB 4.48Å; L294-S316 VanDerWaalsContact CA-O 3.26Å; L294-S316 WeakPolarHBondContact CA-O 3.36Å; L294-S332 WeakPolarHBondContact CD1-OG 3.24Å; L294-S332 WeakPolarHBondContact CD2-OG 3.47Å
295	S	87.6	Confident	90.4	Very high	64 Å²	64	54.5 Å²	54.5	45%	0.448	31%	0.314	S	S	.	.	S	Bend	trans	-111.7	158	-169.4	49.6	0	0	0	0	111.6	K293	K293-S295 WeakPolarHBondContact CE-O 3.28Å
296	V	87.4	Confident	90.4	Very high	54 Å²	54	53.2 Å²	53.2	33%	0.327	32%	0.318	S	S	.	.	S	Bend	trans	-66.9	136.1	168	175.5	0	0	0	0	108.1	E242 T270 C271	E242-V296 HydrophobicContact CG-CG1 3.66Å; E242-V296 HydrophobicContact CG-CG2 4.28Å; E242-V296 WeakPolarHBondContact OE1-CG1 3.47Å; E242-V296 WeakPolarHBondContact OE1-CG2 3.46Å; T270-V296 WeakPolarHBondContact OG1-CG1 3.48Å; C271-V296 WeakPolarHBondContact O-CA 3.45Å
297	G	85.8	Confident	90.3	Very high	11 Å²	11	53.7 Å²	53.7	11%	0.113	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	159.6	-168.6	-176.2	0	0	0	0	0	113.5	C271 K293	C271-G297 PolarHBondContact N-O 3.05Å; C271-G297 PolarHBondContact O-N 3.21Å; C271-G297 VanDerWaalsContact O-N 3.11Å; K293-G297 PolarHBondContact NZ-O 3.31Å
298	D	83.4	Confident	90.3	Very high	55 Å²	55	54.2 Å²	54.2	29%	0.294	32%	0.318	S	S	.	.	S	Bend	trans	-99	1.7	-177	-55	-38.2	0	0	0	112.3	R268 T270 P277	R268-D298 IonicContact CZ-OD2 3.55Å; R268-D298 IonicContact NH1-OD2 2.74Å; R268-D298 PolarHBondContact NH1-OD2 3.46Å; R268-D298 IonicContact NH2-OD2 3.4Å; R268-D298 PolarHBondContact NH2-OD2 2.99Å; T270-D298 WeakPolarHBondContact CG2-OD1 3.25Å; P277-D298 WeakPolarHBondContact CG-O 3.47Å
299	D	86.3	Confident	90.3	Very high	89 Å²	89	54.8 Å²	54.8	48%	0.476	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-67.7	140.3	-178.4	-61	-59.6	0	0	0	111.9	K293	K293-D299 WeakPolarHBondContact CE-O 3.33Å
300	P	90.3	Very high	90.3	Very high	74 Å²	74	48.7 Å²	48.7	48%	0.481	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-69.1	162.5	173.1	30.9	-35	0	0	0	111	H302	P300-H302 PolarHBondContact O-CD2 2.91Å; P300-H302 PolarHBondContact O-N 3.12Å
301	C	92.2	Very high	90.2	Very high	20 Å²	20	51.1 Å²	51.1	14%	0.135	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-67.3	137.7	174.8	-61.5	0	0	0	0	110.8	Q276 C287	Q276-C301 HydrophobicContact CB-CB 4.48Å; Q276-C301 WeakPolarHBondContact CB-SG 3.03Å; Q276-C301 VanDerWaalsContact CG-SG 3.58Å; Q276-C301 VanDerWaalsContact OE1-CB 3.24Å; Q276-C301 PolarHBondContact OE1-SG 3.47Å; Q276-C301 VanDerWaalsContact OE1-SG 3.34Å; C287-C301 WeakPolarHBondContact CA-SG 3.36Å; C287-C301 HydrophobicContact CB-CB 3.72Å; C287-C301 WeakPolarHBondContact CB-SG 3.37Å; C287-C301 WeakPolarHBondContact SG-CB 3.09Å; C287-C301 CovalentContact SG-SG 2.02Å; C287-C301 PolarHBondContact SG-SG 3.06Å
302	H	91.2	Very high	90.1	Very high	101 Å²	101	54.9 Å²	54.9	47%	0.468	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	144.5	177.9	-63.6	-71.5	0	0	0	110.5	S291 F292 P300	S291-H302 CarbonylContact C-O 3.5Å; S291-H302 WeakPolarHBondContact CA-O 3.27Å; S291-H302 WeakPolarHBondContact CB-O 3.29Å; F292-H302 HydrophobicContact CD1-CB 4.42Å; F292-H302 VanDerWaalsContact CD1-O 3.31Å; F292-H302 WeakPolarHBondContact CD1-O 3.25Å; F292-H302 HydrophobicContact CE1-CB 4Å; F292-H302 PolarHBondContact N-O 3.24Å; F292-H302 PolarHBondContact O-N 3.13Å; P300-H302 PolarHBondContact O-CD2 2.91Å; P300-H302 PolarHBondContact O-N 3.12Å
303	L	92.4	Very high	90	Very high	146 Å²	146	58.4 Å²	58.4	76%	0.764	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	144.4	171.2	-71.6	168.7	0	0	0	110.1
304	C	92.1	Very high	90	Very high	26 Å²	26	59.2 Å²	59.2	18%	0.176	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-58.9	134.7	175.9	-76	0	0	0	0	111.3	G290 H309 A310 C318	G290-C304 PolarHBondContact O-N 3.23Å; G290-C304 PolarHBondContact O-SG 3.37Å; C304-H309 VanDerWaalsContact SG-C 3.54Å; C304-A310 WeakPolarHBondContact SG-CB 3.45Å; C304-A310 PolarHBondContact SG-N 3.21Å; C304-C318 WeakPolarHBondContact CA-SG 3.45Å; C304-C318 HydrophobicContact CB-CB 3.8Å; C304-C318 WeakPolarHBondContact CB-SG 3.42Å; C304-C318 WeakPolarHBondContact SG-CB 3.36Å; C304-C318 CovalentContact SG-SG 2.03Å; C304-C318 PolarHBondContact SG-SG 2.97Å
305	P	92.4	Very high	90.2	Very high	24 Å²	24	55.5 Å²	55.5	16%	0.156	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-68.8	167	179.7	31.8	-38.3	0	0	0	111.2	S308 D333 A334 P335	P305-S308 WeakPolarHBondContact CD-OG 3.33Å; P305-S308 WeakPolarHBondContact CG-OG 3.4Å; P305-S308 PolarHBondContact O-N 3.43Å; P305-S308 VanDerWaalsContact O-N 3.16Å; P305-S308 PolarHBondContact O-OG 2.99Å; P305-D333 WeakPolarHBondContact CB-O 3.39Å; P305-D333 WeakPolarHBondContact CG-O 3.44Å; P305-A334 WeakPolarHBondContact CG-O 3.19Å; P305-P335 HydrophobicContact CB-CB 4.25Å
306	A	91.9	Very high	90.4	Very high	60 Å²	60	55.1 Å²	55.1	50%	0.496	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	142.8	-175.3	0	0	0	0	0	112.7	S308 P335 C336	A306-S308 PolarHBondContact O-N 3.41Å; A306-P335 HydrophobicContact CB-CB 4.02Å; A306-C336 PolarHBondContact O-N 3.41Å
307	H	92.7	Very high	90.5	Very high	73 Å²	73	58.2 Å²	58.2	34%	0.338	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	26	-177.5	-51.2	-66	0	0	0	115	Q321 Y324 C336	H307-Q321 WeakPolarHBondContact O-CB 3.46Å; H307-Q321 WeakPolarHBondContact O-CG 3.45Å; H307-Q321 PolarHBondContact O-N 2.97Å; H307-Y324 HydrophobicContact CB-CD1 3.6Å; H307-Y324 HydrophobicContact CB-CD2 3.87Å; H307-Y324 HydrophobicContact CB-CE1 4.02Å; H307-Y324 HydrophobicContact CB-CE2 4.25Å; H307-Y324 HydrophobicContact CB-CG 3.53Å; H307-Y324 AromaticContact CD2-CD1 3.71Å; H307-Y324 AromaticContact CD2-CE1 3.41Å; H307-Y324 VanDerWaalsContact CD2-CE1 3.41Å; H307-Y324 WeakPolarHBondContact CD2-CE1 3.38Å; H307-Y324 AromaticContact CD2-CZ 3.96Å; H307-Y324 AromaticContact CE1-CE1 3.65Å; H307-Y324 AromaticContact CE1-CZ 3.42Å; H307-Y324 VanDerWaalsContact CE1-CZ 3.42Å; H307-Y324 PolarHBondContact CE1-OH 2.99Å; H307-Y324 VanDerWaalsContact CE1-OH 3.22Å; H307-Y324 AromaticContact CG-CD1 3.51Å; H307-Y324 AromaticContact CG-CE1 3.39Å; H307-Y324 AromaticContact CG-CE2 3.94Å; H307-Y324 AromaticContact CG-CG 3.86Å; H307-Y324 AromaticContact CG-CZ 3.61Å; H307-Y324 AromaticContact ND1-CE1 3.55Å; H307-Y324 AromaticContact ND1-CE2 3.55Å; H307-Y324 AromaticContact ND1-CZ 3.26Å; H307-Y324 VanDerWaalsContact ND1-CZ 3.26Å; H307-Y324 AromaticContact NE2-CE1 3.59Å; H307-Y324 AromaticContact NE2-CZ 3.86Å; H307-C336 HydrophobicContact CB-CB 4.11Å; H307-C336 WeakPolarHBondContact O-CB 3.12Å
308	S	93.1	Very high	90.7	Very high	10 Å²	10	57.9 Å²	57.9	7%	0.07	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	164.7	172.1	77.6	0	0	0	0	111.1	P305 A306 C318 V319	P305-S308 WeakPolarHBondContact CD-OG 3.33Å; P305-S308 WeakPolarHBondContact CG-OG 3.4Å; P305-S308 PolarHBondContact O-N 3.43Å; P305-S308 VanDerWaalsContact O-N 3.16Å; P305-S308 PolarHBondContact O-OG 2.99Å; A306-S308 PolarHBondContact O-N 3.41Å; S308-C318 WeakPolarHBondContact OG-CB 3.39Å; S308-V319 CarbonylContact C-O 3.49Å; S308-V319 VanDerWaalsContact CA-O 3.25Å; S308-V319 WeakPolarHBondContact CA-O 3.43Å
309	H	91.9	Very high	91.1	Very high	85 Å²	85	58.8 Å²	58.8	39%	0.394	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	151.8	178.3	68.5	-56.9	0	0	0	111.9	C304 V319	C304-H309 VanDerWaalsContact SG-C 3.54Å; H309-V319 PolarHBondContact N-O 2.03Å; H309-V319 PolarHBondContact ND1-O 3.3Å; H309-V319 VanDerWaalsContact ND1-O 3.11Å; H309-V319 PolarHBondContact O-N 3.46Å
310	A	92	Very high	91.4	Very high	2 Å²	2	56.1 Å²	56.1	2%	0.017	33%	0.331	C	S	.	.			trans	-109.4	107.2	173.3	0	0	0	0	0	108.2	G290 S291 C304 V312	G290-A310 PolarHBondContact N-O 3.1Å; S291-A310 WeakPolarHBondContact O-CB 3.31Å; C304-A310 WeakPolarHBondContact SG-CB 3.45Å; C304-A310 PolarHBondContact SG-N 3.21Å; A310-V312 VanDerWaalsContact C-N 3.33Å; A310-V312 PolarHBondContact O-N 3.46Å
311	P	86.7	Confident	91.5	Very high	75 Å²	75	56.6 Å²	56.6	49%	0.487	33%	0.327	S	S	.	.			trans	-76.2	-19.4	-170.7	29.5	-34.8	0	0	0	113.5
312	V	91.2	Very high	91.4	Very high	83 Å²	83	62.9 Å²	62.9	50%	0.503	36%	0.359	S	S	.	.	S	Bend	trans	-127.3	147.8	-177.2	-64	0	0	0	0	111.5	A310 S315	A310-V312 VanDerWaalsContact C-N 3.33Å; A310-V312 PolarHBondContact O-N 3.46Å; V312-S315 WeakPolarHBondContact CG2-OG 3.35Å; V312-S315 PolarHBondContact O-OG 3.24Å
313	P	91.3	Very high	91.3	Very high	81 Å²	81	66 Å²	66	53%	0.526	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	147.2	167.9	-20.8	32.8	0	0	0	111	C287	C287-P313 CarbonylContact O-C 3.36Å; C287-P313 VanDerWaalsContact O-CA 3.24Å; C287-P313 WeakPolarHBondContact O-CA 3.44Å
314	G	91.1	Very high	91.3	Very high	21 Å²	21	62.6 Å²	62.6	22%	0.216	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	19.2	-179.4	0	0	0	0	0	114.9	G274 C287	G274-G314 WeakPolarHBondContact CA-O 3.44Å; G274-G314 VanDerWaalsContact O-CA 3.28Å; G274-G314 WeakPolarHBondContact O-CA 3.33Å; C287-G314 PolarHBondContact O-N 3.34Å
315	S	92	Very high	91.3	Very high	12 Å²	12	64 Å²	64	8%	0.084	35%	0.346	C	S	.	.			trans	-67.7	133.3	179.9	-68.1	0	0	0	0	111.8	F292 K293 V312	F292-S315 WeakPolarHBondContact CA-O 3.21Å; F292-S315 WeakPolarHBondContact CB-O 3.24Å; K293-S315 PolarHBondContact N-O 2.9Å; V312-S315 WeakPolarHBondContact CG2-OG 3.35Å; V312-S315 PolarHBondContact O-OG 3.24Å
316	S	90.3	Very high	91.3	Very high	55 Å²	55	65.3 Å²	65.3	39%	0.385	35%	0.348	S	S	.	.	S	Bend	trans	-85	-16.8	173.7	55.9	0	0	0	0	113.2	K293 L294	K293-S316 CarbonylContact C-O 3.43Å; K293-S316 VanDerWaalsContact O-CA 3.3Å; K293-S316 WeakPolarHBondContact O-CA 3.17Å; L294-S316 VanDerWaalsContact CA-O 3.26Å; L294-S316 WeakPolarHBondContact CA-O 3.36Å
317	E	89.9	Confident	91.2	Very high	120 Å²	120	63.4 Å²	63.4	56%	0.561	33%	0.331	S	S	*	.	S	Bend	trans	-147	158.4	-179.4	61.2	176.8	-168.3	0	0	111.4
318	C	91.3	Very high	90.9	Very high	3 Å²	3	65.4 Å²	65.4	2%	0.02	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-102.1	126.4	174.6	-62.9	0	0	0	0	110.9	F292 C304 S308 R326	F292-C318 WeakPolarHBondContact CD1-SG 3.35Å; F292-C318 WeakPolarHBondContact CG-SG 3.45Å; C304-C318 WeakPolarHBondContact CA-SG 3.45Å; C304-C318 HydrophobicContact CB-CB 3.8Å; C304-C318 WeakPolarHBondContact CB-SG 3.42Å; C304-C318 WeakPolarHBondContact SG-CB 3.36Å; C304-C318 CovalentContact SG-SG 2.03Å; C304-C318 PolarHBondContact SG-SG 2.97Å; S308-C318 WeakPolarHBondContact OG-CB 3.39Å; C318-R326 PolarHBondContact O-NH1 3.18Å
319	V	91.6	Very high	90.6	Very high	74 Å²	74	68.8 Å²	68.8	45%	0.448	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.3	179.3	-175.6	0	0	0	0	110.1	S308 H309	S308-V319 CarbonylContact C-O 3.49Å; S308-V319 VanDerWaalsContact CA-O 3.25Å; S308-V319 WeakPolarHBondContact CA-O 3.43Å; H309-V319 PolarHBondContact N-O 2.03Å; H309-V319 PolarHBondContact ND1-O 3.3Å; H309-V319 VanDerWaalsContact ND1-O 3.11Å; H309-V319 PolarHBondContact O-N 3.46Å
320	C	92.4	Very high	90.4	Very high	33 Å²	33	66.4 Å²	66.4	22%	0.223	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	144.3	177.7	-67.1	0	0	0	0	112.3	Y324 C336	C320-Y324 VanDerWaalsContact CB-O 3.3Å; C320-Y324 WeakPolarHBondContact CB-O 3.33Å; C320-C336 WeakPolarHBondContact CA-SG 3.44Å; C320-C336 HydrophobicContact CB-CB 3.73Å; C320-C336 WeakPolarHBondContact CB-SG 3.06Å; C320-C336 WeakPolarHBondContact SG-CB 3.22Å; C320-C336 CovalentContact SG-SG 2.04Å; C320-C336 PolarHBondContact SG-SG 3.22Å
321	Q	92.5	Very high	90	Very high	84 Å²	84	70.4 Å²	70.4	39%	0.393	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-72.3	158.1	171.4	-66	173.9	0.4	0	0	110.7	H307 R323 Y324	H307-Q321 WeakPolarHBondContact O-CB 3.46Å; H307-Q321 WeakPolarHBondContact O-CG 3.45Å; H307-Q321 PolarHBondContact O-N 2.97Å; Q321-R323 PolarHBondContact O-N 3.37Å; Q321-Y324 HydrophobicContact CB-CD2 4.38Å; Q321-Y324 PolarHBondContact O-N 2.96Å; Q321-Y324 VanDerWaalsContact O-N 3.09Å
322	N	89.9	Confident	89.6	Confident	153 Å²	153	68.3 Å²	68.3	82%	0.818	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	136.5	178.3	-77.5	-10.9	0	0	0	111.9	Y324	N322-Y324 VanDerWaalsContact C-N 3.28Å; N322-Y324 WeakPolarHBondContact O-CD2 3.48Å
323	R	88.4	Confident	89.2	Confident	165 Å²	165	69 Å²	69	62%	0.623	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	3.5	-176.1	-48.7	177.8	177.4	-125.8	-7.4	116.1	Q321 Y325 E436	Q321-R323 PolarHBondContact O-N 3.37Å; R323-Y325 WeakPolarHBondContact O-CE2 3.44Å; R323-E436 IonicContact CZ-OE1 3.52Å; R323-E436 VanDerWaalsContact CZ-OE1 3.29Å; R323-E436 IonicContact NH1-OE1 3.1Å; R323-E436 PolarHBondContact NH1-OE1 2.84Å; R323-E436 IonicContact NH1-OE2 2.9Å; R323-E436 IonicContact NH2-OE1 3.92Å
324	Y	92.4	Very high	89	Confident	75 Å²	75	66.1 Å²	66.1	29%	0.294	37%	0.37	S	S	.	.			trans	-118.5	145.9	173.8	-64.2	-92.4	0	0	0	110.4	H307 C320 Q321 N322 T337	H307-Y324 HydrophobicContact CB-CD1 3.6Å; H307-Y324 HydrophobicContact CB-CD2 3.87Å; H307-Y324 HydrophobicContact CB-CE1 4.02Å; H307-Y324 HydrophobicContact CB-CE2 4.25Å; H307-Y324 HydrophobicContact CB-CG 3.53Å; H307-Y324 AromaticContact CD2-CD1 3.71Å; H307-Y324 AromaticContact CD2-CE1 3.41Å; H307-Y324 VanDerWaalsContact CD2-CE1 3.41Å; H307-Y324 WeakPolarHBondContact CD2-CE1 3.38Å; H307-Y324 AromaticContact CD2-CZ 3.96Å; H307-Y324 AromaticContact CE1-CE1 3.65Å; H307-Y324 AromaticContact CE1-CZ 3.42Å; H307-Y324 VanDerWaalsContact CE1-CZ 3.42Å; H307-Y324 PolarHBondContact CE1-OH 2.99Å; H307-Y324 VanDerWaalsContact CE1-OH 3.22Å; H307-Y324 AromaticContact CG-CD1 3.51Å; H307-Y324 AromaticContact CG-CE1 3.39Å; H307-Y324 AromaticContact CG-CE2 3.94Å; H307-Y324 AromaticContact CG-CG 3.86Å; H307-Y324 AromaticContact CG-CZ 3.61Å; H307-Y324 AromaticContact ND1-CE1 3.55Å; H307-Y324 AromaticContact ND1-CE2 3.55Å; H307-Y324 AromaticContact ND1-CZ 3.26Å; H307-Y324 VanDerWaalsContact ND1-CZ 3.26Å; H307-Y324 AromaticContact NE2-CE1 3.59Å; H307-Y324 AromaticContact NE2-CZ 3.86Å; C320-Y324 VanDerWaalsContact CB-O 3.3Å; C320-Y324 WeakPolarHBondContact CB-O 3.33Å; Q321-Y324 HydrophobicContact CB-CD2 4.38Å; Q321-Y324 PolarHBondContact O-N 2.96Å; Q321-Y324 VanDerWaalsContact O-N 3.09Å; N322-Y324 VanDerWaalsContact C-N 3.28Å; N322-Y324 WeakPolarHBondContact O-CD2 3.48Å; Y324-T337 CarbonylContact C-O 3.55Å; Y324-T337 WeakPolarHBondContact CA-O 3.35Å
325	Y	92.3	Very high	89.1	Confident	55 Å²	55	68 Å²	68	22%	0.216	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-142.5	163.8	-172.1	-47.3	-84.3	0	0	0	111.2	R323 T337 L433	R323-Y325 WeakPolarHBondContact O-CE2 3.44Å; Y325-T337 PolarHBondContact N-O 3.22Å; Y325-T337 PolarHBondContact O-N 2.84Å; Y325-T337 PolarHBondContact O-OG1 3.44Å; Y325-L433 HydrophobicContact CD1-CB 4.08Å; Y325-L433 HydrophobicContact CG-CB 3.99Å
326	R	91.8	Very high	89.1	Confident	52 Å²	52	67.5 Å²	67.5	20%	0.196	37%	0.374	C	S	.	.			trans	-116.9	134.3	166.6	-71	-172.5	-170.9	101.4	-2.4	109	C318 D330 S332 A334 L433	C318-R326 PolarHBondContact O-NH1 3.18Å; R326-D330 HydrophobicContact CB-CB 4.2Å; R326-S332 PolarHBondContact NH2-O 2.9Å; R326-A334 PolarHBondContact NE-O 2.87Å; R326-A334 PolarHBondContact NH2-O 2.83Å; R326-A334 VanDerWaalsContact NH2-O 3.13Å; R326-L433 VanDerWaalsContact O-CD1 3.26Å; R326-L433 WeakPolarHBondContact O-CD1 3.27Å
327	S	90.6	Very high	89.3	Confident	21 Å²	21	65.3 Å²	65.3	15%	0.147	36%	0.359	C	S	.	.			trans	-70.2	157.9	169.4	173	0	0	0	0	110	S329 D330	S327-S329 WeakPolarHBondContact CB-OG 3.25Å; S327-S329 PolarHBondContact O-N 3.45Å; S327-S329 VanDerWaalsContact O-N 3.14Å; S327-S329 PolarHBondContact OG-N 3.11Å; S327-S329 PolarHBondContact OG-OG 3.44Å; S327-D330 PolarHBondContact N-OD2 2.89Å; S327-D330 WeakPolarHBondContact O-CB 3.41Å; S327-D330 PolarHBondContact O-N 3.07Å
328	A	86.7	Confident	89.5	Confident	114 Å²	114	60 Å²	60	94%	0.942	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.2	171.9	0	0	0	0	0	113.3
329	S	85.9	Confident	89.6	Confident	81 Å²	81	61 Å²	61	57%	0.566	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-15.3	173.7	58.8	0	0	0	0	114	S327	S327-S329 WeakPolarHBondContact CB-OG 3.25Å; S327-S329 PolarHBondContact O-N 3.45Å; S327-S329 VanDerWaalsContact O-N 3.14Å; S327-S329 PolarHBondContact OG-N 3.11Å; S327-S329 PolarHBondContact OG-OG 3.44Å
330	D	87.5	Confident	89.8	Confident	35 Å²	35	57.5 Å²	57.5	19%	0.187	32%	0.32	C	S	.	.	S	Bend	trans	-83.6	139.7	-176.4	-60.1	-21.4	0	0	0	109.8	R326 S327 A334 R368	R326-D330 HydrophobicContact CB-CB 4.2Å; S327-D330 PolarHBondContact N-OD2 2.89Å; S327-D330 WeakPolarHBondContact O-CB 3.41Å; S327-D330 PolarHBondContact O-N 3.07Å; D330-A334 HydrophobicContact CB-CB 4.27Å; D330-R368 IonicContact OD1-CZ 2.74Å; D330-R368 IonicContact OD1-NH1 3.51Å; D330-R368 PolarHBondContact OD1-NH1 3.28Å; D330-R368 IonicContact OD1-NH2 2.85Å; D330-R368 PolarHBondContact OD1-NH2 3.4Å; D330-R368 IonicContact OD2-CZ 3.61Å; D330-R368 IonicContact OD2-NH1 2.75Å; D330-R368 PolarHBondContact OD2-NH1 3.5Å; D330-R368 IonicContact OD2-NH2 3.25Å; D330-R368 PolarHBondContact OD2-NH2 3.21Å
331	T	84.7	Confident	89.9	Confident	86 Å²	86	57.5 Å²	57.5	53%	0.528	32%	0.32	S	S	.	.			trans	-72.6	154.1	171.7	56.5	0	0	0	0	110	D333 A334	T331-D333 WeakPolarHBondContact CB-OD1 3.49Å; T331-D333 PolarHBondContact O-N 3.1Å; T331-D333 PolarHBondContact OG1-OD1 3.03Å; T331-A334 WeakPolarHBondContact O-CB 3.27Å; T331-A334 PolarHBondContact O-N 2.83Å
332	S	78.4	Confident	90	Very high	31 Å²	31	55 Å²	55	22%	0.217	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.2	-177.2	50.1	0	0	0	0	114.1	L294 R326	L294-S332 WeakPolarHBondContact CD1-OG 3.24Å; L294-S332 WeakPolarHBondContact CD2-OG 3.47Å; R326-S332 PolarHBondContact NH2-O 2.9Å
333	D	81.7	Confident	90.3	Very high	98 Å²	98	48 Å²	48	52%	0.524	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-8.4	174.2	64.8	-37	0	0	0	113.5	F292 P305 T331	F292-D333 HydrophobicContact CZ-CB 3.94Å; P305-D333 WeakPolarHBondContact CB-O 3.39Å; P305-D333 WeakPolarHBondContact CG-O 3.44Å; T331-D333 WeakPolarHBondContact CB-OD1 3.49Å; T331-D333 PolarHBondContact O-N 3.1Å; T331-D333 PolarHBondContact OG1-OD1 3.03Å
334	A	88.2	Confident	90.6	Very high	21 Å²	21	45.7 Å²	45.7	17%	0.174	27%	0.268	C	S	.	.	S	Bend	trans	-69	148.4	173.6	0	0	0	0	0	111.4	P305 R326 D330 T331	P305-A334 WeakPolarHBondContact CG-O 3.19Å; R326-A334 PolarHBondContact NE-O 2.87Å; R326-A334 PolarHBondContact NH2-O 2.83Å; R326-A334 VanDerWaalsContact NH2-O 3.13Å; D330-A334 HydrophobicContact CB-CB 4.27Å; T331-A334 WeakPolarHBondContact O-CB 3.27Å; T331-A334 PolarHBondContact O-N 2.83Å
335	P	91.9	Very high	90.6	Very high	61 Å²	61	46.6 Å²	46.6	40%	0.396	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-64.8	147.8	173.5	28.7	-34.7	0	0	0	111.2	P305 A306	P305-P335 HydrophobicContact CB-CB 4.25Å; A306-P335 HydrophobicContact CB-CB 4.02Å
336	C	93.6	Very high	90.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.007	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-73.5	139.7	170.9	-55.7	0	0	0	0	109	A306 H307 C320	A306-C336 PolarHBondContact O-N 3.41Å; H307-C336 HydrophobicContact CB-CB 4.11Å; H307-C336 WeakPolarHBondContact O-CB 3.12Å; C320-C336 WeakPolarHBondContact CA-SG 3.44Å; C320-C336 HydrophobicContact CB-CB 3.73Å; C320-C336 WeakPolarHBondContact CB-SG 3.06Å; C320-C336 WeakPolarHBondContact SG-CB 3.22Å; C320-C336 CovalentContact SG-SG 2.04Å; C320-C336 PolarHBondContact SG-SG 3.22Å
337	T	94.5	Very high	90.7	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.055	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-125.3	156	-169.6	48.1	0	0	0	0	111.2	Y324 Y325 G366 R368	Y324-T337 CarbonylContact C-O 3.55Å; Y324-T337 WeakPolarHBondContact CA-O 3.35Å; Y325-T337 PolarHBondContact N-O 3.22Å; Y325-T337 PolarHBondContact O-N 2.84Å; Y325-T337 PolarHBondContact O-OG1 3.44Å; T337-G366 VanDerWaalsContact CB-O 3.26Å; T337-G366 WeakPolarHBondContact CB-O 3.46Å; T337-R368 HydrophobicContact CG2-CG 3.68Å; T337-R368 WeakPolarHBondContact OG1-CD 3.48Å; T337-R368 PolarHBondContact OG1-NH1 2.99Å
338	G	93.1	Very high	90.8	Very high	8 Å²	8	49.6 Å²	49.6	8%	0.082	30%	0.298	C	S	.	.			trans	-105.7	177.3	-176.7	0	0	0	0	0	112.9	G366 N428 V430	G338-G366 PolarHBondContact N-O 3.38Å; G338-G366 WeakPolarHBondContact O-CA 3.46Å; G338-N428 PolarHBondContact O-ND2 2.7Å; G338-V430 VanDerWaalsContact O-CG2 3.28Å; G338-V430 WeakPolarHBondContact O-CG2 3.18Å
339	I	94.1	Very high	90.8	Very high	23 Å²	23	50 Å²	50	12%	0.118	28%	0.28	C	S	.	.			trans	-77.6	148.7	173	65.7	174.9	0	0	0	111.1	T431 E436 Y439	I339-T431 HydrophobicContact CG2-CG2 4.31Å; I339-E436 HydrophobicContact CD1-CB 4.13Å; I339-Y439 HydrophobicContact CD1-CD2 4.09Å; I339-Y439 HydrophobicContact CD1-CE2 3.71Å; I339-Y439 HydrophobicContact CG1-CD2 4.36Å; I339-Y439 HydrophobicContact CG1-CE2 4Å
340	P	95.1	Very high	90.5	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.272	C	S	.	.			trans	-76.5	150.6	-177.3	32.6	-34	0	0	0	111.4	V371 A426 Y439	P340-V371 HydrophobicContact CB-CG1 4.5Å; P340-A426 HydrophobicContact CB-CB 4.17Å; P340-A426 HydrophobicContact CG-CB 3.88Å; P340-A426 WeakPolarHBondContact CG-O 3.45Å; P340-Y439 WeakPolarHBondContact O-CD2 3.43Å
341	S	95	Very high	89.9	Confident	33 Å²	33	51.8 Å²	51.8	23%	0.231	29%	0.285	C	S	.	.			trans	-70.1	174.8	172.5	60.2	0	0	0	0	112.8	P362 K363 D364 A426	S341-P362 WeakPolarHBondContact O-CB 3.45Å; S341-P362 WeakPolarHBondContact O-CG 3.18Å; S341-P362 VanDerWaalsContact OG-CB 3.31Å; S341-P362 WeakPolarHBondContact OG-CB 3.39Å; S341-K363 PolarHBondContact OG-N 3.19Å; S341-D364 PolarHBondContact N-O 3.02Å; S341-D364 PolarHBondContact OG-N 3.32Å; S341-D364 PolarHBondContact OG-O 3.07Å; S341-A426 WeakPolarHBondContact O-CB 3.35Å
342	A	94.8	Very high	89.3	Confident	33 Å²	33	51.3 Å²	51.3	27%	0.273	30%	0.298	S	S	.	.			trans	-65.2	146.8	179.3	0	0	0	0	0	112.9	P362	A342-P362 WeakPolarHBondContact O-CA 3.42Å
343	P	95.3	Very high	88.9	Confident	6 Å²	6	54 Å²	54	4%	0.039	32%	0.316	C	S	.	.			trans	-58.5	156	170.6	-19.7	30.6	0	0	0	112.5	L346 W359 F373 I424 A426 A441	P343-L346 HydrophobicContact CB-CD1 4.24Å; P343-W359 HydrophobicContact CB-CB 4.49Å; P343-W359 HydrophobicContact CB-CG 4.35Å; P343-F373 HydrophobicContact CB-CE1 4.4Å; P343-F373 HydrophobicContact CG-CD1 4.03Å; P343-F373 HydrophobicContact CG-CE1 4.01Å; P343-I424 HydrophobicContact CB-CG2 4.49Å; P343-I424 WeakPolarHBondContact CD-O 3.47Å; P343-I424 HydrophobicContact CG-CB 4.4Å; P343-I424 HydrophobicContact CG-CG2 3.91Å; P343-I424 WeakPolarHBondContact CG-O 3.36Å; P343-A426 HydrophobicContact CG-CB 4.16Å; P343-A441 WeakPolarHBondContact O-CB 3.35Å
344	R	94.9	Very high	89	Confident	115 Å²	115	51.3 Å²	51.3	43%	0.434	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	161.1	-174.5	-62.7	-172.7	-66.3	154.1	-2.2	112.1	L346 R360 L361	R344-L346 PolarHBondContact O-N 3.29Å; R344-R360 HydrophobicContact CB-CB 4.37Å; R344-R360 PolarHBondContact N-O 2.9Å; R344-R360 PolarHBondContact O-N 3.26Å; R344-L361 PolarHBondContact NE-O 2.98Å; R344-L361 VanDerWaalsContact NE-O 3.14Å
345	D	93.1	Very high	89	Confident	94 Å²	94	50.3 Å²	50.3	50%	0.503	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50	53.1	169.6	-54.6	-16.4	0	0	0	113.5	R360	D345-R360 HydrophobicContact CB-CB 4.39Å; D345-R360 HydrophobicContact CB-CG 4.14Å; D345-R360 VanDerWaalsContact OD2-CD 3.32Å; D345-R360 WeakPolarHBondContact OD2-CD 3.12Å; D345-R360 IonicContact OD2-CZ 3.49Å; D345-R360 IonicContact OD2-NE 2.64Å; D345-R360 IonicContact OD2-NH1 2.79Å; D345-R360 PolarHBondContact OD2-NH1 2.96Å
346	L	94.8	Very high	89	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.199	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	134.2	177.6	-79.8	59.6	0	0	0	110.2	P343 R344 W359 I424 A441 I443	P343-L346 HydrophobicContact CB-CD1 4.24Å; R344-L346 PolarHBondContact O-N 3.29Å; L346-W359 HydrophobicContact CD1-CB 3.93Å; L346-W359 HydrophobicContact CG-CB 4.09Å; L346-I424 HydrophobicContact CD2-CD1 3.46Å; L346-I424 VanDerWaalsContact CD2-CD1 3.46Å; L346-I424 HydrophobicContact CG-CD1 4.14Å; L346-A441 HydrophobicContact CD1-CB 3.6Å; L346-A441 HydrophobicContact CD2-CB 3.75Å; L346-A441 HydrophobicContact CG-CB 4.36Å; L346-I443 HydrophobicContact CB-CB 4.29Å; L346-I443 HydrophobicContact CB-CD1 4.04Å; L346-I443 HydrophobicContact CD2-CB 4.17Å; L346-I443 HydrophobicContact CD2-CG2 4.28Å
347	S	91.6	Very high	89.1	Confident	55 Å²	55	49.6 Å²	49.6	39%	0.385	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	162.3	175	64.1	0	0	0	0	111	T358	S347-T358 PolarHBondContact N-O 3.13Å; S347-T358 PolarHBondContact O-N 3.16Å; S347-T358 VanDerWaalsContact O-O 3.13Å; S347-T358 PolarHBondContact OG-OG1 2.75Å
348	Y	91.8	Very high	89.1	Confident	99 Å²	99	51.5 Å²	51.5	39%	0.388	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.3	176.7	74.1	-89.4	0	0	0	112.2	I350 V355 L356 I443 V445	Y348-I350 HydrophobicContact CD2-CG1 4.43Å; Y348-I350 HydrophobicContact CE2-CG1 4.34Å; Y348-V355 HydrophobicContact CD2-CG1 4.43Å; Y348-L356 CarbonylContact C-O 3.57Å; Y348-L356 WeakPolarHBondContact CA-O 3.32Å; Y348-I443 HydrophobicContact CD1-CD1 3.72Å; Y348-I443 HydrophobicContact CD1-CG1 4.11Å; Y348-V445 HydrophobicContact CD1-CG2 3.87Å; Y348-V445 HydrophobicContact CD2-CG1 3.9Å; Y348-V445 HydrophobicContact CD2-CG2 4.15Å; Y348-V445 HydrophobicContact CE1-CG2 4.22Å; Y348-V445 HydrophobicContact CE2-CG1 3.89Å; Y348-V445 HydrophobicContact CE2-CG2 4.49Å; Y348-V445 HydrophobicContact CG-CG1 4.43Å; Y348-V445 HydrophobicContact CG-CG2 3.84Å
349	E	86.3	Confident	89.3	Confident	122 Å²	122	51.6 Å²	51.6	57%	0.57	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	141.2	173.8	-173.7	177.1	-178.1	0	0	109.9	V351 L356	E349-V351 HydrophobicContact CG-CG2 4.29Å; E349-L356 PolarHBondContact N-O 2.76Å; E349-L356 PolarHBondContact O-N 3.26Å
350	I	80	Confident	89.3	Confident	77 Å²	77	57.9 Å²	57.9	40%	0.395	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	114.3	177.3	-57.7	175.3	0	0	0	108.5	Y348 N354	Y348-I350 HydrophobicContact CD2-CG1 4.43Å; Y348-I350 HydrophobicContact CE2-CG1 4.34Å; I350-N354 WeakPolarHBondContact CA-O 3.39Å
351	V	74.6	Confident	89.2	Confident	76 Å²	76	62.3 Å²	62.3	46%	0.461	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	98.9	-179.5	-175.4	0	0	0	0	108.5	E349 S353 N354 L356	E349-V351 HydrophobicContact CG-CG2 4.29Å; V351-S353 PolarHBondContact O-N 2.82Å; V351-N354 PolarHBondContact N-O 2.83Å; V351-N354 PolarHBondContact O-N 2.73Å; V351-L356 HydrophobicContact CG2-CB 4.43Å
352	G	72.7	Confident	89.2	Confident	77 Å²	77	61 Å²	61	79%	0.794	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	-114.6	-172.7	0	0	0	0	0	111.5
353	S	69.6	Low	89.2	Confident	87 Å²	87	68 Å²	68	61%	0.608	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	1	173.6	58.6	0	0	0	0	114	V351	V351-S353 PolarHBondContact O-N 2.82Å
354	N	84.2	Confident	89.1	Confident	42 Å²	42	72.2 Å²	72.2	23%	0.225	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	156	-173.4	-59.6	-16.3	0	0	0	110.9	I350 V351 L410 V411 S412	I350-N354 WeakPolarHBondContact CA-O 3.39Å; V351-N354 PolarHBondContact N-O 2.83Å; V351-N354 PolarHBondContact O-N 2.73Å; N354-L410 HydrophobicContact CB-CD1 3.81Å; N354-L410 HydrophobicContact CB-CG 4.19Å; N354-V411 CarbonylContact C-O 3.56Å; N354-V411 WeakPolarHBondContact CA-O 3.42Å; N354-S412 VanDerWaalsContact OD1-CB 3.22Å; N354-S412 WeakPolarHBondContact OD1-CB 3.46Å
355	V	89	Confident	89	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118	177.1	173.6	0	0	0	0	108.9	Y348 L357 V411 L414 V445	Y348-V355 HydrophobicContact CD2-CG1 4.43Å; V355-L357 HydrophobicContact CG1-CD2 3.94Å; V355-L357 HydrophobicContact CG1-CG 4.26Å; V355-V411 PolarHBondContact N-O 2.85Å; V355-V411 PolarHBondContact O-N 2.9Å; V355-L414 HydrophobicContact CB-CD1 3.8Å; V355-L414 HydrophobicContact CG2-CD1 3.39Å; V355-V445 HydrophobicContact CG1-CG1 3.98Å; V355-V445 HydrophobicContact CG1-CG2 4.33Å; V355-V445 HydrophobicContact CG2-CG1 3.8Å
356	L	92.1	Very high	88.8	Confident	45 Å²	45	65.1 Å²	65.1	24%	0.236	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	114.5	171	179.4	63.9	0	0	0	108.8	Y348 E349 V351 T358 L410	Y348-L356 CarbonylContact C-O 3.57Å; Y348-L356 WeakPolarHBondContact CA-O 3.32Å; E349-L356 PolarHBondContact N-O 2.76Å; E349-L356 PolarHBondContact O-N 3.26Å; V351-L356 HydrophobicContact CG2-CB 4.43Å; L356-T358 HydrophobicContact CD2-CG2 4.44Å; L356-T358 HydrophobicContact CG-CG2 4.13Å; L356-L410 HydrophobicContact CB-CD1 4.08Å; L356-L410 HydrophobicContact CD1-CD1 4.39Å
357	L	94.8	Very high	88.5	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.4	172.8	-62.4	174.6	0	0	0	109.4	V355 W359 V375 R408 V409 V411 F422 I443 V445	V355-L357 HydrophobicContact CG1-CD2 3.94Å; V355-L357 HydrophobicContact CG1-CG 4.26Å; L357-W359 HydrophobicContact CB-CZ3 4.17Å; L357-V375 HydrophobicContact CD1-CG1 4.45Å; L357-R408 CarbonylContact O-C 3.55Å; L357-R408 WeakPolarHBondContact O-CA 3.41Å; L357-V409 HydrophobicContact CB-CG1 3.98Å; L357-V409 HydrophobicContact CD1-CG1 4.05Å; L357-V409 HydrophobicContact CG-CG1 4.45Å; L357-V409 PolarHBondContact N-O 3.16Å; L357-V409 PolarHBondContact O-N 3.09Å; L357-V411 HydrophobicContact CD1-CG2 3.91Å; L357-V411 HydrophobicContact CG-CG2 4.32Å; L357-F422 HydrophobicContact CD1-CB 3.89Å; L357-F422 HydrophobicContact CD1-CD1 3.79Å; L357-F422 HydrophobicContact CD1-CD2 3.92Å; L357-F422 HydrophobicContact CD1-CE1 4.27Å; L357-F422 HydrophobicContact CD1-CE2 4.39Å; L357-F422 HydrophobicContact CD1-CG 3.59Å; L357-F422 HydrophobicContact CD2-CD2 4.17Å; L357-I443 HydrophobicContact CD2-CG2 4.07Å; L357-V445 HydrophobicContact CD2-CG2 4.33Å
358	T	95.1	Very high	88.4	Confident	49 Å²	49	65.5 Å²	65.5	30%	0.301	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.9	173.8	68.7	0	0	0	0	111.3	S347 L356 S407 R408	S347-T358 PolarHBondContact N-O 3.13Å; S347-T358 PolarHBondContact O-N 3.16Å; S347-T358 VanDerWaalsContact O-O 3.13Å; S347-T358 PolarHBondContact OG-OG1 2.75Å; L356-T358 HydrophobicContact CD2-CG2 4.44Å; L356-T358 HydrophobicContact CG-CG2 4.13Å; T358-S407 WeakPolarHBondContact CA-O 3.43Å; T358-R408 HydrophobicContact CG2-CB 4Å
359	W	95.8	Very high	88.3	Confident	10 Å²	10	70.5 Å²	70.5	4%	0.038	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	171.6	177.8	56.8	93.4	0	0	0	111.3	P343 L346 L357 F373 V375 L404 S407 V409 I424	P343-W359 HydrophobicContact CB-CB 4.49Å; P343-W359 HydrophobicContact CB-CG 4.35Å; L346-W359 HydrophobicContact CD1-CB 3.93Å; L346-W359 HydrophobicContact CG-CB 4.09Å; L357-W359 HydrophobicContact CB-CZ3 4.17Å; W359-F373 AromaticContact CD1-CE1 3.99Å; W359-F373 AromaticContact CE2-CG 3.94Å; W359-F373 HydrophobicContact CZ2-CB 3.79Å; W359-F373 HydrophobicContact CZ2-CD2 4.11Å; W359-F373 AromaticContact CZ2-CG 3.94Å; W359-F373 HydrophobicContact CZ2-CG 3.94Å; W359-F373 AromaticContact NE1-CD1 3.41Å; W359-F373 AromaticContact NE1-CD2 3.51Å; W359-F373 AromaticContact NE1-CE1 3.53Å; W359-F373 AromaticContact NE1-CE2 3.64Å; W359-F373 AromaticContact NE1-CG 3.39Å; W359-F373 AromaticContact NE1-CZ 3.64Å; W359-V375 HydrophobicContact CH2-CG2 4.16Å; W359-L404 HydrophobicContact CH2-CD1 4.19Å; W359-S407 PolarHBondContact N-O 3.24Å; W359-S407 WeakPolarHBondContact O-CB 3.26Å; W359-S407 PolarHBondContact O-OG 3.22Å; W359-S407 VanDerWaalsContact O-OG 3.13Å; W359-V409 HydrophobicContact CH2-CB 4.29Å; W359-V409 HydrophobicContact CH2-CG1 4.12Å; W359-V409 HydrophobicContact CZ3-CG1 4.01Å; W359-I424 HydrophobicContact CD2-CG2 3.93Å; W359-I424 HydrophobicContact CE3-CG1 4.17Å; W359-I424 HydrophobicContact CE3-CG2 4.31Å; W359-I424 HydrophobicContact CG-CG2 4.37Å; W359-I424 HydrophobicContact CH2-CG2 4.43Å; W359-I424 HydrophobicContact CZ2-CG2 4.04Å; W359-I424 HydrophobicContact CZ3-CG1 4.29Å
360	R	95.1	Very high	88.6	Confident	155 Å²	155	66.3 Å²	66.3	59%	0.585	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.1	170.2	-69.3	-167.2	-179.4	160.8	-10.4	111.9	R344 D345	R344-R360 HydrophobicContact CB-CB 4.37Å; R344-R360 PolarHBondContact N-O 2.9Å; R344-R360 PolarHBondContact O-N 3.26Å; D345-R360 HydrophobicContact CB-CB 4.39Å; D345-R360 HydrophobicContact CB-CG 4.14Å; D345-R360 VanDerWaalsContact OD2-CD 3.32Å; D345-R360 WeakPolarHBondContact OD2-CD 3.12Å; D345-R360 IonicContact OD2-CZ 3.49Å; D345-R360 IonicContact OD2-NE 2.64Å; D345-R360 IonicContact OD2-NH1 2.79Å; D345-R360 PolarHBondContact OD2-NH1 2.96Å
361	L	93.6	Very high	89.2	Confident	93 Å²	93	63.3 Å²	63.3	49%	0.487	35%	0.354	S	S	.	.			trans	-55.2	146.4	176.2	-76.7	151.3	0	0	0	111.9	R344 L365 F373	R344-L361 PolarHBondContact NE-O 2.98Å; R344-L361 VanDerWaalsContact NE-O 3.14Å; L361-L365 HydrophobicContact CD2-CD2 4.21Å; L361-F373 HydrophobicContact CD2-CE2 4.47Å; L361-F373 HydrophobicContact CD2-CZ 3.97Å
362	P	95.1	Very high	90.2	Very high	6 Å²	6	62.7 Å²	62.7	4%	0.039	35%	0.345	C	S	.	.			trans	-52.8	157.8	172.9	-26	34.2	0	0	0	113.3	S341 A342 D364 L365 F373 A426	S341-P362 WeakPolarHBondContact O-CB 3.45Å; S341-P362 WeakPolarHBondContact O-CG 3.18Å; S341-P362 VanDerWaalsContact OG-CB 3.31Å; S341-P362 WeakPolarHBondContact OG-CB 3.39Å; A342-P362 WeakPolarHBondContact O-CA 3.42Å; P362-D364 WeakPolarHBondContact CB-O 3.33Å; P362-L365 HydrophobicContact CB-CD2 4.06Å; P362-L365 HydrophobicContact CG-CD2 4.15Å; P362-F373 HydrophobicContact CG-CE1 4.36Å; P362-A426 HydrophobicContact CG-CB 3.61Å
363	K	92.9	Very high	91.3	Very high	180 Å²	180	59.2 Å²	59.2	78%	0.783	31%	0.308	S	S	*	.	S	Bend	trans	-69	-42.2	177.4	-176.7	-180	176.1	-175.5	0	111.3	S341	S341-K363 PolarHBondContact OG-N 3.19Å
364	D	93.3	Very high	92.5	Very high	95 Å²	95	56.4 Å²	56.4	51%	0.508	29%	0.286	S	S	.	.			trans	-117.8	126.7	173.4	-174.7	4.4	0	0	0	109	S341 P362 G366	S341-D364 PolarHBondContact N-O 3.02Å; S341-D364 PolarHBondContact OG-N 3.32Å; S341-D364 PolarHBondContact OG-O 3.07Å; P362-D364 WeakPolarHBondContact CB-O 3.33Å; D364-G366 VanDerWaalsContact C-N 3.35Å; D364-G366 PolarHBondContact OD1-N 3.01Å
365	L	92.9	Very high	93.1	Very high	52 Å²	52	54.5 Å²	54.5	27%	0.272	28%	0.276	S	S	.	.			trans	-93.1	3.6	178.3	-54.7	179.4	0	0	0	112.2	L361 P362 G367 R368 V371	L361-L365 HydrophobicContact CD2-CD2 4.21Å; P362-L365 HydrophobicContact CB-CD2 4.06Å; P362-L365 HydrophobicContact CG-CD2 4.15Å; L365-G367 VanDerWaalsContact C-N 3.28Å; L365-G367 PolarHBondContact O-N 3.5Å; L365-R368 WeakPolarHBondContact CB-O 3.47Å; L365-V371 HydrophobicContact CB-CG2 3.95Å; L365-V371 HydrophobicContact CD2-CG2 4.04Å; L365-V371 HydrophobicContact CG-CG2 4.4Å
366	G	89.2	Confident	93.3	Very high	8 Å²	8	55.7 Å²	55.7	8%	0.082	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	20.4	-176.4	0	0	0	0	0	113.2	T337 G338 D364 R368	T337-G366 VanDerWaalsContact CB-O 3.26Å; T337-G366 WeakPolarHBondContact CB-O 3.46Å; G338-G366 PolarHBondContact N-O 3.38Å; G338-G366 WeakPolarHBondContact O-CA 3.46Å; D364-G366 VanDerWaalsContact C-N 3.35Å; D364-G366 PolarHBondContact OD1-N 3.01Å; G366-R368 VanDerWaalsContact C-N 3.35Å
367	G	89.1	Confident	93.3	Very high	71 Å²	71	53.8 Å²	53.8	73%	0.732	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	8.8	-178.6	0	0	0	0	0	115.1	L365	L365-G367 VanDerWaalsContact C-N 3.28Å; L365-G367 PolarHBondContact O-N 3.5Å
368	R	90.4	Very high	93.1	Very high	30 Å²	30	56 Å²	56	11%	0.113	28%	0.282	C	S	.	.			trans	-119.6	165.1	179.8	-44.7	-176.5	68.1	87.4	-1.4	113.2	D330 T337 L365 G366 D370	D330-R368 IonicContact OD1-CZ 2.74Å; D330-R368 IonicContact OD1-NH1 3.51Å; D330-R368 PolarHBondContact OD1-NH1 3.28Å; D330-R368 IonicContact OD1-NH2 2.85Å; D330-R368 PolarHBondContact OD1-NH2 3.4Å; D330-R368 IonicContact OD2-CZ 3.61Å; D330-R368 IonicContact OD2-NH1 2.75Å; D330-R368 PolarHBondContact OD2-NH1 3.5Å; D330-R368 IonicContact OD2-NH2 3.25Å; D330-R368 PolarHBondContact OD2-NH2 3.21Å; T337-R368 HydrophobicContact CG2-CG 3.68Å; T337-R368 WeakPolarHBondContact OG1-CD 3.48Å; T337-R368 PolarHBondContact OG1-NH1 2.99Å; L365-R368 WeakPolarHBondContact CB-O 3.47Å; G366-R368 VanDerWaalsContact C-N 3.35Å; R368-D370 WeakPolarHBondContact CB-OD1 3Å; R368-D370 WeakPolarHBondContact CD-OD1 3.23Å; R368-D370 IonicContact CZ-OD2 3.9Å; R368-D370 IonicContact NE-OD1 3.53Å; R368-D370 PolarHBondContact NE-OD1 2.86Å; R368-D370 IonicContact NE-OD2 3.38Å; R368-D370 PolarHBondContact NE-OD2 2.93Å; R368-D370 IonicContact NH2-OD2 4Å; R368-D370 PolarHBondContact NH2-OD2 3.45Å
369	K	89.7	Confident	92.8	Very high	204 Å²	204	55.9 Å²	55.9	89%	0.887	28%	0.281	S	S	*	.	S	Bend	trans	-110.8	-13.3	178.3	-63.3	-178.4	-177.3	176.2	0	113.3	V371	K369-V371 PolarHBondContact O-N 3.02Å
370	D	92.3	Very high	92.1	Very high	33 Å²	33	56.3 Å²	56.3	18%	0.176	29%	0.285	C	S	.	.			trans	-79.5	50.6	176.3	57.7	-7.8	0	0	0	111	R368 F372 N428 L429	R368-D370 WeakPolarHBondContact CB-OD1 3Å; R368-D370 WeakPolarHBondContact CD-OD1 3.23Å; R368-D370 IonicContact CZ-OD2 3.9Å; R368-D370 IonicContact NE-OD1 3.53Å; R368-D370 PolarHBondContact NE-OD1 2.86Å; R368-D370 IonicContact NE-OD2 3.38Å; R368-D370 PolarHBondContact NE-OD2 2.93Å; R368-D370 IonicContact NH2-OD2 4Å; R368-D370 PolarHBondContact NH2-OD2 3.45Å; D370-F372 HydrophobicContact CB-CE2 4.11Å; D370-F372 HydrophobicContact CB-CZ 4.34Å; D370-F372 VanDerWaalsContact O-CD2 3.24Å; D370-F372 WeakPolarHBondContact O-CD2 3.11Å; D370-F372 WeakPolarHBondContact O-CE2 3.39Å; D370-N428 WeakPolarHBondContact O-CA 3.21Å; D370-L429 HydrophobicContact CB-CG 4.38Å; D370-L429 WeakPolarHBondContact OD2-CB 3.42Å; D370-L429 WeakPolarHBondContact OD2-CD1 3.49Å; D370-L429 WeakPolarHBondContact OD2-CG 3.49Å
371	V	92.8	Very high	90.9	Very high	15 Å²	15	51.9 Å²	51.9	9%	0.091	28%	0.277	C	S	.	.			trans	-89.8	126.1	178	-178.1	0	0	0	0	109.6	P340 L365 K369 F373 A426 V427	P340-V371 HydrophobicContact CB-CG1 4.5Å; L365-V371 HydrophobicContact CB-CG2 3.95Å; L365-V371 HydrophobicContact CD2-CG2 4.04Å; L365-V371 HydrophobicContact CG-CG2 4.4Å; K369-V371 PolarHBondContact O-N 3.02Å; V371-F373 HydrophobicContact CG1-CE1 4.35Å; V371-F373 HydrophobicContact CG1-CZ 4.24Å; V371-A426 HydrophobicContact CG1-CB 4.35Å; V371-V427 CarbonylContact C-O 3.58Å; V371-V427 WeakPolarHBondContact CA-O 3.47Å
372	F	94.9	Very high	89.3	Confident	63 Å²	63	51.5 Å²	51.5	28%	0.276	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	160.6	176.2	-47.9	-83.6	0	0	0	110.1	D370 L404 T405 V427 L429	D370-F372 HydrophobicContact CB-CE2 4.11Å; D370-F372 HydrophobicContact CB-CZ 4.34Å; D370-F372 VanDerWaalsContact O-CD2 3.24Å; D370-F372 WeakPolarHBondContact O-CD2 3.11Å; D370-F372 WeakPolarHBondContact O-CE2 3.39Å; F372-L404 CarbonylContact C-O 3.45Å; F372-L404 WeakPolarHBondContact CA-O 3.17Å; F372-T405 HydrophobicContact CD1-CG2 3.74Å; F372-T405 HydrophobicContact CE1-CG2 3.85Å; F372-V427 HydrophobicContact CB-CG2 3.99Å; F372-V427 PolarHBondContact N-O 3.49Å; F372-V427 WeakPolarHBondContact O-CG2 3.43Å; F372-V427 PolarHBondContact O-N 3.34Å; F372-L429 HydrophobicContact CE2-CD2 4.42Å
373	F	95.5	Very high	87.7	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.013	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.3	179.5	-55.2	-79.5	0	0	0	112.1	P343 W359 L361 P362 V371 G403 L404 I424 Q425 A426	P343-F373 HydrophobicContact CB-CE1 4.4Å; P343-F373 HydrophobicContact CG-CD1 4.03Å; P343-F373 HydrophobicContact CG-CE1 4.01Å; W359-F373 AromaticContact CD1-CE1 3.99Å; W359-F373 AromaticContact CE2-CG 3.94Å; W359-F373 HydrophobicContact CZ2-CB 3.79Å; W359-F373 HydrophobicContact CZ2-CD2 4.11Å; W359-F373 AromaticContact CZ2-CG 3.94Å; W359-F373 HydrophobicContact CZ2-CG 3.94Å; W359-F373 AromaticContact NE1-CD1 3.41Å; W359-F373 AromaticContact NE1-CD2 3.51Å; W359-F373 AromaticContact NE1-CE1 3.53Å; W359-F373 AromaticContact NE1-CE2 3.64Å; W359-F373 AromaticContact NE1-CG 3.39Å; W359-F373 AromaticContact NE1-CZ 3.64Å; L361-F373 HydrophobicContact CD2-CE2 4.47Å; L361-F373 HydrophobicContact CD2-CZ 3.97Å; P362-F373 HydrophobicContact CG-CE1 4.36Å; V371-F373 HydrophobicContact CG1-CE1 4.35Å; V371-F373 HydrophobicContact CG1-CZ 4.24Å; F373-G403 PolarHBondContact O-N 3.32Å; F373-L404 HydrophobicContact CB-CB 4.09Å; F373-L404 WeakPolarHBondContact CD2-O 3.39Å; F373-L404 PolarHBondContact N-O 3.4Å; F373-L404 WeakPolarHBondContact O-CB 2.83Å; F373-L404 PolarHBondContact O-N 2.87Å; F373-I424 HydrophobicContact CB-CG2 4.27Å; F373-I424 HydrophobicContact CD1-CG2 4.28Å; F373-Q425 VanDerWaalsContact CA-O 3.23Å; F373-Q425 WeakPolarHBondContact CA-O 3.45Å; F373-A426 HydrophobicContact CD1-CB 4.16Å; F373-A426 HydrophobicContact CE1-CB 4.02Å
374	N	95.7	Very high	85.8	Confident	29 Å²	29	50.1 Å²	50.1	16%	0.155	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	135.3	174.4	-59.9	-20.4	0	0	0	109.2	V402 G403 I424 Q425	N374-V402 WeakPolarHBondContact OD1-CA 3.17Å; N374-V402 WeakPolarHBondContact OD1-CG1 3.43Å; N374-G403 PolarHBondContact OD1-N 2.97Å; N374-I424 WeakPolarHBondContact O-CA 3.05Å; N374-Q425 HydrophobicContact CB-CB 4.34Å; N374-Q425 PolarHBondContact N-O 2.02Å; N374-Q425 PolarHBondContact O-N 2.99Å
375	V	95.2	Very high	83.9	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120	-177.2	-177.2	0	0	0	0	110.4	L357 W359 F397 Q401 L404 V409 F422 I424	L357-V375 HydrophobicContact CD1-CG1 4.45Å; W359-V375 HydrophobicContact CH2-CG2 4.16Å; V375-F397 HydrophobicContact CB-CE1 4.43Å; V375-F397 HydrophobicContact CG1-CD1 4.41Å; V375-F397 HydrophobicContact CG1-CE1 3.89Å; V375-Q401 PolarHBondContact N-O 3.17Å; V375-Q401 WeakPolarHBondContact O-CG 3.45Å; V375-Q401 PolarHBondContact O-NE2 3.47Å; V375-L404 HydrophobicContact CG2-CD1 3.65Å; V375-V409 HydrophobicContact CG2-CG1 4.15Å; V375-F422 HydrophobicContact CG1-CD1 4.05Å; V375-I424 HydrophobicContact CG2-CG1 4.14Å
376	I	93.6	Very high	82.5	Confident	24 Å²	24	51.6 Å²	51.6	12%	0.123	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.9	177.5	-56.3	176	0	0	0	108.2	K378 F422 E423 Q425	I376-K378 HydrophobicContact CG2-CG 4.34Å; I376-F422 CarbonylContact O-C 3.59Å; I376-F422 WeakPolarHBondContact O-CA 3.22Å; I376-E423 HydrophobicContact CB-CB 4.17Å; I376-E423 PolarHBondContact N-O 2.83Å; I376-E423 PolarHBondContact O-N 2.89Å; I376-Q425 HydrophobicContact CD1-CG 4.1Å
377	C	92.7	Very high	81.8	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.034	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.8	176.1	-179.1	0	0	0	0	110.6	R390 C391 F397 F422	C377-R390 WeakPolarHBondContact O-CA 3.45Å; C377-C391 HydrophobicContact CB-CB 3.62Å; C377-C391 WeakPolarHBondContact CB-SG 3.03Å; C377-C391 PolarHBondContact O-N 3.05Å; C377-C391 PolarHBondContact O-SG 3.48Å; C377-C391 WeakPolarHBondContact SG-CB 3.06Å; C377-C391 CovalentContact SG-SG 2.03Å; C377-C391 PolarHBondContact SG-SG 3.4Å; C377-F397 HydrophobicContact CB-CZ 3.81Å; C377-F422 HydrophobicContact CB-CD1 3.9Å; C377-F422 HydrophobicContact CB-CE1 3.72Å; C377-F422 WeakPolarHBondContact SG-CE1 3.48Å
378	K	91.1	Very high	81.5	Confident	48 Å²	48	56.2 Å²	56.2	21%	0.209	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	144.5	174.7	-60.2	179.8	-176.2	171.4	0	110.6	I376 C388 V389 C391 Y420 T421 E423	I376-K378 HydrophobicContact CG2-CG 4.34Å; K378-C388 HydrophobicContact CB-CB 4.04Å; K378-C388 HydrophobicContact CD-CB 4.35Å; K378-V389 CarbonylContact C-O 3.58Å; K378-V389 VanDerWaalsContact CA-O 3.23Å; K378-V389 WeakPolarHBondContact CA-O 3.36Å; K378-C391 PolarHBondContact N-SG 2.87Å; K378-C391 VanDerWaalsContact N-SG 3.38Å; K378-Y420 CarbonylContact O-C 3.45Å; K378-Y420 WeakPolarHBondContact O-CA 3.27Å; K378-T421 PolarHBondContact N-O 2.97Å; K378-T421 PolarHBondContact O-N 3.4Å; K378-E423 VanDerWaalsContact CE-CD 3.48Å; K378-E423 WeakPolarHBondContact CE-OE1 3.03Å; K378-E423 WeakPolarHBondContact CE-OE2 3.2Å; K378-E423 IonicContact NZ-OE1 3.05Å; K378-E423 PolarHBondContact NZ-OE1 3.23Å; K378-E423 IonicContact NZ-OE2 2.78Å; K378-E423 PolarHBondContact NZ-OE2 2.77Å
379	V	87.6	Confident	81.4	Confident	48 Å²	48	59.6 Å²	59.6	29%	0.291	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.4	171.4	-177	0	0	0	0	108.1	C388 V389 V418 Y420	V379-C388 VanDerWaalsContact O-CA 3.31Å; V379-C388 WeakPolarHBondContact O-CA 3.06Å; V379-V389 PolarHBondContact N-O 2.95Å; V379-V389 PolarHBondContact O-N 3.11Å; V379-V418 HydrophobicContact CG1-CG1 3.54Å; V379-Y420 HydrophobicContact CG2-CD1 3.81Å; V379-Y420 HydrophobicContact CG2-CE1 3.57Å
380	C	81.1	Confident	81.3	Confident	18 Å²	18	58.7 Å²	58.7	12%	0.122	37%	0.369	C	S	.	.			trans	-114	128.7	179.3	-58.1	0	0	0	0	109.3	A382 C388 Q419 T421	C380-A382 PolarHBondContact O-N 3.07Å; C380-C388 HydrophobicContact CB-CB 4.14Å; C380-C388 WeakPolarHBondContact CB-SG 3.45Å; C380-C388 WeakPolarHBondContact SG-CB 3.29Å; C380-C388 CovalentContact SG-SG 2.04Å; C380-C388 PolarHBondContact SG-SG 3.19Å; C380-Q419 PolarHBondContact N-O 3.31Å; C380-T421 PolarHBondContact SG-OG1 3.33Å; C380-T421 VanDerWaalsContact SG-OG1 3.35Å
381	P	70.6	Confident	81.1	Confident	63 Å²	63	58.3 Å²	58.3	41%	0.409	37%	0.369	S	S	.	.			trans	-62	126.3	178.1	-20	30.9	0	0	0	111.6	G383 S384	P381-G383 PolarHBondContact O-N 2.96Å; P381-G383 VanDerWaalsContact O-N 3.14Å; P381-S384 WeakPolarHBondContact CB-OG 3.48Å
382	A	60.7	Low	80.5	Confident	84 Å²	84	59.9 Å²	59.9	69%	0.694	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	111.5	173.5	0	0	0	0	0	109.7	C380	C380-A382 PolarHBondContact O-N 3.07Å
383	G	60.1	Low	79.8	Confident	88 Å²	88	65 Å²	65	91%	0.907	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	14.2	170	0	0	0	0	0	117.4	P381	P381-G383 PolarHBondContact O-N 2.96Å; P381-G383 VanDerWaalsContact O-N 3.14Å
384	S	53	Low	79.1	Confident	69 Å²	69	68.8 Å²	68.8	48%	0.483	45%	0.445	S	S	.	.	S	Bend	trans	-133.6	145.3	169.6	59	0	0	0	0	112	P381 G386	P381-S384 WeakPolarHBondContact CB-OG 3.48Å; S384-G386 PolarHBondContact O-N 3.42Å
385	P	54.6	Low	78.8	Confident	146 Å²	146	68 Å²	68	95%	0.948	44%	0.441	S	S	*	.			trans	-79.3	63.2	-178.2	33.1	-34	0	0	0	111.2
386	G	63.6	Low	78.6	Confident	32 Å²	32	73.5 Å²	73.5	33%	0.33	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-102.1	148.3	172.5	0	0	0	0	0	111.9	S384	S384-G386 PolarHBondContact O-N 3.42Å
387	P	74.6	Confident	78.6	Confident	116 Å²	116	73.8 Å²	73.8	75%	0.753	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-65.4	136.9	175.3	27.6	-33.1	0	0	0	110.6	V389	P387-V389 PolarHBondContact O-N 3.4Å
388	C	81.5	Confident	78.5	Confident	61 Å²	61	79.9 Å²	79.9	41%	0.412	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-66.6	131.8	175.4	-54.7	0	0	0	0	110.4	K378 V379 C380	K378-C388 HydrophobicContact CB-CB 4.04Å; K378-C388 HydrophobicContact CD-CB 4.35Å; V379-C388 VanDerWaalsContact O-CA 3.31Å; V379-C388 WeakPolarHBondContact O-CA 3.06Å; C380-C388 HydrophobicContact CB-CB 4.14Å; C380-C388 WeakPolarHBondContact CB-SG 3.45Å; C380-C388 WeakPolarHBondContact SG-CB 3.29Å; C380-C388 CovalentContact SG-SG 2.04Å; C380-C388 PolarHBondContact SG-SG 3.19Å
389	V	87.7	Confident	78.5	Confident	100 Å²	100	81.9 Å²	81.9	61%	0.606	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	145.9	-178.8	-174.2	0	0	0	0	109	K378 V379 P387	K378-V389 CarbonylContact C-O 3.58Å; K378-V389 VanDerWaalsContact CA-O 3.23Å; K378-V389 WeakPolarHBondContact CA-O 3.36Å; V379-V389 PolarHBondContact N-O 2.95Å; V379-V389 PolarHBondContact O-N 3.11Å; P387-V389 PolarHBondContact O-N 3.4Å
390	R	89.2	Confident	78.8	Confident	186 Å²	186	85.4 Å²	85.4	70%	0.702	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.9	143.2	173.8	-74.3	-164.1	175.4	131.7	-0.9	110.8	C377	C377-R390 WeakPolarHBondContact O-CA 3.45Å
391	C	87.6	Confident	79.4	Confident	25 Å²	25	88.5 Å²	88.5	17%	0.169	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-60.8	146.4	174.9	-56.9	0	0	0	0	110.6	C377 K378 V395	C377-C391 HydrophobicContact CB-CB 3.62Å; C377-C391 WeakPolarHBondContact CB-SG 3.03Å; C377-C391 PolarHBondContact O-N 3.05Å; C377-C391 PolarHBondContact O-SG 3.48Å; C377-C391 WeakPolarHBondContact SG-CB 3.06Å; C377-C391 CovalentContact SG-SG 2.03Å; C377-C391 PolarHBondContact SG-SG 3.4Å; K378-C391 PolarHBondContact N-SG 2.87Å; K378-C391 VanDerWaalsContact N-SG 3.38Å; C391-V395 HydrophobicContact CB-CG2 4.05Å
392	G	80.3	Confident	80.5	Confident	48 Å²	48	89.9 Å²	89.9	50%	0.495	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-76.4	168.4	174.8	0	0	0	0	0	112.8	S394 V395	G392-S394 PolarHBondContact O-N 3.41Å; G392-V395 PolarHBondContact O-N 3.3Å
393	D	80.8	Confident	82	Confident	170 Å²	170	86.8 Å²	86.8	91%	0.909	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-5.9	-175.4	-57	-36.2	0	0	0	114.6	V395	D393-V395 VanDerWaalsContact C-N 3.28Å; D393-V395 PolarHBondContact O-N 2.68Å
394	S	80	Confident	83.6	Confident	82 Å²	82	82.7 Å²	82.7	57%	0.573	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-24.5	175.7	58.3	0	0	0	0	113.2	G392 N413	G392-S394 PolarHBondContact O-N 3.41Å; S394-N413 WeakPolarHBondContact O-CB 3.4Å; S394-N413 PolarHBondContact O-ND2 3.45Å
395	V	89.1	Confident	85.4	Confident	13 Å²	13	83.4 Å²	83.4	8%	0.079	48%	0.476	C	S	.	.	S	Bend	trans	-78.1	124.1	178.3	-178.7	0	0	0	0	109.2	C391 G392 D393 F397 V411 L414	C391-V395 HydrophobicContact CB-CG2 4.05Å; G392-V395 PolarHBondContact O-N 3.3Å; D393-V395 VanDerWaalsContact C-N 3.28Å; D393-V395 PolarHBondContact O-N 2.68Å; V395-F397 HydrophobicContact CB-CE2 4.49Å; V395-F397 HydrophobicContact CG1-CE2 3.99Å; V395-F397 HydrophobicContact CG1-CZ 3.98Å; V395-V411 HydrophobicContact CG1-CG1 3.42Å; V395-V411 VanDerWaalsContact CG1-CG1 3.42Å; V395-L414 HydrophobicContact CG1-CD2 3.99Å; V395-L414 HydrophobicContact CG2-CD2 4.26Å
396	Q	90.9	Very high	87.2	Confident	118 Å²	118	80.6 Å²	80.6	55%	0.551	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.6	-177.7	-67	-176.4	-8.1	0	0	111.3	V411 S412	Q396-V411 WeakPolarHBondContact O-CA 3.36Å; Q396-S412 WeakPolarHBondContact CB-OG 3.5Å; Q396-S412 PolarHBondContact N-O 2.68Å; Q396-S412 PolarHBondContact O-N 2.78Å
397	F	93.9	Very high	88.7	Confident	30 Å²	30	81.5 Å²	81.5	13%	0.132	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.1	-179.6	-61.6	-94	0	0	0	109.5	V375 C377 V395 P399 R400 Q401 V409 L410 V411 F422	V375-F397 HydrophobicContact CB-CE1 4.43Å; V375-F397 HydrophobicContact CG1-CD1 4.41Å; V375-F397 HydrophobicContact CG1-CE1 3.89Å; C377-F397 HydrophobicContact CB-CZ 3.81Å; V395-F397 HydrophobicContact CB-CE2 4.49Å; V395-F397 HydrophobicContact CG1-CE2 3.99Å; V395-F397 HydrophobicContact CG1-CZ 3.98Å; F397-P399 CarbonylContact O-C 3.51Å; F397-R400 PolarHBondContact O-N 3.07Å; F397-Q401 HydrophobicContact CB-CB 4.03Å; F397-Q401 HydrophobicContact CD1-CG 4.29Å; F397-Q401 HydrophobicContact CD2-CB 3.8Å; F397-Q401 HydrophobicContact CD2-CG 3.81Å; F397-Q401 HydrophobicContact CE1-CG 4.4Å; F397-Q401 HydrophobicContact CE2-CB 4.42Å; F397-Q401 HydrophobicContact CE2-CG 3.94Å; F397-Q401 HydrophobicContact CG-CB 3.86Å; F397-Q401 HydrophobicContact CG-CG 4.01Å; F397-Q401 HydrophobicContact CZ-CG 4.24Å; F397-V409 HydrophobicContact CB-CG2 4.01Å; F397-V409 HydrophobicContact CD1-CG2 4.17Å; F397-L410 WeakPolarHBondContact CA-O 3.36Å; F397-V411 HydrophobicContact CD1-CG1 4.46Å; F397-V411 HydrophobicContact CD1-CG2 3.89Å; F397-V411 HydrophobicContact CE1-CG1 4.15Å; F397-V411 HydrophobicContact CE1-CG2 3.92Å; F397-F422 HydrophobicContact CE1-CE1 4.22Å
