A0A3Q0KBF9_SCHMA Loading...

Nuclear pore complex protein

Functions as a component of the nuclear pore complex (NPC).

AlphaFold DB , UniProt , Accession A0A3Q0KBF9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,045 aa.

						>A0A3Q0KBF9_SCHMA|A0A3Q0KBF9
MTGVGLVNSRSEVDHFQKSNNVTLLFDEDPEMFDGSSLFPHFCSLWKNSQTALSEIPIQYGNACHKIAHRLPRMFTKMSHRKGLPNVRNITEMINLERNTWNLISSIYLDRFESESRTGTVEGNDLSNFNHSEREIIRLLYERDNELREAQILIDWLEQIVREQIEEVAEKYECLFNQTTAWENTAHLLSYLSQAELTKHHLVKELHPDAVTLTGNELDQKDQIDNDRFINYLFLCLRGGDLHRAQLLCTQRGEFWRAISLEGWRPFHYSGFVENESTQIQTIKDTNENSNYSKPLQMKFNIEGNPMRILYKSVCWWNSENIKLRSFERAIYATLSGNLNVLSQILPTSWTDQTWAHCRALVEARVDSSLRSLLNTGPRADTLAVTGKTSKYWPLDGGLSLPESAWTPGDWTLSDVFARVDARLGWSAIGCLEKCNNLRMKSVLRSAMNDFLMDDTSYLYTNDDIGGGGANGNDMESPSVYAIIYCIFYAVQQTIMLKNYDSFLLTLANVMPKLVCYGLGDGIVPDVTPLQPPNLNKVGNTDQVVCHTLRFLTHFVLFLKSADSDIPDESYSEIIKAYLCFLIVNKETDLVAYYVSALPNESLQIEWYSWFLSEINHPTEREHCLSLAVNYGFNLSKLTRSVVRLSKQRIELSSMNQYSSNTIGHHSILSKQNGCMKPSSSNEMDFFTKLLHNNNNSNSNSNKHEIGKLTDLDKQRIIAMDWLFYNPDQRGEALCLANSLLRVFIAMHSFKAAQQVLSKLPVGTLEHAKIICEKLDSPDWLVNTIREHECLTLYLESRDAFADWYQQVHTNRPVQPSSLTNNNNNLMHTTYGPRGLAQRLAIEESKKEYLARLERWRHDTRLDTEAAAEKLLALLTYPHPGWLVDIEQQQQQQQQQQLNMDPNDRLTSTTKTNHNHSMNFHHDKLMDHEIEYNEGETHEKHCGTLLVNKEDLFDGLGENSTSRQLQMNVLRETCITETVFLIVRLYQTAGLHQKCIELSNLIVDNEYGLFKLFSGPQLQNLLHHISESIQYLIDNEQDPLGYTVH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.6	Very low	31.4	Very low	140 Å²	140	111.2 Å²	111.2	69%	0.69	66%	0.661	S	S	*	*				0	18.1	0	-78.3	-164.7	173.6	0	0	114.2	Q164 V168 F451	M1-Q164 HydrophobicContact CE-CB 4.42Å; M1-V168 HydrophobicContact CE-CG2 4.35Å; M1-F451 HydrophobicContact SD-CE1 4.3Å; M1-F451 HydrophobicContact SD-CZ 3.94Å
2	T	27.3	Very low	31.7	Very low	110 Å²	110	114.3 Å²	114.3	68%	0.675	66%	0.663	S	S	*	*			trans	-96.4	103.1	-176.6	44.2	0	0	0	0	111.1
3	G	27.6	Very low	32.2	Very low	74 Å²	74	108.5 Å²	108.5	76%	0.763	63%	0.631	S	S	*	*	S	Bend	trans	135.9	-9.2	156.8	0	0	0	0	0	119.2
4	V	29	Very low	32.6	Very low	122 Å²	122	107.5 Å²	107.5	74%	0.739	62%	0.622	S	S	*	*	S	Bend	trans	-131.3	94.8	-173.7	-166.3	0	0	0	0	112.1
5	G	27.5	Very low	33.1	Very low	58 Å²	58	110.5 Å²	110.5	60%	0.598	63%	0.627	S	S	*	*	S	Bend	trans	124.3	23.2	149.2	0	0	0	0	0	120.9
6	L	29.4	Very low	33.5	Very low	127 Å²	127	110.6 Å²	110.6	67%	0.665	62%	0.619	S	S	*	*			trans	-97.7	17	175.6	-101.2	160.3	0	0	0	115.2	N8 S9	L6-N8 VanDerWaalsContact C-N 3.26Å; L6-N8 PolarHBondContact O-N 3.06Å; L6-S9 WeakPolarHBondContact CD2-OG 3.38Å
7	V	31.5	Very low	34.1	Very low	125 Å²	125	108.4 Å²	108.4	76%	0.758	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-19.8	-176.1	-177.6	0	0	0	0	113
8	N	31	Very low	34.8	Very low	151 Å²	151	112.9 Å²	112.9	81%	0.807	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	3.6	-173.7	-74.7	-0.7	0	0	0	116.4	L6	L6-N8 VanDerWaalsContact C-N 3.26Å; L6-N8 PolarHBondContact O-N 3.06Å
9	S	34.8	Very low	35.1	Very low	33 Å²	33	108.9 Å²	108.9	23%	0.231	60%	0.596	C	S	.	*	S	Bend	trans	-106.7	-1.3	176.4	68.1	0	0	0	0	114.9	L6 V13	L6-S9 WeakPolarHBondContact CD2-OG 3.38Å; S9-V13 WeakPolarHBondContact O-CG2 3.45Å
10	R	32.4	Very low	35.5	Very low	198 Å²	198	111 Å²	111	75%	0.747	61%	0.606	S	S	*	*	H	α-helix	trans	-68.9	-32.1	178.4	-93	-179	170.2	172.1	-3.2	112.8	E12 D14	R10-E12 PolarHBondContact O-N 2.87Å; R10-D14 PolarHBondContact O-N 3.39Å
11	S	38.9	Very low	36	Very low	85 Å²	85	110 Å²	110	59%	0.594	60%	0.601	S	S	*	*	H	α-helix	trans	-70.4	-29.3	-176.9	52.9	0	0	0	0	114.5
12	E	34.9	Very low	36.5	Very low	148 Å²	148	104.8 Å²	104.8	69%	0.692	58%	0.576	S	S	*	*	H	α-helix	trans	-81.3	-33.8	178	-72.8	-178.9	162.1	0	0	112.5	R10 H15 F16	R10-E12 PolarHBondContact O-N 2.87Å; E12-H15 PolarHBondContact O-N 3.47Å; E12-F16 PolarHBondContact O-N 3.21Å
13	V	38.3	Very low	37.5	Very low	40 Å²	40	104.6 Å²	104.6	24%	0.242	58%	0.576	C	S	.	*	H	α-helix	trans	-70.7	-38.6	178.1	178.7	0	0	0	0	111.3	S9 H15 F16 Q17	S9-V13 WeakPolarHBondContact O-CG2 3.45Å; V13-H15 PolarHBondContact O-N 2.91Å; V13-F16 PolarHBondContact O-N 3.39Å; V13-Q17 PolarHBondContact O-N 3.21Å; V13-Q17 VanDerWaalsContact O-N 3.15Å
14	D	37.8	Very low	38.5	Very low	94 Å²	94	107 Å²	107	50%	0.503	57%	0.57	S	S	.	*	H	α-helix	trans	-64.6	-27.7	177	-77.8	-17.5	0	0	0	112.8	R10	R10-D14 PolarHBondContact O-N 3.39Å
15	H	40.9	Very low	39.4	Very low	153 Å²	153	104.3 Å²	104.3	71%	0.708	55%	0.551	S	S	*	*	H	α-helix	trans	-77.9	-31.6	178.6	-126.8	-38.6	0	0	0	112.7	E12 V13	E12-H15 PolarHBondContact O-N 3.47Å; V13-H15 PolarHBondContact O-N 2.91Å
16	F	39.6	Very low	40.4	Very low	111 Å²	111	104.1 Å²	104.1	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-77.5	-35.7	176.9	-112.9	-89.8	0	0	0	113	E12 V13 K18 S19	E12-F16 PolarHBondContact O-N 3.21Å; V13-F16 PolarHBondContact O-N 3.39Å; F16-K18 PolarHBondContact O-N 3.11Å; F16-K18 VanDerWaalsContact O-N 3.09Å; F16-S19 PolarHBondContact O-N 2.89Å; F16-S19 VanDerWaalsContact O-N 3.1Å; F16-S19 PolarHBondContact O-OG 3.48Å
17	Q	43	Very low	41.2	Very low	74 Å²	74	105 Å²	105	35%	0.346	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.5	178.9	-81.8	-172.7	-4.5	0	0	114.5	V13 M78	V13-Q17 PolarHBondContact O-N 3.21Å; V13-Q17 VanDerWaalsContact O-N 3.15Å; Q17-M78 HydrophobicContact CB-CE 4.45Å; Q17-M78 HydrophobicContact CG-CE 3.61Å
18	K	46.2	Very low	42.1	Very low	189 Å²	189	104.5 Å²	104.5	82%	0.822	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.4	179.8	-73.5	-179.8	179	172.9	0	114.6	F16	F16-K18 PolarHBondContact O-N 3.11Å; F16-K18 VanDerWaalsContact O-N 3.09Å
19	S	40.8	Very low	43.6	Very low	37 Å²	37	103.1 Å²	103.1	26%	0.259	52%	0.521	S	S	.	.	S	Bend	trans	-101.1	136.7	-177.2	70.9	0	0	0	0	112.2	F16 N21	F16-S19 PolarHBondContact O-N 2.89Å; F16-S19 VanDerWaalsContact O-N 3.1Å; F16-S19 PolarHBondContact O-OG 3.48Å; S19-N21 PolarHBondContact O-N 3.48Å
20	N	43.3	Very low	44.9	Very low	150 Å²	150	106 Å²	106	80%	0.802	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	9.1	174.9	-77.9	-14.6	0	0	0	114.3	V22	N20-V22 VanDerWaalsContact C-N 3.32Å; N20-V22 PolarHBondContact O-N 3.49Å
21	N	45.7	Very low	46.5	Very low	91 Å²	91	102.1 Å²	102.1	49%	0.487	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.9	-175.4	-77	-9.5	0	0	0	114	S19 T23 L24	S19-N21 PolarHBondContact O-N 3.48Å; N21-T23 VanDerWaalsContact C-N 3.3Å; N21-T23 PolarHBondContact O-N 2.86Å; N21-L24 PolarHBondContact O-N 3.21Å
22	V	47.3	Very low	47.9	Very low	30 Å²	30	100.7 Å²	100.7	18%	0.182	51%	0.514	C	S	.	.	H	α-helix	trans	-65.2	-35	180	173.8	0	0	0	0	111.5	N20 L24 L25 F26 F75 M78	N20-V22 VanDerWaalsContact C-N 3.32Å; N20-V22 PolarHBondContact O-N 3.49Å; V22-L24 PolarHBondContact O-N 3.11Å; V22-L25 PolarHBondContact O-N 2.65Å; V22-F26 HydrophobicContact CG1-CD2 4.11Å; V22-F26 HydrophobicContact CG1-CE2 3.5Å; V22-F26 WeakPolarHBondContact O-CD2 3.43Å; V22-F75 HydrophobicContact CG1-CE1 4.31Å; V22-M78 HydrophobicContact CG2-CE 4.33Å
23	T	48.3	Very low	49.4	Very low	107 Å²	107	93.8 Å²	93.8	66%	0.656	48%	0.482	S	S	*	.	H	α-helix	trans	-70.9	-28.2	-178.8	-35.9	0	0	0	0	113.2	N21 L25	N21-T23 VanDerWaalsContact C-N 3.3Å; N21-T23 PolarHBondContact O-N 2.86Å; T23-L25 VanDerWaalsContact C-N 3.34Å
24	L	47.4	Very low	51.1	Low	123 Å²	123	93 Å²	93	64%	0.644	48%	0.477	S	S	*	.	H	α-helix	trans	-76.5	-18.3	179.6	-79.4	162.6	0	0	0	113.6	N21 V22	N21-L24 PolarHBondContact O-N 3.21Å; V22-L24 PolarHBondContact O-N 3.11Å
25	L	48.4	Very low	53	Low	66 Å²	66	88.6 Å²	88.6	35%	0.346	45%	0.453	S	S	.	.	H	α-helix	trans	-86.5	-17.7	175.9	-83.4	156.3	0	0	0	112.8	V22 T23 D27 E28 F33	V22-L25 PolarHBondContact O-N 2.65Å; T23-L25 VanDerWaalsContact C-N 3.34Å; L25-D27 VanDerWaalsContact C-N 3.32Å; L25-E28 PolarHBondContact O-N 2.78Å; L25-F33 WeakPolarHBondContact O-CZ 3.33Å
26	F	47.8	Very low	55.1	Low	55 Å²	55	82.2 Å²	82.2	24%	0.241	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-2.7	177	-75.5	-66.2	0	0	0	113.9	V22 E28 F33 L84	V22-F26 HydrophobicContact CG1-CD2 4.11Å; V22-F26 HydrophobicContact CG1-CE2 3.5Å; V22-F26 WeakPolarHBondContact O-CD2 3.43Å; F26-E28 PolarHBondContact O-N 2.9Å; F26-F33 HydrophobicContact CD1-CD1 4.22Å; F26-F33 HydrophobicContact CD1-CD2 4.19Å; F26-F33 HydrophobicContact CD1-CE1 4.15Å; F26-F33 HydrophobicContact CD1-CE2 4.14Å; F26-F33 HydrophobicContact CD1-CG 4.23Å; F26-F33 HydrophobicContact CD1-CZ 4.12Å; F26-F33 AromaticContact CE1-CD1 3.73Å; F26-F33 HydrophobicContact CE1-CD1 3.73Å; F26-F33 HydrophobicContact CE1-CD2 4.49Å; F26-F33 AromaticContact CE1-CE1 3.81Å; F26-F33 HydrophobicContact CE1-CE1 3.81Å; F26-F33 HydrophobicContact CE1-CG 4.08Å; F26-F33 HydrophobicContact CE1-CZ 4.25Å; F26-L84 HydrophobicContact CD1-CD2 4.1Å; F26-L84 HydrophobicContact CD2-CD2 4.18Å; F26-L84 HydrophobicContact CE1-CD2 3.56Å; F26-L84 HydrophobicContact CE2-CD1 4.06Å; F26-L84 HydrophobicContact CE2-CD2 3.63Å; F26-L84 HydrophobicContact CG-CD2 4.41Å; F26-L84 HydrophobicContact CZ-CD1 4.22Å; F26-L84 HydrophobicContact CZ-CD2 3.32Å; F26-L84 HydrophobicContact CZ-CG 4.34Å
27	D	47.1	Very low	57.3	Low	145 Å²	145	78.8 Å²	78.8	78%	0.775	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-7.7	165.9	-85.5	-17.7	0	0	0	111.8	L25	L25-D27 VanDerWaalsContact C-N 3.32Å
28	E	50.9	Low	59.5	Low	114 Å²	114	75.3 Å²	75.3	53%	0.533	40%	0.399	S	S	.	.	S	Bend	trans	-81.6	138.7	166.8	-65.4	-170.4	162.1	0	0	110.5	L25 F26 F33	L25-E28 PolarHBondContact O-N 2.78Å; F26-E28 PolarHBondContact O-N 2.9Å; E28-F33 HydrophobicContact CB-CE2 4.27Å
29	D	60.9	Low	61.7	Low	122 Å²	122	66.7 Å²	66.7	65%	0.652	36%	0.362	S	S	*	.			trans	-28	113.6	-168.1	-80.3	-39.3	0	0	0	114.8	E31 M32	D29-E31 PolarHBondContact O-N 3.28Å; D29-E31 VanDerWaalsContact O-N 3.1Å; D29-M32 HydrophobicContact CB-CB 4.41Å; D29-M32 VanDerWaalsContact O-CB 3.25Å; D29-M32 WeakPolarHBondContact O-CB 3.24Å; D29-M32 PolarHBondContact O-N 3.39Å
30	P	62.9	Low	64.1	Low	94 Å²	94	68.2 Å²	68.2	61%	0.61	37%	0.371	S	S	*	.	H	α-helix	trans	-58.5	-29.6	-178.1	20.6	-30.8	0	0	0	112.7	M32 F33 D34	P30-M32 PolarHBondContact O-N 3.48Å; P30-F33 PolarHBondContact O-N 2.95Å; P30-F33 VanDerWaalsContact O-N 3.12Å; P30-D34 PolarHBondContact O-N 3.29Å
31	E	66	Low	66.4	Low	117 Å²	117	64.6 Å²	64.6	55%	0.547	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-22.6	175.8	-61.8	-178.3	-173.6	0	0	113.9	D29 D34 G35 S36	D29-E31 PolarHBondContact O-N 3.28Å; D29-E31 VanDerWaalsContact O-N 3.1Å; E31-D34 WeakPolarHBondContact CA-OD1 3.21Å; E31-G35 CarbonylContact O-C 3.59Å; E31-G35 PolarHBondContact O-N 2.85Å; E31-S36 WeakPolarHBondContact CA-OG 3.38Å; E31-S36 WeakPolarHBondContact CB-OG 3.42Å; E31-S36 PolarHBondContact O-N 2.77Å; E31-S36 PolarHBondContact O-OG 3.14Å
32	M	68.1	Low	68.7	Low	54 Å²	54	60.2 Å²	60.2	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-76.6	-34.5	176.4	-168.4	-173.1	68.9	0	0	111.2	D29 P30 L71	D29-M32 HydrophobicContact CB-CB 4.41Å; D29-M32 VanDerWaalsContact O-CB 3.25Å; D29-M32 WeakPolarHBondContact O-CB 3.24Å; D29-M32 PolarHBondContact O-N 3.39Å; P30-M32 PolarHBondContact O-N 3.48Å; M32-L71 WeakPolarHBondContact O-CD2 3.37Å
33	F	66.3	Low	70.8	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-78.9	-31.1	-173.6	-81.6	-85.3	0	0	0	113.9	L25 F26 E28 P30 L71 P72 F75	L25-F33 WeakPolarHBondContact O-CZ 3.33Å; F26-F33 HydrophobicContact CD1-CD1 4.22Å; F26-F33 HydrophobicContact CD1-CD2 4.19Å; F26-F33 HydrophobicContact CD1-CE1 4.15Å; F26-F33 HydrophobicContact CD1-CE2 4.14Å; F26-F33 HydrophobicContact CD1-CG 4.23Å; F26-F33 HydrophobicContact CD1-CZ 4.12Å; F26-F33 AromaticContact CE1-CD1 3.73Å; F26-F33 HydrophobicContact CE1-CD1 3.73Å; F26-F33 HydrophobicContact CE1-CD2 4.49Å; F26-F33 AromaticContact CE1-CE1 3.81Å; F26-F33 HydrophobicContact CE1-CE1 3.81Å; F26-F33 HydrophobicContact CE1-CG 4.08Å; F26-F33 HydrophobicContact CE1-CZ 4.25Å; E28-F33 HydrophobicContact CB-CE2 4.27Å; P30-F33 PolarHBondContact O-N 2.95Å; P30-F33 VanDerWaalsContact O-N 3.12Å; F33-L71 WeakPolarHBondContact O-CD2 3.42Å; F33-P72 HydrophobicContact CD1-CG 4.3Å; F33-P72 HydrophobicContact CE1-CG 3.69Å; F33-P72 HydrophobicContact CZ-CG 4.29Å; F33-F75 HydrophobicContact CE1-CD2 4.27Å; F33-F75 AromaticContact CE1-CE2 4Å; F33-F75 HydrophobicContact CE1-CE2 4Å
34	D	74.1	Confident	72.9	Confident	24 Å²	24	56 Å²	56	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-96.6	-7.7	174.4	66.5	3.9	0	0	0	113.3	P30 E31 S36 P85 Q543 H547	P30-D34 PolarHBondContact O-N 3.29Å; E31-D34 WeakPolarHBondContact CA-OD1 3.21Å; D34-S36 VanDerWaalsContact C-N 3.27Å; D34-S36 PolarHBondContact O-N 2.84Å; D34-S36 WeakPolarHBondContact OD1-CB 3.42Å; D34-S36 PolarHBondContact OD1-N 2.82Å; D34-S36 PolarHBondContact OD1-OG 3.35Å; D34-P85 HydrophobicContact CB-CB 4.36Å; D34-P85 HydrophobicContact CB-CG 4.21Å; D34-Q543 HydrophobicContact CB-CG 3.96Å; D34-Q543 PolarHBondContact OD2-NE2 2.85Å; D34-H547 PolarHBondContact O-NE2 3.14Å
35	G	79	Confident	74.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.277	C	S	.	.			trans	73.6	15	-178.1	0	0	0	0	0	113.7	E31 S37 L38 H547	E31-G35 CarbonylContact O-C 3.59Å; E31-G35 PolarHBondContact O-N 2.85Å; G35-S37 PolarHBondContact O-N 2.93Å; G35-L38 VanDerWaalsContact O-CB 3.3Å; G35-L38 WeakPolarHBondContact O-CB 3.45Å; G35-L38 PolarHBondContact O-N 3.45Å; G35-H547 PolarHBondContact O-CE1 3Å
36	S	83.3	Confident	77	Confident	19 Å²	19	49.4 Å²	49.4	13%	0.133	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.8	-175.8	53.1	0	0	0	0	114.3	E31 D34 L38 F39 P40	E31-S36 WeakPolarHBondContact CA-OG 3.38Å; E31-S36 WeakPolarHBondContact CB-OG 3.42Å; E31-S36 PolarHBondContact O-N 2.77Å; E31-S36 PolarHBondContact O-OG 3.14Å; D34-S36 VanDerWaalsContact C-N 3.27Å; D34-S36 PolarHBondContact O-N 2.84Å; D34-S36 WeakPolarHBondContact OD1-CB 3.42Å; D34-S36 PolarHBondContact OD1-N 2.82Å; D34-S36 PolarHBondContact OD1-OG 3.35Å; S36-L38 PolarHBondContact O-N 2.94Å; S36-F39 VanDerWaalsContact CB-CE2 3.48Å; S36-F39 WeakPolarHBondContact O-CD2 3.27Å; S36-F39 PolarHBondContact O-N 3.06Å; S36-P40 WeakPolarHBondContact O-CD 3.21Å
37	S	86.7	Confident	78.9	Confident	40 Å²	40	50.1 Å²	50.1	28%	0.28	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-19.5	169	58.8	0	0	0	0	114.3	G35 H41 I67	G35-S37 PolarHBondContact O-N 2.93Å; S37-H41 WeakPolarHBondContact O-CB 3.49Å; S37-I67 WeakPolarHBondContact OG-CD1 3.17Å
38	L	89.1	Confident	80.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-32.7	172.6	-78.1	167.5	0	0	0	113.7	G35 S36 H41 F42 A63 I67 I94	G35-L38 VanDerWaalsContact O-CB 3.3Å; G35-L38 WeakPolarHBondContact O-CB 3.45Å; G35-L38 PolarHBondContact O-N 3.45Å; S36-L38 PolarHBondContact O-N 2.94Å; L38-H41 PolarHBondContact O-N 3.34Å; L38-F42 HydrophobicContact CD2-CD2 4.05Å; L38-F42 HydrophobicContact CD2-CE2 3.64Å; L38-F42 WeakPolarHBondContact O-CB 3.48Å; L38-F42 WeakPolarHBondContact O-CD2 3.39Å; L38-F42 PolarHBondContact O-N 3.45Å; L38-A63 HydrophobicContact CD2-CB 4.23Å; L38-I67 HydrophobicContact CB-CD1 4.43Å; L38-I67 HydrophobicContact CD1-CB 4.38Å; L38-I67 HydrophobicContact CD1-CD1 4.29Å; L38-I67 HydrophobicContact CD1-CG2 4.07Å; L38-I67 HydrophobicContact CD2-CB 4.47Å; L38-I67 HydrophobicContact CD2-CD1 3.51Å; L38-I67 HydrophobicContact CD2-CG1 4.37Å; L38-I67 HydrophobicContact CG-CB 4.39Å; L38-I67 HydrophobicContact CG-CD1 3.41Å; L38-I67 VanDerWaalsContact CG-CD1 3.41Å; L38-I67 HydrophobicContact CG-CG1 4.41Å; L38-I67 HydrophobicContact CG-CG2 4.33Å; L38-I94 HydrophobicContact CD1-CD1 4.06Å; L38-I94 HydrophobicContact CD1-CG1 4.23Å
39	F	92	Very high	81.4	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-57.7	-174.1	-55	-66	0	0	0	111.9	S36 H41 C43 C546 H547 R550 Y578 L590	S36-F39 VanDerWaalsContact CB-CE2 3.48Å; S36-F39 WeakPolarHBondContact O-CD2 3.27Å; S36-F39 PolarHBondContact O-N 3.06Å; F39-H41 VanDerWaalsContact C-N 3.29Å; F39-H41 PolarHBondContact O-N 3.35Å; F39-C43 PolarHBondContact O-N 3.37Å; F39-C546 VanDerWaalsContact CE1-SG 3.56Å; F39-C546 HydrophobicContact CZ-CB 4.18Å; F39-C546 WeakPolarHBondContact CZ-SG 3.46Å; F39-H547 AromaticContact CZ-CE1 3.8Å; F39-R550 HydrophobicContact CD1-CB 4.09Å; F39-R550 HydrophobicContact CD1-CG 3.92Å; F39-R550 HydrophobicContact CE1-CB 4.01Å; F39-R550 HydrophobicContact CE1-CG 4.29Å; F39-Y578 HydrophobicContact CD1-CE2 4.1Å; F39-Y578 WeakPolarHBondContact CD1-OH 3.47Å; F39-Y578 HydrophobicContact CE1-CE2 4.21Å; F39-L590 HydrophobicContact CB-CD1 3.8Å
40	P	91.1	Very high	81.5	Confident	70 Å²	70	47.7 Å²	47.7	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-67.4	-31.9	176.2	28.4	-35.6	0	0	0	112.3	S36 C43 S44 L590	S36-P40 WeakPolarHBondContact O-CD 3.21Å; P40-C43 PolarHBondContact O-N 2.9Å; P40-S44 WeakPolarHBondContact O-CB 3.27Å; P40-S44 PolarHBondContact O-N 2.94Å; P40-L590 HydrophobicContact CB-CD2 4.49Å
41	H	91.9	Very high	81.1	Confident	73 Å²	73	49.8 Å²	49.8	34%	0.338	27%	0.266	S	S	.	.	H	α-helix	trans	-64.7	-47.1	-179.8	-170.2	39.4	0	0	0	112	S37 L38 F39 C43 S44 L45	S37-H41 WeakPolarHBondContact O-CB 3.49Å; L38-H41 PolarHBondContact O-N 3.34Å; F39-H41 VanDerWaalsContact C-N 3.29Å; F39-H41 PolarHBondContact O-N 3.35Å; H41-C43 PolarHBondContact O-N 3.5Å; H41-S44 PolarHBondContact O-N 2.9Å; H41-S44 VanDerWaalsContact O-N 3.16Å; H41-S44 PolarHBondContact O-OG 3.2Å; H41-L45 WeakPolarHBondContact O-CG 3.48Å; H41-L45 PolarHBondContact O-N 3.26Å
42	F	93.5	Very high	81.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-42.9	177.1	-93	-128	0	0	0	112.1	L38 S44 L45 W46 Y60 A63 C64 E97 W101 H554	L38-F42 HydrophobicContact CD2-CD2 4.05Å; L38-F42 HydrophobicContact CD2-CE2 3.64Å; L38-F42 WeakPolarHBondContact O-CB 3.48Å; L38-F42 WeakPolarHBondContact O-CD2 3.39Å; L38-F42 PolarHBondContact O-N 3.45Å; F42-S44 VanDerWaalsContact C-N 3.29Å; F42-S44 PolarHBondContact O-N 3.47Å; F42-L45 PolarHBondContact O-N 3.13Å; F42-W46 WeakPolarHBondContact O-CB 3.39Å; F42-W46 PolarHBondContact O-N 3.33Å; F42-Y60 HydrophobicContact CB-CE1 4.13Å; F42-Y60 AromaticContact CD1-CD1 3.47Å; F42-Y60 HydrophobicContact CD1-CD1 3.47Å; F42-Y60 VanDerWaalsContact CD1-CD1 3.47Å; F42-Y60 HydrophobicContact CD1-CD2 4.12Å; F42-Y60 AromaticContact CD1-CE1 3.5Å; F42-Y60 HydrophobicContact CD1-CE1 3.5Å; F42-Y60 VanDerWaalsContact CD1-CE1 3.5Å; F42-Y60 HydrophobicContact CD1-CE2 4.15Å; F42-Y60 AromaticContact CD1-CG 3.79Å; F42-Y60 HydrophobicContact CD1-CG 3.79Å; F42-Y60 AromaticContact CD1-CZ 3.86Å; F42-Y60 HydrophobicContact CD2-CD1 4.06Å; F42-Y60 HydrophobicContact CD2-CE1 4.4Å; F42-Y60 AromaticContact CE1-CD1 3.43Å; F42-Y60 HydrophobicContact CE1-CD1 3.43Å; F42-Y60 VanDerWaalsContact CE1-CD1 3.43Å; F42-Y60 AromaticContact CE1-CD2 3.76Å; F42-Y60 HydrophobicContact CE1-CD2 3.76Å; F42-Y60 AromaticContact CE1-CE1 3.96Å; F42-Y60 HydrophobicContact CE1-CE1 3.96Å; F42-Y60 HydrophobicContact CE1-CE2 4.24Å; F42-Y60 AromaticContact CE1-CG 3.32Å; F42-Y60 HydrophobicContact CE1-CG 3.32Å; F42-Y60 HydrophobicContact CE2-CD1 4.01Å; F42-Y60 HydrophobicContact CE2-CG 4.41Å; F42-Y60 AromaticContact CG-CD1 3.8Å; F42-Y60 HydrophobicContact CG-CD1 3.8Å; F42-Y60 AromaticContact CG-CE1 3.76Å; F42-Y60 HydrophobicContact CG-CE1 3.76Å; F42-Y60 AromaticContact CZ-CD1 3.71Å; F42-Y60 HydrophobicContact CZ-CD1 3.71Å; F42-Y60 AromaticContact CZ-CG 3.68Å; F42-Y60 HydrophobicContact CZ-CG 3.68Å; F42-A63 HydrophobicContact CD2-CB 4.41Å; F42-A63 HydrophobicContact CE2-CB 3.72Å; F42-C64 VanDerWaalsContact CZ-SG 3.6Å; F42-E97 WeakPolarHBondContact CE1-OE1 3.31Å; F42-W101 AromaticContact CE1-NE1 3.78Å; F42-H554 HydrophobicContact CD1-CB 4.36Å; F42-H554 AromaticContact CD1-CD2 3.95Å; F42-H554 AromaticContact CD1-CG 3.92Å
43	C	92.2	Very high	82.6	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-57.6	-43.6	173.8	-175.1	0	0	0	0	111.5	F39 P40 H41 W46 K47 L590 Y593	F39-C43 PolarHBondContact O-N 3.37Å; P40-C43 PolarHBondContact O-N 2.9Å; H41-C43 PolarHBondContact O-N 3.5Å; C43-W46 PolarHBondContact O-N 3.37Å; C43-K47 VanDerWaalsContact O-CG 3.32Å; C43-K47 WeakPolarHBondContact O-CG 3.41Å; C43-K47 PolarHBondContact O-N 2.9Å; C43-K47 WeakPolarHBondContact SG-CE 3.29Å; C43-K47 PolarHBondContact SG-NZ 2.84Å; C43-K47 VanDerWaalsContact SG-NZ 3.4Å; C43-L590 HydrophobicContact CB-CD2 3.68Å; C43-Y593 WeakPolarHBondContact SG-CD1 3.46Å
44	S	91.4	Very high	83.5	Confident	45 Å²	45	47.1 Å²	47.1	32%	0.315	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-43.2	178.3	75.4	0	0	0	0	113	P40 H41 F42 W46 K47 N48	P40-S44 WeakPolarHBondContact O-CB 3.27Å; P40-S44 PolarHBondContact O-N 2.94Å; H41-S44 PolarHBondContact O-N 2.9Å; H41-S44 VanDerWaalsContact O-N 3.16Å; H41-S44 PolarHBondContact O-OG 3.2Å; F42-S44 VanDerWaalsContact C-N 3.29Å; F42-S44 PolarHBondContact O-N 3.47Å; S44-W46 VanDerWaalsContact C-N 3.34Å; S44-W46 PolarHBondContact O-N 3.03Å; S44-K47 PolarHBondContact O-N 2.86Å; S44-N48 PolarHBondContact O-N 2.9Å; S44-N48 VanDerWaalsContact O-N 3.14Å; S44-N48 PolarHBondContact O-ND2 3.48Å; S44-N48 VanDerWaalsContact O-ND2 3.15Å
45	L	91.3	Very high	84.2	Confident	25 Å²	25	50.9 Å²	50.9	13%	0.131	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-45.5	178	-69.5	173.5	0	0	0	110.4	H41 F42 N48 S49 Q59 Y60 A63	H41-L45 WeakPolarHBondContact O-CG 3.48Å; H41-L45 PolarHBondContact O-N 3.26Å; F42-L45 PolarHBondContact O-N 3.13Å; L45-N48 PolarHBondContact O-N 2.96Å; L45-S49 WeakPolarHBondContact O-CB 3.31Å; L45-S49 PolarHBondContact O-N 3.38Å; L45-Q59 HydrophobicContact CD1-CB 4.22Å; L45-Q59 HydrophobicContact CD2-CB 4.48Å; L45-Y60 HydrophobicContact CB-CE1 4Å; L45-Y60 HydrophobicContact CD1-CD1 3.98Å; L45-Y60 HydrophobicContact CD1-CE1 4.24Å; L45-A63 HydrophobicContact CD1-CB 4.4Å
46	W	91.7	Very high	84.8	Confident	27 Å²	27	50.9 Å²	50.9	10%	0.102	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-40	177.8	-171.6	-103	0	0	0	113.7	F42 C43 S44 N48 S49 L53 I56 Y60 L557 F558 S561 Y593	F42-W46 WeakPolarHBondContact O-CB 3.39Å; F42-W46 PolarHBondContact O-N 3.33Å; C43-W46 PolarHBondContact O-N 3.37Å; S44-W46 VanDerWaalsContact C-N 3.34Å; S44-W46 PolarHBondContact O-N 3.03Å; W46-N48 VanDerWaalsContact C-N 3.3Å; W46-N48 PolarHBondContact O-N 2.86Å; W46-S49 PolarHBondContact O-N 2.92Å; W46-S49 PolarHBondContact O-OG 3.04Å; W46-L53 HydrophobicContact CH2-CD1 4.31Å; W46-L53 HydrophobicContact CZ3-CD1 4.35Å; W46-I56 HydrophobicContact CE3-CG1 4.32Å; W46-I56 HydrophobicContact CE3-CG2 3.89Å; W46-I56 HydrophobicContact CZ3-CG2 3.93Å; W46-Y60 WeakPolarHBondContact CB-OH 3.28Å; W46-Y60 VanDerWaalsContact CE3-OH 3.26Å; W46-L557 VanDerWaalsContact CH2-C 3.46Å; W46-L557 HydrophobicContact CH2-CB 4.15Å; W46-L557 VanDerWaalsContact CH2-O 3.32Å; W46-L557 WeakPolarHBondContact CH2-O 3.46Å; W46-L557 HydrophobicContact CZ2-CB 3.69Å; W46-L557 WeakPolarHBondContact CZ2-O 3.3Å; W46-F558 HydrophobicContact CH2-CB 4.29Å; W46-F558 HydrophobicContact CZ3-CB 4.08Å; W46-F558 HydrophobicContact CZ3-CD2 4.39Å; W46-S561 WeakPolarHBondContact CH2-OG 3.15Å; W46-S561 WeakPolarHBondContact CZ2-OG 3.16Å; W46-Y593 AromaticContact CD1-CZ 3.96Å; W46-Y593 PolarHBondContact NE1-OH 3.26Å
47	K	86.7	Confident	85.3	Confident	69 Å²	69	50 Å²	50	30%	0.3	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-37.2	176.7	-76.5	171.2	177.6	171.1	0	112.3	C43 S44 S49 Y593 Y631	C43-K47 VanDerWaalsContact O-CG 3.32Å; C43-K47 WeakPolarHBondContact O-CG 3.41Å; C43-K47 PolarHBondContact O-N 2.9Å; C43-K47 WeakPolarHBondContact SG-CE 3.29Å; C43-K47 PolarHBondContact SG-NZ 2.84Å; C43-K47 VanDerWaalsContact SG-NZ 3.4Å; S44-K47 PolarHBondContact O-N 2.86Å; K47-S49 VanDerWaalsContact C-N 3.3Å; K47-Y593 HydrophobicContact CD-CD2 4.31Å; K47-Y593 HydrophobicContact CD-CE2 4.28Å; K47-Y593 HydrophobicContact CG-CD2 4.38Å; K47-Y593 HydrophobicContact CG-CE2 3.85Å; K47-Y631 PolarHBondContact NZ-OH 2.95Å
48	N	83	Confident	85.6	Confident	126 Å²	126	51.4 Å²	51.4	67%	0.674	28%	0.278	S	S	*	.	H	α-helix	trans	-79.1	-14.4	-177.3	-66.2	-22.1	0	0	0	113	S44 L45 W46 Q50	S44-N48 PolarHBondContact O-N 2.9Å; S44-N48 VanDerWaalsContact O-N 3.14Å; S44-N48 PolarHBondContact O-ND2 3.48Å; S44-N48 VanDerWaalsContact O-ND2 3.15Å; L45-N48 PolarHBondContact O-N 2.96Å; W46-N48 VanDerWaalsContact C-N 3.3Å; W46-N48 PolarHBondContact O-N 2.86Å; N48-Q50 PolarHBondContact O-N 2.73Å
49	S	68.2	Low	85.9	Confident	19 Å²	19	54.1 Å²	54.1	13%	0.133	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	14.9	-166.3	67.6	0	0	0	0	116.1	L45 W46 K47 T51 A52 I56	L45-S49 WeakPolarHBondContact O-CB 3.31Å; L45-S49 PolarHBondContact O-N 3.38Å; W46-S49 PolarHBondContact O-N 2.92Å; W46-S49 PolarHBondContact O-OG 3.04Å; K47-S49 VanDerWaalsContact C-N 3.3Å; S49-T51 PolarHBondContact O-N 3.49Å; S49-A52 PolarHBondContact O-N 3.42Å; S49-I56 VanDerWaalsContact OG-CD1 3.24Å; S49-I56 WeakPolarHBondContact OG-CD1 3.26Å; S49-I56 VanDerWaalsContact OG-CG1 3.32Å; S49-I56 WeakPolarHBondContact OG-CG1 3.42Å
50	Q	62	Low	86	Confident	186 Å²	186	53.8 Å²	53.8	87%	0.869	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-4.9	179.3	-70.9	-176.4	-8.9	0	0	113.8	N48	N48-Q50 PolarHBondContact O-N 2.73Å
51	T	55.8	Low	86.2	Confident	137 Å²	137	50.5 Å²	50.5	84%	0.84	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-17.2	-178.7	55.2	0	0	0	0	116.1	S49	S49-T51 PolarHBondContact O-N 3.49Å
52	A	79.7	Confident	86.2	Confident	29 Å²	29	51 Å²	51	24%	0.24	27%	0.273	C	S	.	.			trans	-157.6	94.3	179.3	0	0	0	0	0	113.3	S49 S54 E55	S49-A52 PolarHBondContact O-N 3.42Å; A52-S54 PolarHBondContact O-N 3.36Å; A52-E55 HydrophobicContact CB-CG 4.16Å; A52-E55 PolarHBondContact O-N 3.08Å
53	L	86.1	Confident	86.2	Confident	44 Å²	44	51.1 Å²	51.1	23%	0.23	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-61.1	-29.3	-178.4	-172.8	62.6	0	0	0	113.4	W46 E55 I56 P57 F112 F558 A562	W46-L53 HydrophobicContact CH2-CD1 4.31Å; W46-L53 HydrophobicContact CZ3-CD1 4.35Å; L53-E55 VanDerWaalsContact C-N 3.3Å; L53-E55 PolarHBondContact O-N 3.15Å; L53-I56 PolarHBondContact O-N 3.06Å; L53-P57 WeakPolarHBondContact O-CD 3.47Å; L53-F112 HydrophobicContact CD2-CZ 3.98Å; L53-F112 HydrophobicContact CG-CZ 4.28Å; L53-F558 HydrophobicContact CD1-CD2 3.7Å; L53-F558 HydrophobicContact CD1-CE2 3.81Å; L53-F558 HydrophobicContact CG-CD2 4.26Å; L53-F558 HydrophobicContact CG-CE2 3.84Å; L53-A562 HydrophobicContact CD2-CB 3.79Å
54	S	85.2	Confident	86.3	Confident	47 Å²	47	51 Å²	51	33%	0.329	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-65.8	-27.2	179.8	55.6	0	0	0	0	114	A52	A52-S54 PolarHBondContact O-N 3.36Å
55	E	88.2	Confident	86.3	Confident	103 Å²	103	53 Å²	53	48%	0.481	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-81.8	-21.4	-177.7	-65	-172.5	178.7	0	0	112.9	A52 L53 I58 Q59	A52-E55 HydrophobicContact CB-CG 4.16Å; A52-E55 PolarHBondContact O-N 3.08Å; L53-E55 VanDerWaalsContact C-N 3.3Å; L53-E55 PolarHBondContact O-N 3.15Å; E55-I58 WeakPolarHBondContact O-CB 3.33Å; E55-I58 PolarHBondContact O-N 3.16Å; E55-Q59 WeakPolarHBondContact O-CG 3.43Å; E55-Q59 PolarHBondContact O-N 3.26Å; E55-Q59 PolarHBondContact OE2-NE2 3.42Å
56	I	92.2	Very high	86.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-52.4	-172.7	-80.4	-60.3	0	0	0	113.3	W46 S49 L53 I58 Q59 Y60 F558	W46-I56 HydrophobicContact CE3-CG1 4.32Å; W46-I56 HydrophobicContact CE3-CG2 3.89Å; W46-I56 HydrophobicContact CZ3-CG2 3.93Å; S49-I56 VanDerWaalsContact OG-CD1 3.24Å; S49-I56 WeakPolarHBondContact OG-CD1 3.26Å; S49-I56 VanDerWaalsContact OG-CG1 3.32Å; S49-I56 WeakPolarHBondContact OG-CG1 3.42Å; L53-I56 PolarHBondContact O-N 3.06Å; I56-I58 PolarHBondContact O-N 3.21Å; I56-Q59 PolarHBondContact O-N 3.01Å; I56-Q59 VanDerWaalsContact O-N 3.11Å; I56-Y60 HydrophobicContact CG2-CD2 3.79Å; I56-Y60 HydrophobicContact CG2-CE1 4.33Å; I56-Y60 HydrophobicContact CG2-CE2 3.35Å; I56-Y60 HydrophobicContact CG2-CG 4.45Å; I56-Y60 PolarHBondContact O-N 2.84Å; I56-F558 HydrophobicContact CG2-CD2 4.28Å
57	P	93.9	Very high	86.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-36.5	177.3	-29.8	39	0	0	0	113	L53 Y60 G61 W101 I104 F558	L53-P57 WeakPolarHBondContact O-CD 3.47Å; P57-Y60 PolarHBondContact O-N 3.5Å; P57-G61 PolarHBondContact O-N 3.12Å; P57-W101 HydrophobicContact CB-CE3 3.93Å; P57-W101 HydrophobicContact CB-CZ3 4.44Å; P57-W101 HydrophobicContact CG-CE3 4.37Å; P57-W101 HydrophobicContact CG-CZ3 4.39Å; P57-I104 HydrophobicContact CB-CB 4.44Å; P57-I104 HydrophobicContact CB-CG2 4.14Å; P57-I104 HydrophobicContact CG-CG2 3.96Å; P57-F558 HydrophobicContact CG-CD2 4.01Å; P57-F558 HydrophobicContact CG-CE1 4.3Å; P57-F558 HydrophobicContact CG-CE2 3.46Å; P57-F558 VanDerWaalsContact CG-CE2 3.46Å; P57-F558 HydrophobicContact CG-CZ 3.63Å
58	I	93	Very high	86	Confident	68 Å²	68	54.6 Å²	54.6	35%	0.349	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-46.2	177.5	-56.9	174.1	0	0	0	110.4	E55 I56 Y60 G61 N62	E55-I58 WeakPolarHBondContact O-CB 3.33Å; E55-I58 PolarHBondContact O-N 3.16Å; I56-I58 PolarHBondContact O-N 3.21Å; I58-Y60 VanDerWaalsContact C-N 3.33Å; I58-Y60 PolarHBondContact O-N 2.54Å; I58-G61 PolarHBondContact O-N 3.1Å; I58-N62 WeakPolarHBondContact O-CB 3.36Å; I58-N62 VanDerWaalsContact O-CG 3.28Å; I58-N62 PolarHBondContact O-N 2.91Å; I58-N62 PolarHBondContact O-ND2 3.18Å; I58-N62 VanDerWaalsContact O-ND2 3.16Å
59	Q	94.1	Very high	86	Confident	58 Å²	58	54.1 Å²	54.1	27%	0.271	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-40.8	178.3	-68.1	175.6	13	0	0	111.5	L45 E55 I56 N62 A63	L45-Q59 HydrophobicContact CD1-CB 4.22Å; L45-Q59 HydrophobicContact CD2-CB 4.48Å; E55-Q59 WeakPolarHBondContact O-CG 3.43Å; E55-Q59 PolarHBondContact O-N 3.26Å; E55-Q59 PolarHBondContact OE2-NE2 3.42Å; I56-Q59 PolarHBondContact O-N 3.01Å; I56-Q59 VanDerWaalsContact O-N 3.11Å; Q59-N62 PolarHBondContact O-N 3.38Å; Q59-A63 WeakPolarHBondContact O-CB 3.16Å; Q59-A63 PolarHBondContact O-N 2.92Å
60	Y	95.4	Very high	86.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-46.7	174.4	-70.6	-16.1	0	0	0	112.9	F42 L45 W46 I56 P57 I58 N62 A63 C64 W101 H554	F42-Y60 HydrophobicContact CB-CE1 4.13Å; F42-Y60 AromaticContact CD1-CD1 3.47Å; F42-Y60 HydrophobicContact CD1-CD1 3.47Å; F42-Y60 VanDerWaalsContact CD1-CD1 3.47Å; F42-Y60 HydrophobicContact CD1-CD2 4.12Å; F42-Y60 AromaticContact CD1-CE1 3.5Å; F42-Y60 HydrophobicContact CD1-CE1 3.5Å; F42-Y60 VanDerWaalsContact CD1-CE1 3.5Å; F42-Y60 HydrophobicContact CD1-CE2 4.15Å; F42-Y60 AromaticContact CD1-CG 3.79Å; F42-Y60 HydrophobicContact CD1-CG 3.79Å; F42-Y60 AromaticContact CD1-CZ 3.86Å; F42-Y60 HydrophobicContact CD2-CD1 4.06Å; F42-Y60 HydrophobicContact CD2-CE1 4.4Å; F42-Y60 AromaticContact CE1-CD1 3.43Å; F42-Y60 HydrophobicContact CE1-CD1 3.43Å; F42-Y60 VanDerWaalsContact CE1-CD1 3.43Å; F42-Y60 AromaticContact CE1-CD2 3.76Å; F42-Y60 HydrophobicContact CE1-CD2 3.76Å; F42-Y60 AromaticContact CE1-CE1 3.96Å; F42-Y60 HydrophobicContact CE1-CE1 3.96Å; F42-Y60 HydrophobicContact CE1-CE2 4.24Å; F42-Y60 AromaticContact CE1-CG 3.32Å; F42-Y60 HydrophobicContact CE1-CG 3.32Å; F42-Y60 HydrophobicContact CE2-CD1 4.01Å; F42-Y60 HydrophobicContact CE2-CG 4.41Å; F42-Y60 AromaticContact CG-CD1 3.8Å; F42-Y60 HydrophobicContact CG-CD1 3.8Å; F42-Y60 AromaticContact CG-CE1 3.76Å; F42-Y60 HydrophobicContact CG-CE1 3.76Å; F42-Y60 AromaticContact CZ-CD1 3.71Å; F42-Y60 HydrophobicContact CZ-CD1 3.71Å; F42-Y60 AromaticContact CZ-CG 3.68Å; F42-Y60 HydrophobicContact CZ-CG 3.68Å; L45-Y60 HydrophobicContact CB-CE1 4Å; L45-Y60 HydrophobicContact CD1-CD1 3.98Å; L45-Y60 HydrophobicContact CD1-CE1 4.24Å; W46-Y60 WeakPolarHBondContact CB-OH 3.28Å; W46-Y60 VanDerWaalsContact CE3-OH 3.26Å; I56-Y60 HydrophobicContact CG2-CD2 3.79Å; I56-Y60 HydrophobicContact CG2-CE1 4.33Å; I56-Y60 HydrophobicContact CG2-CE2 3.35Å; I56-Y60 HydrophobicContact CG2-CG 4.45Å; I56-Y60 PolarHBondContact O-N 2.84Å; P57-Y60 PolarHBondContact O-N 3.5Å; I58-Y60 VanDerWaalsContact C-N 3.33Å; I58-Y60 PolarHBondContact O-N 2.54Å; Y60-N62 VanDerWaalsContact C-N 3.3Å; Y60-N62 PolarHBondContact O-N 2.69Å; Y60-A63 PolarHBondContact O-N 3.39Å; Y60-C64 PolarHBondContact O-N 3.28Å; Y60-C64 PolarHBondContact O-SG 3.43Å; Y60-W101 AromaticContact CD2-CD2 3.83Å; Y60-W101 HydrophobicContact CD2-CD2 3.83Å; Y60-W101 AromaticContact CD2-CE2 3.55Å; Y60-W101 AromaticContact CD2-CE3 3.94Å; Y60-W101 HydrophobicContact CD2-CE3 3.94Å; Y60-W101 AromaticContact CD2-CH2 3.58Å; Y60-W101 HydrophobicContact CD2-CH2 3.58Å; Y60-W101 AromaticContact CD2-CZ2 3.45Å; Y60-W101 HydrophobicContact CD2-CZ2 3.45Å; Y60-W101 VanDerWaalsContact CD2-CZ2 3.45Å; Y60-W101 AromaticContact CD2-CZ3 3.83Å; Y60-W101 HydrophobicContact CD2-CZ3 3.83Å; Y60-W101 AromaticContact CE2-CH2 3.77Å; Y60-W101 HydrophobicContact CE2-CH2 3.77Å; Y60-W101 AromaticContact CE2-CZ2 3.85Å; Y60-W101 HydrophobicContact CE2-CZ2 3.85Å; Y60-W101 HydrophobicContact CE2-CZ3 4.29Å; Y60-W101 HydrophobicContact CG-CD2 4.41Å; Y60-W101 HydrophobicContact CG-CZ2 4.47Å; Y60-H554 HydrophobicContact CE2-CB 3.96Å; Y60-H554 AromaticContact CZ-ND1 3.54Å; Y60-H554 PolarHBondContact OH-ND1 3.49Å
61	G	93.9	Very high	87.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-55.8	-46	174.2	0	0	0	0	0	111.7	P57 I58 A63 C64 H65	P57-G61 PolarHBondContact O-N 3.12Å; I58-G61 PolarHBondContact O-N 3.1Å; G61-A63 PolarHBondContact O-N 3.19Å; G61-C64 PolarHBondContact O-N 3.21Å; G61-H65 WeakPolarHBondContact O-CB 3.41Å; G61-H65 PolarHBondContact O-N 2.76Å
62	N	93.6	Very high	88	Confident	84 Å²	84	47.5 Å²	47.5	45%	0.449	23%	0.234	S	C	.	.	H	α-helix	trans	-64.2	-39	177.1	-74.3	-33.3	0	0	0	113.3	I58 Q59 Y60 H65 K66	I58-N62 WeakPolarHBondContact O-CB 3.36Å; I58-N62 VanDerWaalsContact O-CG 3.28Å; I58-N62 PolarHBondContact O-N 2.91Å; I58-N62 PolarHBondContact O-ND2 3.18Å; I58-N62 VanDerWaalsContact O-ND2 3.16Å; Q59-N62 PolarHBondContact O-N 3.38Å; Y60-N62 VanDerWaalsContact C-N 3.3Å; Y60-N62 PolarHBondContact O-N 2.69Å; N62-H65 PolarHBondContact O-N 3.37Å; N62-K66 VanDerWaalsContact O-CG 3.3Å; N62-K66 WeakPolarHBondContact O-CG 2.97Å; N62-K66 PolarHBondContact O-N 2.94Å
63	A	93.5	Very high	87.5	Confident	3 Å²	3	53.3 Å²	53.3	3%	0.025	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-47.5	176.4	0	0	0	0	0	111.3	L38 F42 L45 Q59 Y60 G61 H65 K66 I67	L38-A63 HydrophobicContact CD2-CB 4.23Å; F42-A63 HydrophobicContact CD2-CB 4.41Å; F42-A63 HydrophobicContact CE2-CB 3.72Å; L45-A63 HydrophobicContact CD1-CB 4.4Å; Q59-A63 WeakPolarHBondContact O-CB 3.16Å; Q59-A63 PolarHBondContact O-N 2.92Å; Y60-A63 PolarHBondContact O-N 3.39Å; G61-A63 PolarHBondContact O-N 3.19Å; A63-H65 VanDerWaalsContact C-N 3.35Å; A63-H65 PolarHBondContact O-N 2.82Å; A63-K66 PolarHBondContact O-N 3.46Å; A63-I67 PolarHBondContact O-N 3.14Å
64	C	93.6	Very high	86.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-42.6	174.8	-68.5	0	0	0	0	111.6	F42 Y60 G61 K66 I67 A68 I94 R98	F42-C64 VanDerWaalsContact CZ-SG 3.6Å; Y60-C64 PolarHBondContact O-N 3.28Å; Y60-C64 PolarHBondContact O-SG 3.43Å; G61-C64 PolarHBondContact O-N 3.21Å; C64-K66 PolarHBondContact O-N 2.78Å; C64-I67 PolarHBondContact O-N 3.12Å; C64-A68 WeakPolarHBondContact O-CB 3.29Å; C64-A68 PolarHBondContact O-N 2.98Å; C64-I94 HydrophobicContact CB-CG2 3.86Å; C64-I94 WeakPolarHBondContact O-CG2 3.06Å; C64-R98 HydrophobicContact CB-CB 3.7Å; C64-R98 HydrophobicContact CB-CG 4.26Å
65	H	91	Very high	84.8	Confident	86 Å²	86	56.2 Å²	56.2	40%	0.398	26%	0.258	S	S	.	.	H	α-helix	trans	-58.5	-48.3	176.7	-178	88.8	0	0	0	112.3	G61 N62 A63 I67 A68 H69 R98	G61-H65 WeakPolarHBondContact O-CB 3.41Å; G61-H65 PolarHBondContact O-N 2.76Å; N62-H65 PolarHBondContact O-N 3.37Å; A63-H65 VanDerWaalsContact C-N 3.35Å; A63-H65 PolarHBondContact O-N 2.82Å; H65-I67 VanDerWaalsContact C-N 3.28Å; H65-I67 PolarHBondContact O-N 3.35Å; H65-A68 PolarHBondContact O-N 3.21Å; H65-H69 WeakPolarHBondContact O-CB 3.45Å; H65-H69 PolarHBondContact O-N 3.41Å; H65-R98 HydrophobicContact CB-CG 4.32Å; H65-R98 PolarHBondContact ND1-NH1 3.05Å
66	K	90.2	Very high	83.4	Confident	126 Å²	126	53.1 Å²	53.1	55%	0.548	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-39.7	179.6	-74.9	171.1	-176.2	174.6	0	112	N62 A63 C64 R70	N62-K66 VanDerWaalsContact O-CG 3.3Å; N62-K66 WeakPolarHBondContact O-CG 2.97Å; N62-K66 PolarHBondContact O-N 2.94Å; A63-K66 PolarHBondContact O-N 3.46Å; C64-K66 PolarHBondContact O-N 2.78Å; K66-R70 WeakPolarHBondContact O-CG 3.46Å; K66-R70 PolarHBondContact O-N 3.47Å
67	I	87.9	Confident	81.7	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.082	28%	0.275	C	S	.	.	H	α-helix	trans	-78.7	-40.7	-177.9	-73.7	178.8	0	0	0	111.6	S37 L38 A63 C64 H65 H69 R70 L71 I94	S37-I67 WeakPolarHBondContact OG-CD1 3.17Å; L38-I67 HydrophobicContact CB-CD1 4.43Å; L38-I67 HydrophobicContact CD1-CB 4.38Å; L38-I67 HydrophobicContact CD1-CD1 4.29Å; L38-I67 HydrophobicContact CD1-CG2 4.07Å; L38-I67 HydrophobicContact CD2-CB 4.47Å; L38-I67 HydrophobicContact CD2-CD1 3.51Å; L38-I67 HydrophobicContact CD2-CG1 4.37Å; L38-I67 HydrophobicContact CG-CB 4.39Å; L38-I67 HydrophobicContact CG-CD1 3.41Å; L38-I67 VanDerWaalsContact CG-CD1 3.41Å; L38-I67 HydrophobicContact CG-CG1 4.41Å; L38-I67 HydrophobicContact CG-CG2 4.33Å; A63-I67 PolarHBondContact O-N 3.14Å; C64-I67 PolarHBondContact O-N 3.12Å; H65-I67 VanDerWaalsContact C-N 3.28Å; H65-I67 PolarHBondContact O-N 3.35Å; I67-H69 PolarHBondContact O-N 3.08Å; I67-R70 PolarHBondContact O-N 2.83Å; I67-L71 PolarHBondContact O-N 3.39Å; I67-L71 VanDerWaalsContact O-N 3.08Å; I67-I94 HydrophobicContact CG2-CD1 4.11Å
68	A	85.2	Confident	79.7	Confident	12 Å²	12	61.8 Å²	61.8	10%	0.099	29%	0.285	C	S	.	.	H	α-helix	trans	-56.5	-36.3	171.7	0	0	0	0	0	112.5	C64 H65 I94 N95	C64-A68 WeakPolarHBondContact O-CB 3.29Å; C64-A68 PolarHBondContact O-N 2.98Å; H65-A68 PolarHBondContact O-N 3.21Å; A68-I94 HydrophobicContact CB-CG2 4Å; A68-N95 WeakPolarHBondContact CB-OD1 3.31Å
69	H	83.1	Confident	77.8	Confident	116 Å²	116	62.8 Å²	62.8	54%	0.537	30%	0.298	S	S	.	.	H	α-helix	trans	-75.9	-22.9	177.6	-159.6	-64.9	0	0	0	113.7	H65 I67	H65-H69 WeakPolarHBondContact O-CB 3.45Å; H65-H69 PolarHBondContact O-N 3.41Å; I67-H69 PolarHBondContact O-N 3.08Å
70	R	80.8	Confident	75.9	Confident	168 Å²	168	65.1 Å²	65.1	63%	0.634	31%	0.309	S	S	*	.	H	α-helix	trans	-82.5	-26.4	175.6	-74	176.2	-177.7	-176.1	-0.5	112.6	K66 I67	K66-R70 WeakPolarHBondContact O-CG 3.46Å; K66-R70 PolarHBondContact O-N 3.47Å; I67-R70 PolarHBondContact O-N 2.83Å
71	L	78.5	Confident	73.7	Confident	4 Å²	4	72.2 Å²	72.2	2%	0.021	34%	0.336	C	S	.	.	S	Bend	trans	-62.1	133.4	177.2	-75.6	170.1	0	0	0	110.8	M32 F33 I67 R73 V87 I90 I94	M32-L71 WeakPolarHBondContact O-CD2 3.37Å; F33-L71 WeakPolarHBondContact O-CD2 3.42Å; I67-L71 PolarHBondContact O-N 3.39Å; I67-L71 VanDerWaalsContact O-N 3.08Å; L71-R73 PolarHBondContact O-N 3.34Å; L71-R73 VanDerWaalsContact O-N 3.08Å; L71-V87 HydrophobicContact CD2-CG1 4.41Å; L71-I90 HydrophobicContact CD1-CG2 4.23Å; L71-I94 HydrophobicContact CD1-CD1 3.84Å
72	P	69.7	Low	71.5	Confident	32 Å²	32	82.2 Å²	82.2	21%	0.208	38%	0.379	C	S	.	.			trans	-72.7	113.7	-170.6	-8.3	21	0	0	0	111.6	F33 M74 F75	F33-P72 HydrophobicContact CD1-CG 4.3Å; F33-P72 HydrophobicContact CE1-CG 3.69Å; F33-P72 HydrophobicContact CZ-CG 4.29Å; P72-M74 PolarHBondContact O-N 2.92Å; P72-F75 HydrophobicContact CB-CD2 3.68Å; P72-F75 HydrophobicContact CB-CE2 4.11Å; P72-F75 HydrophobicContact CG-CD2 3.83Å; P72-F75 HydrophobicContact CG-CE2 4.13Å; P72-F75 PolarHBondContact O-N 3.31Å
73	R	67.8	Low	69.2	Low	150 Å²	150	81.2 Å²	81.2	57%	0.566	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-17.7	179.1	-66.3	-176.9	176.3	179	-3.4	114.5	L71 T76	L71-R73 PolarHBondContact O-N 3.34Å; L71-R73 VanDerWaalsContact O-N 3.08Å; R73-T76 PolarHBondContact O-OG1 3.03Å
74	M	57.2	Low	67.1	Low	126 Å²	126	84 Å²	84	62%	0.621	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-32.8	176.5	-60.9	-166.1	-53	0	0	112.3	P72	P72-M74 PolarHBondContact O-N 2.92Å
75	F	58.2	Low	65.3	Low	26 Å²	26	86.2 Å²	86.2	11%	0.114	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-80.1	-17.7	-177.9	-68.6	-66.5	0	0	0	113.2	V22 F33 P72 K77 M78 V87	V22-F75 HydrophobicContact CG1-CE1 4.31Å; F33-F75 HydrophobicContact CE1-CD2 4.27Å; F33-F75 AromaticContact CE1-CE2 4Å; F33-F75 HydrophobicContact CE1-CE2 4Å; P72-F75 HydrophobicContact CB-CD2 3.68Å; P72-F75 HydrophobicContact CB-CE2 4.11Å; P72-F75 HydrophobicContact CG-CD2 3.83Å; P72-F75 HydrophobicContact CG-CE2 4.13Å; P72-F75 PolarHBondContact O-N 3.31Å; F75-K77 PolarHBondContact O-N 2.99Å; F75-K77 VanDerWaalsContact O-N 3.14Å; F75-M78 HydrophobicContact CD1-SD 3.8Å; F75-M78 HydrophobicContact CE1-SD 4.06Å; F75-M78 PolarHBondContact O-N 3.14Å; F75-M78 VanDerWaalsContact O-N 3.09Å; F75-V87 HydrophobicContact CB-CB 4.03Å; F75-V87 HydrophobicContact CB-CG1 4.03Å; F75-V87 HydrophobicContact CB-CG2 4.28Å