398	E	91.2	Very high	89.6	Confident	132 Å²	132	82.7 Å²	82.7	62%	0.617	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.7	177	-167.3	173.6	-174.9	0	0	109.8	V409 L410	E398-V409 WeakPolarHBondContact O-CG2 3.08Å; E398-L410 HydrophobicContact CB-CB 4.4Å; E398-L410 PolarHBondContact N-O 2.93Å; E398-L410 PolarHBondContact O-N 3.35Å
399	P	91.1	Very high	90.3	Very high	91 Å²	91	79.8 Å²	79.8	59%	0.591	42%	0.422	S	S	*	.	S	Bend	cis	-82.2	-23.7	7.5	31	-35	0	0	0	115.6	F397 L404	F397-P399 CarbonylContact O-C 3.51Å; P399-L404 HydrophobicContact CG-CD2 4Å
400	R	93	Very high	90.6	Very high	121 Å²	121	77.2 Å²	77.2	46%	0.457	40%	0.404	S	S	.	.			trans	-163.3	165	-179.7	53.9	-171.9	157.5	179.3	-3.7	111.6	F397 V402 G403 L404	F397-R400 PolarHBondContact O-N 3.07Å; R400-V402 WeakPolarHBondContact CD-O 3.41Å; R400-G403 PolarHBondContact NE-O 3.33Å; R400-G403 VanDerWaalsContact NE-O 3.16Å; R400-G403 PolarHBondContact NH2-O 3.25Å; R400-L404 HydrophobicContact CG-CD2 3.91Å; R400-L404 HydrophobicContact CG-CG 4.14Å; R400-L404 WeakPolarHBondContact O-CD1 3.26Å; R400-L404 VanDerWaalsContact O-CD2 3.27Å; R400-L404 WeakPolarHBondContact O-CD2 3.2Å; R400-L404 WeakPolarHBondContact O-CG 3.05Å
401	Q	93.6	Very high	90.7	Very high	84 Å²	84	68.3 Å²	68.3	39%	0.393	37%	0.371	S	S	.	.	S	Bend	trans	-89.9	-32.8	179.4	-172.1	179.1	-0.6	0	0	114	V375 F397	V375-Q401 PolarHBondContact N-O 3.17Å; V375-Q401 WeakPolarHBondContact O-CG 3.45Å; V375-Q401 PolarHBondContact O-NE2 3.47Å; F397-Q401 HydrophobicContact CB-CB 4.03Å; F397-Q401 HydrophobicContact CD1-CG 4.29Å; F397-Q401 HydrophobicContact CD2-CB 3.8Å; F397-Q401 HydrophobicContact CD2-CG 3.81Å; F397-Q401 HydrophobicContact CE1-CG 4.4Å; F397-Q401 HydrophobicContact CE2-CB 4.42Å; F397-Q401 HydrophobicContact CE2-CG 3.94Å; F397-Q401 HydrophobicContact CG-CB 3.86Å; F397-Q401 HydrophobicContact CG-CG 4.01Å; F397-Q401 HydrophobicContact CZ-CG 4.24Å
402	V	93.6	Very high	90.8	Very high	91 Å²	91	68 Å²	68	55%	0.552	37%	0.368	S	S	*	.	S	Bend	trans	-125	146.7	-174	179.1	0	0	0	0	108.5	N374 R400 L404	N374-V402 WeakPolarHBondContact OD1-CA 3.17Å; N374-V402 WeakPolarHBondContact OD1-CG1 3.43Å; R400-V402 WeakPolarHBondContact CD-O 3.41Å; V402-L404 VanDerWaalsContact C-N 3.33Å
403	G	92.1	Very high	91	Very high	20 Å²	20	70 Å²	70	21%	0.206	37%	0.368	C	S	.	.	S	Bend	trans	70.6	29.8	178.7	0	0	0	0	0	113.3	F373 N374 R400 T405	F373-G403 PolarHBondContact O-N 3.32Å; N374-G403 PolarHBondContact OD1-N 2.97Å; R400-G403 PolarHBondContact NE-O 3.33Å; R400-G403 VanDerWaalsContact NE-O 3.16Å; R400-G403 PolarHBondContact NH2-O 3.25Å; G403-T405 PolarHBondContact O-N 2.82Å
404	L	94	Very high	91.1	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-67.1	125.9	175.8	-75.5	155.1	0	0	0	110	W359 F372 F373 V375 P399 R400 V402 V409	W359-L404 HydrophobicContact CH2-CD1 4.19Å; F372-L404 CarbonylContact C-O 3.45Å; F372-L404 WeakPolarHBondContact CA-O 3.17Å; F373-L404 HydrophobicContact CB-CB 4.09Å; F373-L404 WeakPolarHBondContact CD2-O 3.39Å; F373-L404 PolarHBondContact N-O 3.4Å; F373-L404 WeakPolarHBondContact O-CB 2.83Å; F373-L404 PolarHBondContact O-N 2.87Å; V375-L404 HydrophobicContact CG2-CD1 3.65Å; P399-L404 HydrophobicContact CG-CD2 4Å; R400-L404 HydrophobicContact CG-CD2 3.91Å; R400-L404 HydrophobicContact CG-CG 4.14Å; R400-L404 WeakPolarHBondContact O-CD1 3.26Å; R400-L404 VanDerWaalsContact O-CD2 3.27Å; R400-L404 WeakPolarHBondContact O-CD2 3.2Å; R400-L404 WeakPolarHBondContact O-CG 3.05Å; V402-L404 VanDerWaalsContact C-N 3.33Å; L404-V409 HydrophobicContact CD1-CB 4.21Å; L404-V409 HydrophobicContact CD1-CG2 4.32Å; L404-V409 HydrophobicContact CD2-CG2 4.43Å
405	T	91.8	Very high	91	Very high	84 Å²	84	64.5 Å²	64.5	52%	0.515	33%	0.331	S	S	.	.			trans	-91.7	-23.2	174.1	47.5	0	0	0	0	112.1	F372 G403	F372-T405 HydrophobicContact CD1-CG2 3.74Å; F372-T405 HydrophobicContact CE1-CG2 3.85Å; G403-T405 PolarHBondContact O-N 2.82Å
406	E	91.9	Very high	90.1	Very high	88 Å²	88	67.2 Å²	67.2	41%	0.411	36%	0.355	S	S	.	.	S	Bend	trans	-94	149.6	176.8	-61	-168.6	-171	0	0	110.7	R408	E406-R408 HydrophobicContact CB-CG 4.2Å; E406-R408 PolarHBondContact O-N 3.04Å; E406-R408 VanDerWaalsContact O-N 3.12Å; E406-R408 IonicContact OE1-NH2 2.65Å; E406-R408 IonicContact OE2-CZ 2.71Å; E406-R408 VanDerWaalsContact OE2-CZ 3.25Å; E406-R408 IonicContact OE2-NE 3.29Å; E406-R408 PolarHBondContact OE2-NE 3.38Å; E406-R408 IonicContact OE2-NH2 2.78Å; E406-R408 PolarHBondContact OE2-NH2 3.4Å
407	S	93.9	Very high	89.1	Confident	51 Å²	51	71 Å²	71	36%	0.357	36%	0.364	S	S	.	.	S	Bend	trans	-87.6	37.3	179.7	66.2	0	0	0	0	113	T358 W359	T358-S407 WeakPolarHBondContact CA-O 3.43Å; W359-S407 PolarHBondContact N-O 3.24Å; W359-S407 WeakPolarHBondContact O-CB 3.26Å; W359-S407 PolarHBondContact O-OG 3.22Å; W359-S407 VanDerWaalsContact O-OG 3.13Å
408	R	94.5	Very high	88.3	Confident	140 Å²	140	71.3 Å²	71.3	53%	0.528	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	148.6	178.6	61.8	-178.4	165.6	-170	-5.3	111.3	L357 T358 E406	L357-R408 CarbonylContact O-C 3.55Å; L357-R408 WeakPolarHBondContact O-CA 3.41Å; T358-R408 HydrophobicContact CG2-CB 4Å; E406-R408 HydrophobicContact CB-CG 4.2Å; E406-R408 PolarHBondContact O-N 3.04Å; E406-R408 VanDerWaalsContact O-N 3.12Å; E406-R408 IonicContact OE1-NH2 2.65Å; E406-R408 IonicContact OE2-CZ 2.71Å; E406-R408 VanDerWaalsContact OE2-CZ 3.25Å; E406-R408 IonicContact OE2-NE 3.29Å; E406-R408 PolarHBondContact OE2-NE 3.38Å; E406-R408 IonicContact OE2-NH2 2.78Å; E406-R408 PolarHBondContact OE2-NH2 3.4Å
409	V	95.7	Very high	87.9	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	138.2	170.9	69.9	0	0	0	0	109.6	L357 W359 V375 F397 E398 L404 V411	L357-V409 HydrophobicContact CB-CG1 3.98Å; L357-V409 HydrophobicContact CD1-CG1 4.05Å; L357-V409 HydrophobicContact CG-CG1 4.45Å; L357-V409 PolarHBondContact N-O 3.16Å; L357-V409 PolarHBondContact O-N 3.09Å; W359-V409 HydrophobicContact CH2-CB 4.29Å; W359-V409 HydrophobicContact CH2-CG1 4.12Å; W359-V409 HydrophobicContact CZ3-CG1 4.01Å; V375-V409 HydrophobicContact CG2-CG1 4.15Å; F397-V409 HydrophobicContact CB-CG2 4.01Å; F397-V409 HydrophobicContact CD1-CG2 4.17Å; E398-V409 WeakPolarHBondContact O-CG2 3.08Å; L404-V409 HydrophobicContact CD1-CB 4.21Å; L404-V409 HydrophobicContact CD1-CG2 4.32Å; L404-V409 HydrophobicContact CD2-CG2 4.43Å; V409-V411 HydrophobicContact CG1-CG2 4.17Å
410	L	93.6	Very high	87.8	Confident	45 Å²	45	64.5 Å²	64.5	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.2	171.8	-173.2	70.8	0	0	0	108.9	N354 L356 F397 E398	N354-L410 HydrophobicContact CB-CD1 3.81Å; N354-L410 HydrophobicContact CB-CG 4.19Å; L356-L410 HydrophobicContact CB-CD1 4.08Å; L356-L410 HydrophobicContact CD1-CD1 4.39Å; F397-L410 WeakPolarHBondContact CA-O 3.36Å; E398-L410 HydrophobicContact CB-CB 4.4Å; E398-L410 PolarHBondContact N-O 2.93Å; E398-L410 PolarHBondContact O-N 3.35Å
411	V	93.2	Very high	87.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.4	179.9	-169.6	0	0	0	0	109.3	N354 V355 L357 V395 Q396 F397 V409 L414 F422	N354-V411 CarbonylContact C-O 3.56Å; N354-V411 WeakPolarHBondContact CA-O 3.42Å; V355-V411 PolarHBondContact N-O 2.85Å; V355-V411 PolarHBondContact O-N 2.9Å; L357-V411 HydrophobicContact CD1-CG2 3.91Å; L357-V411 HydrophobicContact CG-CG2 4.32Å; V395-V411 HydrophobicContact CG1-CG1 3.42Å; V395-V411 VanDerWaalsContact CG1-CG1 3.42Å; Q396-V411 WeakPolarHBondContact O-CA 3.36Å; F397-V411 HydrophobicContact CD1-CG1 4.46Å; F397-V411 HydrophobicContact CD1-CG2 3.89Å; F397-V411 HydrophobicContact CE1-CG1 4.15Å; F397-V411 HydrophobicContact CE1-CG2 3.92Å; V409-V411 HydrophobicContact CG1-CG2 4.17Å; V411-L414 HydrophobicContact CB-CD1 4.44Å; V411-L414 HydrophobicContact CG1-CD1 4.15Å; V411-L414 HydrophobicContact CG1-CD2 3.93Å; V411-L414 HydrophobicContact CG1-CG 4.15Å; V411-F422 HydrophobicContact CB-CZ 4.45Å; V411-F422 HydrophobicContact CG1-CE1 4.02Å; V411-F422 HydrophobicContact CG1-CZ 3.99Å; V411-F422 HydrophobicContact CG2-CE1 4.13Å; V411-F422 HydrophobicContact CG2-CZ 4.35Å
412	S	88.8	Confident	87.7	Confident	17 Å²	17	55.5 Å²	55.5	12%	0.119	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	173.4	-177.3	60.9	0	0	0	0	112.1	N354 Q396 L414	N354-S412 VanDerWaalsContact OD1-CB 3.22Å; N354-S412 WeakPolarHBondContact OD1-CB 3.46Å; Q396-S412 WeakPolarHBondContact CB-OG 3.5Å; Q396-S412 PolarHBondContact N-O 2.68Å; Q396-S412 PolarHBondContact O-N 2.78Å; S412-L414 VanDerWaalsContact C-N 3.29Å; S412-L414 PolarHBondContact O-N 2.62Å
413	N	85.1	Confident	87.7	Confident	91 Å²	91	52.2 Å²	52.2	49%	0.487	27%	0.271	S	S	.	.			trans	59	34.1	-176	-61.5	-23.3	0	0	0	114.4	S394	S394-N413 WeakPolarHBondContact O-CB 3.4Å; S394-N413 PolarHBondContact O-ND2 3.45Å
414	L	82.9	Confident	87.9	Confident	20 Å²	20	51.3 Å²	51.3	11%	0.105	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-79.7	130.2	174.2	-62.9	172	0	0	0	110.2	V355 V395 V411 S412 Y420 F422 T447	V355-L414 HydrophobicContact CB-CD1 3.8Å; V355-L414 HydrophobicContact CG2-CD1 3.39Å; V395-L414 HydrophobicContact CG1-CD2 3.99Å; V395-L414 HydrophobicContact CG2-CD2 4.26Å; V411-L414 HydrophobicContact CB-CD1 4.44Å; V411-L414 HydrophobicContact CG1-CD1 4.15Å; V411-L414 HydrophobicContact CG1-CD2 3.93Å; V411-L414 HydrophobicContact CG1-CG 4.15Å; S412-L414 VanDerWaalsContact C-N 3.29Å; S412-L414 PolarHBondContact O-N 2.62Å; L414-Y420 HydrophobicContact CB-CE2 4.07Å; L414-Y420 HydrophobicContact CD2-CD1 3.92Å; L414-Y420 HydrophobicContact CD2-CD2 4.11Å; L414-Y420 HydrophobicContact CD2-CE1 3.73Å; L414-Y420 HydrophobicContact CD2-CE2 3.93Å; L414-Y420 HydrophobicContact CD2-CG 4.11Å; L414-F422 HydrophobicContact CD2-CZ 4.31Å; L414-T447 HydrophobicContact CB-CG2 4.14Å; L414-T447 HydrophobicContact CD1-CG2 4.48Å
415	L	77	Confident	88	Confident	117 Å²	117	53 Å²	53	61%	0.613	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-62.6	138	174.5	-61.9	172.8	0	0	0	111.1	V418 Y420 T447	L415-V418 HydrophobicContact CB-CB 4.35Å; L415-V418 HydrophobicContact CB-CG2 3.79Å; L415-V418 HydrophobicContact CD1-CG2 4.47Å; L415-Y420 WeakPolarHBondContact CB-OH 3.21Å; L415-Y420 PolarHBondContact N-OH 3.38Å; L415-T447 PolarHBondContact O-OG1 2.98Å
416	A	70.8	Confident	88.2	Confident	69 Å²	69	49 Å²	49	57%	0.57	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	143.6	174.6	0	0	0	0	0	111.2	V418 T447	A416-V418 VanDerWaalsContact C-N 3.28Å; A416-V418 PolarHBondContact O-N 2.81Å; A416-T447 VanDerWaalsContact CA-OG1 3.27Å; A416-T447 WeakPolarHBondContact CA-OG1 3.32Å
417	R	70.3	Confident	88.3	Confident	197 Å²	197	45.9 Å²	45.9	74%	0.743	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	24.2	178.8	-57.3	-179.6	175.8	159.8	-0.4	115.4	T447 Q449	R417-T447 PolarHBondContact N-O 2.86Å; R417-T447 PolarHBondContact N-OG1 3.46Å; R417-Q449 VanDerWaalsContact NH2-NE2 3.19Å
418	V	76.3	Confident	88.3	Confident	38 Å²	38	43.8 Å²	43.8	23%	0.23	22%	0.217	C	C	.	.			trans	-110.7	142.2	173.9	177.3	0	0	0	0	110.1	V379 L415 A416 Y420	V379-V418 HydrophobicContact CG1-CG1 3.54Å; L415-V418 HydrophobicContact CB-CB 4.35Å; L415-V418 HydrophobicContact CB-CG2 3.79Å; L415-V418 HydrophobicContact CD1-CG2 4.47Å; A416-V418 VanDerWaalsContact C-N 3.28Å; A416-V418 PolarHBondContact O-N 2.81Å; V418-Y420 HydrophobicContact CB-CD2 4.39Å; V418-Y420 HydrophobicContact CB-CE2 3.68Å; V418-Y420 HydrophobicContact CG1-CD2 4.18Å; V418-Y420 HydrophobicContact CG1-CE1 4.48Å; V418-Y420 HydrophobicContact CG1-CE2 3.67Å
419	Q	83.6	Confident	88.2	Confident	72 Å²	72	40.9 Å²	40.9	34%	0.336	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	117.9	175.8	-174	176	-8.8	0	0	110.6	C380 V445	C380-Q419 PolarHBondContact N-O 3.31Å; Q419-V445 WeakPolarHBondContact CA-O 3.46Å
420	Y	87.8	Confident	88.1	Confident	8 Å²	8	40.8 Å²	40.8	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	141.3	177.6	-66.7	-92	0	0	0	110.5	K378 V379 L414 L415 V418 N444 V445	K378-Y420 CarbonylContact O-C 3.45Å; K378-Y420 WeakPolarHBondContact O-CA 3.27Å; V379-Y420 HydrophobicContact CG2-CD1 3.81Å; V379-Y420 HydrophobicContact CG2-CE1 3.57Å; L414-Y420 HydrophobicContact CB-CE2 4.07Å; L414-Y420 HydrophobicContact CD2-CD1 3.92Å; L414-Y420 HydrophobicContact CD2-CD2 4.11Å; L414-Y420 HydrophobicContact CD2-CE1 3.73Å; L414-Y420 HydrophobicContact CD2-CE2 3.93Å; L414-Y420 HydrophobicContact CD2-CG 4.11Å; L415-Y420 WeakPolarHBondContact CB-OH 3.21Å; L415-Y420 PolarHBondContact N-OH 3.38Å; V418-Y420 HydrophobicContact CB-CD2 4.39Å; V418-Y420 HydrophobicContact CB-CE2 3.68Å; V418-Y420 HydrophobicContact CG1-CD2 4.18Å; V418-Y420 HydrophobicContact CG1-CE1 4.48Å; V418-Y420 HydrophobicContact CG1-CE2 3.67Å; Y420-N444 CarbonylContact O-C 3.52Å; Y420-N444 VanDerWaalsContact O-CA 3.29Å; Y420-N444 WeakPolarHBondContact O-CA 3.12Å; Y420-V445 PolarHBondContact N-O 2.67Å; Y420-V445 PolarHBondContact O-N 3.32Å
421	T	91	Very high	88	Confident	16 Å²	16	39.3 Å²	39.3	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.6	170.6	-61.8	0	0	0	0	108.7	K378 C380 I443 N444	K378-T421 PolarHBondContact N-O 2.97Å; K378-T421 PolarHBondContact O-N 3.4Å; C380-T421 PolarHBondContact SG-OG1 3.33Å; C380-T421 VanDerWaalsContact SG-OG1 3.35Å; T421-I443 CarbonylContact C-O 3.53Å; T421-I443 WeakPolarHBondContact CA-O 3.3Å; T421-N444 WeakPolarHBondContact CB-OD1 3.34Å; T421-N444 VanDerWaalsContact CG2-OD1 3.31Å; T421-N444 WeakPolarHBondContact CG2-OD1 3.48Å; T421-N444 PolarHBondContact OG1-OD1 3.07Å
422	F	93.8	Very high	87.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.6	177	-63.8	-83.6	0	0	0	110	L357 V375 I376 C377 F397 V411 L414 I424 T442 I443 V445	L357-F422 HydrophobicContact CD1-CB 3.89Å; L357-F422 HydrophobicContact CD1-CD1 3.79Å; L357-F422 HydrophobicContact CD1-CD2 3.92Å; L357-F422 HydrophobicContact CD1-CE1 4.27Å; L357-F422 HydrophobicContact CD1-CE2 4.39Å; L357-F422 HydrophobicContact CD1-CG 3.59Å; L357-F422 HydrophobicContact CD2-CD2 4.17Å; V375-F422 HydrophobicContact CG1-CD1 4.05Å; I376-F422 CarbonylContact O-C 3.59Å; I376-F422 WeakPolarHBondContact O-CA 3.22Å; C377-F422 HydrophobicContact CB-CD1 3.9Å; C377-F422 HydrophobicContact CB-CE1 3.72Å; C377-F422 WeakPolarHBondContact SG-CE1 3.48Å; F397-F422 HydrophobicContact CE1-CE1 4.22Å; V411-F422 HydrophobicContact CB-CZ 4.45Å; V411-F422 HydrophobicContact CG1-CE1 4.02Å; V411-F422 HydrophobicContact CG1-CZ 3.99Å; V411-F422 HydrophobicContact CG2-CE1 4.13Å; V411-F422 HydrophobicContact CG2-CZ 4.35Å; L414-F422 HydrophobicContact CD2-CZ 4.31Å; F422-I424 HydrophobicContact CB-CD1 4.27Å; F422-T442 CarbonylContact O-C 3.55Å; F422-T442 VanDerWaalsContact O-CA 3.25Å; F422-T442 WeakPolarHBondContact O-CA 3.35Å; F422-I443 HydrophobicContact CB-CG2 4.07Å; F422-I443 PolarHBondContact N-O 3.38Å; F422-I443 PolarHBondContact O-N 3.11Å; F422-V445 HydrophobicContact CD2-CG2 4.01Å; F422-V445 HydrophobicContact CE2-CB 4.27Å; F422-V445 HydrophobicContact CE2-CG2 4.04Å
423	E	94.8	Very high	87.9	Confident	22 Å²	22	51.7 Å²	51.7	10%	0.103	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.9	171.7	-40	-176.2	144.1	0	0	108.9	I376 K378 Y440 A441 T442	I376-E423 HydrophobicContact CB-CB 4.17Å; I376-E423 PolarHBondContact N-O 2.83Å; I376-E423 PolarHBondContact O-N 2.89Å; K378-E423 VanDerWaalsContact CE-CD 3.48Å; K378-E423 WeakPolarHBondContact CE-OE1 3.03Å; K378-E423 WeakPolarHBondContact CE-OE2 3.2Å; K378-E423 IonicContact NZ-OE1 3.05Å; K378-E423 PolarHBondContact NZ-OE1 3.23Å; K378-E423 IonicContact NZ-OE2 2.78Å; K378-E423 PolarHBondContact NZ-OE2 2.77Å; E423-Y440 HydrophobicContact CB-CD2 4.03Å; E423-Y440 HydrophobicContact CG-CD2 4.42Å; E423-A441 CarbonylContact C-O 3.57Å; E423-A441 WeakPolarHBondContact CA-O 3.26Å; E423-T442 HydrophobicContact CB-CG2 4.12Å; E423-T442 HydrophobicContact CG-CG2 3.76Å
424	I	95.9	Very high	88.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.6	178.6	-59.6	91.6	0	0	0	107.7	P343 L346 W359 F373 N374 V375 F422 Y440 A441 I443	P343-I424 HydrophobicContact CB-CG2 4.49Å; P343-I424 WeakPolarHBondContact CD-O 3.47Å; P343-I424 HydrophobicContact CG-CB 4.4Å; P343-I424 HydrophobicContact CG-CG2 3.91Å; P343-I424 WeakPolarHBondContact CG-O 3.36Å; L346-I424 HydrophobicContact CD2-CD1 3.46Å; L346-I424 VanDerWaalsContact CD2-CD1 3.46Å; L346-I424 HydrophobicContact CG-CD1 4.14Å; W359-I424 HydrophobicContact CD2-CG2 3.93Å; W359-I424 HydrophobicContact CE3-CG1 4.17Å; W359-I424 HydrophobicContact CE3-CG2 4.31Å; W359-I424 HydrophobicContact CG-CG2 4.37Å; W359-I424 HydrophobicContact CH2-CG2 4.43Å; W359-I424 HydrophobicContact CZ2-CG2 4.04Å; W359-I424 HydrophobicContact CZ3-CG1 4.29Å; F373-I424 HydrophobicContact CB-CG2 4.27Å; F373-I424 HydrophobicContact CD1-CG2 4.28Å; N374-I424 WeakPolarHBondContact O-CA 3.05Å; V375-I424 HydrophobicContact CG2-CG1 4.14Å; F422-I424 HydrophobicContact CB-CD1 4.27Å; I424-Y440 VanDerWaalsContact O-CA 3.26Å; I424-Y440 WeakPolarHBondContact O-CA 3.35Å; I424-A441 PolarHBondContact N-O 3.13Å; I424-A441 PolarHBondContact O-N 2.85Å; I424-I443 HydrophobicContact CD1-CG2 4.35Å
425	Q	95.8	Very high	88.3	Confident	37 Å²	37	53 Å²	53	17%	0.173	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.6	177.6	-48.7	-170.3	-58.2	0	0	109.8	F373 N374 I376 P438	F373-Q425 VanDerWaalsContact CA-O 3.23Å; F373-Q425 WeakPolarHBondContact CA-O 3.45Å; N374-Q425 HydrophobicContact CB-CB 4.34Å; N374-Q425 PolarHBondContact N-O 2.02Å; N374-Q425 PolarHBondContact O-N 2.99Å; I376-Q425 HydrophobicContact CD1-CG 4.1Å; Q425-P438 HydrophobicContact CB-CB 4.4Å
426	A	94.9	Very high	88.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.9	166	0	0	0	0	0	109.2	P340 S341 P343 P362 V371 F373 Y439	P340-A426 HydrophobicContact CB-CB 4.17Å; P340-A426 HydrophobicContact CG-CB 3.88Å; P340-A426 WeakPolarHBondContact CG-O 3.45Å; S341-A426 WeakPolarHBondContact O-CB 3.35Å; P343-A426 HydrophobicContact CG-CB 4.16Å; P362-A426 HydrophobicContact CG-CB 3.61Å; V371-A426 HydrophobicContact CG1-CB 4.35Å; F373-A426 HydrophobicContact CD1-CB 4.16Å; F373-A426 HydrophobicContact CE1-CB 4.02Å; A426-Y439 PolarHBondContact N-O 2.78Å
427	V	94.9	Very high	89.5	Confident	21 Å²	21	51 Å²	51	13%	0.127	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	154	179.3	-59.6	0	0	0	0	110.3	V371 F372 T431 P438	V371-V427 CarbonylContact C-O 3.58Å; V371-V427 WeakPolarHBondContact CA-O 3.47Å; F372-V427 HydrophobicContact CB-CG2 3.99Å; F372-V427 PolarHBondContact N-O 3.49Å; F372-V427 WeakPolarHBondContact O-CG2 3.43Å; F372-V427 PolarHBondContact O-N 3.34Å; V427-T431 HydrophobicContact CB-CG2 4.28Å; V427-T431 HydrophobicContact CG1-CG2 4.15Å; V427-P438 HydrophobicContact CG1-CB 4Å; V427-P438 HydrophobicContact CG1-CG 4.15Å
428	N	93.9	Very high	90.5	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.037	25%	0.246	C	C	.	.			trans	-137.7	178.3	171.9	68	9	0	0	0	110	G338 D370 V430 T431	G338-N428 PolarHBondContact O-ND2 2.7Å; D370-N428 WeakPolarHBondContact O-CA 3.21Å; N428-V430 PolarHBondContact O-N 2.8Å; N428-V430 VanDerWaalsContact O-N 3.14Å; N428-V430 WeakPolarHBondContact OD1-CG2 3.34Å; N428-V430 PolarHBondContact OD1-N 3.43Å; N428-T431 PolarHBondContact N-OG1 2.03Å; N428-T431 VanDerWaalsContact O-CB 3.25Å; N428-T431 WeakPolarHBondContact O-CB 3.31Å; N428-T431 PolarHBondContact O-N 2.93Å; N428-T431 PolarHBondContact O-OG1 2.04Å; N428-T431 VanDerWaalsContact O-OG1 3.14Å; N428-T431 PolarHBondContact OD1-N 2.85Å; N428-T431 VanDerWaalsContact OD1-N 3.1Å; N428-T431 PolarHBondContact OD1-OG1 3.49Å
429	L	92.4	Very high	91.3	Very high	79 Å²	79	46.9 Å²	46.9	41%	0.414	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.8	-175.5	-66.6	-177.4	0	0	0	114.7	D370 F372	D370-L429 HydrophobicContact CB-CG 4.38Å; D370-L429 WeakPolarHBondContact OD2-CB 3.42Å; D370-L429 WeakPolarHBondContact OD2-CD1 3.49Å; D370-L429 WeakPolarHBondContact OD2-CG 3.49Å; F372-L429 HydrophobicContact CE2-CD2 4.42Å
430	V	92.8	Very high	91.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-4.4	176.6	-61.8	0	0	0	0	113.1	G338 N428 E432 L433 S434	G338-V430 VanDerWaalsContact O-CG2 3.28Å; G338-V430 WeakPolarHBondContact O-CG2 3.18Å; N428-V430 PolarHBondContact O-N 2.8Å; N428-V430 VanDerWaalsContact O-N 3.14Å; N428-V430 WeakPolarHBondContact OD1-CG2 3.34Å; N428-V430 PolarHBondContact OD1-N 3.43Å; V430-E432 VanDerWaalsContact C-N 3.28Å; V430-E432 PolarHBondContact O-N 2.69Å; V430-L433 PolarHBondContact O-N 3.48Å; V430-L433 VanDerWaalsContact O-N 3.13Å; V430-S434 PolarHBondContact O-N 3.19Å
431	T	92.5	Very high	92.1	Very high	13 Å²	13	49.9 Å²	49.9	8%	0.08	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-65.1	-32.9	-177.8	-57.9	0	0	0	0	112.2	I339 V427 N428 L433 S434 P438	I339-T431 HydrophobicContact CG2-CG2 4.31Å; V427-T431 HydrophobicContact CB-CG2 4.28Å; V427-T431 HydrophobicContact CG1-CG2 4.15Å; N428-T431 PolarHBondContact N-OG1 2.03Å; N428-T431 VanDerWaalsContact O-CB 3.25Å; N428-T431 WeakPolarHBondContact O-CB 3.31Å; N428-T431 PolarHBondContact O-N 2.93Å; N428-T431 PolarHBondContact O-OG1 2.04Å; N428-T431 VanDerWaalsContact O-OG1 3.14Å; N428-T431 PolarHBondContact OD1-N 2.85Å; N428-T431 VanDerWaalsContact OD1-N 3.1Å; N428-T431 PolarHBondContact OD1-OG1 3.49Å; T431-L433 VanDerWaalsContact C-N 3.29Å; T431-L433 PolarHBondContact O-N 2.77Å; T431-S434 PolarHBondContact O-N 2.91Å; T431-P438 HydrophobicContact CG2-CB 4.29Å; T431-P438 HydrophobicContact CG2-CG 3.82Å
432	E	89.4	Confident	92.2	Very high	188 Å²	188	52.8 Å²	52.8	88%	0.879	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-71.9	-21.8	176.2	-62.8	-173.5	171.3	0	0	113.6	V430	V430-E432 VanDerWaalsContact C-N 3.28Å; V430-E432 PolarHBondContact O-N 2.69Å
433	L	90	Very high	92.2	Very high	90 Å²	90	54 Å²	54	47%	0.471	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-84.7	-14.4	178	-58.2	175.4	0	0	0	112.4	Y325 R326 V430 T431	Y325-L433 HydrophobicContact CD1-CB 4.08Å; Y325-L433 HydrophobicContact CG-CB 3.99Å; R326-L433 VanDerWaalsContact O-CD1 3.26Å; R326-L433 WeakPolarHBondContact O-CD1 3.27Å; V430-L433 PolarHBondContact O-N 3.48Å; V430-L433 VanDerWaalsContact O-N 3.13Å; T431-L433 VanDerWaalsContact C-N 3.29Å; T431-L433 PolarHBondContact O-N 2.77Å
434	S	89.4	Confident	92	Very high	22 Å²	22	56.9 Å²	56.9	15%	0.154	31%	0.309	C	S	.	.			trans	-81.9	140.7	-179.2	-173.1	0	0	0	0	111.6	V430 T431 E436	V430-S434 PolarHBondContact O-N 3.19Å; T431-S434 PolarHBondContact O-N 2.91Å; S434-E436 PolarHBondContact O-N 2.75Å; S434-E436 PolarHBondContact OG-N 3.25Å
435	S	86.9	Confident	91.5	Very high	117 Å²	117	56.9 Å²	56.9	82%	0.818	31%	0.309	S	S	*	.	S	Bend	trans	-76	-11.1	169.1	59.5	0	0	0	0	113.6
436	E	85.8	Confident	90.7	Very high	63 Å²	63	58.6 Å²	58.6	29%	0.294	33%	0.325	S	S	.	.	S	Bend	trans	-93.1	142.1	180	-63.7	-172.7	176.9	0	0	111.4	R323 I339 S434 Y439	R323-E436 IonicContact CZ-OE1 3.52Å; R323-E436 VanDerWaalsContact CZ-OE1 3.29Å; R323-E436 IonicContact NH1-OE1 3.1Å; R323-E436 PolarHBondContact NH1-OE1 2.84Å; R323-E436 IonicContact NH1-OE2 2.9Å; R323-E436 IonicContact NH2-OE1 3.92Å; I339-E436 HydrophobicContact CD1-CB 4.13Å; S434-E436 PolarHBondContact O-N 2.75Å; S434-E436 PolarHBondContact OG-N 3.25Å; E436-Y439 PolarHBondContact OE2-OH 3.26Å
437	A	86.9	Confident	89.4	Confident	80 Å²	80	59.6 Å²	59.6	66%	0.661	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-69.7	149.7	178.5	0	0	0	0	0	112.1	Y439	A437-Y439 PolarHBondContact O-N 3.37Å
438	P	91.2	Very high	87.9	Confident	38 Å²	38	63.3 Å²	63.3	25%	0.247	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-60.1	135.2	179	-22.5	31.9	0	0	0	113	Q425 V427 T431	Q425-P438 HydrophobicContact CB-CB 4.4Å; V427-P438 HydrophobicContact CG1-CB 4Å; V427-P438 HydrophobicContact CG1-CG 4.15Å; T431-P438 HydrophobicContact CG2-CB 4.29Å; T431-P438 HydrophobicContact CG2-CG 3.82Å
439	Y	92.9	Very high	86.1	Confident	110 Å²	110	68.7 Å²	68.7	43%	0.431	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-71	144.1	175.3	-62.9	-72.5	0	0	0	111.6	I339 P340 A426 E436 A437	I339-Y439 HydrophobicContact CD1-CD2 4.09Å; I339-Y439 HydrophobicContact CD1-CE2 3.71Å; I339-Y439 HydrophobicContact CG1-CD2 4.36Å; I339-Y439 HydrophobicContact CG1-CE2 4Å; P340-Y439 WeakPolarHBondContact O-CD2 3.43Å; A426-Y439 PolarHBondContact N-O 2.78Å; E436-Y439 PolarHBondContact OE2-OH 3.26Å; A437-Y439 PolarHBondContact O-N 3.37Å
440	Y	94.5	Very high	84.6	Confident	123 Å²	123	67.3 Å²	67.3	48%	0.482	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	157.9	-173.9	66.6	-92.8	0	0	0	113.5	E423 I424 T442	E423-Y440 HydrophobicContact CB-CD2 4.03Å; E423-Y440 HydrophobicContact CG-CD2 4.42Å; I424-Y440 VanDerWaalsContact O-CA 3.26Å; I424-Y440 WeakPolarHBondContact O-CA 3.35Å; Y440-T442 HydrophobicContact CD2-CG2 3.73Å; Y440-T442 HydrophobicContact CE2-CG2 3.74Å
441	A	94.6	Very high	83.6	Confident	21 Å²	21	70.3 Å²	70.3	17%	0.174	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.4	172.5	0	0	0	0	0	110.2	P343 L346 E423 I424	P343-A441 WeakPolarHBondContact O-CB 3.35Å; L346-A441 HydrophobicContact CD1-CB 3.6Å; L346-A441 HydrophobicContact CD2-CB 3.75Å; L346-A441 HydrophobicContact CG-CB 4.36Å; E423-A441 CarbonylContact C-O 3.57Å; E423-A441 WeakPolarHBondContact CA-O 3.26Å; I424-A441 PolarHBondContact N-O 3.13Å; I424-A441 PolarHBondContact O-N 2.85Å
442	T	93.6	Very high	83	Confident	77 Å²	77	69.8 Å²	69.8	47%	0.472	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.1	-170.2	62.3	0	0	0	0	113.4	F422 E423 Y440	F422-T442 CarbonylContact O-C 3.55Å; F422-T442 VanDerWaalsContact O-CA 3.25Å; F422-T442 WeakPolarHBondContact O-CA 3.35Å; E423-T442 HydrophobicContact CB-CG2 4.12Å; E423-T442 HydrophobicContact CG-CG2 3.76Å; Y440-T442 HydrophobicContact CD2-CG2 3.73Å; Y440-T442 HydrophobicContact CE2-CG2 3.74Å
443	I	92.6	Very high	82.6	Confident	25 Å²	25	62.1 Å²	62.1	13%	0.128	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.8	174.1	-166.8	161.5	0	0	0	112.1	L346 Y348 L357 T421 F422 I424	L346-I443 HydrophobicContact CB-CB 4.29Å; L346-I443 HydrophobicContact CB-CD1 4.04Å; L346-I443 HydrophobicContact CD2-CB 4.17Å; L346-I443 HydrophobicContact CD2-CG2 4.28Å; Y348-I443 HydrophobicContact CD1-CD1 3.72Å; Y348-I443 HydrophobicContact CD1-CG1 4.11Å; L357-I443 HydrophobicContact CD2-CG2 4.07Å; T421-I443 CarbonylContact C-O 3.53Å; T421-I443 WeakPolarHBondContact CA-O 3.3Å; F422-I443 HydrophobicContact CB-CG2 4.07Å; F422-I443 PolarHBondContact N-O 3.38Å; F422-I443 PolarHBondContact O-N 3.11Å; I424-I443 HydrophobicContact CD1-CG2 4.35Å
444	N	90	Very high	82.4	Confident	82 Å²	82	59.7 Å²	59.7	44%	0.439	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.6	-178.8	-65.4	-20.6	0	0	0	111.3	Y420 T421	Y420-N444 CarbonylContact O-C 3.52Å; Y420-N444 VanDerWaalsContact O-CA 3.29Å; Y420-N444 WeakPolarHBondContact O-CA 3.12Å; T421-N444 WeakPolarHBondContact CB-OD1 3.34Å; T421-N444 VanDerWaalsContact CG2-OD1 3.31Å; T421-N444 WeakPolarHBondContact CG2-OD1 3.48Å; T421-N444 PolarHBondContact OG1-OD1 3.07Å
445	V	86.2	Confident	82.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.012	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.9	-173.9	-174.4	0	0	0	0	111.8	Y348 V355 L357 Q419 Y420 F422	Y348-V445 HydrophobicContact CD1-CG2 3.87Å; Y348-V445 HydrophobicContact CD2-CG1 3.9Å; Y348-V445 HydrophobicContact CD2-CG2 4.15Å; Y348-V445 HydrophobicContact CE1-CG2 4.22Å; Y348-V445 HydrophobicContact CE2-CG1 3.89Å; Y348-V445 HydrophobicContact CE2-CG2 4.49Å; Y348-V445 HydrophobicContact CG-CG1 4.43Å; Y348-V445 HydrophobicContact CG-CG2 3.84Å; V355-V445 HydrophobicContact CG1-CG1 3.98Å; V355-V445 HydrophobicContact CG1-CG2 4.33Å; V355-V445 HydrophobicContact CG2-CG1 3.8Å; L357-V445 HydrophobicContact CD2-CG2 4.33Å; Q419-V445 WeakPolarHBondContact CA-O 3.46Å; Y420-V445 PolarHBondContact N-O 2.67Å; Y420-V445 PolarHBondContact O-N 3.32Å; F422-V445 HydrophobicContact CD2-CG2 4.01Å; F422-V445 HydrophobicContact CE2-CB 4.27Å; F422-V445 HydrophobicContact CE2-CG2 4.04Å
446	S	78.2	Confident	82.1	Confident	73 Å²	73	56.2 Å²	56.2	51%	0.51	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	133.7	177.1	60.8	0	0	0	0	112.7
447	T	68.2	Low	81.9	Confident	20 Å²	20	57.8 Å²	57.8	12%	0.123	34%	0.338	C	S	.	.			trans	-101.3	139.1	-174.9	50.4	0	0	0	0	113.6	L414 L415 A416 R417	L414-T447 HydrophobicContact CB-CG2 4.14Å; L414-T447 HydrophobicContact CD1-CG2 4.48Å; L415-T447 PolarHBondContact O-OG1 2.98Å; A416-T447 VanDerWaalsContact CA-OG1 3.27Å; A416-T447 WeakPolarHBondContact CA-OG1 3.32Å; R417-T447 PolarHBondContact N-O 2.86Å; R417-T447 PolarHBondContact N-OG1 3.46Å
448	S	63.2	Low	82	Confident	99 Å²	99	54.3 Å²	54.3	69%	0.692	31%	0.308	S	S	*	.			trans	-115.4	-179.8	-177	65.3	0	0	0	0	115.2
449	Q	57.7	Low	81.7	Confident	121 Å²	121	57.3 Å²	57.3	57%	0.565	32%	0.318	S	S	*	.			trans	-68.5	147.8	-170.1	-61.2	179.5	35.7	0	0	114.9	R417	R417-Q449 VanDerWaalsContact NH2-NE2 3.19Å
450	S	60.5	Low	81.4	Confident	50 Å²	50	55.2 Å²	55.2	35%	0.35	31%	0.313	S	S	.	.			trans	-130	174.5	-173	64.7	0	0	0	0	115.2	N479	S450-N479 WeakPolarHBondContact O-CB 3.31Å; S450-N479 VanDerWaalsContact O-O 3.1Å; S450-N479 WeakPolarHBondContact OG-CB 3.36Å; S450-N479 PolarHBondContact OG-ND2 3.35Å
451	V	72	Confident	81	Confident	62 Å²	62	53 Å²	53	38%	0.376	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-75	155.5	176.7	-66.7	0	0	0	0	113	N479 V530	V451-N479 WeakPolarHBondContact O-CB 3.43Å; V451-N479 PolarHBondContact O-ND2 3.07Å; V451-V530 HydrophobicContact CG1-CB 4.25Å; V451-V530 HydrophobicContact CG1-CG1 3.92Å
452	P	79.8	Confident	80.3	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.013	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-64.1	155.7	177.1	-20.3	32.2	0	0	0	113.7	P475 Q477 P478 A526 T528 G533 P534	P452-P475 HydrophobicContact CB-CG 4.33Å; P452-Q477 WeakPolarHBondContact CA-O 3.35Å; P452-P478 WeakPolarHBondContact CG-O 3.46Å; P452-A526 HydrophobicContact CB-CB 4.44Å; P452-T528 HydrophobicContact CG-CG2 3.37Å; P452-G533 WeakPolarHBondContact O-CA 3.47Å; P452-P534 WeakPolarHBondContact O-CD 3.32Å
453	S	81	Confident	79.9	Confident	28 Å²	28	56.3 Å²	56.3	20%	0.196	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-69.4	172.3	166.6	66.2	0	0	0	0	112.9	P475 D476 Q477	S453-P475 WeakPolarHBondContact O-CB 3.35Å; S453-P475 WeakPolarHBondContact OG-CB 3.47Å; S453-D476 PolarHBondContact OG-N 3.28Å; S453-Q477 PolarHBondContact N-O 2.86Å; S453-Q477 PolarHBondContact OG-N 3.18Å; S453-Q477 PolarHBondContact OG-O 3.21Å
454	A	85	Confident	79.5	Confident	39 Å²	39	57.7 Å²	57.7	32%	0.322	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-64.8	152.1	173	0	0	0	0	0	111.6	P534	A454-P534 HydrophobicContact CB-CG 4.01Å
455	V	87	Confident	79.1	Confident	3 Å²	3	56 Å²	56	2%	0.018	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-74.7	127.6	170	175	0	0	0	0	108.8	W472 P475 Y485 V524 S536	V455-W472 HydrophobicContact CG1-CB 3.77Å; V455-W472 HydrophobicContact CG1-CG 4.11Å; V455-P475 HydrophobicContact CG2-CG 4.06Å; V455-Y485 HydrophobicContact CG2-CD1 4.48Å; V455-Y485 HydrophobicContact CG2-CE1 4.24Å; V455-V524 HydrophobicContact CB-CG1 3.78Å; V455-V524 HydrophobicContact CG1-CG1 3.76Å; V455-V524 HydrophobicContact CG2-CG1 4.05Å; V455-S536 WeakPolarHBondContact O-CB 3.41Å
456	P	82.7	Confident	79	Confident	62 Å²	62	58.7 Å²	58.7	40%	0.403	34%	0.342	S	S	.	.			trans	-72.9	-33.5	-167	25.4	-33.9	0	0	0	114	P473	P456-P473 HydrophobicContact CG-CG 3.79Å
457	M	82.8	Confident	79.3	Confident	96 Å²	96	56.2 Å²	56.2	47%	0.473	33%	0.325	S	S	.	.			trans	-159	167.6	-178.9	64.4	-174.7	75.5	0	0	113.2	H459 W472 P473	M457-H459 PolarHBondContact SD-NE2 3.13Å; M457-W472 WeakPolarHBondContact O-CB 3.47Å; M457-P473 HydrophobicContact CG-CG 4.23Å; M457-P473 VanDerWaalsContact O-CD 3.26Å; M457-P473 WeakPolarHBondContact O-CD 3.44Å
458	M	88.4	Confident	80.4	Confident	7 Å²	7	55.3 Å²	55.3	3%	0.034	32%	0.319	C	S	.	.			trans	-140.2	135.6	177.6	-180	163	45.2	0	0	110.5	L470 S471 W472 L487 F522 M539	M458-L470 HydrophobicContact CE-CD1 4.22Å; M458-L470 HydrophobicContact CG-CB 3.95Å; M458-L470 HydrophobicContact CG-CD1 4.34Å; M458-L470 HydrophobicContact CG-CD2 4.49Å; M458-L470 HydrophobicContact CG-CG 4.48Å; M458-L470 HydrophobicContact SD-CB 3.84Å; M458-L470 HydrophobicContact SD-CD1 3.56Å; M458-L470 VanDerWaalsContact SD-CD1 3.56Å; M458-L470 HydrophobicContact SD-CG 4.21Å; M458-S471 CarbonylContact C-O 3.59Å; M458-S471 WeakPolarHBondContact CA-O 3.49Å; M458-W472 HydrophobicContact CB-CB 4.49Å; M458-W472 HydrophobicContact CG-CE3 4.21Å; M458-W472 HydrophobicContact SD-CE3 3.86Å; M458-W472 HydrophobicContact SD-CZ3 4.26Å; M458-L487 HydrophobicContact CE-CD1 4.28Å; M458-L487 HydrophobicContact SD-CD1 3.74Å; M458-F522 HydrophobicContact CE-CB 3.42Å; M458-F522 VanDerWaalsContact CE-CB 3.42Å; M458-F522 HydrophobicContact SD-CB 4.43Å; M458-M539 HydrophobicContact CE-CB 4.16Å
459	H	84.7	Confident	81.7	Confident	102 Å²	102	51.2 Å²	51.2	47%	0.472	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	135.7	-176.2	-60.2	-66.3	0	0	0	111.4	M457 V461 L470 S471	M457-H459 PolarHBondContact SD-NE2 3.13Å; H459-V461 PolarHBondContact O-N 3.32Å; H459-L470 CarbonylContact O-C 3.46Å; H459-L470 WeakPolarHBondContact O-CA 3.1Å; H459-S471 PolarHBondContact N-O 3.13Å; H459-S471 PolarHBondContact O-N 3.33Å
460	Q	87.4	Confident	83.3	Confident	66 Å²	66	45.4 Å²	45.4	31%	0.308	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	117.2	170.7	-168.9	-168.2	-78.7	0	0	110.3	I468 L470 F541	Q460-I468 HydrophobicContact CG-CG2 3.96Å; Q460-L470 HydrophobicContact CB-CD2 4.12Å; Q460-L470 HydrophobicContact CG-CD2 4.27Å; Q460-F541 HydrophobicContact CB-CD1 3.79Å; Q460-F541 HydrophobicContact CB-CE1 3.65Å; Q460-F541 HydrophobicContact CB-CG 4.43Å; Q460-F541 HydrophobicContact CB-CZ 4.17Å; Q460-F541 HydrophobicContact CG-CD1 4.26Å
461	V	85.1	Confident	84.8	Confident	77 Å²	77	44.2 Å²	44.2	47%	0.467	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-43.5	-179.7	-176.4	0	0	0	0	110.8	H459 T469 S471 M508	H459-V461 PolarHBondContact O-N 3.32Å; V461-T469 HydrophobicContact CB-CG2 4.11Å; V461-T469 PolarHBondContact N-O 2.9Å; V461-S471 VanDerWaalsContact CG2-OG 3.29Å; V461-S471 WeakPolarHBondContact CG2-OG 3.47Å; V461-M508 HydrophobicContact CG2-CE 4.24Å
462	S	80.5	Confident	85.8	Confident	53 Å²	53	41.5 Å²	41.5	37%	0.371	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	156.9	176.8	67.3	0	0	0	0	110.9	T469	S462-T469 PolarHBondContact N-O 3.07Å; S462-T469 PolarHBondContact O-N 3.11Å; S462-T469 VanDerWaalsContact OG-CB 3.31Å; S462-T469 WeakPolarHBondContact OG-CB 3.47Å; S462-T469 PolarHBondContact OG-OG1 3.49Å
463	R	84.4	Confident	86.2	Confident	114 Å²	114	43.8 Å²	43.8	43%	0.43	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142	172.3	62.7	171	-179.6	178.7	3.8	110.5	S467 I468 Q542 L544	R463-S467 CarbonylContact C-O 3.6Å; R463-S467 WeakPolarHBondContact CA-O 3.41Å; R463-I468 HydrophobicContact CB-CG1 4.26Å; R463-Q542 VanDerWaalsContact CD-O 3.27Å; R463-Q542 WeakPolarHBondContact CD-O 3.22Å; R463-Q542 PolarHBondContact NH1-O 3.14Å; R463-L544 HydrophobicContact CG-CD1 4.48Å; R463-L544 HydrophobicContact CG-CD2 4.23Å; R463-L544 HydrophobicContact CG-CG 4.1Å; R463-L544 WeakPolarHBondContact O-CD1 3.46Å
464	T	84.4	Confident	86.4	Confident	54 Å²	54	48.4 Å²	48.4	33%	0.331	27%	0.271	S	S	.	.			trans	-122.7	-174.5	171.3	74.3	0	0	0	0	109.1	S466 S467 L544	T464-S466 PolarHBondContact O-N 3.27Å; T464-S466 PolarHBondContact OG1-N 3.34Å; T464-S467 PolarHBondContact N-O 2.87Å; T464-S467 PolarHBondContact OG1-N 3.47Å; T464-S467 PolarHBondContact OG1-O 3Å; T464-S467 PolarHBondContact OG1-OG 3.15Å; T464-L544 PolarHBondContact O-N 3.03Å
465	S	82.3	Confident	86.4	Confident	47 Å²	47	46.8 Å²	46.8	33%	0.329	26%	0.257	S	S	.	.	S	Bend	trans	-70.5	-16.4	173.1	54	0	0	0	0	113.4	P516 L544	S465-P516 WeakPolarHBondContact O-CA 3.23Å; S465-P516 WeakPolarHBondContact O-CB 3.49Å; S465-P516 WeakPolarHBondContact O-CG 3.41Å; S465-L544 WeakPolarHBondContact CA-O 3.21Å; S465-L544 VanDerWaalsContact CB-O 3.29Å; S465-L544 WeakPolarHBondContact CB-O 3.5Å
466	S	82.8	Confident	86.2	Confident	57 Å²	57	52.8 Å²	52.8	40%	0.399	29%	0.289	S	S	.	.	S	Bend	trans	-134.5	6	-177	61.9	0	0	0	0	114.8	T464 S512 N513 L514	T464-S466 PolarHBondContact O-N 3.27Å; T464-S466 PolarHBondContact OG1-N 3.34Å; S466-S512 CarbonylContact O-C 3.39Å; S466-N513 PolarHBondContact O-N 3.12Å; S466-L514 WeakPolarHBondContact CA-O 3.47Å; S466-L514 PolarHBondContact O-N 3.15Å
467	S	86.3	Confident	85.9	Confident	22 Å²	22	55.6 Å²	55.6	15%	0.154	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	151.8	178.3	67.4	0	0	0	0	113.9	R463 T464 I511	R463-S467 CarbonylContact C-O 3.6Å; R463-S467 WeakPolarHBondContact CA-O 3.41Å; T464-S467 PolarHBondContact N-O 2.87Å; T464-S467 PolarHBondContact OG1-N 3.47Å; T464-S467 PolarHBondContact OG1-O 3Å; T464-S467 PolarHBondContact OG1-OG 3.15Å; S467-I511 CarbonylContact C-O 3.55Å; S467-I511 WeakPolarHBondContact CA-O 3.39Å; S467-I511 WeakPolarHBondContact CB-O 3.43Å
468	I	90.5	Very high	85.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132	173.2	-63.9	175.3	0	0	0	108.3	Q460 R463 L470 I511 L514 F522 F541 T543	Q460-I468 HydrophobicContact CG-CG2 3.96Å; R463-I468 HydrophobicContact CB-CG1 4.26Å; I468-L470 HydrophobicContact CG2-CD2 3.67Å; I468-L470 HydrophobicContact CG2-CG 4.07Å; I468-I511 PolarHBondContact N-O 2.97Å; I468-I511 VanDerWaalsContact O-CD1 3.32Å; I468-I511 WeakPolarHBondContact O-CD1 3.04Å; I468-I511 PolarHBondContact O-N 3.47Å; I468-L514 HydrophobicContact CB-CD1 3.97Å; I468-L514 HydrophobicContact CD1-CD1 3.87Å; I468-L514 HydrophobicContact CG1-CD1 3.74Å; I468-F522 HydrophobicContact CD1-CE2 4.32Å; I468-F522 HydrophobicContact CD1-CZ 4.27Å; I468-F541 HydrophobicContact CD1-CB 3.87Å; I468-F541 HydrophobicContact CG2-CB 4.33Å; I468-T543 HydrophobicContact CD1-CG2 3.9Å; I468-T543 HydrophobicContact CG1-CG2 3.98Å
469	T	89.9	Confident	84.3	Confident	13 Å²	13	56 Å²	56	8%	0.08	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.7	175.4	-48.6	0	0	0	0	109.8	V461 S462 M508 A509 T510	V461-T469 HydrophobicContact CB-CG2 4.11Å; V461-T469 PolarHBondContact N-O 2.9Å; S462-T469 PolarHBondContact N-O 3.07Å; S462-T469 PolarHBondContact O-N 3.11Å; S462-T469 VanDerWaalsContact OG-CB 3.31Å; S462-T469 WeakPolarHBondContact OG-CB 3.47Å; S462-T469 PolarHBondContact OG-OG1 3.49Å; T469-M508 HydrophobicContact CG2-CG 4.14Å; T469-M508 HydrophobicContact CG2-SD 4.26Å; T469-A509 WeakPolarHBondContact CA-O 3.33Å; T469-T510 WeakPolarHBondContact CG2-OG1 3.39Å; T469-T510 PolarHBondContact OG1-OG1 3.41Å
470	L	92.6	Very high	83.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.5	-175.9	-57.9	178.3	0	0	0	111.1	M458 H459 Q460 I468 W472 L487 M508 A509 I511 F522 F541	M458-L470 HydrophobicContact CE-CD1 4.22Å; M458-L470 HydrophobicContact CG-CB 3.95Å; M458-L470 HydrophobicContact CG-CD1 4.34Å; M458-L470 HydrophobicContact CG-CD2 4.49Å; M458-L470 HydrophobicContact CG-CG 4.48Å; M458-L470 HydrophobicContact SD-CB 3.84Å; M458-L470 HydrophobicContact SD-CD1 3.56Å; M458-L470 VanDerWaalsContact SD-CD1 3.56Å; M458-L470 HydrophobicContact SD-CG 4.21Å; H459-L470 CarbonylContact O-C 3.46Å; H459-L470 WeakPolarHBondContact O-CA 3.1Å; Q460-L470 HydrophobicContact CB-CD2 4.12Å; Q460-L470 HydrophobicContact CG-CD2 4.27Å; I468-L470 HydrophobicContact CG2-CD2 3.67Å; I468-L470 HydrophobicContact CG2-CG 4.07Å; L470-W472 HydrophobicContact CB-CZ3 4.31Å; L470-L487 HydrophobicContact CD1-CD2 4.44Å; L470-M508 CarbonylContact O-C 3.59Å; L470-M508 VanDerWaalsContact O-CA 3.27Å; L470-M508 WeakPolarHBondContact O-CA 3.35Å; L470-M508 VanDerWaalsContact O-CG 3.28Å; L470-M508 WeakPolarHBondContact O-CG 3.37Å; L470-A509 PolarHBondContact N-O 3.09Å; L470-A509 PolarHBondContact O-N 3.34Å; L470-I511 HydrophobicContact CD1-CD1 4.05Å; L470-I511 HydrophobicContact CG-CD1 4.18Å; L470-F522 HydrophobicContact CD1-CB 3.89Å; L470-F522 HydrophobicContact CD1-CD1 3.35Å; L470-F522 HydrophobicContact CD1-CD2 4Å; L470-F522 HydrophobicContact CD1-CE1 3.78Å; L470-F522 HydrophobicContact CD1-CE2 4.35Å; L470-F522 HydrophobicContact CD1-CG 3.48Å; L470-F522 VanDerWaalsContact CD1-CG 3.48Å; L470-F522 HydrophobicContact CD1-CZ 4.25Å; L470-F541 HydrophobicContact CD1-CD2 4.19Å; L470-F541 HydrophobicContact CD1-CE2 4.18Å; L470-F541 HydrophobicContact CD2-CD2 3.5Å; L470-F541 HydrophobicContact CD2-CE2 3.38Å; L470-F541 HydrophobicContact CD2-CG 4.22Å; L470-F541 HydrophobicContact CD2-CZ 4.01Å; L470-F541 HydrophobicContact CG-CE2 4.44Å
471	S	92	Very high	83.4	Confident	25 Å²	25	56.3 Å²	56.3	18%	0.175	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	150.8	173	65.3	0	0	0	0	111.5	M458 H459 V461 N507	M458-S471 CarbonylContact C-O 3.59Å; M458-S471 WeakPolarHBondContact CA-O 3.49Å; H459-S471 PolarHBondContact N-O 3.13Å; H459-S471 PolarHBondContact O-N 3.33Å; V461-S471 VanDerWaalsContact CG2-OG 3.29Å; V461-S471 WeakPolarHBondContact CG2-OG 3.47Å; S471-N507 VanDerWaalsContact CA-O 3.31Å; S471-N507 WeakPolarHBondContact CA-O 3.45Å
472	W	92.6	Very high	83.2	Confident	5 Å²	5	54.3 Å²	54.3	2%	0.019	30%	0.304	C	S	.	.			trans	-143.9	156.9	-178.9	52.7	87.1	0	0	0	111.9	V455 M457 M458 L470 Y485 L487 N507 A509 V524	V455-W472 HydrophobicContact CG1-CB 3.77Å; V455-W472 HydrophobicContact CG1-CG 4.11Å; M457-W472 WeakPolarHBondContact O-CB 3.47Å; M458-W472 HydrophobicContact CB-CB 4.49Å; M458-W472 HydrophobicContact CG-CE3 4.21Å; M458-W472 HydrophobicContact SD-CE3 3.86Å; M458-W472 HydrophobicContact SD-CZ3 4.26Å; L470-W472 HydrophobicContact CB-CZ3 4.31Å; W472-Y485 AromaticContact CD1-CD1 3.95Å; W472-Y485 AromaticContact CD1-CE1 3.88Å; W472-Y485 HydrophobicContact CZ2-CD2 4.5Å; W472-Y485 HydrophobicContact CZ2-CG 4.01Å; W472-Y485 AromaticContact NE1-CD1 3.15Å; W472-Y485 AromaticContact NE1-CD2 3.85Å; W472-Y485 AromaticContact NE1-CE1 3.44Å; W472-Y485 AromaticContact NE1-CG 3.37Å; W472-Y485 AromaticContact NE1-CZ 3.93Å; W472-L487 HydrophobicContact CH2-CD1 4.43Å; W472-L487 HydrophobicContact CZ3-CD1 4.07Å; W472-N507 PolarHBondContact N-O 3.03Å; W472-N507 VanDerWaalsContact O-CB 3.31Å; W472-N507 WeakPolarHBondContact O-CB 3.44Å; W472-N507 PolarHBondContact O-ND2 3.16Å; W472-A509 HydrophobicContact CH2-CB 3.77Å; W472-A509 HydrophobicContact CZ3-CB 4.15Å; W472-V524 HydrophobicContact CD2-CB 4.45Å; W472-V524 HydrophobicContact CD2-CG1 4.22Å; W472-V524 HydrophobicContact CD2-CG2 3.96Å; W472-V524 HydrophobicContact CE3-CG2 4.39Å; W472-V524 HydrophobicContact CG-CG1 4.15Å; W472-V524 HydrophobicContact CG-CG2 4.47Å; W472-V524 HydrophobicContact CH2-CG2 4.22Å; W472-V524 HydrophobicContact CZ2-CG2 3.77Å
473	P	87.9	Confident	83.4	Confident	49 Å²	49	55.7 Å²	55.7	32%	0.318	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-79.7	168.4	171.2	33.7	-33.7	0	0	0	111.7	P456 M457	P456-P473 HydrophobicContact CG-CG 3.79Å; M457-P473 HydrophobicContact CG-CG 4.23Å; M457-P473 VanDerWaalsContact O-CD 3.26Å; M457-P473 WeakPolarHBondContact O-CD 3.44Å
474	Q	84.6	Confident	83.6	Confident	126 Å²	126	51.5 Å²	51.5	59%	0.589	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-67.5	155.2	171.1	-62	-167.8	-22.6	0	0	111.2	I482	Q474-I482 HydrophobicContact CB-CD1 4.23Å; Q474-I482 HydrophobicContact CG-CD1 4.34Å
475	P	86.4	Confident	84	Confident	4 Å²	4	49.4 Å²	49.4	3%	0.026	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-60.2	142	173.1	-19	30.6	0	0	0	112.6	P452 S453 V455 Q477 P478 I482 A526	P452-P475 HydrophobicContact CB-CG 4.33Å; S453-P475 WeakPolarHBondContact O-CB 3.35Å; S453-P475 WeakPolarHBondContact OG-CB 3.47Å; V455-P475 HydrophobicContact CG2-CG 4.06Å; P475-Q477 PolarHBondContact O-N 3.45Å; P475-P478 WeakPolarHBondContact O-CD 3.27Å; P475-I482 VanDerWaalsContact CD-CD1 3.48Å; P475-I482 HydrophobicContact CG-CD1 4.22Å; P475-A526 HydrophobicContact CG-CB 3.68Å
476	D	81.1	Confident	84.5	Confident	129 Å²	129	48.5 Å²	48.5	69%	0.69	27%	0.269	S	S	*	.	S	Bend	trans	-58.7	-31.1	-178.7	-61.4	-36.5	0	0	0	113.3	S453	S453-D476 PolarHBondContact OG-N 3.28Å
477	Q	77.9	Confident	84.9	Confident	121 Å²	121	45.9 Å²	45.9	57%	0.565	25%	0.251	S	S	*	.			trans	-124.1	90.3	174.1	-60.9	-179.4	-2.1	0	0	109.9	P452 S453 P475 N479	P452-Q477 WeakPolarHBondContact CA-O 3.35Å; S453-Q477 PolarHBondContact N-O 2.86Å; S453-Q477 PolarHBondContact OG-N 3.18Å; S453-Q477 PolarHBondContact OG-O 3.21Å; P475-Q477 PolarHBondContact O-N 3.45Å; Q477-N479 PolarHBondContact O-N 2.67Å
478	P	66.5	Low	85.1	Confident	46 Å²	46	47.9 Å²	47.9	30%	0.299	26%	0.255	S	S	.	.			trans	-63.8	-29	-178.5	-22.7	32.9	0	0	0	113.2	P452 P475 G480 I482 T528	P452-P478 WeakPolarHBondContact CG-O 3.46Å; P475-P478 WeakPolarHBondContact O-CD 3.27Å; P478-G480 PolarHBondContact O-N 3.2Å; P478-I482 HydrophobicContact CB-CD1 4.43Å; P478-I482 HydrophobicContact CB-CG1 4.45Å; P478-T528 WeakPolarHBondContact O-CG2 3.36Å
479	N	71.1	Confident	85.1	Confident	65 Å²	65	49.5 Å²	49.5	35%	0.348	26%	0.261	S	S	.	.			trans	50.7	16.7	179.1	-63.2	-26.9	0	0	0	115.3	S450 V451 Q477	S450-N479 WeakPolarHBondContact O-CB 3.31Å; S450-N479 VanDerWaalsContact O-O 3.1Å; S450-N479 WeakPolarHBondContact OG-CB 3.36Å; S450-N479 PolarHBondContact OG-ND2 3.35Å; V451-N479 WeakPolarHBondContact O-CB 3.43Å; V451-N479 PolarHBondContact O-ND2 3.07Å; Q477-N479 PolarHBondContact O-N 2.67Å
480	G	73.4	Confident	85	Confident	34 Å²	34	49.6 Å²	49.6	35%	0.351	26%	0.26	S	S	.	.	S	Bend	trans	162.6	-174.9	-175.6	0	0	0	0	0	111.1	P478	P478-G480 PolarHBondContact O-N 3.2Å
481	I	78.4	Confident	84.6	Confident	141 Å²	141	50.2 Å²	50.2	72%	0.723	26%	0.264	S	S	*	.			trans	-81.9	126.3	174.2	-60.1	169.6	0	0	0	109	T528	I481-T528 WeakPolarHBondContact O-CG2 3.45Å
482	I	82.1	Confident	84.1	Confident	35 Å²	35	55.3 Å²	55.3	18%	0.179	28%	0.283	C	S	.	.			trans	-76.6	124.5	177.6	-57.4	173.2	0	0	0	109.1	Q474 P475 P478 Y485 A526 R527	Q474-I482 HydrophobicContact CB-CD1 4.23Å; Q474-I482 HydrophobicContact CG-CD1 4.34Å; P475-I482 VanDerWaalsContact CD-CD1 3.48Å; P475-I482 HydrophobicContact CG-CD1 4.22Å; P478-I482 HydrophobicContact CB-CD1 4.43Å; P478-I482 HydrophobicContact CB-CG1 4.45Å; I482-Y485 WeakPolarHBondContact CD1-OH 3.4Å; I482-Y485 HydrophobicContact CG2-CE1 4.37Å; I482-Y485 HydrophobicContact CG2-CE2 3.95Å; I482-A526 HydrophobicContact CG2-CB 4.16Å; I482-R527 WeakPolarHBondContact CA-O 3.24Å
483	L	85	Confident	83.1	Confident	82 Å²	82	59.1 Å²	59.1	43%	0.429	32%	0.316	S	S	.	.			trans	-92.9	-47.4	-177.5	-59.1	176.1	0	0	0	111.5	R527	L483-R527 VanDerWaalsContact CD1-NH1 3.32Å; L483-R527 PolarHBondContact N-O 3.23Å
484	D	87.5	Confident	82.4	Confident	27 Å²	27	60.6 Å²	60.6	14%	0.144	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	172.4	179.2	55.2	39.2	0	0	0	111.9	R527	D484-R527 PolarHBondContact O-N 3.27Å; D484-R527 VanDerWaalsContact OD1-CB 3.32Å; D484-R527 WeakPolarHBondContact OD1-CB 3.44Å; D484-R527 IonicContact OD1-CZ 3.8Å; D484-R527 IonicContact OD1-NE 2.93Å; D484-R527 PolarHBondContact OD1-NE 3.35Å; D484-R527 IonicContact OD1-NH2 3.85Å; D484-R527 IonicContact OD2-CZ 3.31Å; D484-R527 VanDerWaalsContact OD2-CZ 3.31Å; D484-R527 IonicContact OD2-NE 3.13Å; D484-R527 PolarHBondContact OD2-NE 3.06Å; D484-R527 VanDerWaalsContact OD2-NE 3.13Å; D484-R527 IonicContact OD2-NH2 2.67Å; D484-R527 PolarHBondContact OD2-NH2 2.9Å
485	Y	92.7	Very high	81.6	Confident	10 Å²	10	62 Å²	62	4%	0.039	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	142.8	172.8	-63.7	-89.1	0	0	0	110.8	V455 W472 I482 T503 S504 N507 V524 R525 A526	V455-Y485 HydrophobicContact CG2-CD1 4.48Å; V455-Y485 HydrophobicContact CG2-CE1 4.24Å; W472-Y485 AromaticContact CD1-CD1 3.95Å; W472-Y485 AromaticContact CD1-CE1 3.88Å; W472-Y485 HydrophobicContact CZ2-CD2 4.5Å; W472-Y485 HydrophobicContact CZ2-CG 4.01Å; W472-Y485 AromaticContact NE1-CD1 3.15Å; W472-Y485 AromaticContact NE1-CD2 3.85Å; W472-Y485 AromaticContact NE1-CE1 3.44Å; W472-Y485 AromaticContact NE1-CG 3.37Å; W472-Y485 AromaticContact NE1-CZ 3.93Å; I482-Y485 WeakPolarHBondContact CD1-OH 3.4Å; I482-Y485 HydrophobicContact CG2-CE1 4.37Å; I482-Y485 HydrophobicContact CG2-CE2 3.95Å; Y485-T503 CarbonylContact O-C 3.56Å; Y485-T503 VanDerWaalsContact O-CA 3.3Å; Y485-T503 WeakPolarHBondContact O-CA 3.48Å; Y485-S504 PolarHBondContact N-O 3.42Å; Y485-S504 PolarHBondContact O-N 2.93Å; Y485-N507 HydrophobicContact CE2-CB 4.5Å; Y485-V524 HydrophobicContact CD1-CG2 4.25Å; Y485-R525 CarbonylContact C-O 3.47Å; Y485-R525 VanDerWaalsContact CA-O 3.31Å; Y485-R525 WeakPolarHBondContact CA-O 3.39Å; Y485-A526 HydrophobicContact CD1-CB 3.85Å; Y485-A526 HydrophobicContact CE1-CB 3.65Å
486	Q	92.9	Very high	80.5	Confident	28 Å²	28	65.4 Å²	65.4	13%	0.131	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120.1	172.2	-172.6	176.2	52.8	0	0	109.9	T503 V524 R525 Y532 Y535	Q486-T503 HydrophobicContact CB-CG2 4.28Å; Q486-T503 HydrophobicContact CG-CG2 4.15Å; Q486-V524 WeakPolarHBondContact O-CA 3.44Å; Q486-R525 HydrophobicContact CB-CG 4.12Å; Q486-R525 PolarHBondContact N-O 3.28Å; Q486-R525 PolarHBondContact O-N 3.23Å; Q486-R525 VanDerWaalsContact OE1-CZ 3.23Å; Q486-Y532 HydrophobicContact CB-CE1 3.98Å; Q486-Y535 PolarHBondContact OE1-OH 2.93Å
487	L	91.3	Very high	79.7	Confident	1 Å²	1	66 Å²	66	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.8	175.1	-168.6	76.6	0	0	0	109.6	M458 L470 W472 T501 L502 A509 I511 F522 Q523 V524	M458-L487 HydrophobicContact CE-CD1 4.28Å; M458-L487 HydrophobicContact SD-CD1 3.74Å; L470-L487 HydrophobicContact CD1-CD2 4.44Å; W472-L487 HydrophobicContact CH2-CD1 4.43Å; W472-L487 HydrophobicContact CZ3-CD1 4.07Å; L487-T501 CarbonylContact O-C 3.51Å; L487-T501 VanDerWaalsContact O-CA 3.24Å; L487-T501 WeakPolarHBondContact O-CA 3.41Å; L487-L502 WeakPolarHBondContact CB-O 3.41Å; L487-L502 PolarHBondContact N-O 3.49Å; L487-L502 PolarHBondContact O-N 2.73Å; L487-A509 HydrophobicContact CD2-CB 4.35Å; L487-I511 HydrophobicContact CD2-CD1 3.62Å; L487-I511 HydrophobicContact CD2-CG1 3.93Å; L487-F522 HydrophobicContact CD2-CD1 4.21Å; L487-Q523 CarbonylContact C-O 3.55Å; L487-Q523 WeakPolarHBondContact CA-O 3.28Å; L487-Q523 WeakPolarHBondContact CD1-O 3.39Å; L487-V524 HydrophobicContact CD1-CB 3.85Å; L487-V524 HydrophobicContact CD1-CG2 4.3Å
488	R	90.4	Very high	79.5	Confident	65 Å²	65	65.6 Å²	65.6	25%	0.245	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.8	175.2	-175.3	-179.3	-143.8	-172.2	3.1	109.1	S499 L500 T501 F522 Q523 Y535	R488-S499 PolarHBondContact NE-OG 2.68Å; R488-S499 PolarHBondContact NH2-OG 2.9Å; R488-L500 CarbonylContact C-O 3.53Å; R488-L500 WeakPolarHBondContact CA-O 3.44Å; R488-T501 HydrophobicContact CB-CG2 4.2Å; R488-T501 HydrophobicContact CG-CG2 4.08Å; R488-F522 CarbonylContact O-C 3.6Å; R488-F522 WeakPolarHBondContact O-CA 3.49Å; R488-Q523 PolarHBondContact N-O 2.88Å; R488-Q523 PolarHBondContact O-N 3.44Å; R488-Y535 HydrophobicContact CB-CE1 3.95Å