76	T	58.8	Low	64.4	Low	38 Å²	38	83.5 Å²	83.5	23%	0.233	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-65.3	-16.6	176.3	63.4	0	0	0	0	112.9	R73 R88 T91	R73-T76 PolarHBondContact O-OG1 3.03Å; T76-R88 VanDerWaalsContact O-CD 3.28Å; T76-R88 WeakPolarHBondContact O-CD 3.3Å; T76-R88 WeakPolarHBondContact O-CG 3.41Å; T76-T91 HydrophobicContact CG2-CG2 4.41Å
77	K	55.6	Low	63.5	Low	140 Å²	140	78 Å²	78	61%	0.609	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-98.6	-1.2	176.6	-62.6	-178.3	-177.6	175.2	0	114	F75	F75-K77 PolarHBondContact O-N 2.99Å; F75-K77 VanDerWaalsContact O-N 3.14Å
78	M	52.2	Low	62.8	Low	43 Å²	43	79.9 Å²	79.9	21%	0.212	39%	0.388	C	S	.	.	S	Bend	trans	-97.4	138	-175.8	-119.3	171.9	166	0	0	110.8	Q17 V22 F75	Q17-M78 HydrophobicContact CB-CE 4.45Å; Q17-M78 HydrophobicContact CG-CE 3.61Å; V22-M78 HydrophobicContact CG2-CE 4.33Å; F75-M78 HydrophobicContact CD1-SD 3.8Å; F75-M78 HydrophobicContact CE1-SD 4.06Å; F75-M78 PolarHBondContact O-N 3.14Å; F75-M78 VanDerWaalsContact O-N 3.09Å
79	S	53.6	Low	62.5	Low	89 Å²	89	80.1 Å²	80.1	62%	0.622	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-65.1	139.1	173.3	-52.6	0	0	0	0	111.1	R81	S79-R81 PolarHBondContact O-N 3Å
80	H	53.5	Low	62.5	Low	107 Å²	107	74.6 Å²	74.6	50%	0.495	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-58	131.1	-179.1	173.8	38.1	0	0	0	111.9	L84 N86	H80-L84 PolarHBondContact CE1-O 3.45Å; H80-L84 PolarHBondContact ND1-O 2.95Å; H80-N86 HydrophobicContact CB-CB 4.48Å
81	R	49.1	Very low	62.6	Low	149 Å²	149	67.4 Å²	67.4	56%	0.562	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-101.1	132.2	168.1	-72	-169.7	178.9	-168.2	2.8	109.9	S79 G83 L84	S79-R81 PolarHBondContact O-N 3Å; R81-G83 PolarHBondContact O-N 3.37Å; R81-L84 HydrophobicContact CB-CD1 4.45Å; R81-L84 PolarHBondContact O-N 3.4Å; R81-L84 VanDerWaalsContact O-N 3.17Å
82	K	47.6	Very low	62.8	Low	211 Å²	211	68.9 Å²	68.9	92%	0.917	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	124.4	175.3	-74.7	-173.9	176.1	-176.1	0	110.6
83	G	46.2	Very low	63.6	Low	64 Å²	64	67.6 Å²	67.6	66%	0.66	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-6.8	178.1	0	0	0	0	0	116	R81	R81-G83 PolarHBondContact O-N 3.37Å
84	L	48.5	Very low	64.7	Low	62 Å²	62	60.4 Å²	60.4	33%	0.325	31%	0.308	S	S	.	.	S	Bend	trans	-111	144.7	174.3	-83.4	158.6	0	0	0	110.9	F26 H80 R81 N86	F26-L84 HydrophobicContact CD1-CD2 4.1Å; F26-L84 HydrophobicContact CD2-CD2 4.18Å; F26-L84 HydrophobicContact CE1-CD2 3.56Å; F26-L84 HydrophobicContact CE2-CD1 4.06Å; F26-L84 HydrophobicContact CE2-CD2 3.63Å; F26-L84 HydrophobicContact CG-CD2 4.41Å; F26-L84 HydrophobicContact CZ-CD1 4.22Å; F26-L84 HydrophobicContact CZ-CD2 3.32Å; F26-L84 HydrophobicContact CZ-CG 4.34Å; H80-L84 PolarHBondContact CE1-O 3.45Å; H80-L84 PolarHBondContact ND1-O 2.95Å; R81-L84 HydrophobicContact CB-CD1 4.45Å; R81-L84 PolarHBondContact O-N 3.4Å; R81-L84 VanDerWaalsContact O-N 3.17Å; L84-N86 PolarHBondContact O-N 3.02Å
85	P	56.4	Low	66.2	Low	45 Å²	45	56.6 Å²	56.6	29%	0.292	29%	0.29	S	S	.	.			trans	-54.4	134.4	175.2	-19.2	29	0	0	0	109.9	D34 V87 I90	D34-P85 HydrophobicContact CB-CB 4.36Å; D34-P85 HydrophobicContact CB-CG 4.21Å; P85-V87 PolarHBondContact O-N 2.98Å; P85-I90 HydrophobicContact CB-CD1 3.55Å
86	N	71.8	Confident	67.7	Low	30 Å²	30	56.6 Å²	56.6	16%	0.16	29%	0.291	C	S	.	.			trans	-74.3	81.8	173.4	-171.4	-14.5	0	0	0	108.7	H80 L84 R88 N89 I90	H80-N86 HydrophobicContact CB-CB 4.48Å; L84-N86 PolarHBondContact O-N 3.02Å; N86-R88 PolarHBondContact O-N 3.32Å; N86-R88 VanDerWaalsContact O-N 3.08Å; N86-R88 PolarHBondContact OD1-N 3.44Å; N86-N89 HydrophobicContact CB-CB 4.14Å; N86-N89 VanDerWaalsContact CG-CG 3.44Å; N86-N89 PolarHBondContact ND2-ND2 3.02Å; N86-N89 PolarHBondContact ND2-OD1 3.08Å; N86-N89 PolarHBondContact O-N 3.32Å; N86-N89 PolarHBondContact OD1-N 3.48Å; N86-I90 WeakPolarHBondContact O-CG1 3.49Å; N86-I90 PolarHBondContact O-N 3.24Å
87	V	71.2	Confident	69.4	Low	9 Å²	9	54.8 Å²	54.8	6%	0.055	28%	0.28	C	S	.	.	H	α-helix	trans	-51.8	-35.5	-174.6	178.9	0	0	0	0	111.5	L71 F75 P85 T91	L71-V87 HydrophobicContact CD2-CG1 4.41Å; F75-V87 HydrophobicContact CB-CB 4.03Å; F75-V87 HydrophobicContact CB-CG1 4.03Å; F75-V87 HydrophobicContact CB-CG2 4.28Å; P85-V87 PolarHBondContact O-N 2.98Å; V87-T91 VanDerWaalsContact O-CB 3.3Å; V87-T91 WeakPolarHBondContact O-CB 3.31Å; V87-T91 PolarHBondContact O-N 2.89Å; V87-T91 PolarHBondContact O-OG1 2.66Å
88	R	74.5	Confident	71.3	Confident	57 Å²	57	49.3 Å²	49.3	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-57.1	174.4	-174.8	-173.7	173.3	-177.7	-10.3	111.3	T76 N86 I90 T91 E92 F451 M453	T76-R88 VanDerWaalsContact O-CD 3.28Å; T76-R88 WeakPolarHBondContact O-CD 3.3Å; T76-R88 WeakPolarHBondContact O-CG 3.41Å; N86-R88 PolarHBondContact O-N 3.32Å; N86-R88 VanDerWaalsContact O-N 3.08Å; N86-R88 PolarHBondContact OD1-N 3.44Å; R88-I90 VanDerWaalsContact C-N 3.26Å; R88-I90 PolarHBondContact O-N 2.87Å; R88-T91 PolarHBondContact O-N 2.96Å; R88-T91 VanDerWaalsContact O-N 3.16Å; R88-E92 VanDerWaalsContact CG-OE1 3.23Å; R88-E92 WeakPolarHBondContact CG-OE1 3.5Å; R88-E92 IonicContact CZ-OE1 3.93Å; R88-E92 IonicContact NE-OE1 2.86Å; R88-E92 PolarHBondContact NE-OE1 2.81Å; R88-E92 IonicContact NH2-OE1 3.55Å; R88-E92 WeakPolarHBondContact O-CG 3.47Å; R88-E92 PolarHBondContact O-N 2.98Å; R88-F451 PolarHBondContact NH2-O 3.33Å; R88-M453 PolarHBondContact NH1-O 3.32Å; R88-M453 PolarHBondContact NH2-O 3.31Å
89	N	78.8	Confident	73.3	Confident	16 Å²	16	48.3 Å²	48.3	9%	0.086	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-36.3	-177.6	-65.8	10.7	0	0	0	111.7	N86 M93 L452 Y481 V544	N86-N89 HydrophobicContact CB-CB 4.14Å; N86-N89 VanDerWaalsContact CG-CG 3.44Å; N86-N89 PolarHBondContact ND2-ND2 3.02Å; N86-N89 PolarHBondContact ND2-OD1 3.08Å; N86-N89 PolarHBondContact O-N 3.32Å; N86-N89 PolarHBondContact OD1-N 3.48Å; N89-M93 WeakPolarHBondContact O-CB 3.4Å; N89-M93 PolarHBondContact O-N 3.45Å; N89-L452 HydrophobicContact CB-CD2 4.02Å; N89-L452 WeakPolarHBondContact OD1-CD2 3.32Å; N89-Y481 HydrophobicContact CB-CE1 4.25Å; N89-Y481 WeakPolarHBondContact ND2-CE1 3.46Å; N89-Y481 PolarHBondContact ND2-OH 2.89Å; N89-V544 HydrophobicContact CB-CG2 3.82Å
90	I	82.5	Confident	75.3	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-46.2	175.4	-65.1	170.5	0	0	0	110.6	L71 P85 N86 R88 E92 M93 I94 Q543 V544	L71-I90 HydrophobicContact CD1-CG2 4.23Å; P85-I90 HydrophobicContact CB-CD1 3.55Å; N86-I90 WeakPolarHBondContact O-CG1 3.49Å; N86-I90 PolarHBondContact O-N 3.24Å; R88-I90 VanDerWaalsContact C-N 3.26Å; R88-I90 PolarHBondContact O-N 2.87Å; I90-E92 VanDerWaalsContact C-N 3.32Å; I90-E92 PolarHBondContact O-N 2.78Å; I90-M93 PolarHBondContact O-N 2.87Å; I90-I94 HydrophobicContact CG2-CD1 3.69Å; I90-I94 HydrophobicContact CG2-CG1 4.35Å; I90-I94 WeakPolarHBondContact O-CB 3.37Å; I90-I94 VanDerWaalsContact O-CG1 3.27Å; I90-I94 WeakPolarHBondContact O-CG1 3.42Å; I90-I94 PolarHBondContact O-N 2.97Å; I90-Q543 HydrophobicContact CD1-CB 3.91Å; I90-Q543 HydrophobicContact CG1-CB 4.35Å; I90-V544 HydrophobicContact CG1-CG2 3.95Å
91	T	83.4	Confident	77.4	Confident	17 Å²	17	39 Å²	39	10%	0.104	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-44.4	177.5	-57	0	0	0	0	111.1	T76 V87 R88 I94 N95	T76-T91 HydrophobicContact CG2-CG2 4.41Å; V87-T91 VanDerWaalsContact O-CB 3.3Å; V87-T91 WeakPolarHBondContact O-CB 3.31Å; V87-T91 PolarHBondContact O-N 2.89Å; V87-T91 PolarHBondContact O-OG1 2.66Å; R88-T91 PolarHBondContact O-N 2.96Å; R88-T91 VanDerWaalsContact O-N 3.16Å; T91-I94 PolarHBondContact O-N 3.39Å; T91-N95 WeakPolarHBondContact O-CB 3.11Å; T91-N95 VanDerWaalsContact O-CG 3.31Å; T91-N95 PolarHBondContact O-N 3.21Å; T91-N95 PolarHBondContact O-ND2 3.39Å
92	E	81.3	Confident	79.6	Confident	34 Å²	34	33.4 Å²	33.4	16%	0.159	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-41.9	178.9	-70.6	177.2	-159.6	0	0	111.6	R88 I90 N95 L96 F451 L452	R88-E92 VanDerWaalsContact CG-OE1 3.23Å; R88-E92 WeakPolarHBondContact CG-OE1 3.5Å; R88-E92 IonicContact CZ-OE1 3.93Å; R88-E92 IonicContact NE-OE1 2.86Å; R88-E92 PolarHBondContact NE-OE1 2.81Å; R88-E92 IonicContact NH2-OE1 3.55Å; R88-E92 WeakPolarHBondContact O-CG 3.47Å; R88-E92 PolarHBondContact O-N 2.98Å; I90-E92 VanDerWaalsContact C-N 3.32Å; I90-E92 PolarHBondContact O-N 2.78Å; E92-N95 PolarHBondContact O-N 2.95Å; E92-L96 WeakPolarHBondContact O-CB 3.42Å; E92-L96 PolarHBondContact O-N 3.31Å; E92-F451 VanDerWaalsContact OE1-O 3.14Å; E92-F451 VanDerWaalsContact OE2-O 3.05Å; E92-L452 HydrophobicContact CB-CD2 4.23Å; E92-L452 HydrophobicContact CB-CG 4.4Å; E92-L452 WeakPolarHBondContact OE2-CA 3.42Å; E92-L452 WeakPolarHBondContact OE2-CD2 3.35Å; E92-L452 WeakPolarHBondContact OE2-CG 3.34Å; E92-L452 PolarHBondContact OE2-N 3.11Å
93	M	88.2	Confident	82	Confident	5 Å²	5	23.3 Å²	23.3	3%	0.025	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-46.4	174	173.5	55.8	-151.5	0	0	112.6	N89 I90 N95 L96 E97 I484 F488 V544 H547 T548	N89-M93 WeakPolarHBondContact O-CB 3.4Å; N89-M93 PolarHBondContact O-N 3.45Å; I90-M93 PolarHBondContact O-N 2.87Å; M93-N95 VanDerWaalsContact C-N 3.29Å; M93-N95 PolarHBondContact O-N 3.4Å; M93-L96 WeakPolarHBondContact O-CB 3.48Å; M93-L96 PolarHBondContact O-N 3.41Å; M93-E97 HydrophobicContact CE-CB 4.31Å; M93-E97 WeakPolarHBondContact O-CB 3.42Å; M93-E97 PolarHBondContact O-N 3.14Å; M93-I484 HydrophobicContact SD-CG2 3.95Å; M93-F488 HydrophobicContact CE-CE2 3.41Å; M93-F488 VanDerWaalsContact CE-CE2 3.41Å; M93-F488 HydrophobicContact CE-CZ 3.27Å; M93-F488 HydrophobicContact SD-CE2 3.48Å; M93-F488 WeakPolarHBondContact SD-CE2 3.35Å; M93-F488 HydrophobicContact SD-CZ 3.9Å; M93-V544 HydrophobicContact CB-CG1 3.9Å; M93-V544 HydrophobicContact CG-CG1 3.93Å; M93-H547 HydrophobicContact CE-CB 4.2Å; M93-H547 HydrophobicContact CG-CB 4.05Å; M93-T548 WeakPolarHBondContact CE-OG1 3.5Å; M93-T548 PolarHBondContact SD-OG1 2.91Å
94	I	90.6	Very high	84.3	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.2	-37.1	177.4	-67.5	169.6	0	0	0	110.7	L38 C64 I67 A68 L71 I90 T91 E97 R98	L38-I94 HydrophobicContact CD1-CD1 4.06Å; L38-I94 HydrophobicContact CD1-CG1 4.23Å; C64-I94 HydrophobicContact CB-CG2 3.86Å; C64-I94 WeakPolarHBondContact O-CG2 3.06Å; I67-I94 HydrophobicContact CG2-CD1 4.11Å; A68-I94 HydrophobicContact CB-CG2 4Å; L71-I94 HydrophobicContact CD1-CD1 3.84Å; I90-I94 HydrophobicContact CG2-CD1 3.69Å; I90-I94 HydrophobicContact CG2-CG1 4.35Å; I90-I94 WeakPolarHBondContact O-CB 3.37Å; I90-I94 VanDerWaalsContact O-CG1 3.27Å; I90-I94 WeakPolarHBondContact O-CG1 3.42Å; I90-I94 PolarHBondContact O-N 2.97Å; T91-I94 PolarHBondContact O-N 3.39Å; I94-E97 PolarHBondContact O-N 2.89Å; I94-R98 VanDerWaalsContact O-CB 3.27Å; I94-R98 WeakPolarHBondContact O-CB 3.44Å; I94-R98 PolarHBondContact O-N 3.34Å
95	N	89.1	Confident	86.5	Confident	45 Å²	45	18 Å²	18	24%	0.241	9%	0.094	C	C	.	.	H	α-helix	trans	-67.6	-40	174.5	-77.6	-32.7	0	0	0	112.2	A68 T91 E92 M93 E97 R98 N99	A68-N95 WeakPolarHBondContact CB-OD1 3.31Å; T91-N95 WeakPolarHBondContact O-CB 3.11Å; T91-N95 VanDerWaalsContact O-CG 3.31Å; T91-N95 PolarHBondContact O-N 3.21Å; T91-N95 PolarHBondContact O-ND2 3.39Å; E92-N95 PolarHBondContact O-N 2.95Å; M93-N95 VanDerWaalsContact C-N 3.29Å; M93-N95 PolarHBondContact O-N 3.4Å; N95-E97 VanDerWaalsContact C-N 3.32Å; N95-R98 PolarHBondContact O-N 3.06Å; N95-N99 WeakPolarHBondContact O-CB 3.47Å; N95-N99 PolarHBondContact O-N 2.91Å; N95-N99 PolarHBondContact O-ND2 2.89Å; N95-N99 PolarHBondContact O-OD1 2.92Å
96	L	89.5	Confident	88.4	Confident	27 Å²	27	18.3 Å²	18.3	14%	0.141	10%	0.096	C	C	.	.	H	α-helix	trans	-62.2	-43	175.4	-173.2	63.6	0	0	0	110.9	E92 M93 T100 Y485 F488	E92-L96 WeakPolarHBondContact O-CB 3.42Å; E92-L96 PolarHBondContact O-N 3.31Å; M93-L96 WeakPolarHBondContact O-CB 3.48Å; M93-L96 PolarHBondContact O-N 3.41Å; L96-T100 WeakPolarHBondContact O-CB 3.22Å; L96-T100 PolarHBondContact O-N 2.94Å; L96-T100 PolarHBondContact O-OG1 2.92Å; L96-Y485 HydrophobicContact CD2-CD1 4.1Å; L96-Y485 HydrophobicContact CD2-CE1 4.13Å; L96-F488 HydrophobicContact CD1-CB 4.27Å; L96-F488 HydrophobicContact CD1-CG 4.36Å; L96-F488 HydrophobicContact CD2-CB 3.78Å; L96-F488 HydrophobicContact CD2-CD1 4.17Å; L96-F488 HydrophobicContact CD2-CD2 3.22Å; L96-F488 HydrophobicContact CD2-CE2 3.81Å; L96-F488 HydrophobicContact CD2-CG 3.43Å; L96-F488 VanDerWaalsContact CD2-CG 3.43Å; L96-F488 HydrophobicContact CD2-CZ 4.47Å; L96-F488 HydrophobicContact CG-CB 3.99Å; L96-F488 HydrophobicContact CG-CD1 3.81Å; L96-F488 HydrophobicContact CG-CD2 3.81Å; L96-F488 HydrophobicContact CG-CE1 4.22Å; L96-F488 HydrophobicContact CG-CE2 4.24Å; L96-F488 HydrophobicContact CG-CG 3.57Å; L96-F488 HydrophobicContact CG-CZ 4.42Å
97	E	94.8	Very high	89.5	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.8	-49.1	173.6	173.9	169.1	177.9	0	0	112.4	F42 M93 I94 N95 N99 T100 W101 F488 R550 F551	F42-E97 WeakPolarHBondContact CE1-OE1 3.31Å; M93-E97 HydrophobicContact CE-CB 4.31Å; M93-E97 WeakPolarHBondContact O-CB 3.42Å; M93-E97 PolarHBondContact O-N 3.14Å; I94-E97 PolarHBondContact O-N 2.89Å; N95-E97 VanDerWaalsContact C-N 3.32Å; E97-N99 VanDerWaalsContact C-N 3.31Å; E97-N99 PolarHBondContact O-N 3.31Å; E97-T100 PolarHBondContact O-N 3.39Å; E97-T100 VanDerWaalsContact O-N 3.16Å; E97-W101 VanDerWaalsContact CG-CD1 3.44Å; E97-W101 VanDerWaalsContact O-CD1 3.3Å; E97-W101 PolarHBondContact O-N 2.9Å; E97-W101 PolarHBondContact OE1-NE1 2.88Å; E97-F488 HydrophobicContact CB-CE1 4.23Å; E97-F488 HydrophobicContact CB-CZ 4.18Å; E97-R550 IonicContact OE1-CZ 2.71Å; E97-R550 VanDerWaalsContact OE1-CZ 3.29Å; E97-R550 IonicContact OE1-NH1 3.79Å; E97-R550 IonicContact OE1-NH2 3.35Å; E97-R550 PolarHBondContact OE1-NH2 2.99Å; E97-R550 IonicContact OE2-CZ 3.61Å; E97-R550 IonicContact OE2-NE 2.9Å; E97-R550 IonicContact OE2-NH2 3Å; E97-R550 PolarHBondContact OE2-NH2 2.97Å; E97-F551 HydrophobicContact CB-CD2 4.46Å; E97-F551 HydrophobicContact CG-CB 4.27Å; E97-F551 HydrophobicContact CG-CD2 3.63Å; E97-F551 HydrophobicContact CG-CE2 4.34Å; E97-F551 HydrophobicContact CG-CG 4.18Å
98	R	94.8	Very high	90.5	Very high	25 Å²	25	16.7 Å²	16.7	9%	0.094	9%	0.087	C	C	.	.	H	α-helix	trans	-52.6	-51.3	175.8	179.6	-166.4	72.6	165.3	15.8	110.9	C64 H65 I94 N95 T100 W101 N102 E163	C64-R98 HydrophobicContact CB-CB 3.7Å; C64-R98 HydrophobicContact CB-CG 4.26Å; H65-R98 HydrophobicContact CB-CG 4.32Å; H65-R98 PolarHBondContact ND1-NH1 3.05Å; I94-R98 VanDerWaalsContact O-CB 3.27Å; I94-R98 WeakPolarHBondContact O-CB 3.44Å; I94-R98 PolarHBondContact O-N 3.34Å; N95-R98 PolarHBondContact O-N 3.06Å; R98-T100 VanDerWaalsContact C-N 3.3Å; R98-T100 PolarHBondContact O-N 3.42Å; R98-W101 PolarHBondContact O-N 3.12Å; R98-N102 VanDerWaalsContact O-CG 3.25Å; R98-N102 PolarHBondContact O-N 3.45Å; R98-N102 PolarHBondContact O-OD1 3.02Å; R98-E163 IonicContact CZ-OE2 3.44Å; R98-E163 IonicContact NH1-OE2 3.89Å; R98-E163 IonicContact NH2-OE2 2.88Å; R98-E163 PolarHBondContact NH2-OE2 3.5Å
99	N	93.8	Very high	91.4	Very high	22 Å²	22	17.6 Å²	17.6	12%	0.118	10%	0.096	C	C	.	.	H	α-helix	trans	-63.1	-42.1	-178.6	-66.1	-13.2	0	0	0	110	N95 E97 N102 L103 W156 I160	N95-N99 WeakPolarHBondContact O-CB 3.47Å; N95-N99 PolarHBondContact O-N 2.91Å; N95-N99 PolarHBondContact O-ND2 2.89Å; N95-N99 PolarHBondContact O-OD1 2.92Å; E97-N99 VanDerWaalsContact C-N 3.31Å; E97-N99 PolarHBondContact O-N 3.31Å; N99-N102 WeakPolarHBondContact O-CB 3.21Å; N99-N102 PolarHBondContact O-N 3.12Å; N99-L103 PolarHBondContact O-N 3.37Å; N99-L103 VanDerWaalsContact O-N 3.11Å; N99-W156 HydrophobicContact CB-CZ2 4.28Å; N99-W156 PolarHBondContact O-NE1 3.39Å; N99-I160 HydrophobicContact CB-CD1 4.15Å; N99-I160 HydrophobicContact CB-CG1 4.34Å
100	T	96.3	Very high	92	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.2	-47.2	177.7	-54	0	0	0	0	111	L96 E97 R98 N102 L103 I104 F488 V491 Q492 F551	L96-T100 WeakPolarHBondContact O-CB 3.22Å; L96-T100 PolarHBondContact O-N 2.94Å; L96-T100 PolarHBondContact O-OG1 2.92Å; E97-T100 PolarHBondContact O-N 3.39Å; E97-T100 VanDerWaalsContact O-N 3.16Å; R98-T100 VanDerWaalsContact C-N 3.3Å; R98-T100 PolarHBondContact O-N 3.42Å; T100-N102 VanDerWaalsContact C-N 3.27Å; T100-N102 PolarHBondContact O-N 2.92Å; T100-L103 WeakPolarHBondContact O-CB 3.43Å; T100-L103 PolarHBondContact O-N 3.24Å; T100-I104 HydrophobicContact CG2-CD1 4.26Å; T100-I104 HydrophobicContact CG2-CG1 4.47Å; T100-I104 VanDerWaalsContact O-CG1 3.3Å; T100-I104 WeakPolarHBondContact O-CG1 3.37Å; T100-I104 PolarHBondContact O-N 2.98Å; T100-F488 HydrophobicContact CG2-CD1 4.25Å; T100-F488 VanDerWaalsContact OG1-CD1 3.29Å; T100-F488 WeakPolarHBondContact OG1-CD1 3.43Å; T100-V491 HydrophobicContact CG2-CG1 3.94Å; T100-Q492 HydrophobicContact CG2-CG 3.96Å; T100-Q492 PolarHBondContact OG1-NE2 2.85Å; T100-F551 HydrophobicContact CG2-CE2 4.21Å; T100-F551 HydrophobicContact CG2-CZ 3.7Å
101	W	97	Very high	92.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.4	-36.3	174.5	-77.5	121.4	0	0	0	113.5	F42 P57 Y60 E97 R98 I104 S105 F551 H554 F555 F558	F42-W101 AromaticContact CE1-NE1 3.78Å; P57-W101 HydrophobicContact CB-CE3 3.93Å; P57-W101 HydrophobicContact CB-CZ3 4.44Å; P57-W101 HydrophobicContact CG-CE3 4.37Å; P57-W101 HydrophobicContact CG-CZ3 4.39Å; Y60-W101 AromaticContact CD2-CD2 3.83Å; Y60-W101 HydrophobicContact CD2-CD2 3.83Å; Y60-W101 AromaticContact CD2-CE2 3.55Å; Y60-W101 AromaticContact CD2-CE3 3.94Å; Y60-W101 HydrophobicContact CD2-CE3 3.94Å; Y60-W101 AromaticContact CD2-CH2 3.58Å; Y60-W101 HydrophobicContact CD2-CH2 3.58Å; Y60-W101 AromaticContact CD2-CZ2 3.45Å; Y60-W101 HydrophobicContact CD2-CZ2 3.45Å; Y60-W101 VanDerWaalsContact CD2-CZ2 3.45Å; Y60-W101 AromaticContact CD2-CZ3 3.83Å; Y60-W101 HydrophobicContact CD2-CZ3 3.83Å; Y60-W101 AromaticContact CE2-CH2 3.77Å; Y60-W101 HydrophobicContact CE2-CH2 3.77Å; Y60-W101 AromaticContact CE2-CZ2 3.85Å; Y60-W101 HydrophobicContact CE2-CZ2 3.85Å; Y60-W101 HydrophobicContact CE2-CZ3 4.29Å; Y60-W101 HydrophobicContact CG-CD2 4.41Å; Y60-W101 HydrophobicContact CG-CZ2 4.47Å; E97-W101 VanDerWaalsContact CG-CD1 3.44Å; E97-W101 VanDerWaalsContact O-CD1 3.3Å; E97-W101 PolarHBondContact O-N 2.9Å; E97-W101 PolarHBondContact OE1-NE1 2.88Å; R98-W101 PolarHBondContact O-N 3.12Å; W101-I104 HydrophobicContact CD2-CD1 4.41Å; W101-I104 HydrophobicContact CE3-CB 4.21Å; W101-I104 HydrophobicContact CE3-CD1 3.74Å; W101-I104 HydrophobicContact CE3-CG1 4.46Å; W101-I104 HydrophobicContact CE3-CG2 4.26Å; W101-I104 HydrophobicContact CZ3-CD1 3.87Å; W101-I104 HydrophobicContact CZ3-CG2 4.27Å; W101-I104 PolarHBondContact O-N 3.47Å; W101-S105 WeakPolarHBondContact O-CB 3.06Å; W101-S105 PolarHBondContact O-N 3.18Å; W101-F551 HydrophobicContact CD2-CE2 4.3Å; W101-F551 AromaticContact CE2-CD2 3.74Å; W101-F551 AromaticContact CE2-CE2 3.74Å; W101-F551 AromaticContact CZ2-CD2 3.92Å; W101-F551 HydrophobicContact CZ2-CD2 3.92Å; W101-F551 AromaticContact CZ2-CE2 3.98Å; W101-F551 HydrophobicContact CZ2-CE2 3.98Å; W101-F551 AromaticContact NE1-CD2 3.46Å; W101-F551 AromaticContact NE1-CE2 3.76Å; W101-H554 HydrophobicContact CH2-CB 4.33Å; W101-H554 HydrophobicContact CZ2-CB 3.98Å; W101-F555 HydrophobicContact CH2-CB 4.32Å; W101-F558 HydrophobicContact CH2-CB 4.43Å; W101-F558 HydrophobicContact CZ3-CG 4.45Å
102	N	96	Very high	92.7	Very high	31 Å²	31	20.2 Å²	20.2	17%	0.166	11%	0.106	C	C	.	.	H	α-helix	trans	-61.7	-43.6	174.3	-68.2	-8	0	0	0	111.2	R98 N99 T100 S105 S106	R98-N102 VanDerWaalsContact O-CG 3.25Å; R98-N102 PolarHBondContact O-N 3.45Å; R98-N102 PolarHBondContact O-OD1 3.02Å; N99-N102 WeakPolarHBondContact O-CB 3.21Å; N99-N102 PolarHBondContact O-N 3.12Å; T100-N102 VanDerWaalsContact C-N 3.27Å; T100-N102 PolarHBondContact O-N 2.92Å; N102-S105 PolarHBondContact O-N 3.41Å; N102-S105 PolarHBondContact O-OG 2.85Å; N102-S106 PolarHBondContact O-N 3.39Å; N102-S106 PolarHBondContact O-OG 3.36Å