489	Y	90.9	Very high	80.2	Confident	34 Å²	34	64.5 Å²	64.5	13%	0.133	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	150.7	177.9	71.1	-82.2	0	0	0	113.9	S499 L500 I511 L514 Y520 A521 F522	Y489-S499 WeakPolarHBondContact O-CA 3.43Å; Y489-L500 HydrophobicContact CD1-CB 4.14Å; Y489-L500 HydrophobicContact CD2-CB 4.41Å; Y489-L500 HydrophobicContact CE1-CB 3.62Å; Y489-L500 HydrophobicContact CE2-CB 3.92Å; Y489-L500 HydrophobicContact CE2-CD1 3.71Å; Y489-L500 HydrophobicContact CE2-CG 4.47Å; Y489-L500 VanDerWaalsContact CZ-CB 3.49Å; Y489-L500 PolarHBondContact N-O 3.43Å; Y489-L500 PolarHBondContact O-N 3.17Å; Y489-I511 HydrophobicContact CD1-CG2 4.3Å; Y489-I511 HydrophobicContact CD2-CG2 4.18Å; Y489-I511 HydrophobicContact CE1-CG2 3.86Å; Y489-I511 HydrophobicContact CE2-CG2 3.73Å; Y489-I511 HydrophobicContact CG-CG2 4.45Å; Y489-L514 HydrophobicContact CD2-CD2 4.28Å; Y489-L514 HydrophobicContact CE2-CD2 3.92Å; Y489-Y520 HydrophobicContact CD2-CD1 4.3Å; Y489-A521 WeakPolarHBondContact CA-O 3.08Å; Y489-A521 WeakPolarHBondContact CB-O 3.44Å; Y489-F522 HydrophobicContact CD2-CE1 4.41Å; Y489-F522 HydrophobicContact CG-CD1 4.25Å; Y489-F522 AromaticContact CG-CE1 3.97Å; Y489-F522 HydrophobicContact CG-CE1 3.97Å
490	F	88.1	Confident	80.8	Confident	14 Å²	14	66.2 Å²	66.2	6%	0.061	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	157.4	178.6	55.4	-82.5	0	0	0	111	E496 Y520 A521 K538	F490-E496 HydrophobicContact CE1-CG 4.19Å; F490-E496 HydrophobicContact CZ-CB 4.5Å; F490-E496 HydrophobicContact CZ-CG 4.23Å; F490-Y520 CarbonylContact O-C 3.55Å; F490-Y520 WeakPolarHBondContact O-CA 3.35Å; F490-A521 HydrophobicContact CD1-CB 4.3Å; F490-A521 HydrophobicContact CD2-CB 4.27Å; F490-A521 HydrophobicContact CE1-CB 3.87Å; F490-A521 HydrophobicContact CE2-CB 3.83Å; F490-A521 HydrophobicContact CG-CB 4.48Å; F490-A521 HydrophobicContact CZ-CB 3.61Å; F490-A521 PolarHBondContact N-O 3.35Å; F490-A521 VanDerWaalsContact N-O 3.15Å; F490-A521 PolarHBondContact O-N 3.09Å; F490-K538 HydrophobicContact CZ-CD 4.33Å
491	D	83.3	Confident	81.4	Confident	13 Å²	13	68.5 Å²	68.5	7%	0.07	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.4	173.6	-169.6	-29.8	0	0	0	109.1	A493 D494 K518 Y520	D491-A493 PolarHBondContact O-N 3.47Å; D491-A493 VanDerWaalsContact O-N 3.12Å; D491-A493 PolarHBondContact OD1-N 2.94Å; D491-D494 HydrophobicContact CB-CB 4.21Å; D491-D494 WeakPolarHBondContact CB-OD2 3.16Å; D491-D494 PolarHBondContact O-N 3.14Å; D491-K518 WeakPolarHBondContact OD2-CD 3.49Å; D491-K518 WeakPolarHBondContact OD2-CE 3.38Å; D491-K518 IonicContact OD2-NZ 3.51Å; D491-K518 PolarHBondContact OD2-NZ 3.17Å; D491-Y520 HydrophobicContact CB-CD1 4.44Å; D491-Y520 HydrophobicContact CB-CE1 4.15Å
492	K	81.4	Confident	81.9	Confident	132 Å²	132	64.9 Å²	64.9	57%	0.574	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.8	177.5	-176.7	-179.1	175.3	-174.4	0	112.5	I519 Y540	K492-I519 HydrophobicContact CB-CB 4.3Å; K492-I519 HydrophobicContact CB-CG2 4.29Å; K492-I519 WeakPolarHBondContact CB-O 3.47Å; K492-I519 HydrophobicContact CD-CB 4.44Å; K492-I519 HydrophobicContact CD-CG2 4.15Å; K492-I519 PolarHBondContact N-O 3.36Å; K492-Y540 HydrophobicContact CD-CD1 4.44Å; K492-Y540 HydrophobicContact CD-CE1 4.48Å; K492-Y540 HydrophobicContact CG-CE1 4.36Å
493	A	71.7	Confident	82.1	Confident	86 Å²	86	67.4 Å²	67.4	71%	0.711	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.6	177.8	0	0	0	0	0	113.9	D491	D491-A493 PolarHBondContact O-N 3.47Å; D491-A493 VanDerWaalsContact O-N 3.12Å; D491-A493 PolarHBondContact OD1-N 2.94Å
494	D	73.6	Confident	82.3	Confident	80 Å²	80	64.5 Å²	64.5	43%	0.428	34%	0.343	S	S	.	.	S	Bend	trans	-94.9	155.3	178.7	-68.9	-27	0	0	0	111.2	D491 N498	D491-D494 HydrophobicContact CB-CB 4.21Å; D491-D494 WeakPolarHBondContact CB-OD2 3.16Å; D491-D494 PolarHBondContact O-N 3.14Å; D494-N498 HydrophobicContact CB-CB 4.44Å
495	E	67.9	Low	82.2	Confident	155 Å²	155	71.6 Å²	71.6	72%	0.724	38%	0.375	S	S	*	.			trans	-70.4	151.9	169.7	-66.3	-169	167.8	0	0	111.3	D497 N498	E495-D497 PolarHBondContact O-N 3.36Å; E495-N498 PolarHBondContact O-N 3.18Å
496	E	63.6	Low	82	Confident	75 Å²	75	75 Å²	75	35%	0.35	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-59.8	-18.1	-173.8	-170.7	161.6	-163.2	0	0	114	F490 N498 S499 K538	F490-E496 HydrophobicContact CE1-CG 4.19Å; F490-E496 HydrophobicContact CZ-CB 4.5Å; F490-E496 HydrophobicContact CZ-CG 4.23Å; E496-N498 VanDerWaalsContact C-N 3.33Å; E496-N498 PolarHBondContact O-N 3.08Å; E496-S499 VanDerWaalsContact O-CB 3.28Å; E496-S499 WeakPolarHBondContact O-CB 3.29Å; E496-S499 PolarHBondContact O-N 2.89Å; E496-S499 PolarHBondContact O-OG 3.27Å; E496-K538 WeakPolarHBondContact OE1-CE 3.44Å; E496-K538 IonicContact OE1-NZ 2.72Å; E496-K538 PolarHBondContact OE1-NZ 3.12Å; E496-K538 IonicContact OE2-NZ 2.72Å; E496-K538 PolarHBondContact OE2-NZ 3.09Å
497	D	64.1	Low	81.7	Confident	142 Å²	142	77.4 Å²	77.4	76%	0.759	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-72.1	-19.8	176.9	-80.1	-14.3	0	0	0	113.8	E495 S499	E495-D497 PolarHBondContact O-N 3.36Å; D497-S499 PolarHBondContact O-N 3.45Å
498	N	73.8	Confident	81.5	Confident	112 Å²	112	81.3 Å²	81.3	60%	0.599	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-90.6	30.3	174	-74	-22.4	0	0	0	112.9	D494 E495 E496	D494-N498 HydrophobicContact CB-CB 4.44Å; E495-N498 PolarHBondContact O-N 3.18Å; E496-N498 VanDerWaalsContact C-N 3.33Å; E496-N498 PolarHBondContact O-N 3.08Å
499	S	80.6	Confident	81.5	Confident	24 Å²	24	78.6 Å²	78.6	17%	0.168	42%	0.422	C	S	.	.			trans	-81.8	133.6	-175.9	48.2	0	0	0	0	113.7	R488 Y489 E496 D497	R488-S499 PolarHBondContact NE-OG 2.68Å; R488-S499 PolarHBondContact NH2-OG 2.9Å; Y489-S499 WeakPolarHBondContact O-CA 3.43Å; E496-S499 VanDerWaalsContact O-CB 3.28Å; E496-S499 WeakPolarHBondContact O-CB 3.29Å; E496-S499 PolarHBondContact O-N 2.89Å; E496-S499 PolarHBondContact O-OG 3.27Å; D497-S499 PolarHBondContact O-N 3.45Å
500	L	83.8	Confident	81.4	Confident	100 Å²	100	81 Å²	81	52%	0.524	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	144.7	174.1	-68.4	152.3	0	0	0	109	R488 Y489	R488-L500 CarbonylContact C-O 3.53Å; R488-L500 WeakPolarHBondContact CA-O 3.44Å; Y489-L500 HydrophobicContact CD1-CB 4.14Å; Y489-L500 HydrophobicContact CD2-CB 4.41Å; Y489-L500 HydrophobicContact CE1-CB 3.62Å; Y489-L500 HydrophobicContact CE2-CB 3.92Å; Y489-L500 HydrophobicContact CE2-CD1 3.71Å; Y489-L500 HydrophobicContact CE2-CG 4.47Å; Y489-L500 VanDerWaalsContact CZ-CB 3.49Å; Y489-L500 PolarHBondContact N-O 3.43Å; Y489-L500 PolarHBondContact O-N 3.17Å
501	T	86.4	Confident	81.5	Confident	82 Å²	82	80.4 Å²	80.4	50%	0.503	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.4	178	59.2	0	0	0	0	111.3	L487 R488	L487-T501 CarbonylContact O-C 3.51Å; L487-T501 VanDerWaalsContact O-CA 3.24Å; L487-T501 WeakPolarHBondContact O-CA 3.41Å; R488-T501 HydrophobicContact CB-CG2 4.2Å; R488-T501 HydrophobicContact CG-CG2 4.08Å
502	L	88.2	Confident	81.6	Confident	65 Å²	65	83 Å²	83	34%	0.34	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129.3	179.8	178.1	68.9	0	0	0	108.5	L487 A509 I511	L487-L502 WeakPolarHBondContact CB-O 3.41Å; L487-L502 PolarHBondContact N-O 3.49Å; L487-L502 PolarHBondContact O-N 2.73Å; L502-A509 HydrophobicContact CD2-CB 4.1Å; L502-I511 HydrophobicContact CD2-CG1 4.27Å
503	T	88.2	Confident	81.7	Confident	88 Å²	88	83.9 Å²	83.9	54%	0.54	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	138.4	173.9	44.8	0	0	0	0	110.7	Y485 Q486	Y485-T503 CarbonylContact O-C 3.56Å; Y485-T503 VanDerWaalsContact O-CA 3.3Å; Y485-T503 WeakPolarHBondContact O-CA 3.48Å; Q486-T503 HydrophobicContact CB-CG2 4.28Å; Q486-T503 HydrophobicContact CG-CG2 4.15Å
504	S	87.6	Confident	82.4	Confident	21 Å²	21	80.1 Å²	80.1	15%	0.147	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.1	173.8	-172	0	0	0	0	109.9	Y485 T506 M508	Y485-S504 PolarHBondContact N-O 3.42Å; Y485-S504 PolarHBondContact O-N 2.93Å; S504-T506 WeakPolarHBondContact CB-O 3.46Å; S504-T506 PolarHBondContact O-N 2.97Å; S504-T506 PolarHBondContact OG-N 3.06Å; S504-T506 PolarHBondContact OG-O 3.14Å; S504-T506 VanDerWaalsContact OG-O 3.05Å; S504-T506 PolarHBondContact OG-OG1 3.1Å; S504-M508 PolarHBondContact OG-O 3.35Å
505	E	87	Confident	82.9	Confident	176 Å²	176	78.6 Å²	78.6	82%	0.822	43%	0.431	S	S	*	.	S	Bend	trans	-77.2	-12.3	173.3	-63.4	-179.5	178.5	0	0	111.9
506	T	87.1	Confident	83.6	Confident	82 Å²	82	74.8 Å²	74.8	50%	0.503	42%	0.42	S	S	.	.	S	Bend	trans	-117.2	168.7	179.6	65.9	0	0	0	0	110.6	S504 M508	S504-T506 WeakPolarHBondContact CB-O 3.46Å; S504-T506 PolarHBondContact O-N 2.97Å; S504-T506 PolarHBondContact OG-N 3.06Å; S504-T506 PolarHBondContact OG-O 3.14Å; S504-T506 VanDerWaalsContact OG-O 3.05Å; S504-T506 PolarHBondContact OG-OG1 3.1Å; T506-M508 PolarHBondContact O-N 2.92Å; T506-M508 VanDerWaalsContact O-N 3.12Å; T506-M508 PolarHBondContact OG1-O 3.07Å
507	N	86.9	Confident	84.3	Confident	79 Å²	79	71.8 Å²	71.8	42%	0.422	41%	0.409	S	S	.	.	S	Bend	trans	-82.4	22.9	-179.2	70.1	-43.7	0	0	0	113.7	S471 W472 Y485	S471-N507 VanDerWaalsContact CA-O 3.31Å; S471-N507 WeakPolarHBondContact CA-O 3.45Å; W472-N507 PolarHBondContact N-O 3.03Å; W472-N507 VanDerWaalsContact O-CB 3.31Å; W472-N507 WeakPolarHBondContact O-CB 3.44Å; W472-N507 PolarHBondContact O-ND2 3.16Å; Y485-N507 HydrophobicContact CE2-CB 4.5Å
508	M	87.8	Confident	85.3	Confident	83 Å²	83	69.2 Å²	69.2	41%	0.409	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144	178.2	-168.7	179.1	-67.1	0	0	109.9	V461 T469 L470 S504 T506	V461-M508 HydrophobicContact CG2-CE 4.24Å; T469-M508 HydrophobicContact CG2-CG 4.14Å; T469-M508 HydrophobicContact CG2-SD 4.26Å; L470-M508 CarbonylContact O-C 3.59Å; L470-M508 VanDerWaalsContact O-CA 3.27Å; L470-M508 WeakPolarHBondContact O-CA 3.35Å; L470-M508 VanDerWaalsContact O-CG 3.28Å; L470-M508 WeakPolarHBondContact O-CG 3.37Å; S504-M508 PolarHBondContact OG-O 3.35Å; T506-M508 PolarHBondContact O-N 2.92Å; T506-M508 VanDerWaalsContact O-N 3.12Å; T506-M508 PolarHBondContact OG1-O 3.07Å
509	A	89.2	Confident	86	Confident	8 Å²	8	66.8 Å²	66.8	7%	0.066	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	141.6	175.5	0	0	0	0	0	112	T469 L470 W472 L487 L502	T469-A509 WeakPolarHBondContact CA-O 3.33Å; L470-A509 PolarHBondContact N-O 3.09Å; L470-A509 PolarHBondContact O-N 3.34Å; W472-A509 HydrophobicContact CH2-CB 3.77Å; W472-A509 HydrophobicContact CZ3-CB 4.15Å; L487-A509 HydrophobicContact CD2-CB 4.35Å; L502-A509 HydrophobicContact CD2-CB 4.1Å
510	T	88.4	Confident	86.4	Confident	83 Å²	83	66.6 Å²	66.6	51%	0.509	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.6	175.4	-54.1	0	0	0	0	109.8	T469	T469-T510 WeakPolarHBondContact CG2-OG1 3.39Å; T469-T510 PolarHBondContact OG1-OG1 3.41Å
511	I	90.4	Very high	86.7	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.015	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	116.6	-179.4	-54.8	88.6	0	0	0	107.7	S467 I468 L470 L487 Y489 L502 L514 F522	S467-I511 CarbonylContact C-O 3.55Å; S467-I511 WeakPolarHBondContact CA-O 3.39Å; S467-I511 WeakPolarHBondContact CB-O 3.43Å; I468-I511 PolarHBondContact N-O 2.97Å; I468-I511 VanDerWaalsContact O-CD1 3.32Å; I468-I511 WeakPolarHBondContact O-CD1 3.04Å; I468-I511 PolarHBondContact O-N 3.47Å; L470-I511 HydrophobicContact CD1-CD1 4.05Å; L470-I511 HydrophobicContact CG-CD1 4.18Å; L487-I511 HydrophobicContact CD2-CD1 3.62Å; L487-I511 HydrophobicContact CD2-CG1 3.93Å; Y489-I511 HydrophobicContact CD1-CG2 4.3Å; Y489-I511 HydrophobicContact CD2-CG2 4.18Å; Y489-I511 HydrophobicContact CE1-CG2 3.86Å; Y489-I511 HydrophobicContact CE2-CG2 3.73Å; Y489-I511 HydrophobicContact CG-CG2 4.45Å; L502-I511 HydrophobicContact CD2-CG1 4.27Å; I511-L514 HydrophobicContact CB-CD1 4.44Å; I511-L514 HydrophobicContact CG2-CD1 4.2Å; I511-L514 HydrophobicContact CG2-CD2 3.85Å; I511-L514 HydrophobicContact CG2-CG 4.13Å; I511-F522 HydrophobicContact CB-CE1 4.46Å; I511-F522 HydrophobicContact CD1-CD1 4.41Å; I511-F522 HydrophobicContact CD1-CE1 3.87Å; I511-F522 HydrophobicContact CG1-CE1 4Å
512	S	85.5	Confident	87	Confident	67 Å²	67	57.9 Å²	57.9	47%	0.469	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	171.3	179.2	53.7	0	0	0	0	112.2	S466 L514	S466-S512 CarbonylContact O-C 3.39Å; S512-L514 VanDerWaalsContact C-N 3.33Å
513	N	83.8	Confident	87.1	Confident	150 Å²	150	55.8 Å²	55.8	80%	0.802	31%	0.312	S	S	*	.	S	Bend	trans	65.8	29.7	-179.9	-53.4	-33	0	0	0	114.5	S466	S466-N513 PolarHBondContact O-N 3.12Å
514	L	86.4	Confident	87.4	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.042	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-79.8	149.5	173.3	-59.7	179.2	0	0	0	110.4	S466 I468 Y489 I511 S512 Y520 T543	S466-L514 WeakPolarHBondContact CA-O 3.47Å; S466-L514 PolarHBondContact O-N 3.15Å; I468-L514 HydrophobicContact CB-CD1 3.97Å; I468-L514 HydrophobicContact CD1-CD1 3.87Å; I468-L514 HydrophobicContact CG1-CD1 3.74Å; Y489-L514 HydrophobicContact CD2-CD2 4.28Å; Y489-L514 HydrophobicContact CE2-CD2 3.92Å; I511-L514 HydrophobicContact CB-CD1 4.44Å; I511-L514 HydrophobicContact CG2-CD1 4.2Å; I511-L514 HydrophobicContact CG2-CD2 3.85Å; I511-L514 HydrophobicContact CG2-CG 4.13Å; S512-L514 VanDerWaalsContact C-N 3.33Å; L514-Y520 HydrophobicContact CB-CD2 4.4Å; L514-Y520 HydrophobicContact CB-CE2 3.74Å; L514-Y520 HydrophobicContact CD1-CD2 4.22Å; L514-Y520 HydrophobicContact CD1-CE2 4.39Å; L514-Y520 HydrophobicContact CD2-CD1 3.99Å; L514-Y520 HydrophobicContact CD2-CD2 4.08Å; L514-Y520 HydrophobicContact CD2-CE1 3.74Å; L514-Y520 HydrophobicContact CD2-CE2 3.83Å; L514-Y520 HydrophobicContact CD2-CG 4.16Å; L514-Y520 HydrophobicContact CG-CD2 4.47Å; L514-Y520 HydrophobicContact CG-CE2 4.19Å; L514-T543 HydrophobicContact CB-CG2 3.55Å; L514-T543 HydrophobicContact CD1-CG2 3.87Å; L514-T543 HydrophobicContact CG-CG2 4.38Å
515	S	84.4	Confident	87.6	Confident	48 Å²	48	53.4 Å²	53.4	34%	0.336	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-73.2	134.6	176.4	-64.5	0	0	0	0	110.2	K518 Y520 T543	S515-K518 PolarHBondContact O-N 3.43Å; S515-Y520 PolarHBondContact N-OH 3Å; S515-T543 PolarHBondContact O-OG1 2.83Å
516	P	82.6	Confident	87.7	Confident	75 Å²	75	45 Å²	45	49%	0.487	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	137.4	175.1	-23.3	32	0	0	0	112.5	S465 K518	S465-P516 WeakPolarHBondContact O-CA 3.23Å; S465-P516 WeakPolarHBondContact O-CB 3.49Å; S465-P516 WeakPolarHBondContact O-CG 3.41Å; P516-K518 VanDerWaalsContact C-N 3.27Å; P516-K518 PolarHBondContact O-N 3.18Å
517	G	78.3	Confident	87.7	Confident	12 Å²	12	44.5 Å²	44.5	12%	0.124	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	0	176.6	0	0	0	0	0	117	Q542 T543 L544 M545	G517-Q542 PolarHBondContact O-NE2 2.99Å; G517-T543 PolarHBondContact N-OG1 3.01Å; G517-L544 PolarHBondContact N-O 2.98Å; G517-M545 VanDerWaalsContact CA-CE 3.44Å; G517-M545 VanDerWaalsContact CA-SD 3.51Å
518	K	85.2	Confident	87.5	Confident	88 Å²	88	41 Å²	41	38%	0.383	22%	0.221	S	C	.	.			trans	-91.8	151.8	-177.3	-69.8	-150.7	-177.1	-179.4	0	113.3	D491 S515 P516 Y520 Q542 T543	D491-K518 WeakPolarHBondContact OD2-CD 3.49Å; D491-K518 WeakPolarHBondContact OD2-CE 3.38Å; D491-K518 IonicContact OD2-NZ 3.51Å; D491-K518 PolarHBondContact OD2-NZ 3.17Å; S515-K518 PolarHBondContact O-N 3.43Å; P516-K518 VanDerWaalsContact C-N 3.27Å; P516-K518 PolarHBondContact O-N 3.18Å; K518-Y520 HydrophobicContact CB-CD2 4.45Å; K518-Y520 HydrophobicContact CB-CE2 3.8Å; K518-Q542 WeakPolarHBondContact O-CA 3.46Å; K518-Q542 WeakPolarHBondContact O-CG 3.42Å; K518-T543 PolarHBondContact N-OG1 3.28Å; K518-T543 VanDerWaalsContact N-OG1 3.17Å; K518-T543 PolarHBondContact O-N 2.77Å; K518-T543 VanDerWaalsContact O-N 3.15Å; K518-T543 PolarHBondContact O-OG1 2.93Å
519	I	88.6	Confident	86.8	Confident	61 Å²	61	41.5 Å²	41.5	31%	0.313	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.4	177.2	-60.1	166.2	0	0	0	109.1	K492 Y540 F541 Q542	K492-I519 HydrophobicContact CB-CB 4.3Å; K492-I519 HydrophobicContact CB-CG2 4.29Å; K492-I519 WeakPolarHBondContact CB-O 3.47Å; K492-I519 HydrophobicContact CD-CB 4.44Å; K492-I519 HydrophobicContact CD-CG2 4.15Å; K492-I519 PolarHBondContact N-O 3.36Å; I519-Y540 HydrophobicContact CG2-CD1 4.22Å; I519-F541 WeakPolarHBondContact CA-O 3.31Å; I519-Q542 HydrophobicContact CG1-CB 3.99Å; I519-Q542 HydrophobicContact CG1-CG 3.81Å
520	Y	89.5	Confident	86	Confident	19 Å²	19	45.1 Å²	45.1	8%	0.075	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.2	176.6	-70.2	-90.1	0	0	0	110.7	Y489 F490 D491 L514 S515 K518 F522 Y540 F541 T543	Y489-Y520 HydrophobicContact CD2-CD1 4.3Å; F490-Y520 CarbonylContact O-C 3.55Å; F490-Y520 WeakPolarHBondContact O-CA 3.35Å; D491-Y520 HydrophobicContact CB-CD1 4.44Å; D491-Y520 HydrophobicContact CB-CE1 4.15Å; L514-Y520 HydrophobicContact CB-CD2 4.4Å; L514-Y520 HydrophobicContact CB-CE2 3.74Å; L514-Y520 HydrophobicContact CD1-CD2 4.22Å; L514-Y520 HydrophobicContact CD1-CE2 4.39Å; L514-Y520 HydrophobicContact CD2-CD1 3.99Å; L514-Y520 HydrophobicContact CD2-CD2 4.08Å; L514-Y520 HydrophobicContact CD2-CE1 3.74Å; L514-Y520 HydrophobicContact CD2-CE2 3.83Å; L514-Y520 HydrophobicContact CD2-CG 4.16Å; L514-Y520 HydrophobicContact CG-CD2 4.47Å; L514-Y520 HydrophobicContact CG-CE2 4.19Å; S515-Y520 PolarHBondContact N-OH 3Å; K518-Y520 HydrophobicContact CB-CD2 4.45Å; K518-Y520 HydrophobicContact CB-CE2 3.8Å; Y520-F522 VanDerWaalsContact CB-CE2 3.43Å; Y520-F522 WeakPolarHBondContact O-CD2 3.4Å; Y520-F522 WeakPolarHBondContact O-CE2 3.46Å; Y520-Y540 WeakPolarHBondContact O-CA 3.37Å; Y520-F541 PolarHBondContact N-O 2.85Å; Y520-F541 PolarHBondContact O-N 3.07Å; Y520-T543 HydrophobicContact CE2-CG2 4.43Å
521	A	89.9	Confident	85.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	138.4	171.1	0	0	0	0	0	109.9	Y489 F490 M539 Y540	Y489-A521 WeakPolarHBondContact CA-O 3.08Å; Y489-A521 WeakPolarHBondContact CB-O 3.44Å; F490-A521 HydrophobicContact CD1-CB 4.3Å; F490-A521 HydrophobicContact CD2-CB 4.27Å; F490-A521 HydrophobicContact CE1-CB 3.87Å; F490-A521 HydrophobicContact CE2-CB 3.83Å; F490-A521 HydrophobicContact CG-CB 4.48Å; F490-A521 HydrophobicContact CZ-CB 3.61Å; F490-A521 PolarHBondContact N-O 3.35Å; F490-A521 VanDerWaalsContact N-O 3.15Å; F490-A521 PolarHBondContact O-N 3.09Å; A521-M539 CarbonylContact C-O 3.56Å; A521-M539 WeakPolarHBondContact CA-O 3.48Å; A521-Y540 HydrophobicContact CB-CD1 3.81Å; A521-Y540 HydrophobicContact CB-CE1 3.6Å
522	F	91.8	Very high	84.8	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.9	-177.9	-61.4	-95.5	0	0	0	111.9	M458 I468 L470 L487 R488 Y489 I511 Y520 M539 F541	M458-F522 HydrophobicContact CE-CB 3.42Å; M458-F522 VanDerWaalsContact CE-CB 3.42Å; M458-F522 HydrophobicContact SD-CB 4.43Å; I468-F522 HydrophobicContact CD1-CE2 4.32Å; I468-F522 HydrophobicContact CD1-CZ 4.27Å; L470-F522 HydrophobicContact CD1-CB 3.89Å; L470-F522 HydrophobicContact CD1-CD1 3.35Å; L470-F522 HydrophobicContact CD1-CD2 4Å; L470-F522 HydrophobicContact CD1-CE1 3.78Å; L470-F522 HydrophobicContact CD1-CE2 4.35Å; L470-F522 HydrophobicContact CD1-CG 3.48Å; L470-F522 VanDerWaalsContact CD1-CG 3.48Å; L470-F522 HydrophobicContact CD1-CZ 4.25Å; L487-F522 HydrophobicContact CD2-CD1 4.21Å; R488-F522 CarbonylContact O-C 3.6Å; R488-F522 WeakPolarHBondContact O-CA 3.49Å; Y489-F522 HydrophobicContact CD2-CE1 4.41Å; Y489-F522 HydrophobicContact CG-CD1 4.25Å; Y489-F522 AromaticContact CG-CE1 3.97Å; Y489-F522 HydrophobicContact CG-CE1 3.97Å; I511-F522 HydrophobicContact CB-CE1 4.46Å; I511-F522 HydrophobicContact CD1-CD1 4.41Å; I511-F522 HydrophobicContact CD1-CE1 3.87Å; I511-F522 HydrophobicContact CG1-CE1 4Å; Y520-F522 VanDerWaalsContact CB-CE2 3.43Å; Y520-F522 WeakPolarHBondContact O-CD2 3.4Å; Y520-F522 WeakPolarHBondContact O-CE2 3.46Å; F522-M539 PolarHBondContact N-O 3.48Å; F522-M539 PolarHBondContact O-N 3.13Å; F522-F541 HydrophobicContact CD2-CB 4.41Å; F522-F541 AromaticContact CD2-CD2 3.59Å; F522-F541 HydrophobicContact CD2-CD2 3.59Å; F522-F541 HydrophobicContact CD2-CE2 4.42Å; F522-F541 HydrophobicContact CD2-CG 4.47Å; F522-F541 HydrophobicContact CE2-CB 4Å; F522-F541 AromaticContact CE2-CD2 3.93Å; F522-F541 HydrophobicContact CE2-CD2 3.93Å; F522-F541 HydrophobicContact CE2-CG 4.48Å; F522-F541 HydrophobicContact CG-CD2 4.39Å
523	Q	91.8	Very high	84.6	Confident	21 Å²	21	42.9 Å²	42.9	10%	0.098	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144	174.1	-63.8	-178.9	-83	0	0	110.8	L487 R488 Y535 S536 K538	L487-Q523 CarbonylContact C-O 3.55Å; L487-Q523 WeakPolarHBondContact CA-O 3.28Å; L487-Q523 WeakPolarHBondContact CD1-O 3.39Å; R488-Q523 PolarHBondContact N-O 2.88Å; R488-Q523 PolarHBondContact O-N 3.44Å; Q523-Y535 HydrophobicContact CB-CD1 3.9Å; Q523-Y535 HydrophobicContact CB-CG 4.39Å; Q523-S536 PolarHBondContact NE2-O 2.83Å; Q523-K538 HydrophobicContact CG-CB 4.47Å; Q523-K538 HydrophobicContact CG-CG 3.87Å
524	V	93	Very high	84.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.6	179.7	67.5	0	0	0	0	112.1	V455 W472 Y485 Q486 L487 S536	V455-V524 HydrophobicContact CB-CG1 3.78Å; V455-V524 HydrophobicContact CG1-CG1 3.76Å; V455-V524 HydrophobicContact CG2-CG1 4.05Å; W472-V524 HydrophobicContact CD2-CB 4.45Å; W472-V524 HydrophobicContact CD2-CG1 4.22Å; W472-V524 HydrophobicContact CD2-CG2 3.96Å; W472-V524 HydrophobicContact CE3-CG2 4.39Å; W472-V524 HydrophobicContact CG-CG1 4.15Å; W472-V524 HydrophobicContact CG-CG2 4.47Å; W472-V524 HydrophobicContact CH2-CG2 4.22Å; W472-V524 HydrophobicContact CZ2-CG2 3.77Å; Y485-V524 HydrophobicContact CD1-CG2 4.25Å; Q486-V524 WeakPolarHBondContact O-CA 3.44Å; L487-V524 HydrophobicContact CD1-CB 3.85Å; L487-V524 HydrophobicContact CD1-CG2 4.3Å; V524-S536 PolarHBondContact N-OG 2.89Å; V524-S536 PolarHBondContact O-N 2.93Å
525	R	91.8	Very high	84.7	Confident	58 Å²	58	41.8 Å²	41.8	22%	0.219	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153.3	171.1	63.8	-177.9	-176.8	170.7	-0.1	111.9	Y485 Q486 Y532 G533 P534 Y535	Y485-R525 CarbonylContact C-O 3.47Å; Y485-R525 VanDerWaalsContact CA-O 3.31Å; Y485-R525 WeakPolarHBondContact CA-O 3.39Å; Q486-R525 HydrophobicContact CB-CG 4.12Å; Q486-R525 PolarHBondContact N-O 3.28Å; Q486-R525 PolarHBondContact O-N 3.23Å; Q486-R525 VanDerWaalsContact OE1-CZ 3.23Å; R525-Y532 HydrophobicContact CG-CD1 3.96Å; R525-G533 WeakPolarHBondContact CD-O 3.35Å; R525-P534 WeakPolarHBondContact CB-O 3.43Å; R525-Y535 HydrophobicContact CB-CD1 3.96Å; R525-Y535 HydrophobicContact CB-CE1 4.29Å; R525-Y535 HydrophobicContact CB-CG 4.3Å; R525-Y535 HydrophobicContact CG-CD1 3.88Å; R525-Y535 HydrophobicContact CG-CE1 3.69Å; R525-Y535 HydrophobicContact CG-CG 4.4Å; R525-Y535 PolarHBondContact NE-OH 3.19Å
526	A	89.4	Confident	85	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	156.1	177.9	0	0	0	0	0	111.8	P452 P475 I482 Y485 G533	P452-A526 HydrophobicContact CB-CB 4.44Å; P475-A526 HydrophobicContact CG-CB 3.68Å; I482-A526 HydrophobicContact CG2-CB 4.16Å; Y485-A526 HydrophobicContact CD1-CB 3.85Å; Y485-A526 HydrophobicContact CE1-CB 3.65Å; A526-G533 PolarHBondContact O-N 3.12Å
527	R	86.9	Confident	85.1	Confident	71 Å²	71	39.3 Å²	39.3	27%	0.268	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.3	179	-171.1	174.3	65.3	90	-3.5	113	I482 L483 D484 G531 Y532	I482-R527 WeakPolarHBondContact CA-O 3.24Å; L483-R527 VanDerWaalsContact CD1-NH1 3.32Å; L483-R527 PolarHBondContact N-O 3.23Å; D484-R527 PolarHBondContact O-N 3.27Å; D484-R527 VanDerWaalsContact OD1-CB 3.32Å; D484-R527 WeakPolarHBondContact OD1-CB 3.44Å; D484-R527 IonicContact OD1-CZ 3.8Å; D484-R527 IonicContact OD1-NE 2.93Å; D484-R527 PolarHBondContact OD1-NE 3.35Å; D484-R527 IonicContact OD1-NH2 3.85Å; D484-R527 IonicContact OD2-CZ 3.31Å; D484-R527 VanDerWaalsContact OD2-CZ 3.31Å; D484-R527 IonicContact OD2-NE 3.13Å; D484-R527 PolarHBondContact OD2-NE 3.06Å; D484-R527 VanDerWaalsContact OD2-NE 3.13Å; D484-R527 IonicContact OD2-NH2 2.67Å; D484-R527 PolarHBondContact OD2-NH2 2.9Å; R527-G531 WeakPolarHBondContact CA-O 3.41Å; R527-Y532 HydrophobicContact CB-CD1 3.67Å; R527-Y532 HydrophobicContact CB-CE1 3.73Å; R527-Y532 HydrophobicContact CB-CG 4.28Å; R527-Y532 VanDerWaalsContact CD-CZ 3.47Å; R527-Y532 HydrophobicContact CG-CD1 4.06Å; R527-Y532 HydrophobicContact CG-CD2 4.41Å; R527-Y532 HydrophobicContact CG-CE1 4.1Å; R527-Y532 HydrophobicContact CG-CE2 4.45Å; R527-Y532 HydrophobicContact CG-CG 4.22Å
528	T	82.9	Confident	85.6	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.025	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-178.9	164.3	60.7	0	0	0	0	110.8	P452 P478 I481 V530 G531	P452-T528 HydrophobicContact CG-CG2 3.37Å; P478-T528 WeakPolarHBondContact O-CG2 3.36Å; I481-T528 WeakPolarHBondContact O-CG2 3.45Å; T528-V530 PolarHBondContact O-N 2.88Å; T528-V530 VanDerWaalsContact O-N 3.14Å; T528-V530 PolarHBondContact OG1-N 2.87Å; T528-G531 PolarHBondContact N-O 3.41Å; T528-G531 PolarHBondContact O-N 3.19Å; T528-G531 VanDerWaalsContact O-N 3.13Å
529	A	73.8	Confident	85.7	Confident	94 Å²	94	42 Å²	42	78%	0.777	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.8	173.3	0	0	0	0	0	114
530	V	72.9	Confident	85.7	Confident	84 Å²	84	44.7 Å²	44.7	51%	0.509	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-29.9	178.5	-176.5	0	0	0	0	111.7	V451 T528	V451-V530 HydrophobicContact CG1-CB 4.25Å; V451-V530 HydrophobicContact CG1-CG1 3.92Å; T528-V530 PolarHBondContact O-N 2.88Å; T528-V530 VanDerWaalsContact O-N 3.14Å; T528-V530 PolarHBondContact OG1-N 2.87Å
531	G	73.1	Confident	85.7	Confident	22 Å²	22	45.1 Å²	45.1	23%	0.227	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.7	-171.7	179.5	0	0	0	0	0	114	R527 T528	R527-G531 WeakPolarHBondContact CA-O 3.41Å; T528-G531 PolarHBondContact N-O 3.41Å; T528-G531 PolarHBondContact O-N 3.19Å; T528-G531 VanDerWaalsContact O-N 3.13Å
532	Y	79.4	Confident	85.5	Confident	82 Å²	82	49 Å²	49	32%	0.322	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	135.2	176.8	-73.3	-80.6	0	0	0	111.4	Q486 R525 R527	Q486-Y532 HydrophobicContact CB-CE1 3.98Å; R525-Y532 HydrophobicContact CG-CD1 3.96Å; R527-Y532 HydrophobicContact CB-CD1 3.67Å; R527-Y532 HydrophobicContact CB-CE1 3.73Å; R527-Y532 HydrophobicContact CB-CG 4.28Å; R527-Y532 VanDerWaalsContact CD-CZ 3.47Å; R527-Y532 HydrophobicContact CG-CD1 4.06Å; R527-Y532 HydrophobicContact CG-CD2 4.41Å; R527-Y532 HydrophobicContact CG-CE1 4.1Å; R527-Y532 HydrophobicContact CG-CE2 4.45Å; R527-Y532 HydrophobicContact CG-CG 4.22Å
533	G	82.1	Confident	85.1	Confident	3 Å²	3	49 Å²	49	3%	0.031	27%	0.267	C	S	.	.			trans	-71.2	174.7	163.9	0	0	0	0	0	112.3	P452 R525 A526	P452-G533 WeakPolarHBondContact O-CA 3.47Å; R525-G533 WeakPolarHBondContact CD-O 3.35Å; A526-G533 PolarHBondContact O-N 3.12Å
534	P	85.2	Confident	84.6	Confident	75 Å²	75	51.2 Å²	51.2	49%	0.487	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-65.6	153.5	175.9	27.1	-33	0	0	0	112.4	P452 A454 R525	P452-P534 WeakPolarHBondContact O-CD 3.32Å; A454-P534 HydrophobicContact CB-CG 4.01Å; R525-P534 WeakPolarHBondContact CB-O 3.43Å
535	Y	87.1	Confident	83.5	Confident	59 Å²	59	57.7 Å²	57.7	23%	0.231	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-67.4	147.2	171.7	-79.4	-75.2	0	0	0	111.6	Q486 R488 Q523 R525	Q486-Y535 PolarHBondContact OE1-OH 2.93Å; R488-Y535 HydrophobicContact CB-CE1 3.95Å; Q523-Y535 HydrophobicContact CB-CD1 3.9Å; Q523-Y535 HydrophobicContact CB-CG 4.39Å; R525-Y535 HydrophobicContact CB-CD1 3.96Å; R525-Y535 HydrophobicContact CB-CE1 4.29Å; R525-Y535 HydrophobicContact CB-CG 4.3Å; R525-Y535 HydrophobicContact CG-CD1 3.88Å; R525-Y535 HydrophobicContact CG-CE1 3.69Å; R525-Y535 HydrophobicContact CG-CG 4.4Å; R525-Y535 PolarHBondContact NE-OH 3.19Å
536	S	90.4	Very high	81.6	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.063	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-61.8	166	168.6	71.8	0	0	0	0	111.9	V455 Q523 V524	V455-S536 WeakPolarHBondContact O-CB 3.41Å; Q523-S536 PolarHBondContact NE2-O 2.83Å; V524-S536 PolarHBondContact N-OG 2.89Å; V524-S536 PolarHBondContact O-N 2.93Å
537	G	84.4	Confident	79.7	Confident	62 Å²	62	61.7 Å²	61.7	64%	0.639	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-56.1	154.7	165.7	0	0	0	0	0	112.2	M539	G537-M539 PolarHBondContact O-N 3.39Å
538	K	88.4	Confident	77.2	Confident	83 Å²	83	66.6 Å²	66.6	36%	0.361	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-70.7	123.8	178.3	-66.8	179.1	-179.7	-179.9	0	109.9	F490 E496 Q523 Y540	F490-K538 HydrophobicContact CZ-CD 4.33Å; E496-K538 WeakPolarHBondContact OE1-CE 3.44Å; E496-K538 IonicContact OE1-NZ 2.72Å; E496-K538 PolarHBondContact OE1-NZ 3.12Å; E496-K538 IonicContact OE2-NZ 2.72Å; E496-K538 PolarHBondContact OE2-NZ 3.09Å; Q523-K538 HydrophobicContact CG-CB 4.47Å; Q523-K538 HydrophobicContact CG-CG 3.87Å; K538-Y540 HydrophobicContact CB-CE2 4.32Å
539	M	87.1	Confident	74.7	Confident	74 Å²	74	77.1 Å²	77.1	37%	0.365	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.6	174.6	-165.2	66.9	81.6	0	0	110	M458 A521 F522 G537 F541	M458-M539 HydrophobicContact CE-CB 4.16Å; A521-M539 CarbonylContact C-O 3.56Å; A521-M539 WeakPolarHBondContact CA-O 3.48Å; F522-M539 PolarHBondContact N-O 3.48Å; F522-M539 PolarHBondContact O-N 3.13Å; G537-M539 PolarHBondContact O-N 3.39Å; M539-F541 HydrophobicContact CB-CE2 3.96Å; M539-F541 HydrophobicContact CB-CZ 4.27Å; M539-F541 HydrophobicContact CG-CD2 4.3Å; M539-F541 HydrophobicContact CG-CE1 4Å; M539-F541 HydrophobicContact CG-CE2 3.41Å; M539-F541 VanDerWaalsContact CG-CE2 3.41Å; M539-F541 HydrophobicContact CG-CZ 3.24Å; M539-F541 HydrophobicContact SD-CZ 4.46Å
540	Y	88.9	Confident	72.5	Confident	118 Å²	118	77.3 Å²	77.3	46%	0.463	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.5	-174	-60.9	-86.7	0	0	0	111.4	K492 I519 Y520 A521 K538	K492-Y540 HydrophobicContact CD-CD1 4.44Å; K492-Y540 HydrophobicContact CD-CE1 4.48Å; K492-Y540 HydrophobicContact CG-CE1 4.36Å; I519-Y540 HydrophobicContact CG2-CD1 4.22Å; Y520-Y540 WeakPolarHBondContact O-CA 3.37Å; A521-Y540 HydrophobicContact CB-CD1 3.81Å; A521-Y540 HydrophobicContact CB-CE1 3.6Å; K538-Y540 HydrophobicContact CB-CE2 4.32Å
541	F	88.6	Confident	70.4	Confident	28 Å²	28	81.5 Å²	81.5	12%	0.123	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.6	178	-58.8	-67.5	0	0	0	111.3	Q460 I468 L470 I519 Y520 F522 M539	Q460-F541 HydrophobicContact CB-CD1 3.79Å; Q460-F541 HydrophobicContact CB-CE1 3.65Å; Q460-F541 HydrophobicContact CB-CG 4.43Å; Q460-F541 HydrophobicContact CB-CZ 4.17Å; Q460-F541 HydrophobicContact CG-CD1 4.26Å; I468-F541 HydrophobicContact CD1-CB 3.87Å; I468-F541 HydrophobicContact CG2-CB 4.33Å; L470-F541 HydrophobicContact CD1-CD2 4.19Å; L470-F541 HydrophobicContact CD1-CE2 4.18Å; L470-F541 HydrophobicContact CD2-CD2 3.5Å; L470-F541 HydrophobicContact CD2-CE2 3.38Å; L470-F541 HydrophobicContact CD2-CG 4.22Å; L470-F541 HydrophobicContact CD2-CZ 4.01Å; L470-F541 HydrophobicContact CG-CE2 4.44Å; I519-F541 WeakPolarHBondContact CA-O 3.31Å; Y520-F541 PolarHBondContact N-O 2.85Å; Y520-F541 PolarHBondContact O-N 3.07Å; F522-F541 HydrophobicContact CD2-CB 4.41Å; F522-F541 AromaticContact CD2-CD2 3.59Å; F522-F541 HydrophobicContact CD2-CD2 3.59Å; F522-F541 HydrophobicContact CD2-CE2 4.42Å; F522-F541 HydrophobicContact CD2-CG 4.47Å; F522-F541 HydrophobicContact CE2-CB 4Å; F522-F541 AromaticContact CE2-CD2 3.93Å; F522-F541 HydrophobicContact CE2-CD2 3.93Å; F522-F541 HydrophobicContact CE2-CG 4.48Å; F522-F541 HydrophobicContact CG-CD2 4.39Å; M539-F541 HydrophobicContact CB-CE2 3.96Å; M539-F541 HydrophobicContact CB-CZ 4.27Å; M539-F541 HydrophobicContact CG-CD2 4.3Å; M539-F541 HydrophobicContact CG-CE1 4Å; M539-F541 HydrophobicContact CG-CE2 3.41Å; M539-F541 VanDerWaalsContact CG-CE2 3.41Å; M539-F541 HydrophobicContact CG-CZ 3.24Å; M539-F541 HydrophobicContact SD-CZ 4.46Å
542	Q	86.1	Confident	68.3	Low	80 Å²	80	88.7 Å²	88.7	37%	0.374	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.3	-176.3	-165.8	-174.9	12.6	0	0	111.8	R463 G517 K518 I519	R463-Q542 VanDerWaalsContact CD-O 3.27Å; R463-Q542 WeakPolarHBondContact CD-O 3.22Å; R463-Q542 PolarHBondContact NH1-O 3.14Å; G517-Q542 PolarHBondContact O-NE2 2.99Å; K518-Q542 WeakPolarHBondContact O-CA 3.46Å; K518-Q542 WeakPolarHBondContact O-CG 3.42Å; I519-Q542 HydrophobicContact CG1-CB 3.99Å; I519-Q542 HydrophobicContact CG1-CG 3.81Å
543	T	84.7	Confident	65.9	Low	2 Å²	2	90.2 Å²	90.2	1%	0.012	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-71.3	155	171.9	51	0	0	0	0	111.9	I468 L514 S515 G517 K518 Y520	I468-T543 HydrophobicContact CD1-CG2 3.9Å; I468-T543 HydrophobicContact CG1-CG2 3.98Å; L514-T543 HydrophobicContact CB-CG2 3.55Å; L514-T543 HydrophobicContact CD1-CG2 3.87Å; L514-T543 HydrophobicContact CG-CG2 4.38Å; S515-T543 PolarHBondContact O-OG1 2.83Å; G517-T543 PolarHBondContact N-OG1 3.01Å; K518-T543 PolarHBondContact N-OG1 3.28Å; K518-T543 VanDerWaalsContact N-OG1 3.17Å; K518-T543 PolarHBondContact O-N 2.77Å; K518-T543 VanDerWaalsContact O-N 3.15Å; K518-T543 PolarHBondContact O-OG1 2.93Å; Y520-T543 HydrophobicContact CE2-CG2 4.43Å
544	L	80	Confident	63.4	Low	67 Å²	67	98.3 Å²	98.3	35%	0.351	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-70.1	145.5	178.5	-63.1	174.1	0	0	0	111.4	R463 T464 S465 G517	R463-L544 HydrophobicContact CG-CD1 4.48Å; R463-L544 HydrophobicContact CG-CD2 4.23Å; R463-L544 HydrophobicContact CG-CG 4.1Å; R463-L544 WeakPolarHBondContact O-CD1 3.46Å; T464-L544 PolarHBondContact O-N 3.03Å; S465-L544 WeakPolarHBondContact CA-O 3.21Å; S465-L544 VanDerWaalsContact CB-O 3.29Å; S465-L544 WeakPolarHBondContact CB-O 3.5Å; G517-L544 PolarHBondContact N-O 2.98Å
545	M	71.2	Confident	60.6	Low	135 Å²	135	102.1 Å²	102.1	67%	0.665	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-74.8	139.4	167.6	-68.7	-78	-175.9	0	0	108.8	G517 G547	G517-M545 VanDerWaalsContact CA-CE 3.44Å; G517-M545 VanDerWaalsContact CA-SD 3.51Å; M545-G547 PolarHBondContact O-N 2.81Å
546	G	51.6	Low	58	Low	71 Å²	71	110.7 Å²	110.7	73%	0.732	58%	0.578	S	S	*	*	S	Bend	trans	-68.8	114	179.2	0	0	0	0	0	112.2
547	G	48.6	Very low	55.1	Low	73 Å²	73	117.9 Å²	117.9	75%	0.753	62%	0.615	S	S	*	*	S	Bend	trans	113.1	104.5	176.5	0	0	0	0	0	113.6	M545	M545-G547 PolarHBondContact O-N 2.81Å
548	E	34.9	Very low	52.9	Low	174 Å²	174	119.8 Å²	119.8	81%	0.813	62%	0.616	S	S	*	*			trans	-76.6	163.7	-173.7	-54.8	-176.4	130.5	0	0	112.9
549	R	30.9	Very low	50.2	Low	225 Å²	225	123.1 Å²	123.1	85%	0.849	64%	0.637	S	S	*	*			cis	-168.8	159.6	21.6	-143.5	171.8	-172.4	-173.8	2.8	109.2
550	S	26.9	Very low	47.8	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	65%	0.652	S	S	*	*			trans	99.7	137.8	154.3	-140.9	0	0	0	0	121.2
551	E	28.9	Very low	45.3	Very low	171 Å²	171	126.8 Å²	126.8	80%	0.799	67%	0.669	S	S	*	*			trans	69	107.4	159.7	-74.5	163.5	-159.2	0	0	118.2
552	M	28.6	Very low	42.6	Very low	173 Å²	173	128.7 Å²	128.7	85%	0.852	70%	0.697	S	S	*	*				71.1	138.9	77.7	-161.8	175.5	128.1	0	0	112.3
553	V	29.4	Very low	40.4	Very low	114 Å²	114	130.5 Å²	130.5	69%	0.691	72%	0.718	S	S	*	*			trans	93.9	97.5	168.9	-171	0	0	0	0	113.3
554	Q	28.5	Very low	38.4	Very low	173 Å²	173	135.3 Å²	135.3	81%	0.808	76%	0.758	S	S	*	*				95.6	98	83.6	-163.6	106.9	3.2	0	0	111	R556	Q554-R556 PolarHBondContact O-N 2.88Å
555	D	28.3	Very low	37	Very low	156 Å²	156	140.5 Å²	140.5	83%	0.834	79%	0.785	S	S	*	*			trans	-67.6	123.7	169.1	-95.2	-30.5	0	0	0	111.2
556	R	31.2	Very low	35.8	Very low	238 Å²	238	137.2 Å²	137.2	90%	0.898	79%	0.786	S	S	*	*			trans	-142.1	118.9	143.6	-85.8	-151.3	175.9	-163	1.4	110.4	Q554	Q554-R556 PolarHBondContact O-N 2.88Å
557	L	30	Very low	35.8	Very low	160 Å²	160	136.2 Å²	136.2	84%	0.838	78%	0.776	S	S	*	*			trans	-63.8	149.5	164.5	-84.4	97.3	0	0	0	112.7
558	P	38.9	Very low	35.9	Very low	102 Å²	102	139.6 Å²	139.6	66%	0.662	78%	0.776	S	S	*	*			trans	-100.8	140.6	148.1	10.5	10.7	0	0	0	111.5
559	L	31.4	Very low	36.8	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	76%	0.762	S	S	*	*				55.5	140	107.8	-89.1	79	0	0	0	115.4
560	I	36.6	Very low	38	Very low	133 Å²	133	131.7 Å²	131.7	68%	0.682	76%	0.757	S	S	*	*			cis	-174.3	147.7	7.1	-116.8	174	0	0	0	109.5
561	V	35.3	Very low	39.7	Very low	137 Å²	137	132.9 Å²	132.9	83%	0.83	76%	0.755	S	S	*	*			trans	60.5	134.7	138.5	-179.4	0	0	0	0	123.2
562	G	32.6	Very low	41.5	Very low	68 Å²	68	128.8 Å²	128.8	70%	0.701	74%	0.742	S	S	*	*			trans	175.3	59.9	156.9	0	0	0	0	0	117
563	S	40.6	Very low	43.2	Very low	117 Å²	117	126.3 Å²	126.3	82%	0.818	73%	0.73	S	S	*	*			trans	15	117.6	154.5	55.7	0	0	0	0	121.6
564	A	41.7	Very low	44.9	Very low	104 Å²	104	122.8 Å²	122.8	86%	0.86	71%	0.714	S	S	*	*			trans	-147.3	69.5	156.9	0	0	0	0	0	111.6
565	L	50	Low	46.7	Very low	176 Å²	176	116.9 Å²	116.9	92%	0.921	69%	0.694	S	S	*	*			trans	-120.6	17.8	177.6	-107.6	154.7	0	0	0	113.1
566	G	47.8	Very low	48.7	Very low	65 Å²	65	114.7 Å²	114.7	67%	0.67	68%	0.681	S	S	*	*	S	Bend	trans	-102.4	-16.9	177.3	0	0	0	0	0	115.2
567	G	49.8	Very low	50.3	Low	51 Å²	51	105.9 Å²	105.9	53%	0.526	66%	0.659	S	S	.	*	H	α-helix	trans	-84.6	-25.1	-171.5	0	0	0	0	0	115.3
568	L	52.6	Low	52.1	Low	143 Å²	143	103 Å²	103	75%	0.749	64%	0.644	S	S	*	*	H	α-helix	trans	-85.3	-28.1	-170.6	-136.4	79.3	0	0	0	113.4	V572	L568-V572 WeakPolarHBondContact O-CG2 3.41Å
569	A	53.8	Low	53.3	Low	64 Å²	64	102.7 Å²	102.7	53%	0.529	64%	0.636	S	S	.	*	H	α-helix	trans	-75.2	-29.2	-179.4	0	0	0	0	0	112.9	I573	A569-I573 WeakPolarHBondContact O-CG1 3.34Å; A569-I573 PolarHBondContact O-N 2.87Å
570	F	56.2	Low	54.7	Low	170 Å²	170	98.4 Å²	98.4	75%	0.746	62%	0.623	S	S	*	*	H	α-helix	trans	-78.1	-32.3	-178.5	-150.2	-95.5	0	0	0	112.5	A574	F570-A574 WeakPolarHBondContact O-CB 3.45Å; F570-A574 PolarHBondContact O-N 3.24Å
571	L	61.4	Low	55.9	Low	123 Å²	123	97.8 Å²	97.8	64%	0.644	62%	0.62	S	S	*	*	H	α-helix	trans	-72.8	-33	178.1	-70.9	173.8	0	0	0	112.8	A575	L571-A575 WeakPolarHBondContact O-CB 3.19Å; L571-A575 PolarHBondContact O-N 2.92Å; L571-A575 VanDerWaalsContact O-N 3.11Å
572	V	66.1	Low	57.2	Low	85 Å²	85	95.7 Å²	95.7	52%	0.515	60%	0.603	S	S	.	*	H	α-helix	trans	-72.5	-37.5	178.3	176.3	0	0	0	0	111.4	L568 A575 I576	L568-V572 WeakPolarHBondContact O-CG2 3.41Å; V572-A575 PolarHBondContact O-N 3.41Å; V572-I576 HydrophobicContact CG1-CD1 4.12Å; V572-I576 WeakPolarHBondContact O-CD1 3.47Å; V572-I576 VanDerWaalsContact O-CG1 3.31Å; V572-I576 WeakPolarHBondContact O-CG1 3.47Å; V572-I576 PolarHBondContact O-N 3.29Å
573	I	65.4	Low	58	Low	120 Å²	120	100.4 Å²	100.4	62%	0.615	60%	0.604	S	S	*	*	H	α-helix	trans	-71.8	-37.7	178	-64.2	172	0	0	0	111.2	A569 I576 A577	A569-I573 WeakPolarHBondContact O-CG1 3.34Å; A569-I573 PolarHBondContact O-N 2.87Å; I573-I576 PolarHBondContact O-N 3.15Å; I573-A577 PolarHBondContact O-N 3.46Å; I573-A577 VanDerWaalsContact O-N 3.17Å
574	A	64.3	Low	58.3	Low	41 Å²	41	103.6 Å²	103.6	34%	0.339	60%	0.603	S	S	.	*	H	α-helix	trans	-66.2	-38.6	174.9	0	0	0	0	0	112.5	F570 A577 I578	F570-A574 WeakPolarHBondContact O-CB 3.45Å; F570-A574 PolarHBondContact O-N 3.24Å; A574-A577 PolarHBondContact O-N 2.95Å; A574-I578 VanDerWaalsContact O-CG1 3.26Å; A574-I578 WeakPolarHBondContact O-CG1 3.41Å; A574-I578 PolarHBondContact O-N 3.11Å
575	A	66.6	Low	58.4	Low	48 Å²	48	103 Å²	103	40%	0.397	59%	0.593	S	S	.	*	H	α-helix	trans	-65.5	-38	177	0	0	0	0	0	112.7	L571 V572 I578 L579	L571-A575 WeakPolarHBondContact O-CB 3.19Å; L571-A575 PolarHBondContact O-N 2.92Å; L571-A575 VanDerWaalsContact O-N 3.11Å; V572-A575 PolarHBondContact O-N 3.41Å; A575-I578 PolarHBondContact O-N 3.36Å; A575-L579 WeakPolarHBondContact O-CB 3.38Å; A575-L579 WeakPolarHBondContact O-CG 3.37Å; A575-L579 PolarHBondContact O-N 3.42Å
576	I	69.9	Low	57.8	Low	111 Å²	111	103.6 Å²	103.6	57%	0.569	59%	0.588	S	S	*	*	H	α-helix	trans	-69	-38.4	177.4	-66.4	167.2	0	0	0	111.1	V572 I573 A580	V572-I576 HydrophobicContact CG1-CD1 4.12Å; V572-I576 WeakPolarHBondContact O-CD1 3.47Å; V572-I576 VanDerWaalsContact O-CG1 3.31Å; V572-I576 WeakPolarHBondContact O-CG1 3.47Å; V572-I576 PolarHBondContact O-N 3.29Å; I573-I576 PolarHBondContact O-N 3.15Å; I576-A580 WeakPolarHBondContact O-CB 3.43Å; I576-A580 PolarHBondContact O-N 2.92Å
577	A	64.7	Low	57.3	Low	52 Å²	52	111.1 Å²	111.1	43%	0.43	60%	0.596	S	S	.	*	H	α-helix	trans	-67.7	-40	175.7	0	0	0	0	0	112.6	I573 A574 A580 I581	I573-A577 PolarHBondContact O-N 3.46Å; I573-A577 VanDerWaalsContact O-N 3.17Å; A574-A577 PolarHBondContact O-N 2.95Å; A577-A580 PolarHBondContact O-N 2.89Å; A577-I581 WeakPolarHBondContact O-CG1 3.38Å; A577-I581 PolarHBondContact O-N 3.43Å; A577-I581 VanDerWaalsContact O-N 3.1Å
578	I	68.5	Low	56.7	Low	100 Å²	100	120.6 Å²	120.6	51%	0.513	62%	0.616	S	S	.	*	H	α-helix	trans	-68	-39.8	176.9	-68.5	168	0	0	0	110.8	A574 A575 I581 I582	A574-I578 VanDerWaalsContact O-CG1 3.26Å; A574-I578 WeakPolarHBondContact O-CG1 3.41Å; A574-I578 PolarHBondContact O-N 3.11Å; A575-I578 PolarHBondContact O-N 3.36Å; I578-I581 PolarHBondContact O-N 3.46Å; I578-I582 HydrophobicContact CG2-CD1 3.73Å; I578-I582 HydrophobicContact CG2-CG1 4.44Å; I578-I582 VanDerWaalsContact O-CG1 3.29Å; I578-I582 WeakPolarHBondContact O-CG1 3.46Å; I578-I582 PolarHBondContact O-N 3.32Å
579	L	63.7	Low	55.9	Low	96 Å²	96	122.5 Å²	122.5	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-64.5	-39.4	173.8	-83.7	160.7	0	0	0	112.1	A575 I581 I582 F583	A575-L579 WeakPolarHBondContact O-CB 3.38Å; A575-L579 WeakPolarHBondContact O-CG 3.37Å; A575-L579 PolarHBondContact O-N 3.42Å; L579-I581 VanDerWaalsContact C-N 3.32Å; L579-I581 PolarHBondContact O-N 3.37Å; L579-I582 PolarHBondContact O-N 2.61Å; L579-F583 HydrophobicContact CD2-CD2 4.44Å; L579-F583 HydrophobicContact CD2-CE2 4.18Å; L579-F583 WeakPolarHBondContact O-CB 3.14Å; L579-F583 WeakPolarHBondContact O-CD2 3.4Å; L579-F583 PolarHBondContact O-N 3.35Å
580	A	60.4	Low	54.9	Low	63 Å²	63	125.2 Å²	125.2	52%	0.521	63%	0.631	S	S	.	*	H	α-helix	trans	-64.4	-34.2	175.5	0	0	0	0	0	112.8	I576 A577 K584	I576-A580 WeakPolarHBondContact O-CB 3.43Å; I576-A580 PolarHBondContact O-N 2.92Å; A577-A580 PolarHBondContact O-N 2.89Å; A580-K584 PolarHBondContact O-N 2.9Å
581	I	63.5	Low	54.2	Low	120 Å²	120	123.4 Å²	123.4	62%	0.615	64%	0.636	S	S	*	*	H	α-helix	trans	-74.4	-40.8	176.8	-67.1	167.5	0	0	0	111.2	A577 I578 L579 K584 S585	A577-I581 WeakPolarHBondContact O-CG1 3.38Å; A577-I581 PolarHBondContact O-N 3.43Å; A577-I581 VanDerWaalsContact O-N 3.1Å; I578-I581 PolarHBondContact O-N 3.46Å; L579-I581 VanDerWaalsContact C-N 3.32Å; L579-I581 PolarHBondContact O-N 3.37Å; I581-K584 PolarHBondContact O-N 3.09Å; I581-S585 PolarHBondContact O-N 2.89Å
582	I	60.8	Low	53.1	Low	93 Å²	93	127.7 Å²	127.7	48%	0.477	65%	0.646	S	S	.	*	H	α-helix	trans	-69	-34.9	178.4	-66.4	169.7	0	0	0	111.6	I578 L579 K584 S585	I578-I582 HydrophobicContact CG2-CD1 3.73Å; I578-I582 HydrophobicContact CG2-CG1 4.44Å; I578-I582 VanDerWaalsContact O-CG1 3.29Å; I578-I582 WeakPolarHBondContact O-CG1 3.46Å; I578-I582 PolarHBondContact O-N 3.32Å; L579-I582 PolarHBondContact O-N 2.61Å; I582-K584 VanDerWaalsContact C-N 3.34Å; I582-S585 PolarHBondContact O-N 2.9Å; I582-S585 PolarHBondContact O-OG 3.38Å
583	F	50.3	Low	52	Low	167 Å²	167	128.1 Å²	128.1	73%	0.732	65%	0.649	S	S	*	*	H	α-helix	trans	-75.1	-21.5	174	-88.7	-81	0	0	0	113.4	L579	L579-F583 HydrophobicContact CD2-CD2 4.44Å; L579-F583 HydrophobicContact CD2-CE2 4.18Å; L579-F583 WeakPolarHBondContact O-CB 3.14Å; L579-F583 WeakPolarHBondContact O-CD2 3.4Å; L579-F583 PolarHBondContact O-N 3.35Å
584	K	45.8	Very low	50.9	Low	183 Å²	183	128 Å²	128	80%	0.796	65%	0.649	S	S	*	*	H	α-helix	trans	-79.8	-26.9	170.2	-131.3	-178.9	178.2	-175.7	0	112.6	A580 I581 I582 K586	A580-K584 PolarHBondContact O-N 2.9Å; I581-K584 PolarHBondContact O-N 3.09Å; I582-K584 VanDerWaalsContact C-N 3.34Å; K584-K586 VanDerWaalsContact C-N 3.32Å; K584-K586 PolarHBondContact O-N 3.03Å
585	S	44.1	Very low	49.7	Very low	92 Å²	92	136.9 Å²	136.9	64%	0.643	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	5.9	-178.4	91.1	0	0	0	0	114.8	I581 I582	I581-S585 PolarHBondContact O-N 2.89Å; I582-S585 PolarHBondContact O-N 2.9Å; I582-S585 PolarHBondContact O-OG 3.38Å
586	K	39.1	Very low	48.7	Very low	189 Å²	189	140 Å²	140	82%	0.822	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	23.2	178.5	-129.8	-179.8	-174.2	179.5	0	113.9	K584	K584-K586 VanDerWaalsContact C-N 3.32Å; K584-K586 PolarHBondContact O-N 3.03Å
587	R	37.4	Very low	47.4	Very low	223 Å²	223	140.5 Å²	140.5	84%	0.842	68%	0.683	S	S	*	*	S	Bend	trans	-89	105.4	161.7	-145.8	176.5	-171.5	179.4	0.8	107.4	E589	R587-E589 PolarHBondContact O-N 3.23Å; R587-E589 VanDerWaalsContact O-N 3.11Å
588	R	35.8	Very low	46.3	Very low	250 Å²	250	144.3 Å²	144.3	94%	0.943	69%	0.692	S	S	*	*			trans	-62.9	105.9	175.1	-104.7	175.6	165.1	176.9	-5.2	108.9
589	E	35.5	Very low	45.1	Very low	182 Å²	182	149.1 Å²	149.1	85%	0.85	71%	0.705	S	S	*	*			trans	-87.2	135.5	164.3	-74.4	176.1	168.4	0	0	109.2	R587	R587-E589 PolarHBondContact O-N 3.23Å; R587-E589 VanDerWaalsContact O-N 3.11Å
590	T	34.6	Very low	44.3	Very low	121 Å²	121	149.7 Å²	149.7	74%	0.742	71%	0.708	S	S	*	*			trans	-92.7	131.4	177.7	42.3	0	0	0	0	110.4	Y592	T590-Y592 PolarHBondContact O-N 3.42Å
591	P	41.4	Very low	43.3	Very low	132 Å²	132	150.4 Å²	150.4	86%	0.857	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	95.4	-174.7	33.2	-30.5	0	0	0	111.3
592	Y	36.7	Very low	42.2	Very low	213 Å²	213	148.8 Å²	148.8	84%	0.835	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.7	-14.5	163.9	-163.8	-106.8	0	0	0	114.2	T590 D594	T590-Y592 PolarHBondContact O-N 3.42Å; Y592-D594 PolarHBondContact O-N 2.9Å
593	T	44.2	Very low	41.1	Very low	95 Å²	95	155.8 Å²	155.8	58%	0.583	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	7.7	-170.4	52.7	0	0	0	0	115.8	Q597	T593-Q597 WeakPolarHBondContact O-CB 3.34Å
594	D	41.3	Very low	40.5	Very low	116 Å²	116	151 Å²	151	62%	0.62	73%	0.731	S	S	*	*	H	α-helix	trans	-83.9	-21.2	-169.5	-129.2	-2	0	0	0	114	Y592 Q598	Y592-D594 PolarHBondContact O-N 2.9Å; D594-Q598 WeakPolarHBondContact O-CG 3.11Å
595	R	39.1	Very low	40.3	Very low	228 Å²	228	148.6 Å²	148.6	86%	0.86	73%	0.727	S	S	*	*	H	α-helix	trans	-86.6	-24.5	-174.8	-79.4	-168.1	173	-177.3	-0.9	115.3
596	L	45.4	Very low	40.3	Very low	114 Å²	114	148.9 Å²	148.9	60%	0.597	74%	0.744	S	S	*	*	H	α-helix	trans	-91.3	-34.3	176.4	-163.4	65.1	0	0	0	111.7	Q598 Y599 I600	L596-Q598 VanDerWaalsContact C-N 3.29Å; L596-Q598 PolarHBondContact O-N 3.44Å; L596-Y599 PolarHBondContact O-N 2.96Å; L596-I600 PolarHBondContact O-N 3.48Å
597	Q	42.5	Very low	40.7	Very low	121 Å²	121	143 Å²	143	57%	0.565	72%	0.724	S	S	*	*	H	α-helix	trans	-64.6	-32.4	177.4	-155.3	75.9	-0.5	0	0	112.5	T593 Y599 S601	T593-Q597 WeakPolarHBondContact O-CB 3.34Å; Q597-Y599 VanDerWaalsContact C-N 3.34Å; Q597-Y599 PolarHBondContact O-N 3.39Å; Q597-S601 VanDerWaalsContact O-CB 3.27Å; Q597-S601 WeakPolarHBondContact O-CB 3.43Å; Q597-S601 PolarHBondContact O-N 2.91Å; Q597-S601 PolarHBondContact O-OG 3.04Å
598	Q	43.1	Very low	41.7	Very low	132 Å²	132	138.4 Å²	138.4	62%	0.617	71%	0.71	S	S	*	*	H	α-helix	trans	-69.9	-25.1	176.4	-83.3	-179.1	-11.2	0	0	113.7	D594 L596	D594-Q598 WeakPolarHBondContact O-CG 3.11Å; L596-Q598 VanDerWaalsContact C-N 3.29Å; L596-Q598 PolarHBondContact O-N 3.44Å
599	Y	42.3	Very low	43.6	Very low	202 Å²	202	131.8 Å²	131.8	79%	0.792	69%	0.686	S	S	*	*	H	α-helix	trans	-80.5	-34.3	177.6	-122.9	-90.2	0	0	0	112.4	L596 Q597	L596-Y599 PolarHBondContact O-N 2.96Å; Q597-Y599 VanDerWaalsContact C-N 3.34Å; Q597-Y599 PolarHBondContact O-N 3.39Å
600	I	46.6	Very low	45.7	Very low	107 Å²	107	125 Å²	125	55%	0.549	65%	0.652	S	S	.	*	H	α-helix	trans	-83.7	-33.1	-178.2	-60.3	173.7	0	0	0	111.4	L596 A602	L596-I600 PolarHBondContact O-N 3.48Å; I600-A602 PolarHBondContact O-N 3.46Å
601	S	40.2	Very low	47.9	Very low	78 Å²	78	122 Å²	122	55%	0.545	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-71.1	-13.4	178.3	-56	0	0	0	0	113.9	Q597 R603 G604	Q597-S601 VanDerWaalsContact O-CB 3.27Å; Q597-S601 WeakPolarHBondContact O-CB 3.43Å; Q597-S601 PolarHBondContact O-N 2.91Å; Q597-S601 PolarHBondContact O-OG 3.04Å; S601-R603 PolarHBondContact O-N 2.76Å; S601-G604 PolarHBondContact O-N 3.3Å
602	A	39.8	Very low	49.6	Very low	86 Å²	86	117.9 Å²	117.9	71%	0.711	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-70.4	-5.6	-179.8	0	0	0	0	0	114.4	I600	I600-A602 PolarHBondContact O-N 3.46Å
603	R	38.2	Very low	51.4	Low	240 Å²	240	108.1 Å²	108.1	91%	0.906	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-105.6	10.3	174.7	-79.8	-170	175.6	179.5	0.6	115.8	S601	S601-R603 PolarHBondContact O-N 2.76Å
604	G	37.3	Very low	52.5	Low	66 Å²	66	107.8 Å²	107.8	68%	0.68	57%	0.566	S	S	*	*	S	Bend	trans	74.7	38.7	149.9	0	0	0	0	0	118.5	S601	S601-G604 PolarHBondContact O-N 3.3Å
605	L	42.8	Very low	54	Low	134 Å²	134	107 Å²	107	70%	0.702	57%	0.566	S	S	*	*			trans	-145.5	111.8	161.6	-88.9	153.5	0	0	0	106.6	V607	L605-V607 HydrophobicContact CB-CG2 4.24Å; L605-V607 PolarHBondContact O-N 2.92Å
606	G	42.7	Very low	55.5	Low	97 Å²	97	98 Å²	98	100%	1	53%	0.532	S	S	*	.			trans	-69.3	47.9	-178	0	0	0	0	0	114.5
607	V	48.1	Very low	56.5	Low	67 Å²	67	102.1 Å²	102.1	41%	0.406	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-95.6	124.6	179.8	-176.9	0	0	0	0	108.3	L605 Y609	L605-V607 HydrophobicContact CB-CG2 4.24Å; L605-V607 PolarHBondContact O-N 2.92Å; V607-Y609 HydrophobicContact CB-CE2 4.04Å; V607-Y609 HydrophobicContact CG1-CE1 4.22Å; V607-Y609 HydrophobicContact CG1-CE2 4.39Å; V607-Y609 VanDerWaalsContact O-CD2 3.23Å; V607-Y609 WeakPolarHBondContact O-CD2 3.49Å; V607-Y609 WeakPolarHBondContact O-CE2 3.4Å; V607-Y609 PolarHBondContact O-N 3.5Å
608	K	59.2	Low	57.9	Low	126 Å²	126	99.2 Å²	99.2	55%	0.548	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-71.2	121.3	172.5	-164.9	-173.1	-177.7	-165.8	0	107.4	Q690 M754	K608-Q690 PolarHBondContact NZ-O 3.26Å; K608-M754 HydrophobicContact CB-CE 4.36Å; K608-M754 HydrophobicContact CB-SD 4.09Å; K608-M754 HydrophobicContact CD-CE 3.99Å; K608-M754 HydrophobicContact CD-SD 4.35Å; K608-M754 HydrophobicContact CG-CE 3.98Å; K608-M754 HydrophobicContact CG-SD 4.33Å
609	Y	74	Confident	59.2	Low	111 Å²	111	94 Å²	94	44%	0.435	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-102.4	146.8	176	-67.7	-78	0	0	0	110	V607 N755	V607-Y609 HydrophobicContact CB-CE2 4.04Å; V607-Y609 HydrophobicContact CG1-CE1 4.22Å; V607-Y609 HydrophobicContact CG1-CE2 4.39Å; V607-Y609 VanDerWaalsContact O-CD2 3.23Å; V607-Y609 WeakPolarHBondContact O-CD2 3.49Å; V607-Y609 WeakPolarHBondContact O-CE2 3.4Å; V607-Y609 PolarHBondContact O-N 3.5Å; Y609-N755 WeakPolarHBondContact CD1-ND2 3.46Å; Y609-N755 WeakPolarHBondContact CE1-ND2 3.25Å
610	Y	80.4	Confident	60.8	Low	38 Å²	38	86.1 Å²	86.1	15%	0.149	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-63.2	133.6	166.1	167.8	-100.7	0	0	0	109.9	D612 P613 I687 F691 M754 Y756	Y610-D612 HydrophobicContact CE1-CB 3.97Å; Y610-P613 VanDerWaalsContact OH-CD 3.24Å; Y610-P613 WeakPolarHBondContact OH-CD 3.45Å; Y610-I687 HydrophobicContact CE2-CG1 4.23Å; Y610-I687 HydrophobicContact CE2-CG2 4.17Å; Y610-F691 HydrophobicContact CD2-CE1 4.03Å; Y610-F691 AromaticContact CD2-CZ 3.79Å; Y610-F691 HydrophobicContact CD2-CZ 3.79Å; Y610-F691 HydrophobicContact CE2-CZ 4.23Å; Y610-M754 VanDerWaalsContact CB-O 3.24Å; Y610-M754 WeakPolarHBondContact CB-O 3.39Å; Y610-M754 PolarHBondContact N-O 3.34Å; Y610-Y756 AromaticContact CD1-CD2 3.88Å; Y610-Y756 HydrophobicContact CD1-CD2 3.88Å; Y610-Y756 AromaticContact CD2-CD2 3.67Å; Y610-Y756 HydrophobicContact CD2-CD2 3.67Å; Y610-Y756 HydrophobicContact CD2-CE2 4.27Å; Y610-Y756 AromaticContact CE1-CD2 3.83Å; Y610-Y756 HydrophobicContact CE1-CD2 3.83Å; Y610-Y756 HydrophobicContact CE1-CE2 4.18Å; Y610-Y756 AromaticContact CE2-CD2 3.6Å; Y610-Y756 HydrophobicContact CE2-CD2 3.6Å; Y610-Y756 AromaticContact CE2-CE2 3.73Å; Y610-Y756 HydrophobicContact CE2-CE2 3.73Å; Y610-Y756 AromaticContact CG-CD2 3.8Å; Y610-Y756 HydrophobicContact CG-CD2 3.8Å; Y610-Y756 AromaticContact CZ-CD2 3.68Å; Y610-Y756 AromaticContact CZ-CE2 3.68Å