103	L	96.6	Very high	93	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.2	-48.9	174.1	-180	62.1	0	0	0	111.3	N99 T100 S105 S106 I107 L153 W156 Q492	N99-L103 PolarHBondContact O-N 3.37Å; N99-L103 VanDerWaalsContact O-N 3.11Å; T100-L103 WeakPolarHBondContact O-CB 3.43Å; T100-L103 PolarHBondContact O-N 3.24Å; L103-S105 VanDerWaalsContact C-N 3.26Å; L103-S105 PolarHBondContact O-N 3.05Å; L103-S106 PolarHBondContact O-N 3.16Å; L103-I107 HydrophobicContact CD1-CD1 3.68Å; L103-I107 HydrophobicContact CD1-CG1 4.1Å; L103-I107 HydrophobicContact CD2-CD1 4.38Å; L103-I107 HydrophobicContact CG-CD1 3.65Å; L103-I107 HydrophobicContact CG-CG1 4.43Å; L103-I107 VanDerWaalsContact O-CG1 3.31Å; L103-I107 WeakPolarHBondContact O-CG1 3.41Å; L103-I107 PolarHBondContact O-N 3.43Å; L103-L153 HydrophobicContact CD1-CD1 4.04Å; L103-L153 HydrophobicContact CD2-CD1 4.03Å; L103-W156 HydrophobicContact CB-CD2 3.87Å; L103-W156 HydrophobicContact CB-CG 3.89Å; L103-W156 HydrophobicContact CB-CZ2 4.31Å; L103-W156 HydrophobicContact CD1-CB 3.89Å; L103-W156 HydrophobicContact CD1-CD2 3.94Å; L103-W156 HydrophobicContact CD1-CE3 4.13Å; L103-W156 HydrophobicContact CD1-CG 3.82Å; L103-W156 HydrophobicContact CD2-CD2 4.11Å; L103-W156 HydrophobicContact CD2-CE3 3.98Å; L103-W156 HydrophobicContact CD2-CH2 4.26Å; L103-W156 HydrophobicContact CD2-CZ2 4.35Å; L103-W156 HydrophobicContact CD2-CZ3 4.06Å; L103-W156 HydrophobicContact CG-CD2 4.19Å; L103-W156 HydrophobicContact CG-CE3 4.45Å; L103-W156 HydrophobicContact CG-CG 4.35Å; L103-Q492 HydrophobicContact CD2-CB 4.13Å; L103-Q492 HydrophobicContact CD2-CG 4.09Å
104	I	96.1	Very high	92.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-56.1	-45.1	177.9	-59	-176.6	0	0	0	110.1	P57 T100 W101 I107 Y108 I495 F555 F558	P57-I104 HydrophobicContact CB-CB 4.44Å; P57-I104 HydrophobicContact CB-CG2 4.14Å; P57-I104 HydrophobicContact CG-CG2 3.96Å; T100-I104 HydrophobicContact CG2-CD1 4.26Å; T100-I104 HydrophobicContact CG2-CG1 4.47Å; T100-I104 VanDerWaalsContact O-CG1 3.3Å; T100-I104 WeakPolarHBondContact O-CG1 3.37Å; T100-I104 PolarHBondContact O-N 2.98Å; W101-I104 HydrophobicContact CD2-CD1 4.41Å; W101-I104 HydrophobicContact CE3-CB 4.21Å; W101-I104 HydrophobicContact CE3-CD1 3.74Å; W101-I104 HydrophobicContact CE3-CG1 4.46Å; W101-I104 HydrophobicContact CE3-CG2 4.26Å; W101-I104 HydrophobicContact CZ3-CD1 3.87Å; W101-I104 HydrophobicContact CZ3-CG2 4.27Å; W101-I104 PolarHBondContact O-N 3.47Å; I104-I107 PolarHBondContact O-N 3.48Å; I104-Y108 HydrophobicContact CG2-CD2 3.87Å; I104-Y108 HydrophobicContact CG2-CE2 4.28Å; I104-Y108 WeakPolarHBondContact O-CB 3.47Å; I104-Y108 WeakPolarHBondContact O-CD2 3.29Å; I104-Y108 PolarHBondContact O-N 3.46Å; I104-I495 HydrophobicContact CB-CD1 4Å; I104-I495 HydrophobicContact CD1-CD1 3.94Å; I104-I495 HydrophobicContact CG1-CD1 3.46Å; I104-I495 VanDerWaalsContact CG1-CD1 3.46Å; I104-I495 HydrophobicContact CG2-CD1 3.79Å; I104-F555 HydrophobicContact CD1-CD2 3.6Å; I104-F555 HydrophobicContact CD1-CE2 3.7Å; I104-F558 HydrophobicContact CG2-CD1 4.12Å; I104-F558 HydrophobicContact CG2-CE1 3.58Å; I104-F558 HydrophobicContact CG2-CZ 4.13Å
105	S	94.9	Very high	92.2	Very high	15 Å²	15	28.8 Å²	28.8	11%	0.105	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-46.5	-179.8	77.1	0	0	0	0	112.3	W101 N102 L103 L109	W101-S105 WeakPolarHBondContact O-CB 3.06Å; W101-S105 PolarHBondContact O-N 3.18Å; N102-S105 PolarHBondContact O-N 3.41Å; N102-S105 PolarHBondContact O-OG 2.85Å; L103-S105 VanDerWaalsContact C-N 3.26Å; L103-S105 PolarHBondContact O-N 3.05Å; S105-L109 WeakPolarHBondContact O-CB 3.45Å; S105-L109 PolarHBondContact O-N 3.3Å
106	S	95.5	Very high	91.5	Very high	50 Å²	50	30.8 Å²	30.8	35%	0.35	17%	0.165	S	C	.	.	H	α-helix	trans	-66.5	-42.1	-178.9	-59.3	0	0	0	0	111.8	N102 L103 D110	N102-S106 PolarHBondContact O-N 3.39Å; N102-S106 PolarHBondContact O-OG 3.36Å; L103-S106 PolarHBondContact O-N 3.16Å; S106-D110 PolarHBondContact O-N 3.37Å; S106-D110 VanDerWaalsContact O-N 3.15Å
107	I	94.9	Very high	90.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.7	-50.9	179	-68.1	168	0	0	0	110.8	L103 I104 L109 D110 R111 I152 I495 M496	L103-I107 HydrophobicContact CD1-CD1 3.68Å; L103-I107 HydrophobicContact CD1-CG1 4.1Å; L103-I107 HydrophobicContact CD2-CD1 4.38Å; L103-I107 HydrophobicContact CG-CD1 3.65Å; L103-I107 HydrophobicContact CG-CG1 4.43Å; L103-I107 VanDerWaalsContact O-CG1 3.31Å; L103-I107 WeakPolarHBondContact O-CG1 3.41Å; L103-I107 PolarHBondContact O-N 3.43Å; I104-I107 PolarHBondContact O-N 3.48Å; I107-L109 VanDerWaalsContact C-N 3.31Å; I107-L109 PolarHBondContact O-N 3.43Å; I107-D110 PolarHBondContact O-N 3.45Å; I107-R111 HydrophobicContact CG2-CG 4.32Å; I107-R111 WeakPolarHBondContact O-CG 3.34Å; I107-R111 PolarHBondContact O-N 2.98Å; I107-I152 HydrophobicContact CG1-CG2 4.06Å; I107-I495 HydrophobicContact CD1-CG2 3.75Å; I107-M496 HydrophobicContact CD1-CG 4.46Å; I107-M496 HydrophobicContact CD1-SD 3.3Å; I107-M496 WeakPolarHBondContact CD1-SD 3.49Å; I107-M496 HydrophobicContact CG1-SD 4.1Å
108	Y	92.8	Very high	88.8	Confident	5 Å²	5	40.7 Å²	40.7	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-70.6	-30.5	-176.7	-86.7	-89.3	0	0	0	112.2	I104 R111 F112 I495 Y500 F558 L559 A562 D563	I104-Y108 HydrophobicContact CG2-CD2 3.87Å; I104-Y108 HydrophobicContact CG2-CE2 4.28Å; I104-Y108 WeakPolarHBondContact O-CB 3.47Å; I104-Y108 WeakPolarHBondContact O-CD2 3.29Å; I104-Y108 PolarHBondContact O-N 3.46Å; Y108-R111 PolarHBondContact O-N 2.94Å; Y108-F112 HydrophobicContact CD1-CE1 4.31Å; Y108-F112 AromaticContact CD1-CE2 3.96Å; Y108-F112 HydrophobicContact CD1-CE2 3.96Å; Y108-F112 AromaticContact CD1-CZ 3.7Å; Y108-F112 HydrophobicContact CD1-CZ 3.7Å; Y108-F112 HydrophobicContact CG-CE2 4.33Å; Y108-F112 HydrophobicContact CG-CZ 4.5Å; Y108-F112 WeakPolarHBondContact O-CB 3.42Å; Y108-F112 WeakPolarHBondContact O-CD2 3.36Å; Y108-F112 VanDerWaalsContact O-CG 3.22Å; Y108-F112 WeakPolarHBondContact O-CG 3.45Å; Y108-F112 PolarHBondContact O-N 2.62Å; Y108-I495 HydrophobicContact CD2-CD1 4.29Å; Y108-I495 HydrophobicContact CE2-CD1 3.66Å; Y108-I495 HydrophobicContact CE2-CG1 3.88Å; Y108-Y500 PolarHBondContact OH-OH 3.26Å; Y108-Y500 VanDerWaalsContact OH-OH 3.13Å; Y108-F558 HydrophobicContact CD1-CE1 4.21Å; Y108-F558 AromaticContact CD1-CZ 3.95Å; Y108-F558 HydrophobicContact CD1-CZ 3.95Å; Y108-F558 AromaticContact CD2-CE1 3.65Å; Y108-F558 HydrophobicContact CD2-CE1 3.65Å; Y108-F558 AromaticContact CD2-CZ 3.86Å; Y108-F558 HydrophobicContact CD2-CZ 3.86Å; Y108-F558 HydrophobicContact CE1-CE1 4.18Å; Y108-F558 HydrophobicContact CE1-CZ 4.33Å; Y108-F558 AromaticContact CE2-CE1 3.62Å; Y108-F558 HydrophobicContact CE2-CE1 3.62Å; Y108-F558 HydrophobicContact CE2-CZ 4.24Å; Y108-F558 AromaticContact CG-CE1 3.93Å; Y108-F558 HydrophobicContact CG-CE1 3.93Å; Y108-F558 AromaticContact CG-CZ 3.68Å; Y108-F558 HydrophobicContact CG-CZ 3.68Å; Y108-F558 AromaticContact CZ-CE1 3.87Å; Y108-L559 WeakPolarHBondContact OH-CD2 3.35Å; Y108-A562 HydrophobicContact CD1-CB 4.2Å; Y108-A562 HydrophobicContact CE1-CB 3.53Å; Y108-D563 PolarHBondContact OH-OD2 3.17Å
109	L	92.5	Very high	86.7	Confident	76 Å²	76	42.9 Å²	42.9	40%	0.398	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-46.5	169.8	-172.1	147.7	0	0	0	111.1	S105 I107 E113	S105-L109 WeakPolarHBondContact O-CB 3.45Å; S105-L109 PolarHBondContact O-N 3.3Å; I107-L109 VanDerWaalsContact C-N 3.31Å; I107-L109 PolarHBondContact O-N 3.43Å; L109-E113 WeakPolarHBondContact CD2-OE1 3.4Å; L109-E113 WeakPolarHBondContact O-CB 3.37Å; L109-E113 WeakPolarHBondContact O-CG 3.39Å; L109-E113 PolarHBondContact O-N 2.96Å
110	D	92.4	Very high	84.6	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.102	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-42	174.8	-176.1	84.9	0	0	0	112.3	S106 I107 E113 S114 R148 I152	S106-D110 PolarHBondContact O-N 3.37Å; S106-D110 VanDerWaalsContact O-N 3.15Å; I107-D110 PolarHBondContact O-N 3.45Å; D110-E113 PolarHBondContact O-N 3.01Å; D110-S114 VanDerWaalsContact O-CB 3.25Å; D110-S114 WeakPolarHBondContact O-CB 3.46Å; D110-S114 PolarHBondContact O-N 2.78Å; D110-S114 PolarHBondContact O-OG 2.87Å; D110-S114 PolarHBondContact OD2-OG 2.81Å; D110-R148 IonicContact OD1-CZ 3.43Å; D110-R148 IonicContact OD1-NE 3.23Å; D110-R148 PolarHBondContact OD1-NE 3.06Å; D110-R148 IonicContact OD1-NH2 3.93Å; D110-R148 IonicContact OD2-CZ 2.7Å; D110-R148 IonicContact OD2-NE 3.78Å; D110-R148 IonicContact OD2-NH2 3.49Å; D110-R148 PolarHBondContact OD2-NH2 3.44Å; D110-R148 VanDerWaalsContact OD2-NH2 3.14Å; D110-I152 HydrophobicContact CB-CD1 3.61Å
111	R	92	Very high	82.2	Confident	11 Å²	11	52.4 Å²	52.4	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-48.7	180	-71.3	173.5	179.7	173.1	5.4	112.1	I107 Y108 E113 S114 E115 E149 I495 K498	I107-R111 HydrophobicContact CG2-CG 4.32Å; I107-R111 WeakPolarHBondContact O-CG 3.34Å; I107-R111 PolarHBondContact O-N 2.98Å; Y108-R111 PolarHBondContact O-N 2.94Å; R111-E113 VanDerWaalsContact C-N 3.34Å; R111-E113 PolarHBondContact O-N 2.97Å; R111-S114 PolarHBondContact O-N 3.22Å; R111-E115 WeakPolarHBondContact O-CG 3.27Å; R111-E115 PolarHBondContact O-N 2.96Å; R111-E149 WeakPolarHBondContact CG-OE1 3.26Å; R111-E149 IonicContact CZ-OE1 3.85Å; R111-E149 IonicContact CZ-OE2 3.88Å; R111-E149 IonicContact NE-OE1 3.95Å; R111-E149 PolarHBondContact NE-OE1 3.45Å; R111-E149 IonicContact NE-OE2 3.86Å; R111-E149 IonicContact NH2-OE1 3.25Å; R111-E149 PolarHBondContact NH2-OE1 3.19Å; R111-E149 IonicContact NH2-OE2 2.76Å; R111-E149 PolarHBondContact NH2-OE2 2.71Å; R111-I495 PolarHBondContact NH1-O 3.41Å; R111-I495 PolarHBondContact NH2-O 3.1Å; R111-K498 VanDerWaalsContact NH2-CE 3.29Å
112	F	88.1	Confident	79.5	Confident	60 Å²	60	62 Å²	62	26%	0.263	35%	0.348	S	S	.	.	H	α-helix	trans	-63.8	-39.4	178	-65.3	-46.1	0	0	0	111.9	L53 Y108 S116	L53-F112 HydrophobicContact CD2-CZ 3.98Å; L53-F112 HydrophobicContact CG-CZ 4.28Å; Y108-F112 HydrophobicContact CD1-CE1 4.31Å; Y108-F112 AromaticContact CD1-CE2 3.96Å; Y108-F112 HydrophobicContact CD1-CE2 3.96Å; Y108-F112 AromaticContact CD1-CZ 3.7Å; Y108-F112 HydrophobicContact CD1-CZ 3.7Å; Y108-F112 HydrophobicContact CG-CE2 4.33Å; Y108-F112 HydrophobicContact CG-CZ 4.5Å; Y108-F112 WeakPolarHBondContact O-CB 3.42Å; Y108-F112 WeakPolarHBondContact O-CD2 3.36Å; Y108-F112 VanDerWaalsContact O-CG 3.22Å; Y108-F112 WeakPolarHBondContact O-CG 3.45Å; Y108-F112 PolarHBondContact O-N 2.62Å; F112-S116 PolarHBondContact O-N 3.4Å
113	E	86.4	Confident	77.2	Confident	79 Å²	79	63.4 Å²	63.4	37%	0.369	37%	0.37	S	S	.	.	H	α-helix	trans	-65	-42.2	173.6	-77.6	-168.7	-164.6	0	0	112.1	L109 D110 R111 E115 S116 R117	L109-E113 WeakPolarHBondContact CD2-OE1 3.4Å; L109-E113 WeakPolarHBondContact O-CB 3.37Å; L109-E113 WeakPolarHBondContact O-CG 3.39Å; L109-E113 PolarHBondContact O-N 2.96Å; D110-E113 PolarHBondContact O-N 3.01Å; R111-E113 VanDerWaalsContact C-N 3.34Å; R111-E113 PolarHBondContact O-N 2.97Å; E113-E115 PolarHBondContact O-N 3.4Å; E113-S116 PolarHBondContact O-N 3.48Å; E113-S116 PolarHBondContact O-OG 2.96Å; E113-R117 WeakPolarHBondContact O-CG 3.36Å; E113-R117 PolarHBondContact O-N 3.43Å; E113-R117 IonicContact OE2-CZ 3.29Å; E113-R117 IonicContact OE2-NH2 3.92Å; E113-R117 PolarHBondContact OE2-NH2 3.34Å
114	S	84.7	Confident	74.9	Confident	14 Å²	14	69.7 Å²	69.7	10%	0.098	40%	0.404	C	S	.	.	H	α-helix	trans	-62.5	-44	-178.8	-63	0	0	0	0	111.8	D110 R111 S116 R117 T118 R148	D110-S114 VanDerWaalsContact O-CB 3.25Å; D110-S114 WeakPolarHBondContact O-CB 3.46Å; D110-S114 PolarHBondContact O-N 2.78Å; D110-S114 PolarHBondContact O-OG 2.87Å; D110-S114 PolarHBondContact OD2-OG 2.81Å; R111-S114 PolarHBondContact O-N 3.22Å; S114-S116 VanDerWaalsContact C-N 3.27Å; S114-S116 PolarHBondContact O-N 3.04Å; S114-R117 PolarHBondContact O-N 3.3Å; S114-R117 VanDerWaalsContact O-N 3.09Å; S114-T118 WeakPolarHBondContact O-CG2 3.38Å; S114-T118 PolarHBondContact O-N 3.12Å; S114-R148 PolarHBondContact OG-NH2 3.32Å
115	E	78.8	Confident	72.8	Confident	125 Å²	125	75.2 Å²	75.2	58%	0.584	43%	0.433	S	S	*	.	H	α-helix	trans	-56.6	-42.8	175.3	-74.9	172.7	-171.2	0	0	111.5	R111 E113 R117 T118	R111-E115 WeakPolarHBondContact O-CG 3.27Å; R111-E115 PolarHBondContact O-N 2.96Å; E113-E115 PolarHBondContact O-N 3.4Å; E115-R117 VanDerWaalsContact C-N 3.3Å; E115-R117 PolarHBondContact O-N 2.91Å; E115-T118 PolarHBondContact O-N 3.27Å; E115-T118 PolarHBondContact O-OG1 3.2Å
116	S	72.9	Confident	70.9	Confident	87 Å²	87	76.9 Å²	76.9	61%	0.608	44%	0.441	S	S	*	.	H	α-helix	trans	-64.2	-31.3	177.6	78.9	0	0	0	0	113.8	F112 E113 S114	F112-S116 PolarHBondContact O-N 3.4Å; E113-S116 PolarHBondContact O-N 3.48Å; E113-S116 PolarHBondContact O-OG 2.96Å; S114-S116 VanDerWaalsContact C-N 3.27Å; S114-S116 PolarHBondContact O-N 3.04Å
117	R	69.6	Low	68.9	Low	113 Å²	113	78.8 Å²	78.8	43%	0.426	45%	0.454	S	S	.	.	H	α-helix	trans	-78.8	-27.7	-177.8	-68.2	176.6	-167.5	-175.6	8.9	113.3	E113 S114 E115 G119 T120	E113-R117 WeakPolarHBondContact O-CG 3.36Å; E113-R117 PolarHBondContact O-N 3.43Å; E113-R117 IonicContact OE2-CZ 3.29Å; E113-R117 IonicContact OE2-NH2 3.92Å; E113-R117 PolarHBondContact OE2-NH2 3.34Å; S114-R117 PolarHBondContact O-N 3.3Å; S114-R117 VanDerWaalsContact O-N 3.09Å; E115-R117 VanDerWaalsContact C-N 3.3Å; E115-R117 PolarHBondContact O-N 2.91Å; R117-G119 PolarHBondContact O-N 3.29Å; R117-T120 PolarHBondContact O-N 3.25Å; R117-T120 PolarHBondContact O-OG1 3.13Å
118	T	59.3	Low	66.7	Low	123 Å²	123	83.6 Å²	83.6	76%	0.755	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-19.5	-178	59.3	0	0	0	0	114	S114 E115	S114-T118 WeakPolarHBondContact O-CG2 3.38Å; S114-T118 PolarHBondContact O-N 3.12Å; E115-T118 PolarHBondContact O-N 3.27Å; E115-T118 PolarHBondContact O-OG1 3.2Å
119	G	50.3	Low	64.7	Low	70 Å²	70	90 Å²	90	72%	0.722	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.6	176.9	0	0	0	0	0	117	R117	R117-G119 PolarHBondContact O-N 3.29Å
120	T	50	Low	63.3	Low	116 Å²	116	90.7 Å²	90.7	71%	0.712	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	-3.9	-165.7	36	0	0	0	0	118	R117	R117-T120 PolarHBondContact O-N 3.25Å; R117-T120 PolarHBondContact O-OG1 3.13Å
121	V	45.3	Very low	62.1	Low	106 Å²	106	91.9 Å²	91.9	64%	0.642	52%	0.517	S	S	*	.			trans	-122.2	82.5	-173.8	-168.1	0	0	0	0	112.4
122	E	40.3	Very low	61.5	Low	201 Å²	201	91.4 Å²	91.4	94%	0.939	52%	0.515	S	S	*	.			trans	-80.8	116.3	151.6	-73.1	-173.3	162.8	0	0	108.6
123	G	47.3	Very low	61.1	Low	62 Å²	62	88.7 Å²	88.7	64%	0.639	50%	0.503	S	S	*	.			trans	97.3	35.6	144.9	0	0	0	0	0	120.6	D125	G123-D125 VanDerWaalsContact C-N 3.31Å; G123-D125 PolarHBondContact O-N 2.93Å
124	N	48.8	Very low	61.1	Low	131 Å²	131	89.5 Å²	89.5	70%	0.701	50%	0.503	S	S	*	.			trans	-85.2	79.5	160.2	-83.3	-1.7	0	0	0	110.5	L126	N124-L126 PolarHBondContact O-N 3.2Å
125	D	52.5	Low	60.9	Low	117 Å²	117	90 Å²	90	63%	0.626	50%	0.504	S	S	*	.			trans	-62.4	114.4	172.3	-96.7	-19.2	0	0	0	110.4	G123 S127 N128	G123-D125 VanDerWaalsContact C-N 3.31Å; G123-D125 PolarHBondContact O-N 2.93Å; D125-S127 PolarHBondContact O-N 2.93Å; D125-N128 PolarHBondContact O-N 3.17Å
126	L	54.6	Low	61.1	Low	49 Å²	49	84.3 Å²	84.3	26%	0.257	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-11.5	173.4	-85.6	94.3	0	0	0	113.7	N124 N128 L139 L373	N124-L126 PolarHBondContact O-N 3.2Å; L126-N128 VanDerWaalsContact C-N 3.29Å; L126-N128 PolarHBondContact O-N 3.4Å; L126-L139 HydrophobicContact CG-CD1 4.46Å; L126-L373 HydrophobicContact CB-CD2 4.22Å; L126-L373 HydrophobicContact CD2-CD1 3.42Å; L126-L373 VanDerWaalsContact CD2-CD1 3.42Å; L126-L373 HydrophobicContact CD2-CD2 3.97Å; L126-L373 HydrophobicContact CD2-CG 4.35Å
127	S	54.4	Low	61.7	Low	91 Å²	91	81.2 Å²	81.2	64%	0.636	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-14.9	-175.8	60	0	0	0	0	113.8	D125	D125-S127 PolarHBondContact O-N 2.93Å
128	N	47.5	Very low	62.6	Low	100 Å²	100	82.1 Å²	82.1	54%	0.535	46%	0.457	S	S	.	.	S	Bend	trans	-109.8	120.2	-177	-74.2	-28.5	0	0	0	111.5	D125 L126 H131	D125-N128 PolarHBondContact O-N 3.17Å; L126-N128 VanDerWaalsContact C-N 3.29Å; L126-N128 PolarHBondContact O-N 3.4Å; N128-H131 PolarHBondContact O-CE1 3.4Å
129	F	52.1	Low	63.8	Low	141 Å²	141	77.7 Å²	77.7	62%	0.618	43%	0.429	S	S	*	.	S	Bend	trans	87.8	148.9	169.6	-56.5	-81.6	0	0	0	118.9	H131	F129-H131 VanDerWaalsContact C-N 3.27Å; F129-H131 PolarHBondContact O-N 3.36Å; F129-H131 PolarHBondContact O-ND1 2.99Å
130	N	61.7	Low	65.5	Low	90 Å²	90	74.9 Å²	74.9	48%	0.481	40%	0.397	S	S	.	.			trans	-66.2	65.6	-170.1	-72.5	-45.1	0	0	0	113.2	F272	N130-F272 HydrophobicContact CB-CD1 4.11Å; N130-F272 HydrophobicContact CB-CG 4.37Å; N130-F272 WeakPolarHBondContact O-CB 3.11Å; N130-F272 WeakPolarHBondContact O-CD2 3.37Å; N130-F272 VanDerWaalsContact O-CG 3.24Å; N130-F272 WeakPolarHBondContact O-CG 3.46Å
131	H	67.4	Low	67.5	Low	43 Å²	43	71.6 Å²	71.6	20%	0.199	37%	0.372	C	S	.	.			trans	-67.4	139.7	-178.7	-66.9	96.5	0	0	0	112.3	N128 F129 E135 I136	N128-H131 PolarHBondContact O-CE1 3.4Å; F129-H131 VanDerWaalsContact C-N 3.27Å; F129-H131 PolarHBondContact O-N 3.36Å; F129-H131 PolarHBondContact O-ND1 2.99Å; H131-E135 HydrophobicContact CB-CB 4.35Å; H131-I136 HydrophobicContact CB-CD1 4.4Å; H131-I136 HydrophobicContact CB-CG1 3.77Å
132	S	79.3	Confident	69.4	Low	1 Å²	1	70.6 Å²	70.6	1%	0.007	36%	0.36	C	S	.	.			trans	-72	161.3	167.9	71.3	0	0	0	0	111.3	R134 E135 I136 F267 H268	S132-R134 VanDerWaalsContact C-N 3.27Å; S132-R134 PolarHBondContact O-N 3.09Å; S132-E135 PolarHBondContact O-N 3.16Å; S132-I136 WeakPolarHBondContact O-CG1 3.32Å; S132-I136 PolarHBondContact O-N 3.34Å; S132-I136 VanDerWaalsContact O-N 3.09Å; S132-F267 WeakPolarHBondContact CB-O 3.17Å; S132-H268 PolarHBondContact OG-ND1 2.65Å
133	E	80.8	Confident	71.6	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.019	35%	0.348	C	S	.	.	H	α-helix	trans	-55.9	-43.4	-178.2	-136.6	179.5	-147	0	0	111.8	E135 I136 I137 P266 F267 L370 R379	E133-E135 VanDerWaalsContact C-N 3.31Å; E133-E135 PolarHBondContact O-N 3.25Å; E133-I136 PolarHBondContact O-N 3.21Å; E133-I137 VanDerWaalsContact O-CG1 3.28Å; E133-I137 WeakPolarHBondContact O-CG1 3.36Å; E133-I137 PolarHBondContact O-N 3.46Å; E133-P266 HydrophobicContact CB-CB 4.02Å; E133-P266 HydrophobicContact CG-CB 4.45Å; E133-P266 VanDerWaalsContact OE2-CA 3.32Å; E133-P266 WeakPolarHBondContact OE2-CA 3.41Å; E133-F267 HydrophobicContact CB-CB 4.34Å; E133-F267 VanDerWaalsContact CB-O 3.31Å; E133-F267 WeakPolarHBondContact CB-O 3.42Å; E133-F267 PolarHBondContact N-O 3.37Å; E133-F267 PolarHBondContact OE2-N 3.05Å; E133-L370 HydrophobicContact CB-CD2 4.44Å; E133-L370 HydrophobicContact CG-CD1 3.63Å; E133-L370 HydrophobicContact CG-CD2 3.5Å; E133-L370 HydrophobicContact CG-CG 4.17Å; E133-R379 VanDerWaalsContact CB-NH1 3.33Å; E133-R379 IonicContact OE1-CZ 2.74Å; E133-R379 IonicContact OE1-NE 4Å; E133-R379 PolarHBondContact OE1-NE 2.99Å; E133-R379 IonicContact OE1-NH1 2.66Å; E133-R379 IonicContact OE1-NH2 3.99Å; E133-R379 PolarHBondContact OE1-NH2 2.9Å; E133-R379 IonicContact OE2-CZ 3.75Å; E133-R379 IonicContact OE2-NH2 3.07Å; E133-R379 PolarHBondContact OE2-NH2 2.78Å
134	R	85.4	Confident	73.6	Confident	95 Å²	95	68.2 Å²	68.2	36%	0.358	33%	0.326	S	S	.	.	H	α-helix	trans	-59.1	-40.5	176.7	-169.6	-171.2	78.1	158.5	8.5	112.6	S132 I137 R138 P266 F267 H268 E303	S132-R134 VanDerWaalsContact C-N 3.27Å; S132-R134 PolarHBondContact O-N 3.09Å; R134-I137 PolarHBondContact O-N 3.44Å; R134-R138 WeakPolarHBondContact O-CB 3.43Å; R134-R138 PolarHBondContact O-N 3.46Å; R134-P266 HydrophobicContact CB-CB 4.41Å; R134-F267 PolarHBondContact N-O 2.9Å; R134-H268 HydrophobicContact CB-CB 3.78Å; R134-H268 HydrophobicContact CG-CB 4.47Å; R134-H268 VanDerWaalsContact CZ-CD2 3.44Å; R134-H268 PolarHBondContact NE-ND1 2.9Å; R134-H268 PolarHBondContact NH2-CE1 2.92Å; R134-H268 VanDerWaalsContact NH2-CE1 3.31Å; R134-H268 PolarHBondContact NH2-NE2 2.99Å; R134-E303 VanDerWaalsContact CD-OE1 3.25Å; R134-E303 WeakPolarHBondContact CD-OE1 3.5Å; R134-E303 IonicContact CZ-OE1 2.67Å; R134-E303 IonicContact NE-OE1 2.73Å; R134-E303 IonicContact NH1-OE1 2.8Å; R134-E303 PolarHBondContact NH1-OE1 2.6Å
135	E	81	Confident	75.6	Confident	24 Å²	24	65.6 Å²	65.6	11%	0.112	31%	0.312	C	S	.	.	H	α-helix	trans	-73.2	-36.6	-177.5	-163.3	58.8	-155.9	0	0	111.4	H131 S132 E133 I137 R138 L139	H131-E135 HydrophobicContact CB-CB 4.35Å; S132-E135 PolarHBondContact O-N 3.16Å; E133-E135 VanDerWaalsContact C-N 3.31Å; E133-E135 PolarHBondContact O-N 3.25Å; E135-I137 VanDerWaalsContact C-N 3.34Å; E135-R138 WeakPolarHBondContact O-CB 3.46Å; E135-R138 PolarHBondContact O-N 3.22Å; E135-R138 IonicContact OE1-CZ 2.79Å; E135-R138 IonicContact OE1-NH1 3.8Å; E135-R138 PolarHBondContact OE1-NH1 3.23Å; E135-R138 IonicContact OE2-NH1 3.45Å; E135-L139 WeakPolarHBondContact O-CG 3.38Å; E135-L139 PolarHBondContact O-N 3.17Å
136	I	81.5	Confident	77.4	Confident	6 Å²	6	63 Å²	63	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-45.3	172.7	-61.9	163.5	0	0	0	110.6	H131 S132 E133 R138 L139 L140 L370 L373 T376	H131-I136 HydrophobicContact CB-CD1 4.4Å; H131-I136 HydrophobicContact CB-CG1 3.77Å; S132-I136 WeakPolarHBondContact O-CG1 3.32Å; S132-I136 PolarHBondContact O-N 3.34Å; S132-I136 VanDerWaalsContact O-N 3.09Å; E133-I136 PolarHBondContact O-N 3.21Å; I136-R138 VanDerWaalsContact C-N 3.31Å; I136-R138 PolarHBondContact O-N 2.96Å; I136-L139 PolarHBondContact O-N 3.44Å; I136-L140 WeakPolarHBondContact O-CB 3.33Å; I136-L140 PolarHBondContact O-N 2.85Å; I136-L370 HydrophobicContact CB-CD2 3.94Å; I136-L370 HydrophobicContact CD1-CD2 4.15Å; I136-L370 HydrophobicContact CG2-CD2 3.76Å; I136-L373 HydrophobicContact CG2-CD1 3.33Å; I136-T376 HydrophobicContact CD1-CG2 4.29Å; I136-T376 WeakPolarHBondContact CD1-OG1 3.42Å
137	I	87.3	Confident	79.3	Confident	22 Å²	22	60.7 Å²	60.7	11%	0.113	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-43.5	176.8	-69.5	167.8	0	0	0	110.5	E133 R134 E135 L140 Y141 P266 V366 L370	E133-I137 VanDerWaalsContact O-CG1 3.28Å; E133-I137 WeakPolarHBondContact O-CG1 3.36Å; E133-I137 PolarHBondContact O-N 3.46Å; R134-I137 PolarHBondContact O-N 3.44Å; E135-I137 VanDerWaalsContact C-N 3.34Å; I137-L140 WeakPolarHBondContact O-CB 3.13Å; I137-L140 PolarHBondContact O-N 2.79Å; I137-Y141 HydrophobicContact CG2-CD2 3.65Å; I137-Y141 HydrophobicContact CG2-CE2 3.53Å; I137-Y141 VanDerWaalsContact O-CD2 3.25Å; I137-Y141 WeakPolarHBondContact O-CD2 3.41Å; I137-Y141 PolarHBondContact O-N 2.92Å; I137-P266 HydrophobicContact CD1-CB 3.6Å; I137-P266 HydrophobicContact CD1-CG 3.34Å; I137-V366 HydrophobicContact CD1-CG1 3.8Å; I137-V366 HydrophobicContact CG1-CG1 3.78Å; I137-L370 HydrophobicContact CD1-CD1 4.21Å; I137-L370 HydrophobicContact CG1-CD1 4.36Å; I137-L370 HydrophobicContact CG1-CD2 4.19Å; I137-L370 HydrophobicContact CG1-CG 4.44Å
138	R	87.4	Confident	81.2	Confident	133 Å²	133	57.6 Å²	57.6	50%	0.502	26%	0.258	S	S	.	.	H	α-helix	trans	-57.9	-51.3	176.2	-179	-168.4	167.3	-176.2	5.6	111.7	R134 E135 I136 L140 Y141 E142	R134-R138 WeakPolarHBondContact O-CB 3.43Å; R134-R138 PolarHBondContact O-N 3.46Å; E135-R138 WeakPolarHBondContact O-CB 3.46Å; E135-R138 PolarHBondContact O-N 3.22Å; E135-R138 IonicContact OE1-CZ 2.79Å; E135-R138 IonicContact OE1-NH1 3.8Å; E135-R138 PolarHBondContact OE1-NH1 3.23Å; E135-R138 IonicContact OE2-NH1 3.45Å; I136-R138 VanDerWaalsContact C-N 3.31Å; I136-R138 PolarHBondContact O-N 2.96Å; R138-L140 VanDerWaalsContact C-N 3.26Å; R138-L140 PolarHBondContact O-N 3.35Å; R138-Y141 PolarHBondContact O-N 2.99Å; R138-E142 IonicContact CZ-OE1 2.61Å; R138-E142 IonicContact NE-OE1 3.51Å; R138-E142 PolarHBondContact NE-OE1 2.87Å; R138-E142 IonicContact NH2-OE1 2.75Å; R138-E142 PolarHBondContact NH2-OE1 2.96Å; R138-E142 WeakPolarHBondContact O-CG 3.49Å; R138-E142 PolarHBondContact O-N 3.41Å
139	L	83.6	Confident	83.4	Confident	29 Å²	29	53.7 Å²	53.7	15%	0.152	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-35.2	178	-68.9	172.6	0	0	0	112.2	L126 E135 I136 E142 R143	L126-L139 HydrophobicContact CG-CD1 4.46Å; E135-L139 WeakPolarHBondContact O-CG 3.38Å; E135-L139 PolarHBondContact O-N 3.17Å; I136-L139 PolarHBondContact O-N 3.44Å; L139-E142 PolarHBondContact O-N 2.87Å; L139-R143 PolarHBondContact O-N 3.15Å; L139-R143 VanDerWaalsContact O-N 3.16Å
140	L	87.3	Confident	85.5	Confident	12 Å²	12	47 Å²	47	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-50.3	173.9	176.2	67.2	0	0	0	111	I136 I137 R138 E142 R143 D144 L147 V366 S369	I136-L140 WeakPolarHBondContact O-CB 3.33Å; I136-L140 PolarHBondContact O-N 2.85Å; I137-L140 WeakPolarHBondContact O-CB 3.13Å; I137-L140 PolarHBondContact O-N 2.79Å; R138-L140 VanDerWaalsContact C-N 3.26Å; R138-L140 PolarHBondContact O-N 3.35Å; L140-E142 VanDerWaalsContact C-N 3.34Å; L140-E142 PolarHBondContact O-N 2.91Å; L140-R143 PolarHBondContact O-N 3.28Å; L140-D144 WeakPolarHBondContact O-CB 3.35Å; L140-D144 PolarHBondContact O-N 3.44Å; L140-L147 HydrophobicContact CD1-CD2 4.43Å; L140-L147 HydrophobicContact CD2-CD2 3.57Å; L140-L147 HydrophobicContact CG-CD2 3.62Å; L140-V366 HydrophobicContact CD2-CG2 4.26Å; L140-S369 WeakPolarHBondContact CD2-OG 3.4Å
141	Y	91	Very high	87.2	Confident	47 Å²	47	44.6 Å²	44.6	18%	0.184	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-40.7	175.6	-82	-70	0	0	0	111.5	I137 R138 R143 L147 R148 Q151 V362	I137-Y141 HydrophobicContact CG2-CD2 3.65Å; I137-Y141 HydrophobicContact CG2-CE2 3.53Å; I137-Y141 VanDerWaalsContact O-CD2 3.25Å; I137-Y141 WeakPolarHBondContact O-CD2 3.41Å; I137-Y141 PolarHBondContact O-N 2.92Å; R138-Y141 PolarHBondContact O-N 2.99Å; Y141-R143 PolarHBondContact O-N 3.29Å; Y141-L147 HydrophobicContact CD1-CD2 3.98Å; Y141-L147 HydrophobicContact CD1-CG 3.99Å; Y141-L147 HydrophobicContact CE1-CD2 3.92Å; Y141-L147 HydrophobicContact CE1-CG 3.67Å; Y141-L147 HydrophobicContact CG-CD2 4.43Å; Y141-R148 HydrophobicContact CD1-CB 4.44Å; Y141-R148 HydrophobicContact CD1-CG 3.66Å; Y141-R148 HydrophobicContact CG-CG 4.28Å; Y141-R148 WeakPolarHBondContact O-CD 3.44Å; Y141-R148 WeakPolarHBondContact O-CG 3.44Å; Y141-R148 PolarHBondContact O-NH1 3.34Å; Y141-Q151 HydrophobicContact CE1-CB 3.74Å; Y141-Q151 HydrophobicContact CE1-CG 4.14Å; Y141-Q151 PolarHBondContact OH-OE1 3.06Å; Y141-V362 WeakPolarHBondContact OH-CG1 3.08Å
142	E	86.5	Confident	88.6	Confident	85 Å²	85	43.9 Å²	43.9	40%	0.397	19%	0.191	S	C	.	.	H	α-helix	trans	-60.7	-29.7	177.5	-73.2	174.4	-175.1	0	0	113	R138 L139 L140 R148	R138-E142 IonicContact CZ-OE1 2.61Å; R138-E142 IonicContact NE-OE1 3.51Å; R138-E142 PolarHBondContact NE-OE1 2.87Å; R138-E142 IonicContact NH2-OE1 2.75Å; R138-E142 PolarHBondContact NH2-OE1 2.96Å; R138-E142 WeakPolarHBondContact O-CG 3.49Å; R138-E142 PolarHBondContact O-N 3.41Å; L139-E142 PolarHBondContact O-N 2.87Å; L140-E142 VanDerWaalsContact C-N 3.34Å; L140-E142 PolarHBondContact O-N 2.91Å; E142-R148 PolarHBondContact O-NH1 2.93Å; E142-R148 VanDerWaalsContact O-NH1 3.16Å
143	R	85.1	Confident	89.5	Confident	182 Å²	182	43.8 Å²	43.8	69%	0.687	19%	0.19	S	C	*	.	H	α-helix	trans	-93.2	-36.6	-177.9	-169.3	-177.8	69.3	154.1	2.1	114.4	L139 L140 Y141	L139-R143 PolarHBondContact O-N 3.15Å; L139-R143 VanDerWaalsContact O-N 3.16Å; L140-R143 PolarHBondContact O-N 3.28Å; Y141-R143 PolarHBondContact O-N 3.29Å
144	D	89.4	Confident	90.3	Very high	30 Å²	30	43.7 Å²	43.7	16%	0.16	19%	0.19	C	C	.	.			trans	-99.6	99.6	-173.1	-172.2	-17	0	0	0	111.1	L140 E146 L147 R148 R365	L140-D144 WeakPolarHBondContact O-CB 3.35Å; L140-D144 PolarHBondContact O-N 3.44Å; D144-E146 PolarHBondContact OD1-N 2.91Å; D144-E146 VanDerWaalsContact OD1-N 3.09Å; D144-L147 HydrophobicContact CB-CB 3.83Å; D144-L147 VanDerWaalsContact CG-CB 3.43Å; D144-L147 PolarHBondContact O-N 3.5Å; D144-L147 PolarHBondContact OD1-N 2.86Å; D144-R148 PolarHBondContact O-N 3.05Å; D144-R148 VanDerWaalsContact O-N 3.09Å; D144-R365 IonicContact OD1-NH1 3.44Å; D144-R365 IonicContact OD2-CZ 3.46Å; D144-R365 VanDerWaalsContact OD2-CZ 3.25Å; D144-R365 IonicContact OD2-NE 2.64Å; D144-R365 IonicContact OD2-NH1 2.81Å; D144-R365 PolarHBondContact OD2-NH1 3.03Å; D144-R365 IonicContact OD2-NH2 2.83Å
145	N	90.8	Very high	90.9	Very high	76 Å²	76	42.7 Å²	42.7	41%	0.406	19%	0.191	S	C	.	.	H	α-helix	trans	-63.9	-40.6	179.4	-61.5	-11.3	0	0	0	112.1	L147 R148 E149	N145-L147 VanDerWaalsContact C-N 3.32Å; N145-L147 PolarHBondContact O-N 3.13Å; N145-R148 PolarHBondContact O-N 3.38Å; N145-R148 PolarHBondContact OD1-NH1 3.33Å; N145-R148 VanDerWaalsContact OD1-NH1 3.12Å; N145-R148 PolarHBondContact OD1-NH2 3.45Å; N145-E149 WeakPolarHBondContact O-CB 3.45Å; N145-E149 WeakPolarHBondContact O-CG 3.43Å; N145-E149 PolarHBondContact O-N 2.89Å
146	E	92.1	Very high	91.6	Very high	62 Å²	62	42 Å²	42	29%	0.29	19%	0.188	S	C	.	.	H	α-helix	trans	-65.3	-39.6	-179.4	-172.6	-170.1	-164.9	0	0	110.6	D144 E149 A150 R365 L413	D144-E146 PolarHBondContact OD1-N 2.91Å; D144-E146 VanDerWaalsContact OD1-N 3.09Å; E146-E149 PolarHBondContact O-N 3.12Å; E146-A150 WeakPolarHBondContact O-CB 3.44Å; E146-A150 PolarHBondContact O-N 3.12Å; E146-R365 IonicContact OE2-CZ 3.3Å; E146-R365 IonicContact OE2-NH1 2.91Å; E146-R365 PolarHBondContact OE2-NH1 3.06Å; E146-R365 IonicContact OE2-NH2 2.65Å; E146-L413 HydrophobicContact CG-CB 4.32Å; E146-L413 PolarHBondContact OE1-N 2.96Å
147	L	93.1	Very high	92.3	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-42.9	175.3	-175.7	72.8	0	0	0	111.9	L140 Y141 D144 N145 A150 Q151 V362 R365	L140-L147 HydrophobicContact CD1-CD2 4.43Å; L140-L147 HydrophobicContact CD2-CD2 3.57Å; L140-L147 HydrophobicContact CG-CD2 3.62Å; Y141-L147 HydrophobicContact CD1-CD2 3.98Å; Y141-L147 HydrophobicContact CD1-CG 3.99Å; Y141-L147 HydrophobicContact CE1-CD2 3.92Å; Y141-L147 HydrophobicContact CE1-CG 3.67Å; Y141-L147 HydrophobicContact CG-CD2 4.43Å; D144-L147 HydrophobicContact CB-CB 3.83Å; D144-L147 VanDerWaalsContact CG-CB 3.43Å; D144-L147 PolarHBondContact O-N 3.5Å; D144-L147 PolarHBondContact OD1-N 2.86Å; N145-L147 VanDerWaalsContact C-N 3.32Å; N145-L147 PolarHBondContact O-N 3.13Å; L147-A150 PolarHBondContact O-N 3.4Å; L147-Q151 PolarHBondContact O-N 3.31Å; L147-V362 HydrophobicContact CD1-CB 4.27Å; L147-V362 HydrophobicContact CD1-CG1 4.15Å; L147-V362 HydrophobicContact CD1-CG2 4.02Å; L147-R365 HydrophobicContact CD1-CB 3.79Å; L147-R365 HydrophobicContact CD1-CG 4.3Å
148	R	94.5	Very high	92.7	Very high	26 Å²	26	41.1 Å²	41.1	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-47.7	174.1	-80.2	-164.2	-40.1	-79.5	-8	111.7	D110 S114 Y141 E142 D144 N145 A150 Q151 I152	D110-R148 IonicContact OD1-CZ 3.43Å; D110-R148 IonicContact OD1-NE 3.23Å; D110-R148 PolarHBondContact OD1-NE 3.06Å; D110-R148 IonicContact OD1-NH2 3.93Å; D110-R148 IonicContact OD2-CZ 2.7Å; D110-R148 IonicContact OD2-NE 3.78Å; D110-R148 IonicContact OD2-NH2 3.49Å; D110-R148 PolarHBondContact OD2-NH2 3.44Å; D110-R148 VanDerWaalsContact OD2-NH2 3.14Å; S114-R148 PolarHBondContact OG-NH2 3.32Å; Y141-R148 HydrophobicContact CD1-CB 4.44Å; Y141-R148 HydrophobicContact CD1-CG 3.66Å; Y141-R148 HydrophobicContact CG-CG 4.28Å; Y141-R148 WeakPolarHBondContact O-CD 3.44Å; Y141-R148 WeakPolarHBondContact O-CG 3.44Å; Y141-R148 PolarHBondContact O-NH1 3.34Å; E142-R148 PolarHBondContact O-NH1 2.93Å; E142-R148 VanDerWaalsContact O-NH1 3.16Å; D144-R148 PolarHBondContact O-N 3.05Å; D144-R148 VanDerWaalsContact O-N 3.09Å; N145-R148 PolarHBondContact O-N 3.38Å; N145-R148 PolarHBondContact OD1-NH1 3.33Å; N145-R148 VanDerWaalsContact OD1-NH1 3.12Å; N145-R148 PolarHBondContact OD1-NH2 3.45Å; R148-A150 VanDerWaalsContact C-N 3.32Å; R148-A150 PolarHBondContact O-N 3.08Å; R148-Q151 WeakPolarHBondContact O-CB 3.25Å; R148-Q151 PolarHBondContact O-N 3.08Å; R148-Q151 VanDerWaalsContact O-N 3.1Å; R148-I152 WeakPolarHBondContact O-CG1 3.26Å; R148-I152 PolarHBondContact O-N 3.31Å
149	E	94.8	Very high	93.1	Very high	18 Å²	18	37.9 Å²	37.9	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-41.3	178.8	-72.8	-168.1	-172	0	0	111.1	R111 N145 E146 Q151 I152 L153 M496	R111-E149 WeakPolarHBondContact CG-OE1 3.26Å; R111-E149 IonicContact CZ-OE1 3.85Å; R111-E149 IonicContact CZ-OE2 3.88Å; R111-E149 IonicContact NE-OE1 3.95Å; R111-E149 PolarHBondContact NE-OE1 3.45Å; R111-E149 IonicContact NE-OE2 3.86Å; R111-E149 IonicContact NH2-OE1 3.25Å; R111-E149 PolarHBondContact NH2-OE1 3.19Å; R111-E149 IonicContact NH2-OE2 2.76Å; R111-E149 PolarHBondContact NH2-OE2 2.71Å; N145-E149 WeakPolarHBondContact O-CB 3.45Å; N145-E149 WeakPolarHBondContact O-CG 3.43Å; N145-E149 PolarHBondContact O-N 2.89Å; E146-E149 PolarHBondContact O-N 3.12Å; E149-Q151 VanDerWaalsContact C-N 3.32Å; E149-Q151 PolarHBondContact O-N 3.19Å; E149-I152 WeakPolarHBondContact O-CB 3.45Å; E149-I152 PolarHBondContact O-N 3.4Å; E149-L153 PolarHBondContact O-N 3.4Å; E149-M496 HydrophobicContact CB-CE 3.89Å; E149-M496 WeakPolarHBondContact O-CE 3.41Å
150	A	95.9	Very high	93.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-38.3	173.9	0	0	0	0	0	112.7	E146 L147 R148 L153 I154 V362 L413	E146-A150 WeakPolarHBondContact O-CB 3.44Å; E146-A150 PolarHBondContact O-N 3.12Å; L147-A150 PolarHBondContact O-N 3.4Å; R148-A150 VanDerWaalsContact C-N 3.32Å; R148-A150 PolarHBondContact O-N 3.08Å; A150-L153 PolarHBondContact O-N 2.99Å; A150-I154 WeakPolarHBondContact O-CG1 3.47Å; A150-I154 PolarHBondContact O-N 3.24Å; A150-I154 VanDerWaalsContact O-N 3.13Å; A150-V362 HydrophobicContact CB-CG2 3.95Å; A150-L413 HydrophobicContact CB-CD1 4.36Å
151	Q	96.5	Very high	93.6	Very high	39 Å²	39	38.2 Å²	38.2	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-67.7	-40.5	174.2	-176.1	61.1	53.2	0	0	112	Y141 L147 R148 E149 L153 I154 D155	Y141-Q151 HydrophobicContact CE1-CB 3.74Å; Y141-Q151 HydrophobicContact CE1-CG 4.14Å; Y141-Q151 PolarHBondContact OH-OE1 3.06Å; L147-Q151 PolarHBondContact O-N 3.31Å; R148-Q151 WeakPolarHBondContact O-CB 3.25Å; R148-Q151 PolarHBondContact O-N 3.08Å; R148-Q151 VanDerWaalsContact O-N 3.1Å; E149-Q151 VanDerWaalsContact C-N 3.32Å; E149-Q151 PolarHBondContact O-N 3.19Å; Q151-L153 VanDerWaalsContact C-N 3.27Å; Q151-L153 PolarHBondContact O-N 3.39Å; Q151-I154 WeakPolarHBondContact O-CB 3.44Å; Q151-I154 PolarHBondContact O-N 3.24Å; Q151-I154 VanDerWaalsContact O-N 3.1Å; Q151-D155 PolarHBondContact NE2-OD1 2.9Å; Q151-D155 VanDerWaalsContact O-CG 3.28Å; Q151-D155 PolarHBondContact O-N 2.8Å
152	I	97.4	Very high	93.6	Very high	27 Å²	27	39.4 Å²	39.4	14%	0.138	18%	0.18	C	C	.	.	H	α-helix	trans	-58.1	-42	174	-69.4	166.6	0	0	0	110.7	I107 D110 R148 E149 I154 D155 W156	I107-I152 HydrophobicContact CG1-CG2 4.06Å; D110-I152 HydrophobicContact CB-CD1 3.61Å; R148-I152 WeakPolarHBondContact O-CG1 3.26Å; R148-I152 PolarHBondContact O-N 3.31Å; E149-I152 WeakPolarHBondContact O-CB 3.45Å; E149-I152 PolarHBondContact O-N 3.4Å; I152-I154 VanDerWaalsContact C-N 3.34Å; I152-I154 PolarHBondContact O-N 3.25Å; I152-D155 PolarHBondContact O-N 3.19Å; I152-W156 WeakPolarHBondContact O-CB 3.43Å; I152-W156 PolarHBondContact O-N 3.48Å
153	L	97.4	Very high	93.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-39.5	176.2	-178.4	64.3	0	0	0	112.1	L103 E149 A150 Q151 W156 L157 T354 F417 M496	L103-L153 HydrophobicContact CD1-CD1 4.04Å; L103-L153 HydrophobicContact CD2-CD1 4.03Å; E149-L153 PolarHBondContact O-N 3.4Å; A150-L153 PolarHBondContact O-N 2.99Å; Q151-L153 VanDerWaalsContact C-N 3.27Å; Q151-L153 PolarHBondContact O-N 3.39Å; L153-W156 HydrophobicContact CD1-CE3 3.76Å; L153-W156 HydrophobicContact CD1-CZ3 4.03Å; L153-L157 HydrophobicContact CG-CD1 4.33Å; L153-L157 WeakPolarHBondContact O-CG 3.38Å; L153-L157 PolarHBondContact O-N 3.25Å; L153-T354 HydrophobicContact CD2-CG2 3.94Å; L153-F417 HydrophobicContact CD2-CZ 3.98Å; L153-M496 HydrophobicContact CB-CE 3.98Å; L153-M496 HydrophobicContact CB-SD 4.11Å; L153-M496 HydrophobicContact CD1-CG 4.33Å; L153-M496 HydrophobicContact CD1-SD 4.26Å; L153-M496 HydrophobicContact CD2-CE 4.23Å; L153-M496 HydrophobicContact CD2-CG 4.15Å; L153-M496 HydrophobicContact CD2-SD 4.35Å; L153-M496 HydrophobicContact CG-SD 4.48Å
154	I	97.5	Very high	93.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-63.5	-50.9	174.3	-67.2	164.6	0	0	0	110.2	A150 Q151 I152 W156 L157 E158 C358 R359 V362	A150-I154 WeakPolarHBondContact O-CG1 3.47Å; A150-I154 PolarHBondContact O-N 3.24Å; A150-I154 VanDerWaalsContact O-N 3.13Å; Q151-I154 WeakPolarHBondContact O-CB 3.44Å; Q151-I154 PolarHBondContact O-N 3.24Å; Q151-I154 VanDerWaalsContact O-N 3.1Å; I152-I154 VanDerWaalsContact C-N 3.34Å; I152-I154 PolarHBondContact O-N 3.25Å; I154-W156 PolarHBondContact O-N 3.46Å; I154-L157 PolarHBondContact O-N 2.77Å; I154-L157 VanDerWaalsContact O-N 3.11Å; I154-E158 HydrophobicContact CG2-CG 4.22Å; I154-E158 WeakPolarHBondContact CG2-OE1 3.29Å; I154-E158 WeakPolarHBondContact O-CB 3.49Å; I154-E158 VanDerWaalsContact O-CG 3.3Å; I154-E158 WeakPolarHBondContact O-CG 3.34Å; I154-E158 PolarHBondContact O-N 3.15Å; I154-C358 HydrophobicContact CD1-CB 4.04Å; I154-C358 HydrophobicContact CG1-CB 3.69Å; I154-R359 HydrophobicContact CD1-CB 4.18Å; I154-V362 HydrophobicContact CD1-CB 4.14Å; I154-V362 HydrophobicContact CD1-CG2 3.68Å
155	D	97.7	Very high	93.4	Very high	74 Å²	74	30.4 Å²	30.4	40%	0.396	15%	0.145	S	C	.	.	H	α-helix	trans	-59.2	-39	-178	-67.8	-17.9	0	0	0	111.2	Q151 I152 E158 Q159	Q151-D155 PolarHBondContact NE2-OD1 2.9Å; Q151-D155 VanDerWaalsContact O-CG 3.28Å; Q151-D155 PolarHBondContact O-N 2.8Å; I152-D155 PolarHBondContact O-N 3.19Å; D155-E158 PolarHBondContact O-N 2.65Å; D155-Q159 VanDerWaalsContact O-CB 3.32Å; D155-Q159 WeakPolarHBondContact O-CB 3.49Å; D155-Q159 PolarHBondContact O-N 3.23Å
156	W	97.2	Very high	93.2	Very high	10 Å²	10	32.1 Å²	32.1	4%	0.038	15%	0.151	C	C	.	.	H	α-helix	trans	-64.9	-48.5	173.9	172	75.7	0	0	0	112.6	N99 L103 I152 L153 I154 E158 Q159 I160 W350 Q492	N99-W156 HydrophobicContact CB-CZ2 4.28Å; N99-W156 PolarHBondContact O-NE1 3.39Å; L103-W156 HydrophobicContact CB-CD2 3.87Å; L103-W156 HydrophobicContact CB-CG 3.89Å; L103-W156 HydrophobicContact CB-CZ2 4.31Å; L103-W156 HydrophobicContact CD1-CB 3.89Å; L103-W156 HydrophobicContact CD1-CD2 3.94Å; L103-W156 HydrophobicContact CD1-CE3 4.13Å; L103-W156 HydrophobicContact CD1-CG 3.82Å; L103-W156 HydrophobicContact CD2-CD2 4.11Å; L103-W156 HydrophobicContact CD2-CE3 3.98Å; L103-W156 HydrophobicContact CD2-CH2 4.26Å; L103-W156 HydrophobicContact CD2-CZ2 4.35Å; L103-W156 HydrophobicContact CD2-CZ3 4.06Å; L103-W156 HydrophobicContact CG-CD2 4.19Å; L103-W156 HydrophobicContact CG-CE3 4.45Å; L103-W156 HydrophobicContact CG-CG 4.35Å; I152-W156 WeakPolarHBondContact O-CB 3.43Å; I152-W156 PolarHBondContact O-N 3.48Å; L153-W156 HydrophobicContact CD1-CE3 3.76Å; L153-W156 HydrophobicContact CD1-CZ3 4.03Å; I154-W156 PolarHBondContact O-N 3.46Å; W156-E158 PolarHBondContact O-N 2.93Å; W156-Q159 PolarHBondContact O-N 3.26Å; W156-I160 HydrophobicContact CD2-CD1 4.09Å; W156-I160 HydrophobicContact CE3-CD1 4.48Å; W156-I160 HydrophobicContact CH2-CD1 3.98Å; W156-I160 HydrophobicContact CZ2-CD1 3.55Å; W156-I160 HydrophobicContact CZ3-CD1 4.43Å; W156-I160 WeakPolarHBondContact O-CG1 3.27Å; W156-I160 PolarHBondContact O-N 3.5Å; W156-I160 VanDerWaalsContact O-N 3.16Å; W156-W350 HydrophobicContact CZ3-CZ3 4.39Å; W156-Q492 HydrophobicContact CH2-CG 4.13Å
157	L	95.8	Very high	92.6	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-31.1	176.3	-75.2	169.9	0	0	0	112.4	L153 I154 R238 T351 T354 W355	L153-L157 HydrophobicContact CG-CD1 4.33Å; L153-L157 WeakPolarHBondContact O-CG 3.38Å; L153-L157 PolarHBondContact O-N 3.25Å; I154-L157 PolarHBondContact O-N 2.77Å; I154-L157 VanDerWaalsContact O-N 3.11Å; L157-R238 PolarHBondContact O-NH1 3.27Å; L157-T351 HydrophobicContact CD2-CG2 4.36Å; L157-T354 HydrophobicContact CD1-CG2 3.92Å; L157-W355 HydrophobicContact CB-CB 4.36Å; L157-W355 HydrophobicContact CD1-CB 3.82Å