611	I	81.4	Confident	62.4	Low	60 Å²	60	85.2 Å²	85.2	31%	0.308	48%	0.48	S	S	.	.			trans	-109.7	123.9	173.6	-59	173.5	0	0	0	106.8	P613 Y616 F626 Q690	I611-P613 VanDerWaalsContact O-CD 3.28Å; I611-P613 WeakPolarHBondContact O-CD 3.39Å; I611-Y616 HydrophobicContact CG2-CE2 4.1Å; I611-F626 HydrophobicContact CB-CZ 4.08Å; I611-F626 HydrophobicContact CD1-CE1 4.49Å; I611-F626 HydrophobicContact CD1-CZ 4.21Å; I611-F626 HydrophobicContact CG2-CZ 4.28Å; I611-Q690 PolarHBondContact O-NE2 3.36Å; I611-Q690 PolarHBondContact O-OE1 3.3Å
612	D	75.9	Confident	64.4	Low	44 Å²	44	81.5 Å²	81.5	24%	0.235	45%	0.454	C	S	.	.			trans	-68.3	120.3	178.7	-162.9	-38.7	0	0	0	110.2	Y610 S614 T615	Y610-D612 HydrophobicContact CE1-CB 3.97Å; D612-S614 PolarHBondContact O-N 2.88Å; D612-S614 WeakPolarHBondContact OD1-CB 3.49Å; D612-S614 PolarHBondContact OD1-N 3.1Å; D612-S614 PolarHBondContact OD1-OG 2.9Å; D612-S614 VanDerWaalsContact OD1-OG 3.07Å; D612-T615 HydrophobicContact CB-CG2 4.34Å; D612-T615 PolarHBondContact O-N 3.15Å; D612-T615 PolarHBondContact O-OG1 3.26Å
613	P	74.5	Confident	66.5	Low	8 Å²	8	77.6 Å²	77.6	5%	0.052	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-58.1	-19.6	176.8	-26.1	37.2	0	0	0	113.8	Y610 I611 T615 Y616 A622 I687	Y610-P613 VanDerWaalsContact OH-CD 3.24Å; Y610-P613 WeakPolarHBondContact OH-CD 3.45Å; I611-P613 VanDerWaalsContact O-CD 3.28Å; I611-P613 WeakPolarHBondContact O-CD 3.39Å; P613-T615 PolarHBondContact O-N 2.76Å; P613-Y616 PolarHBondContact O-N 2.83Å; P613-A622 HydrophobicContact CB-CB 4.04Å; P613-I687 HydrophobicContact CG-CG1 3.92Å
614	S	67.8	Low	68.7	Low	88 Å²	88	74.3 Å²	74.3	62%	0.615	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-68	-12.4	174.8	79.6	0	0	0	0	113.7	D612 Y616	D612-S614 PolarHBondContact O-N 2.88Å; D612-S614 WeakPolarHBondContact OD1-CB 3.49Å; D612-S614 PolarHBondContact OD1-N 3.1Å; D612-S614 PolarHBondContact OD1-OG 2.9Å; D612-S614 VanDerWaalsContact OD1-OG 3.07Å; S614-Y616 PolarHBondContact O-N 2.59Å
615	T	73.9	Confident	70.8	Confident	100 Å²	100	75.4 Å²	75.4	61%	0.613	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-73.5	-10.2	172.9	63.5	0	0	0	0	112.9	D612 P613	D612-T615 HydrophobicContact CB-CG2 4.34Å; D612-T615 PolarHBondContact O-N 3.15Å; D612-T615 PolarHBondContact O-OG1 3.26Å; P613-T615 PolarHBondContact O-N 2.76Å
616	Y	69	Low	73	Confident	38 Å²	38	70.7 Å²	70.7	15%	0.149	37%	0.37	C	S	.	.	S	Bend	trans	-94.1	132.9	175.8	-64	-103.3	0	0	0	109.6	I611 P613 S614 D618 E621 A622 E625 F626	I611-Y616 HydrophobicContact CG2-CE2 4.1Å; P613-Y616 PolarHBondContact O-N 2.83Å; S614-Y616 PolarHBondContact O-N 2.59Å; Y616-D618 VanDerWaalsContact C-N 3.32Å; Y616-E621 HydrophobicContact CD1-CB 4.06Å; Y616-E621 HydrophobicContact CD1-CG 3.9Å; Y616-E621 HydrophobicContact CE1-CG 4.29Å; Y616-A622 HydrophobicContact CD1-CB 4.36Å; Y616-A622 HydrophobicContact CD2-CB 3.85Å; Y616-A622 HydrophobicContact CE2-CB 4.35Å; Y616-A622 HydrophobicContact CG-CB 3.88Å; Y616-E625 VanDerWaalsContact CE1-OE2 3.27Å; Y616-E625 WeakPolarHBondContact CE1-OE2 3.45Å; Y616-E625 VanDerWaalsContact CZ-OE2 3.25Å; Y616-E625 PolarHBondContact OH-OE1 3.21Å; Y616-E625 PolarHBondContact OH-OE2 3.17Å; Y616-F626 AromaticContact CE2-CE2 3.84Å; Y616-F626 HydrophobicContact CE2-CE2 3.84Å; Y616-F626 HydrophobicContact CE2-CZ 4.21Å; Y616-F626 WeakPolarHBondContact OH-CZ 3.18Å
617	E	66.3	Low	75.2	Confident	201 Å²	201	66.8 Å²	66.8	94%	0.939	33%	0.328	S	S	*	.	S	Bend	trans	-68.4	-33.1	176.1	-67.1	-177	173.9	0	0	111.9
618	D	72.3	Confident	77.3	Confident	60 Å²	60	69.8 Å²	69.8	32%	0.321	34%	0.336	S	S	.	.	S	Bend	trans	-113.9	114.8	175	177.9	15.1	0	0	0	111	Y616 N620 E621 R624	Y616-D618 VanDerWaalsContact C-N 3.32Å; D618-N620 PolarHBondContact O-N 3.05Å; D618-N620 VanDerWaalsContact O-N 3.14Å; D618-N620 WeakPolarHBondContact OD1-CB 3.48Å; D618-N620 PolarHBondContact OD1-N 3.14Å; D618-N620 PolarHBondContact OD1-ND2 3.4Å; D618-E621 HydrophobicContact CB-CB 4.46Å; D618-E621 WeakPolarHBondContact O-CA 3.35Å; D618-E621 WeakPolarHBondContact O-CB 3.35Å; D618-E621 PolarHBondContact O-N 2.86Å; D618-R624 IonicContact OD2-NH2 3.26Å
619	P	70.4	Confident	78.9	Confident	23 Å²	23	66.6 Å²	66.6	15%	0.149	32%	0.322	C	S	.	.	H	α-helix	trans	-63.9	-18.3	177.4	12.5	-17.9	0	0	0	114.2	E621 A622 I623 R679	P619-E621 PolarHBondContact O-N 2.86Å; P619-A622 PolarHBondContact O-N 3.26Å; P619-I623 WeakPolarHBondContact O-CG1 3.49Å; P619-I623 PolarHBondContact O-N 3.34Å; P619-R679 HydrophobicContact CG-CB 3.94Å; P619-R679 HydrophobicContact CG-CG 3.43Å; P619-R679 VanDerWaalsContact CG-CG 3.43Å
620	N	76.4	Confident	79.9	Confident	37 Å²	37	61.6 Å²	61.6	20%	0.198	30%	0.303	C	S	.	.	H	α-helix	trans	-68.4	-23.4	170.3	-57.5	-79	0	0	0	111.8	D618 R624 R678	D618-N620 PolarHBondContact O-N 3.05Å; D618-N620 VanDerWaalsContact O-N 3.14Å; D618-N620 WeakPolarHBondContact OD1-CB 3.48Å; D618-N620 PolarHBondContact OD1-N 3.14Å; D618-N620 PolarHBondContact OD1-ND2 3.4Å; N620-R624 WeakPolarHBondContact O-CB 3.47Å; N620-R624 VanDerWaalsContact O-CG 3.25Å; N620-R624 WeakPolarHBondContact O-CG 3.35Å; N620-R624 PolarHBondContact O-N 3.38Å; N620-R624 VanDerWaalsContact O-N 3.11Å; N620-R624 PolarHBondContact O-NE 3.38Å; N620-R678 PolarHBondContact OD1-NH2 3.4Å
621	E	80.9	Confident	80.4	Confident	88 Å²	88	64.2 Å²	64.2	41%	0.411	32%	0.32	S	S	.	.	H	α-helix	trans	-72.2	-48.5	173.3	-165.8	172.6	-167.9	0	0	111.3	Y616 D618 P619 I623 R624 E625	Y616-E621 HydrophobicContact CD1-CB 4.06Å; Y616-E621 HydrophobicContact CD1-CG 3.9Å; Y616-E621 HydrophobicContact CE1-CG 4.29Å; D618-E621 HydrophobicContact CB-CB 4.46Å; D618-E621 WeakPolarHBondContact O-CA 3.35Å; D618-E621 WeakPolarHBondContact O-CB 3.35Å; D618-E621 PolarHBondContact O-N 2.86Å; P619-E621 PolarHBondContact O-N 2.86Å; E621-I623 VanDerWaalsContact C-N 3.29Å; E621-I623 PolarHBondContact O-N 2.95Å; E621-R624 PolarHBondContact O-N 2.8Å; E621-R624 VanDerWaalsContact O-N 3.08Å; E621-E625 PolarHBondContact O-N 3.48Å
622	A	80.2	Confident	80.9	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-40.1	174	0	0	0	0	0	112.2	P613 Y616 P619 E625 F626	P613-A622 HydrophobicContact CB-CB 4.04Å; Y616-A622 HydrophobicContact CD1-CB 4.36Å; Y616-A622 HydrophobicContact CD2-CB 3.85Å; Y616-A622 HydrophobicContact CE2-CB 4.35Å; Y616-A622 HydrophobicContact CG-CB 3.88Å; P619-A622 PolarHBondContact O-N 3.26Å; A622-E625 PolarHBondContact O-N 2.89Å; A622-F626 HydrophobicContact CB-CD2 4.36Å; A622-F626 HydrophobicContact CB-CE2 4.46Å; A622-F626 WeakPolarHBondContact O-CD2 3.41Å; A622-F626 PolarHBondContact O-N 3.42Å
623	I	84.7	Confident	81.6	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-43.8	173.6	-79.5	-69.1	0	0	0	112.1	P619 E621 E625 F626 A627 L682 A685 S686 V702 T704	P619-I623 WeakPolarHBondContact O-CG1 3.49Å; P619-I623 PolarHBondContact O-N 3.34Å; E621-I623 VanDerWaalsContact C-N 3.29Å; E621-I623 PolarHBondContact O-N 2.95Å; I623-E625 PolarHBondContact O-N 3.14Å; I623-F626 PolarHBondContact O-N 2.91Å; I623-A627 HydrophobicContact CD1-CB 4.09Å; I623-A627 HydrophobicContact CG2-CB 4.41Å; I623-A627 CarbonylContact O-C 3.58Å; I623-A627 WeakPolarHBondContact O-CA 3.48Å; I623-A627 WeakPolarHBondContact O-CB 3.35Å; I623-A627 PolarHBondContact O-N 2.9Å; I623-A627 VanDerWaalsContact O-O 3.08Å; I623-L682 HydrophobicContact CD1-CB 4.2Å; I623-L682 HydrophobicContact CD1-CD2 4.22Å; I623-L682 VanDerWaalsContact CD1-O 3.26Å; I623-L682 WeakPolarHBondContact CD1-O 3.41Å; I623-L682 HydrophobicContact CG1-CB 3.83Å; I623-L682 HydrophobicContact CG1-CD1 4.49Å; I623-L682 HydrophobicContact CG1-CD2 4.13Å; I623-L682 HydrophobicContact CG1-CG 4.36Å; I623-A685 HydrophobicContact CD1-CB 3.75Å; I623-S686 WeakPolarHBondContact CD1-OG 3.31Å; I623-S686 WeakPolarHBondContact CG1-OG 3.42Å; I623-S686 PolarHBondContact N-OG 3.29Å; I623-V702 HydrophobicContact CD1-CG1 4.27Å; I623-V702 HydrophobicContact CG2-CG2 3.83Å; I623-T704 HydrophobicContact CG2-CG2 4.2Å
624	R	83.9	Confident	82.4	Confident	170 Å²	170	69.3 Å²	69.3	64%	0.642	36%	0.357	S	S	*	.	H	α-helix	trans	-63.6	-29.6	178.8	-79.3	-178.3	-65.6	-111.2	1.1	112.3	D618 N620 E621	D618-R624 IonicContact OD2-NH2 3.26Å; N620-R624 WeakPolarHBondContact O-CB 3.47Å; N620-R624 VanDerWaalsContact O-CG 3.25Å; N620-R624 WeakPolarHBondContact O-CG 3.35Å; N620-R624 PolarHBondContact O-N 3.38Å; N620-R624 VanDerWaalsContact O-N 3.11Å; N620-R624 PolarHBondContact O-NE 3.38Å; E621-R624 PolarHBondContact O-N 2.8Å; E621-R624 VanDerWaalsContact O-N 3.08Å
625	E	83.1	Confident	83.7	Confident	90 Å²	90	66 Å²	66	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-81.3	-44.3	179	-168.9	170.4	163.5	0	0	112.7	Y616 E621 A622 I623	Y616-E625 VanDerWaalsContact CE1-OE2 3.27Å; Y616-E625 WeakPolarHBondContact CE1-OE2 3.45Å; Y616-E625 VanDerWaalsContact CZ-OE2 3.25Å; Y616-E625 PolarHBondContact OH-OE1 3.21Å; Y616-E625 PolarHBondContact OH-OE2 3.17Å; E621-E625 PolarHBondContact O-N 3.48Å; A622-E625 PolarHBondContact O-N 2.89Å; I623-E625 PolarHBondContact O-N 3.14Å
626	F	87	Confident	84.6	Confident	35 Å²	35	66.9 Å²	66.9	15%	0.154	33%	0.328	C	S	.	.	H	α-helix	trans	-104.5	-17	-169.5	-55.3	-51	0	0	0	114.9	I611 Y616 A622 I623 G689 Q690	I611-F626 HydrophobicContact CB-CZ 4.08Å; I611-F626 HydrophobicContact CD1-CE1 4.49Å; I611-F626 HydrophobicContact CD1-CZ 4.21Å; I611-F626 HydrophobicContact CG2-CZ 4.28Å; Y616-F626 AromaticContact CE2-CE2 3.84Å; Y616-F626 HydrophobicContact CE2-CE2 3.84Å; Y616-F626 HydrophobicContact CE2-CZ 4.21Å; Y616-F626 WeakPolarHBondContact OH-CZ 3.18Å; A622-F626 HydrophobicContact CB-CD2 4.36Å; A622-F626 HydrophobicContact CB-CE2 4.46Å; A622-F626 WeakPolarHBondContact O-CD2 3.41Å; A622-F626 PolarHBondContact O-N 3.42Å; I623-F626 PolarHBondContact O-N 2.91Å; F626-G689 CarbonylContact O-C 3.56Å; F626-G689 WeakPolarHBondContact O-CA 2.97Å; F626-Q690 HydrophobicContact CB-CG 3.98Å; F626-Q690 HydrophobicContact CD1-CG 3.59Å; F626-Q690 HydrophobicContact CD2-CG 4.14Å; F626-Q690 HydrophobicContact CE1-CG 4.1Å; F626-Q690 HydrophobicContact CG-CG 3.62Å
627	A	90.4	Very high	85.7	Confident	15 Å²	15	69 Å²	69	12%	0.124	34%	0.34	C	S	.	.	S	Bend	trans	-122.2	148.2	-177.4	0	0	0	0	0	112.6	I623 L699 V702	I623-A627 HydrophobicContact CD1-CB 4.09Å; I623-A627 HydrophobicContact CG2-CB 4.41Å; I623-A627 CarbonylContact O-C 3.58Å; I623-A627 WeakPolarHBondContact O-CA 3.48Å; I623-A627 WeakPolarHBondContact O-CB 3.35Å; I623-A627 PolarHBondContact O-N 2.9Å; I623-A627 VanDerWaalsContact O-O 3.08Å; A627-L699 HydrophobicContact CB-CD2 3.8Å; A627-V702 HydrophobicContact CB-CG1 4.07Å; A627-V702 HydrophobicContact CB-CG2 3.98Å
628	K	91.9	Very high	86.8	Confident	130 Å²	130	62.9 Å²	62.9	57%	0.565	31%	0.312	S	S	*	.			trans	-88.5	124.4	176.9	-179.7	-174.6	169	-161.4	0	110.5	I630 G701 V702	K628-I630 PolarHBondContact O-N 2.92Å; K628-G701 CarbonylContact O-C 3.52Å; K628-G701 WeakPolarHBondContact O-CA 3.39Å; K628-V702 PolarHBondContact O-N 2.95Å
629	E	93.2	Very high	87.7	Confident	58 Å²	58	65.4 Å²	65.4	27%	0.271	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-70.4	128.8	170.6	-172.1	71.9	-171.5	0	0	110.7	V702 T704 K705	E629-V702 CarbonylContact C-O 3.45Å; E629-V702 WeakPolarHBondContact CA-O 3.39Å; E629-T704 PolarHBondContact OE1-N 3.2Å; E629-T704 PolarHBondContact OE1-OG1 2.99Å; E629-T704 PolarHBondContact OE2-N 3.34Å; E629-T704 PolarHBondContact OE2-OG1 3.28Å; E629-K705 HydrophobicContact CG-CD 4.02Å; E629-K705 HydrophobicContact CG-CG 4.45Å; E629-K705 WeakPolarHBondContact OE1-CB 3.47Å; E629-K705 WeakPolarHBondContact OE1-CG 3.31Å; E629-K705 PolarHBondContact OE1-N 3.49Å
630	I	93.4	Very high	88.5	Confident	7 Å²	7	68.2 Å²	68.2	4%	0.036	34%	0.339	C	S	.	.			trans	-107	135.5	176.2	-60.2	172.3	0	0	0	109.3	K628 L634 I635 L654 V702 V703 V712	K628-I630 PolarHBondContact O-N 2.92Å; I630-L634 HydrophobicContact CG2-CB 4.36Å; I630-L634 HydrophobicContact CG2-CD1 4.47Å; I630-I635 HydrophobicContact CB-CD1 4.21Å; I630-I635 HydrophobicContact CG2-CD1 3.59Å; I630-I635 HydrophobicContact CG2-CG1 3.88Å; I630-L654 HydrophobicContact CD1-CD1 4.3Å; I630-L654 HydrophobicContact CD1-CD2 4.07Å; I630-L654 HydrophobicContact CG2-CD1 3.8Å; I630-V702 PolarHBondContact N-O 3.32Å; I630-V703 HydrophobicContact CB-CG2 4.22Å; I630-V712 HydrophobicContact CD1-CB 4.1Å; I630-V712 HydrophobicContact CD1-CG1 4.5Å; I630-V712 HydrophobicContact CD1-CG2 4.17Å
631	D	91.7	Very high	88.9	Confident	93 Å²	93	70 Å²	70	50%	0.497	35%	0.347	S	S	.	.			trans	-73.3	130.3	171.5	-169.5	-68.1	0	0	0	110.1	S633 L634	D631-S633 PolarHBondContact O-N 3.15Å; D631-S633 VanDerWaalsContact O-N 3.12Å; D631-S633 VanDerWaalsContact OD1-CB 3.27Å; D631-S633 WeakPolarHBondContact OD1-CB 3.46Å; D631-S633 PolarHBondContact OD1-N 2.73Å; D631-S633 PolarHBondContact OD1-OG 3.3Å; D631-L634 HydrophobicContact CB-CD1 4.03Å; D631-L634 HydrophobicContact CB-CG 4.14Å; D631-L634 WeakPolarHBondContact O-CB 3.2Å; D631-L634 PolarHBondContact O-N 3.05Å
632	V	91.6	Very high	88.9	Confident	72 Å²	72	67.3 Å²	67.3	44%	0.436	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-57	-28.8	-176.9	66.2	0	0	0	0	113	L634 I635 V703 M710	V632-L634 PolarHBondContact O-N 3.4Å; V632-I635 PolarHBondContact O-N 3.15Å; V632-I635 VanDerWaalsContact O-N 3.17Å; V632-V703 HydrophobicContact CB-CG1 4.43Å; V632-M710 HydrophobicContact CG2-CE 3.98Å
633	S	90.8	Very high	88.6	Confident	96 Å²	96	72.2 Å²	72.2	67%	0.671	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-66.8	-16.1	177.5	65.6	0	0	0	0	114.1	D631	D631-S633 PolarHBondContact O-N 3.15Å; D631-S633 VanDerWaalsContact O-N 3.12Å; D631-S633 VanDerWaalsContact OD1-CB 3.27Å; D631-S633 WeakPolarHBondContact OD1-CB 3.46Å; D631-S633 PolarHBondContact OD1-N 2.73Å; D631-S633 PolarHBondContact OD1-OG 3.3Å
634	L	92.5	Very high	87.6	Confident	50 Å²	50	73.5 Å²	73.5	26%	0.262	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-89.2	-8.4	178.6	-54.3	174.9	0	0	0	112.7	I630 D631 V632 L654 K655 P657	I630-L634 HydrophobicContact CG2-CB 4.36Å; I630-L634 HydrophobicContact CG2-CD1 4.47Å; D631-L634 HydrophobicContact CB-CD1 4.03Å; D631-L634 HydrophobicContact CB-CG 4.14Å; D631-L634 WeakPolarHBondContact O-CB 3.2Å; D631-L634 PolarHBondContact O-N 3.05Å; V632-L634 PolarHBondContact O-N 3.4Å; L634-L654 HydrophobicContact CB-CD1 4.24Å; L634-K655 WeakPolarHBondContact CD2-O 3.27Å; L634-K655 PolarHBondContact O-N 3.33Å; L634-P657 HydrophobicContact CD1-CG 4.33Å; L634-P657 HydrophobicContact CD2-CG 4.44Å
635	I	93.4	Very high	86.7	Confident	20 Å²	20	73.1 Å²	73.1	10%	0.103	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.3	-176.9	-66.1	165.1	0	0	0	109.2	I630 V632 I637 R653 L654 I666 V703 V712	I630-I635 HydrophobicContact CB-CD1 4.21Å; I630-I635 HydrophobicContact CG2-CD1 3.59Å; I630-I635 HydrophobicContact CG2-CG1 3.88Å; V632-I635 PolarHBondContact O-N 3.15Å; V632-I635 VanDerWaalsContact O-N 3.17Å; I635-I637 HydrophobicContact CG2-CG1 4.35Å; I635-R653 WeakPolarHBondContact CA-O 3.46Å; I635-L654 HydrophobicContact CG1-CD1 3.68Å; I635-I666 HydrophobicContact CG2-CD1 3.48Å; I635-I666 VanDerWaalsContact CG2-CD1 3.48Å; I635-I666 HydrophobicContact CG2-CG1 4.44Å; I635-V703 HydrophobicContact CD1-CG2 3.49Å; I635-V703 VanDerWaalsContact CD1-CG2 3.49Å; I635-V712 HydrophobicContact CD1-CG2 3.78Å
636	K	92.6	Very high	85.9	Confident	118 Å²	118	69.8 Å²	69.8	51%	0.513	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.3	169.8	-174.4	-172.4	174.1	-146.2	0	108.8	E638 G652 R653	K636-E638 HydrophobicContact CD-CG 4.44Å; K636-E638 HydrophobicContact CG-CG 4.38Å; K636-E638 IonicContact NZ-OE1 2.68Å; K636-E638 PolarHBondContact NZ-OE1 2.89Å; K636-G652 CarbonylContact O-C 3.59Å; K636-G652 WeakPolarHBondContact O-CA 3.48Å; K636-R653 PolarHBondContact N-O 3.39Å; K636-R653 PolarHBondContact O-N 2.82Å
637	I	92.4	Very high	85.4	Confident	81 Å²	81	68.1 Å²	68.1	42%	0.415	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.6	172.6	-57.7	173.8	0	0	0	107.6	I635 C650 I666 M710	I635-I637 HydrophobicContact CG2-CG1 4.35Å; I637-C650 HydrophobicContact CG2-CB 3.61Å; I637-I666 HydrophobicContact CG1-CD1 3.85Å; I637-M710 HydrophobicContact CD1-SD 4.08Å
638	E	89.8	Confident	85.1	Confident	73 Å²	73	72 Å²	72	34%	0.341	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-58.6	-176.5	-60.7	-164.4	142.9	0	0	111.8	K636 F651 R653	K636-E638 HydrophobicContact CD-CG 4.44Å; K636-E638 HydrophobicContact CG-CG 4.38Å; K636-E638 IonicContact NZ-OE1 2.68Å; K636-E638 PolarHBondContact NZ-OE1 2.89Å; E638-F651 HydrophobicContact CB-CD1 4.08Å; E638-F651 HydrophobicContact CB-CE1 4.48Å; E638-F651 PolarHBondContact N-O 3.41Å; E638-F651 VanDerWaalsContact OE2-CE1 3.26Å; E638-F651 WeakPolarHBondContact OE2-CE1 3.27Å; E638-R653 IonicContact OE1-NE 2.62Å; E638-R653 PolarHBondContact OE1-NE 3.36Å; E638-R653 IonicContact OE2-NE 2.91Å; E638-R653 PolarHBondContact OE2-NE 2.76Å
639	E	91.1	Very high	85	Confident	114 Å²	114	67.5 Å²	67.5	53%	0.533	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.9	-177.6	64.4	179.5	-175.4	0	0	112.3	I641 C650 F651	E639-I641 HydrophobicContact CG-CG2 4.04Å; E639-C650 CarbonylContact O-C 3.53Å; E639-C650 WeakPolarHBondContact O-CA 3.44Å; E639-C650 VanDerWaalsContact O-CB 3.27Å; E639-C650 WeakPolarHBondContact O-CB 3.49Å; E639-F651 HydrophobicContact CG-CB 3.73Å; E639-F651 HydrophobicContact CG-CD1 4.05Å; E639-F651 HydrophobicContact CG-CG 4.31Å; E639-F651 PolarHBondContact N-O 3.3Å; E639-F651 PolarHBondContact O-N 3.37Å
640	V	88.3	Confident	84.9	Confident	82 Å²	82	65 Å²	65	50%	0.497	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.3	172.8	-179.6	0	0	0	0	108.6	E648	V640-E648 HydrophobicContact CG1-CB 4.1Å; V640-E648 HydrophobicContact CG1-CG 4.23Å
641	I	84.5	Confident	85	Confident	75 Å²	75	66.1 Å²	66.1	39%	0.385	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-12.2	-178.1	58.8	174	0	0	0	113.2	E639 V649 F651 F715	E639-I641 HydrophobicContact CG-CG2 4.04Å; I641-V649 HydrophobicContact CD1-CG1 3.91Å; I641-V649 HydrophobicContact CG1-CB 4.2Å; I641-V649 HydrophobicContact CG1-CG1 3.86Å; I641-V649 WeakPolarHBondContact CG1-O 3.41Å; I641-V649 PolarHBondContact N-O 3.2Å; I641-F651 HydrophobicContact CD1-CB 4.42Å; I641-F651 HydrophobicContact CG2-CB 3.55Å; I641-F715 HydrophobicContact CD1-CD2 4.2Å; I641-F715 HydrophobicContact CD1-CE2 3.7Å
642	G	79.6	Confident	85.1	Confident	30 Å²	30	61.7 Å²	61.7	31%	0.309	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	170.9	175.1	0	0	0	0	0	113.4	V649	G642-V649 PolarHBondContact N-O 2.95Å; G642-V649 VanDerWaalsContact N-O 3.1Å; G642-V649 PolarHBondContact O-N 3.39Å
643	S	73.9	Confident	85.3	Confident	104 Å²	104	62.7 Å²	62.7	73%	0.727	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.6	173.4	61	0	0	0	0	109.7
644	G	64.8	Low	85.5	Confident	30 Å²	30	58.3 Å²	58.3	31%	0.309	31%	0.307	S	S	.	.			trans	-106.1	-178.2	174.1	0	0	0	0	0	113	F646 G647	G644-F646 VanDerWaalsContact C-N 3.31Å; G644-F646 PolarHBondContact O-N 2.83Å; G644-G647 PolarHBondContact N-O 3.06Å; G644-G647 PolarHBondContact O-N 3.42Å
645	E	65.3	Low	85.6	Confident	163 Å²	163	61.8 Å²	61.8	76%	0.762	32%	0.32	S	S	*	.	S	Bend	trans	-55.5	-41.4	-178.5	-178	170.8	-157.3	0	0	113.4
646	F	65.7	Low	85.3	Confident	19 Å²	19	61.4 Å²	61.4	8%	0.083	32%	0.319	C	S	.	.	S	Bend	trans	-93.5	-13.9	-175.8	-60.3	-73.5	0	0	0	114.2	G644 L669 K670 E680 F681	G644-F646 VanDerWaalsContact C-N 3.31Å; G644-F646 PolarHBondContact O-N 2.83Å; F646-L669 HydrophobicContact CB-CD1 3.84Å; F646-L669 HydrophobicContact CD1-CD1 4.3Å; F646-L669 HydrophobicContact CG-CD1 4.49Å; F646-K670 PolarHBondContact O-N 2.83Å; F646-K670 VanDerWaalsContact O-N 3.16Å; F646-E680 HydrophobicContact CE1-CB 3.79Å; F646-E680 HydrophobicContact CZ-CB 3.75Å; F646-F681 HydrophobicContact CB-CD2 3.47Å; F646-F681 VanDerWaalsContact CB-CD2 3.47Å; F646-F681 HydrophobicContact CB-CE2 3.87Å; F646-F681 HydrophobicContact CB-CG 4.46Å; F646-F681 HydrophobicContact CD1-CB 4.24Å; F646-F681 HydrophobicContact CD1-CD2 4.34Å; F646-F681 AromaticContact CD2-CD2 3.97Å; F646-F681 HydrophobicContact CD2-CD2 3.97Å; F646-F681 HydrophobicContact CG-CB 4.36Å; F646-F681 AromaticContact CG-CD2 3.67Å; F646-F681 HydrophobicContact CG-CD2 3.67Å; F646-F681 HydrophobicContact CG-CE2 4.47Å; F646-F681 HydrophobicContact CG-CG 4.49Å
647	G	76.6	Confident	85	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.328	C	S	.	.	S	Bend	trans	158.9	-156.1	-176.8	0	0	0	0	0	115.4	G644 T668	G644-G647 PolarHBondContact N-O 3.06Å; G644-G647 PolarHBondContact O-N 3.42Å; G647-T668 VanDerWaalsContact CA-O 3.29Å; G647-T668 WeakPolarHBondContact CA-O 3.4Å
648	E	85	Confident	84.6	Confident	96 Å²	96	61.4 Å²	61.4	45%	0.449	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.1	-178.6	-68.2	171.4	179.1	0	0	110.1	V640 T668	V640-E648 HydrophobicContact CG1-CB 4.1Å; V640-E648 HydrophobicContact CG1-CG 4.23Å; E648-T668 PolarHBondContact O-N 3.01Å; E648-T668 PolarHBondContact O-OG1 3.14Å; E648-T668 VanDerWaalsContact O-OG1 3.07Å
649	V	88.8	Confident	84.6	Confident	37 Å²	37	65 Å²	65	22%	0.224	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.5	167.5	-172.5	0	0	0	0	106.6	I641 G642 I666 K667	I641-V649 HydrophobicContact CD1-CG1 3.91Å; I641-V649 HydrophobicContact CG1-CB 4.2Å; I641-V649 HydrophobicContact CG1-CG1 3.86Å; I641-V649 WeakPolarHBondContact CG1-O 3.41Å; I641-V649 PolarHBondContact N-O 3.2Å; G642-V649 PolarHBondContact N-O 2.95Å; G642-V649 VanDerWaalsContact N-O 3.1Å; G642-V649 PolarHBondContact O-N 3.39Å; V649-I666 WeakPolarHBondContact CA-O 3.37Å; V649-K667 HydrophobicContact CG2-CG 4.2Å
650	C	91.4	Very high	84.6	Confident	5 Å²	5	70.6 Å²	70.6	3%	0.034	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.2	-177.7	-49.9	0	0	0	0	110.8	I637 E639 A665 I666	I637-C650 HydrophobicContact CG2-CB 3.61Å; E639-C650 CarbonylContact O-C 3.53Å; E639-C650 WeakPolarHBondContact O-CA 3.44Å; E639-C650 VanDerWaalsContact O-CB 3.27Å; E639-C650 WeakPolarHBondContact O-CB 3.49Å; C650-A665 CarbonylContact O-C 3.45Å; C650-I666 HydrophobicContact CB-CB 4.44Å; C650-I666 PolarHBondContact N-O 3.16Å; C650-I666 PolarHBondContact O-N 3.36Å
651	F	94.6	Very high	84.8	Confident	30 Å²	30	70.8 Å²	70.8	13%	0.132	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	141	161.9	170.1	-98.5	0	0	0	109.4	E638 E639 I641 T663 F715	E638-F651 HydrophobicContact CB-CD1 4.08Å; E638-F651 HydrophobicContact CB-CE1 4.48Å; E638-F651 PolarHBondContact N-O 3.41Å; E638-F651 VanDerWaalsContact OE2-CE1 3.26Å; E638-F651 WeakPolarHBondContact OE2-CE1 3.27Å; E639-F651 HydrophobicContact CG-CB 3.73Å; E639-F651 HydrophobicContact CG-CD1 4.05Å; E639-F651 HydrophobicContact CG-CG 4.31Å; E639-F651 PolarHBondContact N-O 3.3Å; E639-F651 PolarHBondContact O-N 3.37Å; I641-F651 HydrophobicContact CD1-CB 4.42Å; I641-F651 HydrophobicContact CG2-CB 3.55Å; F651-T663 HydrophobicContact CE2-CG2 3.56Å; F651-T663 HydrophobicContact CZ-CG2 3.53Å; F651-F715 HydrophobicContact CB-CE2 4.41Å; F651-F715 AromaticContact CD2-CD1 3.78Å; F651-F715 HydrophobicContact CD2-CD1 3.78Å; F651-F715 AromaticContact CD2-CD2 3.73Å; F651-F715 HydrophobicContact CD2-CD2 3.73Å; F651-F715 AromaticContact CD2-CE1 3.69Å; F651-F715 HydrophobicContact CD2-CE1 3.69Å; F651-F715 AromaticContact CD2-CE2 3.66Å; F651-F715 HydrophobicContact CD2-CE2 3.66Å; F651-F715 AromaticContact CD2-CG 3.79Å; F651-F715 HydrophobicContact CD2-CG 3.79Å; F651-F715 AromaticContact CD2-CZ 3.63Å; F651-F715 HydrophobicContact CD2-CZ 3.63Å; F651-F715 AromaticContact CE2-CD1 3.62Å; F651-F715 HydrophobicContact CE2-CD1 3.62Å; F651-F715 HydrophobicContact CE2-CD2 4.4Å; F651-F715 AromaticContact CE2-CE1 3.65Å; F651-F715 HydrophobicContact CE2-CE1 3.65Å; F651-F715 HydrophobicContact CE2-CE2 4.44Å; F651-F715 HydrophobicContact CE2-CG 4.01Å; F651-F715 HydrophobicContact CE2-CZ 4.08Å; F651-F715 HydrophobicContact CG-CE2 4.49Å
652	G	95.1	Very high	85.2	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	-173	177.6	0	0	0	0	0	113.3	K636 T663 V664	K636-G652 CarbonylContact O-C 3.59Å; K636-G652 WeakPolarHBondContact O-CA 3.48Å; G652-T663 WeakPolarHBondContact O-CA 2.98Å; G652-V664 PolarHBondContact N-O 3.06Å; G652-V664 PolarHBondContact O-N 2.99Å
653	R	94.7	Very high	86	Confident	93 Å²	93	71.7 Å²	71.7	35%	0.351	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.1	-179.3	-57.3	-165	-178.6	-140	-7.2	111	I635 K636 E638 E661 Y662	I635-R653 WeakPolarHBondContact CA-O 3.46Å; K636-R653 PolarHBondContact N-O 3.39Å; K636-R653 PolarHBondContact O-N 2.82Å; E638-R653 IonicContact OE1-NE 2.62Å; E638-R653 PolarHBondContact OE1-NE 3.36Å; E638-R653 IonicContact OE2-NE 2.91Å; E638-R653 PolarHBondContact OE2-NE 2.76Å; R653-E661 HydrophobicContact CB-CG 3.77Å; R653-E661 VanDerWaalsContact CD-CD 3.42Å; R653-E661 WeakPolarHBondContact CD-OE2 3.17Å; R653-E661 HydrophobicContact CG-CG 4.45Å; R653-E661 IonicContact CZ-OE2 3.58Å; R653-E661 IonicContact NE-OE2 2.85Å; R653-E661 IonicContact NH1-OE2 3.02Å; R653-E661 PolarHBondContact NH1-OE2 2.96Å; R653-Y662 WeakPolarHBondContact CA-O 3.36Å
654	L	95.6	Very high	87.1	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.026	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.7	174.6	178.8	61.8	0	0	0	108.9	I630 L634 I635 P656 E661 Y662 V664 E700 V712	I630-L654 HydrophobicContact CD1-CD1 4.3Å; I630-L654 HydrophobicContact CD1-CD2 4.07Å; I630-L654 HydrophobicContact CG2-CD1 3.8Å; L634-L654 HydrophobicContact CB-CD1 4.24Å; I635-L654 HydrophobicContact CG1-CD1 3.68Å; L654-P656 HydrophobicContact CD2-CG 4.44Å; L654-P656 HydrophobicContact CG-CG 4.11Å; L654-P656 WeakPolarHBondContact O-CD 3.44Å; L654-E661 WeakPolarHBondContact O-CA 3.21Å; L654-Y662 HydrophobicContact CD2-CE2 4.29Å; L654-Y662 WeakPolarHBondContact CD2-OH 3.27Å; L654-Y662 PolarHBondContact N-O 3.07Å; L654-Y662 PolarHBondContact O-N 3.08Å; L654-V664 HydrophobicContact CB-CG1 3.67Å; L654-V664 HydrophobicContact CB-CG2 4Å; L654-V664 HydrophobicContact CD2-CG1 4.19Å; L654-E700 HydrophobicContact CD2-CB 4.02Å; L654-E700 HydrophobicContact CD2-CG 4.42Å; L654-V712 HydrophobicContact CD2-CG1 4.46Å
655	K	93.8	Very high	88.6	Confident	123 Å²	123	65.9 Å²	65.9	54%	0.535	33%	0.33	S	S	.	.			trans	-119.7	84.5	177.4	-172.3	178.2	-179.3	177.1	0	110.8	L634 E661	L634-K655 WeakPolarHBondContact CD2-O 3.27Å; L634-K655 PolarHBondContact O-N 3.33Å; K655-E661 HydrophobicContact CB-CB 4.2Å; K655-E661 HydrophobicContact CB-CG 4.31Å; K655-E661 HydrophobicContact CG-CB 4.25Å
656	P	88.1	Confident	89.9	Confident	11 Å²	11	58.1 Å²	58.1	7%	0.071	29%	0.294	C	S	.	.			trans	-67.1	151.3	178.6	-16.2	30	0	0	0	111.7	L654 G658 K659 Y662	L654-P656 HydrophobicContact CD2-CG 4.44Å; L654-P656 HydrophobicContact CG-CG 4.11Å; L654-P656 WeakPolarHBondContact O-CD 3.44Å; P656-G658 PolarHBondContact O-N 3.12Å; P656-K659 HydrophobicContact CB-CB 4.16Å; P656-K659 HydrophobicContact CB-CD 4.34Å; P656-K659 HydrophobicContact CB-CG 4.47Å; P656-K659 HydrophobicContact CG-CB 4.3Å; P656-K659 HydrophobicContact CG-CD 4.4Å; P656-K659 PolarHBondContact O-N 3.35Å; P656-Y662 HydrophobicContact CG-CE1 3.71Å
657	P	85.9	Confident	91.2	Very high	109 Å²	109	59 Å²	59	71%	0.708	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	124.5	176.4	-24.7	33.7	0	0	0	111.7	L634 K659	L634-P657 HydrophobicContact CD1-CG 4.33Å; L634-P657 HydrophobicContact CD2-CG 4.44Å; P657-K659 VanDerWaalsContact C-N 3.26Å; P657-K659 PolarHBondContact O-N 3.46Å
658	G	85.3	Confident	91.8	Very high	91 Å²	91	59.7 Å²	59.7	94%	0.938	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	7.4	178.7	0	0	0	0	0	115.5	P656	P656-G658 PolarHBondContact O-N 3.12Å
659	K	89.6	Confident	91.8	Very high	147 Å²	147	55.4 Å²	55.4	64%	0.639	28%	0.282	S	S	*	.	S	Bend	trans	-115.6	160.7	172.6	-67.3	-169.6	177.2	-173.3	0	111.2	P656 P657	P656-K659 HydrophobicContact CB-CB 4.16Å; P656-K659 HydrophobicContact CB-CD 4.34Å; P656-K659 HydrophobicContact CB-CG 4.47Å; P656-K659 HydrophobicContact CG-CB 4.3Å; P656-K659 HydrophobicContact CG-CD 4.4Å; P656-K659 PolarHBondContact O-N 3.35Å; P657-K659 VanDerWaalsContact C-N 3.26Å; P657-K659 PolarHBondContact O-N 3.46Å
660	R	89.7	Confident	91.3	Very high	232 Å²	232	59.3 Å²	59.3	88%	0.875	30%	0.296	S	S	*	.			trans	-68	150.9	169.6	-70	-175.9	176.5	-178.2	-1.5	109.6	Y662	R660-Y662 WeakPolarHBondContact O-CD1 3.11Å
661	E	93.3	Very high	90.6	Very high	86 Å²	86	65 Å²	65	40%	0.402	34%	0.336	S	S	.	.			trans	-67.6	139.9	171	-177.8	-178	-95.4	0	0	110.1	R653 L654 K655	R653-E661 HydrophobicContact CB-CG 3.77Å; R653-E661 VanDerWaalsContact CD-CD 3.42Å; R653-E661 WeakPolarHBondContact CD-OE2 3.17Å; R653-E661 HydrophobicContact CG-CG 4.45Å; R653-E661 IonicContact CZ-OE2 3.58Å; R653-E661 IonicContact NE-OE2 2.85Å; R653-E661 IonicContact NH1-OE2 3.02Å; R653-E661 PolarHBondContact NH1-OE2 2.96Å; L654-E661 WeakPolarHBondContact O-CA 3.21Å; K655-E661 HydrophobicContact CB-CB 4.2Å; K655-E661 HydrophobicContact CB-CG 4.31Å; K655-E661 HydrophobicContact CG-CB 4.25Å
662	Y	93.4	Very high	89.8	Confident	70 Å²	70	67.5 Å²	67.5	28%	0.275	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	163.8	176.4	59.1	-82.6	0	0	0	111.5	R653 L654 P656 R660 V664 E700	R653-Y662 WeakPolarHBondContact CA-O 3.36Å; L654-Y662 HydrophobicContact CD2-CE2 4.29Å; L654-Y662 WeakPolarHBondContact CD2-OH 3.27Å; L654-Y662 PolarHBondContact N-O 3.07Å; L654-Y662 PolarHBondContact O-N 3.08Å; P656-Y662 HydrophobicContact CG-CE1 3.71Å; R660-Y662 WeakPolarHBondContact O-CD1 3.11Å; Y662-V664 HydrophobicContact CD2-CG1 4.04Å; Y662-V664 HydrophobicContact CE2-CG1 3.86Å; Y662-E700 HydrophobicContact CE2-CG 4.21Å; Y662-E700 WeakPolarHBondContact CE2-OE1 3.48Å; Y662-E700 PolarHBondContact OH-OE2 3.36Å
663	T	96.1	Very high	88.9	Confident	55 Å²	55	70 Å²	70	34%	0.337	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	139.5	-175.2	50.1	0	0	0	0	112.3	F651 G652	F651-T663 HydrophobicContact CE2-CG2 3.56Å; F651-T663 HydrophobicContact CZ-CG2 3.53Å; G652-T663 WeakPolarHBondContact O-CA 2.98Å
664	V	96.5	Very high	88.3	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.3	-178	-67.9	0	0	0	0	111.3	G652 L654 Y662 I666 E700 V712 T713	G652-V664 PolarHBondContact N-O 3.06Å; G652-V664 PolarHBondContact O-N 2.99Å; L654-V664 HydrophobicContact CB-CG1 3.67Å; L654-V664 HydrophobicContact CB-CG2 4Å; L654-V664 HydrophobicContact CD2-CG1 4.19Å; Y662-V664 HydrophobicContact CD2-CG1 4.04Å; Y662-V664 HydrophobicContact CE2-CG1 3.86Å; V664-I666 HydrophobicContact CG2-CD1 4.06Å; V664-I666 HydrophobicContact CG2-CG1 3.89Å; V664-E700 HydrophobicContact CG1-CG 4.18Å; V664-V712 HydrophobicContact CB-CG1 3.65Å; V664-V712 HydrophobicContact CG1-CG1 3.89Å; V664-V712 HydrophobicContact CG2-CG1 3.82Å; V664-T713 WeakPolarHBondContact CA-O 3.28Å; V664-T713 WeakPolarHBondContact CB-O 3.49Å
665	A	95.4	Very high	87.6	Confident	11 Å²	11	74.5 Å²	74.5	9%	0.091	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129	166.7	0	0	0	0	0	109.4	C650 V712 T713 F715	C650-A665 CarbonylContact O-C 3.45Å; A665-V712 WeakPolarHBondContact O-CA 3.45Å; A665-T713 PolarHBondContact N-O 3.44Å; A665-T713 PolarHBondContact O-N 3.43Å; A665-T713 PolarHBondContact O-OG1 3.01Å; A665-F715 HydrophobicContact CB-CD2 4.3Å
666	I	94.1	Very high	86.9	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	103.9	-171.7	-55.6	165.6	0	0	0	108	I635 I637 V649 C650 V664 T668 M710 I711 V712	I635-I666 HydrophobicContact CG2-CD1 3.48Å; I635-I666 VanDerWaalsContact CG2-CD1 3.48Å; I635-I666 HydrophobicContact CG2-CG1 4.44Å; I637-I666 HydrophobicContact CG1-CD1 3.85Å; V649-I666 WeakPolarHBondContact CA-O 3.37Å; C650-I666 HydrophobicContact CB-CB 4.44Å; C650-I666 PolarHBondContact N-O 3.16Å; C650-I666 PolarHBondContact O-N 3.36Å; V664-I666 HydrophobicContact CG2-CD1 4.06Å; V664-I666 HydrophobicContact CG2-CG1 3.89Å; I666-T668 HydrophobicContact CG2-CG2 4.11Å; I666-M710 HydrophobicContact CG2-CB 4.04Å; I666-M710 HydrophobicContact CG2-CG 4.14Å; I666-M710 HydrophobicContact CG2-SD 3.72Å; I666-I711 WeakPolarHBondContact CA-O 3.2Å; I666-V712 HydrophobicContact CG1-CG1 4.4Å
667	K	92	Very high	86.5	Confident	37 Å²	37	76.8 Å²	76.8	16%	0.161	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125	172.1	-161.4	-179.4	-173.5	178	0	107.9	V649 F681 E684 M710 I711	V649-K667 HydrophobicContact CG2-CG 4.2Å; K667-F681 HydrophobicContact CB-CE2 4.37Å; K667-F681 HydrophobicContact CB-CZ 4.39Å; K667-F681 HydrophobicContact CD-CE2 3.82Å; K667-F681 HydrophobicContact CG-CE2 3.82Å; K667-F681 HydrophobicContact CG-CZ 4.3Å; K667-E684 IonicContact NZ-OE1 2.88Å; K667-E684 PolarHBondContact NZ-OE1 3.48Å; K667-E684 IonicContact NZ-OE2 2.77Å; K667-E684 PolarHBondContact NZ-OE2 2.77Å; K667-M710 CarbonylContact O-C 3.52Å; K667-M710 VanDerWaalsContact O-CA 3.24Å; K667-M710 WeakPolarHBondContact O-CA 3.42Å; K667-I711 HydrophobicContact CB-CB 4.3Å; K667-I711 PolarHBondContact N-O 3.36Å; K667-I711 PolarHBondContact O-N 3.2Å
668	T	89.5	Confident	86.4	Confident	15 Å²	15	74.8 Å²	74.8	9%	0.092	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	144	-178.8	64	0	0	0	0	110.8	G647 E648 I666 P708 M710	G647-T668 VanDerWaalsContact CA-O 3.29Å; G647-T668 WeakPolarHBondContact CA-O 3.4Å; E648-T668 PolarHBondContact O-N 3.01Å; E648-T668 PolarHBondContact O-OG1 3.14Å; E648-T668 VanDerWaalsContact O-OG1 3.07Å; I666-T668 HydrophobicContact CG2-CG2 4.11Å; T668-P708 HydrophobicContact CG2-CG 4.46Å; T668-M710 HydrophobicContact CG2-CG 4.1Å; T668-M710 HydrophobicContact CG2-SD 4.39Å
669	L	85	Confident	86.1	Confident	7 Å²	7	77 Å²	77	4%	0.037	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-92.8	122.7	175.5	-170.4	64.1	0	0	0	110.5	F646 Y673 R678 F681 V709	F646-L669 HydrophobicContact CB-CD1 3.84Å; F646-L669 HydrophobicContact CD1-CD1 4.3Å; F646-L669 HydrophobicContact CG-CD1 4.49Å; L669-Y673 HydrophobicContact CD2-CD1 3.39Å; L669-Y673 HydrophobicContact CD2-CD2 4.07Å; L669-Y673 HydrophobicContact CD2-CE1 3.56Å; L669-Y673 HydrophobicContact CD2-CE2 4.23Å; L669-Y673 HydrophobicContact CD2-CG 3.67Å; L669-Y673 HydrophobicContact CG-CD1 3.52Å; L669-Y673 HydrophobicContact CG-CE1 4.05Å; L669-Y673 HydrophobicContact CG-CG 3.95Å; L669-R678 HydrophobicContact CD2-CB 4.22Å; L669-R678 HydrophobicContact CD2-CG 4.24Å; L669-F681 HydrophobicContact CB-CD1 4.07Å; L669-F681 HydrophobicContact CB-CE1 3.89Å; L669-F681 HydrophobicContact CB-CE2 4.49Å; L669-F681 HydrophobicContact CB-CG 4.45Å; L669-F681 HydrophobicContact CB-CZ 4.11Å; L669-F681 HydrophobicContact CD1-CB 4.05Å; L669-F681 HydrophobicContact CD1-CD1 4.3Å; L669-F681 HydrophobicContact CD1-CD2 4.04Å; L669-F681 HydrophobicContact CD1-CG 3.89Å; L669-F681 HydrophobicContact CD2-CB 4.44Å; L669-F681 HydrophobicContact CD2-CD1 4.09Å; L669-F681 HydrophobicContact CD2-CG 4.36Å; L669-F681 HydrophobicContact CG-CD1 4.39Å; L669-F681 HydrophobicContact CG-CG 4.46Å; L669-V709 HydrophobicContact CB-CB 4.13Å; L669-V709 HydrophobicContact CD2-CB 4.29Å; L669-V709 PolarHBondContact N-O 3.48Å
670	K	78.6	Confident	85.7	Confident	119 Å²	119	72.3 Å²	72.3	52%	0.517	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-60.1	148.3	-176.5	-74.8	175.1	173.8	174.4	0	113.4	F646 Y673	F646-K670 PolarHBondContact O-N 2.83Å; F646-K670 VanDerWaalsContact O-N 3.16Å; K670-Y673 VanDerWaalsContact O-CD1 3.24Å; K670-Y673 WeakPolarHBondContact O-CD1 3.4Å
671	S	76.9	Confident	85.5	Confident	125 Å²	125	61.3 Å²	61.3	87%	0.874	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	136.2	173.6	55.9	0	0	0	0	112.2
672	G	76.8	Confident	85.1	Confident	82 Å²	82	57.2 Å²	57.2	85%	0.845	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	16.1	178.6	0	0	0	0	0	115.2
673	Y	77.7	Confident	84.7	Confident	53 Å²	53	55.6 Å²	55.6	21%	0.208	30%	0.302	C	S	.	.			trans	-62.3	151.2	176	62.2	-105.7	0	0	0	113	L669 K670 R678	L669-Y673 HydrophobicContact CD2-CD1 3.39Å; L669-Y673 HydrophobicContact CD2-CD2 4.07Å; L669-Y673 HydrophobicContact CD2-CE1 3.56Å; L669-Y673 HydrophobicContact CD2-CE2 4.23Å; L669-Y673 HydrophobicContact CD2-CG 3.67Å; L669-Y673 HydrophobicContact CG-CD1 3.52Å; L669-Y673 HydrophobicContact CG-CE1 4.05Å; L669-Y673 HydrophobicContact CG-CG 3.95Å; K670-Y673 VanDerWaalsContact O-CD1 3.24Å; K670-Y673 WeakPolarHBondContact O-CD1 3.4Å; Y673-R678 HydrophobicContact CD2-CB 3.71Å; Y673-R678 HydrophobicContact CD2-CG 4.46Å; Y673-R678 HydrophobicContact CE2-CB 3.61Å; Y673-R678 HydrophobicContact CE2-CG 3.92Å
674	T	82.1	Confident	84.2	Confident	72 Å²	72	53.8 Å²	53.8	44%	0.442	29%	0.29	S	S	.	.			trans	-78.8	157.2	169.5	68.6	0	0	0	0	111	E676 Q677 R678	T674-E676 PolarHBondContact O-N 3.44Å; T674-Q677 PolarHBondContact O-N 3.01Å; T674-Q677 VanDerWaalsContact O-N 3.14Å; T674-Q677 WeakPolarHBondContact OG1-CG 3.47Å; T674-Q677 PolarHBondContact OG1-N 2.95Å; T674-Q677 VanDerWaalsContact OG1-N 3.15Å; T674-R678 PolarHBondContact O-N 3.11Å
675	D	79.3	Confident	83.8	Confident	120 Å²	120	53.8 Å²	53.8	64%	0.642	29%	0.29	S	S	*	.	H	α-helix	trans	-57.9	-34.1	174.5	-75.4	-38.4	0	0	0	111.5	R678 R679	D675-R678 PolarHBondContact O-N 3.11Å; D675-R679 VanDerWaalsContact O-CG 3.24Å; D675-R679 WeakPolarHBondContact O-CG 3.45Å; D675-R679 PolarHBondContact O-N 3.04Å
676	E	78.9	Confident	83.5	Confident	101 Å²	101	53.3 Å²	53.3	47%	0.472	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-51	173	-174.2	172.8	-160.4	0	0	112.8	T674 R678 R679 E680	T674-E676 PolarHBondContact O-N 3.44Å; E676-R678 VanDerWaalsContact C-N 3.26Å; E676-R678 PolarHBondContact O-N 2.88Å; E676-R679 WeakPolarHBondContact O-CB 3.27Å; E676-R679 PolarHBondContact O-N 3.37Å; E676-E680 WeakPolarHBondContact O-CG 3.37Å; E676-E680 PolarHBondContact O-N 3.38Å
677	Q	79.9	Confident	83.2	Confident	81 Å²	81	53.4 Å²	53.4	38%	0.379	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-36.1	177.1	-72.6	172.1	-34.7	0	0	112.2	T674 F681	T674-Q677 PolarHBondContact O-N 3.01Å; T674-Q677 VanDerWaalsContact O-N 3.14Å; T674-Q677 WeakPolarHBondContact OG1-CG 3.47Å; T674-Q677 PolarHBondContact OG1-N 2.95Å; T674-Q677 VanDerWaalsContact OG1-N 3.15Å; Q677-F681 VanDerWaalsContact O-CB 3.26Å; Q677-F681 WeakPolarHBondContact O-CB 3.35Å; Q677-F681 PolarHBondContact O-N 3.47Å
678	R	83.9	Confident	83.1	Confident	67 Å²	67	52 Å²	52	25%	0.253	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-43.1	173.5	-176	-174.6	175.3	-165.7	-3.8	111.8	N620 L669 Y673 T674 D675 E676 E680 F681 L682	N620-R678 PolarHBondContact OD1-NH2 3.4Å; L669-R678 HydrophobicContact CD2-CB 4.22Å; L669-R678 HydrophobicContact CD2-CG 4.24Å; Y673-R678 HydrophobicContact CD2-CB 3.71Å; Y673-R678 HydrophobicContact CD2-CG 4.46Å; Y673-R678 HydrophobicContact CE2-CB 3.61Å; Y673-R678 HydrophobicContact CE2-CG 3.92Å; T674-R678 PolarHBondContact O-N 3.11Å; D675-R678 PolarHBondContact O-N 3.11Å; E676-R678 VanDerWaalsContact C-N 3.26Å; E676-R678 PolarHBondContact O-N 2.88Å; R678-E680 VanDerWaalsContact C-N 3.35Å; R678-F681 PolarHBondContact O-N 3.33Å; R678-L682 HydrophobicContact CG-CD1 4.14Å; R678-L682 HydrophobicContact CG-CG 4.46Å; R678-L682 WeakPolarHBondContact O-CB 3.42Å; R678-L682 WeakPolarHBondContact O-CG 3.29Å; R678-L682 PolarHBondContact O-N 3.12Å
679	R	80.6	Confident	83.2	Confident	137 Å²	137	52.6 Å²	52.6	52%	0.517	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-43.4	178.5	-69.5	-167.9	-70.5	-169	-1.3	111	P619 D675 E676 L682 S683	P619-R679 HydrophobicContact CG-CB 3.94Å; P619-R679 HydrophobicContact CG-CG 3.43Å; P619-R679 VanDerWaalsContact CG-CG 3.43Å; D675-R679 VanDerWaalsContact O-CG 3.24Å; D675-R679 WeakPolarHBondContact O-CG 3.45Å; D675-R679 PolarHBondContact O-N 3.04Å; E676-R679 WeakPolarHBondContact O-CB 3.27Å; E676-R679 PolarHBondContact O-N 3.37Å; R679-L682 PolarHBondContact O-N 3.02Å; R679-S683 VanDerWaalsContact O-CB 3.22Å; R679-S683 WeakPolarHBondContact O-CB 3.43Å; R679-S683 PolarHBondContact O-N 2.85Å
680	E	79.4	Confident	83.4	Confident	49 Å²	49	52.6 Å²	52.6	23%	0.229	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-47.4	175.8	-69.9	171.5	177.2	0	0	111.6	F646 E676 R678 L682 S683 E684 R783	F646-E680 HydrophobicContact CE1-CB 3.79Å; F646-E680 HydrophobicContact CZ-CB 3.75Å; E676-E680 WeakPolarHBondContact O-CG 3.37Å; E676-E680 PolarHBondContact O-N 3.38Å; R678-E680 VanDerWaalsContact C-N 3.35Å; E680-L682 PolarHBondContact O-N 3.4Å; E680-S683 WeakPolarHBondContact O-CB 3.1Å; E680-S683 PolarHBondContact O-N 2.77Å; E680-E684 PolarHBondContact O-N 3.27Å; E680-E684 VanDerWaalsContact O-N 3.13Å; E680-R783 VanDerWaalsContact CD-NH1 3.34Å; E680-R783 IonicContact OE1-CZ 2.61Å; E680-R783 IonicContact OE1-NH1 2.7Å; E680-R783 PolarHBondContact OE1-NH1 3.29Å; E680-R783 IonicContact OE1-NH2 2.66Å
681	F	85.6	Confident	84.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-47.2	176.9	-171.5	-108.3	0	0	0	112.3	F646 K667 L669 Q677 R678 V709 I711	F646-F681 HydrophobicContact CB-CD2 3.47Å; F646-F681 VanDerWaalsContact CB-CD2 3.47Å; F646-F681 HydrophobicContact CB-CE2 3.87Å; F646-F681 HydrophobicContact CB-CG 4.46Å; F646-F681 HydrophobicContact CD1-CB 4.24Å; F646-F681 HydrophobicContact CD1-CD2 4.34Å; F646-F681 AromaticContact CD2-CD2 3.97Å; F646-F681 HydrophobicContact CD2-CD2 3.97Å; F646-F681 HydrophobicContact CG-CB 4.36Å; F646-F681 AromaticContact CG-CD2 3.67Å; F646-F681 HydrophobicContact CG-CD2 3.67Å; F646-F681 HydrophobicContact CG-CE2 4.47Å; F646-F681 HydrophobicContact CG-CG 4.49Å; K667-F681 HydrophobicContact CB-CE2 4.37Å; K667-F681 HydrophobicContact CB-CZ 4.39Å; K667-F681 HydrophobicContact CD-CE2 3.82Å; K667-F681 HydrophobicContact CG-CE2 3.82Å; K667-F681 HydrophobicContact CG-CZ 4.3Å; L669-F681 HydrophobicContact CB-CD1 4.07Å; L669-F681 HydrophobicContact CB-CE1 3.89Å; L669-F681 HydrophobicContact CB-CE2 4.49Å; L669-F681 HydrophobicContact CB-CG 4.45Å; L669-F681 HydrophobicContact CB-CZ 4.11Å; L669-F681 HydrophobicContact CD1-CB 4.05Å; L669-F681 HydrophobicContact CD1-CD1 4.3Å; L669-F681 HydrophobicContact CD1-CD2 4.04Å; L669-F681 HydrophobicContact CD1-CG 3.89Å; L669-F681 HydrophobicContact CD2-CB 4.44Å; L669-F681 HydrophobicContact CD2-CD1 4.09Å; L669-F681 HydrophobicContact CD2-CG 4.36Å; L669-F681 HydrophobicContact CG-CD1 4.39Å; L669-F681 HydrophobicContact CG-CG 4.46Å; Q677-F681 VanDerWaalsContact O-CB 3.26Å; Q677-F681 WeakPolarHBondContact O-CB 3.35Å; Q677-F681 PolarHBondContact O-N 3.47Å; R678-F681 PolarHBondContact O-N 3.33Å; F681-V709 HydrophobicContact CD1-CG1 4.13Å; F681-V709 HydrophobicContact CE1-CB 4.44Å; F681-V709 HydrophobicContact CE1-CG1 3.94Å; F681-I711 HydrophobicContact CD1-CD1 3.94Å; F681-I711 HydrophobicContact CD1-CG1 4.19Å; F681-I711 HydrophobicContact CD2-CD1 3.92Å; F681-I711 HydrophobicContact CE1-CD1 3.7Å; F681-I711 HydrophobicContact CE1-CG1 3.57Å; F681-I711 HydrophobicContact CE2-CD1 3.71Å; F681-I711 HydrophobicContact CE2-CG1 4.26Å; F681-I711 HydrophobicContact CG-CD1 4.05Å; F681-I711 HydrophobicContact CZ-CB 4.35Å; F681-I711 HydrophobicContact CZ-CD1 3.59Å; F681-I711 HydrophobicContact CZ-CG1 3.63Å; F681-I711 WeakPolarHBondContact O-CD1 3.2Å
682	L	86.5	Confident	84.8	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-71.5	-33.8	178.6	-68.1	-178.8	0	0	0	112.6	I623 R678 R679 E680 E684 A685 S686 T704 V709	I623-L682 HydrophobicContact CD1-CB 4.2Å; I623-L682 HydrophobicContact CD1-CD2 4.22Å; I623-L682 VanDerWaalsContact CD1-O 3.26Å; I623-L682 WeakPolarHBondContact CD1-O 3.41Å; I623-L682 HydrophobicContact CG1-CB 3.83Å; I623-L682 HydrophobicContact CG1-CD1 4.49Å; I623-L682 HydrophobicContact CG1-CD2 4.13Å; I623-L682 HydrophobicContact CG1-CG 4.36Å; R678-L682 HydrophobicContact CG-CD1 4.14Å; R678-L682 HydrophobicContact CG-CG 4.46Å; R678-L682 WeakPolarHBondContact O-CB 3.42Å; R678-L682 WeakPolarHBondContact O-CG 3.29Å; R678-L682 PolarHBondContact O-N 3.12Å; R679-L682 PolarHBondContact O-N 3.02Å; E680-L682 PolarHBondContact O-N 3.4Å; L682-E684 VanDerWaalsContact C-N 3.3Å; L682-E684 PolarHBondContact O-N 3.47Å; L682-A685 PolarHBondContact O-N 3.1Å; L682-S686 PolarHBondContact O-N 2.89Å; L682-S686 PolarHBondContact O-OG 2.85Å; L682-T704 HydrophobicContact CD2-CG2 3.88Å; L682-V709 HydrophobicContact CD2-CG1 4Å
683	S	83.3	Confident	85.7	Confident	36 Å²	36	46.4 Å²	46.4	25%	0.252	23%	0.226	S	C	.	.	H	α-helix	trans	-59.5	-41.9	176.1	-176.4	0	0	0	0	111.4	R679 E680 A685 S686 I687	R679-S683 VanDerWaalsContact O-CB 3.22Å; R679-S683 WeakPolarHBondContact O-CB 3.43Å; R679-S683 PolarHBondContact O-N 2.85Å; E680-S683 WeakPolarHBondContact O-CB 3.1Å; E680-S683 PolarHBondContact O-N 2.77Å; S683-A685 VanDerWaalsContact C-N 3.32Å; S683-A685 PolarHBondContact O-N 2.82Å; S683-S686 PolarHBondContact O-N 3.12Å; S683-S686 VanDerWaalsContact O-N 3.14Å; S683-I687 WeakPolarHBondContact O-CG1 3.4Å; S683-I687 PolarHBondContact O-N 3.43Å
684	E	85.9	Confident	86.5	Confident	17 Å²	17	47.9 Å²	47.9	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-55.8	-45.9	175	-165.5	-172.2	157.8	0	0	111.5	K667 E680 L682 I687 M688	K667-E684 IonicContact NZ-OE1 2.88Å; K667-E684 PolarHBondContact NZ-OE1 3.48Å; K667-E684 IonicContact NZ-OE2 2.77Å; K667-E684 PolarHBondContact NZ-OE2 2.77Å; E680-E684 PolarHBondContact O-N 3.27Å; E680-E684 VanDerWaalsContact O-N 3.13Å; L682-E684 VanDerWaalsContact C-N 3.3Å; L682-E684 PolarHBondContact O-N 3.47Å; E684-I687 PolarHBondContact O-N 2.67Å; E684-M688 HydrophobicContact CG-CE 4.05Å; E684-M688 WeakPolarHBondContact O-CG 3.32Å; E684-M688 PolarHBondContact O-N 3.28Å; E684-M688 VanDerWaalsContact O-N 3.07Å
685	A	89.5	Confident	87.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.2	-38.2	176.3	0	0	0	0	0	113.2	I623 L682 S683 I687 M688 G689 L699 V702 I711	I623-A685 HydrophobicContact CD1-CB 3.75Å; L682-A685 PolarHBondContact O-N 3.1Å; S683-A685 VanDerWaalsContact C-N 3.32Å; S683-A685 PolarHBondContact O-N 2.82Å; A685-I687 VanDerWaalsContact C-N 3.27Å; A685-I687 PolarHBondContact O-N 2.8Å; A685-M688 HydrophobicContact CB-CE 4.46Å; A685-M688 PolarHBondContact O-N 2.76Å; A685-G689 PolarHBondContact O-N 3.17Å; A685-L699 HydrophobicContact CB-CD1 4.46Å; A685-L699 HydrophobicContact CB-CD2 4.39Å; A685-L699 VanDerWaalsContact O-CD2 3.31Å; A685-L699 WeakPolarHBondContact O-CD2 3.15Å; A685-V702 HydrophobicContact CB-CG1 3.62Å; A685-I711 HydrophobicContact CB-CD1 3.92Å; A685-I711 HydrophobicContact CB-CG1 3.92Å; A685-I711 HydrophobicContact CB-CG2 4.1Å
686	S	87.9	Confident	88.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-32.2	174.7	-69.7	0	0	0	0	112.9	I623 L682 S683 Q690	I623-S686 WeakPolarHBondContact CD1-OG 3.31Å; I623-S686 WeakPolarHBondContact CG1-OG 3.42Å; I623-S686 PolarHBondContact N-OG 3.29Å; L682-S686 PolarHBondContact O-N 2.89Å; L682-S686 PolarHBondContact O-OG 2.85Å; S683-S686 PolarHBondContact O-N 3.12Å; S683-S686 VanDerWaalsContact O-N 3.14Å; S686-Q690 WeakPolarHBondContact O-CG 3.35Å; S686-Q690 PolarHBondContact O-NE2 3.2Å; S686-Q690 VanDerWaalsContact O-NE2 3.17Å
687	I	88	Confident	88.9	Confident	3 Å²	3	35 Å²	35	2%	0.015	17%	0.174	C	C	.	.	H	α-helix	trans	-69.4	-53.5	173.3	-66	163.6	0	0	0	109.7	Y610 P613 S683 E684 A685 G689 Q690 F691 Y756 F779 S782	Y610-I687 HydrophobicContact CE2-CG1 4.23Å; Y610-I687 HydrophobicContact CE2-CG2 4.17Å; P613-I687 HydrophobicContact CG-CG1 3.92Å; S683-I687 WeakPolarHBondContact O-CG1 3.4Å; S683-I687 PolarHBondContact O-N 3.43Å; E684-I687 PolarHBondContact O-N 2.67Å; A685-I687 VanDerWaalsContact C-N 3.27Å; A685-I687 PolarHBondContact O-N 2.8Å; I687-G689 VanDerWaalsContact C-N 3.26Å; I687-G689 PolarHBondContact O-N 3.06Å; I687-Q690 PolarHBondContact O-N 3.33Å; I687-Q690 VanDerWaalsContact O-N 3.14Å; I687-F691 HydrophobicContact CG2-CD2 4.38Å; I687-F691 HydrophobicContact CG2-CE2 3.49Å; I687-F691 VanDerWaalsContact CG2-CE2 3.49Å; I687-F691 HydrophobicContact CG2-CZ 4.04Å; I687-F691 WeakPolarHBondContact O-CD2 3.24Å; I687-Y756 HydrophobicContact CG2-CE2 3.82Å; I687-F779 HydrophobicContact CB-CB 4.39Å; I687-F779 HydrophobicContact CD1-CB 4.41Å; I687-F779 HydrophobicContact CG2-CB 3.84Å; I687-F779 HydrophobicContact CG2-CD1 4.17Å; I687-F779 HydrophobicContact CG2-CG 3.94Å; I687-S782 VanDerWaalsContact CD1-OG 3.25Å; I687-S782 WeakPolarHBondContact CD1-OG 3.42Å
688	M	90.8	Very high	89.6	Confident	7 Å²	7	34.3 Å²	34.3	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-57.6	-39.1	-179.4	-70.7	-174.2	-72.3	0	0	112.5	E684 A685 Q690 F691 I697 L699 I711 T713 F779	E684-M688 HydrophobicContact CG-CE 4.05Å; E684-M688 WeakPolarHBondContact O-CG 3.32Å; E684-M688 PolarHBondContact O-N 3.28Å; E684-M688 VanDerWaalsContact O-N 3.07Å; A685-M688 HydrophobicContact CB-CE 4.46Å; A685-M688 PolarHBondContact O-N 2.76Å; M688-Q690 PolarHBondContact O-N 2.75Å; M688-Q690 VanDerWaalsContact O-N 3.13Å; M688-F691 PolarHBondContact O-N 2.72Å; M688-F691 VanDerWaalsContact O-N 3.09Å; M688-I697 HydrophobicContact SD-CG2 4.08Å; M688-L699 HydrophobicContact CB-CB 3.97Å; M688-L699 HydrophobicContact CB-CD2 4.45Å; M688-L699 HydrophobicContact CE-CD1 4.33Å; M688-I711 HydrophobicContact CE-CG2 3.68Å; M688-T713 HydrophobicContact CE-CG2 4.38Å; M688-T713 HydrophobicContact SD-CG2 4.13Å; M688-F779 HydrophobicContact CG-CD2 3.38Å; M688-F779 HydrophobicContact CG-CE2 3.64Å; M688-F779 HydrophobicContact CG-CG 4.49Å; M688-F779 HydrophobicContact SD-CD2 4.18Å; M688-F779 HydrophobicContact SD-CE2 4.42Å
689	G	90.3	Very high	90.1	Very high	27 Å²	27	31.8 Å²	31.8	28%	0.278	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.5	-179.3	0	0	0	0	0	115	F626 A685 I687	F626-G689 CarbonylContact O-C 3.56Å; F626-G689 WeakPolarHBondContact O-CA 2.97Å; A685-G689 PolarHBondContact O-N 3.17Å; I687-G689 VanDerWaalsContact C-N 3.26Å; I687-G689 PolarHBondContact O-N 3.06Å
690	Q	90.5	Very high	90.8	Very high	8 Å²	8	27 Å²	27	4%	0.037	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-16.8	177.5	-66.1	178.8	63.2	0	0	113.3	K608 I611 F626 S686 I687 M688	K608-Q690 PolarHBondContact NZ-O 3.26Å; I611-Q690 PolarHBondContact O-NE2 3.36Å; I611-Q690 PolarHBondContact O-OE1 3.3Å; F626-Q690 HydrophobicContact CB-CG 3.98Å; F626-Q690 HydrophobicContact CD1-CG 3.59Å; F626-Q690 HydrophobicContact CD2-CG 4.14Å; F626-Q690 HydrophobicContact CE1-CG 4.1Å; F626-Q690 HydrophobicContact CG-CG 3.62Å; S686-Q690 WeakPolarHBondContact O-CG 3.35Å; S686-Q690 PolarHBondContact O-NE2 3.2Å; S686-Q690 VanDerWaalsContact O-NE2 3.17Å; I687-Q690 PolarHBondContact O-N 3.33Å; I687-Q690 VanDerWaalsContact O-N 3.14Å; M688-Q690 PolarHBondContact O-N 2.75Å; M688-Q690 VanDerWaalsContact O-N 3.13Å
691	F	92	Very high	91.5	Very high	7 Å²	7	24.7 Å²	24.7	3%	0.031	14%	0.135	C	C	.	.			trans	-103.7	137.8	-171	-57.3	-37.7	0	0	0	112.9	Y610 I687 M688 V696 Y750 L751 M754 Y756 F779	Y610-F691 HydrophobicContact CD2-CE1 4.03Å; Y610-F691 AromaticContact CD2-CZ 3.79Å; Y610-F691 HydrophobicContact CD2-CZ 3.79Å; Y610-F691 HydrophobicContact CE2-CZ 4.23Å; I687-F691 HydrophobicContact CG2-CD2 4.38Å; I687-F691 HydrophobicContact CG2-CE2 3.49Å; I687-F691 VanDerWaalsContact CG2-CE2 3.49Å; I687-F691 HydrophobicContact CG2-CZ 4.04Å; I687-F691 WeakPolarHBondContact O-CD2 3.24Å; M688-F691 PolarHBondContact O-N 2.72Å; M688-F691 VanDerWaalsContact O-N 3.09Å; F691-V696 HydrophobicContact CB-CG1 4.09Å; F691-V696 HydrophobicContact CD2-CG1 4.42Å; F691-Y750 HydrophobicContact CB-CE1 3.95Å; F691-Y750 HydrophobicContact CD1-CE1 4.02Å; F691-Y750 HydrophobicContact CG-CE1 4.26Å; F691-L751 HydrophobicContact CD1-CD2 3.95Å; F691-L751 HydrophobicContact CD2-CD2 3.75Å; F691-L751 HydrophobicContact CE1-CD2 3.91Å; F691-L751 HydrophobicContact CE2-CD2 3.68Å; F691-L751 HydrophobicContact CG-CD2 3.89Å; F691-L751 HydrophobicContact CZ-CD2 3.79Å; F691-M754 HydrophobicContact CD1-CE 4.42Å; F691-M754 HydrophobicContact CE1-CB 4.42Å; F691-M754 HydrophobicContact CE1-CE 4.47Å; F691-Y756 HydrophobicContact CE1-CG 4.38Å; F691-Y756 HydrophobicContact CE2-CD1 4.26Å; F691-Y756 HydrophobicContact CE2-CD2 4.42Å; F691-Y756 HydrophobicContact CE2-CE1 4.32Å; F691-Y756 HydrophobicContact CE2-CE2 4.47Å; F691-Y756 HydrophobicContact CE2-CG 4.29Å; F691-Y756 AromaticContact CZ-CD1 3.95Å; F691-Y756 HydrophobicContact CZ-CD1 3.95Å; F691-Y756 AromaticContact CZ-CD2 3.68Å; F691-Y756 HydrophobicContact CZ-CD2 3.68Å; F691-Y756 HydrophobicContact CZ-CE1 4.37Å; F691-Y756 HydrophobicContact CZ-CE2 4.12Å; F691-Y756 AromaticContact CZ-CG 3.56Å; F691-Y756 HydrophobicContact CZ-CG 3.56Å; F691-F779 HydrophobicContact CD2-CE1 4.31Å; F691-F779 HydrophobicContact CD2-CZ 4.16Å; F691-F779 HydrophobicContact CE2-CD1 4.34Å; F691-F779 HydrophobicContact CE2-CE1 4.03Å; F691-F779 HydrophobicContact CE2-CZ 4.33Å
692	E	91.5	Very high	91.9	Very high	148 Å²	148	24.7 Å²	24.7	69%	0.692	14%	0.135	S	C	*	.			trans	-143.3	98	176.1	-170.8	173.6	-168	0	0	109.4	Y750	E692-Y750 PolarHBondContact N-OH 2.87Å
693	H	95.3	Very high	92.3	Very high	40 Å²	40	24.7 Å²	24.7	19%	0.185	14%	0.135	C	C	.	.			trans	-155.8	142.2	179.6	-173.8	-93	0	0	0	110.9	N695 V696 A746 Y750	H693-N695 PolarHBondContact ND1-N 2.97Å; H693-N695 VanDerWaalsContact ND1-N 3.1Å; H693-N695 PolarHBondContact O-N 2.87Å; H693-N695 VanDerWaalsContact O-N 3.07Å; H693-V696 HydrophobicContact CB-CB 4.18Å; H693-V696 HydrophobicContact CB-CG2 4Å; H693-V696 PolarHBondContact O-N 2.58Å; H693-A746 PolarHBondContact CE1-O 3.42Å; H693-Y750 HydrophobicContact CB-CD1 3.68Å; H693-Y750 HydrophobicContact CB-CD2 4.14Å; H693-Y750 HydrophobicContact CB-CE1 3.99Å; H693-Y750 HydrophobicContact CB-CE2 4.4Å; H693-Y750 HydrophobicContact CB-CG 3.75Å; H693-Y750 AromaticContact CD2-CD2 3.99Å; H693-Y750 AromaticContact CD2-CG 3.87Å; H693-Y750 AromaticContact CG-CG 3.84Å
694	P	95.3	Very high	92.6	Very high	85 Å²	85	24.4 Å²	24.4	55%	0.552	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18	-177.5	21.9	-34.5	0	0	0	115.4	K775	P694-K775 WeakPolarHBondContact O-CE 3.49Å; P694-K775 PolarHBondContact O-NZ 3.33Å
695	N	97.9	Very high	92.7	Very high	14 Å²	14	32.2 Å²	32.2	8%	0.075	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	19.9	176.6	-60.2	108	0	0	0	113.7	H693 G743 C774 K775 V776	H693-N695 PolarHBondContact ND1-N 2.97Å; H693-N695 VanDerWaalsContact ND1-N 3.1Å; H693-N695 PolarHBondContact O-N 2.87Å; H693-N695 VanDerWaalsContact O-N 3.07Å; N695-G743 WeakPolarHBondContact CB-O 3.44Å; N695-G743 VanDerWaalsContact ND2-CA 3.35Å; N695-G743 WeakPolarHBondContact ND2-CA 3.34Å; N695-C774 PolarHBondContact ND2-O 3.2Å; N695-K775 WeakPolarHBondContact O-CA 3.42Å; N695-V776 PolarHBondContact O-N 2.82Å
696	V	96.4	Very high	92.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.012	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-125.1	138.5	170.3	179	0	0	0	0	106.9	F691 H693 H698 Y750 L751 F779	F691-V696 HydrophobicContact CB-CG1 4.09Å; F691-V696 HydrophobicContact CD2-CG1 4.42Å; H693-V696 HydrophobicContact CB-CB 4.18Å; H693-V696 HydrophobicContact CB-CG2 4Å; H693-V696 PolarHBondContact O-N 2.58Å; V696-H698 PolarHBondContact O-N 3.25Å; V696-Y750 HydrophobicContact CG2-CD1 4.07Å; V696-L751 HydrophobicContact CG2-CD2 4.38Å; V696-L751 HydrophobicContact CG2-CG 4.27Å; V696-F779 HydrophobicContact CG1-CZ 3.88Å
697	I	95.8	Very high	92.1	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	22%	0.216	C	C	.	.			trans	-60.2	131.2	-177.6	-168	67.9	0	0	0	110.6	M688 E714 M716 L767 V776 F779	M688-I697 HydrophobicContact SD-CG2 4.08Å; I697-E714 HydrophobicContact CD1-CG 3.45Å; I697-E714 VanDerWaalsContact CD1-CG 3.45Å; I697-E714 HydrophobicContact CG1-CG 4.37Å; I697-M716 HydrophobicContact CD1-CG 3.73Å; I697-M716 HydrophobicContact CD1-SD 4.12Å; I697-L767 HydrophobicContact CD1-CD1 3.97Å; I697-L767 HydrophobicContact CG1-CD1 4.44Å; I697-V776 PolarHBondContact N-O 3.37Å; I697-F779 HydrophobicContact CG2-CE2 3.81Å
698	H	94.6	Very high	92.1	Very high	67 Å²	67	46.8 Å²	46.8	31%	0.31	23%	0.233	S	C	.	.			trans	-90	130.3	-177.5	-173.3	60.9	0	0	0	111.8	V696 E700 T713 E714	V696-H698 PolarHBondContact O-N 3.25Å; H698-E700 IonicContact CD2-OE1 2.7Å; H698-T713 VanDerWaalsContact O-CA 3.29Å; H698-T713 WeakPolarHBondContact O-CA 3.47Å; H698-T713 WeakPolarHBondContact O-CB 3.34Å; H698-E714 HydrophobicContact CB-CG 4.25Å; H698-E714 WeakPolarHBondContact CB-OE1 3.44Å; H698-E714 PolarHBondContact N-OE1 2.87Å; H698-E714 PolarHBondContact O-N 3.15Å; H698-E714 VanDerWaalsContact O-N 3.1Å
699	L	95.4	Very high	92	Very high	14 Å²	14	46.7 Å²	46.7	7%	0.073	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.7	169.1	-179.4	73.5	0	0	0	110.2	A627 A685 M688 V702 I711 V712 T713	A627-L699 HydrophobicContact CB-CD2 3.8Å; A685-L699 HydrophobicContact CB-CD1 4.46Å; A685-L699 HydrophobicContact CB-CD2 4.39Å; A685-L699 VanDerWaalsContact O-CD2 3.31Å; A685-L699 WeakPolarHBondContact O-CD2 3.15Å; M688-L699 HydrophobicContact CB-CB 3.97Å; M688-L699 HydrophobicContact CB-CD2 4.45Å; M688-L699 HydrophobicContact CE-CD1 4.33Å; L699-V702 HydrophobicContact CD1-CG1 4.47Å; L699-I711 HydrophobicContact CD1-CG2 3.51Å; L699-V712 WeakPolarHBondContact CD1-O 3.25Å; L699-T713 HydrophobicContact CD1-CG2 4.24Å
700	E	94.9	Very high	92.2	Very high	36 Å²	36	45.6 Å²	45.6	17%	0.168	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-34.4	173.6	-68.2	-67.3	166.5	0	0	111.7	L654 Y662 V664 H698 V712	L654-E700 HydrophobicContact CD2-CB 4.02Å; L654-E700 HydrophobicContact CD2-CG 4.42Å; Y662-E700 HydrophobicContact CE2-CG 4.21Å; Y662-E700 WeakPolarHBondContact CE2-OE1 3.48Å; Y662-E700 PolarHBondContact OH-OE2 3.36Å; V664-E700 HydrophobicContact CG1-CG 4.18Å; H698-E700 IonicContact CD2-OE1 2.7Å; E700-V712 HydrophobicContact CB-CB 4.32Å; E700-V712 HydrophobicContact CB-CG1 4.05Å; E700-V712 WeakPolarHBondContact CB-O 3.34Å; E700-V712 PolarHBondContact N-O 3.37Å
701	G	93.9	Very high	92.3	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.7	-169.7	174.3	0	0	0	0	0	113.2	K628 V712	K628-G701 CarbonylContact O-C 3.52Å; K628-G701 WeakPolarHBondContact O-CA 3.39Å; G701-V712 PolarHBondContact N-O 2.86Å; G701-V712 PolarHBondContact O-N 3.21Å
702	V	94.9	Very high	92.5	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	155.9	-178.6	-64.3	0	0	0	0	110.9	I623 A627 K628 E629 I630 A685 L699 T704 M710 I711	I623-V702 HydrophobicContact CD1-CG1 4.27Å; I623-V702 HydrophobicContact CG2-CG2 3.83Å; A627-V702 HydrophobicContact CB-CG1 4.07Å; A627-V702 HydrophobicContact CB-CG2 3.98Å; K628-V702 PolarHBondContact O-N 2.95Å; E629-V702 CarbonylContact C-O 3.45Å; E629-V702 WeakPolarHBondContact CA-O 3.39Å; I630-V702 PolarHBondContact N-O 3.32Å; A685-V702 HydrophobicContact CB-CG1 3.62Å; L699-V702 HydrophobicContact CD1-CG1 4.47Å; V702-T704 HydrophobicContact CB-CG2 4.14Å; V702-T704 HydrophobicContact CG2-CG2 3.86Å; V702-M710 CarbonylContact C-O 3.49Å; V702-M710 VanDerWaalsContact CA-O 3.3Å; V702-M710 WeakPolarHBondContact CA-O 3.27Å; V702-I711 HydrophobicContact CG1-CG1 4.45Å
703	V	93.4	Very high	92.6	Very high	1 Å²	1	39 Å²	39	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	105.4	169.2	-174.5	0	0	0	0	107.3	I630 V632 I635 S706 V709 M710	I630-V703 HydrophobicContact CB-CG2 4.22Å; V632-V703 HydrophobicContact CB-CG1 4.43Å; I635-V703 HydrophobicContact CD1-CG2 3.49Å; I635-V703 VanDerWaalsContact CD1-CG2 3.49Å; V703-S706 WeakPolarHBondContact CG1-OG 3.42Å; V703-V709 CarbonylContact O-C 3.6Å; V703-V709 VanDerWaalsContact O-CA 3.3Å; V703-V709 WeakPolarHBondContact O-CA 3.47Å; V703-V709 WeakPolarHBondContact O-CG1 3.31Å; V703-M710 HydrophobicContact CB-CB 4.01Å; V703-M710 HydrophobicContact CB-CE 3.87Å; V703-M710 HydrophobicContact CB-CG 4.45Å; V703-M710 HydrophobicContact CG1-CE 3.83Å; V703-M710 HydrophobicContact CG2-CB 4.19Å; V703-M710 HydrophobicContact CG2-CE 3.93Å; V703-M710 PolarHBondContact N-O 3.08Å; V703-M710 PolarHBondContact O-N 3.12Å
704	T	90.5	Very high	92.6	Very high	31 Å²	31	38.8 Å²	38.8	19%	0.19	19%	0.191	C	C	.	.			trans	-115.5	-20.3	-177	66.1	0	0	0	0	112.8	I623 E629 L682 V702 V709	I623-T704 HydrophobicContact CG2-CG2 4.2Å; E629-T704 PolarHBondContact OE1-N 3.2Å; E629-T704 PolarHBondContact OE1-OG1 2.99Å; E629-T704 PolarHBondContact OE2-N 3.34Å; E629-T704 PolarHBondContact OE2-OG1 3.28Å; L682-T704 HydrophobicContact CD2-CG2 3.88Å; V702-T704 HydrophobicContact CB-CG2 4.14Å; V702-T704 HydrophobicContact CG2-CG2 3.86Å; T704-V709 HydrophobicContact CG2-CG1 4.4Å
705	K	87.3	Confident	92.6	Very high	180 Å²	180	36.7 Å²	36.7	78%	0.783	17%	0.173	S	C	*	.	S	Bend	trans	-82.4	-8.7	-179.2	-68	174.5	-176.3	174.7	0	114.9	E629	E629-K705 HydrophobicContact CG-CD 4.02Å; E629-K705 HydrophobicContact CG-CG 4.45Å; E629-K705 WeakPolarHBondContact OE1-CB 3.47Å; E629-K705 WeakPolarHBondContact OE1-CG 3.31Å; E629-K705 PolarHBondContact OE1-N 3.49Å
706	S	84.6	Confident	92.5	Very high	35 Å²	35	36.5 Å²	36.5	25%	0.245	17%	0.172	C	C	.	.	S	Bend	trans	-130.2	168.1	178.2	71.4	0	0	0	0	110.9	V703 P708	V703-S706 WeakPolarHBondContact CG1-OG 3.42Å; S706-P708 CarbonylContact O-C 3.55Å
707	R	80.9	Confident	92.4	Very high	216 Å²	216	40.5 Å²	40.5	82%	0.815	19%	0.191	S	C	*	.	S	Bend	trans	-110.6	137.2	174.4	-71.6	-173	176.5	174.7	-0.8	109.7
708	P	87.8	Confident	92.3	Very high	58 Å²	58	43 Å²	43	38%	0.377	20%	0.204	S	C	.	.	S	Bend	cis	-72	158.6	-1.1	31.6	-35.4	0	0	0	112.9	T668 S706 M710	T668-P708 HydrophobicContact CG2-CG 4.46Å; S706-P708 CarbonylContact O-C 3.55Å; P708-M710 HydrophobicContact CG-CG 4.37Å; P708-M710 WeakPolarHBondContact O-CG 3.48Å
709	V	89.8	Confident	92.2	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.03	20%	0.204	C	C	.	.			trans	-72.1	136.1	170.8	-178.4	0	0	0	0	108	L669 F681 L682 V703 T704	L669-V709 HydrophobicContact CB-CB 4.13Å; L669-V709 HydrophobicContact CD2-CB 4.29Å; L669-V709 PolarHBondContact N-O 3.48Å; F681-V709 HydrophobicContact CD1-CG1 4.13Å; F681-V709 HydrophobicContact CE1-CB 4.44Å; F681-V709 HydrophobicContact CE1-CG1 3.94Å; L682-V709 HydrophobicContact CD2-CG1 4Å; V703-V709 CarbonylContact O-C 3.6Å; V703-V709 VanDerWaalsContact O-CA 3.3Å; V703-V709 WeakPolarHBondContact O-CA 3.47Å; V703-V709 WeakPolarHBondContact O-CG1 3.31Å; T704-V709 HydrophobicContact CG2-CG1 4.4Å
710	M	93.1	Very high	92.2	Very high	4 Å²	4	42 Å²	42	2%	0.02	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.8	-173.2	-54.6	-179.3	-98.8	0	0	113	V632 I637 I666 K667 T668 V702 V703 P708	V632-M710 HydrophobicContact CG2-CE 3.98Å; I637-M710 HydrophobicContact CD1-SD 4.08Å; I666-M710 HydrophobicContact CG2-CB 4.04Å; I666-M710 HydrophobicContact CG2-CG 4.14Å; I666-M710 HydrophobicContact CG2-SD 3.72Å; K667-M710 CarbonylContact O-C 3.52Å; K667-M710 VanDerWaalsContact O-CA 3.24Å; K667-M710 WeakPolarHBondContact O-CA 3.42Å; T668-M710 HydrophobicContact CG2-CG 4.1Å; T668-M710 HydrophobicContact CG2-SD 4.39Å; V702-M710 CarbonylContact C-O 3.49Å; V702-M710 VanDerWaalsContact CA-O 3.3Å; V702-M710 WeakPolarHBondContact CA-O 3.27Å; V703-M710 HydrophobicContact CB-CB 4.01Å; V703-M710 HydrophobicContact CB-CE 3.87Å; V703-M710 HydrophobicContact CB-CG 4.45Å; V703-M710 HydrophobicContact CG1-CE 3.83Å; V703-M710 HydrophobicContact CG2-CB 4.19Å; V703-M710 HydrophobicContact CG2-CE 3.93Å; V703-M710 PolarHBondContact N-O 3.08Å; V703-M710 PolarHBondContact O-N 3.12Å; P708-M710 HydrophobicContact CG-CG 4.37Å; P708-M710 WeakPolarHBondContact O-CG 3.48Å
711	I	93.2	Very high	92.3	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.1	167.4	-58.4	170	0	0	0	107	I666 K667 F681 A685 M688 L699 V702 T713	I666-I711 WeakPolarHBondContact CA-O 3.2Å; K667-I711 HydrophobicContact CB-CB 4.3Å; K667-I711 PolarHBondContact N-O 3.36Å; K667-I711 PolarHBondContact O-N 3.2Å; F681-I711 HydrophobicContact CD1-CD1 3.94Å; F681-I711 HydrophobicContact CD1-CG1 4.19Å; F681-I711 HydrophobicContact CD2-CD1 3.92Å; F681-I711 HydrophobicContact CE1-CD1 3.7Å; F681-I711 HydrophobicContact CE1-CG1 3.57Å; F681-I711 HydrophobicContact CE2-CD1 3.71Å; F681-I711 HydrophobicContact CE2-CG1 4.26Å; F681-I711 HydrophobicContact CG-CD1 4.05Å; F681-I711 HydrophobicContact CZ-CB 4.35Å; F681-I711 HydrophobicContact CZ-CD1 3.59Å; F681-I711 HydrophobicContact CZ-CG1 3.63Å; F681-I711 WeakPolarHBondContact O-CD1 3.2Å; A685-I711 HydrophobicContact CB-CD1 3.92Å; A685-I711 HydrophobicContact CB-CG1 3.92Å; A685-I711 HydrophobicContact CB-CG2 4.1Å; M688-I711 HydrophobicContact CE-CG2 3.68Å; L699-I711 HydrophobicContact CD1-CG2 3.51Å; V702-I711 HydrophobicContact CG1-CG1 4.45Å; I711-T713 HydrophobicContact CG2-CG2 4.29Å
712	V	95.2	Very high	92.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.6	-176	-170.2	0	0	0	0	108.5	I630 I635 L654 V664 A665 I666 L699 E700 G701	I630-V712 HydrophobicContact CD1-CB 4.1Å; I630-V712 HydrophobicContact CD1-CG1 4.5Å; I630-V712 HydrophobicContact CD1-CG2 4.17Å; I635-V712 HydrophobicContact CD1-CG2 3.78Å; L654-V712 HydrophobicContact CD2-CG1 4.46Å; V664-V712 HydrophobicContact CB-CG1 3.65Å; V664-V712 HydrophobicContact CG1-CG1 3.89Å; V664-V712 HydrophobicContact CG2-CG1 3.82Å; A665-V712 WeakPolarHBondContact O-CA 3.45Å; I666-V712 HydrophobicContact CG1-CG1 4.4Å; L699-V712 WeakPolarHBondContact CD1-O 3.25Å; E700-V712 HydrophobicContact CB-CB 4.32Å; E700-V712 HydrophobicContact CB-CG1 4.05Å; E700-V712 WeakPolarHBondContact CB-O 3.34Å; E700-V712 PolarHBondContact N-O 3.37Å; G701-V712 PolarHBondContact N-O 2.86Å; G701-V712 PolarHBondContact O-N 3.21Å
713	T	95.5	Very high	92.1	Very high	22 Å²	22	43.2 Å²	43.2	14%	0.135	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	165.8	178.6	54.7	0	0	0	0	110.2	V664 A665 M688 H698 L699 I711	V664-T713 WeakPolarHBondContact CA-O 3.28Å; V664-T713 WeakPolarHBondContact CB-O 3.49Å; A665-T713 PolarHBondContact N-O 3.44Å; A665-T713 PolarHBondContact O-N 3.43Å; A665-T713 PolarHBondContact O-OG1 3.01Å; M688-T713 HydrophobicContact CE-CG2 4.38Å; M688-T713 HydrophobicContact SD-CG2 4.13Å; H698-T713 VanDerWaalsContact O-CA 3.29Å; H698-T713 WeakPolarHBondContact O-CA 3.47Å; H698-T713 WeakPolarHBondContact O-CB 3.34Å; L699-T713 HydrophobicContact CD1-CG2 4.24Å; I711-T713 HydrophobicContact CG2-CG2 4.29Å
714	E	94.9	Very high	92.2	Very high	36 Å²	36	43.6 Å²	43.6	17%	0.168	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	144.2	169.3	66.3	-176.6	129.3	0	0	111.3	I697 H698 M716 K775	I697-E714 HydrophobicContact CD1-CG 3.45Å; I697-E714 VanDerWaalsContact CD1-CG 3.45Å; I697-E714 HydrophobicContact CG1-CG 4.37Å; H698-E714 HydrophobicContact CB-CG 4.25Å; H698-E714 WeakPolarHBondContact CB-OE1 3.44Å; H698-E714 PolarHBondContact N-OE1 2.87Å; H698-E714 PolarHBondContact O-N 3.15Å; H698-E714 VanDerWaalsContact O-N 3.1Å; E714-M716 HydrophobicContact CG-SD 4.21Å; E714-K775 VanDerWaalsContact OE1-CD 3.22Å; E714-K775 WeakPolarHBondContact OE1-CD 3.49Å; E714-K775 WeakPolarHBondContact OE1-CE 3.36Å; E714-K775 IonicContact OE1-NZ 3.7Å; E714-K775 PolarHBondContact OE1-NZ 2.84Å; E714-K775 VanDerWaalsContact OE2-CE 3.27Å; E714-K775 WeakPolarHBondContact OE2-CE 3.43Å; E714-K775 IonicContact OE2-NZ 2.93Å; E714-K775 PolarHBondContact OE2-NZ 2.98Å
715	F	95.6	Very high	92.3	Very high	42 Å²	42	42.1 Å²	42.1	18%	0.184	21%	0.214	C	C	.	.			trans	-82.5	134.9	177.7	-178	-118.2	0	0	0	111.4	I641 F651 A665 E717	I641-F715 HydrophobicContact CD1-CD2 4.2Å; I641-F715 HydrophobicContact CD1-CE2 3.7Å; F651-F715 HydrophobicContact CB-CE2 4.41Å; F651-F715 AromaticContact CD2-CD1 3.78Å; F651-F715 HydrophobicContact CD2-CD1 3.78Å; F651-F715 AromaticContact CD2-CD2 3.73Å; F651-F715 HydrophobicContact CD2-CD2 3.73Å; F651-F715 AromaticContact CD2-CE1 3.69Å; F651-F715 HydrophobicContact CD2-CE1 3.69Å; F651-F715 AromaticContact CD2-CE2 3.66Å; F651-F715 HydrophobicContact CD2-CE2 3.66Å; F651-F715 AromaticContact CD2-CG 3.79Å; F651-F715 HydrophobicContact CD2-CG 3.79Å; F651-F715 AromaticContact CD2-CZ 3.63Å; F651-F715 HydrophobicContact CD2-CZ 3.63Å; F651-F715 AromaticContact CE2-CD1 3.62Å; F651-F715 HydrophobicContact CE2-CD1 3.62Å; F651-F715 HydrophobicContact CE2-CD2 4.4Å; F651-F715 AromaticContact CE2-CE1 3.65Å; F651-F715 HydrophobicContact CE2-CE1 3.65Å; F651-F715 HydrophobicContact CE2-CE2 4.44Å; F651-F715 HydrophobicContact CE2-CG 4.01Å; F651-F715 HydrophobicContact CE2-CZ 4.08Å; F651-F715 HydrophobicContact CG-CE2 4.49Å; A665-F715 HydrophobicContact CB-CD2 4.3Å; F715-E717 HydrophobicContact CD1-CG 3.91Å; F715-E717 HydrophobicContact CE1-CB 4.15Å; F715-E717 HydrophobicContact CE1-CG 3.76Å
716	M	95.4	Very high	92.4	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.049	20%	0.198	C	C	.	.			trans	-116.4	99.8	-178.3	-60.6	-65.5	-70.6	0	0	109.1	I697 E714 N718 G719 L767 V768 N769 K775	I697-M716 HydrophobicContact CD1-CG 3.73Å; I697-M716 HydrophobicContact CD1-SD 4.12Å; E714-M716 HydrophobicContact CG-SD 4.21Å; M716-N718 VanDerWaalsContact C-N 3.25Å; M716-N718 PolarHBondContact O-N 3.36Å; M716-N718 VanDerWaalsContact O-N 3.15Å; M716-G719 PolarHBondContact O-N 3.21Å; M716-G719 VanDerWaalsContact O-N 3.11Å; M716-L767 HydrophobicContact CB-CB 3.8Å; M716-L767 HydrophobicContact CB-CD1 4.33Å; M716-L767 VanDerWaalsContact CE-C 3.46Å; M716-L767 HydrophobicContact CE-CB 3.84Å; M716-L767 VanDerWaalsContact CE-O 3.31Å; M716-L767 WeakPolarHBondContact CE-O 3.35Å; M716-L767 HydrophobicContact CG-CB 3.65Å; M716-L767 HydrophobicContact CG-CD1 3.93Å; M716-L767 HydrophobicContact CG-CG 4.41Å; M716-V768 CarbonylContact C-O 3.57Å; M716-N769 HydrophobicContact CE-CB 3.9Å; M716-N769 HydrophobicContact SD-CB 4.07Å; M716-K775 HydrophobicContact CE-CB 3.92Å; M716-K775 HydrophobicContact CE-CD 3.88Å; M716-K775 HydrophobicContact CE-CG 3.66Å; M716-K775 HydrophobicContact SD-CD 3.94Å; M716-K775 HydrophobicContact SD-CG 4.39Å
717	E	93.1	Very high	92.6	Very high	86 Å²	86	44.4 Å²	44.4	40%	0.402	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-25.7	-162.8	-55.3	94.1	138.8	0	0	114.3	F715 N769 S770	F715-E717 HydrophobicContact CD1-CG 3.91Å; F715-E717 HydrophobicContact CE1-CB 4.15Å; F715-E717 HydrophobicContact CE1-CG 3.76Å; E717-N769 WeakPolarHBondContact OE2-CA 3.37Å; E717-N769 VanDerWaalsContact OE2-CB 3.26Å; E717-N769 WeakPolarHBondContact OE2-CB 3.44Å; E717-S770 WeakPolarHBondContact OE1-CB 3.33Å; E717-S770 PolarHBondContact OE1-OG 2.8Å; E717-S770 PolarHBondContact OE2-N 3.49Å
718	N	93.6	Very high	92.7	Very high	56 Å²	56	37.9 Å²	37.9	30%	0.299	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	4.3	-178	-70.8	-45.2	0	0	0	113.1	M716 F724 V768 N769	M716-N718 VanDerWaalsContact C-N 3.25Å; M716-N718 PolarHBondContact O-N 3.36Å; M716-N718 VanDerWaalsContact O-N 3.15Å; N718-F724 HydrophobicContact CB-CD2 3.58Å; N718-F724 HydrophobicContact CB-CE2 3.73Å; N718-F724 HydrophobicContact CB-CG 4.17Å; N718-F724 HydrophobicContact CB-CZ 4.43Å; N718-F724 VanDerWaalsContact CG-CE2 3.47Å; N718-V768 WeakPolarHBondContact CA-O 3.46Å; N718-V768 HydrophobicContact CB-CB 3.92Å; N718-V768 HydrophobicContact CB-CG1 4.14Å; N718-V768 WeakPolarHBondContact CB-O 3.32Å; N718-V768 PolarHBondContact N-O 3.15Å; N718-N769 PolarHBondContact ND2-O 2.93Å
719	G	93	Very high	92.5	Very high	31 Å²	31	41.9 Å²	41.9	32%	0.32	21%	0.21	S	C	.	.			trans	64.8	-147.2	177.7	0	0	0	0	0	113.5	M716 L767 V768	M716-G719 PolarHBondContact O-N 3.21Å; M716-G719 VanDerWaalsContact O-N 3.11Å; G719-L767 CarbonylContact O-C 3.56Å; G719-L767 WeakPolarHBondContact O-CA 3.39Å; G719-V768 PolarHBondContact O-N 3.17Å
720	S	94.7	Very high	91.8	Very high	29 Å²	29	44.5 Å²	44.5	20%	0.203	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-75.3	142.5	-179	70.1	0	0	0	0	112.5	D722 S723 F724 R764 I766	S720-D722 VanDerWaalsContact C-N 3.33Å; S720-D722 VanDerWaalsContact CB-OD1 3.29Å; S720-D722 WeakPolarHBondContact CB-OD1 3.23Å; S720-D722 PolarHBondContact O-N 2.7Å; S720-D722 PolarHBondContact OG-OD1 2.84Å; S720-S723 PolarHBondContact O-N 2.85Å; S720-S723 PolarHBondContact OG-OG 2.8Å; S720-F724 VanDerWaalsContact O-CB 3.3Å; S720-F724 WeakPolarHBondContact O-CB 3.37Å; S720-F724 PolarHBondContact O-N 2.78Å; S720-R764 WeakPolarHBondContact CB-O 3.44Å; S720-I766 CarbonylContact C-O 3.47Å; S720-I766 WeakPolarHBondContact CA-O 3.4Å
721	L	97.1	Very high	91.3	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-37.4	-173.4	176.9	63.2	0	0	0	112.3	F724 L725 M740 I744 A763 I766 V768 V833	L721-F724 HydrophobicContact CD1-CD1 4.38Å; L721-F724 PolarHBondContact O-N 3.1Å; L721-L725 HydrophobicContact CD1-CD1 3.81Å; L721-L725 HydrophobicContact CD1-CD2 4.32Å; L721-L725 HydrophobicContact CD1-CG 3.8Å; L721-L725 HydrophobicContact CD2-CD1 4.5Å; L721-L725 HydrophobicContact CG-CD1 3.75Å; L721-L725 HydrophobicContact CG-CG 4.2Å; L721-L725 WeakPolarHBondContact O-CB 3.35Å; L721-L725 WeakPolarHBondContact O-CD1 3.29Å; L721-L725 WeakPolarHBondContact O-CG 3.44Å; L721-L725 PolarHBondContact O-N 2.9Å; L721-M740 HydrophobicContact CD1-SD 4.05Å; L721-I744 HydrophobicContact CD2-CD1 3.66Å; L721-A763 WeakPolarHBondContact CB-O 3.34Å; L721-A763 PolarHBondContact N-O 3.17Å; L721-I766 HydrophobicContact CB-CB 3.86Å; L721-I766 HydrophobicContact CB-CG2 4.05Å; L721-I766 WeakPolarHBondContact CB-O 3.4Å; L721-I766 HydrophobicContact CD2-CB 3.99Å; L721-I766 HydrophobicContact CD2-CG1 4.41Å; L721-I766 HydrophobicContact CD2-CG2 3.83Å; L721-I766 PolarHBondContact N-O 3.23Å; L721-V768 HydrophobicContact CB-CG2 3.76Å; L721-V768 HydrophobicContact CD1-CG2 3.6Å; L721-V768 HydrophobicContact CG-CG2 4.26Å; L721-V833 HydrophobicContact CD2-CG2 3.82Å
722	D	93.6	Very high	91.1	Very high	21 Å²	21	51.3 Å²	51.3	11%	0.112	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-47.2	179.6	72	-41.5	0	0	0	112.3	S720 R726 A763 R764	S720-D722 VanDerWaalsContact C-N 3.33Å; S720-D722 VanDerWaalsContact CB-OD1 3.29Å; S720-D722 WeakPolarHBondContact CB-OD1 3.23Å; S720-D722 PolarHBondContact O-N 2.7Å; S720-D722 PolarHBondContact OG-OD1 2.84Å; D722-R726 WeakPolarHBondContact O-CG 2.98Å; D722-R726 PolarHBondContact O-N 2.93Å; D722-R726 VanDerWaalsContact O-N 3.15Å; D722-R726 IonicContact OD2-CZ 3.59Å; D722-R726 IonicContact OD2-NH1 3.64Å; D722-R726 PolarHBondContact OD2-NH1 3.18Å; D722-R726 IonicContact OD2-NH2 3.56Å; D722-R726 PolarHBondContact OD2-NH2 3.04Å; D722-A763 HydrophobicContact CB-CB 3.89Å; D722-R764 WeakPolarHBondContact OD1-CA 3.12Å
723	S	92.3	Very high	90.8	Very high	42 Å²	42	54 Å²	54	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-69.3	-39.5	177.5	-63.4	0	0	0	0	111.1	S720 R726 Q727	S720-S723 PolarHBondContact O-N 2.85Å; S720-S723 PolarHBondContact OG-OG 2.8Å; S723-R726 PolarHBondContact O-N 3.31Å; S723-R726 PolarHBondContact OG-NH2 3.49Å; S723-Q727 VanDerWaalsContact O-CG 3.26Å; S723-Q727 WeakPolarHBondContact O-CG 3.2Å; S723-Q727 PolarHBondContact O-N 2.78Å; S723-Q727 VanDerWaalsContact O-N 3.11Å
724	F	94.8	Very high	90.5	Very high	10 Å²	10	55.1 Å²	55.1	4%	0.044	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-44	175.5	178.4	-111.4	0	0	0	112.7	N718 S720 L721 K728 F732 M740 V768 L772	N718-F724 HydrophobicContact CB-CD2 3.58Å; N718-F724 HydrophobicContact CB-CE2 3.73Å; N718-F724 HydrophobicContact CB-CG 4.17Å; N718-F724 HydrophobicContact CB-CZ 4.43Å; N718-F724 VanDerWaalsContact CG-CE2 3.47Å; S720-F724 VanDerWaalsContact O-CB 3.3Å; S720-F724 WeakPolarHBondContact O-CB 3.37Å; S720-F724 PolarHBondContact O-N 2.78Å; L721-F724 HydrophobicContact CD1-CD1 4.38Å; L721-F724 PolarHBondContact O-N 3.1Å; F724-K728 HydrophobicContact CD2-CG 4.48Å; F724-K728 HydrophobicContact CE2-CG 4.22Å; F724-K728 WeakPolarHBondContact O-CB 3.13Å; F724-K728 WeakPolarHBondContact O-CG 3.44Å; F724-K728 PolarHBondContact O-N 2.89Å; F724-F732 HydrophobicContact CD1-CE2 4.49Å; F724-F732 HydrophobicContact CD1-CZ 4.37Å; F724-F732 HydrophobicContact CE1-CE1 4.31Å; F724-F732 AromaticContact CE1-CE2 3.91Å; F724-F732 HydrophobicContact CE1-CE2 3.91Å; F724-F732 AromaticContact CE1-CZ 3.42Å; F724-F732 HydrophobicContact CE1-CZ 3.42Å; F724-F732 VanDerWaalsContact CE1-CZ 3.42Å; F724-F732 HydrophobicContact CZ-CE1 4.28Å; F724-F732 HydrophobicContact CZ-CE2 4.38Å; F724-F732 AromaticContact CZ-CZ 3.52Å; F724-F732 HydrophobicContact CZ-CZ 3.52Å; F724-M740 HydrophobicContact CE1-CE 3.89Å; F724-V768 HydrophobicContact CD1-CB 4.41Å; F724-V768 HydrophobicContact CD1-CG1 4.16Å; F724-V768 HydrophobicContact CD1-CG2 4.23Å; F724-V768 HydrophobicContact CE1-CG1 4.06Å; F724-L772 HydrophobicContact CE1-CD2 3.77Å; F724-L772 HydrophobicContact CZ-CD2 3.46Å; F724-L772 VanDerWaalsContact CZ-CD2 3.46Å
725	L	92.1	Very high	90.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-44.6	178.3	-73.8	168.2	0	0	0	112.1	L721 Q727 K728 E729 F732 L737 M740 V833 Y836	L721-L725 HydrophobicContact CD1-CD1 3.81Å; L721-L725 HydrophobicContact CD1-CD2 4.32Å; L721-L725 HydrophobicContact CD1-CG 3.8Å; L721-L725 HydrophobicContact CD2-CD1 4.5Å; L721-L725 HydrophobicContact CG-CD1 3.75Å; L721-L725 HydrophobicContact CG-CG 4.2Å; L721-L725 WeakPolarHBondContact O-CB 3.35Å; L721-L725 WeakPolarHBondContact O-CD1 3.29Å; L721-L725 WeakPolarHBondContact O-CG 3.44Å; L721-L725 PolarHBondContact O-N 2.9Å; L725-Q727 VanDerWaalsContact C-N 3.3Å; L725-Q727 PolarHBondContact O-N 3.23Å; L725-K728 CarbonylContact O-C 3.55Å; L725-K728 VanDerWaalsContact O-C 3.3Å; L725-K728 PolarHBondContact O-N 2.74Å; L725-E729 PolarHBondContact O-N 3.49Å; L725-E729 VanDerWaalsContact O-N 3.13Å; L725-F732 HydrophobicContact CD2-CD2 4.13Å; L725-F732 HydrophobicContact CD2-CE2 4.14Å; L725-L737 HydrophobicContact CD2-CD2 3.88Å; L725-M740 HydrophobicContact CD2-SD 4.39Å; L725-V833 HydrophobicContact CD1-CB 4.29Å; L725-V833 HydrophobicContact CD1-CG1 4.46Å; L725-V833 HydrophobicContact CD1-CG2 4.07Å; L725-Y836 CarbonylContact C-O 3.58Å; L725-Y836 HydrophobicContact CB-CD1 4.5Å; L725-Y836 HydrophobicContact CD2-CD1 4.28Å
726	R	89.6	Confident	90.2	Very high	118 Å²	118	58.9 Å²	58.9	45%	0.445	31%	0.314	S	S	.	.	H	α-helix	trans	-61	-38.4	177.8	-74.9	-173.4	-66.9	-98.5	-1.5	112.5	D722 S723 K728 Y836 G837	D722-R726 WeakPolarHBondContact O-CG 2.98Å; D722-R726 PolarHBondContact O-N 2.93Å; D722-R726 VanDerWaalsContact O-N 3.15Å; D722-R726 IonicContact OD2-CZ 3.59Å; D722-R726 IonicContact OD2-NH1 3.64Å; D722-R726 PolarHBondContact OD2-NH1 3.18Å; D722-R726 IonicContact OD2-NH2 3.56Å; D722-R726 PolarHBondContact OD2-NH2 3.04Å; S723-R726 PolarHBondContact O-N 3.31Å; S723-R726 PolarHBondContact OG-NH2 3.49Å; R726-K728 PolarHBondContact O-N 3.45Å; R726-Y836 WeakPolarHBondContact CA-O 3.28Å; R726-Y836 WeakPolarHBondContact CG-O 3.17Å; R726-Y836 PolarHBondContact N-O 2.96Å; R726-G837 PolarHBondContact NH1-O 3.42Å
727	Q	89	Confident	90.1	Very high	144 Å²	144	58.5 Å²	58.5	67%	0.673	31%	0.312	S	S	*	.	H	α-helix	trans	-69.8	-17.5	176.6	-71	173.6	22.2	0	0	113.6	S723 L725	S723-Q727 VanDerWaalsContact O-CG 3.26Å; S723-Q727 WeakPolarHBondContact O-CG 3.2Å; S723-Q727 PolarHBondContact O-N 2.78Å; S723-Q727 VanDerWaalsContact O-N 3.11Å; L725-Q727 VanDerWaalsContact C-N 3.3Å; L725-Q727 PolarHBondContact O-N 3.23Å
728	K	83.5	Confident	90.2	Very high	80 Å²	80	54.4 Å²	54.4	35%	0.348	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	28.7	-173.3	-61.6	-67	-177.9	-176.1	0	111.7	F724 L725 R726 G730 Q731 F732 Y836	F724-K728 HydrophobicContact CD2-CG 4.48Å; F724-K728 HydrophobicContact CE2-CG 4.22Å; F724-K728 WeakPolarHBondContact O-CB 3.13Å; F724-K728 WeakPolarHBondContact O-CG 3.44Å; F724-K728 PolarHBondContact O-N 2.89Å; L725-K728 CarbonylContact O-C 3.55Å; L725-K728 VanDerWaalsContact O-C 3.3Å; L725-K728 PolarHBondContact O-N 2.74Å; R726-K728 PolarHBondContact O-N 3.45Å; K728-G730 PolarHBondContact O-N 2.89Å; K728-Q731 HydrophobicContact CB-CB 4.4Å; K728-Q731 VanDerWaalsContact O-CB 3.3Å; K728-Q731 WeakPolarHBondContact O-CB 3.07Å; K728-Q731 PolarHBondContact O-N 3.08Å; K728-F732 HydrophobicContact CB-CD2 4.4Å; K728-F732 HydrophobicContact CB-CE2 3.47Å; K728-F732 VanDerWaalsContact CB-CE2 3.47Å; K728-F732 HydrophobicContact CB-CZ 3.71Å; K728-F732 HydrophobicContact CG-CE2 4.23Å; K728-F732 HydrophobicContact CG-CZ 4.01Å; K728-Y836 WeakPolarHBondContact O-CE1 3.05Å
729	E	83.2	Confident	90.3	Very high	142 Å²	142	53.4 Å²	53.4	66%	0.664	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	127.3	-177	-167.8	177.1	-178.6	0	0	111.7	L725 Q731 Y836	L725-E729 PolarHBondContact O-N 3.49Å; L725-E729 VanDerWaalsContact O-N 3.13Å; E729-Q731 PolarHBondContact O-N 3.3Å; E729-Y836 HydrophobicContact CB-CD1 4.48Å; E729-Y836 HydrophobicContact CG-CG 4.21Å
730	G	75.1	Confident	90.5	Very high	59 Å²	59	52 Å²	52	61%	0.608	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	1.4	-179.1	0	0	0	0	0	116.3	K728 Y836	K728-G730 PolarHBondContact O-N 2.89Å; G730-Y836 VanDerWaalsContact N-CZ 3.34Å
731	Q	83.2	Confident	90.7	Very high	121 Å²	121	50.7 Å²	50.7	57%	0.565	27%	0.272	S	S	*	.			trans	-88.8	-8.1	-175.1	-61	178.1	28.3	0	0	114.1	K728 E729	K728-Q731 HydrophobicContact CB-CB 4.4Å; K728-Q731 VanDerWaalsContact O-CB 3.3Å; K728-Q731 WeakPolarHBondContact O-CB 3.07Å; K728-Q731 PolarHBondContact O-N 3.08Å; E729-Q731 PolarHBondContact O-N 3.3Å
732	F	87.9	Confident	90.7	Very high	28 Å²	28	54.6 Å²	54.6	12%	0.123	29%	0.287	C	S	.	.	S	Bend	trans	-105.4	138.5	-179.2	-59.9	-61.7	0	0	0	111.8	F724 L725 K728 Q736 L737 M740 L772 Y836	F724-F732 HydrophobicContact CD1-CE2 4.49Å; F724-F732 HydrophobicContact CD1-CZ 4.37Å; F724-F732 HydrophobicContact CE1-CE1 4.31Å; F724-F732 AromaticContact CE1-CE2 3.91Å; F724-F732 HydrophobicContact CE1-CE2 3.91Å; F724-F732 AromaticContact CE1-CZ 3.42Å; F724-F732 HydrophobicContact CE1-CZ 3.42Å; F724-F732 VanDerWaalsContact CE1-CZ 3.42Å; F724-F732 HydrophobicContact CZ-CE1 4.28Å; F724-F732 HydrophobicContact CZ-CE2 4.38Å; F724-F732 AromaticContact CZ-CZ 3.52Å; F724-F732 HydrophobicContact CZ-CZ 3.52Å; L725-F732 HydrophobicContact CD2-CD2 4.13Å; L725-F732 HydrophobicContact CD2-CE2 4.14Å; K728-F732 HydrophobicContact CB-CD2 4.4Å; K728-F732 HydrophobicContact CB-CE2 3.47Å; K728-F732 VanDerWaalsContact CB-CE2 3.47Å; K728-F732 HydrophobicContact CB-CZ 3.71Å; K728-F732 HydrophobicContact CG-CE2 4.23Å; K728-F732 HydrophobicContact CG-CZ 4.01Å; F732-Q736 HydrophobicContact CB-CB 4.37Å; F732-L737 HydrophobicContact CB-CD2 3.78Å; F732-L737 HydrophobicContact CB-CG 3.99Å; F732-L737 HydrophobicContact CD2-CD2 4.01Å; F732-L737 HydrophobicContact CG-CD2 4.2Å; F732-M740 HydrophobicContact CD1-CE 4.35Å; F732-M740 HydrophobicContact CE1-CE 4.19Å; F732-M740 HydrophobicContact CE2-CE 4.36Å; F732-M740 HydrophobicContact CZ-CE 4.22Å; F732-L772 HydrophobicContact CE1-CD1 4.19Å; F732-L772 HydrophobicContact CE1-CD2 4.23Å; F732-Y836 HydrophobicContact CB-CE1 4.44Å; F732-Y836 AromaticContact CD2-CE1 3.75Å; F732-Y836 HydrophobicContact CD2-CE1 3.75Å; F732-Y836 PolarHBondContact N-OH 3.08Å; F732-Y836 PolarHBondContact O-OH 3.44Å
733	S	90.2	Very high	90.9	Very high	56 Å²	56	53.8 Å²	53.8	39%	0.392	28%	0.284	S	S	.	.			trans	-65.9	149	164.8	66.2	0	0	0	0	110.2	L735 Q736 L737	S733-L735 PolarHBondContact O-N 2.98Å; S733-L735 VanDerWaalsContact O-N 3.08Å; S733-Q736 WeakPolarHBondContact O-CB 3.28Å; S733-Q736 PolarHBondContact O-N 3.22Å; S733-Q736 WeakPolarHBondContact OG-CG 3.31Å; S733-Q736 PolarHBondContact OG-N 3.37Å; S733-Q736 PolarHBondContact OG-OE1 3.22Å; S733-L737 PolarHBondContact O-N 2.96Å; S733-L737 VanDerWaalsContact O-N 3.14Å
734	V	88.6	Confident	91.2	Very high	46 Å²	46	51.8 Å²	51.8	28%	0.279	27%	0.27	S	S	.	.	H	α-helix	trans	-51	-36.4	173	174.9	0	0	0	0	111.5	Q736 L737 V738 P866 L869 L904	V734-Q736 PolarHBondContact O-N 3.31Å; V734-L737 PolarHBondContact O-N 3.31Å; V734-V738 HydrophobicContact CG1-CG2 4.34Å; V734-V738 VanDerWaalsContact O-CG2 3.25Å; V734-V738 WeakPolarHBondContact O-CG2 3.44Å; V734-V738 PolarHBondContact O-N 3.26Å; V734-P866 HydrophobicContact CG1-CG 3.46Å; V734-P866 VanDerWaalsContact CG1-CG 3.46Å; V734-L869 HydrophobicContact CG1-CD1 4.49Å; V734-L904 HydrophobicContact CG1-CB 4.39Å; V734-L904 HydrophobicContact CG1-CD1 4.33Å; V734-L904 HydrophobicContact CG1-CD2 4.35Å
735	L	90.1	Very high	91.4	Very high	73 Å²	73	51.3 Å²	51.3	38%	0.382	27%	0.268	S	S	.	.	H	α-helix	trans	-65.2	-37.3	178.2	-173.4	63.7	0	0	0	112.8	S733 V738 G739 I898 P901 L904	S733-L735 PolarHBondContact O-N 2.98Å; S733-L735 VanDerWaalsContact O-N 3.08Å; L735-V738 PolarHBondContact O-N 3.33Å; L735-G739 PolarHBondContact O-N 3.06Å; L735-I898 HydrophobicContact CD1-CB 4.43Å; L735-I898 HydrophobicContact CD1-CG1 4.28Å; L735-I898 HydrophobicContact CD1-CG2 4.39Å; L735-P901 HydrophobicContact CD1-CG 4.48Å; L735-L904 HydrophobicContact CD1-CD1 4.28Å
736	Q	93.3	Very high	91.7	Very high	84 Å²	84	51.4 Å²	51.4	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-67	-42.5	174.5	-73.6	164	-62.3	0	0	111.2	F732 S733 V734 V738 G739 M740	F732-Q736 HydrophobicContact CB-CB 4.37Å; S733-Q736 WeakPolarHBondContact O-CB 3.28Å; S733-Q736 PolarHBondContact O-N 3.22Å; S733-Q736 WeakPolarHBondContact OG-CG 3.31Å; S733-Q736 PolarHBondContact OG-N 3.37Å; S733-Q736 PolarHBondContact OG-OE1 3.22Å; V734-Q736 PolarHBondContact O-N 3.31Å; Q736-V738 VanDerWaalsContact C-N 3.35Å; Q736-V738 PolarHBondContact O-N 2.64Å; Q736-G739 WeakPolarHBondContact O-CA 3.41Å; Q736-G739 PolarHBondContact O-N 2.8Å; Q736-G739 VanDerWaalsContact O-N 3.07Å; Q736-M740 PolarHBondContact O-N 3.43Å
737	L	94.8	Very high	92	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-42.8	174.7	-62	178.9	0	0	0	111.6	L725 F732 S733 V734 G739 M740 L741 V833 M834 Y836	L725-L737 HydrophobicContact CD2-CD2 3.88Å; F732-L737 HydrophobicContact CB-CD2 3.78Å; F732-L737 HydrophobicContact CB-CG 3.99Å; F732-L737 HydrophobicContact CD2-CD2 4.01Å; F732-L737 HydrophobicContact CG-CD2 4.2Å; S733-L737 PolarHBondContact O-N 2.96Å; S733-L737 VanDerWaalsContact O-N 3.14Å; V734-L737 PolarHBondContact O-N 3.31Å; L737-G739 VanDerWaalsContact C-N 3.28Å; L737-G739 PolarHBondContact O-N 3.09Å; L737-M740 HydrophobicContact CD2-SD 4.29Å; L737-M740 WeakPolarHBondContact O-CB 3.24Å; L737-M740 PolarHBondContact O-N 3.13Å; L737-L741 WeakPolarHBondContact O-CG 3.5Å; L737-L741 PolarHBondContact O-N 3.14Å; L737-V833 HydrophobicContact CB-CG1 4Å; L737-V833 HydrophobicContact CD2-CG1 3.92Å; L737-V833 HydrophobicContact CG-CG1 4.46Å; L737-M834 HydrophobicContact CB-SD 4.15Å; L737-M834 HydrophobicContact CD1-CE 4.33Å; L737-M834 HydrophobicContact CD1-SD 4.07Å; L737-Y836 HydrophobicContact CD1-CE2 4.09Å
738	V	95	Very high	92.4	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-37.7	172.5	173.9	0	0	0	0	111.4	V734 L735 Q736 L741 R742 L869 L894 M897 I898 L904	V734-V738 HydrophobicContact CG1-CG2 4.34Å; V734-V738 VanDerWaalsContact O-CG2 3.25Å; V734-V738 WeakPolarHBondContact O-CG2 3.44Å; V734-V738 PolarHBondContact O-N 3.26Å; L735-V738 PolarHBondContact O-N 3.33Å; Q736-V738 VanDerWaalsContact C-N 3.35Å; Q736-V738 PolarHBondContact O-N 2.64Å; V738-L741 PolarHBondContact O-N 2.91Å; V738-R742 VanDerWaalsContact O-CB 3.27Å; V738-R742 WeakPolarHBondContact O-CB 3.36Å; V738-R742 PolarHBondContact O-N 2.94Å; V738-L869 HydrophobicContact CG2-CD1 3.62Å; V738-L869 HydrophobicContact CG2-CD2 4.19Å; V738-L869 HydrophobicContact CG2-CG 4.39Å; V738-L894 HydrophobicContact CG1-CD2 4.19Å; V738-M897 HydrophobicContact CG1-CB 4.43Å; V738-I898 HydrophobicContact CG1-CD1 4.11Å; V738-I898 HydrophobicContact CG1-CG1 3.6Å; V738-L904 HydrophobicContact CG2-CD1 4.18Å; V738-L904 HydrophobicContact CG2-CD2 4.15Å
739	G	95.2	Very high	93.1	Very high	35 Å²	35	39.2 Å²	39.2	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-60.3	-45.3	173.7	0	0	0	0	0	112.9	L735 Q736 L737 R742 G743	L735-G739 PolarHBondContact O-N 3.06Å; Q736-G739 WeakPolarHBondContact O-CA 3.41Å; Q736-G739 PolarHBondContact O-N 2.8Å; Q736-G739 VanDerWaalsContact O-N 3.07Å; L737-G739 VanDerWaalsContact C-N 3.28Å; L737-G739 PolarHBondContact O-N 3.09Å; G739-R742 PolarHBondContact O-N 2.91Å; G739-G743 PolarHBondContact O-N 3.23Å
740	M	98	Very high	93.7	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-50.1	174.1	-67.8	175.5	-177.5	0	0	111.1	L721 F724 L725 F732 Q736 L737 R742 G743 I744 L772 C774	L721-M740 HydrophobicContact CD1-SD 4.05Å; F724-M740 HydrophobicContact CE1-CE 3.89Å; L725-M740 HydrophobicContact CD2-SD 4.39Å; F732-M740 HydrophobicContact CD1-CE 4.35Å; F732-M740 HydrophobicContact CE1-CE 4.19Å; F732-M740 HydrophobicContact CE2-CE 4.36Å; F732-M740 HydrophobicContact CZ-CE 4.22Å; Q736-M740 PolarHBondContact O-N 3.43Å; L737-M740 HydrophobicContact CD2-SD 4.29Å; L737-M740 WeakPolarHBondContact O-CB 3.24Å; L737-M740 PolarHBondContact O-N 3.13Å; M740-R742 VanDerWaalsContact C-N 3.32Å; M740-R742 PolarHBondContact O-N 3.5Å; M740-G743 PolarHBondContact O-N 3.5Å; M740-G743 VanDerWaalsContact O-N 3.12Å; M740-I744 WeakPolarHBondContact O-CG1 3.11Å; M740-I744 PolarHBondContact O-N 3.21Å; M740-I744 VanDerWaalsContact O-N 3.08Å; M740-L772 HydrophobicContact CE-CB 3.99Å; M740-L772 HydrophobicContact CE-CD1 4.17Å; M740-L772 HydrophobicContact CE-CD2 3.99Å; M740-L772 HydrophobicContact CE-CG 4.28Å; M740-C774 VanDerWaalsContact CB-SG 3.53Å
741	L	98.3	Very high	94.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.5	-41.8	177.7	-70.5	177.8	0	0	0	112.9	L737 V738 G743 I744 A745 Y826 M830 V833 L894	L737-L741 WeakPolarHBondContact O-CG 3.5Å; L737-L741 PolarHBondContact O-N 3.14Å; V738-L741 PolarHBondContact O-N 2.91Å; L741-G743 VanDerWaalsContact C-N 3.33Å; L741-I744 PolarHBondContact O-N 3.2Å; L741-A745 WeakPolarHBondContact O-CB 3.23Å; L741-A745 PolarHBondContact O-N 3.22Å; L741-Y826 PolarHBondContact O-OH 2.85Å; L741-M830 HydrophobicContact CD1-CB 4.38Å; L741-M830 HydrophobicContact CD1-CG 4.22Å; L741-M830 HydrophobicContact CD2-CB 4.26Å; L741-M830 HydrophobicContact CD2-CG 3.95Å; L741-V833 HydrophobicContact CD1-CG1 4.42Å; L741-V833 HydrophobicContact CD2-CB 3.77Å; L741-V833 HydrophobicContact CD2-CG1 4.1Å; L741-V833 HydrophobicContact CD2-CG2 3.63Å; L741-V833 HydrophobicContact CG-CB 4.21Å; L741-V833 HydrophobicContact CG-CG1 4.02Å; L741-V833 HydrophobicContact CG-CG2 4.41Å; L741-L894 HydrophobicContact CB-CD1 4.3Å
742	R	97.9	Very high	95	Very high	82 Å²	82	27.1 Å²	27.1	31%	0.309	14%	0.143	S	C	.	.	H	α-helix	trans	-63.7	-40.1	177.2	-175.2	-87.2	-176.6	-157.7	-3.6	111.3	V738 G739 M740 A745 A746 L894 D895 I898	V738-R742 VanDerWaalsContact O-CB 3.27Å; V738-R742 WeakPolarHBondContact O-CB 3.36Å; V738-R742 PolarHBondContact O-N 2.94Å; G739-R742 PolarHBondContact O-N 2.91Å; M740-R742 VanDerWaalsContact C-N 3.32Å; M740-R742 PolarHBondContact O-N 3.5Å; R742-A745 PolarHBondContact O-N 3.47Å; R742-A746 WeakPolarHBondContact O-CB 3.32Å; R742-A746 PolarHBondContact O-N 3.42Å; R742-L894 HydrophobicContact CB-CB 4.02Å; R742-L894 HydrophobicContact CB-CD1 4.21Å; R742-L894 HydrophobicContact CG-CB 4.14Å; R742-D895 WeakPolarHBondContact CG-OD1 3.23Å; R742-D895 IonicContact CZ-OD1 3.6Å; R742-D895 IonicContact NE-OD1 3.41Å; R742-D895 PolarHBondContact NE-OD1 3.35Å; R742-D895 IonicContact NH2-OD1 2.92Å; R742-D895 IonicContact NH2-OD2 2.91Å; R742-I898 HydrophobicContact CB-CD1 3.97Å; R742-I898 HydrophobicContact CG-CD1 3.96Å
743	G	96.8	Very high	95.1	Very high	5 Å²	5	30.5 Å²	30.5	5%	0.052	16%	0.163	C	C	.	.	H	α-helix	trans	-58.5	-51.3	173.6	0	0	0	0	0	111.9	N695 G739 M740 L741 A745 A746 G747	N695-G743 WeakPolarHBondContact CB-O 3.44Å; N695-G743 VanDerWaalsContact ND2-CA 3.35Å; N695-G743 WeakPolarHBondContact ND2-CA 3.34Å; G739-G743 PolarHBondContact O-N 3.23Å; M740-G743 PolarHBondContact O-N 3.5Å; M740-G743 VanDerWaalsContact O-N 3.12Å; L741-G743 VanDerWaalsContact C-N 3.33Å; G743-A745 PolarHBondContact O-N 3.44Å; G743-A746 WeakPolarHBondContact O-CB 3.22Å; G743-A746 PolarHBondContact O-N 3.46Å; G743-A746 VanDerWaalsContact O-N 3.14Å; G743-G747 PolarHBondContact O-N 3.02Å
744	I	98.5	Very high	94.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.2	-46.6	178.5	-59.3	162.3	0	0	0	110.8	L721 M740 L741 A746 G747 M748 L761 I766 C774 V776 Y826 V829	L721-I744 HydrophobicContact CD2-CD1 3.66Å; M740-I744 WeakPolarHBondContact O-CG1 3.11Å; M740-I744 PolarHBondContact O-N 3.21Å; M740-I744 VanDerWaalsContact O-N 3.08Å; L741-I744 PolarHBondContact O-N 3.2Å; I744-A746 VanDerWaalsContact C-N 3.3Å; I744-A746 PolarHBondContact O-N 3.4Å; I744-G747 PolarHBondContact O-N 2.87Å; I744-M748 WeakPolarHBondContact O-CG 3.36Å; I744-M748 PolarHBondContact O-N 2.91Å; I744-L761 HydrophobicContact CG2-CD1 4.42Å; I744-I766 HydrophobicContact CD1-CG1 4.12Å; I744-I766 HydrophobicContact CD1-CG2 4Å; I744-I766 HydrophobicContact CG1-CD1 4.28Å; I744-I766 HydrophobicContact CG1-CG1 4.26Å; I744-I766 HydrophobicContact CG1-CG2 3.86Å; I744-I766 HydrophobicContact CG2-CD1 3.9Å; I744-I766 HydrophobicContact CG2-CG1 4.43Å; I744-C774 HydrophobicContact CD1-CB 4.22Å; I744-C774 HydrophobicContact CG1-CB 3.65Å; I744-V776 HydrophobicContact CG2-CG2 4.33Å; I744-Y826 HydrophobicContact CB-CE2 4.02Å; I744-Y826 HydrophobicContact CG2-CD2 3.94Å; I744-Y826 HydrophobicContact CG2-CE2 3.77Å; I744-V829 HydrophobicContact CD1-CG1 3.97Å
745	A	98.5	Very high	94.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-37.5	177.3	0	0	0	0	0	112.6	L741 R742 G743 M748 R749 Y826 I890 V891 L894	L741-A745 WeakPolarHBondContact O-CB 3.23Å; L741-A745 PolarHBondContact O-N 3.22Å; R742-A745 PolarHBondContact O-N 3.47Å; G743-A745 PolarHBondContact O-N 3.44Å; A745-M748 PolarHBondContact O-N 3.19Å; A745-R749 WeakPolarHBondContact O-CB 3.4Å; A745-R749 PolarHBondContact O-N 3.46Å; A745-Y826 HydrophobicContact CB-CE1 4.45Å; A745-Y826 HydrophobicContact CB-CE2 3.9Å; A745-Y826 WeakPolarHBondContact CB-OH 3.29Å; A745-I890 HydrophobicContact CB-CG2 3.97Å; A745-V891 HydrophobicContact CB-CG2 3.66Å; A745-L894 HydrophobicContact CB-CD1 4.08Å
746	A	98.1	Very high	94.6	Very high	2 Å²	2	28.3 Å²	28.3	2%	0.017	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-40.3	177	0	0	0	0	0	111.8	H693 R742 G743 I744 Y750 V891	H693-A746 PolarHBondContact CE1-O 3.42Å; R742-A746 WeakPolarHBondContact O-CB 3.32Å; R742-A746 PolarHBondContact O-N 3.42Å; G743-A746 WeakPolarHBondContact O-CB 3.22Å; G743-A746 PolarHBondContact O-N 3.46Å; G743-A746 VanDerWaalsContact O-N 3.14Å; I744-A746 VanDerWaalsContact C-N 3.3Å; I744-A746 PolarHBondContact O-N 3.4Å; A746-Y750 PolarHBondContact O-N 2.9Å; A746-Y750 VanDerWaalsContact O-N 3.14Å; A746-V891 HydrophobicContact CB-CG2 4.42Å
747	G	97.2	Very high	94.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-47.1	172.6	0	0	0	0	0	112.2	G743 I744 R749 Y750 L751	G743-G747 PolarHBondContact O-N 3.02Å; I744-G747 PolarHBondContact O-N 2.87Å; G747-R749 PolarHBondContact O-N 3.05Å; G747-Y750 WeakPolarHBondContact O-CB 3.3Å; G747-Y750 PolarHBondContact O-N 2.71Å; G747-L751 WeakPolarHBondContact O-CG 3.41Å; G747-L751 PolarHBondContact O-N 3.31Å
748	M	97.9	Very high	94.2	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-68.7	-32.5	178.7	-69	-55.8	-55	0	0	113.8	I744 A745 L751 S752 H758 L761 V776 D822 F887	I744-M748 WeakPolarHBondContact O-CG 3.36Å; I744-M748 PolarHBondContact O-N 2.91Å; A745-M748 PolarHBondContact O-N 3.19Å; M748-L751 PolarHBondContact O-N 3.45Å; M748-L751 HydrophobicContact SD-CD1 3.92Å; M748-S752 WeakPolarHBondContact O-CB 3.33Å; M748-S752 PolarHBondContact O-N 2.74Å; M748-H758 HydrophobicContact CE-CB 3.9Å; M748-H758 HydrophobicContact SD-CB 4.39Å; M748-L761 HydrophobicContact CE-CD2 4.02Å; M748-L761 HydrophobicContact CG-CD1 4.13Å; M748-L761 HydrophobicContact CG-CD2 3.76Å; M748-L761 HydrophobicContact SD-CD1 3.75Å; M748-L761 HydrophobicContact SD-CD2 3.9Å; M748-L761 HydrophobicContact SD-CG 4.36Å; M748-V776 HydrophobicContact CG-CG2 4.2Å; M748-V776 HydrophobicContact SD-CG1 3.92Å; M748-V776 HydrophobicContact SD-CG2 4.11Å; M748-D822 HydrophobicContact CE-CB 3.73Å; M748-F887 HydrophobicContact CB-CD1 3.57Å; M748-F887 HydrophobicContact CB-CD2 4.03Å; M748-F887 HydrophobicContact CB-CE1 3.33Å; M748-F887 HydrophobicContact CB-CE2 3.81Å; M748-F887 HydrophobicContact CB-CG 3.93Å; M748-F887 HydrophobicContact CB-CZ 3.47Å; M748-F887 VanDerWaalsContact CB-CZ 3.47Å; M748-F887 HydrophobicContact CE-CE2 4.07Å; M748-F887 HydrophobicContact CE-CZ 3.97Å; M748-F887 HydrophobicContact CG-CE1 3.97Å; M748-F887 HydrophobicContact CG-CZ 3.99Å
749	R	97.1	Very high	94	Very high	84 Å²	84	27.6 Å²	27.6	32%	0.317	14%	0.141	S	C	.	.	H	α-helix	trans	-58.4	-49.9	169.1	-174.8	-172.6	66.2	165.3	1	110.5	A745 G747 L751 S752 D753 F887 E888 V891	A745-R749 WeakPolarHBondContact O-CB 3.4Å; A745-R749 PolarHBondContact O-N 3.46Å; G747-R749 PolarHBondContact O-N 3.05Å; R749-L751 PolarHBondContact O-N 3.34Å; R749-S752 WeakPolarHBondContact O-CB 3.23Å; R749-S752 PolarHBondContact O-N 3.07Å; R749-D753 VanDerWaalsContact O-CG 3.24Å; R749-D753 PolarHBondContact O-N 3.25Å; R749-F887 HydrophobicContact CB-CB 3.75Å; R749-F887 HydrophobicContact CG-CB 4.28Å; R749-E888 HydrophobicContact CG-CB 4.43Å; R749-V891 HydrophobicContact CB-CG2 4.43Å
750	Y	95.9	Very high	93.7	Very high	41 Å²	41	26.4 Å²	26.4	16%	0.161	13%	0.127	C	C	.	.	H	α-helix	trans	-58.7	-46.1	178.5	169.7	-95.7	0	0	0	112.1	F691 E692 H693 V696 A746 G747 S752 D753 M754	F691-Y750 HydrophobicContact CB-CE1 3.95Å; F691-Y750 HydrophobicContact CD1-CE1 4.02Å; F691-Y750 HydrophobicContact CG-CE1 4.26Å; E692-Y750 PolarHBondContact N-OH 2.87Å; H693-Y750 HydrophobicContact CB-CD1 3.68Å; H693-Y750 HydrophobicContact CB-CD2 4.14Å; H693-Y750 HydrophobicContact CB-CE1 3.99Å; H693-Y750 HydrophobicContact CB-CE2 4.4Å; H693-Y750 HydrophobicContact CB-CG 3.75Å; H693-Y750 AromaticContact CD2-CD2 3.99Å; H693-Y750 AromaticContact CD2-CG 3.87Å; H693-Y750 AromaticContact CG-CG 3.84Å; V696-Y750 HydrophobicContact CG2-CD1 4.07Å; A746-Y750 PolarHBondContact O-N 2.9Å; A746-Y750 VanDerWaalsContact O-N 3.14Å; G747-Y750 WeakPolarHBondContact O-CB 3.3Å; G747-Y750 PolarHBondContact O-N 2.71Å; Y750-S752 VanDerWaalsContact C-N 3.35Å; Y750-S752 PolarHBondContact O-N 3.33Å; Y750-D753 PolarHBondContact O-N 3Å; Y750-M754 HydrophobicContact CE1-CG 4.15Å; Y750-M754 HydrophobicContact CE2-CG 4.2Å; Y750-M754 WeakPolarHBondContact O-CG 3.5Å; Y750-M754 PolarHBondContact O-N 3.47Å
751	L	93.4	Very high	93.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-42.8	176.4	-67.1	178.4	0	0	0	111.8	F691 V696 G747 M748 R749 D753 M754 N755 Y756 V776 F779	F691-L751 HydrophobicContact CD1-CD2 3.95Å; F691-L751 HydrophobicContact CD2-CD2 3.75Å; F691-L751 HydrophobicContact CE1-CD2 3.91Å; F691-L751 HydrophobicContact CE2-CD2 3.68Å; F691-L751 HydrophobicContact CG-CD2 3.89Å; F691-L751 HydrophobicContact CZ-CD2 3.79Å; V696-L751 HydrophobicContact CG2-CD2 4.38Å; V696-L751 HydrophobicContact CG2-CG 4.27Å; G747-L751 WeakPolarHBondContact O-CG 3.41Å; G747-L751 PolarHBondContact O-N 3.31Å; M748-L751 PolarHBondContact O-N 3.45Å; M748-L751 HydrophobicContact SD-CD1 3.92Å; R749-L751 PolarHBondContact O-N 3.34Å; L751-D753 VanDerWaalsContact C-N 3.34Å; L751-D753 PolarHBondContact O-N 2.74Å; L751-M754 CarbonylContact O-C 3.59Å; L751-M754 WeakPolarHBondContact O-CB 3.1Å; L751-M754 PolarHBondContact O-N 2.92Å; L751-N755 PolarHBondContact O-N 3.41Å; L751-Y756 CarbonylContact C-O 3.54Å; L751-Y756 HydrophobicContact CB-CD1 4.25Å; L751-Y756 HydrophobicContact CD1-CD1 4.25Å; L751-Y756 HydrophobicContact CD2-CD1 4.05Å; L751-Y756 HydrophobicContact CG-CD1 4.41Å; L751-Y756 WeakPolarHBondContact O-CB 3.43Å; L751-Y756 PolarHBondContact O-N 3.4Å; L751-V776 HydrophobicContact CD1-CG1 4.01Å; L751-F779 HydrophobicContact CD1-CE1 4.07Å; L751-F779 HydrophobicContact CD2-CE1 4.47Å
752	S	92	Very high	93.4	Very high	28 Å²	28	26.3 Å²	26.3	20%	0.196	13%	0.126	C	C	.	.	H	α-helix	trans	-62.3	-39.3	175.5	-178.6	0	0	0	0	112.7	M748 R749 Y750 M754 N755 S819	M748-S752 WeakPolarHBondContact O-CB 3.33Å; M748-S752 PolarHBondContact O-N 2.74Å; R749-S752 WeakPolarHBondContact O-CB 3.23Å; R749-S752 PolarHBondContact O-N 3.07Å; Y750-S752 VanDerWaalsContact C-N 3.35Å; Y750-S752 PolarHBondContact O-N 3.33Å; S752-M754 VanDerWaalsContact C-N 3.26Å; S752-M754 PolarHBondContact O-N 2.98Å; S752-N755 WeakPolarHBondContact O-CA 3.4Å; S752-N755 PolarHBondContact O-N 3.04Å; S752-S819 WeakPolarHBondContact CB-OG 3.14Å; S752-S819 WeakPolarHBondContact OG-CB 3.34Å; S752-S819 PolarHBondContact OG-OG 3.45Å
753	D	90.1	Very high	93.4	Very high	99 Å²	99	22.4 Å²	22.4	53%	0.529	11%	0.111	S	C	.	.	H	α-helix	trans	-67.6	-30.3	177.8	-68	-19.5	0	0	0	111.3	R749 Y750 L751 N755	R749-D753 VanDerWaalsContact O-CG 3.24Å; R749-D753 PolarHBondContact O-N 3.25Å; Y750-D753 PolarHBondContact O-N 3Å; L751-D753 VanDerWaalsContact C-N 3.34Å; L751-D753 PolarHBondContact O-N 2.74Å; D753-N755 PolarHBondContact O-N 3.28Å
754	M	86.1	Confident	93.3	Very high	11 Å²	11	25.9 Å²	25.9	5%	0.054	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	1.4	170.4	-68	-71.9	-64.4	0	0	113.2	K608 Y610 F691 Y750 L751 S752 Y756	K608-M754 HydrophobicContact CB-CE 4.36Å; K608-M754 HydrophobicContact CB-SD 4.09Å; K608-M754 HydrophobicContact CD-CE 3.99Å; K608-M754 HydrophobicContact CD-SD 4.35Å; K608-M754 HydrophobicContact CG-CE 3.98Å; K608-M754 HydrophobicContact CG-SD 4.33Å; Y610-M754 VanDerWaalsContact CB-O 3.24Å; Y610-M754 WeakPolarHBondContact CB-O 3.39Å; Y610-M754 PolarHBondContact N-O 3.34Å; F691-M754 HydrophobicContact CD1-CE 4.42Å; F691-M754 HydrophobicContact CE1-CB 4.42Å; F691-M754 HydrophobicContact CE1-CE 4.47Å; Y750-M754 HydrophobicContact CE1-CG 4.15Å; Y750-M754 HydrophobicContact CE2-CG 4.2Å; Y750-M754 WeakPolarHBondContact O-CG 3.5Å; Y750-M754 PolarHBondContact O-N 3.47Å; L751-M754 CarbonylContact O-C 3.59Å; L751-M754 WeakPolarHBondContact O-CB 3.1Å; L751-M754 PolarHBondContact O-N 2.92Å; S752-M754 VanDerWaalsContact C-N 3.26Å; S752-M754 PolarHBondContact O-N 2.98Å; M754-Y756 PolarHBondContact O-N 3.16Å
755	N	84.6	Confident	93.1	Very high	112 Å²	112	26.4 Å²	26.4	60%	0.599	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	27.3	-171.1	-69.6	-39.6	0	0	0	114.3	Y609 L751 S752 D753	Y609-N755 WeakPolarHBondContact CD1-ND2 3.46Å; Y609-N755 WeakPolarHBondContact CE1-ND2 3.25Å; L751-N755 PolarHBondContact O-N 3.41Å; S752-N755 WeakPolarHBondContact O-CA 3.4Å; S752-N755 PolarHBondContact O-N 3.04Å; D753-N755 PolarHBondContact O-N 3.28Å