158	E	95.8	Very high	91.9	Very high	9 Å²	9	38 Å²	38	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-75.1	-42.1	175.8	-75.9	179.5	-176.6	0	0	111.5	I154 D155 W156 I160 V161 R162 R238 G239 G240 W355 R359	I154-E158 HydrophobicContact CG2-CG 4.22Å; I154-E158 WeakPolarHBondContact CG2-OE1 3.29Å; I154-E158 WeakPolarHBondContact O-CB 3.49Å; I154-E158 VanDerWaalsContact O-CG 3.3Å; I154-E158 WeakPolarHBondContact O-CG 3.34Å; I154-E158 PolarHBondContact O-N 3.15Å; D155-E158 PolarHBondContact O-N 2.65Å; W156-E158 PolarHBondContact O-N 2.93Å; E158-I160 VanDerWaalsContact C-N 3.31Å; E158-I160 PolarHBondContact O-N 2.94Å; E158-V161 PolarHBondContact O-N 3.45Å; E158-V161 VanDerWaalsContact O-N 3.16Å; E158-R162 WeakPolarHBondContact O-CB 3.35Å; E158-R162 PolarHBondContact O-N 2.61Å; E158-R238 WeakPolarHBondContact CG-O 3.43Å; E158-G239 VanDerWaalsContact O-CA 3.3Å; E158-G239 WeakPolarHBondContact O-CA 3.29Å; E158-G240 WeakPolarHBondContact OE2-CA 3.27Å; E158-W355 PolarHBondContact OE1-NE1 2.88Å; E158-R359 IonicContact OE1-CZ 2.82Å; E158-R359 VanDerWaalsContact OE1-CZ 3.31Å; E158-R359 IonicContact OE1-NE 2.62Å; E158-R359 PolarHBondContact OE1-NE 3.42Å; E158-R359 IonicContact OE1-NH2 3.57Å; E158-R359 PolarHBondContact OE1-NH2 2.92Å; E158-R359 IonicContact OE2-NH2 3.69Å
159	Q	95	Very high	91.4	Very high	64 Å²	64	37.1 Å²	37.1	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-58	-42.8	176.5	179.2	175	-10.1	0	0	111.9	D155 W156 V161 R162 E163	D155-Q159 VanDerWaalsContact O-CB 3.32Å; D155-Q159 WeakPolarHBondContact O-CB 3.49Å; D155-Q159 PolarHBondContact O-N 3.23Å; W156-Q159 PolarHBondContact O-N 3.26Å; Q159-V161 VanDerWaalsContact C-N 3.28Å; Q159-V161 PolarHBondContact O-N 3.08Å; Q159-R162 PolarHBondContact O-N 3.05Å; Q159-E163 HydrophobicContact CG-CG 4.36Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.42Å; Q159-E163 PolarHBondContact NE2-OE1 3.46Å; Q159-E163 WeakPolarHBondContact O-CG 3.31Å; Q159-E163 PolarHBondContact O-N 2.73Å
160	I	91.4	Very high	90.7	Very high	30 Å²	30	44.6 Å²	44.6	15%	0.154	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-45.1	177.8	-66.9	168.9	0	0	0	110.9	N99 W156 E158 Q164	N99-I160 HydrophobicContact CB-CD1 4.15Å; N99-I160 HydrophobicContact CB-CG1 4.34Å; W156-I160 HydrophobicContact CD2-CD1 4.09Å; W156-I160 HydrophobicContact CE3-CD1 4.48Å; W156-I160 HydrophobicContact CH2-CD1 3.98Å; W156-I160 HydrophobicContact CZ2-CD1 3.55Å; W156-I160 HydrophobicContact CZ3-CD1 4.43Å; W156-I160 WeakPolarHBondContact O-CG1 3.27Å; W156-I160 PolarHBondContact O-N 3.5Å; W156-I160 VanDerWaalsContact O-N 3.16Å; E158-I160 VanDerWaalsContact C-N 3.31Å; E158-I160 PolarHBondContact O-N 2.94Å; I160-Q164 WeakPolarHBondContact O-CG 3.48Å; I160-Q164 PolarHBondContact O-N 3.48Å
161	V	89.9	Confident	89.9	Confident	19 Å²	19	51.4 Å²	51.4	12%	0.115	24%	0.244	C	C	.	.	H	α-helix	trans	-71.1	-38.5	179.7	175.9	0	0	0	0	110.9	E158 Q159 Q164 I165 R238	E158-V161 PolarHBondContact O-N 3.45Å; E158-V161 VanDerWaalsContact O-N 3.16Å; Q159-V161 VanDerWaalsContact C-N 3.28Å; Q159-V161 PolarHBondContact O-N 3.08Å; V161-Q164 WeakPolarHBondContact O-CB 3.5Å; V161-Q164 PolarHBondContact O-N 3.02Å; V161-I165 HydrophobicContact CG1-CD1 3.93Å; V161-I165 HydrophobicContact CG1-CG1 4.43Å; V161-I165 VanDerWaalsContact O-CG1 3.29Å; V161-I165 WeakPolarHBondContact O-CG1 3.22Å; V161-I165 PolarHBondContact O-N 3.38Å; V161-R238 HydrophobicContact CG1-CG 4.24Å; V161-R238 HydrophobicContact CG2-CG 4.25Å
162	R	91.8	Very high	89	Confident	71 Å²	71	53.3 Å²	53.3	27%	0.268	25%	0.25	S	C	.	.	H	α-helix	trans	-60.9	-45.7	177.4	-175	164.7	56.4	-121	3.9	112.3	E158 Q159 Q164 I165 E166 G239	E158-R162 WeakPolarHBondContact O-CB 3.35Å; E158-R162 PolarHBondContact O-N 2.61Å; Q159-R162 PolarHBondContact O-N 3.05Å; R162-Q164 VanDerWaalsContact C-N 3.32Å; R162-Q164 PolarHBondContact O-N 3.11Å; R162-I165 WeakPolarHBondContact O-CB 3.43Å; R162-I165 PolarHBondContact O-N 3.41Å; R162-I165 VanDerWaalsContact O-N 3.11Å; R162-E166 WeakPolarHBondContact O-CG 3.33Å; R162-E166 PolarHBondContact O-N 3.2Å; R162-G239 PolarHBondContact NH1-O 3.01Å
163	E	87.9	Confident	88.4	Confident	46 Å²	46	53.7 Å²	53.7	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-42.2	176.1	-71.4	177.8	-165.7	0	0	111.4	R98 Q159 I165 E166 E167	R98-E163 IonicContact CZ-OE2 3.44Å; R98-E163 IonicContact NH1-OE2 3.89Å; R98-E163 IonicContact NH2-OE2 2.88Å; R98-E163 PolarHBondContact NH2-OE2 3.5Å; Q159-E163 HydrophobicContact CG-CG 4.36Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.42Å; Q159-E163 PolarHBondContact NE2-OE1 3.46Å; Q159-E163 WeakPolarHBondContact O-CG 3.31Å; Q159-E163 PolarHBondContact O-N 2.73Å; E163-I165 VanDerWaalsContact C-N 3.3Å; E163-I165 PolarHBondContact O-N 2.95Å; E163-E166 PolarHBondContact O-N 3.45Å; E163-E167 PolarHBondContact O-N 3.35Å; E163-E167 VanDerWaalsContact O-N 3.14Å
164	Q	83.6	Confident	87.7	Confident	55 Å²	55	57.1 Å²	57.1	26%	0.257	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-35.7	174.9	-69.5	177.1	9.8	0	0	112.7	M1 I160 V161 R162	M1-Q164 HydrophobicContact CE-CB 4.42Å; I160-Q164 WeakPolarHBondContact O-CG 3.48Å; I160-Q164 PolarHBondContact O-N 3.48Å; V161-Q164 WeakPolarHBondContact O-CB 3.5Å; V161-Q164 PolarHBondContact O-N 3.02Å; R162-Q164 VanDerWaalsContact C-N 3.32Å; R162-Q164 PolarHBondContact O-N 3.11Å
165	I	85.1	Confident	86.7	Confident	7 Å²	7	61 Å²	61	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-46.8	175.9	-70.7	166.5	0	0	0	110	V161 R162 E163 E167 V168 A169 Y232 L235	V161-I165 HydrophobicContact CG1-CD1 3.93Å; V161-I165 HydrophobicContact CG1-CG1 4.43Å; V161-I165 VanDerWaalsContact O-CG1 3.29Å; V161-I165 WeakPolarHBondContact O-CG1 3.22Å; V161-I165 PolarHBondContact O-N 3.38Å; R162-I165 WeakPolarHBondContact O-CB 3.43Å; R162-I165 PolarHBondContact O-N 3.41Å; R162-I165 VanDerWaalsContact O-N 3.11Å; E163-I165 VanDerWaalsContact C-N 3.3Å; E163-I165 PolarHBondContact O-N 2.95Å; I165-E167 VanDerWaalsContact C-N 3.26Å; I165-E167 PolarHBondContact O-N 2.64Å; I165-V168 CarbonylContact O-C 3.47Å; I165-V168 PolarHBondContact O-N 3.06Å; I165-V168 VanDerWaalsContact O-N 3.11Å; I165-A169 WeakPolarHBondContact O-CA 3.29Å; I165-A169 WeakPolarHBondContact O-CB 3.41Å; I165-A169 PolarHBondContact O-N 3.06Å; I165-Y232 HydrophobicContact CG2-CE2 4.43Å; I165-Y232 WeakPolarHBondContact CG2-OH 3.39Å; I165-L235 HydrophobicContact CD1-CB 4.07Å; I165-L235 VanDerWaalsContact CD1-O 3.31Å; I165-L235 WeakPolarHBondContact CD1-O 3.48Å
166	E	86.5	Confident	85.9	Confident	113 Å²	113	57.8 Å²	57.8	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-58.4	-37.8	179.7	-73.2	174.5	-173.7	0	0	112.2	R162 E163 V168	R162-E166 WeakPolarHBondContact O-CG 3.33Å; R162-E166 PolarHBondContact O-N 3.2Å; E163-E166 PolarHBondContact O-N 3.45Å; E166-V168 VanDerWaalsContact C-N 3.26Å; E166-V168 PolarHBondContact O-N 3.46Å
167	E	80.1	Confident	85	Confident	141 Å²	141	62.4 Å²	62.4	66%	0.659	30%	0.303	S	S	*	.	H	α-helix	trans	-63.1	-28.7	177.6	-74.6	-171.9	167.5	0	0	114.1	E163 I165	E163-E167 PolarHBondContact O-N 3.35Å; E163-E167 VanDerWaalsContact O-N 3.14Å; I165-E167 VanDerWaalsContact C-N 3.26Å; I165-E167 PolarHBondContact O-N 2.64Å
168	V	79	Confident	83.9	Confident	46 Å²	46	65.3 Å²	65.3	28%	0.279	32%	0.316	S	S	.	.	H	α-helix	trans	-114.4	-4.6	-175.6	-56.4	0	0	0	0	113.6	M1 I165 E166 E170 K171 Y172	M1-V168 HydrophobicContact CE-CG2 4.35Å; I165-V168 CarbonylContact O-C 3.47Å; I165-V168 PolarHBondContact O-N 3.06Å; I165-V168 VanDerWaalsContact O-N 3.11Å; E166-V168 VanDerWaalsContact C-N 3.26Å; E166-V168 PolarHBondContact O-N 3.46Å; V168-E170 PolarHBondContact O-N 3.21Å; V168-K171 PolarHBondContact O-N 3.35Å; V168-K171 VanDerWaalsContact O-N 3.12Å; V168-Y172 HydrophobicContact CB-CD2 3.72Å; V168-Y172 HydrophobicContact CB-CE2 3.82Å; V168-Y172 HydrophobicContact CG2-CD2 3.63Å; V168-Y172 HydrophobicContact CG2-CE2 3.85Å; V168-Y172 WeakPolarHBondContact O-CD2 3.23Å; V168-Y172 PolarHBondContact O-N 2.94Å
169	A	82.7	Confident	82.8	Confident	7 Å²	7	70.2 Å²	70.2	6%	0.058	35%	0.347	C	S	.	.	H	α-helix	trans	-50.8	-52.4	-169.9	0	0	0	0	0	113.2	I165 K171 Y172 E173	I165-A169 WeakPolarHBondContact O-CA 3.29Å; I165-A169 WeakPolarHBondContact O-CB 3.41Å; I165-A169 PolarHBondContact O-N 3.06Å; A169-K171 PolarHBondContact O-N 2.76Å; A169-K171 VanDerWaalsContact O-N 3.15Å; A169-Y172 PolarHBondContact O-N 3.22Å; A169-E173 WeakPolarHBondContact O-CB 3.28Å; A169-E173 WeakPolarHBondContact O-CG 3.47Å; A169-E173 PolarHBondContact O-N 3.49Å
170	E	80	Confident	82.1	Confident	175 Å²	175	70.7 Å²	70.7	82%	0.818	35%	0.354	S	S	*	.	H	α-helix	trans	-54.8	-40.7	-176.8	-171.4	-179.2	-176.8	0	0	112.2	V168 C174	V168-E170 PolarHBondContact O-N 3.21Å; E170-C174 PolarHBondContact O-SG 3.22Å
171	K	79.7	Confident	81.7	Confident	145 Å²	145	70.3 Å²	70.3	63%	0.63	36%	0.356	S	S	*	.	H	α-helix	trans	-72.8	-33.5	-179.3	-174.6	-179.5	176.2	-174.2	0	113.1	V168 A169 C174	V168-K171 PolarHBondContact O-N 3.35Å; V168-K171 VanDerWaalsContact O-N 3.12Å; A169-K171 PolarHBondContact O-N 2.76Å; A169-K171 VanDerWaalsContact O-N 3.15Å; K171-C174 PolarHBondContact O-SG 3.1Å
172	Y	78.1	Confident	81.7	Confident	78 Å²	78	70.2 Å²	70.2	31%	0.306	35%	0.353	S	S	.	.	H	α-helix	trans	-90.2	-41.2	-177.1	-79.4	-85.4	0	0	0	112.4	V168 A169 C174 L175 F176 Y232	V168-Y172 HydrophobicContact CB-CD2 3.72Å; V168-Y172 HydrophobicContact CB-CE2 3.82Å; V168-Y172 HydrophobicContact CG2-CD2 3.63Å; V168-Y172 HydrophobicContact CG2-CE2 3.85Å; V168-Y172 WeakPolarHBondContact O-CD2 3.23Å; V168-Y172 PolarHBondContact O-N 2.94Å; A169-Y172 PolarHBondContact O-N 3.22Å; Y172-C174 VanDerWaalsContact C-N 3.34Å; Y172-C174 PolarHBondContact O-N 3.18Å; Y172-L175 VanDerWaalsContact O-CB 3.23Å; Y172-L175 WeakPolarHBondContact O-CB 3.45Å; Y172-L175 WeakPolarHBondContact O-CG 3.45Å; Y172-L175 PolarHBondContact O-N 2.92Å; Y172-L175 VanDerWaalsContact O-N 3.14Å; Y172-F176 WeakPolarHBondContact O-CE2 3.33Å; Y172-Y232 HydrophobicContact CG-CE2 4.47Å
173	E	84.7	Confident	81.5	Confident	36 Å²	36	71 Å²	71	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-70.9	-29.9	-174.8	-67	-174.6	153.1	0	0	113.1	A169 L175 F176 Y232 R244 L248	A169-E173 WeakPolarHBondContact O-CB 3.28Å; A169-E173 WeakPolarHBondContact O-CG 3.47Å; A169-E173 PolarHBondContact O-N 3.49Å; E173-L175 PolarHBondContact O-N 3.41Å; E173-L175 VanDerWaalsContact O-N 3.09Å; E173-F176 PolarHBondContact O-N 2.97Å; E173-Y232 HydrophobicContact CG-CE1 3.77Å; E173-Y232 WeakPolarHBondContact CG-OH 3.45Å; E173-Y232 PolarHBondContact OE1-OH 3.28Å; E173-R244 IonicContact OE1-CZ 3.76Å; E173-R244 IonicContact OE1-NE 2.9Å; E173-R244 PolarHBondContact OE1-NE 3.19Å; E173-R244 IonicContact OE1-NH2 3.97Å; E173-R244 PolarHBondContact OE1-NH2 2.91Å; E173-R244 IonicContact OE2-CZ 2.75Å; E173-R244 IonicContact OE2-NH2 2.61Å; E173-R244 PolarHBondContact OE2-NH2 3.43Å; E173-L248 HydrophobicContact CB-CD2 4.29Å; E173-L248 HydrophobicContact CG-CD2 4Å
174	C	82.4	Confident	81.6	Confident	72 Å²	72	71.7 Å²	71.7	49%	0.486	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-60	-21.1	173.1	63.5	0	0	0	0	113.2	E170 K171 Y172 F176	E170-C174 PolarHBondContact O-SG 3.22Å; K171-C174 PolarHBondContact O-SG 3.1Å; Y172-C174 VanDerWaalsContact C-N 3.34Å; Y172-C174 PolarHBondContact O-N 3.18Å; C174-F176 PolarHBondContact O-N 3.49Å
175	L	77.4	Confident	82	Confident	83 Å²	83	69.1 Å²	69.1	44%	0.435	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-71.7	-14	174.2	-55.6	174.1	0	0	0	112.8	Y172 E173	Y172-L175 VanDerWaalsContact O-CB 3.23Å; Y172-L175 WeakPolarHBondContact O-CB 3.45Å; Y172-L175 WeakPolarHBondContact O-CG 3.45Å; Y172-L175 PolarHBondContact O-N 2.92Å; Y172-L175 VanDerWaalsContact O-N 3.14Å; E173-L175 PolarHBondContact O-N 3.41Å; E173-L175 VanDerWaalsContact O-N 3.09Å
176	F	79.9	Confident	82.3	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.026	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-112.9	8.8	-173.5	-50.1	-50.1	0	0	0	113.9	Y172 E173 C174 Q178 R228 F229 Y232	Y172-F176 WeakPolarHBondContact O-CE2 3.33Å; E173-F176 PolarHBondContact O-N 2.97Å; C174-F176 PolarHBondContact O-N 3.49Å; F176-Q178 PolarHBondContact O-N 2.87Å; F176-R228 HydrophobicContact CE1-CG 4.29Å; F176-R228 HydrophobicContact CZ-CG 4.17Å; F176-F229 HydrophobicContact CB-CD2 4.15Å; F176-F229 HydrophobicContact CB-CE2 4.34Å; F176-F229 HydrophobicContact CD1-CB 4.06Å; F176-F229 AromaticContact CD1-CD2 3.74Å; F176-F229 HydrophobicContact CD1-CD2 3.74Å; F176-F229 HydrophobicContact CD1-CG 4.35Å; F176-F229 AromaticContact CD2-CD2 3.96Å; F176-F229 HydrophobicContact CD2-CD2 3.96Å; F176-F229 HydrophobicContact CD2-CE2 4.45Å; F176-F229 HydrophobicContact CE1-CB 3.82Å; F176-F229 HydrophobicContact CE1-CD2 4.07Å; F176-F229 HydrophobicContact CE1-CG 4.47Å; F176-F229 HydrophobicContact CE2-CD2 4.28Å; F176-F229 AromaticContact CG-CD2 3.68Å; F176-F229 HydrophobicContact CG-CD2 3.68Å; F176-F229 HydrophobicContact CG-CE2 4.27Å; F176-F229 HydrophobicContact CZ-CB 4.39Å; F176-F229 HydrophobicContact CZ-CD2 4.33Å; F176-Y232 HydrophobicContact CD2-CD1 4.33Å; F176-Y232 AromaticContact CE2-CD1 3.76Å; F176-Y232 HydrophobicContact CE2-CD1 3.76Å; F176-Y232 HydrophobicContact CE2-CD2 4.49Å; F176-Y232 HydrophobicContact CE2-CE1 4.44Å; F176-Y232 AromaticContact CE2-CG 3.78Å; F176-Y232 HydrophobicContact CE2-CG 3.78Å; F176-Y232 HydrophobicContact CZ-CG 4.4Å
177	N	78.2	Confident	82.6	Confident	107 Å²	107	70.8 Å²	70.8	57%	0.572	37%	0.367	S	S	*	.			trans	-70.7	16.6	-179.9	-75.9	-13.6	0	0	0	114.9
178	Q	73.6	Confident	83.1	Confident	62 Å²	62	66 Å²	66	29%	0.29	35%	0.346	S	S	.	.			trans	-76.3	125.9	177.9	-65.8	172.2	-0.3	0	0	109.4	F176 T180 R252	F176-Q178 PolarHBondContact O-N 2.87Å; Q178-T180 VanDerWaalsContact C-N 3.26Å; Q178-T180 PolarHBondContact O-N 2.94Å; Q178-R252 VanDerWaalsContact O-CA 3.24Å; Q178-R252 WeakPolarHBondContact O-CA 3.36Å
179	T	73.1	Confident	83.6	Confident	111 Å²	111	65.7 Å²	65.7	68%	0.681	34%	0.342	S	S	*	.	S	Bend	trans	-78.2	-11.9	-179	49.6	0	0	0	0	113.9
180	T	79.5	Confident	84	Confident	75 Å²	75	70 Å²	70	46%	0.46	37%	0.372	S	S	.	.	S	Bend	trans	-129.3	122.7	-174.2	17	0	0	0	0	109.9	Q178 E183	Q178-T180 VanDerWaalsContact C-N 3.26Å; Q178-T180 PolarHBondContact O-N 2.94Å; T180-E183 VanDerWaalsContact O-CG 3.28Å; T180-E183 WeakPolarHBondContact O-CG 3.42Å; T180-E183 PolarHBondContact OG1-OE1 3.49Å
181	A	82.5	Confident	84.5	Confident	22 Å²	22	70.4 Å²	70.4	18%	0.182	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	141.8	176.7	0	0	0	0	0	111.3	E183 E254 W256	A181-E183 PolarHBondContact O-N 3.37Å; A181-E254 HydrophobicContact CB-CG 3.93Å; A181-W256 HydrophobicContact CB-CH2 4.38Å
182	W	89.4	Confident	84.9	Confident	17 Å²	17	65.1 Å²	65.1	6%	0.064	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	44.8	172.4	-46.3	-39.6	0	0	0	115	N184 T185 A186 L206 L218 D222	W182-N184 VanDerWaalsContact C-N 3.3Å; W182-N184 PolarHBondContact O-N 3.47Å; W182-T185 PolarHBondContact O-N 3.25Å; W182-A186 WeakPolarHBondContact O-CB 3.13Å; W182-A186 PolarHBondContact O-N 2.94Å; W182-L206 HydrophobicContact CB-CD2 4.43Å; W182-L206 HydrophobicContact CE3-CB 4.44Å; W182-L206 HydrophobicContact CE3-CD2 3.91Å; W182-L218 HydrophobicContact CD2-CD1 4.18Å; W182-L218 HydrophobicContact CD2-CD2 4.13Å; W182-L218 HydrophobicContact CE3-CD2 4.45Å; W182-L218 HydrophobicContact CG-CD1 4.15Å; W182-L218 HydrophobicContact CG-CD2 4.24Å; W182-L218 HydrophobicContact CZ2-CD1 4.24Å; W182-D222 VanDerWaalsContact CA-OD2 3.26Å; W182-D222 WeakPolarHBondContact CA-OD2 3.45Å; W182-D222 HydrophobicContact CB-CB 4.49Å
183	E	88.8	Confident	85.4	Confident	86 Å²	86	64.1 Å²	64.1	40%	0.402	35%	0.35	S	S	.	.	H	α-helix	trans	-58.7	-37.9	-175.7	-59.8	-175.6	168.7	0	0	113.1	T180 A181 A186 H187	T180-E183 VanDerWaalsContact O-CG 3.28Å; T180-E183 WeakPolarHBondContact O-CG 3.42Å; T180-E183 PolarHBondContact OG1-OE1 3.49Å; A181-E183 PolarHBondContact O-N 3.37Å; E183-A186 PolarHBondContact O-N 3.28Å; E183-H187 WeakPolarHBondContact O-CB 3.48Å; E183-H187 PolarHBondContact O-N 2.86Å
184	N	90.4	Very high	85.4	Confident	61 Å²	61	67.6 Å²	67.6	33%	0.326	37%	0.366	S	S	.	.	H	α-helix	trans	-69.4	-42.9	-179.2	-60.4	-74.9	0	0	0	110.7	W182 H187 L188 D219 D222	W182-N184 VanDerWaalsContact C-N 3.3Å; W182-N184 PolarHBondContact O-N 3.47Å; N184-H187 WeakPolarHBondContact O-CB 3.25Å; N184-H187 PolarHBondContact O-N 3.44Å; N184-L188 VanDerWaalsContact O-CG 3.32Å; N184-L188 WeakPolarHBondContact O-CG 3.32Å; N184-L188 PolarHBondContact O-N 2.79Å; N184-D219 HydrophobicContact CB-CB 4.02Å; N184-D222 WeakPolarHBondContact CB-OD1 3.43Å; N184-D222 PolarHBondContact N-OD1 3.09Å; N184-D222 PolarHBondContact N-OD2 3.32Å; N184-D222 PolarHBondContact ND2-OD1 3.06Å
185	T	92	Very high	85.6	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-65.8	-42.1	176.8	-51	0	0	0	0	110.3	W182 H187 L188 L189 V203 L206 L218 D219 D222	W182-T185 PolarHBondContact O-N 3.25Å; T185-H187 VanDerWaalsContact C-N 3.33Å; T185-H187 PolarHBondContact O-N 3.37Å; T185-L188 PolarHBondContact O-N 3.24Å; T185-L189 HydrophobicContact CG2-CD1 4.43Å; T185-L189 WeakPolarHBondContact O-CB 3.42Å; T185-L189 WeakPolarHBondContact O-CG 3.36Å; T185-L189 PolarHBondContact O-N 3.23Å; T185-V203 HydrophobicContact CG2-CG2 3.61Å; T185-L206 HydrophobicContact CG2-CD2 3.98Å; T185-L218 HydrophobicContact CG2-CD2 4.04Å; T185-D219 WeakPolarHBondContact OG1-CB 3.49Å; T185-D219 PolarHBondContact OG1-N 3.3Å; T185-D222 VanDerWaalsContact CB-OD2 3.25Å; T185-D222 WeakPolarHBondContact CB-OD2 3.36Å; T185-D222 PolarHBondContact N-OD2 3.4Å; T185-D222 PolarHBondContact OG1-OD2 3.38Å
186	A	91.1	Very high	86	Confident	37 Å²	37	67.9 Å²	67.9	31%	0.306	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-43.2	174	0	0	0	0	0	112.1	W182 E183 L189 S190 L206	W182-A186 WeakPolarHBondContact O-CB 3.13Å; W182-A186 PolarHBondContact O-N 2.94Å; E183-A186 PolarHBondContact O-N 3.28Å; A186-L189 PolarHBondContact O-N 3.48Å; A186-S190 PolarHBondContact O-N 2.98Å; A186-S190 VanDerWaalsContact O-N 3.13Å; A186-L206 HydrophobicContact CB-CD1 3.55Å
187	H	91.7	Very high	86.3	Confident	118 Å²	118	67.8 Å²	67.8	55%	0.546	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-47.1	174.6	177.1	-86	0	0	0	111.4	E183 N184 T185 L189 S190 Y191	E183-H187 WeakPolarHBondContact O-CB 3.48Å; E183-H187 PolarHBondContact O-N 2.86Å; N184-H187 WeakPolarHBondContact O-CB 3.25Å; N184-H187 PolarHBondContact O-N 3.44Å; T185-H187 VanDerWaalsContact C-N 3.33Å; T185-H187 PolarHBondContact O-N 3.37Å; H187-L189 VanDerWaalsContact C-N 3.33Å; H187-L189 PolarHBondContact O-N 3.33Å; H187-S190 PolarHBondContact O-N 3.05Å; H187-S190 VanDerWaalsContact O-N 3.12Å; H187-S190 PolarHBondContact O-OG 3.32Å; H187-Y191 PolarHBondContact O-N 3.24Å; H187-Y191 VanDerWaalsContact O-N 3.16Å
188	L	91	Very high	86.6	Confident	42 Å²	42	66 Å²	66	22%	0.22	36%	0.364	C	S	.	.	H	α-helix	trans	-61.4	-39.6	177.7	-70.7	177.6	0	0	0	112.4	N184 T185 S190 Y191 L192 L202 D219	N184-L188 VanDerWaalsContact O-CG 3.32Å; N184-L188 WeakPolarHBondContact O-CG 3.32Å; N184-L188 PolarHBondContact O-N 2.79Å; T185-L188 PolarHBondContact O-N 3.24Å; L188-S190 VanDerWaalsContact C-N 3.27Å; L188-S190 PolarHBondContact O-N 3.03Å; L188-Y191 PolarHBondContact O-N 3.23Å; L188-L192 HydrophobicContact CB-CD1 4.1Å; L188-L192 HydrophobicContact CD2-CD1 4.08Å; L188-L192 HydrophobicContact CD2-CG 4.44Å; L188-L192 VanDerWaalsContact O-CB 3.26Å; L188-L192 WeakPolarHBondContact O-CB 3.28Å; L188-L192 WeakPolarHBondContact O-CG 3.07Å; L188-L192 PolarHBondContact O-N 2.66Å; L188-L202 HydrophobicContact CB-CD1 4.43Å; L188-L202 HydrophobicContact CD1-CD1 3.92Å; L188-D219 HydrophobicContact CD1-CB 4.09Å; L188-D219 WeakPolarHBondContact CD1-OD2 3.21Å