756	Y	88.4	Confident	93	Very high	6 Å²	6	26.4 Å²	26.4	2%	0.024	13%	0.126	C	C	.	.			trans	-92.5	138.6	173.9	-173.7	-98	0	0	0	111	Y610 I687 F691 L751 M754 H758 F779 S782	Y610-Y756 AromaticContact CD1-CD2 3.88Å; Y610-Y756 HydrophobicContact CD1-CD2 3.88Å; Y610-Y756 AromaticContact CD2-CD2 3.67Å; Y610-Y756 HydrophobicContact CD2-CD2 3.67Å; Y610-Y756 HydrophobicContact CD2-CE2 4.27Å; Y610-Y756 AromaticContact CE1-CD2 3.83Å; Y610-Y756 HydrophobicContact CE1-CD2 3.83Å; Y610-Y756 HydrophobicContact CE1-CE2 4.18Å; Y610-Y756 AromaticContact CE2-CD2 3.6Å; Y610-Y756 HydrophobicContact CE2-CD2 3.6Å; Y610-Y756 AromaticContact CE2-CE2 3.73Å; Y610-Y756 HydrophobicContact CE2-CE2 3.73Å; Y610-Y756 AromaticContact CG-CD2 3.8Å; Y610-Y756 HydrophobicContact CG-CD2 3.8Å; Y610-Y756 AromaticContact CZ-CD2 3.68Å; Y610-Y756 AromaticContact CZ-CE2 3.68Å; I687-Y756 HydrophobicContact CG2-CE2 3.82Å; F691-Y756 HydrophobicContact CE1-CG 4.38Å; F691-Y756 HydrophobicContact CE2-CD1 4.26Å; F691-Y756 HydrophobicContact CE2-CD2 4.42Å; F691-Y756 HydrophobicContact CE2-CE1 4.32Å; F691-Y756 HydrophobicContact CE2-CE2 4.47Å; F691-Y756 HydrophobicContact CE2-CG 4.29Å; F691-Y756 AromaticContact CZ-CD1 3.95Å; F691-Y756 HydrophobicContact CZ-CD1 3.95Å; F691-Y756 AromaticContact CZ-CD2 3.68Å; F691-Y756 HydrophobicContact CZ-CD2 3.68Å; F691-Y756 HydrophobicContact CZ-CE1 4.37Å; F691-Y756 HydrophobicContact CZ-CE2 4.12Å; F691-Y756 AromaticContact CZ-CG 3.56Å; F691-Y756 HydrophobicContact CZ-CG 3.56Å; L751-Y756 CarbonylContact C-O 3.54Å; L751-Y756 HydrophobicContact CB-CD1 4.25Å; L751-Y756 HydrophobicContact CD1-CD1 4.25Å; L751-Y756 HydrophobicContact CD2-CD1 4.05Å; L751-Y756 HydrophobicContact CG-CD1 4.41Å; L751-Y756 WeakPolarHBondContact O-CB 3.43Å; L751-Y756 PolarHBondContact O-N 3.4Å; M754-Y756 PolarHBondContact O-N 3.16Å; Y756-H758 HydrophobicContact CE1-CB 4.48Å; Y756-F779 AromaticContact CE1-CD1 3.6Å; Y756-F779 HydrophobicContact CE1-CD1 3.6Å; Y756-F779 AromaticContact CE1-CE1 3.92Å; Y756-F779 HydrophobicContact CE1-CE1 3.92Å; Y756-F779 AromaticContact CZ-CD1 3.77Å; Y756-F779 WeakPolarHBondContact OH-CD1 3.27Å; Y756-S782 WeakPolarHBondContact OH-CB 3.43Å; Y756-S782 PolarHBondContact OH-OG 2.86Å
757	V	89.1	Confident	93	Very high	27 Å²	27	28.4 Å²	28.4	16%	0.164	14%	0.136	C	C	.	.			trans	-117.1	122.5	176	-174.2	0	0	0	0	108	R759 F817 D822	V757-R759 HydrophobicContact CB-CG 4.4Å; V757-R759 HydrophobicContact CG1-CG 3.87Å; V757-F817 HydrophobicContact CG1-CB 4.11Å; V757-D822 WeakPolarHBondContact CA-OD2 3.48Å; V757-D822 WeakPolarHBondContact CG1-OD2 3.08Å
758	H	91	Very high	93	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.009	14%	0.136	C	C	.	.			trans	-76.1	-39.5	-173	-171.1	-44.6	0	0	0	113.2	M748 Y756 D760 V776 S777 D778 D822	M748-H758 HydrophobicContact CE-CB 3.9Å; M748-H758 HydrophobicContact SD-CB 4.39Å; Y756-H758 HydrophobicContact CE1-CB 4.48Å; H758-D760 PolarHBondContact CE1-O 2.82Å; H758-D760 VanDerWaalsContact CE1-O 3.27Å; H758-D760 PolarHBondContact ND1-N 3.02Å; H758-D760 PolarHBondContact O-N 2.8Å; H758-V776 WeakPolarHBondContact CD2-CG1 3.38Å; H758-V776 VanDerWaalsContact NE2-CG1 3.35Å; H758-V776 WeakPolarHBondContact NE2-CG1 3.35Å; H758-S777 PolarHBondContact CE1-O 3.49Å; H758-S777 PolarHBondContact NE2-O 3.46Å; H758-S777 VanDerWaalsContact NE2-O 3.08Å; H758-D778 PolarHBondContact CE1-O 2.91Å; H758-D822 PolarHBondContact N-OD2 3.12Å
759	R	89.2	Confident	92.8	Very high	42 Å²	42	29.6 Å²	29.6	16%	0.158	14%	0.142	C	C	.	.	S	Bend	trans	68.6	-18.4	175.2	-45.3	-176.4	-171	-168.4	6.3	117.1	V757 R783 F817 D822	V757-R759 HydrophobicContact CB-CG 4.4Å; V757-R759 HydrophobicContact CG1-CG 3.87Å; R759-R783 PolarHBondContact NH1-O 2.85Å; R759-F817 HydrophobicContact CB-CD1 3.82Å; R759-F817 HydrophobicContact CB-CE1 4.05Å; R759-F817 HydrophobicContact CB-CG 4.46Å; R759-F817 HydrophobicContact CG-CB 4.03Å; R759-F817 HydrophobicContact CG-CD1 3.77Å; R759-F817 HydrophobicContact CG-CE1 4.42Å; R759-F817 HydrophobicContact CG-CG 3.95Å; R759-D822 PolarHBondContact N-OD1 3.06Å
760	D	89.2	Confident	92.5	Very high	10 Å²	10	28.7 Å²	28.7	5%	0.053	15%	0.149	C	C	.	.			trans	-133.5	52.4	172.7	-168.4	19.6	0	0	0	112.4	H758 A762 R764 N765 L781 P803	H758-D760 PolarHBondContact CE1-O 2.82Å; H758-D760 VanDerWaalsContact CE1-O 3.27Å; H758-D760 PolarHBondContact ND1-N 3.02Å; H758-D760 PolarHBondContact O-N 2.8Å; D760-A762 PolarHBondContact O-N 2.78Å; D760-R764 IonicContact OD1-CZ 3.26Å; D760-R764 IonicContact OD1-NH2 2.78Å; D760-R764 PolarHBondContact OD1-NH2 3.44Å; D760-R764 IonicContact OD2-CZ 3.8Å; D760-R764 IonicContact OD2-NH2 3.37Å; D760-R764 PolarHBondContact OD2-NH2 2.89Å; D760-N765 PolarHBondContact O-ND2 2.83Å; D760-N765 PolarHBondContact OD2-ND2 3.21Å; D760-L781 HydrophobicContact CB-CB 4.46Å; D760-L781 HydrophobicContact CB-CD1 3.63Å; D760-L781 WeakPolarHBondContact OD2-CD1 3.47Å; D760-P803 HydrophobicContact CB-CG 4.39Å; D760-P803 VanDerWaalsContact OD1-CG 3.23Å; D760-P803 WeakPolarHBondContact OD1-CG 3.16Å
761	L	95.3	Very high	92.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.			trans	-76.7	112.5	174	-177.7	66.7	0	0	0	110.1	I744 M748 I766 V776 S825 Y826 V829	I744-L761 HydrophobicContact CG2-CD1 4.42Å; M748-L761 HydrophobicContact CE-CD2 4.02Å; M748-L761 HydrophobicContact CG-CD1 4.13Å; M748-L761 HydrophobicContact CG-CD2 3.76Å; M748-L761 HydrophobicContact SD-CD1 3.75Å; M748-L761 HydrophobicContact SD-CD2 3.9Å; M748-L761 HydrophobicContact SD-CG 4.36Å; L761-I766 HydrophobicContact CD1-CD1 3.86Å; L761-V776 HydrophobicContact CD1-CG1 4.45Å; L761-S825 WeakPolarHBondContact O-CB 3.49Å; L761-Y826 HydrophobicContact CD2-CD2 4.25Å; L761-V829 HydrophobicContact CG-CG2 4.16Å
762	A	95.8	Very high	92.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.			trans	-150.9	159.3	178.1	0	0	0	0	0	110.1	D760 R764 N765 W806	D760-A762 PolarHBondContact O-N 2.78Å; A762-R764 HydrophobicContact CB-CG 3.98Å; A762-R764 PolarHBondContact O-N 3.03Å; A762-R764 VanDerWaalsContact O-N 3.17Å; A762-N765 PolarHBondContact O-N 3.37Å; A762-W806 HydrophobicContact CB-CD2 4.21Å; A762-W806 HydrophobicContact CB-CG 4.01Å
763	A	97.1	Very high	92.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-58.2	-31.9	-179.3	0	0	0	0	0	113.4	L721 D722 N765 I766 E832	L721-A763 WeakPolarHBondContact CB-O 3.34Å; L721-A763 PolarHBondContact N-O 3.17Å; D722-A763 HydrophobicContact CB-CB 3.89Å; A763-N765 PolarHBondContact O-N 3.09Å; A763-I766 PolarHBondContact O-N 2.03Å; A763-I766 VanDerWaalsContact O-N 3.15Å; A763-E832 HydrophobicContact CB-CB 4.02Å; A763-E832 HydrophobicContact CB-CG 4.49Å; A763-E832 PolarHBondContact N-OE2 3.07Å; A763-E832 VanDerWaalsContact N-OE2 3.08Å
764	R	94	Very high	92.9	Very high	78 Å²	78	31.5 Å²	31.5	29%	0.294	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-62.4	-23.7	174	64.1	176.1	-171.6	-76.8	-6.5	114.5	S720 D722 D760 A762	S720-R764 WeakPolarHBondContact CB-O 3.44Å; D722-R764 WeakPolarHBondContact OD1-CA 3.12Å; D760-R764 IonicContact OD1-CZ 3.26Å; D760-R764 IonicContact OD1-NH2 2.78Å; D760-R764 PolarHBondContact OD1-NH2 3.44Å; D760-R764 IonicContact OD2-CZ 3.8Å; D760-R764 IonicContact OD2-NH2 3.37Å; D760-R764 PolarHBondContact OD2-NH2 2.89Å; A762-R764 HydrophobicContact CB-CG 3.98Å; A762-R764 PolarHBondContact O-N 3.03Å; A762-R764 VanDerWaalsContact O-N 3.17Å
765	N	94.7	Very high	93.4	Very high	11 Å²	11	32 Å²	32	6%	0.059	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-100.5	10.4	180	-65.1	-9.3	0	0	0	111.9	D760 A762 A763 S777 D778	D760-N765 PolarHBondContact O-ND2 2.83Å; D760-N765 PolarHBondContact OD2-ND2 3.21Å; A762-N765 PolarHBondContact O-N 3.37Å; A763-N765 PolarHBondContact O-N 3.09Å; N765-S777 CarbonylContact O-C 3.55Å; N765-S777 PolarHBondContact O-N 2.58Å; N765-S777 PolarHBondContact O-OG 3.44Å; N765-D778 HydrophobicContact CB-CB 4.11Å; N765-D778 PolarHBondContact OD1-OD2 3.01Å
766	I	98	Very high	94	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.4	171	-54.8	-55	0	0	0	108.3	S720 L721 I744 L761 A763 C774 K775 V776	S720-I766 CarbonylContact C-O 3.47Å; S720-I766 WeakPolarHBondContact CA-O 3.4Å; L721-I766 HydrophobicContact CB-CB 3.86Å; L721-I766 HydrophobicContact CB-CG2 4.05Å; L721-I766 WeakPolarHBondContact CB-O 3.4Å; L721-I766 HydrophobicContact CD2-CB 3.99Å; L721-I766 HydrophobicContact CD2-CG1 4.41Å; L721-I766 HydrophobicContact CD2-CG2 3.83Å; L721-I766 PolarHBondContact N-O 3.23Å; I744-I766 HydrophobicContact CD1-CG1 4.12Å; I744-I766 HydrophobicContact CD1-CG2 4Å; I744-I766 HydrophobicContact CG1-CD1 4.28Å; I744-I766 HydrophobicContact CG1-CG1 4.26Å; I744-I766 HydrophobicContact CG1-CG2 3.86Å; I744-I766 HydrophobicContact CG2-CD1 3.9Å; I744-I766 HydrophobicContact CG2-CG1 4.43Å; L761-I766 HydrophobicContact CD1-CD1 3.86Å; A763-I766 PolarHBondContact O-N 2.03Å; A763-I766 VanDerWaalsContact O-N 3.15Å; I766-C774 HydrophobicContact CG2-CB 3.65Å; I766-K775 CarbonylContact C-O 3.6Å; I766-K775 WeakPolarHBondContact CA-O 3.24Å; I766-V776 HydrophobicContact CD1-CB 4.3Å; I766-V776 HydrophobicContact CD1-CG1 4.49Å; I766-V776 HydrophobicContact CD1-CG2 3.94Å
767	L	96.6	Very high	94.2	Very high	44 Å²	44	27 Å²	27	23%	0.23	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	149.5	175.2	-63.1	174.6	0	0	0	111.2	I697 M716 G719 C774 K775	I697-L767 HydrophobicContact CD1-CD1 3.97Å; I697-L767 HydrophobicContact CG1-CD1 4.44Å; M716-L767 HydrophobicContact CB-CB 3.8Å; M716-L767 HydrophobicContact CB-CD1 4.33Å; M716-L767 VanDerWaalsContact CE-C 3.46Å; M716-L767 HydrophobicContact CE-CB 3.84Å; M716-L767 VanDerWaalsContact CE-O 3.31Å; M716-L767 WeakPolarHBondContact CE-O 3.35Å; M716-L767 HydrophobicContact CG-CB 3.65Å; M716-L767 HydrophobicContact CG-CD1 3.93Å; M716-L767 HydrophobicContact CG-CG 4.41Å; G719-L767 CarbonylContact O-C 3.56Å; G719-L767 WeakPolarHBondContact O-CA 3.39Å; L767-C774 CarbonylContact O-C 3.6Å; L767-C774 WeakPolarHBondContact O-CA 3.34Å; L767-K775 PolarHBondContact N-O 3.48Å; L767-K775 PolarHBondContact O-N 2.83Å
768	V	97.1	Very high	93.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132	-176.8	-169.8	0	0	0	0	110.1	M716 N718 G719 L721 F724	M716-V768 CarbonylContact C-O 3.57Å; N718-V768 WeakPolarHBondContact CA-O 3.46Å; N718-V768 HydrophobicContact CB-CB 3.92Å; N718-V768 HydrophobicContact CB-CG1 4.14Å; N718-V768 WeakPolarHBondContact CB-O 3.32Å; N718-V768 PolarHBondContact N-O 3.15Å; G719-V768 PolarHBondContact O-N 3.17Å; L721-V768 HydrophobicContact CB-CG2 3.76Å; L721-V768 HydrophobicContact CD1-CG2 3.6Å; L721-V768 HydrophobicContact CG-CG2 4.26Å; F724-V768 HydrophobicContact CD1-CB 4.41Å; F724-V768 HydrophobicContact CD1-CG1 4.16Å; F724-V768 HydrophobicContact CD1-CG2 4.23Å; F724-V768 HydrophobicContact CE1-CG1 4.06Å
769	N	94.3	Very high	93.4	Very high	26 Å²	26	28.8 Å²	28.8	14%	0.139	15%	0.151	C	C	.	.			trans	-94.9	174.9	174.9	77.8	2	0	0	0	112	M716 E717 N718 N771 L772 V773	M716-N769 HydrophobicContact CE-CB 3.9Å; M716-N769 HydrophobicContact SD-CB 4.07Å; E717-N769 WeakPolarHBondContact OE2-CA 3.37Å; E717-N769 VanDerWaalsContact OE2-CB 3.26Å; E717-N769 WeakPolarHBondContact OE2-CB 3.44Å; N718-N769 PolarHBondContact ND2-O 2.93Å; N769-N771 PolarHBondContact O-N 2.97Å; N769-N771 WeakPolarHBondContact OD1-CA 3.36Å; N769-N771 PolarHBondContact OD1-N 2.76Å; N769-L772 PolarHBondContact O-N 3.07Å; N769-L772 PolarHBondContact OD1-N 2.88Å; N769-V773 PolarHBondContact N-O 2.96Å; N769-V773 WeakPolarHBondContact OD1-CB 3.41Å; N769-V773 PolarHBondContact OD1-N 3.22Å
770	S	91.8	Very high	92	Very high	66 Å²	66	28.4 Å²	28.4	46%	0.462	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-24.4	178.7	50.8	0	0	0	0	114.6	E717	E717-S770 WeakPolarHBondContact OE1-CB 3.33Å; E717-S770 PolarHBondContact OE1-OG 2.8Å; E717-S770 PolarHBondContact OE2-N 3.49Å
771	N	91.9	Very high	90.3	Very high	127 Å²	127	31.2 Å²	31.2	68%	0.679	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	14.5	178.1	-63.2	-63.5	0	0	0	113.6	N769 V773	N769-N771 PolarHBondContact O-N 2.97Å; N769-N771 WeakPolarHBondContact OD1-CA 3.36Å; N769-N771 PolarHBondContact OD1-N 2.76Å; N771-V773 HydrophobicContact CB-CG2 4.26Å; N771-V773 PolarHBondContact O-N 2.9Å
772	L	93	Very high	88.3	Confident	49 Å²	49	31.8 Å²	31.8	26%	0.257	18%	0.179	S	C	.	.			trans	61.7	21.6	-176.6	-49.9	178.9	0	0	0	114	F724 F732 M740 N769 C774	F724-L772 HydrophobicContact CE1-CD2 3.77Å; F724-L772 HydrophobicContact CZ-CD2 3.46Å; F724-L772 VanDerWaalsContact CZ-CD2 3.46Å; F732-L772 HydrophobicContact CE1-CD1 4.19Å; F732-L772 HydrophobicContact CE1-CD2 4.23Å; M740-L772 HydrophobicContact CE-CB 3.99Å; M740-L772 HydrophobicContact CE-CD1 4.17Å; M740-L772 HydrophobicContact CE-CD2 3.99Å; M740-L772 HydrophobicContact CE-CG 4.28Å; N769-L772 PolarHBondContact O-N 3.07Å; N769-L772 PolarHBondContact OD1-N 2.88Å; L772-C774 PolarHBondContact O-N 3.44Å
773	V	95.6	Very high	86.4	Confident	50 Å²	50	37.7 Å²	37.7	30%	0.303	20%	0.202	S	C	.	.			trans	-79.4	118.5	174	-177.9	0	0	0	0	108.6	N769 N771	N769-V773 PolarHBondContact N-O 2.96Å; N769-V773 WeakPolarHBondContact OD1-CB 3.41Å; N769-V773 PolarHBondContact OD1-N 3.22Å; N771-V773 HydrophobicContact CB-CG2 4.26Å; N771-V773 PolarHBondContact O-N 2.9Å
774	C	97.8	Very high	83.9	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.007	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.7	174.4	-64.6	0	0	0	0	111.2	N695 M740 I744 I766 L767 L772	N695-C774 PolarHBondContact ND2-O 3.2Å; M740-C774 VanDerWaalsContact CB-SG 3.53Å; I744-C774 HydrophobicContact CD1-CB 4.22Å; I744-C774 HydrophobicContact CG1-CB 3.65Å; I766-C774 HydrophobicContact CG2-CB 3.65Å; L767-C774 CarbonylContact O-C 3.6Å; L767-C774 WeakPolarHBondContact O-CA 3.34Å; L772-C774 PolarHBondContact O-N 3.44Å
775	K	97.8	Very high	81.3	Confident	22 Å²	22	44.2 Å²	44.2	10%	0.096	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.8	175.5	-59.3	-164.6	177.7	-150.2	0	111.2	P694 N695 E714 M716 I766 L767	P694-K775 WeakPolarHBondContact O-CE 3.49Å; P694-K775 PolarHBondContact O-NZ 3.33Å; N695-K775 WeakPolarHBondContact O-CA 3.42Å; E714-K775 VanDerWaalsContact OE1-CD 3.22Å; E714-K775 WeakPolarHBondContact OE1-CD 3.49Å; E714-K775 WeakPolarHBondContact OE1-CE 3.36Å; E714-K775 IonicContact OE1-NZ 3.7Å; E714-K775 PolarHBondContact OE1-NZ 2.84Å; E714-K775 VanDerWaalsContact OE2-CE 3.27Å; E714-K775 WeakPolarHBondContact OE2-CE 3.43Å; E714-K775 IonicContact OE2-NZ 2.93Å; E714-K775 PolarHBondContact OE2-NZ 2.98Å; M716-K775 HydrophobicContact CE-CB 3.92Å; M716-K775 HydrophobicContact CE-CD 3.88Å; M716-K775 HydrophobicContact CE-CG 3.66Å; M716-K775 HydrophobicContact SD-CD 3.94Å; M716-K775 HydrophobicContact SD-CG 4.39Å; I766-K775 CarbonylContact C-O 3.6Å; I766-K775 WeakPolarHBondContact CA-O 3.24Å; L767-K775 PolarHBondContact N-O 3.48Å; L767-K775 PolarHBondContact O-N 2.83Å
776	V	97.2	Very high	78.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.1	174.1	-177.9	0	0	0	0	109.3	N695 I697 I744 M748 L751 H758 L761 I766	N695-V776 PolarHBondContact O-N 2.82Å; I697-V776 PolarHBondContact N-O 3.37Å; I744-V776 HydrophobicContact CG2-CG2 4.33Å; M748-V776 HydrophobicContact CG-CG2 4.2Å; M748-V776 HydrophobicContact SD-CG1 3.92Å; M748-V776 HydrophobicContact SD-CG2 4.11Å; L751-V776 HydrophobicContact CD1-CG1 4.01Å; H758-V776 WeakPolarHBondContact CD2-CG1 3.38Å; H758-V776 VanDerWaalsContact NE2-CG1 3.35Å; H758-V776 WeakPolarHBondContact NE2-CG1 3.35Å; L761-V776 HydrophobicContact CD1-CG1 4.45Å; I766-V776 HydrophobicContact CD1-CB 4.3Å; I766-V776 HydrophobicContact CD1-CG1 4.49Å; I766-V776 HydrophobicContact CD1-CG2 3.94Å
777	S	92.6	Very high	75.6	Confident	11 Å²	11	58.5 Å²	58.5	8%	0.077	31%	0.306	C	S	.	.			trans	-143.6	-179.2	-176	71.4	0	0	0	0	111.4	H758 N765	H758-S777 PolarHBondContact CE1-O 3.49Å; H758-S777 PolarHBondContact NE2-O 3.46Å; H758-S777 VanDerWaalsContact NE2-O 3.08Å; N765-S777 CarbonylContact O-C 3.55Å; N765-S777 PolarHBondContact O-N 2.58Å; N765-S777 PolarHBondContact O-OG 3.44Å
778	D	82.7	Confident	72.4	Confident	66 Å²	66	63.1 Å²	63.1	35%	0.353	33%	0.331	S	S	.	.			trans	61.4	86.3	179.2	-161.8	-1.5	0	0	0	114.8	H758 N765 G780	H758-D778 PolarHBondContact CE1-O 2.91Å; N765-D778 HydrophobicContact CB-CB 4.11Å; N765-D778 PolarHBondContact OD1-OD2 3.01Å; D778-G780 PolarHBondContact OD1-N 2.62Å
779	F	79.6	Confident	69.6	Low	1 Å²	1	68.2 Å²	68.2	0%	0.004	37%	0.373	C	S	.	.			trans	-99	12.3	-178.7	-58	-76.3	0	0	0	113.2	I687 M688 F691 V696 I697 L751 Y756 L781 S782	I687-F779 HydrophobicContact CB-CB 4.39Å; I687-F779 HydrophobicContact CD1-CB 4.41Å; I687-F779 HydrophobicContact CG2-CB 3.84Å; I687-F779 HydrophobicContact CG2-CD1 4.17Å; I687-F779 HydrophobicContact CG2-CG 3.94Å; M688-F779 HydrophobicContact CG-CD2 3.38Å; M688-F779 HydrophobicContact CG-CE2 3.64Å; M688-F779 HydrophobicContact CG-CG 4.49Å; M688-F779 HydrophobicContact SD-CD2 4.18Å; M688-F779 HydrophobicContact SD-CE2 4.42Å; F691-F779 HydrophobicContact CD2-CE1 4.31Å; F691-F779 HydrophobicContact CD2-CZ 4.16Å; F691-F779 HydrophobicContact CE2-CD1 4.34Å; F691-F779 HydrophobicContact CE2-CE1 4.03Å; F691-F779 HydrophobicContact CE2-CZ 4.33Å; V696-F779 HydrophobicContact CG1-CZ 3.88Å; I697-F779 HydrophobicContact CG2-CE2 3.81Å; L751-F779 HydrophobicContact CD1-CE1 4.07Å; L751-F779 HydrophobicContact CD2-CE1 4.47Å; Y756-F779 AromaticContact CE1-CD1 3.6Å; Y756-F779 HydrophobicContact CE1-CD1 3.6Å; Y756-F779 AromaticContact CE1-CE1 3.92Å; Y756-F779 HydrophobicContact CE1-CE1 3.92Å; Y756-F779 AromaticContact CZ-CD1 3.77Å; Y756-F779 WeakPolarHBondContact OH-CD1 3.27Å; F779-L781 VanDerWaalsContact C-N 3.26Å; F779-L781 PolarHBondContact O-N 2.68Å; F779-S782 PolarHBondContact O-OG 3.38Å
780	G	60.8	Low	66.7	Low	35 Å²	35	71.6 Å²	71.6	36%	0.361	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.2	-171	0	0	0	0	0	115.8	D778	D778-G780 PolarHBondContact OD1-N 2.62Å
781	L	52.4	Low	63.7	Low	68 Å²	68	75.3 Å²	75.3	36%	0.356	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	8.7	-175.1	-68.1	174.7	0	0	0	114.8	D760 F779 R783	D760-L781 HydrophobicContact CB-CB 4.46Å; D760-L781 HydrophobicContact CB-CD1 3.63Å; D760-L781 WeakPolarHBondContact OD2-CD1 3.47Å; F779-L781 VanDerWaalsContact C-N 3.26Å; F779-L781 PolarHBondContact O-N 2.68Å; L781-R783 PolarHBondContact O-N 2.93Å
782	S	53.7	Low	61.1	Low	13 Å²	13	75.3 Å²	75.3	9%	0.091	42%	0.421	C	S	.	.			trans	-74.8	19.1	-174.3	64.3	0	0	0	0	116	I687 Y756 F779	I687-S782 VanDerWaalsContact CD1-OG 3.25Å; I687-S782 WeakPolarHBondContact CD1-OG 3.42Å; Y756-S782 WeakPolarHBondContact OH-CB 3.43Å; Y756-S782 PolarHBondContact OH-OG 2.86Å; F779-S782 PolarHBondContact O-OG 3.38Å
783	R	54.9	Low	57.9	Low	124 Å²	124	78.4 Å²	78.4	47%	0.468	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-68.2	135.8	-172.6	-58.8	-179.3	82.3	133.2	-2.8	113.6	E680 R759 L781	E680-R783 VanDerWaalsContact CD-NH1 3.34Å; E680-R783 IonicContact OE1-CZ 2.61Å; E680-R783 IonicContact OE1-NH1 2.7Å; E680-R783 PolarHBondContact OE1-NH1 3.29Å; E680-R783 IonicContact OE1-NH2 2.66Å; R759-R783 PolarHBondContact NH1-O 2.85Å; L781-R783 PolarHBondContact O-N 2.93Å
784	F	45.6	Very low	55	Low	161 Å²	161	86 Å²	86	71%	0.706	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-73.3	149.7	171	-150.9	-97.7	0	0	0	111.7
785	L	39.4	Very low	51.9	Low	53 Å²	53	92 Å²	92	28%	0.277	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-90.1	121.4	171.9	-70.7	145.6	0	0	0	107.5	D787 R815	L785-D787 PolarHBondContact O-N 2.85Å; L785-R815 HydrophobicContact CD1-CB 3.51Å; L785-R815 HydrophobicContact CD1-CG 4.24Å
786	E	36	Very low	49	Very low	150 Å²	150	95.1 Å²	95.1	70%	0.701	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-69.3	123.1	167.2	-75.5	176.9	163.8	0	0	109.2	D788	E786-D788 PolarHBondContact O-N 2.68Å; E786-D788 VanDerWaalsContact O-N 3.1Å
787	D	36.2	Very low	45.8	Very low	162 Å²	162	99.4 Å²	99.4	87%	0.866	58%	0.576	S	S	*	*			trans	-70.7	89.2	168.6	-98.1	-26	0	0	0	108.4	L785	L785-D787 PolarHBondContact O-N 2.85Å
788	D	30.1	Very low	43.1	Very low	141 Å²	141	104.2 Å²	104.2	75%	0.754	60%	0.601	S	S	*	*			trans	-116.9	93.2	161.4	-102.2	-22.4	0	0	0	110.4	E786 S790	E786-D788 PolarHBondContact O-N 2.68Å; E786-D788 VanDerWaalsContact O-N 3.1Å; D788-S790 VanDerWaalsContact C-N 3.35Å; D788-S790 PolarHBondContact O-N 3.4Å
789	A	37.6	Very low	41.2	Very low	107 Å²	107	105.1 Å²	105.1	88%	0.884	63%	0.626	S	S	*	*			trans	-72.4	79.9	175.8	0	0	0	0	0	111
790	S	34	Very low	39.6	Very low	96 Å²	96	107.1 Å²	107.1	67%	0.671	64%	0.64	S	S	*	*			trans	-155.3	24.1	170.4	63.4	0	0	0	0	117.1	D788	D788-S790 VanDerWaalsContact C-N 3.35Å; D788-S790 PolarHBondContact O-N 3.4Å
791	N	28.5	Very low	39.6	Very low	145 Å²	145	114.6 Å²	114.6	78%	0.775	66%	0.662	S	S	*	*			trans	-152.1	105.9	167.8	-115.9	-27.3	0	0	0	114	T793	N791-T793 PolarHBondContact O-N 3.3Å
792	P	37.4	Very low	40.5	Very low	127 Å²	127	112.8 Å²	112.8	83%	0.825	65%	0.652	S	S	*	*			trans	-92.8	78.4	176.8	35.9	-27.6	0	0	0	108.9
793	T	26.1	Very low	42.2	Very low	113 Å²	113	113.3 Å²	113.3	69%	0.693	66%	0.656	S	S	*	*			trans	-136.6	128	161.9	-26.4	0	0	0	0	109.2	N791 T795	N791-T793 PolarHBondContact O-N 3.3Å; T793-T795 PolarHBondContact O-N 2.88Å
794	Y	34.2	Very low	43.8	Very low	211 Å²	211	108.9 Å²	108.9	83%	0.827	64%	0.641	S	S	*	*	S	Bend	trans	-44	136	170.7	-147.7	-104.2	0	0	0	110.1
795	T	33.9	Very low	46.1	Very low	126 Å²	126	101.6 Å²	101.6	77%	0.773	61%	0.609	S	S	*	*	S	Bend	trans	99	131.8	175.4	70.8	0	0	0	0	119.1	T793 A797	T793-T795 PolarHBondContact O-N 2.88Å; T795-A797 PolarHBondContact O-N 3.33Å
796	G	36.4	Very low	48.7	Very low	87 Å²	87	100.8 Å²	100.8	90%	0.897	60%	0.602	S	S	*	*				85.3	-6.9	124.2	0	0	0	0	0	121.6
797	A	29.9	Very low	51.4	Low	90 Å²	90	93.8 Å²	93.8	74%	0.744	57%	0.57	S	S	*	*			trans	-124	72.3	-172.4	0	0	0	0	0	113.7	T795	T795-A797 PolarHBondContact O-N 3.33Å
798	L	36.7	Very low	54.2	Low	112 Å²	112	86.1 Å²	86.1	59%	0.586	53%	0.528	S	S	*	.	S	Bend	trans	178.4	61.5	152.8	-96	149.8	0	0	0	109.3	C800	L798-C800 VanDerWaalsContact C-N 3.31Å; L798-C800 PolarHBondContact O-N 3.06Å
799	G	41.4	Very low	57.1	Low	86 Å²	86	80.2 Å²	80.2	89%	0.887	50%	0.498	S	S	*	.			trans	55.6	-10.9	150.7	0	0	0	0	0	123.6
800	C	47.2	Very low	59.6	Low	43 Å²	43	76.2 Å²	76.2	29%	0.291	46%	0.461	S	S	.	.			trans	-109.1	108.3	-171.5	-77.8	0	0	0	0	113.4	L798 R815	L798-C800 VanDerWaalsContact C-N 3.31Å; L798-C800 PolarHBondContact O-N 3.06Å; C800-R815 PolarHBondContact O-NH1 3.01Å
801	K	60.4	Low	62.1	Low	192 Å²	192	71.6 Å²	71.6	84%	0.835	43%	0.429	S	S	*	.			trans	-68.6	121.4	166.9	-69.5	177.4	-179.8	172.4	0	109.4
802	I	71.8	Confident	64.9	Low	29 Å²	29	66.3 Å²	66.3	15%	0.149	40%	0.402	C	S	.	.			trans	-99.4	135.5	175.6	-69.9	-176	0	0	0	110.6	I804 T807 R815 F817	I802-I804 HydrophobicContact CB-CD1 4.48Å; I802-I804 HydrophobicContact CG2-CD1 4.17Å; I802-I804 PolarHBondContact O-N 3.27Å; I802-T807 HydrophobicContact CG2-CG2 3.69Å; I802-T807 WeakPolarHBondContact CG2-OG1 3.26Å; I802-R815 VanDerWaalsContact CD1-CD 3.45Å; I802-R815 VanDerWaalsContact CG1-NH1 3.32Å; I802-F817 HydrophobicContact CD1-CE2 4.39Å; I802-F817 HydrophobicContact CD1-CZ 3.66Å; I802-F817 HydrophobicContact CG1-CZ 4.23Å
803	P	87.8	Confident	67	Low	24 Å²	24	66 Å²	66	16%	0.156	39%	0.389	C	S	.	.			trans	-77.2	80.5	174.5	33.9	-37	0	0	0	111.4	D760 R805 W806 T807	D760-P803 HydrophobicContact CB-CG 4.39Å; D760-P803 VanDerWaalsContact OD1-CG 3.23Å; D760-P803 WeakPolarHBondContact OD1-CG 3.16Å; P803-R805 VanDerWaalsContact C-N 3.27Å; P803-R805 PolarHBondContact O-N 3.14Å; P803-W806 HydrophobicContact CB-CE3 4.05Å; P803-W806 PolarHBondContact O-N 2.9Å; P803-T807 PolarHBondContact O-N 2.95Å; P803-T807 PolarHBondContact O-OG1 2.77Å
804	I	89.4	Confident	69.5	Low	31 Å²	31	68.2 Å²	68.2	16%	0.159	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-42.7	-168.7	-62.3	-61.2	0	0	0	114.6	I802 W806 T807 V812 N846 I850	I802-I804 HydrophobicContact CB-CD1 4.48Å; I802-I804 HydrophobicContact CG2-CD1 4.17Å; I802-I804 PolarHBondContact O-N 3.27Å; I804-W806 VanDerWaalsContact C-N 3.3Å; I804-W806 PolarHBondContact O-N 3.36Å; I804-T807 PolarHBondContact O-N 3.17Å; I804-V812 HydrophobicContact CD1-CG1 4.09Å; I804-V812 HydrophobicContact CD1-CG2 4.25Å; I804-N846 HydrophobicContact CB-CB 4.17Å; I804-N846 HydrophobicContact CG1-CB 4.21Å; I804-N846 HydrophobicContact CG2-CB 4.08Å; I804-I850 HydrophobicContact CD1-CD1 4.49Å; I804-I850 HydrophobicContact CG2-CD1 4Å; I804-I850 HydrophobicContact CG2-CG1 3.77Å
805	R	93.6	Very high	71.5	Confident	8 Å²	8	63.2 Å²	63.2	3%	0.03	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.9	-173.7	-62.4	167.4	-175.1	-96.8	-3.7	114.9	P803 P840 Y841 W842 M844 N846 V849	P803-R805 VanDerWaalsContact C-N 3.27Å; P803-R805 PolarHBondContact O-N 3.14Å; R805-P840 HydrophobicContact CB-CB 4.4Å; R805-P840 WeakPolarHBondContact CD-O 3.5Å; R805-P840 PolarHBondContact NH1-O 2.7Å; R805-Y841 HydrophobicContact CB-CD2 4.34Å; R805-W842 PolarHBondContact NH1-O 2.98Å; R805-M844 PolarHBondContact NH1-O 3.36Å; R805-M844 PolarHBondContact NH2-O 3.4Å; R805-N846 PolarHBondContact NE-OD1 2.92Å; R805-V849 HydrophobicContact CG-CG1 4.46Å; R805-V849 HydrophobicContact CG-CG2 4.4Å
806	W	95.1	Very high	73.6	Confident	36 Å²	36	62.1 Å²	62.1	14%	0.136	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-13.6	177.6	-64.9	-99	0	0	0	111.7	A762 P803 I804 S825 I828 E832 P840	A762-W806 HydrophobicContact CB-CD2 4.21Å; A762-W806 HydrophobicContact CB-CG 4.01Å; P803-W806 HydrophobicContact CB-CE3 4.05Å; P803-W806 PolarHBondContact O-N 2.9Å; I804-W806 VanDerWaalsContact C-N 3.3Å; I804-W806 PolarHBondContact O-N 3.36Å; W806-S825 VanDerWaalsContact O-CA 3.31Å; W806-S825 WeakPolarHBondContact O-CA 3.33Å; W806-S825 WeakPolarHBondContact O-CB 3.29Å; W806-S825 PolarHBondContact O-OG 3.18Å; W806-I828 HydrophobicContact CG-CG2 4.04Å; W806-E832 WeakPolarHBondContact CZ2-OE1 3.24Å; W806-E832 PolarHBondContact NE1-OE1 3.48Å; W806-E832 VanDerWaalsContact NE1-OE1 3.15Å; W806-E832 PolarHBondContact NE1-OE2 3.34Å; W806-P840 HydrophobicContact CZ2-CG 3.76Å
807	T	92.4	Very high	75.9	Confident	4 Å²	4	60 Å²	60	3%	0.025	32%	0.316	C	S	.	.	S	Bend	trans	-87.9	136.7	-169.6	-54.5	0	0	0	0	111.4	I802 P803 I804 A811 V812 F817 W824	I802-T807 HydrophobicContact CG2-CG2 3.69Å; I802-T807 WeakPolarHBondContact CG2-OG1 3.26Å; P803-T807 PolarHBondContact O-N 2.95Å; P803-T807 PolarHBondContact O-OG1 2.77Å; I804-T807 PolarHBondContact O-N 3.17Å; T807-A811 HydrophobicContact CG2-CB 3.49Å; T807-A811 VanDerWaalsContact CG2-CB 3.49Å; T807-V812 HydrophobicContact CG2-CG2 3.69Å; T807-F817 HydrophobicContact CG2-CE1 4.35Å; T807-W824 PolarHBondContact O-NE1 3.48Å
808	A	93.9	Very high	78.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.289	C	S	.	.			trans	-63.5	150.2	176.9	0	0	0	0	0	112.4	E810 A811 V812 W824	A808-E810 VanDerWaalsContact C-N 3.28Å; A808-E810 WeakPolarHBondContact CB-OE1 3.47Å; A808-E810 WeakPolarHBondContact CB-OE2 3.37Å; A808-E810 PolarHBondContact O-N 3.32Å; A808-A811 HydrophobicContact CB-CB 4.46Å; A808-A811 WeakPolarHBondContact O-CA 3.08Å; A808-A811 PolarHBondContact O-N 3.18Å; A808-V812 PolarHBondContact O-N 2.85Å; A808-W824 HydrophobicContact CB-CB 3.71Å; A808-W824 HydrophobicContact CB-CD2 4.17Å; A808-W824 HydrophobicContact CB-CG 3.75Å
809	P	91.3	Very high	81.3	Confident	18 Å²	18	53.3 Å²	53.3	12%	0.117	27%	0.273	C	S	.	.	H	α-helix	trans	-53.1	-43.3	-178.2	-24	31.1	0	0	0	113.3	A811 V812 Q813 W824 I853	P809-A811 VanDerWaalsContact C-N 3.28Å; P809-A811 PolarHBondContact O-N 3.07Å; P809-V812 PolarHBondContact O-N 3.27Å; P809-Q813 VanDerWaalsContact O-CB 3.31Å; P809-Q813 WeakPolarHBondContact O-CB 3.48Å; P809-Q813 PolarHBondContact O-N 3.37Å; P809-W824 HydrophobicContact CG-CE3 4.46Å; P809-W824 HydrophobicContact CG-CH2 3.7Å; P809-W824 HydrophobicContact CG-CZ2 4.11Å; P809-W824 HydrophobicContact CG-CZ3 3.89Å; P809-I853 HydrophobicContact CG-CG2 3.69Å
810	E	89.3	Confident	83.9	Confident	22 Å²	22	51 Å²	51	10%	0.103	24%	0.242	C	C	.	.	H	α-helix	trans	-68.6	-26.8	-179.8	73.1	-79.3	-170.8	0	0	113.4	A808 Y814 R815 K816 R884	A808-E810 VanDerWaalsContact C-N 3.28Å; A808-E810 WeakPolarHBondContact CB-OE1 3.47Å; A808-E810 WeakPolarHBondContact CB-OE2 3.37Å; A808-E810 PolarHBondContact O-N 3.32Å; E810-Y814 HydrophobicContact CB-CD2 4.3Å; E810-Y814 CarbonylContact O-C 3.43Å; E810-Y814 WeakPolarHBondContact O-CA 3.28Å; E810-Y814 WeakPolarHBondContact O-CB 3.45Å; E810-Y814 PolarHBondContact O-N 2.94Å; E810-R815 PolarHBondContact O-N 3.12Å; E810-K816 PolarHBondContact O-N 2.89Å; E810-R884 IonicContact OE1-CZ 3.78Å; E810-R884 IonicContact OE1-NH1 2.85Å; E810-R884 PolarHBondContact OE1-NH1 2.96Å; E810-R884 IonicContact OE1-NH2 3.86Å; E810-R884 PolarHBondContact OE1-NH2 3.02Å; E810-R884 IonicContact OE2-CZ 2.8Å; E810-R884 IonicContact OE2-NH1 3.13Å; E810-R884 PolarHBondContact OE2-NH1 2.8Å; E810-R884 IonicContact OE2-NH2 2.98Å; E810-R884 PolarHBondContact OE2-NH2 3.5Å
811	A	88.1	Confident	86.1	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-82.5	-31.6	176.4	0	0	0	0	0	111.5	T807 A808 P809 R815 F817	T807-A811 HydrophobicContact CG2-CB 3.49Å; T807-A811 VanDerWaalsContact CG2-CB 3.49Å; A808-A811 HydrophobicContact CB-CB 4.46Å; A808-A811 WeakPolarHBondContact O-CA 3.08Å; A808-A811 PolarHBondContact O-N 3.18Å; P809-A811 VanDerWaalsContact C-N 3.28Å; P809-A811 PolarHBondContact O-N 3.07Å; A811-R815 WeakPolarHBondContact O-CA 3.29Å; A811-R815 PolarHBondContact O-N 3.4Å; A811-F817 HydrophobicContact CB-CD1 3.91Å; A811-F817 HydrophobicContact CB-CE1 3.84Å; A811-F817 HydrophobicContact CB-CG 4.46Å; A811-F817 HydrophobicContact CB-CZ 4.31Å
812	V	85.9	Confident	87.8	Confident	34 Å²	34	40 Å²	40	21%	0.206	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-49.5	170.5	177	0	0	0	0	110.8	I804 T807 A808 P809 I850	I804-V812 HydrophobicContact CD1-CG1 4.09Å; I804-V812 HydrophobicContact CD1-CG2 4.25Å; T807-V812 HydrophobicContact CG2-CG2 3.69Å; A808-V812 PolarHBondContact O-N 2.85Å; P809-V812 PolarHBondContact O-N 3.27Å; V812-I850 HydrophobicContact CG1-CD1 3.98Å; V812-I850 HydrophobicContact CG1-CG1 4.19Å
813	Q	81.9	Confident	89	Confident	120 Å²	120	38.6 Å²	38.6	56%	0.561	18%	0.183	S	C	*	.	H	α-helix	trans	-80.5	-44.3	-170.8	-169.9	177.4	14.4	0	0	113.3	P809	P809-Q813 VanDerWaalsContact O-CB 3.31Å; P809-Q813 WeakPolarHBondContact O-CB 3.48Å; P809-Q813 PolarHBondContact O-N 3.37Å
814	Y	79.2	Confident	89.5	Confident	159 Å²	159	37.5 Å²	37.5	62%	0.624	18%	0.176	S	C	*	.	H	α-helix	trans	-116.4	5.9	-172.1	-49.2	-66.5	0	0	0	113.1	E810 K816	E810-Y814 HydrophobicContact CB-CD2 4.3Å; E810-Y814 CarbonylContact O-C 3.43Å; E810-Y814 WeakPolarHBondContact O-CA 3.28Å; E810-Y814 WeakPolarHBondContact O-CB 3.45Å; E810-Y814 PolarHBondContact O-N 2.94Å; Y814-K816 PolarHBondContact O-N 3.36Å; Y814-K816 VanDerWaalsContact O-N 3.08Å
815	R	76.4	Confident	89.9	Confident	106 Å²	106	36.2 Å²	36.2	40%	0.4	17%	0.17	S	C	.	.			trans	54.4	28.4	-177.7	-60.2	-69.1	178.1	140.8	-6.5	113.8	L785 C800 I802 E810 A811 F817	L785-R815 HydrophobicContact CD1-CB 3.51Å; L785-R815 HydrophobicContact CD1-CG 4.24Å; C800-R815 PolarHBondContact O-NH1 3.01Å; I802-R815 VanDerWaalsContact CD1-CD 3.45Å; I802-R815 VanDerWaalsContact CG1-NH1 3.32Å; E810-R815 PolarHBondContact O-N 3.12Å; A811-R815 WeakPolarHBondContact O-CA 3.29Å; A811-R815 PolarHBondContact O-N 3.4Å; R815-F817 VanDerWaalsContact O-CD2 3.31Å; R815-F817 WeakPolarHBondContact O-CD2 3.14Å; R815-F817 PolarHBondContact O-N 3.49Å
816	K	78.1	Confident	90.2	Very high	103 Å²	103	35.8 Å²	35.8	45%	0.448	17%	0.168	S	C	.	.			trans	-94.2	92.9	-176.6	-167.2	176.2	-165.3	172.4	0	111.8	E810 Y814 T818	E810-K816 PolarHBondContact O-N 2.89Å; Y814-K816 PolarHBondContact O-N 3.36Å; Y814-K816 VanDerWaalsContact O-N 3.08Å; K816-T818 HydrophobicContact CG-CG2 4.45Å
817	F	84.4	Confident	90.3	Very high	42 Å²	42	34.1 Å²	34.1	18%	0.184	16%	0.162	C	C	.	.			trans	-86.7	132.1	177.6	-61.5	-86.2	0	0	0	111.7	V757 R759 I802 T807 A811 R815	V757-F817 HydrophobicContact CG1-CB 4.11Å; R759-F817 HydrophobicContact CB-CD1 3.82Å; R759-F817 HydrophobicContact CB-CE1 4.05Å; R759-F817 HydrophobicContact CB-CG 4.46Å; R759-F817 HydrophobicContact CG-CB 4.03Å; R759-F817 HydrophobicContact CG-CD1 3.77Å; R759-F817 HydrophobicContact CG-CE1 4.42Å; R759-F817 HydrophobicContact CG-CG 3.95Å; I802-F817 HydrophobicContact CD1-CE2 4.39Å; I802-F817 HydrophobicContact CD1-CZ 3.66Å; I802-F817 HydrophobicContact CG1-CZ 4.23Å; T807-F817 HydrophobicContact CG2-CE1 4.35Å; A811-F817 HydrophobicContact CB-CD1 3.91Å; A811-F817 HydrophobicContact CB-CE1 3.84Å; A811-F817 HydrophobicContact CB-CG 4.46Å; A811-F817 HydrophobicContact CB-CZ 4.31Å; R815-F817 VanDerWaalsContact O-CD2 3.31Å; R815-F817 WeakPolarHBondContact O-CD2 3.14Å; R815-F817 PolarHBondContact O-N 3.49Å
818	T	88.8	Confident	90.6	Very high	30 Å²	30	33.9 Å²	33.9	18%	0.184	16%	0.16	C	C	.	.			trans	-147.9	168	179.5	60.8	0	0	0	0	110.5	K816 S820 S821 D822	K816-T818 HydrophobicContact CG-CG2 4.45Å; T818-S820 PolarHBondContact O-N 2.93Å; T818-S820 VanDerWaalsContact O-N 3.15Å; T818-S820 PolarHBondContact OG1-N 2.93Å; T818-S821 PolarHBondContact N-OG 3.17Å; T818-S821 PolarHBondContact O-N 2.76Å; T818-S821 PolarHBondContact O-OG 2.97Å; T818-S821 PolarHBondContact OG1-N 3.31Å; T818-D822 PolarHBondContact O-N 3.12Å
819	S	91.8	Very high	90.8	Very high	33 Å²	33	33.9 Å²	33.9	23%	0.231	16%	0.16	C	C	.	.	H	α-helix	trans	-53	-35.7	169.7	174.8	0	0	0	0	112.1	S752 S821 D822 V823	S752-S819 WeakPolarHBondContact CB-OG 3.14Å; S752-S819 WeakPolarHBondContact OG-CB 3.34Å; S752-S819 PolarHBondContact OG-OG 3.45Å; S819-S821 VanDerWaalsContact C-N 3.34Å; S819-S821 PolarHBondContact O-N 3.14Å; S819-D822 PolarHBondContact O-N 2.93Å; S819-V823 WeakPolarHBondContact O-CG2 3.46Å; S819-V823 PolarHBondContact O-N 3.26Å
820	S	94.6	Very high	91.1	Very high	36 Å²	36	33 Å²	33	25%	0.252	16%	0.155	S	C	.	.	H	α-helix	trans	-67.5	-26.5	174.3	-59.2	0	0	0	0	114.5	T818 W824 R881 R884	T818-S820 PolarHBondContact O-N 2.93Å; T818-S820 VanDerWaalsContact O-N 3.15Å; T818-S820 PolarHBondContact OG1-N 2.93Å; S820-W824 PolarHBondContact O-N 3Å; S820-R881 PolarHBondContact OG-O 2.77Å; S820-R884 WeakPolarHBondContact O-CD 3.48Å; S820-R884 PolarHBondContact O-NH1 3.16Å
821	S	93.7	Very high	91.5	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-75.2	-34.5	172.3	64.3	0	0	0	0	111	T818 S819 V823 W824 S825	T818-S821 PolarHBondContact N-OG 3.17Å; T818-S821 PolarHBondContact O-N 2.76Å; T818-S821 PolarHBondContact O-OG 2.97Å; T818-S821 PolarHBondContact OG1-N 3.31Å; S819-S821 VanDerWaalsContact C-N 3.34Å; S819-S821 PolarHBondContact O-N 3.14Å; S821-V823 VanDerWaalsContact C-N 3.28Å; S821-V823 PolarHBondContact O-N 3.48Å; S821-W824 WeakPolarHBondContact O-CB 3.12Å; S821-W824 PolarHBondContact O-N 2.85Å; S821-S825 PolarHBondContact O-N 3.31Å; S821-S825 PolarHBondContact O-OG 2.74Å
822	D	95.7	Very high	91.9	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-67.3	-29.6	171.7	-72.6	-18.6	0	0	0	112.2	M748 V757 H758 R759 T818 S819 W824 S825 Y826 F887	M748-D822 HydrophobicContact CE-CB 3.73Å; V757-D822 WeakPolarHBondContact CA-OD2 3.48Å; V757-D822 WeakPolarHBondContact CG1-OD2 3.08Å; H758-D822 PolarHBondContact N-OD2 3.12Å; R759-D822 PolarHBondContact N-OD1 3.06Å; T818-D822 PolarHBondContact O-N 3.12Å; S819-D822 PolarHBondContact O-N 2.93Å; D822-W824 VanDerWaalsContact C-N 3.31Å; D822-W824 PolarHBondContact O-N 2.7Å; D822-S825 WeakPolarHBondContact O-CB 3.43Å; D822-S825 PolarHBondContact O-N 2.89Å; D822-Y826 WeakPolarHBondContact O-CB 3.3Å; D822-Y826 PolarHBondContact O-N 2.88Å; D822-F887 HydrophobicContact CB-CE2 4.04Å; D822-F887 HydrophobicContact CB-CZ 4.11Å
823	V	98.4	Very high	92.4	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-61.9	-39.8	171.5	169	0	0	0	0	111.4	S819 S821 Y826 G827 C876 R884 P885 F887 I890	S819-V823 WeakPolarHBondContact O-CG2 3.46Å; S819-V823 PolarHBondContact O-N 3.26Å; S821-V823 VanDerWaalsContact C-N 3.28Å; S821-V823 PolarHBondContact O-N 3.48Å; V823-Y826 WeakPolarHBondContact O-CB 3.48Å; V823-Y826 PolarHBondContact O-N 3.15Å; V823-G827 PolarHBondContact O-N 3.32Å; V823-C876 HydrophobicContact CG1-CB 3.97Å; V823-C876 WeakPolarHBondContact O-CB 3.49Å; V823-R884 HydrophobicContact CG1-CB 3.96Å; V823-P885 HydrophobicContact CG1-CG 4.39Å; V823-P885 WeakPolarHBondContact CG1-O 3.45Å; V823-P885 WeakPolarHBondContact CG2-O 3.33Å; V823-F887 HydrophobicContact CG2-CD2 3.92Å; V823-F887 HydrophobicContact CG2-CE1 4.34Å; V823-F887 HydrophobicContact CG2-CE2 3.64Å; V823-F887 HydrophobicContact CG2-CG 4.37Å; V823-F887 HydrophobicContact CG2-CZ 3.86Å; V823-I890 HydrophobicContact CG1-CD1 3.99Å; V823-I890 HydrophobicContact CG2-CD1 4.33Å
824	W	98.1	Very high	93	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.3	-48.5	174.1	177.1	-75.6	0	0	0	111	T807 A808 P809 S820 S821 D822 Y826 G827 I828 I853 W877	T807-W824 PolarHBondContact O-NE1 3.48Å; A808-W824 HydrophobicContact CB-CB 3.71Å; A808-W824 HydrophobicContact CB-CD2 4.17Å; A808-W824 HydrophobicContact CB-CG 3.75Å; P809-W824 HydrophobicContact CG-CE3 4.46Å; P809-W824 HydrophobicContact CG-CH2 3.7Å; P809-W824 HydrophobicContact CG-CZ2 4.11Å; P809-W824 HydrophobicContact CG-CZ3 3.89Å; S820-W824 PolarHBondContact O-N 3Å; S821-W824 WeakPolarHBondContact O-CB 3.12Å; S821-W824 PolarHBondContact O-N 2.85Å; D822-W824 VanDerWaalsContact C-N 3.31Å; D822-W824 PolarHBondContact O-N 2.7Å; W824-Y826 VanDerWaalsContact C-N 3.27Å; W824-Y826 PolarHBondContact O-N 3.35Å; W824-G827 WeakPolarHBondContact O-CA 3.26Å; W824-G827 PolarHBondContact O-N 3.23Å; W824-I828 PolarHBondContact O-N 2.81Å; W824-I853 HydrophobicContact CH2-CG2 3.78Å; W824-I853 HydrophobicContact CZ2-CD1 4.16Å; W824-I853 HydrophobicContact CZ2-CG1 4.41Å; W824-I853 HydrophobicContact CZ2-CG2 3.85Å; W824-W877 AromaticContact CD2-CD1 3.78Å; W824-W877 AromaticContact CE2-CD1 3.9Å; W824-W877 HydrophobicContact CE3-CB 4.14Å; W824-W877 HydrophobicContact CH2-CB 4.18Å; W824-W877 HydrophobicContact CZ3-CB 3.94Å; W824-W877 WeakPolarHBondContact CZ3-O 3.35Å; W824-W877 PolarHBondContact O-NE1 3.37Å
825	S	97.9	Very high	93.5	Very high	4 Å²	4	18.5 Å²	18.5	3%	0.028	9%	0.091	C	C	.	.	H	α-helix	trans	-58.3	-40.7	176.4	-46.7	0	0	0	0	111.4	L761 W806 S821 D822 G827 I828 V829	L761-S825 WeakPolarHBondContact O-CB 3.49Å; W806-S825 VanDerWaalsContact O-CA 3.31Å; W806-S825 WeakPolarHBondContact O-CA 3.33Å; W806-S825 WeakPolarHBondContact O-CB 3.29Å; W806-S825 PolarHBondContact O-OG 3.18Å; S821-S825 PolarHBondContact O-N 3.31Å; S821-S825 PolarHBondContact O-OG 2.74Å; D822-S825 WeakPolarHBondContact O-CB 3.43Å; D822-S825 PolarHBondContact O-N 2.89Å; S825-G827 VanDerWaalsContact C-N 3.32Å; S825-G827 PolarHBondContact O-N 3.25Å; S825-I828 WeakPolarHBondContact O-CA 3.2Å; S825-I828 WeakPolarHBondContact O-CB 3.29Å; S825-I828 PolarHBondContact O-N 3.44Å; S825-V829 PolarHBondContact O-N 2.99Å
826	Y	98.6	Very high	94.2	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.5	-38.5	174.9	-179.4	-97.1	0	0	0	112.2	L741 I744 A745 L761 D822 V823 W824 I828 V829 M830 F887 I890 L894	L741-Y826 PolarHBondContact O-OH 2.85Å; I744-Y826 HydrophobicContact CB-CE2 4.02Å; I744-Y826 HydrophobicContact CG2-CD2 3.94Å; I744-Y826 HydrophobicContact CG2-CE2 3.77Å; A745-Y826 HydrophobicContact CB-CE1 4.45Å; A745-Y826 HydrophobicContact CB-CE2 3.9Å; A745-Y826 WeakPolarHBondContact CB-OH 3.29Å; L761-Y826 HydrophobicContact CD2-CD2 4.25Å; D822-Y826 WeakPolarHBondContact O-CB 3.3Å; D822-Y826 PolarHBondContact O-N 2.88Å; V823-Y826 WeakPolarHBondContact O-CB 3.48Å; V823-Y826 PolarHBondContact O-N 3.15Å; W824-Y826 VanDerWaalsContact C-N 3.27Å; W824-Y826 PolarHBondContact O-N 3.35Å; Y826-I828 VanDerWaalsContact C-N 3.27Å; Y826-I828 PolarHBondContact O-N 3.21Å; Y826-V829 CarbonylContact O-C 3.55Å; Y826-V829 WeakPolarHBondContact O-CB 3.33Å; Y826-V829 PolarHBondContact O-N 3.47Å; Y826-V829 VanDerWaalsContact O-N 3.14Å; Y826-M830 HydrophobicContact CD1-CG 3.98Å; Y826-M830 HydrophobicContact CD1-SD 3.88Å; Y826-M830 HydrophobicContact CE1-CG 3.49Å; Y826-M830 VanDerWaalsContact CE1-CG 3.49Å; Y826-M830 HydrophobicContact CE1-SD 3.4Å; Y826-M830 WeakPolarHBondContact CE1-SD 3.33Å; Y826-M830 WeakPolarHBondContact O-CG 3.26Å; Y826-M830 PolarHBondContact O-N 3.35Å; Y826-F887 HydrophobicContact CD1-CE1 4.33Å; Y826-F887 HydrophobicContact CD2-CE1 4.05Å; Y826-F887 AromaticContact CG-CE1 3.76Å; Y826-F887 HydrophobicContact CG-CE1 3.76Å; Y826-I890 HydrophobicContact CD1-CD1 4.03Å; Y826-I890 HydrophobicContact CD1-CG2 4.12Å; Y826-I890 HydrophobicContact CE1-CD1 4.37Å; Y826-I890 HydrophobicContact CE1-CG2 3.41Å; Y826-I890 VanDerWaalsContact CE1-CG2 3.41Å; Y826-L894 VanDerWaalsContact OH-CD1 3.23Å; Y826-L894 WeakPolarHBondContact OH-CD1 3.36Å
827	G	98.1	Very high	94.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-58.7	-39.1	172	0	0	0	0	0	112.5	V823 W824 S825 M830 W831 W877	V823-G827 PolarHBondContact O-N 3.32Å; W824-G827 WeakPolarHBondContact O-CA 3.26Å; W824-G827 PolarHBondContact O-N 3.23Å; S825-G827 VanDerWaalsContact C-N 3.32Å; S825-G827 PolarHBondContact O-N 3.25Å; G827-M830 WeakPolarHBondContact O-CB 3.49Å; G827-M830 PolarHBondContact O-N 3.46Å; G827-W831 PolarHBondContact O-N 3.43Å; G827-W831 VanDerWaalsContact O-N 3.14Å; G827-W877 WeakPolarHBondContact O-CZ2 3.34Å
828	I	98.3	Very high	94.9	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-66.7	-42.1	173.6	-56.4	-68.4	0	0	0	110.7	W806 W824 S825 Y826 M830 W831 E832 P840 Y841 L859 W877	W806-I828 HydrophobicContact CG-CG2 4.04Å; W824-I828 PolarHBondContact O-N 2.81Å; S825-I828 WeakPolarHBondContact O-CA 3.2Å; S825-I828 WeakPolarHBondContact O-CB 3.29Å; S825-I828 PolarHBondContact O-N 3.44Å; Y826-I828 VanDerWaalsContact C-N 3.27Å; Y826-I828 PolarHBondContact O-N 3.21Å; I828-M830 VanDerWaalsContact C-N 3.31Å; I828-M830 PolarHBondContact O-N 3.03Å; I828-W831 WeakPolarHBondContact O-CA 3.38Å; I828-W831 WeakPolarHBondContact O-CB 3.45Å; I828-W831 PolarHBondContact O-N 3.02Å; I828-E832 HydrophobicContact CG2-CG 4.46Å; I828-E832 WeakPolarHBondContact O-CG 3.25Å; I828-E832 PolarHBondContact O-N 2.72Å; I828-P840 HydrophobicContact CG2-CB 3.78Å; I828-P840 HydrophobicContact CG2-CG 3.52Å; I828-Y841 HydrophobicContact CD1-CE2 4.02Å; I828-L859 HydrophobicContact CD1-CD1 3.84Å; I828-W877 HydrophobicContact CD1-CZ2 3.73Å; I828-W877 HydrophobicContact CG1-CZ2 4.43Å
829	V	98.4	Very high	94.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.5	-39.9	174	175	0	0	0	0	111.7	I744 L761 S825 Y826 W831 E832 V833	I744-V829 HydrophobicContact CD1-CG1 3.97Å; L761-V829 HydrophobicContact CG-CG2 4.16Å; S825-V829 PolarHBondContact O-N 2.99Å; Y826-V829 CarbonylContact O-C 3.55Å; Y826-V829 WeakPolarHBondContact O-CB 3.33Å; Y826-V829 PolarHBondContact O-N 3.47Å; Y826-V829 VanDerWaalsContact O-N 3.14Å; V829-W831 VanDerWaalsContact C-N 3.26Å; V829-W831 PolarHBondContact O-N 3.45Å; V829-E832 PolarHBondContact O-N 3.36Å; V829-V833 HydrophobicContact CG1-CG2 4.29Å; V829-V833 VanDerWaalsContact O-CG2 3.32Å; V829-V833 WeakPolarHBondContact O-CG2 3.46Å; V829-V833 PolarHBondContact O-N 3.17Å
830	M	98.2	Very high	94.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.7	-42.8	173.3	-69.8	177.9	69.3	0	0	111.5	L741 Y826 G827 I828 M834 L869 L872 M873	L741-M830 HydrophobicContact CD1-CB 4.38Å; L741-M830 HydrophobicContact CD1-CG 4.22Å; L741-M830 HydrophobicContact CD2-CB 4.26Å; L741-M830 HydrophobicContact CD2-CG 3.95Å; Y826-M830 HydrophobicContact CD1-CG 3.98Å; Y826-M830 HydrophobicContact CD1-SD 3.88Å; Y826-M830 HydrophobicContact CE1-CG 3.49Å; Y826-M830 VanDerWaalsContact CE1-CG 3.49Å; Y826-M830 HydrophobicContact CE1-SD 3.4Å; Y826-M830 WeakPolarHBondContact CE1-SD 3.33Å; Y826-M830 WeakPolarHBondContact O-CG 3.26Å; Y826-M830 PolarHBondContact O-N 3.35Å; G827-M830 WeakPolarHBondContact O-CB 3.49Å; G827-M830 PolarHBondContact O-N 3.46Å; I828-M830 VanDerWaalsContact C-N 3.31Å; I828-M830 PolarHBondContact O-N 3.03Å; M830-M834 VanDerWaalsContact O-CG 3.32Å; M830-M834 WeakPolarHBondContact O-CG 3.48Å; M830-M834 PolarHBondContact O-N 3.26Å; M830-M834 VanDerWaalsContact O-N 3.14Å; M830-L869 HydrophobicContact CE-CD2 4.04Å; M830-L872 HydrophobicContact CE-CB 4.05Å; M830-L872 HydrophobicContact CE-CD2 3.83Å; M830-L872 HydrophobicContact CE-CG 3.9Å; M830-L872 HydrophobicContact SD-CD2 4.44Å; M830-L872 HydrophobicContact SD-CG 4.27Å; M830-M873 HydrophobicContact CB-CE 3.9Å; M830-M873 HydrophobicContact CB-CG 3.76Å; M830-M873 HydrophobicContact CB-SD 4.41Å; M830-M873 HydrophobicContact CE-CG 3.85Å; M830-M873 WeakPolarHBondContact O-CE 3.22Å; M830-M873 HydrophobicContact SD-CG 4.12Å
831	W	97.1	Very high	94.3	Very high	3 Å²	3	13.5 Å²	13.5	1%	0.011	6%	0.059	C	C	.	.	H	α-helix	trans	-64.5	-48.3	175.8	-171.5	93	0	0	0	111.5	G827 I828 V829 V833 M834 S835 E838 P840 W842 L859 P860 P862 M873 W877	G827-W831 PolarHBondContact O-N 3.43Å; G827-W831 VanDerWaalsContact O-N 3.14Å; I828-W831 WeakPolarHBondContact O-CA 3.38Å; I828-W831 WeakPolarHBondContact O-CB 3.45Å; I828-W831 PolarHBondContact O-N 3.02Å; V829-W831 VanDerWaalsContact C-N 3.26Å; V829-W831 PolarHBondContact O-N 3.45Å; W831-V833 VanDerWaalsContact C-N 3.3Å; W831-V833 PolarHBondContact O-N 3.47Å; W831-M834 PolarHBondContact O-N 3.48Å; W831-S835 VanDerWaalsContact CZ3-OG 3.28Å; W831-S835 WeakPolarHBondContact CZ3-OG 3.49Å; W831-S835 WeakPolarHBondContact O-CB 3.14Å; W831-S835 PolarHBondContact O-N 2.9Å; W831-S835 PolarHBondContact O-OG 3.09Å; W831-E838 HydrophobicContact CH2-CB 3.74Å; W831-E838 HydrophobicContact CZ3-CB 3.8Å; W831-P840 HydrophobicContact CE3-CG 4.47Å; W831-W842 HydrophobicContact CZ2-CZ2 4.18Å; W831-L859 HydrophobicContact CB-CD1 4.39Å; W831-L859 HydrophobicContact CD2-CD1 3.85Å; W831-L859 HydrophobicContact CE3-CD1 4.23Å; W831-L859 HydrophobicContact CG-CB 4.25Å; W831-L859 HydrophobicContact CG-CD1 3.9Å; W831-L859 HydrophobicContact CZ2-CD2 4.47Å; W831-P860 PolarHBondContact NE1-O 3.41Å; W831-P862 HydrophobicContact CD2-CG 4.39Å; W831-P862 HydrophobicContact CG-CG 4.23Å; W831-M873 HydrophobicContact CB-SD 4.27Å; W831-W877 HydrophobicContact CB-CH2 4.04Å; W831-W877 HydrophobicContact CB-CZ2 4.13Å; W831-W877 HydrophobicContact CG-CH2 4.38Å
832	E	97.4	Very high	94	Very high	8 Å²	8	17.3 Å²	17.3	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-55.9	-42.3	176.7	-69.8	179.7	115.2	0	0	112	A763 W806 I828 V829 S835 Y836 G837 P840	A763-E832 HydrophobicContact CB-CB 4.02Å; A763-E832 HydrophobicContact CB-CG 4.49Å; A763-E832 PolarHBondContact N-OE2 3.07Å; A763-E832 VanDerWaalsContact N-OE2 3.08Å; W806-E832 WeakPolarHBondContact CZ2-OE1 3.24Å; W806-E832 PolarHBondContact NE1-OE1 3.48Å; W806-E832 VanDerWaalsContact NE1-OE1 3.15Å; W806-E832 PolarHBondContact NE1-OE2 3.34Å; I828-E832 HydrophobicContact CG2-CG 4.46Å; I828-E832 WeakPolarHBondContact O-CG 3.25Å; I828-E832 PolarHBondContact O-N 2.72Å; V829-E832 PolarHBondContact O-N 3.36Å; E832-S835 WeakPolarHBondContact CA-OG 3.24Å; E832-S835 CarbonylContact O-C 3.6Å; E832-S835 PolarHBondContact O-N 3.36Å; E832-S835 PolarHBondContact O-OG 3.5Å; E832-Y836 PolarHBondContact O-N 2.93Å; E832-Y836 VanDerWaalsContact O-N 3.13Å; E832-G837 PolarHBondContact O-N 3Å; E832-P840 HydrophobicContact CG-CG 3.73Å
833	V	96.6	Very high	93.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.6	-43	178.7	173.6	0	0	0	0	111.6	L721 L725 L737 L741 V829 W831 S835 Y836	L721-V833 HydrophobicContact CD2-CG2 3.82Å; L725-V833 HydrophobicContact CD1-CB 4.29Å; L725-V833 HydrophobicContact CD1-CG1 4.46Å; L725-V833 HydrophobicContact CD1-CG2 4.07Å; L737-V833 HydrophobicContact CB-CG1 4Å; L737-V833 HydrophobicContact CD2-CG1 3.92Å; L737-V833 HydrophobicContact CG-CG1 4.46Å; L741-V833 HydrophobicContact CD1-CG1 4.42Å; L741-V833 HydrophobicContact CD2-CB 3.77Å; L741-V833 HydrophobicContact CD2-CG1 4.1Å; L741-V833 HydrophobicContact CD2-CG2 3.63Å; L741-V833 HydrophobicContact CG-CB 4.21Å; L741-V833 HydrophobicContact CG-CG1 4.02Å; L741-V833 HydrophobicContact CG-CG2 4.41Å; V829-V833 HydrophobicContact CG1-CG2 4.29Å; V829-V833 VanDerWaalsContact O-CG2 3.32Å; V829-V833 WeakPolarHBondContact O-CG2 3.46Å; V829-V833 PolarHBondContact O-N 3.17Å; W831-V833 VanDerWaalsContact C-N 3.3Å; W831-V833 PolarHBondContact O-N 3.47Å; V833-S835 VanDerWaalsContact C-N 3.31Å; V833-Y836 PolarHBondContact O-N 2.92Å
834	M	93.4	Very high	92.2	Very high	10 Å²	10	26.7 Å²	26.7	5%	0.049	12%	0.122	C	C	.	.	H	α-helix	trans	-74.5	-22.3	-179.9	-66.8	-55.1	-55.1	0	0	113	L737 M830 W831 P862 C865 L869 M873	L737-M834 HydrophobicContact CB-SD 4.15Å; L737-M834 HydrophobicContact CD1-CE 4.33Å; L737-M834 HydrophobicContact CD1-SD 4.07Å; M830-M834 VanDerWaalsContact O-CG 3.32Å; M830-M834 WeakPolarHBondContact O-CG 3.48Å; M830-M834 PolarHBondContact O-N 3.26Å; M830-M834 VanDerWaalsContact O-N 3.14Å; W831-M834 PolarHBondContact O-N 3.48Å; M834-P862 HydrophobicContact CB-CB 4.32Å; M834-P862 HydrophobicContact CB-CG 3.94Å; M834-C865 HydrophobicContact CE-CB 4.27Å; M834-L869 HydrophobicContact CE-CD1 4.3Å; M834-L869 HydrophobicContact SD-CD1 3.91Å; M834-M873 HydrophobicContact CB-CE 4.17Å; M834-M873 HydrophobicContact CG-CE 3.72Å
835	S	89.7	Confident	91.4	Very high	8 Å²	8	29.2 Å²	29.2	6%	0.056	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	14.1	173.1	65.7	0	0	0	0	113.4	W831 E832 V833 G837 E838	W831-S835 VanDerWaalsContact CZ3-OG 3.28Å; W831-S835 WeakPolarHBondContact CZ3-OG 3.49Å; W831-S835 WeakPolarHBondContact O-CB 3.14Å; W831-S835 PolarHBondContact O-N 2.9Å; W831-S835 PolarHBondContact O-OG 3.09Å; E832-S835 WeakPolarHBondContact CA-OG 3.24Å; E832-S835 CarbonylContact O-C 3.6Å; E832-S835 PolarHBondContact O-N 3.36Å; E832-S835 PolarHBondContact O-OG 3.5Å; V833-S835 VanDerWaalsContact C-N 3.31Å; S835-G837 PolarHBondContact O-N 3.1Å; S835-E838 WeakPolarHBondContact O-CG 3.25Å; S835-E838 PolarHBondContact O-N 3.38Å
836	Y	90.9	Very high	90.7	Very high	33 Å²	33	32.7 Å²	32.7	13%	0.129	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	35.2	178.7	-75.1	-95.4	0	0	0	114.8	L725 R726 K728 E729 G730 F732 L737 E832 V833	L725-Y836 CarbonylContact C-O 3.58Å; L725-Y836 HydrophobicContact CB-CD1 4.5Å; L725-Y836 HydrophobicContact CD2-CD1 4.28Å; R726-Y836 WeakPolarHBondContact CA-O 3.28Å; R726-Y836 WeakPolarHBondContact CG-O 3.17Å; R726-Y836 PolarHBondContact N-O 2.96Å; K728-Y836 WeakPolarHBondContact O-CE1 3.05Å; E729-Y836 HydrophobicContact CB-CD1 4.48Å; E729-Y836 HydrophobicContact CG-CG 4.21Å; G730-Y836 VanDerWaalsContact N-CZ 3.34Å; F732-Y836 HydrophobicContact CB-CE1 4.44Å; F732-Y836 AromaticContact CD2-CE1 3.75Å; F732-Y836 HydrophobicContact CD2-CE1 3.75Å; F732-Y836 PolarHBondContact N-OH 3.08Å; F732-Y836 PolarHBondContact O-OH 3.44Å; L737-Y836 HydrophobicContact CD1-CE2 4.09Å; E832-Y836 PolarHBondContact O-N 2.93Å; E832-Y836 VanDerWaalsContact O-N 3.13Å; V833-Y836 PolarHBondContact O-N 2.92Å
837	G	89.6	Confident	90	Very high	3 Å²	3	37.4 Å²	37.4	3%	0.031	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	86	22.7	175.4	0	0	0	0	0	114.3	R726 E832 S835	R726-G837 PolarHBondContact NH1-O 3.42Å; E832-G837 PolarHBondContact O-N 3Å; S835-G837 PolarHBondContact O-N 3.1Å
838	E	87.1	Confident	89	Confident	71 Å²	71	41 Å²	41	33%	0.332	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-57.4	153	166.3	-79.1	-170.8	-162.6	0	0	111.4	W831 S835 P840 W842	W831-E838 HydrophobicContact CH2-CB 3.74Å; W831-E838 HydrophobicContact CZ3-CB 3.8Å; S835-E838 WeakPolarHBondContact O-CG 3.25Å; S835-E838 PolarHBondContact O-N 3.38Å; E838-P840 WeakPolarHBondContact O-CD 3.31Å; E838-W842 PolarHBondContact OE2-NE1 3.41Å
839	R	87.1	Confident	88.1	Confident	138 Å²	138	41 Å²	41	52%	0.521	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-71.9	122	177.2	-178.2	177	174.4	164.3	-3.2	110.9	Y841 W842	R839-Y841 PolarHBondContact O-N 2.89Å; R839-W842 WeakPolarHBondContact CD-O 3.31Å; R839-W842 PolarHBondContact NE-O 2.83Å; R839-W842 PolarHBondContact O-N 3.13Å
840	P	91.5	Very high	87.4	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.4	176.1	-26.8	36.2	0	0	0	112.1	R805 W806 I828 W831 E832 E838 W842 L859	R805-P840 HydrophobicContact CB-CB 4.4Å; R805-P840 WeakPolarHBondContact CD-O 3.5Å; R805-P840 PolarHBondContact NH1-O 2.7Å; W806-P840 HydrophobicContact CZ2-CG 3.76Å; I828-P840 HydrophobicContact CG2-CB 3.78Å; I828-P840 HydrophobicContact CG2-CG 3.52Å; W831-P840 HydrophobicContact CE3-CG 4.47Å; E832-P840 HydrophobicContact CG-CG 3.73Å; E838-P840 WeakPolarHBondContact O-CD 3.31Å; P840-W842 PolarHBondContact O-N 3.47Å; P840-L859 HydrophobicContact CB-CD1 4.22Å
841	Y	84.8	Confident	86.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	18.9	-175.6	-54.8	-87.8	0	0	0	114.3	R805 I828 R839 D843 M844 V849 I853 Y857 L859	R805-Y841 HydrophobicContact CB-CD2 4.34Å; I828-Y841 HydrophobicContact CD1-CE2 4.02Å; R839-Y841 PolarHBondContact O-N 2.89Å; Y841-D843 PolarHBondContact O-N 2.82Å; Y841-M844 HydrophobicContact CD1-SD 4.22Å; Y841-M844 WeakPolarHBondContact O-CB 3.41Å; Y841-M844 WeakPolarHBondContact O-CG 3.27Å; Y841-M844 PolarHBondContact O-N 3.05Å; Y841-V849 HydrophobicContact CD1-CG1 4.38Å; Y841-V849 HydrophobicContact CD1-CG2 4.49Å; Y841-V849 HydrophobicContact CD2-CG1 3.81Å; Y841-V849 HydrophobicContact CD2-CG2 4.32Å; Y841-V849 HydrophobicContact CE2-CG1 4.02Å; Y841-V849 HydrophobicContact CG-CG1 4.01Å; Y841-V849 HydrophobicContact CG-CG2 3.91Å; Y841-I853 HydrophobicContact CE1-CG1 4.29Å; Y841-I853 HydrophobicContact CE2-CD1 4.32Å; Y841-Y857 HydrophobicContact CD1-CD1 4.25Å; Y841-Y857 AromaticContact CD1-CE1 3.99Å; Y841-Y857 HydrophobicContact CD1-CE1 3.99Å; Y841-Y857 AromaticContact CE1-CD1 3.94Å; Y841-Y857 HydrophobicContact CE1-CD1 3.94Å; Y841-Y857 HydrophobicContact CE1-CE1 4Å; Y841-L859 HydrophobicContact CD1-CD2 3.67Å; Y841-L859 HydrophobicContact CD1-CG 4.14Å; Y841-L859 HydrophobicContact CD2-CD1 4.31Å; Y841-L859 HydrophobicContact CD2-CD2 4.23Å; Y841-L859 HydrophobicContact CD2-CG 4.41Å; Y841-L859 HydrophobicContact CE1-CD2 3.9Å; Y841-L859 HydrophobicContact CE1-CG 3.85Å; Y841-L859 HydrophobicContact CE2-CD1 4.02Å; Y841-L859 HydrophobicContact CE2-CD2 4.45Å; Y841-L859 HydrophobicContact CE2-CG 4.14Å; Y841-L859 HydrophobicContact CG-CD2 3.84Å; Y841-L859 HydrophobicContact CG-CG 4.4Å
842	W	88.2	Confident	85.6	Confident	82 Å²	82	46.6 Å²	46.6	31%	0.311	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	-127.8	174.8	-49.9	-71.9	0	0	0	112.5	R805 W831 E838 R839 P840 P860	R805-W842 PolarHBondContact NH1-O 2.98Å; W831-W842 HydrophobicContact CZ2-CZ2 4.18Å; E838-W842 PolarHBondContact OE2-NE1 3.41Å; R839-W842 WeakPolarHBondContact CD-O 3.31Å; R839-W842 PolarHBondContact NE-O 2.83Å; R839-W842 PolarHBondContact O-N 3.13Å; P840-W842 PolarHBondContact O-N 3.47Å; W842-P860 HydrophobicContact CH2-CG 3.72Å; W842-P860 HydrophobicContact CZ2-CG 4.4Å
843	D	79.1	Confident	85	Confident	147 Å²	147	46.8 Å²	46.8	79%	0.786	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	5.9	-174.3	-58.3	-45.7	0	0	0	114.7	Y841 S845	Y841-D843 PolarHBondContact O-N 2.82Å; D843-S845 PolarHBondContact O-N 3.02Å
844	M	76.4	Confident	84.4	Confident	52 Å²	52	50.2 Å²	50.2	26%	0.256	25%	0.25	S	S	.	.			trans	-53.9	138.6	173.7	-68.7	177.9	68.8	0	0	110.1	R805 Y841 D848 V849 A852	R805-M844 PolarHBondContact NH1-O 3.36Å; R805-M844 PolarHBondContact NH2-O 3.4Å; Y841-M844 HydrophobicContact CD1-SD 4.22Å; Y841-M844 WeakPolarHBondContact O-CB 3.41Å; Y841-M844 WeakPolarHBondContact O-CG 3.27Å; Y841-M844 PolarHBondContact O-N 3.05Å; M844-D848 HydrophobicContact CB-CB 4.21Å; M844-D848 HydrophobicContact CE-CB 3.97Å; M844-D848 WeakPolarHBondContact CE-O 3.45Å; M844-V849 HydrophobicContact CB-CG2 3.73Å; M844-V849 HydrophobicContact CE-CG2 4.44Å; M844-A852 HydrophobicContact CE-CB 3.51Å
845	S	80.3	Confident	83.7	Confident	53 Å²	53	57.3 Å²	57.3	37%	0.371	28%	0.283	S	S	.	.			trans	-66.2	160.8	173.9	76.9	0	0	0	0	110.6	D843 Q847 D848 V849	D843-S845 PolarHBondContact O-N 3.02Å; S845-Q847 PolarHBondContact O-N 3.39Å; S845-Q847 PolarHBondContact OG-N 3.18Å; S845-D848 VanDerWaalsContact CB-OD2 3.29Å; S845-D848 WeakPolarHBondContact CB-OD2 3.2Å; S845-D848 PolarHBondContact N-OD2 2.62Å; S845-D848 VanDerWaalsContact N-OD2 3.16Å; S845-D848 PolarHBondContact O-N 2.76Å; S845-D848 VanDerWaalsContact O-N 3.08Å; S845-D848 PolarHBondContact OG-N 3.38Å; S845-D848 VanDerWaalsContact OG-N 3.12Å; S845-D848 PolarHBondContact OG-OD2 3.16Å; S845-V849 WeakPolarHBondContact O-CG2 3.45Å; S845-V849 PolarHBondContact O-N 3Å
846	N	83.6	Confident	83.3	Confident	77 Å²	77	61.7 Å²	61.7	41%	0.412	31%	0.306	S	S	.	.	H	α-helix	trans	-58.5	-31.6	176	-74.8	-6.5	0	0	0	111.9	I804 R805 I850	I804-N846 HydrophobicContact CB-CB 4.17Å; I804-N846 HydrophobicContact CG1-CB 4.21Å; I804-N846 HydrophobicContact CG2-CB 4.08Å; R805-N846 PolarHBondContact NE-OD1 2.92Å; N846-I850 VanDerWaalsContact O-CG1 3.29Å; N846-I850 WeakPolarHBondContact O-CG1 3.3Å; N846-I850 PolarHBondContact O-N 3.46Å
847	Q	83.4	Confident	82.8	Confident	99 Å²	99	63.5 Å²	63.5	46%	0.463	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-41.8	175.4	-170.2	59.9	47.1	0	0	111.7	S845 V849 I850 N851	S845-Q847 PolarHBondContact O-N 3.39Å; S845-Q847 PolarHBondContact OG-N 3.18Å; Q847-V849 VanDerWaalsContact C-N 3.31Å; Q847-V849 PolarHBondContact O-N 3.12Å; Q847-I850 PolarHBondContact O-N 3.19Å; Q847-N851 PolarHBondContact NE2-OD1 3.16Å; Q847-N851 PolarHBondContact O-N 3.33Å; Q847-N851 PolarHBondContact O-ND2 3.44Å; Q847-N851 PolarHBondContact O-OD1 3.31Å
848	D	78.3	Confident	82.8	Confident	77 Å²	77	65.2 Å²	65.2	41%	0.412	32%	0.319	S	S	.	.	H	α-helix	trans	-66.8	-35.2	177.5	-58.5	-42.3	0	0	0	111.8	M844 S845 N851 A852	M844-D848 HydrophobicContact CB-CB 4.21Å; M844-D848 HydrophobicContact CE-CB 3.97Å; M844-D848 WeakPolarHBondContact CE-O 3.45Å; S845-D848 VanDerWaalsContact CB-OD2 3.29Å; S845-D848 WeakPolarHBondContact CB-OD2 3.2Å; S845-D848 PolarHBondContact N-OD2 2.62Å; S845-D848 VanDerWaalsContact N-OD2 3.16Å; S845-D848 PolarHBondContact O-N 2.76Å; S845-D848 VanDerWaalsContact O-N 3.08Å; S845-D848 PolarHBondContact OG-N 3.38Å; S845-D848 VanDerWaalsContact OG-N 3.12Å; S845-D848 PolarHBondContact OG-OD2 3.16Å; D848-N851 PolarHBondContact O-N 2.93Å; D848-A852 WeakPolarHBondContact O-CB 3.43Å; D848-A852 PolarHBondContact O-N 2.97Å
849	V	79.9	Confident	82.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-46.1	174.3	173.3	0	0	0	0	110.8	R805 Y841 M844 S845 Q847 A852 I853	R805-V849 HydrophobicContact CG-CG1 4.46Å; R805-V849 HydrophobicContact CG-CG2 4.4Å; Y841-V849 HydrophobicContact CD1-CG1 4.38Å; Y841-V849 HydrophobicContact CD1-CG2 4.49Å; Y841-V849 HydrophobicContact CD2-CG1 3.81Å; Y841-V849 HydrophobicContact CD2-CG2 4.32Å; Y841-V849 HydrophobicContact CE2-CG1 4.02Å; Y841-V849 HydrophobicContact CG-CG1 4.01Å; Y841-V849 HydrophobicContact CG-CG2 3.91Å; M844-V849 HydrophobicContact CB-CG2 3.73Å; M844-V849 HydrophobicContact CE-CG2 4.44Å; S845-V849 WeakPolarHBondContact O-CG2 3.45Å; S845-V849 PolarHBondContact O-N 3Å; Q847-V849 VanDerWaalsContact C-N 3.31Å; Q847-V849 PolarHBondContact O-N 3.12Å; V849-A852 PolarHBondContact O-N 3.42Å; V849-I853 HydrophobicContact CG1-CD1 3.65Å; V849-I853 HydrophobicContact CG1-CG1 4.39Å; V849-I853 WeakPolarHBondContact O-CB 3.37Å; V849-I853 VanDerWaalsContact O-CG1 3.25Å; V849-I853 WeakPolarHBondContact O-CG1 3.37Å; V849-I853 PolarHBondContact O-N 3.3Å
850	I	82.6	Confident	82.5	Confident	39 Å²	39	57.7 Å²	57.7	20%	0.2	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-51.9	175.6	-67.4	165.2	0	0	0	109.8	I804 V812 N846 Q847 A852 I853 D854	I804-I850 HydrophobicContact CD1-CD1 4.49Å; I804-I850 HydrophobicContact CG2-CD1 4Å; I804-I850 HydrophobicContact CG2-CG1 3.77Å; V812-I850 HydrophobicContact CG1-CD1 3.98Å; V812-I850 HydrophobicContact CG1-CG1 4.19Å; N846-I850 VanDerWaalsContact O-CG1 3.29Å; N846-I850 WeakPolarHBondContact O-CG1 3.3Å; N846-I850 PolarHBondContact O-N 3.46Å; Q847-I850 PolarHBondContact O-N 3.19Å; I850-A852 VanDerWaalsContact C-N 3.32Å; I850-A852 PolarHBondContact O-N 3.44Å; I850-I853 PolarHBondContact O-N 3.46Å; I850-D854 WeakPolarHBondContact O-CB 3.27Å; I850-D854 PolarHBondContact O-N 2.95Å
851	N	79.6	Confident	81.9	Confident	68 Å²	68	60.9 Å²	60.9	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-41.6	-179.8	-66.1	-15.9	0	0	0	112.1	Q847 D848 D854 Q855	Q847-N851 PolarHBondContact NE2-OD1 3.16Å; Q847-N851 PolarHBondContact O-N 3.33Å; Q847-N851 PolarHBondContact O-ND2 3.44Å; Q847-N851 PolarHBondContact O-OD1 3.31Å; D848-N851 PolarHBondContact O-N 2.93Å; N851-D854 PolarHBondContact O-N 3.08Å; N851-Q855 WeakPolarHBondContact O-CB 3.28Å; N851-Q855 VanDerWaalsContact O-CG 3.24Å; N851-Q855 WeakPolarHBondContact O-CG 3.34Å; N851-Q855 PolarHBondContact O-N 2.97Å
852	A	77.6	Confident	81.9	Confident	13 Å²	13	61.3 Å²	61.3	11%	0.107	32%	0.317	C	S	.	.	H	α-helix	trans	-66.9	-45.9	179.2	0	0	0	0	0	111.5	M844 D848 V849 I850 D854 Q855 D856 Y857	M844-A852 HydrophobicContact CE-CB 3.51Å; D848-A852 WeakPolarHBondContact O-CB 3.43Å; D848-A852 PolarHBondContact O-N 2.97Å; V849-A852 PolarHBondContact O-N 3.42Å; I850-A852 VanDerWaalsContact C-N 3.32Å; I850-A852 PolarHBondContact O-N 3.44Å; A852-D854 VanDerWaalsContact C-N 3.28Å; A852-D854 PolarHBondContact O-N 2.97Å; A852-Q855 CarbonylContact O-C 3.3Å; A852-Q855 WeakPolarHBondContact O-CA 3.48Å; A852-Q855 PolarHBondContact O-N 2.83Å; A852-Q855 VanDerWaalsContact O-N 3.12Å; A852-D856 PolarHBondContact O-N 3.42Å; A852-Y857 HydrophobicContact CB-CD1 4.08Å; A852-Y857 HydrophobicContact CB-CG 4.22Å; A852-Y857 WeakPolarHBondContact O-CA 3.42Å; A852-Y857 WeakPolarHBondContact O-CB 3.33Å; A852-Y857 PolarHBondContact O-N 3.18Å
853	I	85.6	Confident	81.2	Confident	12 Å²	12	61.7 Å²	61.7	6%	0.062	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-40.5	177.7	-71.1	168.4	0	0	0	111	P809 W824 Y841 V849 I850 Q855 D856 R858	P809-I853 HydrophobicContact CG-CG2 3.69Å; W824-I853 HydrophobicContact CH2-CG2 3.78Å; W824-I853 HydrophobicContact CZ2-CD1 4.16Å; W824-I853 HydrophobicContact CZ2-CG1 4.41Å; W824-I853 HydrophobicContact CZ2-CG2 3.85Å; Y841-I853 HydrophobicContact CE1-CG1 4.29Å; Y841-I853 HydrophobicContact CE2-CD1 4.32Å; V849-I853 HydrophobicContact CG1-CD1 3.65Å; V849-I853 HydrophobicContact CG1-CG1 4.39Å; V849-I853 WeakPolarHBondContact O-CB 3.37Å; V849-I853 VanDerWaalsContact O-CG1 3.25Å; V849-I853 WeakPolarHBondContact O-CG1 3.37Å; V849-I853 PolarHBondContact O-N 3.3Å; I850-I853 PolarHBondContact O-N 3.46Å; I853-Q855 VanDerWaalsContact C-N 3.3Å; I853-Q855 PolarHBondContact O-N 3.25Å; I853-D856 WeakPolarHBondContact O-CA 3.35Å; I853-D856 PolarHBondContact O-N 3.2Å; I853-R858 PolarHBondContact O-NH1 3Å
854	D	83.1	Confident	80.9	Confident	72 Å²	72	62 Å²	62	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-34.4	176	-80.3	-19.9	0	0	0	112.5	I850 N851 A852 D856 K879	I850-D854 WeakPolarHBondContact O-CB 3.27Å; I850-D854 PolarHBondContact O-N 2.95Å; N851-D854 PolarHBondContact O-N 3.08Å; A852-D854 VanDerWaalsContact C-N 3.28Å; A852-D854 PolarHBondContact O-N 2.97Å; D854-D856 PolarHBondContact O-N 3.32Å; D854-K879 PolarHBondContact O-NZ 2.77Å
855	Q	79.7	Confident	81.2	Confident	158 Å²	158	60.2 Å²	60.2	74%	0.738	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	19.9	171.4	-67.2	174.3	9.7	0	0	113.4	N851 A852 I853 Y857	N851-Q855 WeakPolarHBondContact O-CB 3.28Å; N851-Q855 VanDerWaalsContact O-CG 3.24Å; N851-Q855 WeakPolarHBondContact O-CG 3.34Å; N851-Q855 PolarHBondContact O-N 2.97Å; A852-Q855 CarbonylContact O-C 3.3Å; A852-Q855 WeakPolarHBondContact O-CA 3.48Å; A852-Q855 PolarHBondContact O-N 2.83Å; A852-Q855 VanDerWaalsContact O-N 3.12Å; I853-Q855 VanDerWaalsContact C-N 3.3Å; I853-Q855 PolarHBondContact O-N 3.25Å; Q855-Y857 PolarHBondContact O-N 3.24Å; Q855-Y857 VanDerWaalsContact O-N 3.12Å
856	D	80.8	Confident	81.5	Confident	101 Å²	101	58 Å²	58	54%	0.54	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	20	178.8	-61.4	-44.8	0	0	0	114.9	A852 I853 D854 K879	A852-D856 PolarHBondContact O-N 3.42Å; I853-D856 WeakPolarHBondContact O-CA 3.35Å; I853-D856 PolarHBondContact O-N 3.2Å; D854-D856 PolarHBondContact O-N 3.32Å; D856-K879 IonicContact OD1-NZ 3.42Å
857	Y	81.7	Confident	81.5	Confident	70 Å²	70	57.2 Å²	57.2	28%	0.275	31%	0.306	S	S	.	.			trans	-69.4	136.2	169.4	-176.7	-96.5	0	0	0	110.2	Y841 A852 Q855	Y841-Y857 HydrophobicContact CD1-CD1 4.25Å; Y841-Y857 AromaticContact CD1-CE1 3.99Å; Y841-Y857 HydrophobicContact CD1-CE1 3.99Å; Y841-Y857 AromaticContact CE1-CD1 3.94Å; Y841-Y857 HydrophobicContact CE1-CD1 3.94Å; Y841-Y857 HydrophobicContact CE1-CE1 4Å; A852-Y857 HydrophobicContact CB-CD1 4.08Å; A852-Y857 HydrophobicContact CB-CG 4.22Å; A852-Y857 WeakPolarHBondContact O-CA 3.42Å; A852-Y857 WeakPolarHBondContact O-CB 3.33Å; A852-Y857 PolarHBondContact O-N 3.18Å; Q855-Y857 PolarHBondContact O-N 3.24Å; Q855-Y857 VanDerWaalsContact O-N 3.12Å
858	R	88.9	Confident	81.6	Confident	40 Å²	40	55 Å²	55	15%	0.151	30%	0.3	C	S	.	.			trans	-131.8	152.3	174.1	-61	-61.9	-179.6	-89.6	-4.3	109.1	I853 L874 W877	I853-R858 PolarHBondContact O-NH1 3Å; R858-L874 HydrophobicContact CB-CD2 4.02Å; R858-L874 HydrophobicContact CG-CD2 4.34Å; R858-W877 HydrophobicContact CB-CE3 4.16Å; R858-W877 HydrophobicContact CG-CB 4.48Å; R858-W877 PolarHBondContact NE-O 3.48Å; R858-W877 PolarHBondContact NH2-O 3.19Å
859	L	86.4	Confident	82.3	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-59.6	134.3	179.7	-70.8	168	0	0	0	110.6	I828 W831 P840 Y841 H870 W877	I828-L859 HydrophobicContact CD1-CD1 3.84Å; W831-L859 HydrophobicContact CB-CD1 4.39Å; W831-L859 HydrophobicContact CD2-CD1 3.85Å; W831-L859 HydrophobicContact CE3-CD1 4.23Å; W831-L859 HydrophobicContact CG-CB 4.25Å; W831-L859 HydrophobicContact CG-CD1 3.9Å; W831-L859 HydrophobicContact CZ2-CD2 4.47Å; P840-L859 HydrophobicContact CB-CD1 4.22Å; Y841-L859 HydrophobicContact CD1-CD2 3.67Å; Y841-L859 HydrophobicContact CD1-CG 4.14Å; Y841-L859 HydrophobicContact CD2-CD1 4.31Å; Y841-L859 HydrophobicContact CD2-CD2 4.23Å; Y841-L859 HydrophobicContact CD2-CG 4.41Å; Y841-L859 HydrophobicContact CE1-CD2 3.9Å; Y841-L859 HydrophobicContact CE1-CG 3.85Å; Y841-L859 HydrophobicContact CE2-CD1 4.02Å; Y841-L859 HydrophobicContact CE2-CD2 4.45Å; Y841-L859 HydrophobicContact CE2-CG 4.14Å; Y841-L859 HydrophobicContact CG-CD2 3.84Å; Y841-L859 HydrophobicContact CG-CG 4.4Å; L859-H870 PolarHBondContact O-CE1 3.28Å; L859-H870 VanDerWaalsContact O-CE1 3.3Å; L859-W877 HydrophobicContact CB-CH2 3.91Å; L859-W877 HydrophobicContact CB-CZ3 4.23Å; L859-W877 HydrophobicContact CD1-CH2 4.38Å; L859-W877 HydrophobicContact CD1-CZ2 4.37Å
860	P	80.7	Confident	82.9	Confident	49 Å²	49	52.6 Å²	52.6	32%	0.318	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-70.4	161.2	175.9	30.2	-34.3	0	0	0	111.3	W831 W842	W831-P860 PolarHBondContact NE1-O 3.41Å; W842-P860 HydrophobicContact CH2-CG 3.72Å; W842-P860 HydrophobicContact CZ2-CG 4.4Å
861	P	79.8	Confident	83.3	Confident	68 Å²	68	55.1 Å²	55.1	44%	0.442	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-61.4	133.9	175.7	25.1	-31.3	0	0	0	110.4	C865 H870	P861-C865 HydrophobicContact CB-CB 4.28Å; P861-H870 HydrophobicContact CB-CB 4.09Å; P861-H870 WeakPolarHBondContact CD-NE2 3.31Å
862	P	83.9	Confident	84.1	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.058	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-59.9	161.1	169.9	-25.3	36.2	0	0	0	112.3	W831 M834 D864 C865	W831-P862 HydrophobicContact CD2-CG 4.39Å; W831-P862 HydrophobicContact CG-CG 4.23Å; M834-P862 HydrophobicContact CB-CB 4.32Å; M834-P862 HydrophobicContact CB-CG 3.94Å; P862-D864 PolarHBondContact O-N 3.13Å; P862-C865 HydrophobicContact CB-CB 4.36Å; P862-C865 WeakPolarHBondContact O-CB 3.49Å; P862-C865 PolarHBondContact O-N 2.94Å
863	P	74.6	Confident	85	Confident	90 Å²	90	52 Å²	52	58%	0.584	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	138.9	172.6	-24	34.2	0	0	0	111.5	C865	P863-C865 PolarHBondContact O-N 3.24Å
864	D	71.3	Confident	85.4	Confident	155 Å²	155	53 Å²	53	83%	0.829	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	16.7	179.2	-54.3	-45.9	0	0	0	115.7	P862 P866	P862-D864 PolarHBondContact O-N 3.13Å; D864-P866 WeakPolarHBondContact O-CD 3.37Å
865	C	83.1	Confident	86	Confident	13 Å²	13	53.2 Å²	53.2	9%	0.088	29%	0.287	C	S	.	.			trans	-73.8	122.7	176.3	-176	0	0	0	0	111.3	M834 P861 P862 P863 T867	M834-C865 HydrophobicContact CE-CB 4.27Å; P861-C865 HydrophobicContact CB-CB 4.28Å; P862-C865 HydrophobicContact CB-CB 4.36Å; P862-C865 WeakPolarHBondContact O-CB 3.49Å; P862-C865 PolarHBondContact O-N 2.94Å; P863-C865 PolarHBondContact O-N 3.24Å; C865-T867 PolarHBondContact O-N 3.11Å
866	P	86.8	Confident	86.9	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.039	25%	0.252	C	S	.	.			trans	-56.9	133.5	174	-23.6	31	0	0	0	112.3	V734 D864 V868 L869 H870 L904	V734-P866 HydrophobicContact CG1-CG 3.46Å; V734-P866 VanDerWaalsContact CG1-CG 3.46Å; D864-P866 WeakPolarHBondContact O-CD 3.37Å; P866-V868 HydrophobicContact CB-CG1 4.46Å; P866-V868 PolarHBondContact O-N 2.83Å; P866-V868 VanDerWaalsContact O-N 3.11Å; P866-L869 HydrophobicContact CB-CD1 4.34Å; P866-L869 HydrophobicContact CG-CD1 3.96Å; P866-L869 WeakPolarHBondContact O-CB 3.24Å; P866-L869 PolarHBondContact O-N 3.36Å; P866-H870 PolarHBondContact O-N 3.27Å; P866-L904 HydrophobicContact CB-CB 4.5Å; P866-L904 HydrophobicContact CB-CD2 4.01Å; P866-L904 HydrophobicContact CG-CB 4.26Å; P866-L904 HydrophobicContact CG-CD2 3.97Å
867	T	84.1	Confident	87.7	Confident	61 Å²	61	41 Å²	41	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-53.9	-39	-179	-53.9	0	0	0	0	112.3	C865 L869 H870 L871	C865-T867 PolarHBondContact O-N 3.11Å; T867-L869 VanDerWaalsContact C-N 3.29Å; T867-L869 PolarHBondContact O-N 3.08Å; T867-H870 PolarHBondContact O-N 3.36Å; T867-L871 HydrophobicContact CG2-CD1 4.21Å; T867-L871 HydrophobicContact CG2-CG 4.38Å; T867-L871 WeakPolarHBondContact O-CG 3.37Å; T867-L871 PolarHBondContact O-N 3.32Å
868	V	86.5	Confident	88.3	Confident	54 Å²	54	40.2 Å²	40.2	33%	0.327	23%	0.226	S	C	.	.	H	α-helix	trans	-65.3	-30.2	-179.5	80.8	0	0	0	0	113.2	P866 L872 M897 L904	P866-V868 HydrophobicContact CB-CG1 4.46Å; P866-V868 PolarHBondContact O-N 2.83Å; P866-V868 VanDerWaalsContact O-N 3.11Å; V868-L872 PolarHBondContact O-N 3.06Å; V868-M897 HydrophobicContact CB-CE 4.43Å; V868-M897 HydrophobicContact CG1-CE 3.9Å; V868-M897 HydrophobicContact CG1-CG 4.15Å; V868-M897 HydrophobicContact CG1-SD 3.74Å; V868-M897 HydrophobicContact CG2-CE 3.97Å; V868-L904 HydrophobicContact CG1-CD2 4.09Å
869	L	91.8	Very high	88.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-76	-42.5	174.9	-78.9	172.7	0	0	0	110.9	V734 V738 M830 M834 P866 T867 L871 L872 M873 L894 M897 L904	V734-L869 HydrophobicContact CG1-CD1 4.49Å; V738-L869 HydrophobicContact CG2-CD1 3.62Å; V738-L869 HydrophobicContact CG2-CD2 4.19Å; V738-L869 HydrophobicContact CG2-CG 4.39Å; M830-L869 HydrophobicContact CE-CD2 4.04Å; M834-L869 HydrophobicContact CE-CD1 4.3Å; M834-L869 HydrophobicContact SD-CD1 3.91Å; P866-L869 HydrophobicContact CB-CD1 4.34Å; P866-L869 HydrophobicContact CG-CD1 3.96Å; P866-L869 WeakPolarHBondContact O-CB 3.24Å; P866-L869 PolarHBondContact O-N 3.36Å; T867-L869 VanDerWaalsContact C-N 3.29Å; T867-L869 PolarHBondContact O-N 3.08Å; L869-L871 VanDerWaalsContact C-N 3.33Å; L869-L871 PolarHBondContact O-N 2.97Å; L869-L872 WeakPolarHBondContact O-CB 3.47Å; L869-L872 PolarHBondContact O-N 3.26Å; L869-M873 WeakPolarHBondContact O-CG 3.19Å; L869-M873 PolarHBondContact O-N 3.33Å; L869-L894 HydrophobicContact CD2-CD2 3.74Å; L869-M897 HydrophobicContact CD2-CE 4.21Å; L869-M897 HydrophobicContact CD2-SD 3.51Å; L869-M897 VanDerWaalsContact CD2-SD 3.51Å; L869-M897 HydrophobicContact CG-SD 3.95Å; L869-L904 HydrophobicContact CD1-CD2 4.19Å; L869-L904 HydrophobicContact CG-CD2 4.28Å
870	H	93.1	Very high	88.4	Confident	26 Å²	26	47.9 Å²	47.9	12%	0.12	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-37.8	177.6	-174.7	55.1	0	0	0	112.4	L859 P861 P866 T867 L872 M873 L874	L859-H870 PolarHBondContact O-CE1 3.28Å; L859-H870 VanDerWaalsContact O-CE1 3.3Å; P861-H870 HydrophobicContact CB-CB 4.09Å; P861-H870 WeakPolarHBondContact CD-NE2 3.31Å; P866-H870 PolarHBondContact O-N 3.27Å; T867-H870 PolarHBondContact O-N 3.36Å; H870-L872 VanDerWaalsContact C-N 3.31Å; H870-L872 PolarHBondContact O-N 3.05Å; H870-M873 WeakPolarHBondContact O-CB 3.43Å; H870-M873 PolarHBondContact O-N 3.48Å; H870-M873 VanDerWaalsContact O-N 3.12Å; H870-L874 WeakPolarHBondContact O-CG 3.43Å; H870-L874 PolarHBondContact O-N 2.96Å
871	L	91.4	Very high	88.9	Confident	92 Å²	92	50 Å²	50	48%	0.482	26%	0.263	S	S	.	.	H	α-helix	trans	-59.3	-42.8	172.2	-72.7	173.1	0	0	0	111.7	T867 L869 M873 L874 D875	T867-L871 HydrophobicContact CG2-CD1 4.21Å; T867-L871 HydrophobicContact CG2-CG 4.38Å; T867-L871 WeakPolarHBondContact O-CG 3.37Å; T867-L871 PolarHBondContact O-N 3.32Å; L869-L871 VanDerWaalsContact C-N 3.33Å; L869-L871 PolarHBondContact O-N 2.97Å; L871-M873 VanDerWaalsContact C-N 3.3Å; L871-M873 PolarHBondContact O-N 2.93Å; L871-L874 HydrophobicContact CD2-CD1 4.47Å; L871-L874 WeakPolarHBondContact O-CB 3.47Å; L871-L874 PolarHBondContact O-N 3.34Å; L871-L874 VanDerWaalsContact O-N 3.16Å; L871-D875 PolarHBondContact O-N 3.36Å
872	L	95	Very high	89.5	Confident	14 Å²	14	52.3 Å²	52.3	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-34.3	175.1	-178.1	60.9	0	0	0	112.2	M830 V868 L869 H870 D875 C876 I890 A893 L894 M897	M830-L872 HydrophobicContact CE-CB 4.05Å; M830-L872 HydrophobicContact CE-CD2 3.83Å; M830-L872 HydrophobicContact CE-CG 3.9Å; M830-L872 HydrophobicContact SD-CD2 4.44Å; M830-L872 HydrophobicContact SD-CG 4.27Å; V868-L872 PolarHBondContact O-N 3.06Å; L869-L872 WeakPolarHBondContact O-CB 3.47Å; L869-L872 PolarHBondContact O-N 3.26Å; H870-L872 VanDerWaalsContact C-N 3.31Å; H870-L872 PolarHBondContact O-N 3.05Å; L872-D875 PolarHBondContact O-N 3.41Å; L872-C876 PolarHBondContact O-N 2.89Å; L872-C876 PolarHBondContact O-SG 2.77Å; L872-I890 HydrophobicContact CD1-CG1 4.47Å; L872-I890 HydrophobicContact CD2-CG2 4.39Å; L872-A893 HydrophobicContact CD1-CB 4.45Å; L872-A893 HydrophobicContact CD2-CB 4.06Å; L872-L894 HydrophobicContact CD2-CD2 4.15Å; L872-L894 HydrophobicContact CD2-CG 4.29Å; L872-M897 HydrophobicContact CD2-CE 4.1Å
873	M	97.4	Very high	90	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.9	-45	171.5	-60.1	169.2	-167.8	0	0	111.2	M830 W831 M834 L869 H870 L871 D875 C876 W877	M830-M873 HydrophobicContact CB-CE 3.9Å; M830-M873 HydrophobicContact CB-CG 3.76Å; M830-M873 HydrophobicContact CB-SD 4.41Å; M830-M873 HydrophobicContact CE-CG 3.85Å; M830-M873 WeakPolarHBondContact O-CE 3.22Å; M830-M873 HydrophobicContact SD-CG 4.12Å; W831-M873 HydrophobicContact CB-SD 4.27Å; M834-M873 HydrophobicContact CB-CE 4.17Å; M834-M873 HydrophobicContact CG-CE 3.72Å; L869-M873 WeakPolarHBondContact O-CG 3.19Å; L869-M873 PolarHBondContact O-N 3.33Å; H870-M873 WeakPolarHBondContact O-CB 3.43Å; H870-M873 PolarHBondContact O-N 3.48Å; H870-M873 VanDerWaalsContact O-N 3.12Å; L871-M873 VanDerWaalsContact C-N 3.3Å; L871-M873 PolarHBondContact O-N 2.93Å; M873-D875 VanDerWaalsContact C-N 3.32Å; M873-D875 PolarHBondContact O-N 2.99Å; M873-C876 WeakPolarHBondContact O-CA 3.35Å; M873-C876 WeakPolarHBondContact O-CB 3.2Å; M873-C876 PolarHBondContact O-N 2.56Å; M873-C876 VanDerWaalsContact O-N 3.08Å; M873-W877 HydrophobicContact CB-CE3 4.08Å; M873-W877 HydrophobicContact CB-CH2 3.74Å; M873-W877 HydrophobicContact CB-CZ2 4.19Å; M873-W877 HydrophobicContact CB-CZ3 3.67Å; M873-W877 HydrophobicContact CG-CH2 4.35Å; M873-W877 VanDerWaalsContact O-CD2 3.26Å; M873-W877 PolarHBondContact O-N 3.2Å; M873-W877 HydrophobicContact SD-CH2 4.19Å
874	L	94.1	Very high	91	Very high	33 Å²	33	53.2 Å²	53.2	17%	0.173	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-37.8	177.3	-67.5	171.6	0	0	0	112	R858 H870 L871 C876 W877 Q878	R858-L874 HydrophobicContact CB-CD2 4.02Å; R858-L874 HydrophobicContact CG-CD2 4.34Å; H870-L874 WeakPolarHBondContact O-CG 3.43Å; H870-L874 PolarHBondContact O-N 2.96Å; L871-L874 HydrophobicContact CD2-CD1 4.47Å; L871-L874 WeakPolarHBondContact O-CB 3.47Å; L871-L874 PolarHBondContact O-N 3.34Å; L871-L874 VanDerWaalsContact O-N 3.16Å; L874-C876 VanDerWaalsContact C-N 3.29Å; L874-C876 PolarHBondContact O-N 2.88Å; L874-W877 HydrophobicContact CD2-CE3 4.17Å; L874-W877 HydrophobicContact CD2-CZ3 4.5Å; L874-W877 CarbonylContact O-C 3.5Å; L874-W877 PolarHBondContact O-N 3.35Å; L874-W877 VanDerWaalsContact O-N 3.12Å; L874-Q878 PolarHBondContact O-N 2.95Å
875	D	95.8	Very high	92.3	Very high	77 Å²	77	46.8 Å²	46.8	41%	0.412	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-36.9	172.1	-68.7	-21.2	0	0	0	111.7	L871 L872 M873 W877 Q878 P885	L871-D875 PolarHBondContact O-N 3.36Å; L872-D875 PolarHBondContact O-N 3.41Å; M873-D875 VanDerWaalsContact C-N 3.32Å; M873-D875 PolarHBondContact O-N 2.99Å; D875-W877 VanDerWaalsContact C-N 3.31Å; D875-W877 PolarHBondContact O-N 3.31Å; D875-Q878 VanDerWaalsContact O-CG 3.32Å; D875-Q878 WeakPolarHBondContact O-CG 3.49Å; D875-P885 HydrophobicContact CB-CG 4.29Å; D875-P885 WeakPolarHBondContact O-CD 3.19Å
876	C	97.6	Very high	92.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.9	-28.5	173.8	-64.2	0	0	0	0	112.6	V823 L872 M873 L874 R884	V823-C876 HydrophobicContact CG1-CB 3.97Å; V823-C876 WeakPolarHBondContact O-CB 3.49Å; L872-C876 PolarHBondContact O-N 2.89Å; L872-C876 PolarHBondContact O-SG 2.77Å; M873-C876 WeakPolarHBondContact O-CA 3.35Å; M873-C876 WeakPolarHBondContact O-CB 3.2Å; M873-C876 PolarHBondContact O-N 2.56Å; M873-C876 VanDerWaalsContact O-N 3.08Å; L874-C876 VanDerWaalsContact C-N 3.29Å; L874-C876 PolarHBondContact O-N 2.88Å; C876-R884 VanDerWaalsContact O-CD 3.25Å; C876-R884 WeakPolarHBondContact O-CD 3.39Å; C876-R884 WeakPolarHBondContact O-CG 3.44Å
877	W	97.1	Very high	93.4	Very high	3 Å²	3	53.1 Å²	53.1	1%	0.011	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	23.1	-179	-56.6	-42.3	0	0	0	114.9	W824 G827 I828 W831 R858 L859 M873 L874 D875 K879	W824-W877 AromaticContact CD2-CD1 3.78Å; W824-W877 AromaticContact CE2-CD1 3.9Å; W824-W877 HydrophobicContact CE3-CB 4.14Å; W824-W877 HydrophobicContact CH2-CB 4.18Å; W824-W877 HydrophobicContact CZ3-CB 3.94Å; W824-W877 WeakPolarHBondContact CZ3-O 3.35Å; W824-W877 PolarHBondContact O-NE1 3.37Å; G827-W877 WeakPolarHBondContact O-CZ2 3.34Å; I828-W877 HydrophobicContact CD1-CZ2 3.73Å; I828-W877 HydrophobicContact CG1-CZ2 4.43Å; W831-W877 HydrophobicContact CB-CH2 4.04Å; W831-W877 HydrophobicContact CB-CZ2 4.13Å; W831-W877 HydrophobicContact CG-CH2 4.38Å; R858-W877 HydrophobicContact CB-CE3 4.16Å; R858-W877 HydrophobicContact CG-CB 4.48Å; R858-W877 PolarHBondContact NE-O 3.48Å; R858-W877 PolarHBondContact NH2-O 3.19Å; L859-W877 HydrophobicContact CB-CH2 3.91Å; L859-W877 HydrophobicContact CB-CZ3 4.23Å; L859-W877 HydrophobicContact CD1-CH2 4.38Å; L859-W877 HydrophobicContact CD1-CZ2 4.37Å; M873-W877 HydrophobicContact CB-CE3 4.08Å; M873-W877 HydrophobicContact CB-CH2 3.74Å; M873-W877 HydrophobicContact CB-CZ2 4.19Å; M873-W877 HydrophobicContact CB-CZ3 3.67Å; M873-W877 HydrophobicContact CG-CH2 4.35Å; M873-W877 VanDerWaalsContact O-CD2 3.26Å; M873-W877 PolarHBondContact O-N 3.2Å; M873-W877 HydrophobicContact SD-CH2 4.19Å; L874-W877 HydrophobicContact CD2-CE3 4.17Å; L874-W877 HydrophobicContact CD2-CZ3 4.5Å; L874-W877 CarbonylContact O-C 3.5Å; L874-W877 PolarHBondContact O-N 3.35Å; L874-W877 VanDerWaalsContact O-N 3.12Å; D875-W877 VanDerWaalsContact C-N 3.31Å; D875-W877 PolarHBondContact O-N 3.31Å; W877-K879 PolarHBondContact O-N 2.9Å
878	Q	95.3	Very high	94	Very high	54 Å²	54	55.9 Å²	55.9	25%	0.252	27%	0.272	S	S	.	.			trans	-59.7	134.9	169.4	-66.7	-61.7	-24.7	0	0	110.1	L874 D875 E880 Q883 R884	L874-Q878 PolarHBondContact O-N 2.95Å; D875-Q878 VanDerWaalsContact O-CG 3.32Å; D875-Q878 WeakPolarHBondContact O-CG 3.49Å; Q878-E880 VanDerWaalsContact C-N 3.33Å; Q878-E880 PolarHBondContact O-N 2.85Å; Q878-Q883 HydrophobicContact CB-CB 3.91Å; Q878-Q883 HydrophobicContact CG-CB 4.12Å; Q878-R884 HydrophobicContact CB-CG 3.99Å; Q878-R884 PolarHBondContact O-NE 2.88Å; Q878-R884 PolarHBondContact O-NH2 2.77Å
879	K	88.1	Confident	94.5	Very high	92 Å²	92	58.6 Å²	58.6	40%	0.4	28%	0.281	S	S	.	.	S	Bend	trans	-60.3	-47.4	-178.4	-168.3	169.7	-169.2	159.9	0	110.4	D854 D856 W877 R881 R884	D854-K879 PolarHBondContact O-NZ 2.77Å; D856-K879 IonicContact OD1-NZ 3.42Å; W877-K879 PolarHBondContact O-N 2.9Å; K879-R881 PolarHBondContact O-N 3.2Å; K879-R884 PolarHBondContact O-NH2 2.97Å
880	E	89.1	Confident	94.8	Very high	110 Å²	110	58.6 Å²	58.6	51%	0.514	28%	0.281	S	S	.	.	S	Bend	trans	-76.1	117.9	175.4	-66.9	-57.2	147.2	0	0	111.9	Q878 V882 Q883	Q878-E880 VanDerWaalsContact C-N 3.33Å; Q878-E880 PolarHBondContact O-N 2.85Å; E880-V882 HydrophobicContact CB-CG2 4.43Å; E880-V882 PolarHBondContact O-N 3.39Å; E880-Q883 HydrophobicContact CB-CB 4.42Å; E880-Q883 HydrophobicContact CB-CG 3.92Å; E880-Q883 WeakPolarHBondContact O-CB 3.02Å; E880-Q883 PolarHBondContact O-N 2.88Å
881	R	92.3	Very high	95	Very high	93 Å²	93	57.6 Å²	57.6	35%	0.351	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.3	-177.9	71.6	-178	-176.8	159.6	6.2	114.6	S820 K879 Q883	S820-R881 PolarHBondContact OG-O 2.77Å; K879-R881 PolarHBondContact O-N 3.2Å; R881-Q883 VanDerWaalsContact C-N 3.31Å
882	V	90.9	Very high	95.2	Very high	116 Å²	116	55.8 Å²	55.8	70%	0.703	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.5	-176.9	-62.9	0	0	0	0	112.9	E880	E880-V882 HydrophobicContact CB-CG2 4.43Å; E880-V882 PolarHBondContact O-N 3.39Å
883	Q	93.9	Very high	95.2	Very high	107 Å²	107	56.3 Å²	56.3	50%	0.5	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-14.2	177.7	-62.7	180	5.3	0	0	112	Q878 E880 R881	Q878-Q883 HydrophobicContact CB-CB 3.91Å; Q878-Q883 HydrophobicContact CG-CB 4.12Å; E880-Q883 HydrophobicContact CB-CB 4.42Å; E880-Q883 HydrophobicContact CB-CG 3.92Å; E880-Q883 WeakPolarHBondContact O-CB 3.02Å; E880-Q883 PolarHBondContact O-N 2.88Å; R881-Q883 VanDerWaalsContact C-N 3.31Å
884	R	97.1	Very high	95.1	Very high	11 Å²	11	56.3 Å²	56.3	4%	0.042	28%	0.278	C	S	.	.	S	Bend	trans	-71.1	141.2	176.4	-59.2	178.5	-165.5	153	9.5	110.2	E810 S820 V823 C876 Q878 K879	E810-R884 IonicContact OE1-CZ 3.78Å; E810-R884 IonicContact OE1-NH1 2.85Å; E810-R884 PolarHBondContact OE1-NH1 2.96Å; E810-R884 IonicContact OE1-NH2 3.86Å; E810-R884 PolarHBondContact OE1-NH2 3.02Å; E810-R884 IonicContact OE2-CZ 2.8Å; E810-R884 IonicContact OE2-NH1 3.13Å; E810-R884 PolarHBondContact OE2-NH1 2.8Å; E810-R884 IonicContact OE2-NH2 2.98Å; E810-R884 PolarHBondContact OE2-NH2 3.5Å; S820-R884 WeakPolarHBondContact O-CD 3.48Å; S820-R884 PolarHBondContact O-NH1 3.16Å; V823-R884 HydrophobicContact CG1-CB 3.96Å; C876-R884 VanDerWaalsContact O-CD 3.25Å; C876-R884 WeakPolarHBondContact O-CD 3.39Å; C876-R884 WeakPolarHBondContact O-CG 3.44Å; Q878-R884 HydrophobicContact CB-CG 3.99Å; Q878-R884 PolarHBondContact O-NE 2.88Å; Q878-R884 PolarHBondContact O-NH2 2.77Å; K879-R884 PolarHBondContact O-NH2 2.97Å
885	P	97.3	Very high	95.1	Very high	20 Å²	20	56.5 Å²	56.5	13%	0.13	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-66.4	148.2	177.3	28.1	-34.2	0	0	0	111	V823 D875 Q889 I890	V823-P885 HydrophobicContact CG1-CG 4.39Å; V823-P885 WeakPolarHBondContact CG1-O 3.45Å; V823-P885 WeakPolarHBondContact CG2-O 3.33Å; D875-P885 HydrophobicContact CB-CG 4.29Å; D875-P885 WeakPolarHBondContact O-CD 3.19Å; P885-Q889 HydrophobicContact CB-CB 4.23Å; P885-I890 HydrophobicContact CB-CG1 4.04Å; P885-I890 HydrophobicContact CG-CD1 4.1Å; P885-I890 HydrophobicContact CG-CG1 3.85Å
886	K	96	Very high	95	Very high	149 Å²	149	60 Å²	60	65%	0.648	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-72.9	153.3	167.9	-63.2	-175	179.2	-176.3	0	110	E888 Q889 I890	K886-E888 PolarHBondContact O-N 3.01Å; K886-E888 VanDerWaalsContact O-N 3.11Å; K886-Q889 WeakPolarHBondContact O-CA 3.45Å; K886-Q889 WeakPolarHBondContact O-CB 3.33Å; K886-Q889 PolarHBondContact O-N 2.74Å; K886-I890 PolarHBondContact O-N 2.98Å; K886-I890 VanDerWaalsContact O-N 3.12Å
887	F	97.8	Very high	94.7	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-54.7	-33	177.5	-79.3	-69	0	0	0	114	M748 R749 D822 V823 Y826 Q889 I890 V891	M748-F887 HydrophobicContact CB-CD1 3.57Å; M748-F887 HydrophobicContact CB-CD2 4.03Å; M748-F887 HydrophobicContact CB-CE1 3.33Å; M748-F887 HydrophobicContact CB-CE2 3.81Å; M748-F887 HydrophobicContact CB-CG 3.93Å; M748-F887 HydrophobicContact CB-CZ 3.47Å; M748-F887 VanDerWaalsContact CB-CZ 3.47Å; M748-F887 HydrophobicContact CE-CE2 4.07Å; M748-F887 HydrophobicContact CE-CZ 3.97Å; M748-F887 HydrophobicContact CG-CE1 3.97Å; M748-F887 HydrophobicContact CG-CZ 3.99Å; R749-F887 HydrophobicContact CB-CB 3.75Å; R749-F887 HydrophobicContact CG-CB 4.28Å; D822-F887 HydrophobicContact CB-CE2 4.04Å; D822-F887 HydrophobicContact CB-CZ 4.11Å; V823-F887 HydrophobicContact CG2-CD2 3.92Å; V823-F887 HydrophobicContact CG2-CE1 4.34Å; V823-F887 HydrophobicContact CG2-CE2 3.64Å; V823-F887 HydrophobicContact CG2-CG 4.37Å; V823-F887 HydrophobicContact CG2-CZ 3.86Å; Y826-F887 HydrophobicContact CD1-CE1 4.33Å; Y826-F887 HydrophobicContact CD2-CE1 4.05Å; Y826-F887 AromaticContact CG-CE1 3.76Å; Y826-F887 HydrophobicContact CG-CE1 3.76Å; F887-Q889 VanDerWaalsContact C-N 3.31Å; F887-Q889 PolarHBondContact O-N 2.75Å; F887-I890 HydrophobicContact CD1-CD1 4.05Å; F887-I890 HydrophobicContact CE1-CD1 4.37Å; F887-I890 PolarHBondContact O-N 2.87Å; F887-V891 WeakPolarHBondContact O-CG2 3.17Å; F887-V891 PolarHBondContact O-N 2.98Å
888	E	96.2	Very high	94.4	Very high	119 Å²	119	63.2 Å²	63.2	56%	0.556	31%	0.307	S	S	*	.	H	α-helix	trans	-59.1	-40.5	172.6	-174.1	-176.1	-169.3	0	0	113.1	R749 K886 S892	R749-E888 HydrophobicContact CG-CB 4.43Å; K886-E888 PolarHBondContact O-N 3.01Å; K886-E888 VanDerWaalsContact O-N 3.11Å; E888-S892 WeakPolarHBondContact O-CB 3.4Å; E888-S892 PolarHBondContact O-N 2.93Å; E888-S892 PolarHBondContact O-OG 3.46Å
889	Q	97.1	Very high	94.2	Very high	111 Å²	111	70.2 Å²	70.2	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-70.8	-38.6	178	-61.8	171.9	-49.4	0	0	110.8	P885 K886 F887 S892 A893	P885-Q889 HydrophobicContact CB-CB 4.23Å; K886-Q889 WeakPolarHBondContact O-CA 3.45Å; K886-Q889 WeakPolarHBondContact O-CB 3.33Å; K886-Q889 PolarHBondContact O-N 2.74Å; F887-Q889 VanDerWaalsContact C-N 3.31Å; F887-Q889 PolarHBondContact O-N 2.75Å; Q889-S892 PolarHBondContact O-N 2.92Å; Q889-A893 WeakPolarHBondContact O-CB 3.29Å; Q889-A893 PolarHBondContact O-N 2.79Å
890	I	98.1	Very high	94.1	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-50	175.4	-61.7	175.1	0	0	0	110.7	A745 V823 Y826 L872 P885 K886 F887 S892 A893 L894	A745-I890 HydrophobicContact CB-CG2 3.97Å; V823-I890 HydrophobicContact CG1-CD1 3.99Å; V823-I890 HydrophobicContact CG2-CD1 4.33Å; Y826-I890 HydrophobicContact CD1-CD1 4.03Å; Y826-I890 HydrophobicContact CD1-CG2 4.12Å; Y826-I890 HydrophobicContact CE1-CD1 4.37Å; Y826-I890 HydrophobicContact CE1-CG2 3.41Å; Y826-I890 VanDerWaalsContact CE1-CG2 3.41Å; L872-I890 HydrophobicContact CD1-CG1 4.47Å; L872-I890 HydrophobicContact CD2-CG2 4.39Å; P885-I890 HydrophobicContact CB-CG1 4.04Å; P885-I890 HydrophobicContact CG-CD1 4.1Å; P885-I890 HydrophobicContact CG-CG1 3.85Å; K886-I890 PolarHBondContact O-N 2.98Å; K886-I890 VanDerWaalsContact O-N 3.12Å; F887-I890 HydrophobicContact CD1-CD1 4.05Å; F887-I890 HydrophobicContact CE1-CD1 4.37Å; F887-I890 PolarHBondContact O-N 2.87Å; I890-S892 VanDerWaalsContact C-N 3.28Å; I890-S892 PolarHBondContact O-N 2.94Å; I890-A893 WeakPolarHBondContact O-CB 3.37Å; I890-A893 PolarHBondContact O-N 2.92Å; I890-A893 VanDerWaalsContact O-N 3.09Å; I890-L894 HydrophobicContact CG2-CD1 3.99Å; I890-L894 WeakPolarHBondContact O-CG 3.35Å; I890-L894 PolarHBondContact O-N 2.93Å
891	V	97.9	Very high	93.7	Very high	4 Å²	4	70.4 Å²	70.4	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-57.2	-44.5	176.2	172	0	0	0	0	110.5	A745 A746 R749 F887 A893 L894 D895	A745-V891 HydrophobicContact CB-CG2 3.66Å; A746-V891 HydrophobicContact CB-CG2 4.42Å; R749-V891 HydrophobicContact CB-CG2 4.43Å; F887-V891 WeakPolarHBondContact O-CG2 3.17Å; F887-V891 PolarHBondContact O-N 2.98Å; V891-A893 VanDerWaalsContact C-N 3.31Å; V891-A893 PolarHBondContact O-N 3.15Å; V891-L894 PolarHBondContact O-N 3.04Å; V891-D895 WeakPolarHBondContact O-CB 3.46Å; V891-D895 PolarHBondContact O-N 3.29Å
892	S	96.2	Very high	92.9	Very high	54 Å²	54	70.1 Å²	70.1	38%	0.378	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-35.8	177.5	-62.2	0	0	0	0	112.8	E888 Q889 I890 K896	E888-S892 WeakPolarHBondContact O-CB 3.4Å; E888-S892 PolarHBondContact O-N 2.93Å; E888-S892 PolarHBondContact O-OG 3.46Å; Q889-S892 PolarHBondContact O-N 2.92Å; I890-S892 VanDerWaalsContact C-N 3.28Å; I890-S892 PolarHBondContact O-N 2.94Å; S892-K896 VanDerWaalsContact O-CG 3.25Å; S892-K896 WeakPolarHBondContact O-CG 3.24Å; S892-K896 PolarHBondContact O-N 3.18Å
893	A	94.5	Very high	91.8	Very high	25 Å²	25	66.7 Å²	66.7	21%	0.207	33%	0.333	C	S	.	.	H	α-helix	trans	-67.7	-46.6	175.9	0	0	0	0	0	111.3	L872 Q889 I890 V891 K896 M897	L872-A893 HydrophobicContact CD1-CB 4.45Å; L872-A893 HydrophobicContact CD2-CB 4.06Å; Q889-A893 WeakPolarHBondContact O-CB 3.29Å; Q889-A893 PolarHBondContact O-N 2.79Å; I890-A893 WeakPolarHBondContact O-CB 3.37Å; I890-A893 PolarHBondContact O-N 2.92Å; I890-A893 VanDerWaalsContact O-N 3.09Å; V891-A893 VanDerWaalsContact C-N 3.31Å; V891-A893 PolarHBondContact O-N 3.15Å; A893-K896 WeakPolarHBondContact O-CB 3.49Å; A893-K896 PolarHBondContact O-N 2.64Å; A893-M897 HydrophobicContact CB-CE 4.44Å; A893-M897 WeakPolarHBondContact O-CG 3.31Å; A893-M897 PolarHBondContact O-N 3.41Å; A893-M897 VanDerWaalsContact O-N 3.12Å
894	L	95.9	Very high	90.8	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-41.2	178.8	-64.1	167.9	0	0	0	112	V738 L741 R742 A745 Y826 L869 L872 I890 V891 K896 M897 I898	V738-L894 HydrophobicContact CG1-CD2 4.19Å; L741-L894 HydrophobicContact CB-CD1 4.3Å; R742-L894 HydrophobicContact CB-CB 4.02Å; R742-L894 HydrophobicContact CB-CD1 4.21Å; R742-L894 HydrophobicContact CG-CB 4.14Å; A745-L894 HydrophobicContact CB-CD1 4.08Å; Y826-L894 VanDerWaalsContact OH-CD1 3.23Å; Y826-L894 WeakPolarHBondContact OH-CD1 3.36Å; L869-L894 HydrophobicContact CD2-CD2 3.74Å; L872-L894 HydrophobicContact CD2-CD2 4.15Å; L872-L894 HydrophobicContact CD2-CG 4.29Å; I890-L894 HydrophobicContact CG2-CD1 3.99Å; I890-L894 WeakPolarHBondContact O-CG 3.35Å; I890-L894 PolarHBondContact O-N 2.93Å; V891-L894 PolarHBondContact O-N 3.04Å; L894-K896 VanDerWaalsContact C-N 3.26Å; L894-K896 PolarHBondContact O-N 2.93Å; L894-M897 HydrophobicContact CD2-SD 4.21Å; L894-M897 WeakPolarHBondContact O-CB 3.5Å; L894-M897 PolarHBondContact O-N 3.48Å; L894-I898 WeakPolarHBondContact O-CG1 3.48Å; L894-I898 PolarHBondContact O-N 2.99Å
895	D	93.8	Very high	89.1	Confident	37 Å²	37	70.4 Å²	70.4	20%	0.198	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-37	174.5	-81.2	-13.1	0	0	0	111.5	R742 V891 I898 R899	R742-D895 WeakPolarHBondContact CG-OD1 3.23Å; R742-D895 IonicContact CZ-OD1 3.6Å; R742-D895 IonicContact NE-OD1 3.41Å; R742-D895 PolarHBondContact NE-OD1 3.35Å; R742-D895 IonicContact NH2-OD1 2.92Å; R742-D895 IonicContact NH2-OD2 2.91Å; V891-D895 WeakPolarHBondContact O-CB 3.46Å; V891-D895 PolarHBondContact O-N 3.29Å; D895-I898 PolarHBondContact O-N 3.31Å; D895-R899 WeakPolarHBondContact O-CB 3.27Å; D895-R899 VanDerWaalsContact O-CG 3.27Å; D895-R899 WeakPolarHBondContact O-CG 3.33Å; D895-R899 PolarHBondContact O-N 3.42Å
896	K	92.4	Very high	86.7	Confident	150 Å²	150	72.1 Å²	72.1	65%	0.652	36%	0.364	S	S	*	.	H	α-helix	trans	-65	-40.2	173.7	-74.5	169.3	-173.6	175.6	0	111.8	S892 A893 L894 R899 K900	S892-K896 VanDerWaalsContact O-CG 3.25Å; S892-K896 WeakPolarHBondContact O-CG 3.24Å; S892-K896 PolarHBondContact O-N 3.18Å; A893-K896 WeakPolarHBondContact O-CB 3.49Å; A893-K896 PolarHBondContact O-N 2.64Å; L894-K896 VanDerWaalsContact C-N 3.26Å; L894-K896 PolarHBondContact O-N 2.93Å; K896-R899 PolarHBondContact O-N 3.02Å; K896-K900 PolarHBondContact O-N 3.41Å
897	M	91.6	Very high	84.3	Confident	13 Å²	13	71.1 Å²	71.1	6%	0.064	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-41.1	176.9	-63.4	175.7	-158.6	0	0	111.7	V738 V868 L869 L872 A893 L894 K900 L904	V738-M897 HydrophobicContact CG1-CB 4.43Å; V868-M897 HydrophobicContact CB-CE 4.43Å; V868-M897 HydrophobicContact CG1-CE 3.9Å; V868-M897 HydrophobicContact CG1-CG 4.15Å; V868-M897 HydrophobicContact CG1-SD 3.74Å; V868-M897 HydrophobicContact CG2-CE 3.97Å; L869-M897 HydrophobicContact CD2-CE 4.21Å; L869-M897 HydrophobicContact CD2-SD 3.51Å; L869-M897 VanDerWaalsContact CD2-SD 3.51Å; L869-M897 HydrophobicContact CG-SD 3.95Å; L872-M897 HydrophobicContact CD2-CE 4.1Å; A893-M897 HydrophobicContact CB-CE 4.44Å; A893-M897 WeakPolarHBondContact O-CG 3.31Å; A893-M897 PolarHBondContact O-N 3.41Å; A893-M897 VanDerWaalsContact O-N 3.12Å; L894-M897 HydrophobicContact CD2-SD 4.21Å; L894-M897 WeakPolarHBondContact O-CB 3.5Å; L894-M897 PolarHBondContact O-N 3.48Å; M897-K900 CarbonylContact O-C 3.6Å; M897-K900 PolarHBondContact O-N 3.47Å; M897-L904 HydrophobicContact CB-CD2 4.13Å; M897-L904 HydrophobicContact CB-CG 4.39Å; M897-L904 HydrophobicContact CG-CD2 4.39Å; M897-L904 HydrophobicContact SD-CD2 4.2Å
898	I	91.9	Very high	81.5	Confident	58 Å²	58	73.5 Å²	73.5	30%	0.297	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-42.9	176.1	-65.9	168.9	0	0	0	111.1	L735 V738 R742 L894 D895 K900 P901	L735-I898 HydrophobicContact CD1-CB 4.43Å; L735-I898 HydrophobicContact CD1-CG1 4.28Å; L735-I898 HydrophobicContact CD1-CG2 4.39Å; V738-I898 HydrophobicContact CG1-CD1 4.11Å; V738-I898 HydrophobicContact CG1-CG1 3.6Å; R742-I898 HydrophobicContact CB-CD1 3.97Å; R742-I898 HydrophobicContact CG-CD1 3.96Å; L894-I898 WeakPolarHBondContact O-CG1 3.48Å; L894-I898 PolarHBondContact O-N 2.99Å; D895-I898 PolarHBondContact O-N 3.31Å; I898-K900 VanDerWaalsContact C-N 3.28Å; I898-K900 PolarHBondContact O-N 2.8Å; I898-P901 WeakPolarHBondContact O-CD 3.47Å; I898-P901 WeakPolarHBondContact O-CG 3.48Å
899	R	89.8	Confident	78.5	Confident	202 Å²	202	75 Å²	75	76%	0.762	41%	0.414	S	S	*	.	H	α-helix	trans	-70.8	-21.6	178	-70.2	177.8	-166.7	-164.8	5.7	113.4	D895 K896	D895-R899 WeakPolarHBondContact O-CB 3.27Å; D895-R899 VanDerWaalsContact O-CG 3.27Å; D895-R899 WeakPolarHBondContact O-CG 3.33Å; D895-R899 PolarHBondContact O-N 3.42Å; K896-R899 PolarHBondContact O-N 3.02Å
900	K	86.4	Confident	75.3	Confident	146 Å²	146	73.8 Å²	73.8	64%	0.635	43%	0.431	S	S	*	.			trans	-129.5	73.7	177.2	-66.1	-173.9	178.9	-176.7	0	111.3	K896 M897 I898 S902 A903	K896-K900 PolarHBondContact O-N 3.41Å; M897-K900 CarbonylContact O-C 3.6Å; M897-K900 PolarHBondContact O-N 3.47Å; I898-K900 VanDerWaalsContact C-N 3.28Å; I898-K900 PolarHBondContact O-N 2.8Å; K900-S902 PolarHBondContact O-N 2.64Å; K900-A903 WeakPolarHBondContact O-CB 3.36Å; K900-A903 PolarHBondContact O-N 3.04Å
901	P	81.6	Confident	72.3	Confident	59 Å²	59	80.1 Å²	80.1	38%	0.383	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-60.8	-20	-177.7	-23.2	33.9	0	0	0	114.3	L735 I898 A903 L904	L735-P901 HydrophobicContact CD1-CG 4.48Å; I898-P901 WeakPolarHBondContact O-CD 3.47Å; I898-P901 WeakPolarHBondContact O-CG 3.48Å; P901-A903 PolarHBondContact O-N 2.97Å; P901-L904 WeakPolarHBondContact O-CB 3.47Å; P901-L904 PolarHBondContact O-N 3.14Å; P901-L904 VanDerWaalsContact O-N 3.09Å
902	S	73.9	Confident	68.9	Low	87 Å²	87	83.3 Å²	83.3	61%	0.608	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-61.5	-28.7	172.9	54.3	0	0	0	0	113.1	K900 L904 K905	K900-S902 PolarHBondContact O-N 2.64Å; S902-L904 PolarHBondContact O-N 2.91Å; S902-K905 WeakPolarHBondContact O-CB 3.44Å; S902-K905 PolarHBondContact O-N 3.27Å; S902-K905 VanDerWaalsContact O-N 3.13Å
903	A	67.9	Low	65.6	Low	44 Å²	44	92.3 Å²	92.3	36%	0.364	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-67.9	-20.5	175.3	0	0	0	0	0	112.7	K900 P901 K905	K900-A903 WeakPolarHBondContact O-CB 3.36Å; K900-A903 PolarHBondContact O-N 3.04Å; P901-A903 PolarHBondContact O-N 2.97Å; A903-K905 VanDerWaalsContact C-N 3.32Å
904	L	73.3	Confident	62.7	Low	21 Å²	21	96.2 Å²	96.2	11%	0.11	56%	0.558	C	S	.	*	G	3₁₀ helix	trans	-82.9	-9.2	175.1	-62.2	167.2	0	0	0	112.6	V734 L735 V738 P866 V868 L869 M897 P901 S902	V734-L904 HydrophobicContact CG1-CB 4.39Å; V734-L904 HydrophobicContact CG1-CD1 4.33Å; V734-L904 HydrophobicContact CG1-CD2 4.35Å; L735-L904 HydrophobicContact CD1-CD1 4.28Å; V738-L904 HydrophobicContact CG2-CD1 4.18Å; V738-L904 HydrophobicContact CG2-CD2 4.15Å; P866-L904 HydrophobicContact CB-CB 4.5Å; P866-L904 HydrophobicContact CB-CD2 4.01Å; P866-L904 HydrophobicContact CG-CB 4.26Å; P866-L904 HydrophobicContact CG-CD2 3.97Å; V868-L904 HydrophobicContact CG1-CD2 4.09Å; L869-L904 HydrophobicContact CD1-CD2 4.19Å; L869-L904 HydrophobicContact CG-CD2 4.28Å; M897-L904 HydrophobicContact CB-CD2 4.13Å; M897-L904 HydrophobicContact CB-CG 4.39Å; M897-L904 HydrophobicContact CG-CD2 4.39Å; M897-L904 HydrophobicContact SD-CD2 4.2Å; P901-L904 WeakPolarHBondContact O-CB 3.47Å; P901-L904 PolarHBondContact O-N 3.14Å; P901-L904 VanDerWaalsContact O-N 3.09Å; S902-L904 PolarHBondContact O-N 2.91Å
905	K	60.9	Low	59.4	Low	176 Å²	176	101.4 Å²	101.4	77%	0.765	59%	0.594	S	S	*	*	S	Bend	trans	-91.2	-11.2	178.2	-63.5	-174.1	176.4	-174.3	0	113.9	S902 A903 T907	S902-K905 WeakPolarHBondContact O-CB 3.44Å; S902-K905 PolarHBondContact O-N 3.27Å; S902-K905 VanDerWaalsContact O-N 3.13Å; A903-K905 VanDerWaalsContact C-N 3.32Å; K905-T907 PolarHBondContact O-N 3.2Å; K905-T907 VanDerWaalsContact O-N 3.12Å
906	A	48.3	Very low	56.3	Low	55 Å²	55	107 Å²	107	46%	0.455	62%	0.619	S	S	.	*			trans	-81.3	90.9	-177.9	0	0	0	0	0	110.6	G908	A906-G908 PolarHBondContact O-N 2.87Å
907	T	45.5	Very low	53.2	Low	129 Å²	129	105.9 Å²	105.9	79%	0.791	63%	0.627	S	S	*	*			trans	-69.8	103.5	150.5	39.8	0	0	0	0	106.3	K905	K905-T907 PolarHBondContact O-N 3.2Å; K905-T907 VanDerWaalsContact O-N 3.12Å
908	G	38.6	Very low	50.3	Low	54 Å²	54	111.6 Å²	111.6	56%	0.557	66%	0.657	S	S	*	*	S	Bend	trans	-63	137.4	-150.1	0	0	0	0	0	118.9	A906	A906-G908 PolarHBondContact O-N 2.87Å
909	T	32.6	Very low	47.4	Very low	150 Å²	150	115.6 Å²	115.6	92%	0.92	68%	0.678	S	S	*	*			trans	-132.7	119.3	138.4	48.7	0	0	0	0	107.6
910	G	29.4	Very low	44.5	Very low	85 Å²	85	110 Å²	110	88%	0.876	67%	0.671	S	S	*	*			trans	156	118.4	171.6	0	0	0	0	0	116.4
911	S	35.8	Very low	42.2	Very low	133 Å²	133	111 Å²	111	93%	0.93	68%	0.683	S	S	*	*			trans	-78	156.9	-169.1	167.6	0	0	0	0	117.3
912	G	27.3	Very low	40	Very low	71 Å²	71	112 Å²	112	73%	0.732	69%	0.691	S	S	*	*			trans	168	76.1	155.4	0	0	0	0	0	120.7
913	R	25.3	Very low	38.4	Very low	244 Å²	244	112.3 Å²	112.3	92%	0.921	69%	0.691	S	S	*	*			trans	69.8	156.7	153.5	-103.2	-176.4	176	175.4	-0.4	122
914	P	33.6	Very low	37.3	Very low	106 Å²	106	111.4 Å²	111.4	69%	0.688	68%	0.681	S	S	*	*				-117.5	133.9	-53.5	30.1	-11.8	0	0	0	113.5
915	S	28.6	Very low	36.1	Very low	110 Å²	110	116.2 Å²	116.2	77%	0.769	71%	0.707	S	S	*	*			trans	36.5	95	153.2	59.4	0	0	0	0	120.5
916	Q	27.4	Very low	35.7	Very low	154 Å²	154	109.3 Å²	109.3	72%	0.72	68%	0.677	S	S	*	*				-112.4	126.4	129.8	-86.4	-172.6	-13.4	0	0	108.4	L918	Q916-L918 PolarHBondContact O-N 3Å
917	P	26.5	Very low	35.7	Very low	126 Å²	126	112 Å²	112	82%	0.818	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	20	-161.2	-11.9	29.8	0	0	0	116
918	L	30.9	Very low	35.9	Very low	134 Å²	134	109.9 Å²	109.9	70%	0.702	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-4.7	-170.2	-69.8	172	0	0	0	115.3	Q916 K940	Q916-L918 PolarHBondContact O-N 3Å; L918-K940 PolarHBondContact O-NZ 3.02Å
919	L	32	Very low	37	Very low	141 Å²	141	108.8 Å²	108.8	74%	0.738	66%	0.662	S	S	*	*			trans	-136	45	-179.8	-73.9	166.6	0	0	0	112.7	N921	L919-N921 PolarHBondContact O-N 3.08Å
920	S	28.3	Very low	38.5	Very low	86 Å²	86	106.4 Å²	106.4	60%	0.601	65%	0.651	S	S	*	*			trans	-73.9	100.7	162.5	158.6	0	0	0	0	109.1	S922	S920-S922 PolarHBondContact O-N 3.37Å; S920-S922 PolarHBondContact OG-N 3.24Å; S920-S922 PolarHBondContact OG-OG 3.4Å
921	N	37.6	Very low	40.8	Very low	166 Å²	166	104 Å²	104	89%	0.888	62%	0.621	S	S	*	*			trans	-82.7	63.7	151.5	-93.4	8.4	0	0	0	108.6	L919	L919-N921 PolarHBondContact O-N 3.08Å
922	S	35.5	Very low	43	Very low	81 Å²	81	97.7 Å²	97.7	57%	0.566	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-73.7	135.1	147.5	-49.3	0	0	0	0	104.7	S920	S920-S922 PolarHBondContact O-N 3.37Å; S920-S922 PolarHBondContact OG-N 3.24Å; S920-S922 PolarHBondContact OG-OG 3.4Å
923	P	41.6	Very low	45.5	Very low	92 Å²	92	96.8 Å²	96.8	60%	0.597	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-47.5	144.9	156.6	-10.7	23	0	0	0	106.4	D925	P923-D925 PolarHBondContact O-N 3.07Å
924	P	44.8	Very low	47.9	Very low	25 Å²	25	89.3 Å²	89.3	16%	0.162	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-52.1	129.3	166.2	-7	18.1	0	0	0	106.2	F926 L929	P924-F926 HydrophobicContact CB-CE1 4.5Å; P924-F926 HydrophobicContact CG-CE1 4.18Å; P924-F926 HydrophobicContact CG-CE2 4.3Å; P924-F926 HydrophobicContact CG-CZ 3.94Å; P924-F926 WeakPolarHBondContact O-CD2 3.37Å; P924-F926 PolarHBondContact O-N 2.8Å; P924-L929 HydrophobicContact CB-CD1 3.31Å; P924-L929 HydrophobicContact CB-CG 4.22Å; P924-L929 HydrophobicContact CG-CD1 4.23Å
925	D	47.2	Very low	50.3	Low	122 Å²	122	84.2 Å²	84.2	65%	0.652	50%	0.496	S	S	*	.			trans	-62.2	86.9	166.4	-91.6	-28.6	0	0	0	104.9	P923 P927 S928 L929	P923-D925 PolarHBondContact O-N 3.07Å; D925-P927 VanDerWaalsContact O-N 3.11Å; D925-S928 WeakPolarHBondContact CB-OG 3.19Å; D925-S928 WeakPolarHBondContact O-CA 3.43Å; D925-S928 WeakPolarHBondContact O-CB 3.28Å; D925-S928 PolarHBondContact O-N 3.39Å; D925-S928 PolarHBondContact O-OG 2.86Å; D925-L929 PolarHBondContact O-N 2.62Å