189	L	90.7	Very high	87.3	Confident	39 Å²	39	70.7 Å²	70.7	20%	0.204	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-34.6	174.2	-81.1	173.5	0	0	0	113	T185 A186 H187 L197 V203 L206	T185-L189 HydrophobicContact CG2-CD1 4.43Å; T185-L189 WeakPolarHBondContact O-CB 3.42Å; T185-L189 WeakPolarHBondContact O-CG 3.36Å; T185-L189 PolarHBondContact O-N 3.23Å; A186-L189 PolarHBondContact O-N 3.48Å; H187-L189 VanDerWaalsContact C-N 3.33Å; H187-L189 PolarHBondContact O-N 3.33Å; L189-L197 HydrophobicContact CD2-CD1 3.64Å; L189-L197 HydrophobicContact CD2-CD2 3.93Å; L189-L197 HydrophobicContact CD2-CG 4.45Å; L189-V203 WeakPolarHBondContact CD2-O 3.48Å; L189-L206 HydrophobicContact CD1-CD1 4Å; L189-L206 HydrophobicContact CD1-CD2 3.73Å; L189-L206 HydrophobicContact CD1-CG 3.54Å
190	S	90.1	Very high	87.9	Confident	98 Å²	98	70.9 Å²	70.9	69%	0.685	38%	0.376	S	S	*	.	H	α-helix	trans	-76.1	-25.3	178.3	76.3	0	0	0	0	113.5	A186 H187 L188	A186-S190 PolarHBondContact O-N 2.98Å; A186-S190 VanDerWaalsContact O-N 3.13Å; H187-S190 PolarHBondContact O-N 3.05Å; H187-S190 VanDerWaalsContact O-N 3.12Å; H187-S190 PolarHBondContact O-OG 3.32Å; L188-S190 VanDerWaalsContact C-N 3.27Å; L188-S190 PolarHBondContact O-N 3.03Å
191	Y	89.4	Confident	88.4	Confident	182 Å²	182	73 Å²	73	71%	0.714	38%	0.381	S	S	*	.	H	α-helix	trans	-104.1	-37.3	-171.8	-174.7	-96	0	0	0	113.6	H187 L188	H187-Y191 PolarHBondContact O-N 3.24Å; H187-Y191 VanDerWaalsContact O-N 3.16Å; L188-Y191 PolarHBondContact O-N 3.23Å
192	L	89.7	Confident	88.7	Confident	35 Å²	35	72.7 Å²	72.7	18%	0.183	38%	0.376	C	S	.	.	S	Bend	trans	-84.5	147.5	-175.5	-64.7	178	0	0	0	112.3	L188 E196 L197 L202	L188-L192 HydrophobicContact CB-CD1 4.1Å; L188-L192 HydrophobicContact CD2-CD1 4.08Å; L188-L192 HydrophobicContact CD2-CG 4.44Å; L188-L192 VanDerWaalsContact O-CB 3.26Å; L188-L192 WeakPolarHBondContact O-CB 3.28Å; L188-L192 WeakPolarHBondContact O-CG 3.07Å; L188-L192 PolarHBondContact O-N 2.66Å; L192-E196 HydrophobicContact CB-CB 4.23Å; L192-E196 HydrophobicContact CD2-CB 4.32Å; L192-L197 HydrophobicContact CB-CD2 3.97Å; L192-L197 HydrophobicContact CB-CG 4.05Å; L192-L197 HydrophobicContact CD1-CD2 4.04Å; L192-L202 HydrophobicContact CD1-CD1 4.07Å
193	S	88.7	Confident	88.7	Confident	56 Å²	56	72 Å²	72	39%	0.392	37%	0.373	S	S	.	.			trans	-74.8	158.3	172	66.8	0	0	0	0	112.2	A195 E196 L197	S193-A195 PolarHBondContact O-N 3.04Å; S193-A195 VanDerWaalsContact O-N 3.1Å; S193-E196 WeakPolarHBondContact CB-OE2 3.43Å; S193-E196 PolarHBondContact N-OE2 3.07Å; S193-E196 PolarHBondContact O-N 3.16Å; S193-E196 VanDerWaalsContact OG-CD 3.26Å; S193-E196 WeakPolarHBondContact OG-CG 3.43Å; S193-E196 PolarHBondContact OG-N 3.05Å; S193-E196 PolarHBondContact OG-OE2 2.76Å; S193-L197 PolarHBondContact O-N 3.11Å
194	Q	84.5	Confident	88.6	Confident	109 Å²	109	71.9 Å²	71.9	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-57.6	-29.9	179.7	-166.3	67.6	-8.6	0	0	113.9	T198 K204	Q194-T198 PolarHBondContact O-N 3.39Å; Q194-T198 PolarHBondContact O-OG1 3.35Å; Q194-K204 VanDerWaalsContact NE2-CD 3.3Å
195	A	85.5	Confident	88.4	Confident	76 Å²	76	75.4 Å²	75.4	63%	0.628	39%	0.386	S	S	*	.	H	α-helix	trans	-71.9	-40.9	175.8	0	0	0	0	0	111.8	S193 T198 K199	S193-A195 PolarHBondContact O-N 3.04Å; S193-A195 VanDerWaalsContact O-N 3.1Å; A195-T198 PolarHBondContact O-N 3.34Å; A195-K199 WeakPolarHBondContact O-CB 3.33Å; A195-K199 PolarHBondContact O-N 3.49Å
196	E	87.3	Confident	88.2	Confident	85 Å²	85	79 Å²	79	40%	0.397	41%	0.405	S	S	.	.	H	α-helix	trans	-68	-42.3	176.7	-71.1	163.3	148.4	0	0	111.3	L192 S193 T198 K199 H200	L192-E196 HydrophobicContact CB-CB 4.23Å; L192-E196 HydrophobicContact CD2-CB 4.32Å; S193-E196 WeakPolarHBondContact CB-OE2 3.43Å; S193-E196 PolarHBondContact N-OE2 3.07Å; S193-E196 PolarHBondContact O-N 3.16Å; S193-E196 VanDerWaalsContact OG-CD 3.26Å; S193-E196 WeakPolarHBondContact OG-CG 3.43Å; S193-E196 PolarHBondContact OG-N 3.05Å; S193-E196 PolarHBondContact OG-OE2 2.76Å; E196-T198 VanDerWaalsContact C-N 3.31Å; E196-T198 PolarHBondContact O-N 3.43Å; E196-K199 WeakPolarHBondContact O-CB 3.48Å; E196-K199 PolarHBondContact O-N 3.24Å; E196-K199 VanDerWaalsContact O-N 3.11Å; E196-H200 PolarHBondContact O-CD2 3.36Å; E196-H200 PolarHBondContact O-N 3.28Å
197	L	84.4	Confident	88.1	Confident	4 Å²	4	80 Å²	80	2%	0.021	40%	0.404	C	S	.	.	H	α-helix	trans	-56.9	-45.1	174.7	-69.6	172.1	0	0	0	111.8	L189 L192 S193 K199 H200 H201 L202	L189-L197 HydrophobicContact CD2-CD1 3.64Å; L189-L197 HydrophobicContact CD2-CD2 3.93Å; L189-L197 HydrophobicContact CD2-CG 4.45Å; L192-L197 HydrophobicContact CB-CD2 3.97Å; L192-L197 HydrophobicContact CB-CG 4.05Å; L192-L197 HydrophobicContact CD1-CD2 4.04Å; S193-L197 PolarHBondContact O-N 3.11Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 3.06Å; L197-H200 PolarHBondContact O-N 2.97Å; L197-H201 PolarHBondContact O-N 3.42Å; L197-H201 VanDerWaalsContact O-N 3.09Å; L197-L202 HydrophobicContact CD2-CB 3.97Å; L197-L202 HydrophobicContact CD2-CD1 4.07Å; L197-L202 PolarHBondContact O-N 3.17Å
198	T	86.3	Confident	87.7	Confident	70 Å²	70	77.1 Å²	77.1	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-67.2	-35.1	178.1	-50.5	0	0	0	0	111.6	Q194 A195 E196 H201 K204	Q194-T198 PolarHBondContact O-N 3.39Å; Q194-T198 PolarHBondContact O-OG1 3.35Å; A195-T198 PolarHBondContact O-N 3.34Å; E196-T198 VanDerWaalsContact C-N 3.31Å; E196-T198 PolarHBondContact O-N 3.43Å; T198-H201 PolarHBondContact O-N 3.33Å; T198-K204 WeakPolarHBondContact OG1-CE 3.4Å; T198-K204 PolarHBondContact OG1-NZ 3.15Å
199	K	88	Confident	87.5	Confident	161 Å²	161	79.5 Å²	79.5	70%	0.7	41%	0.408	S	S	*	.	H	α-helix	trans	-67.4	-38.6	176.1	-176.7	-176.3	176.8	-173.1	0	112.3	A195 E196 L197 H201	A195-K199 WeakPolarHBondContact O-CB 3.33Å; A195-K199 PolarHBondContact O-N 3.49Å; E196-K199 WeakPolarHBondContact O-CB 3.48Å; E196-K199 PolarHBondContact O-N 3.24Å; E196-K199 VanDerWaalsContact O-N 3.11Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 3.06Å; K199-H201 VanDerWaalsContact C-N 3.27Å; K199-H201 PolarHBondContact O-ND1 2.76Å
200	H	84.6	Confident	87.3	Confident	114 Å²	114	77.8 Å²	77.8	53%	0.528	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	0.6	178.1	-72.7	-71.9	0	0	0	113.4	E196 L197 L202	E196-H200 PolarHBondContact O-CD2 3.36Å; E196-H200 PolarHBondContact O-N 3.28Å; L197-H200 PolarHBondContact O-N 2.97Å; H200-L202 HydrophobicContact CB-CD1 3.91Å; H200-L202 HydrophobicContact CB-CG 3.91Å; H200-L202 PolarHBondContact O-N 3.38Å
201	H	89.4	Confident	87.2	Confident	121 Å²	121	75.3 Å²	75.3	56%	0.56	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	34.5	-175.3	-54.4	77.3	0	0	0	112.4	L197 T198 K199 N216 E217	L197-H201 PolarHBondContact O-N 3.42Å; L197-H201 VanDerWaalsContact O-N 3.09Å; T198-H201 PolarHBondContact O-N 3.33Å; K199-H201 VanDerWaalsContact C-N 3.27Å; K199-H201 PolarHBondContact O-ND1 2.76Å; H201-N216 CarbonylContact O-C 3.52Å; H201-N216 WeakPolarHBondContact O-CA 3.42Å; H201-N216 VanDerWaalsContact O-CB 3.26Å; H201-N216 WeakPolarHBondContact O-CB 3.47Å; H201-E217 PolarHBondContact O-N 3.08Å
202	L	89.1	Confident	87	Confident	15 Å²	15	68 Å²	68	8%	0.079	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-86	147.1	178.6	-71.1	171.1	0	0	0	110.9	L188 L192 L197 H200 E217	L188-L202 HydrophobicContact CB-CD1 4.43Å; L188-L202 HydrophobicContact CD1-CD1 3.92Å; L192-L202 HydrophobicContact CD1-CD1 4.07Å; L197-L202 HydrophobicContact CD2-CB 3.97Å; L197-L202 HydrophobicContact CD2-CD1 4.07Å; L197-L202 PolarHBondContact O-N 3.17Å; H200-L202 HydrophobicContact CB-CD1 3.91Å; H200-L202 HydrophobicContact CB-CG 3.91Å; H200-L202 PolarHBondContact O-N 3.38Å; L202-E217 WeakPolarHBondContact CA-O 3.31Å
203	V	90	Very high	86.7	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	38%	0.377	C	S	.	.			trans	-57.2	148.8	171.9	-67.6	0	0	0	0	111	T185 L189 L206 A210 V211 N216 E217 L218	T185-V203 HydrophobicContact CG2-CG2 3.61Å; L189-V203 WeakPolarHBondContact CD2-O 3.48Å; V203-L206 HydrophobicContact CG2-CD2 4.34Å; V203-A210 HydrophobicContact CB-CB 4.34Å; V203-A210 HydrophobicContact CG1-CB 4.09Å; V203-V211 HydrophobicContact CG1-CG2 3.91Å; V203-N216 HydrophobicContact CG1-CB 4.02Å; V203-E217 PolarHBondContact N-O 3.32Å; V203-E217 VanDerWaalsContact N-O 3.09Å; V203-L218 HydrophobicContact CG2-CD2 3.81Å
204	K	87.2	Confident	86.5	Confident	84 Å²	84	73 Å²	73	37%	0.365	38%	0.379	S	S	.	.	S	Bend	trans	-100.8	-21.7	-176.4	-70.9	168.5	172.1	179.8	0	113.3	Q194 T198	Q194-K204 VanDerWaalsContact NE2-CD 3.3Å; T198-K204 WeakPolarHBondContact OG1-CE 3.4Å; T198-K204 PolarHBondContact OG1-NZ 3.15Å
205	E	86.5	Confident	86.4	Confident	135 Å²	135	70.8 Å²	70.8	63%	0.631	39%	0.385	S	S	*	.	S	Bend	trans	-137.4	145	-179.8	-65	-178.3	-175.5	0	0	108.3	A210	E205-A210 WeakPolarHBondContact O-CB 3.43Å
206	L	86.8	Confident	86.5	Confident	76 Å²	76	68.6 Å²	68.6	40%	0.398	36%	0.363	S	S	.	.			trans	-98.6	92.5	179.1	-64	172.1	0	0	0	109.7	W182 T185 A186 L189 V203	W182-L206 HydrophobicContact CB-CD2 4.43Å; W182-L206 HydrophobicContact CE3-CB 4.44Å; W182-L206 HydrophobicContact CE3-CD2 3.91Å; T185-L206 HydrophobicContact CG2-CD2 3.98Å; A186-L206 HydrophobicContact CB-CD1 3.55Å; L189-L206 HydrophobicContact CD1-CD1 4Å; L189-L206 HydrophobicContact CD1-CD2 3.73Å; L189-L206 HydrophobicContact CD1-CG 3.54Å; V203-L206 HydrophobicContact CG2-CD2 4.34Å
207	H	88.3	Confident	86.5	Confident	60 Å²	60	70.4 Å²	70.4	28%	0.278	37%	0.372	S	S	.	.	S	Bend	trans	-140	161.7	168.7	65.7	75.2	0	0	0	109.5	D209 A210	H207-D209 VanDerWaalsContact C-N 3.27Å; H207-D209 VanDerWaalsContact CE1-C 3.42Å; H207-D209 PolarHBondContact ND1-N 3.4Å; H207-D209 PolarHBondContact O-N 2.82Å; H207-D209 VanDerWaalsContact O-N 3.16Å; H207-A210 WeakPolarHBondContact CE1-CA 3.32Å; H207-A210 PolarHBondContact CE1-N 3.47Å; H207-A210 PolarHBondContact ND1-N 3.23Å; H207-A210 VanDerWaalsContact ND1-N 3.17Å; H207-A210 WeakPolarHBondContact O-CB 3.46Å; H207-A210 PolarHBondContact O-N 2.88Å
208	P	84.8	Confident	86.7	Confident	56 Å²	56	70.7 Å²	70.7	36%	0.364	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-41	-171.5	-28.9	37.2	0	0	0	114	A210 W256	P208-A210 PolarHBondContact O-N 2.94Å; P208-W256 HydrophobicContact CB-CD2 4.48Å; P208-W256 HydrophobicContact CB-CG 4.21Å; P208-W256 HydrophobicContact CG-CB 4.19Å; P208-W256 VanDerWaalsContact CG-CD1 3.43Å; P208-W256 HydrophobicContact CG-CD2 3.54Å; P208-W256 HydrophobicContact CG-CE3 4.25Å; P208-W256 HydrophobicContact CG-CG 3.46Å; P208-W256 VanDerWaalsContact CG-CG 3.46Å; P208-W256 HydrophobicContact CG-CZ2 4.3Å
209	D	86.2	Confident	87	Confident	93 Å²	93	69.1 Å²	69.1	50%	0.497	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	6.6	-177.8	-56	-38	0	0	0	114.4	H207 V211 T212 L213	H207-D209 VanDerWaalsContact C-N 3.27Å; H207-D209 VanDerWaalsContact CE1-C 3.42Å; H207-D209 PolarHBondContact ND1-N 3.4Å; H207-D209 PolarHBondContact O-N 2.82Å; H207-D209 VanDerWaalsContact O-N 3.16Å; D209-V211 VanDerWaalsContact C-N 3.33Å; D209-V211 PolarHBondContact O-N 3.23Å; D209-T212 PolarHBondContact O-N 3.42Å; D209-T212 VanDerWaalsContact O-N 3.1Å; D209-L213 HydrophobicContact CB-CD1 4.04Å; D209-L213 HydrophobicContact CB-CG 3.95Å; D209-L213 WeakPolarHBondContact O-CB 3.33Å; D209-L213 WeakPolarHBondContact O-CG 3.2Å; D209-L213 PolarHBondContact O-N 2.96Å
210	A	87.5	Confident	87.1	Confident	3 Å²	3	68.8 Å²	68.8	3%	0.025	36%	0.363	C	S	.	.	H	α-helix	trans	-59.2	-44.5	-169.6	0	0	0	0	0	112.3	V203 E205 H207 P208 T214	V203-A210 HydrophobicContact CB-CB 4.34Å; V203-A210 HydrophobicContact CG1-CB 4.09Å; E205-A210 WeakPolarHBondContact O-CB 3.43Å; H207-A210 WeakPolarHBondContact CE1-CA 3.32Å; H207-A210 PolarHBondContact CE1-N 3.47Å; H207-A210 PolarHBondContact ND1-N 3.23Å; H207-A210 VanDerWaalsContact ND1-N 3.17Å; H207-A210 WeakPolarHBondContact O-CB 3.46Å; H207-A210 PolarHBondContact O-N 2.88Å; P208-A210 PolarHBondContact O-N 2.94Å; A210-T214 WeakPolarHBondContact O-CB 3.43Å; A210-T214 WeakPolarHBondContact O-CG2 3.5Å; A210-T214 PolarHBondContact O-N 2.73Å; A210-T214 VanDerWaalsContact O-N 3.13Å; A210-T214 PolarHBondContact O-OG1 2.97Å
211	V	87.1	Confident	87.3	Confident	46 Å²	46	69.8 Å²	69.8	28%	0.279	37%	0.366	S	S	.	.	H	α-helix	trans	-63.8	-47.4	175.7	175.5	0	0	0	0	110.4	V203 D209 L213 G215 N216 L218	V203-V211 HydrophobicContact CG1-CG2 3.91Å; D209-V211 VanDerWaalsContact C-N 3.33Å; D209-V211 PolarHBondContact O-N 3.23Å; V211-L213 PolarHBondContact O-N 3.25Å; V211-G215 VanDerWaalsContact O-CA 3.32Å; V211-G215 WeakPolarHBondContact O-CA 3.5Å; V211-G215 PolarHBondContact O-N 2.97Å; V211-N216 WeakPolarHBondContact CA-O 3.4Å; V211-N216 WeakPolarHBondContact CG1-O 3.24Å; V211-L218 HydrophobicContact CG2-CD1 4.34Å; V211-L218 HydrophobicContact CG2-CD2 4.14Å; V211-L218 HydrophobicContact CG2-CG 3.8Å
212	T	84.1	Confident	87.4	Confident	28 Å²	28	64.2 Å²	64.2	17%	0.172	34%	0.34	C	S	.	.	H	α-helix	trans	-66.9	-39.2	-175.4	-47.2	0	0	0	0	113.4	D209 K323 L324	D209-T212 PolarHBondContact O-N 3.42Å; D209-T212 VanDerWaalsContact O-N 3.1Å; T212-K323 HydrophobicContact CG2-CB 4.27Å; T212-K323 HydrophobicContact CG2-CD 4.24Å; T212-L324 HydrophobicContact CG2-CD2 4.25Å
213	L	84.4	Confident	87.4	Confident	126 Å²	126	64.7 Å²	64.7	66%	0.66	34%	0.342	S	S	*	.	H	α-helix	trans	-75.7	-45	-179.3	-71.1	-179.2	0	0	0	112	D209 V211	D209-L213 HydrophobicContact CB-CD1 4.04Å; D209-L213 HydrophobicContact CB-CG 3.95Å; D209-L213 WeakPolarHBondContact O-CB 3.33Å; D209-L213 WeakPolarHBondContact O-CG 3.2Å; D209-L213 PolarHBondContact O-N 2.96Å; V211-L213 PolarHBondContact O-N 3.25Å
214	T	84.2	Confident	87.4	Confident	70 Å²	70	68.6 Å²	68.6	43%	0.429	36%	0.362	S	S	.	.	H	α-helix	trans	-91.3	-23.1	-172.1	66.7	0	0	0	0	113.5	A210 N216	A210-T214 WeakPolarHBondContact O-CB 3.43Å; A210-T214 WeakPolarHBondContact O-CG2 3.5Å; A210-T214 PolarHBondContact O-N 2.73Å; A210-T214 VanDerWaalsContact O-N 3.13Å; A210-T214 PolarHBondContact O-OG1 2.97Å; T214-N216 WeakPolarHBondContact CB-ND2 3.24Å; T214-N216 PolarHBondContact O-N 3.08Å; T214-N216 WeakPolarHBondContact OG1-CB 3.48Å; T214-N216 PolarHBondContact OG1-N 3.23Å; T214-N216 PolarHBondContact OG1-ND2 3.35Å
215	G	82.4	Confident	87.4	Confident	63 Å²	63	66.6 Å²	66.6	65%	0.649	36%	0.355	S	S	*	.			trans	72.9	5.4	-170.5	0	0	0	0	0	113.9	V211	V211-G215 VanDerWaalsContact O-CA 3.32Å; V211-G215 WeakPolarHBondContact O-CA 3.5Å; V211-G215 PolarHBondContact O-N 2.97Å
216	N	86.9	Confident	87.5	Confident	30 Å²	30	60.8 Å²	60.8	16%	0.16	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-84.5	157.9	175.1	-65	-38.7	0	0	0	110.8	H201 V203 V211 T214	H201-N216 CarbonylContact O-C 3.52Å; H201-N216 WeakPolarHBondContact O-CA 3.42Å; H201-N216 VanDerWaalsContact O-CB 3.26Å; H201-N216 WeakPolarHBondContact O-CB 3.47Å; V203-N216 HydrophobicContact CG1-CB 4.02Å; V211-N216 WeakPolarHBondContact CA-O 3.4Å; V211-N216 WeakPolarHBondContact CG1-O 3.24Å; T214-N216 WeakPolarHBondContact CB-ND2 3.24Å; T214-N216 PolarHBondContact O-N 3.08Å; T214-N216 WeakPolarHBondContact OG1-CB 3.48Å; T214-N216 PolarHBondContact OG1-N 3.23Å; T214-N216 PolarHBondContact OG1-ND2 3.35Å
217	E	87.6	Confident	87.6	Confident	123 Å²	123	59.6 Å²	59.6	58%	0.575	32%	0.322	S	S	*	.	B	Isolated β-bridge	trans	-100.2	160.6	-175.4	-59.7	-171.6	157.1	0	0	112.3	H201 L202 V203	H201-E217 PolarHBondContact O-N 3.08Å; L202-E217 WeakPolarHBondContact CA-O 3.31Å; V203-E217 PolarHBondContact N-O 3.32Å; V203-E217 VanDerWaalsContact N-O 3.09Å
218	L	89.5	Confident	87.6	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.052	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-79.8	167.7	165.1	-62.6	173.4	0	0	0	109.8	W182 T185 V203 V211 D222	W182-L218 HydrophobicContact CD2-CD1 4.18Å; W182-L218 HydrophobicContact CD2-CD2 4.13Å; W182-L218 HydrophobicContact CE3-CD2 4.45Å; W182-L218 HydrophobicContact CG-CD1 4.15Å; W182-L218 HydrophobicContact CG-CD2 4.24Å; W182-L218 HydrophobicContact CZ2-CD1 4.24Å; T185-L218 HydrophobicContact CG2-CD2 4.04Å; V203-L218 HydrophobicContact CG2-CD2 3.81Å; V211-L218 HydrophobicContact CG2-CD1 4.34Å; V211-L218 HydrophobicContact CG2-CD2 4.14Å; V211-L218 HydrophobicContact CG2-CG 3.8Å; L218-D222 HydrophobicContact CB-CB 4.35Å
219	D	91.8	Very high	87.9	Confident	37 Å²	37	58.8 Å²	58.8	20%	0.198	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-53	144.4	166.4	-179	-96.9	0	0	0	110.6	N184 T185 L188 K221 D222 Q223	N184-D219 HydrophobicContact CB-CB 4.02Å; T185-D219 WeakPolarHBondContact OG1-CB 3.49Å; T185-D219 PolarHBondContact OG1-N 3.3Å; L188-D219 HydrophobicContact CD1-CB 4.09Å; L188-D219 WeakPolarHBondContact CD1-OD2 3.21Å; D219-K221 PolarHBondContact O-N 3.15Å; D219-K221 WeakPolarHBondContact OD1-CB 3.41Å; D219-K221 PolarHBondContact OD1-N 2.96Å; D219-D222 HydrophobicContact CB-CB 4.38Å; D219-D222 PolarHBondContact O-N 3.13Å; D219-D222 VanDerWaalsContact O-N 3.12Å; D219-Q223 PolarHBondContact O-N 3.3Å
220	Q	90.6	Very high	88.1	Confident	154 Å²	154	54.7 Å²	54.7	72%	0.72	29%	0.288	S	S	*	.	H	α-helix	trans	-57.5	-37.2	-175.1	-170.8	-178.7	13.2	0	0	112.6	I224	Q220-I224 HydrophobicContact CG-CD1 4.12Å; Q220-I224 WeakPolarHBondContact O-CD1 3.46Å; Q220-I224 VanDerWaalsContact O-CG1 3.26Å; Q220-I224 WeakPolarHBondContact O-CG1 3.43Å; Q220-I224 PolarHBondContact O-N 3.47Å
221	K	89.5	Confident	88.3	Confident	134 Å²	134	57.2 Å²	57.2	58%	0.583	30%	0.301	S	S	*	.	H	α-helix	trans	-68.6	-46.6	178.2	-65.9	179.9	179.3	175.4	0	110.9	D219 Q223 I224 D225	D219-K221 PolarHBondContact O-N 3.15Å; D219-K221 WeakPolarHBondContact OD1-CB 3.41Å; D219-K221 PolarHBondContact OD1-N 2.96Å; K221-Q223 VanDerWaalsContact C-N 3.26Å; K221-Q223 PolarHBondContact O-N 3.02Å; K221-I224 PolarHBondContact O-N 3.44Å; K221-D225 PolarHBondContact O-N 3.41Å
222	D	90.9	Very high	88.5	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.027	29%	0.29	C	S	.	.	H	α-helix	trans	-60.8	-38.3	177.2	-71.2	-13.7	0	0	0	111.4	W182 N184 T185 L218 D219 D225 N226	W182-D222 VanDerWaalsContact CA-OD2 3.26Å; W182-D222 WeakPolarHBondContact CA-OD2 3.45Å; W182-D222 HydrophobicContact CB-CB 4.49Å; N184-D222 WeakPolarHBondContact CB-OD1 3.43Å; N184-D222 PolarHBondContact N-OD1 3.09Å; N184-D222 PolarHBondContact N-OD2 3.32Å; N184-D222 PolarHBondContact ND2-OD1 3.06Å; T185-D222 VanDerWaalsContact CB-OD2 3.25Å; T185-D222 WeakPolarHBondContact CB-OD2 3.36Å; T185-D222 PolarHBondContact N-OD2 3.4Å; T185-D222 PolarHBondContact OG1-OD2 3.38Å; L218-D222 HydrophobicContact CB-CB 4.35Å; D219-D222 HydrophobicContact CB-CB 4.38Å; D219-D222 PolarHBondContact O-N 3.13Å; D219-D222 VanDerWaalsContact O-N 3.12Å; D222-D225 PolarHBondContact O-N 2.95Å; D222-N226 WeakPolarHBondContact O-CB 3.48Å; D222-N226 PolarHBondContact O-N 3.46Å
223	Q	89.5	Confident	88.9	Confident	25 Å²	25	54.3 Å²	54.3	12%	0.117	28%	0.282	C	S	.	.	H	α-helix	trans	-66.1	-44	177	-171.3	62.5	50.6	0	0	112	D219 K221 D225 N226 D227 R325	D219-Q223 PolarHBondContact O-N 3.3Å; K221-Q223 VanDerWaalsContact C-N 3.26Å; K221-Q223 PolarHBondContact O-N 3.02Å; Q223-D225 VanDerWaalsContact C-N 3.34Å; Q223-N226 PolarHBondContact O-N 2.83Å; Q223-D227 PolarHBondContact NE2-OD1 3.14Å; Q223-D227 WeakPolarHBondContact O-CB 3.37Å; Q223-D227 VanDerWaalsContact O-CG 3.24Å; Q223-D227 PolarHBondContact O-N 2.79Å; Q223-R325 VanDerWaalsContact NE2-CZ 3.26Å; Q223-R325 VanDerWaalsContact NE2-NE 3.15Å
224	I	88.8	Confident	89.3	Confident	83 Å²	83	48.6 Å²	48.6	43%	0.426	25%	0.252	S	S	.	.	H	α-helix	trans	-62.8	-43.5	177.4	-69.8	165.2	0	0	0	110.6	Q220 K221 D227 R228	Q220-I224 HydrophobicContact CG-CD1 4.12Å; Q220-I224 WeakPolarHBondContact O-CD1 3.46Å; Q220-I224 VanDerWaalsContact O-CG1 3.26Å; Q220-I224 WeakPolarHBondContact O-CG1 3.43Å; Q220-I224 PolarHBondContact O-N 3.47Å; K221-I224 PolarHBondContact O-N 3.44Å; I224-D227 PolarHBondContact O-N 2.97Å; I224-R228 PolarHBondContact O-N 2.95Å
225	D	87.3	Confident	89.7	Confident	42 Å²	42	47.6 Å²	47.6	23%	0.225	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-35	179.1	-72.9	-19	0	0	0	111.8	K221 D222 Q223 R228 F229 R252	K221-D225 PolarHBondContact O-N 3.41Å; D222-D225 PolarHBondContact O-N 2.95Å; Q223-D225 VanDerWaalsContact C-N 3.34Å; D225-R228 IonicContact OD1-NH1 3.84Å; D225-F229 VanDerWaalsContact O-CB 3.27Å; D225-F229 WeakPolarHBondContact O-CB 3.33Å; D225-F229 PolarHBondContact O-N 2.87Å; D225-R252 PolarHBondContact O-NH1 2.86Å