926	F	52.7	Low	52.7	Low	31 Å²	31	79 Å²	79	14%	0.136	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-52.9	-25.8	178.9	-71.4	-75.3	0	0	0	112.6	P924 S928 L929 M988 H991	P924-F926 HydrophobicContact CB-CE1 4.5Å; P924-F926 HydrophobicContact CG-CE1 4.18Å; P924-F926 HydrophobicContact CG-CE2 4.3Å; P924-F926 HydrophobicContact CG-CZ 3.94Å; P924-F926 WeakPolarHBondContact O-CD2 3.37Å; P924-F926 PolarHBondContact O-N 2.8Å; F926-S928 PolarHBondContact O-N 2.92Å; F926-L929 HydrophobicContact CD1-CD1 4.47Å; F926-M988 HydrophobicContact CD1-CB 4.49Å; F926-M988 HydrophobicContact CD1-CG 4.15Å; F926-M988 HydrophobicContact CE1-CB 3.66Å; F926-M988 HydrophobicContact CE1-CE 3.86Å; F926-M988 HydrophobicContact CE1-CG 3.71Å; F926-M988 HydrophobicContact CZ-CB 3.82Å; F926-M988 HydrophobicContact CZ-CG 4.36Å; F926-H991 WeakPolarHBondContact CB-CD2 3.18Å; F926-H991 WeakPolarHBondContact CB-NE2 3.08Å; F926-H991 HydrophobicContact CD2-CB 4.02Å; F926-H991 AromaticContact CD2-CG 3.96Å; F926-H991 HydrophobicContact CG-CB 4.41Å; F926-H991 AromaticContact CG-CD2 3.95Å
927	P	47.9	Very low	55	Low	111 Å²	111	75.6 Å²	75.6	72%	0.721	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-67.7	-12.5	169	-21.1	33.6	0	0	0	115.6	D925	D925-P927 VanDerWaalsContact O-N 3.11Å
928	S	51	Low	56.9	Low	85 Å²	85	72.4 Å²	72.4	59%	0.594	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-112.7	-7.3	-175.9	70.9	0	0	0	0	114.8	D925 F926	D925-S928 WeakPolarHBondContact CB-OG 3.19Å; D925-S928 WeakPolarHBondContact O-CA 3.43Å; D925-S928 WeakPolarHBondContact O-CB 3.28Å; D925-S928 PolarHBondContact O-N 3.39Å; D925-S928 PolarHBondContact O-OG 2.86Å; F926-S928 PolarHBondContact O-N 2.92Å
929	L	60.8	Low	58.8	Low	31 Å²	31	66.9 Å²	66.9	16%	0.162	40%	0.402	C	S	.	.			trans	-91.8	126.6	177.3	-69.4	177.7	0	0	0	110.2	P924 D925 F926 E934 W935 F956	P924-L929 HydrophobicContact CB-CD1 3.31Å; P924-L929 HydrophobicContact CB-CG 4.22Å; P924-L929 HydrophobicContact CG-CD1 4.23Å; D925-L929 PolarHBondContact O-N 2.62Å; F926-L929 HydrophobicContact CD1-CD1 4.47Å; L929-E934 HydrophobicContact CD2-CB 3.96Å; L929-W935 HydrophobicContact CD1-CB 4.12Å; L929-F956 HydrophobicContact CB-CE2 4.28Å; L929-F956 HydrophobicContact CB-CZ 4.06Å
930	S	64.3	Low	60.2	Low	100 Å²	100	66.3 Å²	66.3	70%	0.699	39%	0.393	S	S	*	.			trans	-103.9	-12.6	-174.1	66.9	0	0	0	0	114	E934	S930-E934 PolarHBondContact N-OE2 3.09Å; S930-E934 PolarHBondContact OG-OE2 2.95Å
931	S	77.8	Confident	62.6	Low	35 Å²	35	62.6 Å²	62.6	25%	0.245	37%	0.366	C	S	.	.	S	Bend	trans	-151.1	157.3	-174.9	67.2	0	0	0	0	114.5	H933 E934 W935 F956	S931-H933 PolarHBondContact O-N 2.9Å; S931-E934 PolarHBondContact O-N 3.02Å; S931-E934 WeakPolarHBondContact OG-CG 3.22Å; S931-E934 PolarHBondContact OG-N 3Å; S931-W935 PolarHBondContact O-N 2.84Å; S931-F956 VanDerWaalsContact C-CZ 3.48Å; S931-F956 WeakPolarHBondContact O-CZ 3.35Å
932	A	80.7	Confident	64.2	Low	1 Å²	1	55.6 Å²	55.6	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-56.8	-33.9	174.1	0	0	0	0	0	113	W935 L936 L953 I959	A932-W935 PolarHBondContact O-N 2.79Å; A932-L936 WeakPolarHBondContact O-CG 3.48Å; A932-L936 PolarHBondContact O-N 2.76Å; A932-L953 WeakPolarHBondContact CB-O 3.29Å; A932-I959 HydrophobicContact CB-CD1 3.53Å
933	H	80.1	Confident	66.1	Low	52 Å²	52	58.8 Å²	58.8	24%	0.241	33%	0.333	C	S	.	.	H	α-helix	trans	-69	-43.5	179.9	-61.6	63.2	0	0	0	112.4	S931 W935 L936 D937 K945 D949	S931-H933 PolarHBondContact O-N 2.9Å; H933-W935 VanDerWaalsContact C-N 3.29Å; H933-W935 PolarHBondContact O-N 2.76Å; H933-L936 PolarHBondContact O-N 3.39Å; H933-D937 PolarHBondContact O-N 3.43Å; H933-K945 HydrophobicContact CB-CD 4.21Å; H933-K945 HydrophobicContact CB-CG 4.2Å; H933-K945 WeakPolarHBondContact O-CE 3.19Å; H933-D949 IonicContact CD2-OD2 3.49Å; H933-D949 IonicContact CE1-OD1 3.84Å; H933-D949 PolarHBondContact CE1-OD1 2.77Å; H933-D949 IonicContact CE1-OD2 3.64Å; H933-D949 VanDerWaalsContact NE2-CG 3.27Å; H933-D949 IonicContact NE2-OD1 3.46Å; H933-D949 PolarHBondContact NE2-OD1 3.01Å; H933-D949 VanDerWaalsContact NE2-OD1 3.1Å; H933-D949 IonicContact NE2-OD2 3.48Å; H933-D949 PolarHBondContact NE2-OD2 2.8Å
934	E	77.3	Confident	68.2	Low	86 Å²	86	55.3 Å²	55.3	40%	0.402	31%	0.309	S	S	.	.	H	α-helix	trans	-64.1	-37.1	175.6	-73.1	179.1	156.7	0	0	111.1	L929 S930 S931 A938	L929-E934 HydrophobicContact CD2-CB 3.96Å; S930-E934 PolarHBondContact N-OE2 3.09Å; S930-E934 PolarHBondContact OG-OE2 2.95Å; S931-E934 PolarHBondContact O-N 3.02Å; S931-E934 WeakPolarHBondContact OG-CG 3.22Å; S931-E934 PolarHBondContact OG-N 3Å; E934-A938 WeakPolarHBondContact O-CB 3.39Å; E934-A938 PolarHBondContact O-N 2.81Å
935	W	83.2	Confident	70.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-47.2	173.3	166.7	64.3	0	0	0	112.6	L929 S931 A932 H933 D937 A938 I939 F948 F956 I959 I981 S984 I985 M988	L929-W935 HydrophobicContact CD1-CB 4.12Å; S931-W935 PolarHBondContact O-N 2.84Å; A932-W935 PolarHBondContact O-N 2.79Å; H933-W935 VanDerWaalsContact C-N 3.29Å; H933-W935 PolarHBondContact O-N 2.76Å; W935-D937 VanDerWaalsContact C-N 3.3Å; W935-D937 PolarHBondContact O-N 3.07Å; W935-A938 WeakPolarHBondContact O-CB 3.34Å; W935-A938 PolarHBondContact O-N 2.9Å; W935-A938 VanDerWaalsContact O-N 3.15Å; W935-I939 HydrophobicContact CH2-CD1 4.45Å; W935-I939 HydrophobicContact CZ2-CD1 3.92Å; W935-I939 WeakPolarHBondContact O-CG1 3.49Å; W935-I939 PolarHBondContact O-N 2.8Å; W935-F948 HydrophobicContact CH2-CE1 4.24Å; W935-F948 HydrophobicContact CH2-CZ 4.28Å; W935-F948 HydrophobicContact CZ3-CD1 4.37Å; W935-F948 AromaticContact CZ3-CE1 3.65Å; W935-F948 HydrophobicContact CZ3-CE1 3.65Å; W935-F948 AromaticContact CZ3-CZ 3.98Å; W935-F948 HydrophobicContact CZ3-CZ 3.98Å; W935-F956 HydrophobicContact CB-CE1 3.55Å; W935-F956 HydrophobicContact CB-CZ 3.89Å; W935-F956 HydrophobicContact CD2-CE1 4.38Å; W935-F956 AromaticContact CG-CE1 3.92Å; W935-F956 HydrophobicContact CG-CE1 3.92Å; W935-I959 HydrophobicContact CE3-CD1 4.34Å; W935-I959 HydrophobicContact CE3-CG2 4.31Å; W935-I959 HydrophobicContact CH2-CG2 3.57Å; W935-I959 HydrophobicContact CZ2-CG2 4.29Å; W935-I959 HydrophobicContact CZ3-CD1 4.25Å; W935-I959 HydrophobicContact CZ3-CG2 3.6Å; W935-I981 HydrophobicContact CH2-CG2 4.04Å; W935-S984 PolarHBondContact NE1-OG 3.43Å; W935-I985 HydrophobicContact CH2-CD1 4.3Å; W935-I985 HydrophobicContact CH2-CG1 3.9Å; W935-I985 HydrophobicContact CZ2-CG1 3.97Å; W935-M988 HydrophobicContact CD2-CE 3.63Å; W935-M988 VanDerWaalsContact CE2-CE 3.41Å; W935-M988 HydrophobicContact CE3-CE 4.32Å; W935-M988 HydrophobicContact CG-CE 3.81Å; W935-M988 HydrophobicContact CZ2-CE 3.91Å
936	L	78.3	Confident	71.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-39.7	177	-76.2	172.3	0	0	0	111.5	A932 H933 I939 K940 M941 G942 K945 F948	A932-L936 WeakPolarHBondContact O-CG 3.48Å; A932-L936 PolarHBondContact O-N 2.76Å; H933-L936 PolarHBondContact O-N 3.39Å; L936-I939 HydrophobicContact CD2-CD1 4.34Å; L936-I939 WeakPolarHBondContact O-CG1 3.47Å; L936-K940 PolarHBondContact O-N 3.25Å; L936-M941 HydrophobicContact CD2-CB 4.06Å; L936-M941 CarbonylContact O-C 3.11Å; L936-M941 WeakPolarHBondContact O-CA 3.49Å; L936-M941 PolarHBondContact O-N 2.93Å; L936-G942 PolarHBondContact O-N 3.46Å; L936-G942 VanDerWaalsContact O-N 3.15Å; L936-K945 HydrophobicContact CB-CG 4.43Å; L936-K945 HydrophobicContact CD1-CG 4.01Å; L936-F948 HydrophobicContact CD1-CB 4.17Å; L936-F948 HydrophobicContact CD1-CD1 4.45Å; L936-F948 HydrophobicContact CD1-CD2 3.9Å; L936-F948 HydrophobicContact CD1-CE2 4.41Å; L936-F948 HydrophobicContact CD1-CG 3.92Å; L936-F948 HydrophobicContact CD2-CD2 4.39Å; L936-F948 HydrophobicContact CD2-CE2 4.07Å; L936-F948 HydrophobicContact CD2-CZ 4.29Å
937	D	75.4	Confident	73.4	Confident	82 Å²	82	58.3 Å²	58.3	44%	0.439	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-43.6	173.5	-75.7	-20	0	0	0	112.2	H933 W935 I939 K940 G942 K945	H933-D937 PolarHBondContact O-N 3.43Å; W935-D937 VanDerWaalsContact C-N 3.3Å; W935-D937 PolarHBondContact O-N 3.07Å; D937-I939 VanDerWaalsContact C-N 3.29Å; D937-I939 PolarHBondContact O-N 2.66Å; D937-K940 WeakPolarHBondContact O-CA 3.45Å; D937-K940 PolarHBondContact O-N 3.14Å; D937-G942 WeakPolarHBondContact OD1-CA 3.5Å; D937-K945 WeakPolarHBondContact OD1-CE 3.32Å; D937-K945 IonicContact OD1-NZ 2.91Å; D937-K945 PolarHBondContact OD1-NZ 3.16Å; D937-K945 VanDerWaalsContact OD2-CE 3.32Å; D937-K945 WeakPolarHBondContact OD2-CE 3.31Å; D937-K945 IonicContact OD2-NZ 2.82Å; D937-K945 PolarHBondContact OD2-NZ 3.02Å
938	A	67	Low	75.3	Confident	59 Å²	59	53 Å²	53	49%	0.488	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-37.7	179.6	0	0	0	0	0	112.4	E934 W935 K940	E934-A938 WeakPolarHBondContact O-CB 3.39Å; E934-A938 PolarHBondContact O-N 2.81Å; W935-A938 WeakPolarHBondContact O-CB 3.34Å; W935-A938 PolarHBondContact O-N 2.9Å; W935-A938 VanDerWaalsContact O-N 3.15Å; A938-K940 PolarHBondContact O-N 3.23Å
939	I	70.4	Confident	76.9	Confident	19 Å²	19	52.4 Å²	52.4	10%	0.097	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	8.5	174.6	68.2	171.1	0	0	0	113.3	W935 L936 D937 M941 K980 I981	W935-I939 HydrophobicContact CH2-CD1 4.45Å; W935-I939 HydrophobicContact CZ2-CD1 3.92Å; W935-I939 WeakPolarHBondContact O-CG1 3.49Å; W935-I939 PolarHBondContact O-N 2.8Å; L936-I939 HydrophobicContact CD2-CD1 4.34Å; L936-I939 WeakPolarHBondContact O-CG1 3.47Å; D937-I939 VanDerWaalsContact C-N 3.29Å; D937-I939 PolarHBondContact O-N 2.66Å; I939-M941 VanDerWaalsContact C-N 3.26Å; I939-M941 HydrophobicContact CD1-CB 3.95Å; I939-M941 HydrophobicContact CD1-CG 3.78Å; I939-M941 HydrophobicContact CG1-CB 3.79Å; I939-M941 HydrophobicContact CG1-CG 3.76Å; I939-M941 PolarHBondContact O-N 2.89Å; I939-K980 WeakPolarHBondContact O-CE 3.34Å; I939-K980 PolarHBondContact O-NZ 3.15Å; I939-I981 HydrophobicContact CD1-CG1 4.17Å
940	K	61.8	Low	78	Confident	129 Å²	129	58.8 Å²	58.8	56%	0.561	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	36	-176.4	-55.2	-174.2	-179.9	179.4	0	113.4	L918 L936 D937 A938	L918-K940 PolarHBondContact O-NZ 3.02Å; L936-K940 PolarHBondContact O-N 3.25Å; D937-K940 WeakPolarHBondContact O-CA 3.45Å; D937-K940 PolarHBondContact O-N 3.14Å; A938-K940 PolarHBondContact O-N 3.23Å
941	M	79.6	Confident	78.9	Confident	7 Å²	7	56.2 Å²	56.2	3%	0.034	29%	0.287	C	S	.	.			trans	-115.1	20.1	175.8	-64	-71.3	101.5	0	0	112.2	L936 I939 R943 Y944 H977 K980 I981	L936-M941 HydrophobicContact CD2-CB 4.06Å; L936-M941 CarbonylContact O-C 3.11Å; L936-M941 WeakPolarHBondContact O-CA 3.49Å; L936-M941 PolarHBondContact O-N 2.93Å; I939-M941 VanDerWaalsContact C-N 3.26Å; I939-M941 HydrophobicContact CD1-CB 3.95Å; I939-M941 HydrophobicContact CD1-CG 3.78Å; I939-M941 HydrophobicContact CG1-CB 3.79Å; I939-M941 HydrophobicContact CG1-CG 3.76Å; I939-M941 PolarHBondContact O-N 2.89Å; M941-R943 PolarHBondContact O-N 2.72Å; M941-Y944 HydrophobicContact CB-CD2 4.18Å; M941-Y944 PolarHBondContact O-N 3Å; M941-Y944 HydrophobicContact SD-CD2 4.33Å; M941-Y944 HydrophobicContact SD-CE2 4.04Å; M941-H977 HydrophobicContact SD-CB 3.84Å; M941-K980 HydrophobicContact CE-CD 3.7Å; M941-K980 HydrophobicContact CG-CD 4.26Å; M941-K980 HydrophobicContact SD-CD 4.09Å; M941-I981 HydrophobicContact CB-CD1 4.41Å; M941-I981 HydrophobicContact CB-CG1 4.3Å; M941-I981 HydrophobicContact CG-CD1 4.28Å; M941-I981 HydrophobicContact CG-CG1 3.84Å; M941-I981 HydrophobicContact SD-CD1 4.37Å; M941-I981 HydrophobicContact SD-CG1 4.26Å
942	G	71.1	Confident	79.1	Confident	20 Å²	20	56.9 Å²	56.9	21%	0.206	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-55.9	-19.2	-177.1	0	0	0	0	0	116	L936 D937 Y944 K945	L936-G942 PolarHBondContact O-N 3.46Å; L936-G942 VanDerWaalsContact O-N 3.15Å; D937-G942 WeakPolarHBondContact OD1-CA 3.5Å; G942-Y944 PolarHBondContact O-N 3.36Å; G942-K945 VanDerWaalsContact O-CD 3.24Å; G942-K945 WeakPolarHBondContact O-CD 3.13Å; G942-K945 WeakPolarHBondContact O-CG 3.47Å; G942-K945 PolarHBondContact O-N 2.8Å
943	R	75.8	Confident	79.2	Confident	147 Å²	147	57.6 Å²	57.6	56%	0.555	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-63.7	-16.4	173.4	65.5	169.8	156.8	-145.2	-31.5	114.5	M941 H977	M941-R943 PolarHBondContact O-N 2.72Å; R943-H977 PolarHBondContact NH1-CE1 3.37Å; R943-H977 PolarHBondContact NH2-CE1 3.38Å; R943-H977 PolarHBondContact NH2-ND1 2.99Å; R943-H977 PolarHBondContact NH2-NE2 2.68Å
944	Y	84.6	Confident	79.1	Confident	20 Å²	20	60.5 Å²	60.5	8%	0.078	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-98.9	11.7	-178.1	-60.5	-60.1	0	0	0	113.2	M941 G942 E946 N947 F948 I972 H977 I981	M941-Y944 HydrophobicContact CB-CD2 4.18Å; M941-Y944 PolarHBondContact O-N 3Å; M941-Y944 HydrophobicContact SD-CD2 4.33Å; M941-Y944 HydrophobicContact SD-CE2 4.04Å; G942-Y944 PolarHBondContact O-N 3.36Å; Y944-E946 PolarHBondContact O-N 3.47Å; Y944-N947 WeakPolarHBondContact O-CB 3.34Å; Y944-N947 PolarHBondContact O-N 2.9Å; Y944-F948 WeakPolarHBondContact O-CD2 3.47Å; Y944-F948 PolarHBondContact O-N 2.81Å; Y944-F948 VanDerWaalsContact O-N 3.08Å; Y944-I972 HydrophobicContact CD1-CD1 3.94Å; Y944-I972 HydrophobicContact CD1-CG1 3.68Å; Y944-I972 HydrophobicContact CD2-CD1 4.06Å; Y944-I972 HydrophobicContact CE1-CB 4.45Å; Y944-I972 HydrophobicContact CE1-CD1 4.5Å; Y944-I972 HydrophobicContact CE1-CG1 3.94Å; Y944-I972 HydrophobicContact CE1-CG2 4.16Å; Y944-I972 HydrophobicContact CE2-CG2 4.15Å; Y944-I972 HydrophobicContact CG-CD1 3.69Å; Y944-I972 HydrophobicContact CG-CG1 3.99Å; Y944-H977 HydrophobicContact CE2-CB 3.91Å; Y944-H977 AromaticContact CE2-ND1 3.88Å; Y944-H977 AromaticContact CZ-ND1 3.75Å; Y944-H977 PolarHBondContact OH-ND1 2.87Å; Y944-I981 HydrophobicContact CD2-CD1 4.01Å; Y944-I981 HydrophobicContact CE2-CD1 4.43Å
945	K	85.1	Confident	79.3	Confident	55 Å²	55	58.2 Å²	58.2	24%	0.239	32%	0.315	C	S	.	.	H	α-helix	trans	-56	-48.8	178.6	-77.7	168.2	176.4	-174.5	0	112.3	H933 L936 D937 G942 N947 F948 D949	H933-K945 HydrophobicContact CB-CD 4.21Å; H933-K945 HydrophobicContact CB-CG 4.2Å; H933-K945 WeakPolarHBondContact O-CE 3.19Å; L936-K945 HydrophobicContact CB-CG 4.43Å; L936-K945 HydrophobicContact CD1-CG 4.01Å; D937-K945 WeakPolarHBondContact OD1-CE 3.32Å; D937-K945 IonicContact OD1-NZ 2.91Å; D937-K945 PolarHBondContact OD1-NZ 3.16Å; D937-K945 VanDerWaalsContact OD2-CE 3.32Å; D937-K945 WeakPolarHBondContact OD2-CE 3.31Å; D937-K945 IonicContact OD2-NZ 2.82Å; D937-K945 PolarHBondContact OD2-NZ 3.02Å; G942-K945 VanDerWaalsContact O-CD 3.24Å; G942-K945 WeakPolarHBondContact O-CD 3.13Å; G942-K945 WeakPolarHBondContact O-CG 3.47Å; G942-K945 PolarHBondContact O-N 2.8Å; K945-N947 VanDerWaalsContact C-N 3.29Å; K945-N947 PolarHBondContact O-N 2.86Å; K945-F948 PolarHBondContact O-N 2.79Å; K945-F948 VanDerWaalsContact O-N 3.12Å; K945-D949 PolarHBondContact O-N 2.89Å
946	E	80.3	Confident	79.1	Confident	141 Å²	141	60.2 Å²	60.2	66%	0.659	32%	0.324	S	S	*	.	H	α-helix	trans	-62.9	-35.9	178.8	-67.3	-178.9	-179.2	0	0	112.2	Y944 F948 D949 Q950	Y944-E946 PolarHBondContact O-N 3.47Å; E946-F948 VanDerWaalsContact C-N 3.34Å; E946-F948 PolarHBondContact O-N 2.95Å; E946-D949 PolarHBondContact O-N 2.99Å; E946-Q950 WeakPolarHBondContact O-CB 3.39Å; E946-Q950 VanDerWaalsContact O-CG 3.27Å; E946-Q950 WeakPolarHBondContact O-CG 3.09Å; E946-Q950 PolarHBondContact O-N 2.86Å
947	N	88	Confident	79.1	Confident	44 Å²	44	64.4 Å²	64.4	24%	0.235	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-39	174.7	-62	76.7	0	0	0	112.1	Y944 K945 A951 I970	Y944-N947 WeakPolarHBondContact O-CB 3.34Å; Y944-N947 PolarHBondContact O-N 2.9Å; K945-N947 VanDerWaalsContact C-N 3.29Å; K945-N947 PolarHBondContact O-N 2.86Å; N947-A951 WeakPolarHBondContact O-CB 3.47Å; N947-A951 PolarHBondContact O-N 3.31Å; N947-I970 WeakPolarHBondContact CB-O 3.37Å; N947-I970 PolarHBondContact ND2-O 2.9Å
948	F	89.6	Confident	79.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-72.9	-37.3	176.5	-87	-111.5	0	0	0	111.8	W935 L936 Y944 K945 E946 A951 G952 L953 I959 M962 I970 I972 I981	W935-F948 HydrophobicContact CH2-CE1 4.24Å; W935-F948 HydrophobicContact CH2-CZ 4.28Å; W935-F948 HydrophobicContact CZ3-CD1 4.37Å; W935-F948 AromaticContact CZ3-CE1 3.65Å; W935-F948 HydrophobicContact CZ3-CE1 3.65Å; W935-F948 AromaticContact CZ3-CZ 3.98Å; W935-F948 HydrophobicContact CZ3-CZ 3.98Å; L936-F948 HydrophobicContact CD1-CB 4.17Å; L936-F948 HydrophobicContact CD1-CD1 4.45Å; L936-F948 HydrophobicContact CD1-CD2 3.9Å; L936-F948 HydrophobicContact CD1-CE2 4.41Å; L936-F948 HydrophobicContact CD1-CG 3.92Å; L936-F948 HydrophobicContact CD2-CD2 4.39Å; L936-F948 HydrophobicContact CD2-CE2 4.07Å; L936-F948 HydrophobicContact CD2-CZ 4.29Å; Y944-F948 WeakPolarHBondContact O-CD2 3.47Å; Y944-F948 PolarHBondContact O-N 2.81Å; Y944-F948 VanDerWaalsContact O-N 3.08Å; K945-F948 PolarHBondContact O-N 2.79Å; K945-F948 VanDerWaalsContact O-N 3.12Å; E946-F948 VanDerWaalsContact C-N 3.34Å; E946-F948 PolarHBondContact O-N 2.95Å; F948-A951 PolarHBondContact O-N 2.8Å; F948-G952 PolarHBondContact O-N 2.86Å; F948-L953 HydrophobicContact CB-CB 4.25Å; F948-L953 HydrophobicContact CD1-CB 3.6Å; F948-L953 HydrophobicContact CD1-CD1 3.91Å; F948-L953 HydrophobicContact CD1-CG 4.44Å; F948-L953 HydrophobicContact CE1-CB 4.33Å; F948-L953 HydrophobicContact CE1-CD1 4.1Å; F948-L953 HydrophobicContact CG-CB 4.25Å; F948-L953 HydrophobicContact CG-CD1 4.34Å; F948-L953 PolarHBondContact O-N 3.1Å; F948-I959 HydrophobicContact CD1-CD1 4.33Å; F948-I959 HydrophobicContact CD1-CG1 4.4Å; F948-I959 HydrophobicContact CE1-CD1 4.43Å; F948-I959 HydrophobicContact CE1-CG1 4.24Å; F948-I959 HydrophobicContact CE1-CG2 4.4Å; F948-M962 HydrophobicContact CE1-CE 4.39Å; F948-M962 HydrophobicContact CE1-SD 3.94Å; F948-M962 HydrophobicContact CZ-CE 4.35Å; F948-M962 HydrophobicContact CZ-SD 4.36Å; F948-I970 HydrophobicContact CD2-CD1 3.68Å; F948-I970 HydrophobicContact CE2-CD1 3.4Å; F948-I970 VanDerWaalsContact CE2-CD1 3.4Å; F948-I970 HydrophobicContact CG-CD1 4.41Å; F948-I970 HydrophobicContact CZ-CD1 3.88Å; F948-I972 HydrophobicContact CE2-CD1 3.82Å; F948-I981 HydrophobicContact CZ-CG2 4.19Å
949	D	83.8	Confident	80.3	Confident	73 Å²	73	60.9 Å²	60.9	39%	0.39	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-47.8	175.5	-75	-34.4	0	0	0	112.4	H933 K945 E946 A951 G952	H933-D949 IonicContact CD2-OD2 3.49Å; H933-D949 IonicContact CE1-OD1 3.84Å; H933-D949 PolarHBondContact CE1-OD1 2.77Å; H933-D949 IonicContact CE1-OD2 3.64Å; H933-D949 VanDerWaalsContact NE2-CG 3.27Å; H933-D949 IonicContact NE2-OD1 3.46Å; H933-D949 PolarHBondContact NE2-OD1 3.01Å; H933-D949 VanDerWaalsContact NE2-OD1 3.1Å; H933-D949 IonicContact NE2-OD2 3.48Å; H933-D949 PolarHBondContact NE2-OD2 2.8Å; K945-D949 PolarHBondContact O-N 2.89Å; E946-D949 PolarHBondContact O-N 2.99Å; D949-A951 PolarHBondContact O-N 2.78Å; D949-G952 PolarHBondContact O-N 3.23Å
950	Q	82.9	Confident	80.9	Confident	164 Å²	164	60.4 Å²	60.4	77%	0.766	32%	0.32	S	S	*	.	H	α-helix	trans	-63	-27.8	178.7	-72.6	174.7	12.5	0	0	112.5	E946	E946-Q950 WeakPolarHBondContact O-CB 3.39Å; E946-Q950 VanDerWaalsContact O-CG 3.27Å; E946-Q950 WeakPolarHBondContact O-CG 3.09Å; E946-Q950 PolarHBondContact O-N 2.86Å
951	A	83.3	Confident	82	Confident	47 Å²	47	63.3 Å²	63.3	39%	0.388	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0	176.7	0	0	0	0	0	113.9	N947 F948 D949 L953 I970	N947-A951 WeakPolarHBondContact O-CB 3.47Å; N947-A951 PolarHBondContact O-N 3.31Å; F948-A951 PolarHBondContact O-N 2.8Å; D949-A951 PolarHBondContact O-N 2.78Å; A951-L953 VanDerWaalsContact C-N 3.25Å; A951-L953 HydrophobicContact CB-CD1 3.75Å; A951-L953 HydrophobicContact CB-CG 3.89Å; A951-L953 PolarHBondContact O-N 2.61Å; A951-I970 HydrophobicContact CB-CB 4.35Å; A951-I970 HydrophobicContact CB-CG2 3.44Å; A951-I970 VanDerWaalsContact CB-CG2 3.44Å
952	G	82.3	Confident	82.4	Confident	49 Å²	49	63.4 Å²	63.4	51%	0.505	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	20.1	-177.7	0	0	0	0	0	114.4	F948 D949 I954	F948-G952 PolarHBondContact O-N 2.86Å; D949-G952 PolarHBondContact O-N 3.23Å; G952-I954 VanDerWaalsContact C-N 3.3Å; G952-I954 PolarHBondContact O-N 2.71Å; G952-I954 VanDerWaalsContact O-N 3.09Å
953	L	83.9	Confident	83.1	Confident	16 Å²	16	65.5 Å²	65.5	8%	0.084	34%	0.337	C	S	.	.			trans	-88.7	65.4	-175.7	-64.2	169	0	0	0	111	A932 F948 A951 V958 I959 M962 I970	A932-L953 WeakPolarHBondContact CB-O 3.29Å; F948-L953 HydrophobicContact CB-CB 4.25Å; F948-L953 HydrophobicContact CD1-CB 3.6Å; F948-L953 HydrophobicContact CD1-CD1 3.91Å; F948-L953 HydrophobicContact CD1-CG 4.44Å; F948-L953 HydrophobicContact CE1-CB 4.33Å; F948-L953 HydrophobicContact CE1-CD1 4.1Å; F948-L953 HydrophobicContact CG-CB 4.25Å; F948-L953 HydrophobicContact CG-CD1 4.34Å; F948-L953 PolarHBondContact O-N 3.1Å; A951-L953 VanDerWaalsContact C-N 3.25Å; A951-L953 HydrophobicContact CB-CD1 3.75Å; A951-L953 HydrophobicContact CB-CG 3.89Å; A951-L953 PolarHBondContact O-N 2.61Å; L953-V958 HydrophobicContact CD2-CG1 3.74Å; L953-I959 HydrophobicContact CB-CG1 4.21Å; L953-M962 HydrophobicContact CD1-CE 3.39Å; L953-M962 HydrophobicContact CD1-SD 3.55Å; L953-M962 VanDerWaalsContact CD1-SD 3.55Å; L953-M962 HydrophobicContact CD2-CG 4.27Å; L953-M962 HydrophobicContact CD2-SD 3.86Å; L953-M962 HydrophobicContact CG-SD 4.26Å; L953-I970 HydrophobicContact CD1-CD1 4.07Å; L953-I970 HydrophobicContact CD1-CG2 4.08Å
954	I	77.7	Confident	83.3	Confident	113 Å²	113	62 Å²	62	58%	0.579	33%	0.329	S	S	*	.			trans	-97.8	-19.3	-175.3	57.9	174.2	0	0	0	113.6	G952	G952-I954 VanDerWaalsContact C-N 3.3Å; G952-I954 PolarHBondContact O-N 2.71Å; G952-I954 VanDerWaalsContact O-N 3.09Å
955	A	80.3	Confident	83.2	Confident	38 Å²	38	66.8 Å²	66.8	31%	0.314	35%	0.352	S	S	.	.	S	Bend	trans	-112.8	139	-173.7	0	0	0	0	0	112.4	D957 V958 I959	A955-D957 VanDerWaalsContact C-N 3.32Å; A955-D957 WeakPolarHBondContact CB-OD1 3.4Å; A955-D957 PolarHBondContact O-N 2.7Å; A955-V958 HydrophobicContact CB-CG2 4.49Å; A955-V958 PolarHBondContact O-N 3.21Å; A955-I959 WeakPolarHBondContact O-CG1 3.46Å; A955-I959 PolarHBondContact O-N 3.25Å; A955-I959 VanDerWaalsContact O-N 3.09Å
956	F	81	Confident	83.2	Confident	41 Å²	41	66.3 Å²	66.3	18%	0.18	35%	0.352	C	S	.	.	H	α-helix	trans	-67.3	-28.7	-173.2	-72	-55.6	0	0	0	114.2	L929 S931 W935 I959 S960 M988	L929-F956 HydrophobicContact CB-CE2 4.28Å; L929-F956 HydrophobicContact CB-CZ 4.06Å; S931-F956 VanDerWaalsContact C-CZ 3.48Å; S931-F956 WeakPolarHBondContact O-CZ 3.35Å; W935-F956 HydrophobicContact CB-CE1 3.55Å; W935-F956 HydrophobicContact CB-CZ 3.89Å; W935-F956 HydrophobicContact CD2-CE1 4.38Å; W935-F956 AromaticContact CG-CE1 3.92Å; W935-F956 HydrophobicContact CG-CE1 3.92Å; F956-I959 HydrophobicContact CD1-CD1 4.33Å; F956-I959 PolarHBondContact O-N 3.5Å; F956-S960 VanDerWaalsContact O-CB 3.22Å; F956-S960 WeakPolarHBondContact O-CB 3.41Å; F956-S960 PolarHBondContact O-N 2.88Å; F956-S960 PolarHBondContact O-OG 3.22Å; F956-M988 HydrophobicContact CB-SD 4.04Å; F956-M988 HydrophobicContact CD1-CE 3.42Å; F956-M988 VanDerWaalsContact CD1-CE 3.42Å; F956-M988 HydrophobicContact CD1-SD 3.62Å; F956-M988 HydrophobicContact CE1-CE 3.72Å; F956-M988 HydrophobicContact CE1-SD 4.49Å; F956-M988 HydrophobicContact CG-CE 4.47Å; F956-M988 HydrophobicContact CG-SD 4.23Å
957	D	77	Confident	83.4	Confident	88 Å²	88	59.6 Å²	59.6	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-63.3	-41.4	174.8	65	-43.7	0	0	0	111.6	A955 S960	A955-D957 VanDerWaalsContact C-N 3.32Å; A955-D957 WeakPolarHBondContact CB-OD1 3.4Å; A955-D957 PolarHBondContact O-N 2.7Å; D957-S960 PolarHBondContact O-OG 3.5Å
958	V	82	Confident	83.2	Confident	67 Å²	67	61.8 Å²	61.8	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-71.3	-46	176.1	-175	0	0	0	0	110.6	L953 A955 S960 R961	L953-V958 HydrophobicContact CD2-CG1 3.74Å; A955-V958 HydrophobicContact CB-CG2 4.49Å; A955-V958 PolarHBondContact O-N 3.21Å; V958-S960 VanDerWaalsContact C-N 3.28Å; V958-S960 PolarHBondContact O-N 3.1Å; V958-R961 PolarHBondContact O-N 2.89Å; V958-R961 VanDerWaalsContact O-N 3.16Å
959	I	86.4	Confident	82.9	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.2	-39	178.5	-66.4	167	0	0	0	111.2	A932 W935 F948 L953 A955 F956 R961 M962 I985 M988	A932-I959 HydrophobicContact CB-CD1 3.53Å; W935-I959 HydrophobicContact CE3-CD1 4.34Å; W935-I959 HydrophobicContact CE3-CG2 4.31Å; W935-I959 HydrophobicContact CH2-CG2 3.57Å; W935-I959 HydrophobicContact CZ2-CG2 4.29Å; W935-I959 HydrophobicContact CZ3-CD1 4.25Å; W935-I959 HydrophobicContact CZ3-CG2 3.6Å; F948-I959 HydrophobicContact CD1-CD1 4.33Å; F948-I959 HydrophobicContact CD1-CG1 4.4Å; F948-I959 HydrophobicContact CE1-CD1 4.43Å; F948-I959 HydrophobicContact CE1-CG1 4.24Å; F948-I959 HydrophobicContact CE1-CG2 4.4Å; L953-I959 HydrophobicContact CB-CG1 4.21Å; A955-I959 WeakPolarHBondContact O-CG1 3.46Å; A955-I959 PolarHBondContact O-N 3.25Å; A955-I959 VanDerWaalsContact O-N 3.09Å; F956-I959 HydrophobicContact CD1-CD1 4.33Å; F956-I959 PolarHBondContact O-N 3.5Å; I959-R961 PolarHBondContact O-N 2.77Å; I959-R961 VanDerWaalsContact O-N 3.09Å; I959-M962 HydrophobicContact CB-SD 4.48Å; I959-M962 HydrophobicContact CG1-SD 4.48Å; I959-M962 HydrophobicContact CG2-SD 4.36Å; I959-M962 WeakPolarHBondContact O-CB 3.25Å; I959-M962 WeakPolarHBondContact O-CG 3.22Å; I959-M962 PolarHBondContact O-N 2.98Å; I959-M962 VanDerWaalsContact O-N 3.16Å; I959-I985 HydrophobicContact CG2-CD1 4.4Å; I959-I985 HydrophobicContact CG2-CG1 3.99Å; I959-I985 WeakPolarHBondContact O-CG2 3.4Å; I959-M988 HydrophobicContact CB-SD 4.42Å; I959-M988 HydrophobicContact CG2-CE 4.25Å; I959-M988 HydrophobicContact CG2-SD 4.08Å
960	S	83.2	Confident	83.1	Confident	10 Å²	10	67.9 Å²	67.9	7%	0.07	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.1	-179.5	77	0	0	0	0	113.9	F956 D957 V958 R989	F956-S960 VanDerWaalsContact O-CB 3.22Å; F956-S960 WeakPolarHBondContact O-CB 3.41Å; F956-S960 PolarHBondContact O-N 2.88Å; F956-S960 PolarHBondContact O-OG 3.22Å; D957-S960 PolarHBondContact O-OG 3.5Å; V958-S960 VanDerWaalsContact C-N 3.28Å; V958-S960 PolarHBondContact O-N 3.1Å; S960-R989 VanDerWaalsContact O-CZ 3.23Å; S960-R989 PolarHBondContact O-NE 2.6Å; S960-R989 PolarHBondContact O-NH2 3.11Å
961	R	84.6	Confident	82.7	Confident	189 Å²	189	62 Å²	62	71%	0.713	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-8.7	-177.8	-64.1	178.3	-171.5	-161.6	0.9	113.6	V958 I959	V958-R961 PolarHBondContact O-N 2.89Å; V958-R961 VanDerWaalsContact O-N 3.16Å; I959-R961 PolarHBondContact O-N 2.77Å; I959-R961 VanDerWaalsContact O-N 3.09Å
962	M	86.6	Confident	82.7	Confident	9 Å²	9	59.8 Å²	59.8	4%	0.044	31%	0.314	C	S	.	.			trans	-60.9	142.1	-178.4	-68.3	178.7	72.2	0	0	112.3	F948 L953 I959 D966 I967 I970 I985	F948-M962 HydrophobicContact CE1-CE 4.39Å; F948-M962 HydrophobicContact CE1-SD 3.94Å; F948-M962 HydrophobicContact CZ-CE 4.35Å; F948-M962 HydrophobicContact CZ-SD 4.36Å; L953-M962 HydrophobicContact CD1-CE 3.39Å; L953-M962 HydrophobicContact CD1-SD 3.55Å; L953-M962 VanDerWaalsContact CD1-SD 3.55Å; L953-M962 HydrophobicContact CD2-CG 4.27Å; L953-M962 HydrophobicContact CD2-SD 3.86Å; L953-M962 HydrophobicContact CG-SD 4.26Å; I959-M962 HydrophobicContact CB-SD 4.48Å; I959-M962 HydrophobicContact CG1-SD 4.48Å; I959-M962 HydrophobicContact CG2-SD 4.36Å; I959-M962 WeakPolarHBondContact O-CB 3.25Å; I959-M962 WeakPolarHBondContact O-CG 3.22Å; I959-M962 PolarHBondContact O-N 2.98Å; I959-M962 VanDerWaalsContact O-N 3.16Å; M962-D966 HydrophobicContact CB-CB 4.41Å; M962-D966 HydrophobicContact CE-CB 4.22Å; M962-I967 HydrophobicContact CE-CG1 4.02Å; M962-I970 HydrophobicContact CE-CD1 3.91Å; M962-I985 HydrophobicContact CB-CD1 4.09Å; M962-I985 HydrophobicContact SD-CD1 4.5Å
963	T	85.9	Confident	82	Confident	65 Å²	65	62.8 Å²	62.8	40%	0.399	32%	0.323	S	S	.	.			trans	-104.3	171.4	175.7	69.4	0	0	0	0	111.2	E965 D966 I967	T963-E965 PolarHBondContact O-N 2.88Å; T963-D966 WeakPolarHBondContact CB-OD2 3.31Å; T963-D966 PolarHBondContact N-OD2 2.94Å; T963-D966 PolarHBondContact O-N 3.08Å; T963-D966 VanDerWaalsContact O-N 3.13Å; T963-D966 VanDerWaalsContact OG1-CG 3.29Å; T963-D966 PolarHBondContact OG1-N 3.11Å; T963-D966 PolarHBondContact OG1-OD2 2.86Å; T963-I967 WeakPolarHBondContact O-CG1 3.37Å; T963-I967 PolarHBondContact O-N 2.83Å; T963-I967 VanDerWaalsContact O-N 3.14Å
964	L	80.1	Confident	80.9	Confident	72 Å²	72	66.2 Å²	66.2	38%	0.377	34%	0.341	S	S	.	.	H	α-helix	trans	-58.2	-37.1	176	-179.2	62.3	0	0	0	111.9	D966 I967 Q968 Q978 L982	L964-D966 VanDerWaalsContact C-N 3.35Å; L964-I967 PolarHBondContact O-N 2.9Å; L964-Q968 WeakPolarHBondContact O-CG 3.41Å; L964-Q968 PolarHBondContact O-N 2.79Å; L964-Q968 VanDerWaalsContact O-N 3.11Å; L964-Q978 HydrophobicContact CD1-CB 3.79Å; L964-Q978 HydrophobicContact CD1-CG 4.41Å; L964-L982 HydrophobicContact CB-CD2 4.25Å; L964-L982 HydrophobicContact CD1-CD2 4.43Å
965	E	82.4	Confident	79.9	Confident	121 Å²	121	65 Å²	65	57%	0.565	34%	0.338	S	S	*	.	H	α-helix	trans	-65.8	-37	176.8	-66.2	-178.3	-169.6	0	0	112.1	T963 Q968 R969	T963-E965 PolarHBondContact O-N 2.88Å; E965-Q968 WeakPolarHBondContact O-CB 3.34Å; E965-Q968 PolarHBondContact O-N 2.83Å; E965-R969 WeakPolarHBondContact O-CG 3.35Å; E965-R969 PolarHBondContact O-N 2.93Å; E965-R969 IonicContact OE2-NH2 3.02Å; E965-R969 PolarHBondContact OE2-NH2 3.25Å; E965-R969 VanDerWaalsContact OE2-NH2 3.13Å
966	D	85.2	Confident	78.3	Confident	45 Å²	45	64.3 Å²	64.3	24%	0.241	34%	0.335	C	S	.	.	H	α-helix	trans	-69.1	-39	178.5	-55.5	-49.1	0	0	0	111.2	M962 T963 L964 Q968 R969 I970	M962-D966 HydrophobicContact CB-CB 4.41Å; M962-D966 HydrophobicContact CE-CB 4.22Å; T963-D966 WeakPolarHBondContact CB-OD2 3.31Å; T963-D966 PolarHBondContact N-OD2 2.94Å; T963-D966 PolarHBondContact O-N 3.08Å; T963-D966 VanDerWaalsContact O-N 3.13Å; T963-D966 VanDerWaalsContact OG1-CG 3.29Å; T963-D966 PolarHBondContact OG1-N 3.11Å; T963-D966 PolarHBondContact OG1-OD2 2.86Å; L964-D966 VanDerWaalsContact C-N 3.35Å; D966-Q968 VanDerWaalsContact C-N 3.27Å; D966-Q968 PolarHBondContact O-N 3Å; D966-R969 PolarHBondContact O-N 3.02Å; D966-R969 IonicContact OD1-CZ 3.02Å; D966-R969 IonicContact OD1-NH1 3.38Å; D966-R969 PolarHBondContact OD1-NH1 3.49Å; D966-R969 IonicContact OD1-NH2 2.86Å; D966-I970 PolarHBondContact O-N 3.46Å; D966-I970 VanDerWaalsContact O-N 3.15Å
967	I	86.2	Confident	78.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-37.8	174	-63.9	170.4	0	0	0	110.8	M962 T963 L964 I970 I972 Q978 I981 L982 I985	M962-I967 HydrophobicContact CE-CG1 4.02Å; T963-I967 WeakPolarHBondContact O-CG1 3.37Å; T963-I967 PolarHBondContact O-N 2.83Å; T963-I967 VanDerWaalsContact O-N 3.14Å; L964-I967 PolarHBondContact O-N 2.9Å; I967-I970 WeakPolarHBondContact O-CG1 3.37Å; I967-I972 HydrophobicContact CG2-CB 3.87Å; I967-I972 HydrophobicContact CG2-CD1 4.16Å; I967-I972 HydrophobicContact CG2-CG1 4.5Å; I967-I972 HydrophobicContact CG2-CG2 4.11Å; I967-I972 WeakPolarHBondContact O-CB 3.48Å; I967-I972 PolarHBondContact O-N 2.75Å; I967-Q978 HydrophobicContact CG2-CB 4.33Å; I967-Q978 HydrophobicContact CG2-CG 4.03Å; I967-I981 HydrophobicContact CD1-CB 4.33Å; I967-I981 HydrophobicContact CD1-CG2 3.88Å; I967-I981 HydrophobicContact CG1-CG2 4.34Å; I967-L982 HydrophobicContact CD1-CB 4Å; I967-L982 HydrophobicContact CD1-CD1 3.93Å; I967-I985 HydrophobicContact CD1-CD1 4.01Å
968	Q	82.5	Confident	77.9	Confident	90 Å²	90	60 Å²	60	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-41.7	175.5	-73.9	173.2	-7.5	0	0	112	L964 E965 D966 I970 G971	L964-Q968 WeakPolarHBondContact O-CG 3.41Å; L964-Q968 PolarHBondContact O-N 2.79Å; L964-Q968 VanDerWaalsContact O-N 3.11Å; E965-Q968 WeakPolarHBondContact O-CB 3.34Å; E965-Q968 PolarHBondContact O-N 2.83Å; D966-Q968 VanDerWaalsContact C-N 3.27Å; D966-Q968 PolarHBondContact O-N 3Å; Q968-I970 VanDerWaalsContact C-N 3.27Å; Q968-I970 PolarHBondContact O-N 2.91Å; Q968-G971 PolarHBondContact O-N 3.28Å
969	R	84.5	Confident	77.1	Confident	174 Å²	174	61.8 Å²	61.8	66%	0.657	32%	0.315	S	S	*	.	H	α-helix	trans	-62.6	-30.3	178.1	-77.3	-176.6	-137.4	137.6	8.2	113.4	E965 D966 G971	E965-R969 WeakPolarHBondContact O-CG 3.35Å; E965-R969 PolarHBondContact O-N 2.93Å; E965-R969 IonicContact OE2-NH2 3.02Å; E965-R969 PolarHBondContact OE2-NH2 3.25Å; E965-R969 VanDerWaalsContact OE2-NH2 3.13Å; D966-R969 PolarHBondContact O-N 3.02Å; D966-R969 IonicContact OD1-CZ 3.02Å; D966-R969 IonicContact OD1-NH1 3.38Å; D966-R969 PolarHBondContact OD1-NH1 3.49Å; D966-R969 IonicContact OD1-NH2 2.86Å; R969-G971 PolarHBondContact O-N 2.76Å
970	I	86.8	Confident	76.1	Confident	27 Å²	27	65.9 Å²	65.9	14%	0.138	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	11.4	175.6	65.5	167	0	0	0	113.7	N947 F948 A951 L953 M962 D966 I967 Q968 I972	N947-I970 WeakPolarHBondContact CB-O 3.37Å; N947-I970 PolarHBondContact ND2-O 2.9Å; F948-I970 HydrophobicContact CD2-CD1 3.68Å; F948-I970 HydrophobicContact CE2-CD1 3.4Å; F948-I970 VanDerWaalsContact CE2-CD1 3.4Å; F948-I970 HydrophobicContact CG-CD1 4.41Å; F948-I970 HydrophobicContact CZ-CD1 3.88Å; A951-I970 HydrophobicContact CB-CB 4.35Å; A951-I970 HydrophobicContact CB-CG2 3.44Å; A951-I970 VanDerWaalsContact CB-CG2 3.44Å; L953-I970 HydrophobicContact CD1-CD1 4.07Å; L953-I970 HydrophobicContact CD1-CG2 4.08Å; M962-I970 HydrophobicContact CE-CD1 3.91Å; D966-I970 PolarHBondContact O-N 3.46Å; D966-I970 VanDerWaalsContact O-N 3.15Å; I967-I970 WeakPolarHBondContact O-CG1 3.37Å; Q968-I970 VanDerWaalsContact C-N 3.27Å; Q968-I970 PolarHBondContact O-N 2.91Å; I970-I972 HydrophobicContact CD1-CD1 3.81Å; I970-I972 HydrophobicContact CD1-CG1 4.34Å; I970-I972 HydrophobicContact CG1-CD1 4.16Å; I970-I972 HydrophobicContact CG1-CG1 4.16Å
971	G	74.6	Confident	75.9	Confident	42 Å²	42	65.4 Å²	65.4	43%	0.433	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	13.9	171.8	0	0	0	0	0	115.1	Q968 R969 T973	Q968-G971 PolarHBondContact O-N 3.28Å; R969-G971 PolarHBondContact O-N 2.76Å; G971-T973 PolarHBondContact O-N 3.03Å
972	I	83.6	Confident	75.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.304	C	S	.	.			trans	-91.3	93.8	175.7	-54.8	179.9	0	0	0	108.4	Y944 F948 I967 I970 H977 Q978 I981	Y944-I972 HydrophobicContact CD1-CD1 3.94Å; Y944-I972 HydrophobicContact CD1-CG1 3.68Å; Y944-I972 HydrophobicContact CD2-CD1 4.06Å; Y944-I972 HydrophobicContact CE1-CB 4.45Å; Y944-I972 HydrophobicContact CE1-CD1 4.5Å; Y944-I972 HydrophobicContact CE1-CG1 3.94Å; Y944-I972 HydrophobicContact CE1-CG2 4.16Å; Y944-I972 HydrophobicContact CE2-CG2 4.15Å; Y944-I972 HydrophobicContact CG-CD1 3.69Å; Y944-I972 HydrophobicContact CG-CG1 3.99Å; F948-I972 HydrophobicContact CE2-CD1 3.82Å; I967-I972 HydrophobicContact CG2-CB 3.87Å; I967-I972 HydrophobicContact CG2-CD1 4.16Å; I967-I972 HydrophobicContact CG2-CG1 4.5Å; I967-I972 HydrophobicContact CG2-CG2 4.11Å; I967-I972 WeakPolarHBondContact O-CB 3.48Å; I967-I972 PolarHBondContact O-N 2.75Å; I970-I972 HydrophobicContact CD1-CD1 3.81Å; I970-I972 HydrophobicContact CD1-CG1 4.34Å; I970-I972 HydrophobicContact CG1-CD1 4.16Å; I970-I972 HydrophobicContact CG1-CG1 4.16Å; I972-H977 HydrophobicContact CG2-CB 4.15Å; I972-Q978 HydrophobicContact CG2-CG 4.18Å; I972-Q978 VanDerWaalsContact O-CG 3.28Å; I972-Q978 WeakPolarHBondContact O-CG 3.29Å; I972-Q978 PolarHBondContact O-NE2 2.86Å; I972-I981 HydrophobicContact CD1-CD1 3.57Å; I972-I981 HydrophobicContact CG2-CD1 4.31Å
973	T	67.2	Low	75.1	Confident	112 Å²	112	62.2 Å²	62.2	69%	0.687	33%	0.326	S	S	*	.			trans	-92.3	-16.3	-172.8	55.7	0	0	0	0	114.4	G971 V975 Q978	G971-T973 PolarHBondContact O-N 3.03Å; T973-V975 PolarHBondContact O-N 2.73Å; T973-Q978 VanDerWaalsContact C-NE2 3.33Å; T973-Q978 PolarHBondContact O-NE2 3.5Å
974	L	61	Low	74.7	Confident	88 Å²	88	59.6 Å²	59.6	46%	0.461	31%	0.311	S	S	.	.			trans	-79.1	110.9	-177.9	-68.3	174.1	0	0	0	110.7	G976 H977 Q978	L974-G976 PolarHBondContact O-N 3.38Å; L974-G976 VanDerWaalsContact O-N 3.15Å; L974-H977 HydrophobicContact CB-CB 4.28Å; L974-H977 WeakPolarHBondContact CB-ND1 3.19Å; L974-H977 WeakPolarHBondContact CD1-CE1 3.46Å; L974-H977 WeakPolarHBondContact CD1-ND1 3.12Å; L974-H977 WeakPolarHBondContact O-CA 3.37Å; L974-H977 PolarHBondContact O-N 3.27Å; L974-Q978 WeakPolarHBondContact O-CG 3.32Å; L974-Q978 PolarHBondContact O-N 2.8Å
975	V	56.1	Low	74.8	Confident	87 Å²	87	56.2 Å²	56.2	53%	0.527	29%	0.293	S	S	.	.	H	α-helix	trans	-53.3	-38.4	-175.7	-178.7	0	0	0	0	112.7	T973 H977 Q978 K979	T973-V975 PolarHBondContact O-N 2.73Å; V975-H977 VanDerWaalsContact C-N 3.35Å; V975-H977 PolarHBondContact O-N 2.99Å; V975-Q978 PolarHBondContact O-N 2.87Å; V975-K979 HydrophobicContact CG1-CD 4.4Å; V975-K979 WeakPolarHBondContact O-CB 3.15Å; V975-K979 WeakPolarHBondContact O-CG 3.49Å; V975-K979 PolarHBondContact O-N 3.04Å
976	G	47.5	Very low	74.4	Confident	24 Å²	24	55.4 Å²	55.4	25%	0.247	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-34.9	175.9	0	0	0	0	0	113.7	L974 K980	L974-G976 PolarHBondContact O-N 3.38Å; L974-G976 VanDerWaalsContact O-N 3.15Å; G976-K980 WeakPolarHBondContact O-CB 3.17Å; G976-K980 PolarHBondContact O-N 3.44Å; G976-K980 VanDerWaalsContact O-N 3.17Å
977	H	76.1	Confident	73.7	Confident	27 Å²	27	58.2 Å²	58.2	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-79.7	-37.3	176.5	-56.4	151.2	0	0	0	111.5	M941 R943 Y944 I972 L974 V975 K979 K980 I981	M941-H977 HydrophobicContact SD-CB 3.84Å; R943-H977 PolarHBondContact NH1-CE1 3.37Å; R943-H977 PolarHBondContact NH2-CE1 3.38Å; R943-H977 PolarHBondContact NH2-ND1 2.99Å; R943-H977 PolarHBondContact NH2-NE2 2.68Å; Y944-H977 HydrophobicContact CE2-CB 3.91Å; Y944-H977 AromaticContact CE2-ND1 3.88Å; Y944-H977 AromaticContact CZ-ND1 3.75Å; Y944-H977 PolarHBondContact OH-ND1 2.87Å; I972-H977 HydrophobicContact CG2-CB 4.15Å; L974-H977 HydrophobicContact CB-CB 4.28Å; L974-H977 WeakPolarHBondContact CB-ND1 3.19Å; L974-H977 WeakPolarHBondContact CD1-CE1 3.46Å; L974-H977 WeakPolarHBondContact CD1-ND1 3.12Å; L974-H977 WeakPolarHBondContact O-CA 3.37Å; L974-H977 PolarHBondContact O-N 3.27Å; V975-H977 VanDerWaalsContact C-N 3.35Å; V975-H977 PolarHBondContact O-N 2.99Å; H977-K979 PolarHBondContact O-N 2.92Å; H977-K980 PolarHBondContact O-N 2.79Å; H977-I981 WeakPolarHBondContact O-CB 3.1Å; H977-I981 VanDerWaalsContact O-CG1 3.31Å; H977-I981 WeakPolarHBondContact O-CG1 3.3Å; H977-I981 PolarHBondContact O-N 2.89Å
978	Q	73.6	Confident	73.3	Confident	11 Å²	11	58.3 Å²	58.3	5%	0.051	30%	0.304	C	S	.	.	H	α-helix	trans	-54.8	-51.9	171.4	-67.3	170.7	4.8	0	0	110.6	L964 I967 I972 T973 L974 V975 K980 I981 L982	L964-Q978 HydrophobicContact CD1-CB 3.79Å; L964-Q978 HydrophobicContact CD1-CG 4.41Å; I967-Q978 HydrophobicContact CG2-CB 4.33Å; I967-Q978 HydrophobicContact CG2-CG 4.03Å; I972-Q978 HydrophobicContact CG2-CG 4.18Å; I972-Q978 VanDerWaalsContact O-CG 3.28Å; I972-Q978 WeakPolarHBondContact O-CG 3.29Å; I972-Q978 PolarHBondContact O-NE2 2.86Å; T973-Q978 VanDerWaalsContact C-NE2 3.33Å; T973-Q978 PolarHBondContact O-NE2 3.5Å; L974-Q978 WeakPolarHBondContact O-CG 3.32Å; L974-Q978 PolarHBondContact O-N 2.8Å; V975-Q978 PolarHBondContact O-N 2.87Å; Q978-K980 VanDerWaalsContact C-N 3.34Å; Q978-K980 PolarHBondContact O-N 2.86Å; Q978-I981 PolarHBondContact O-N 3.02Å; Q978-L982 WeakPolarHBondContact O-CB 3.47Å; Q978-L982 PolarHBondContact O-N 3.01Å
979	K	64.6	Low	73.1	Confident	105 Å²	105	58.9 Å²	58.9	46%	0.457	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-40	177.2	-74.4	-178.4	178	179.9	0	112.4	V975 H977 N983	V975-K979 HydrophobicContact CG1-CD 4.4Å; V975-K979 WeakPolarHBondContact O-CB 3.15Å; V975-K979 WeakPolarHBondContact O-CG 3.49Å; V975-K979 PolarHBondContact O-N 3.04Å; H977-K979 PolarHBondContact O-N 2.92Å; K979-N983 WeakPolarHBondContact O-CB 3.06Å; K979-N983 VanDerWaalsContact O-CG 3.3Å; K979-N983 PolarHBondContact O-N 2.9Å
980	K	66	Low	72.4	Confident	86 Å²	86	54.8 Å²	54.8	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-66.8	-44.7	179.8	-165.5	-179.4	-170.6	-169.7	0	112.7	I939 M941 G976 H977 Q978 S984	I939-K980 WeakPolarHBondContact O-CE 3.34Å; I939-K980 PolarHBondContact O-NZ 3.15Å; M941-K980 HydrophobicContact CE-CD 3.7Å; M941-K980 HydrophobicContact CG-CD 4.26Å; M941-K980 HydrophobicContact SD-CD 4.09Å; G976-K980 WeakPolarHBondContact O-CB 3.17Å; G976-K980 PolarHBondContact O-N 3.44Å; G976-K980 VanDerWaalsContact O-N 3.17Å; H977-K980 PolarHBondContact O-N 2.79Å; Q978-K980 VanDerWaalsContact C-N 3.34Å; Q978-K980 PolarHBondContact O-N 2.86Å; K980-S984 PolarHBondContact O-N 3.38Å
981	I	79.3	Confident	71.4	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-44.8	177.6	-67.3	170.2	0	0	0	109.6	W935 I939 M941 Y944 F948 I967 I972 H977 Q978 N983 S984 I985	W935-I981 HydrophobicContact CH2-CG2 4.04Å; I939-I981 HydrophobicContact CD1-CG1 4.17Å; M941-I981 HydrophobicContact CB-CD1 4.41Å; M941-I981 HydrophobicContact CB-CG1 4.3Å; M941-I981 HydrophobicContact CG-CD1 4.28Å; M941-I981 HydrophobicContact CG-CG1 3.84Å; M941-I981 HydrophobicContact SD-CD1 4.37Å; M941-I981 HydrophobicContact SD-CG1 4.26Å; Y944-I981 HydrophobicContact CD2-CD1 4.01Å; Y944-I981 HydrophobicContact CE2-CD1 4.43Å; F948-I981 HydrophobicContact CZ-CG2 4.19Å; I967-I981 HydrophobicContact CD1-CB 4.33Å; I967-I981 HydrophobicContact CD1-CG2 3.88Å; I967-I981 HydrophobicContact CG1-CG2 4.34Å; I972-I981 HydrophobicContact CD1-CD1 3.57Å; I972-I981 HydrophobicContact CG2-CD1 4.31Å; H977-I981 WeakPolarHBondContact O-CB 3.1Å; H977-I981 VanDerWaalsContact O-CG1 3.31Å; H977-I981 WeakPolarHBondContact O-CG1 3.3Å; H977-I981 PolarHBondContact O-N 2.89Å; Q978-I981 PolarHBondContact O-N 3.02Å; I981-N983 PolarHBondContact O-N 2.93Å; I981-S984 PolarHBondContact O-N 3.05Å; I981-S984 VanDerWaalsContact O-N 3.17Å; I981-I985 HydrophobicContact CG2-CD1 3.74Å; I981-I985 HydrophobicContact CG2-CG1 4.48Å; I981-I985 WeakPolarHBondContact O-CG1 3.46Å; I981-I985 PolarHBondContact O-N 2.71Å
982	L	80.7	Confident	71	Confident	35 Å²	35	57 Å²	57	18%	0.183	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-43.4	178.6	-167.6	71.2	0	0	0	112.6	L964 I967 Q978 S984 I985 Q986	L964-L982 HydrophobicContact CB-CD2 4.25Å; L964-L982 HydrophobicContact CD1-CD2 4.43Å; I967-L982 HydrophobicContact CD1-CB 4Å; I967-L982 HydrophobicContact CD1-CD1 3.93Å; Q978-L982 WeakPolarHBondContact O-CB 3.47Å; Q978-L982 PolarHBondContact O-N 3.01Å; L982-S984 VanDerWaalsContact C-N 3.32Å; L982-S984 PolarHBondContact O-N 3.05Å; L982-I985 PolarHBondContact O-N 3.38Å; L982-Q986 WeakPolarHBondContact O-CG 3.28Å; L982-Q986 PolarHBondContact O-N 2.88Å
983	N	73.6	Confident	70	Confident	96 Å²	96	62.3 Å²	62.3	51%	0.513	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-38.2	175	-79.1	-7.8	0	0	0	111.9	K979 I981 Q986 L987	K979-N983 WeakPolarHBondContact O-CB 3.06Å; K979-N983 VanDerWaalsContact O-CG 3.3Å; K979-N983 PolarHBondContact O-N 2.9Å; I981-N983 PolarHBondContact O-N 2.93Å; N983-Q986 PolarHBondContact O-N 2.91Å; N983-L987 WeakPolarHBondContact O-CG 3.12Å; N983-L987 PolarHBondContact O-N 2.05Å
984	S	76.7	Confident	69.4	Low	9 Å²	9	63.9 Å²	63.9	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-70	-33.4	175.3	-173.8	0	0	0	0	113.2	W935 K980 I981 L982 Q986 L987 M988	W935-S984 PolarHBondContact NE1-OG 3.43Å; K980-S984 PolarHBondContact O-N 3.38Å; I981-S984 PolarHBondContact O-N 3.05Å; I981-S984 VanDerWaalsContact O-N 3.17Å; L982-S984 VanDerWaalsContact C-N 3.32Å; L982-S984 PolarHBondContact O-N 3.05Å; S984-Q986 VanDerWaalsContact C-N 3.35Å; S984-L987 PolarHBondContact O-N 3.39Å; S984-M988 WeakPolarHBondContact O-CB 3.4Å; S984-M988 PolarHBondContact O-N 2.92Å
985	I	82.3	Confident	69	Low	1 Å²	1	65.5 Å²	65.5	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-40.1	174.6	-74.2	163.4	0	0	0	110.5	W935 I959 M962 I967 I981 L982 L987 M988 R989	W935-I985 HydrophobicContact CH2-CD1 4.3Å; W935-I985 HydrophobicContact CH2-CG1 3.9Å; W935-I985 HydrophobicContact CZ2-CG1 3.97Å; I959-I985 HydrophobicContact CG2-CD1 4.4Å; I959-I985 HydrophobicContact CG2-CG1 3.99Å; I959-I985 WeakPolarHBondContact O-CG2 3.4Å; M962-I985 HydrophobicContact CB-CD1 4.09Å; M962-I985 HydrophobicContact SD-CD1 4.5Å; I967-I985 HydrophobicContact CD1-CD1 4.01Å; I981-I985 HydrophobicContact CG2-CD1 3.74Å; I981-I985 HydrophobicContact CG2-CG1 4.48Å; I981-I985 WeakPolarHBondContact O-CG1 3.46Å; I981-I985 PolarHBondContact O-N 2.71Å; L982-I985 PolarHBondContact O-N 3.38Å; I985-L987 PolarHBondContact O-N 3.1Å; I985-M988 WeakPolarHBondContact O-CB 3.32Å; I985-M988 PolarHBondContact O-N 2.04Å; I985-R989 PolarHBondContact O-N 3.11Å
986	Q	74.9	Confident	68.3	Low	104 Å²	104	68.9 Å²	68.9	49%	0.486	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-42.7	175	-71.8	176.3	-7.6	0	0	111.9	L982 N983 S984 R989 V990	L982-Q986 WeakPolarHBondContact O-CG 3.28Å; L982-Q986 PolarHBondContact O-N 2.88Å; N983-Q986 PolarHBondContact O-N 2.91Å; S984-Q986 VanDerWaalsContact C-N 3.35Å; Q986-R989 PolarHBondContact O-N 2.85Å; Q986-V990 WeakPolarHBondContact O-CG2 3.36Å; Q986-V990 PolarHBondContact O-N 3.35Å
987	L	70.8	Confident	67.9	Low	105 Å²	105	73.3 Å²	73.3	55%	0.55	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-40.5	174.8	-69.3	170.3	0	0	0	112.2	N983 S984 I985 V990 H991	N983-L987 WeakPolarHBondContact O-CG 3.12Å; N983-L987 PolarHBondContact O-N 2.05Å; S984-L987 PolarHBondContact O-N 3.39Å; I985-L987 PolarHBondContact O-N 3.1Å; L987-V990 PolarHBondContact O-N 2.88Å; L987-H991 PolarHBondContact O-N 3.31Å
988	M	76.3	Confident	66.1	Low	2 Å²	2	78.4 Å²	78.4	1%	0.01	40%	0.401	C	S	.	.	H	α-helix	trans	-62.5	-40.4	175.8	-173.5	-173.6	-68.9	0	0	112.1	F926 W935 F956 I959 S984 I985 H991 L992	F926-M988 HydrophobicContact CD1-CB 4.49Å; F926-M988 HydrophobicContact CD1-CG 4.15Å; F926-M988 HydrophobicContact CE1-CB 3.66Å; F926-M988 HydrophobicContact CE1-CE 3.86Å; F926-M988 HydrophobicContact CE1-CG 3.71Å; F926-M988 HydrophobicContact CZ-CB 3.82Å; F926-M988 HydrophobicContact CZ-CG 4.36Å; W935-M988 HydrophobicContact CD2-CE 3.63Å; W935-M988 VanDerWaalsContact CE2-CE 3.41Å; W935-M988 HydrophobicContact CE3-CE 4.32Å; W935-M988 HydrophobicContact CG-CE 3.81Å; W935-M988 HydrophobicContact CZ2-CE 3.91Å; F956-M988 HydrophobicContact CB-SD 4.04Å; F956-M988 HydrophobicContact CD1-CE 3.42Å; F956-M988 VanDerWaalsContact CD1-CE 3.42Å; F956-M988 HydrophobicContact CD1-SD 3.62Å; F956-M988 HydrophobicContact CE1-CE 3.72Å; F956-M988 HydrophobicContact CE1-SD 4.49Å; F956-M988 HydrophobicContact CG-CE 4.47Å; F956-M988 HydrophobicContact CG-SD 4.23Å; I959-M988 HydrophobicContact CB-SD 4.42Å; I959-M988 HydrophobicContact CG2-CE 4.25Å; I959-M988 HydrophobicContact CG2-SD 4.08Å; S984-M988 WeakPolarHBondContact O-CB 3.4Å; S984-M988 PolarHBondContact O-N 2.92Å; I985-M988 WeakPolarHBondContact O-CB 3.32Å; I985-M988 PolarHBondContact O-N 2.04Å; M988-H991 PolarHBondContact O-N 3.32Å; M988-L992 HydrophobicContact CG-CD1 4.14Å; M988-L992 PolarHBondContact O-N 2.82Å
989	R	78.7	Confident	64.4	Low	101 Å²	101	86.9 Å²	86.9	38%	0.381	44%	0.44	S	S	.	.	H	α-helix	trans	-64	-40.5	177.8	-169.5	-178	-65.4	176.9	-0.2	112.4	S960 I985 Q986 H991 N993	S960-R989 VanDerWaalsContact O-CZ 3.23Å; S960-R989 PolarHBondContact O-NE 2.6Å; S960-R989 PolarHBondContact O-NH2 3.11Å; I985-R989 PolarHBondContact O-N 3.11Å; Q986-R989 PolarHBondContact O-N 2.85Å; R989-H991 VanDerWaalsContact C-N 3.28Å; R989-H991 PolarHBondContact O-N 3.05Å; R989-N993 WeakPolarHBondContact O-CB 3.28Å; R989-N993 PolarHBondContact O-N 3.48Å; R989-N993 VanDerWaalsContact O-N 3.17Å
990	V	69.7	Low	63.2	Low	89 Å²	89	91.9 Å²	91.9	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-35.8	175.9	174.1	0	0	0	0	111.1	Q986 L987 Q994	Q986-V990 WeakPolarHBondContact O-CG2 3.36Å; Q986-V990 PolarHBondContact O-N 3.35Å; L987-V990 PolarHBondContact O-N 2.88Å; V990-Q994 WeakPolarHBondContact O-CG 3.05Å
991	H	65.3	Low	63.1	Low	51 Å²	51	92.2 Å²	92.2	24%	0.236	48%	0.484	C	S	.	.	H	α-helix	trans	-72.7	-45	178	-170.6	74.3	0	0	0	113	F926 L987 M988 R989 N993 Q994	F926-H991 WeakPolarHBondContact CB-CD2 3.18Å; F926-H991 WeakPolarHBondContact CB-NE2 3.08Å; F926-H991 HydrophobicContact CD2-CB 4.02Å; F926-H991 AromaticContact CD2-CG 3.96Å; F926-H991 HydrophobicContact CG-CB 4.41Å; F926-H991 AromaticContact CG-CD2 3.95Å; L987-H991 PolarHBondContact O-N 3.31Å; M988-H991 PolarHBondContact O-N 3.32Å; R989-H991 VanDerWaalsContact C-N 3.28Å; R989-H991 PolarHBondContact O-N 3.05Å; H991-N993 VanDerWaalsContact C-N 3.31Å; H991-N993 PolarHBondContact O-N 3.48Å; H991-Q994 PolarHBondContact O-N 3.47Å
992	L	67.5	Low	62.2	Low	64 Å²	64	97.1 Å²	97.1	34%	0.335	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-34.3	179.2	-72.2	168.5	0	0	0	112.7	M988 Q994 L995	M988-L992 HydrophobicContact CG-CD1 4.14Å; M988-L992 PolarHBondContact O-N 2.82Å; L992-Q994 VanDerWaalsContact C-N 3.26Å; L992-Q994 PolarHBondContact O-N 3.23Å; L992-L995 PolarHBondContact O-N 3.46Å
993	N	62.6	Low	61.2	Low	111 Å²	111	100.5 Å²	100.5	59%	0.594	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.3	176.9	-74.3	-2.3	0	0	0	114.2	R989 H991 L995	R989-N993 WeakPolarHBondContact O-CB 3.28Å; R989-N993 PolarHBondContact O-N 3.48Å; R989-N993 VanDerWaalsContact O-N 3.17Å; H991-N993 VanDerWaalsContact C-N 3.31Å; H991-N993 PolarHBondContact O-N 3.48Å; N993-L995 VanDerWaalsContact C-N 3.33Å
994	Q	54.8	Low	60.5	Low	145 Å²	145	100.8 Å²	100.8	68%	0.678	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.6	175.5	-73.8	177.9	-5.1	0	0	113.3	V990 H991 L992	V990-Q994 WeakPolarHBondContact O-CG 3.05Å; H991-Q994 PolarHBondContact O-N 3.47Å; L992-Q994 VanDerWaalsContact C-N 3.26Å; L992-Q994 PolarHBondContact O-N 3.23Å
995	L	51.5	Low	59.5	Low	123 Å²	123	106.5 Å²	106.5	64%	0.644	56%	0.558	S	S	*	*	S	Bend	trans	-106.3	0.2	-175.5	-74.2	162.1	0	0	0	114.2	L992 N993	L992-L995 PolarHBondContact O-N 3.46Å; N993-L995 VanDerWaalsContact C-N 3.33Å
996	E	40.8	Very low	58	Low	157 Å²	157	113.5 Å²	113.5	73%	0.734	60%	0.595	S	S	*	*			trans	-76.7	124.9	172	-76.5	-169.7	159.7	0	0	110.7	V998	E996-V998 PolarHBondContact O-N 3.44Å
997	P	40.4	Very low	56.7	Low	117 Å²	117	114.2 Å²	114.2	76%	0.76	60%	0.603	S	S	*	*			trans	-70.4	129.7	171.8	28.1	-29.3	0	0	0	109.5	E999	P997-E999 PolarHBondContact O-N 2.95Å; P997-E999 VanDerWaalsContact O-N 3.14Å
998	V	38.1	Very low	55.7	Low	135 Å²	135	114.9 Å²	114.9	82%	0.818	61%	0.607	S	S	*	*			trans	-59.3	112.1	165.9	178.2	0	0	0	0	107.8	E996 V1000	E996-V998 PolarHBondContact O-N 3.44Å; V998-V1000 PolarHBondContact O-N 2.68Å
999	E	38.1	Very low	54	Low	188 Å²	188	124.3 Å²	124.3	88%	0.879	66%	0.656	S	S	*	*			trans	-64.4	129.3	166	-81.1	-172.5	153.5	0	0	109.2	P997	P997-E999 PolarHBondContact O-N 2.95Å; P997-E999 VanDerWaalsContact O-N 3.14Å
1000	V	39.9	Very low	51.7	Low	211 Å²	211	126.5 Å²	126.5	100%	1.279	68%	0.681	S	S	*	*			trans	-83.2	0	173.6	174.5	0	0	0	0	110	V998	V998-V1000 PolarHBondContact O-N 2.68Å

Retrieved 1,000 of 1,000 residues in 816.3 ms (Link to these results)

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