226	N	89.6	Confident	90.2	Very high	13 Å²	13	44.6 Å²	44.6	7%	0.07	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-44.4	172.9	-168.3	72.8	0	0	0	111.8	D222 Q223 R228 F229 I230 R252	D222-N226 WeakPolarHBondContact O-CB 3.48Å; D222-N226 PolarHBondContact O-N 3.46Å; Q223-N226 PolarHBondContact O-N 2.83Å; N226-R228 PolarHBondContact O-N 3.35Å; N226-F229 PolarHBondContact O-N 3.29Å; N226-I230 WeakPolarHBondContact O-CB 3.35Å; N226-I230 VanDerWaalsContact O-CG1 3.27Å; N226-I230 WeakPolarHBondContact O-CG1 3.47Å; N226-I230 PolarHBondContact O-N 2.93Å; N226-R252 PolarHBondContact OD1-NH2 2.9Å
227	D	88.7	Confident	90.5	Very high	50 Å²	50	43.2 Å²	43.2	27%	0.267	21%	0.205	S	C	.	.	H	α-helix	trans	-62.3	-43.1	178	-73.8	-1.3	0	0	0	111.9	Q223 I224 F229 N231 R325	Q223-D227 PolarHBondContact NE2-OD1 3.14Å; Q223-D227 WeakPolarHBondContact O-CB 3.37Å; Q223-D227 VanDerWaalsContact O-CG 3.24Å; Q223-D227 PolarHBondContact O-N 2.79Å; I224-D227 PolarHBondContact O-N 2.97Å; D227-F229 VanDerWaalsContact C-N 3.34Å; D227-N231 WeakPolarHBondContact O-CB 3.32Å; D227-N231 PolarHBondContact O-N 2.95Å; D227-R325 VanDerWaalsContact OD1-CD 3.28Å; D227-R325 WeakPolarHBondContact OD1-CD 3.5Å; D227-R325 IonicContact OD1-CZ 3.76Å; D227-R325 IonicContact OD1-NE 3.89Å; D227-R325 IonicContact OD1-NH1 2.74Å; D227-R325 IonicContact OD2-CZ 3.5Å; D227-R325 IonicContact OD2-NE 3.29Å; D227-R325 IonicContact OD2-NH1 2.87Å; D227-R325 PolarHBondContact OD2-NH1 2.93Å
228	R	88	Confident	90.8	Very high	100 Å²	100	37.7 Å²	37.7	38%	0.377	18%	0.179	S	C	.	.	H	α-helix	trans	-62.8	-42.9	176	-171.8	-174.9	-67	142.9	3.3	111.2	F176 I224 D225 N226 N231 Y232	F176-R228 HydrophobicContact CE1-CG 4.29Å; F176-R228 HydrophobicContact CZ-CG 4.17Å; I224-R228 PolarHBondContact O-N 2.95Å; D225-R228 IonicContact OD1-NH1 3.84Å; N226-R228 PolarHBondContact O-N 3.35Å; R228-N231 PolarHBondContact O-N 3.34Å; R228-Y232 PolarHBondContact O-N 2.63Å
229	F	90.6	Very high	91	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-46.8	179	178.5	-114	0	0	0	112.4	F176 D225 N226 D227 N231 Y232 L233 L248 R252 R257	F176-F229 HydrophobicContact CB-CD2 4.15Å; F176-F229 HydrophobicContact CB-CE2 4.34Å; F176-F229 HydrophobicContact CD1-CB 4.06Å; F176-F229 AromaticContact CD1-CD2 3.74Å; F176-F229 HydrophobicContact CD1-CD2 3.74Å; F176-F229 HydrophobicContact CD1-CG 4.35Å; F176-F229 AromaticContact CD2-CD2 3.96Å; F176-F229 HydrophobicContact CD2-CD2 3.96Å; F176-F229 HydrophobicContact CD2-CE2 4.45Å; F176-F229 HydrophobicContact CE1-CB 3.82Å; F176-F229 HydrophobicContact CE1-CD2 4.07Å; F176-F229 HydrophobicContact CE1-CG 4.47Å; F176-F229 HydrophobicContact CE2-CD2 4.28Å; F176-F229 AromaticContact CG-CD2 3.68Å; F176-F229 HydrophobicContact CG-CD2 3.68Å; F176-F229 HydrophobicContact CG-CE2 4.27Å; F176-F229 HydrophobicContact CZ-CB 4.39Å; F176-F229 HydrophobicContact CZ-CD2 4.33Å; D225-F229 VanDerWaalsContact O-CB 3.27Å; D225-F229 WeakPolarHBondContact O-CB 3.33Å; D225-F229 PolarHBondContact O-N 2.87Å; N226-F229 PolarHBondContact O-N 3.29Å; D227-F229 VanDerWaalsContact C-N 3.34Å; F229-N231 VanDerWaalsContact C-N 3.29Å; F229-N231 PolarHBondContact O-N 3.32Å; F229-Y232 PolarHBondContact O-N 3.19Å; F229-L233 WeakPolarHBondContact O-CB 3.39Å; F229-L233 PolarHBondContact O-N 3.28Å; F229-L248 HydrophobicContact CE2-CB 4.08Å; F229-L248 HydrophobicContact CZ-CB 4.37Å; F229-R252 VanDerWaalsContact CG-NH1 3.34Å; F229-R252 HydrophobicContact CZ-CB 4.45Å; F229-R257 VanDerWaalsContact CD1-NH1 3.33Å; F229-R257 VanDerWaalsContact CE1-NH1 3.27Å
230	I	91.6	Very high	91.1	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.036	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-39.9	177	-69.5	-71	0	0	0	111.2	N226 L233 F234 F327 E328 I331	N226-I230 WeakPolarHBondContact O-CB 3.35Å; N226-I230 VanDerWaalsContact O-CG1 3.27Å; N226-I230 WeakPolarHBondContact O-CG1 3.47Å; N226-I230 PolarHBondContact O-N 2.93Å; I230-L233 PolarHBondContact O-N 3.48Å; I230-F234 WeakPolarHBondContact O-CB 3.13Å; I230-F234 PolarHBondContact O-N 3.23Å; I230-F327 HydrophobicContact CG2-CB 3.69Å; I230-E328 HydrophobicContact CG2-CB 4.03Å; I230-I331 HydrophobicContact CG2-CD1 4.23Å
231	N	91	Very high	91.2	Very high	56 Å²	56	30.8 Å²	30.8	30%	0.299	15%	0.153	S	C	.	.	H	α-helix	trans	-62.2	-46.9	174.8	-174.2	10	0	0	0	111.3	D227 R228 F229 L233 F234 L235 F327	D227-N231 WeakPolarHBondContact O-CB 3.32Å; D227-N231 PolarHBondContact O-N 2.95Å; R228-N231 PolarHBondContact O-N 3.34Å; F229-N231 VanDerWaalsContact C-N 3.29Å; F229-N231 PolarHBondContact O-N 3.32Å; N231-L233 VanDerWaalsContact C-N 3.3Å; N231-L233 PolarHBondContact O-N 3.36Å; N231-F234 WeakPolarHBondContact O-CB 3.34Å; N231-F234 PolarHBondContact O-N 2.89Å; N231-L235 WeakPolarHBondContact O-CG 3.47Å; N231-L235 PolarHBondContact O-N 3.45Å; N231-F327 HydrophobicContact CB-CD2 3.86Å; N231-F327 HydrophobicContact CB-CE2 4.11Å; N231-F327 HydrophobicContact CB-CG 4.23Å; N231-F327 WeakPolarHBondContact OD1-CZ 3.46Å
232	Y	91.4	Very high	91.3	Very high	12 Å²	12	25.6 Å²	25.6	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-37.3	176.2	-169.8	-100.3	0	0	0	112.5	I165 Y172 E173 F176 R228 F229 L235 C236 L248	I165-Y232 HydrophobicContact CG2-CE2 4.43Å; I165-Y232 WeakPolarHBondContact CG2-OH 3.39Å; Y172-Y232 HydrophobicContact CG-CE2 4.47Å; E173-Y232 HydrophobicContact CG-CE1 3.77Å; E173-Y232 WeakPolarHBondContact CG-OH 3.45Å; E173-Y232 PolarHBondContact OE1-OH 3.28Å; F176-Y232 HydrophobicContact CD2-CD1 4.33Å; F176-Y232 AromaticContact CE2-CD1 3.76Å; F176-Y232 HydrophobicContact CE2-CD1 3.76Å; F176-Y232 HydrophobicContact CE2-CD2 4.49Å; F176-Y232 HydrophobicContact CE2-CE1 4.44Å; F176-Y232 AromaticContact CE2-CG 3.78Å; F176-Y232 HydrophobicContact CE2-CG 3.78Å; F176-Y232 HydrophobicContact CZ-CG 4.4Å; R228-Y232 PolarHBondContact O-N 2.63Å; F229-Y232 PolarHBondContact O-N 3.19Å; Y232-L235 WeakPolarHBondContact O-CB 3.36Å; Y232-L235 PolarHBondContact O-N 3.28Å; Y232-C236 PolarHBondContact O-N 3.13Å; Y232-C236 PolarHBondContact O-SG 3.38Å; Y232-L248 HydrophobicContact CD1-CD1 3.9Å; Y232-L248 HydrophobicContact CE1-CD1 3.55Å
233	L	92.6	Very high	91.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-43.9	175.4	-168.6	68.1	0	0	0	111.4	F229 I230 N231 L235 C236 L237 A245 R257 L261 I331	F229-L233 WeakPolarHBondContact O-CB 3.39Å; F229-L233 PolarHBondContact O-N 3.28Å; I230-L233 PolarHBondContact O-N 3.48Å; N231-L233 VanDerWaalsContact C-N 3.3Å; N231-L233 PolarHBondContact O-N 3.36Å; L233-L235 VanDerWaalsContact C-N 3.29Å; L233-L235 PolarHBondContact O-N 3.06Å; L233-C236 WeakPolarHBondContact O-CB 3.4Å; L233-C236 PolarHBondContact O-N 2.61Å; L233-C236 VanDerWaalsContact O-N 3.17Å; L233-L237 HydrophobicContact CG-CD1 4.37Å; L233-L237 WeakPolarHBondContact O-CD1 3.28Å; L233-L237 PolarHBondContact O-N 3.25Å; L233-L237 VanDerWaalsContact O-N 3.1Å; L233-A245 HydrophobicContact CD1-CB 3.48Å; L233-A245 VanDerWaalsContact CD1-CB 3.48Å; L233-A245 WeakPolarHBondContact CD1-O 3.33Å; L233-A245 HydrophobicContact CG-CB 4.45Å; L233-R257 VanDerWaalsContact CD2-CD 3.41Å; L233-R257 HydrophobicContact CD2-CG 4.18Å; L233-L261 HydrophobicContact CD1-CD1 4.1Å; L233-L261 HydrophobicContact CD2-CD1 4.31Å; L233-L261 HydrophobicContact CG-CD1 4.42Å; L233-I331 HydrophobicContact CB-CD1 4.25Å; L233-I331 HydrophobicContact CD2-CD1 3.9Å; L233-I331 HydrophobicContact CG-CD1 4.11Å
234	F	93.8	Very high	91.5	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-40.2	172.9	175.9	-104.1	0	0	0	111.7	I230 N231 C236 L237 R238 F327 A330 I331 L342 L346 W355	I230-F234 WeakPolarHBondContact O-CB 3.13Å; I230-F234 PolarHBondContact O-N 3.23Å; N231-F234 WeakPolarHBondContact O-CB 3.34Å; N231-F234 PolarHBondContact O-N 2.89Å; F234-C236 VanDerWaalsContact C-N 3.33Å; F234-C236 PolarHBondContact O-N 3.44Å; F234-L237 PolarHBondContact O-N 3.46Å; F234-R238 HydrophobicContact CE1-CB 4.4Å; F234-R238 WeakPolarHBondContact O-CB 3.44Å; F234-R238 PolarHBondContact O-N 3.47Å; F234-F327 HydrophobicContact CB-CB 4.29Å; F234-F327 HydrophobicContact CB-CD1 4.18Å; F234-F327 AromaticContact CD1-CD1 3.63Å; F234-F327 HydrophobicContact CD1-CD1 3.63Å; F234-F327 HydrophobicContact CD1-CE1 4.02Å; F234-F327 HydrophobicContact CE1-CD1 4.29Å; F234-F327 HydrophobicContact CE1-CE1 4.43Å; F234-F327 AromaticContact CG-CD1 3.97Å; F234-F327 HydrophobicContact CG-CD1 3.97Å; F234-A330 HydrophobicContact CD2-CB 3.65Å; F234-A330 HydrophobicContact CE2-CB 3.43Å; F234-A330 VanDerWaalsContact CE2-CB 3.43Å; F234-A330 HydrophobicContact CG-CB 4.37Å; F234-A330 HydrophobicContact CZ-CB 3.98Å; F234-I331 HydrophobicContact CB-CD1 4.37Å; F234-I331 HydrophobicContact CB-CG1 4Å; F234-I331 HydrophobicContact CD2-CG1 4.06Å; F234-L342 HydrophobicContact CE2-CD1 4.23Å; F234-L342 HydrophobicContact CZ-CD1 4.3Å; F234-L346 HydrophobicContact CE1-CD2 3.8Å; F234-L346 HydrophobicContact CZ-CD2 3.62Å; F234-L346 HydrophobicContact CZ-CG 4.47Å; F234-W355 HydrophobicContact CZ-CZ3 4.48Å
235	L	91.2	Very high	91.7	Very high	48 Å²	48	28.9 Å²	28.9	25%	0.251	14%	0.143	S	C	.	.	H	α-helix	trans	-61.4	-40.4	174.6	-68.1	175.1	0	0	0	112.1	I165 N231 Y232 L233 L237 R238 G239	I165-L235 HydrophobicContact CD1-CB 4.07Å; I165-L235 VanDerWaalsContact CD1-O 3.31Å; I165-L235 WeakPolarHBondContact CD1-O 3.48Å; N231-L235 WeakPolarHBondContact O-CG 3.47Å; N231-L235 PolarHBondContact O-N 3.45Å; Y232-L235 WeakPolarHBondContact O-CB 3.36Å; Y232-L235 PolarHBondContact O-N 3.28Å; L233-L235 VanDerWaalsContact C-N 3.29Å; L233-L235 PolarHBondContact O-N 3.06Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 3.42Å; L235-R238 CarbonylContact O-C 3.56Å; L235-R238 PolarHBondContact O-N 3.06Å; L235-G239 PolarHBondContact O-N 3.28Å
236	C	93.1	Very high	92	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.1	-42.8	174.4	-61.9	0	0	0	0	111.5	Y232 L233 F234 G239 G240 D241 A245	Y232-C236 PolarHBondContact O-N 3.13Å; Y232-C236 PolarHBondContact O-SG 3.38Å; L233-C236 WeakPolarHBondContact O-CB 3.4Å; L233-C236 PolarHBondContact O-N 2.61Å; L233-C236 VanDerWaalsContact O-N 3.17Å; F234-C236 VanDerWaalsContact C-N 3.33Å; F234-C236 PolarHBondContact O-N 3.44Å; C236-G239 CarbonylContact O-C 3.58Å; C236-G239 PolarHBondContact O-N 3.35Å; C236-G240 PolarHBondContact O-N 3.49Å; C236-D241 PolarHBondContact O-N 3.28Å; C236-A245 HydrophobicContact CB-CB 3.79Å
237	L	94.3	Very high	92.1	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-41.9	173.9	-86.5	78.4	0	0	0	112.3	L233 F234 L235 G239 G240 L242 A245 L261 I331 L335	L233-L237 HydrophobicContact CG-CD1 4.37Å; L233-L237 WeakPolarHBondContact O-CD1 3.28Å; L233-L237 PolarHBondContact O-N 3.25Å; L233-L237 VanDerWaalsContact O-N 3.1Å; F234-L237 PolarHBondContact O-N 3.46Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 3.42Å; L237-G239 PolarHBondContact O-N 3.5Å; L237-G240 PolarHBondContact O-N 2.88Å; L237-L242 HydrophobicContact CG-CD1 4.28Å; L237-L242 HydrophobicContact CG-CG 4.4Å; L237-A245 HydrophobicContact CD1-CB 3.86Å; L237-L261 HydrophobicContact CD1-CD1 4.4Å; L237-L261 HydrophobicContact CD1-CD2 4.07Å; L237-L261 HydrophobicContact CD2-CD2 4.15Å; L237-I331 HydrophobicContact CD2-CB 4.3Å; L237-I331 HydrophobicContact CD2-CG1 4.29Å; L237-I331 HydrophobicContact CD2-CG2 3.81Å; L237-L335 HydrophobicContact CD2-CD1 4.19Å; L237-L335 HydrophobicContact CD2-CD2 4.16Å; L237-L335 HydrophobicContact CD2-CG 4.04Å
238	R	93.6	Very high	92.3	Very high	6 Å²	6	29 Å²	29	2%	0.023	14%	0.142	C	C	.	.	H	α-helix	trans	-65.9	-22.4	176.2	177.5	59.4	-173.3	86.3	-0.3	112.6	L157 E158 V161 F234 L235 T351 D352 W355	L157-R238 PolarHBondContact O-NH1 3.27Å; E158-R238 WeakPolarHBondContact CG-O 3.43Å; V161-R238 HydrophobicContact CG1-CG 4.24Å; V161-R238 HydrophobicContact CG2-CG 4.25Å; F234-R238 HydrophobicContact CE1-CB 4.4Å; F234-R238 WeakPolarHBondContact O-CB 3.44Å; F234-R238 PolarHBondContact O-N 3.47Å; L235-R238 CarbonylContact O-C 3.56Å; L235-R238 PolarHBondContact O-N 3.06Å; R238-T351 PolarHBondContact NH2-O 3.28Å; R238-D352 IonicContact CZ-OD1 3.06Å; R238-D352 IonicContact NE-OD1 3.74Å; R238-D352 PolarHBondContact NE-OD1 3.3Å; R238-D352 IonicContact NH2-OD1 2.75Å; R238-D352 PolarHBondContact NH2-OD1 3.06Å; R238-D352 VanDerWaalsContact NH2-OD1 3.07Å; R238-W355 HydrophobicContact CB-CH2 4.45Å; R238-W355 VanDerWaalsContact CD-CD2 3.44Å; R238-W355 VanDerWaalsContact CD-CE3 3.42Å
239	G	93.2	Very high	92.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	7.8	170.4	0	0	0	0	0	114.5	E158 R162 L235 C236 L237 D241	E158-G239 VanDerWaalsContact O-CA 3.3Å; E158-G239 WeakPolarHBondContact O-CA 3.29Å; R162-G239 PolarHBondContact NH1-O 3.01Å; L235-G239 PolarHBondContact O-N 3.28Å; C236-G239 CarbonylContact O-C 3.58Å; C236-G239 PolarHBondContact O-N 3.35Å; L237-G239 PolarHBondContact O-N 3.5Å; G239-D241 PolarHBondContact O-N 2.87Å; G239-D241 VanDerWaalsContact O-N 3.09Å
240	G	93.6	Very high	92.5	Very high	24 Å²	24	27.2 Å²	27.2	25%	0.247	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	6.4	-179.3	0	0	0	0	0	114.9	E158 C236 L237 L242	E158-G240 WeakPolarHBondContact OE2-CA 3.27Å; C236-G240 PolarHBondContact O-N 3.49Å; L237-G240 PolarHBondContact O-N 2.88Å; G240-L242 PolarHBondContact O-N 3.39Å
241	D	92.4	Very high	92.4	Very high	33 Å²	33	31 Å²	31	18%	0.176	16%	0.16	C	C	.	.			trans	-95	68.5	-176.8	-165.2	-10.3	0	0	0	111	C236 G239 H243 R244 A245	C236-D241 PolarHBondContact O-N 3.28Å; G239-D241 PolarHBondContact O-N 2.87Å; G239-D241 VanDerWaalsContact O-N 3.09Å; D241-H243 PolarHBondContact O-N 2.81Å; D241-R244 HydrophobicContact CB-CB 4.16Å; D241-R244 PolarHBondContact O-N 3.31Å; D241-R244 VanDerWaalsContact OD1-CB 3.23Å; D241-R244 WeakPolarHBondContact OD1-CB 3.31Å; D241-R244 PolarHBondContact OD1-N 3.31Å; D241-R244 WeakPolarHBondContact OD2-CB 3.44Å; D241-R244 WeakPolarHBondContact OD2-CD 3.26Å; D241-A245 PolarHBondContact O-N 2.92Å
242	L	91.4	Very high	92.4	Very high	25 Å²	25	28.5 Å²	28.5	13%	0.131	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-27.3	177.1	-89.5	77.4	0	0	0	112.3	L237 G240 A245 Q246 W264 L335	L237-L242 HydrophobicContact CG-CD1 4.28Å; L237-L242 HydrophobicContact CG-CG 4.4Å; G240-L242 PolarHBondContact O-N 3.39Å; L242-A245 WeakPolarHBondContact O-CB 3.48Å; L242-A245 PolarHBondContact O-N 3.44Å; L242-Q246 WeakPolarHBondContact O-CB 3.48Å; L242-Q246 VanDerWaalsContact O-CG 3.25Å; L242-Q246 WeakPolarHBondContact O-CG 3.44Å; L242-Q246 PolarHBondContact O-N 2.99Å; L242-W264 HydrophobicContact CD2-CZ2 4Å; L242-L335 HydrophobicContact CD2-CD2 4.37Å
243	H	93.1	Very high	92.2	Very high	133 Å²	133	28.8 Å²	28.8	62%	0.616	15%	0.153	S	C	*	.	H	α-helix	trans	-66.7	-47.3	179.2	-175.6	59.2	0	0	0	110.9	D241 A245 Q246 L247	D241-H243 PolarHBondContact O-N 2.81Å; H243-A245 VanDerWaalsContact C-N 3.31Å; H243-A245 PolarHBondContact O-N 2.98Å; H243-Q246 PolarHBondContact O-N 3.49Å; H243-L247 WeakPolarHBondContact O-CB 3.41Å; H243-L247 PolarHBondContact O-N 3.45Å
244	R	92	Very high	92.1	Very high	49 Å²	49	28.8 Å²	28.8	19%	0.185	15%	0.152	C	C	.	.	H	α-helix	trans	-57.9	-44.5	172.7	-174.6	178.6	-153.6	101.7	21.5	111.7	E173 D241 Q246 L247 L248	E173-R244 IonicContact OE1-CZ 3.76Å; E173-R244 IonicContact OE1-NE 2.9Å; E173-R244 PolarHBondContact OE1-NE 3.19Å; E173-R244 IonicContact OE1-NH2 3.97Å; E173-R244 PolarHBondContact OE1-NH2 2.91Å; E173-R244 IonicContact OE2-CZ 2.75Å; E173-R244 IonicContact OE2-NH2 2.61Å; E173-R244 PolarHBondContact OE2-NH2 3.43Å; D241-R244 HydrophobicContact CB-CB 4.16Å; D241-R244 PolarHBondContact O-N 3.31Å; D241-R244 VanDerWaalsContact OD1-CB 3.23Å; D241-R244 WeakPolarHBondContact OD1-CB 3.31Å; D241-R244 PolarHBondContact OD1-N 3.31Å; D241-R244 WeakPolarHBondContact OD2-CB 3.44Å; D241-R244 WeakPolarHBondContact OD2-CD 3.26Å; R244-Q246 PolarHBondContact O-N 3.37Å; R244-L247 PolarHBondContact O-N 3.26Å; R244-L248 HydrophobicContact CG-CD1 4.02Å; R244-L248 WeakPolarHBondContact O-CB 3.1Å; R244-L248 WeakPolarHBondContact O-CD1 3.23Å; R244-L248 VanDerWaalsContact O-CG 3.25Å; R244-L248 WeakPolarHBondContact O-CG 3.08Å; R244-L248 PolarHBondContact O-N 3.07Å
245	A	93.2	Very high	91.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.8	-47.4	176.5	0	0	0	0	0	112.6	L233 C236 L237 D241 L242 H243 C249 L261	L233-A245 HydrophobicContact CD1-CB 3.48Å; L233-A245 VanDerWaalsContact CD1-CB 3.48Å; L233-A245 WeakPolarHBondContact CD1-O 3.33Å; L233-A245 HydrophobicContact CG-CB 4.45Å; C236-A245 HydrophobicContact CB-CB 3.79Å; L237-A245 HydrophobicContact CD1-CB 3.86Å; D241-A245 PolarHBondContact O-N 2.92Å; L242-A245 WeakPolarHBondContact O-CB 3.48Å; L242-A245 PolarHBondContact O-N 3.44Å; H243-A245 VanDerWaalsContact C-N 3.31Å; H243-A245 PolarHBondContact O-N 2.98Å; A245-C249 PolarHBondContact O-N 2.84Å; A245-C249 VanDerWaalsContact O-N 3.1Å; A245-C249 PolarHBondContact O-SG 3.26Å; A245-L261 HydrophobicContact CB-CD1 3.92Å
246	Q	93.8	Very high	91.9	Very high	24 Å²	24	36.4 Å²	36.4	11%	0.112	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-41.6	178.3	-72.8	172.5	-19	0	0	112.6	L242 H243 R244 C249 T250 L261 E262	L242-Q246 WeakPolarHBondContact O-CB 3.48Å; L242-Q246 VanDerWaalsContact O-CG 3.25Å; L242-Q246 WeakPolarHBondContact O-CG 3.44Å; L242-Q246 PolarHBondContact O-N 2.99Å; H243-Q246 PolarHBondContact O-N 3.49Å; R244-Q246 PolarHBondContact O-N 3.37Å; Q246-C249 PolarHBondContact O-N 3.4Å; Q246-T250 WeakPolarHBondContact O-CB 3.48Å; Q246-T250 PolarHBondContact O-N 3.32Å; Q246-T250 PolarHBondContact O-OG1 3.39Å; Q246-L261 HydrophobicContact CG-CB 3.98Å; Q246-L261 HydrophobicContact CG-CD1 4.32Å; Q246-L261 PolarHBondContact NE2-O 2.88Å; Q246-E262 PolarHBondContact NE2-OE2 3.38Å
247	L	92.5	Very high	91.8	Very high	80 Å²	80	37.3 Å²	37.3	42%	0.419	19%	0.185	S	C	.	.	H	α-helix	trans	-60.3	-46.6	177.4	179.6	63.3	0	0	0	110.7	H243 R244 C249 T250 Q251	H243-L247 WeakPolarHBondContact O-CB 3.41Å; H243-L247 PolarHBondContact O-N 3.45Å; R244-L247 PolarHBondContact O-N 3.26Å; L247-C249 PolarHBondContact O-N 2.97Å; L247-T250 WeakPolarHBondContact O-CB 2.98Å; L247-T250 PolarHBondContact O-N 3.06Å; L247-T250 VanDerWaalsContact O-N 3.14Å; L247-Q251 HydrophobicContact CD1-CG 4.3Å; L247-Q251 HydrophobicContact CG-CG 4.41Å; L247-Q251 WeakPolarHBondContact O-CB 3.31Å; L247-Q251 WeakPolarHBondContact O-CG 3.25Å; L247-Q251 PolarHBondContact O-N 3.37Å
248	L	91.7	Very high	91.8	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-42.1	177.5	-71.1	166.2	0	0	0	112.2	E173 F229 Y232 R244 T250 Q251 R252	E173-L248 HydrophobicContact CB-CD2 4.29Å; E173-L248 HydrophobicContact CG-CD2 4Å; F229-L248 HydrophobicContact CE2-CB 4.08Å; F229-L248 HydrophobicContact CZ-CB 4.37Å; Y232-L248 HydrophobicContact CD1-CD1 3.9Å; Y232-L248 HydrophobicContact CE1-CD1 3.55Å; R244-L248 HydrophobicContact CG-CD1 4.02Å; R244-L248 WeakPolarHBondContact O-CB 3.1Å; R244-L248 WeakPolarHBondContact O-CD1 3.23Å; R244-L248 VanDerWaalsContact O-CG 3.25Å; R244-L248 WeakPolarHBondContact O-CG 3.08Å; R244-L248 PolarHBondContact O-N 3.07Å; L248-T250 VanDerWaalsContact C-N 3.29Å; L248-T250 PolarHBondContact O-N 3.41Å; L248-Q251 PolarHBondContact O-N 2.89Å; L248-R252 WeakPolarHBondContact O-CB 3.29Å; L248-R252 PolarHBondContact O-N 3.38Å
249	C	92.8	Very high	91.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-41.4	173.4	-67.6	0	0	0	0	111.5	A245 Q246 L247 R252 G253 E254 R257 A258	A245-C249 PolarHBondContact O-N 2.84Å; A245-C249 VanDerWaalsContact O-N 3.1Å; A245-C249 PolarHBondContact O-SG 3.26Å; Q246-C249 PolarHBondContact O-N 3.4Å; L247-C249 PolarHBondContact O-N 2.97Å; C249-R252 PolarHBondContact O-N 3.27Å; C249-G253 PolarHBondContact O-N 3.11Å; C249-E254 CarbonylContact O-C 3.58Å; C249-E254 WeakPolarHBondContact O-CA 3.46Å; C249-E254 PolarHBondContact O-N 3.48Å; C249-R257 HydrophobicContact CB-CB 4.47Å; C249-A258 HydrophobicContact CB-CB 3.79Å
250	T	91.2	Very high	91.6	Very high	62 Å²	62	44.7 Å²	44.7	38%	0.38	23%	0.227	S	C	.	.	H	α-helix	trans	-68.2	-44.5	179.8	-55.6	0	0	0	0	111.6	Q246 L247 L248 R252 G253 F255	Q246-T250 WeakPolarHBondContact O-CB 3.48Å; Q246-T250 PolarHBondContact O-N 3.32Å; Q246-T250 PolarHBondContact O-OG1 3.39Å; L247-T250 WeakPolarHBondContact O-CB 2.98Å; L247-T250 PolarHBondContact O-N 3.06Å; L247-T250 VanDerWaalsContact O-N 3.14Å; L248-T250 VanDerWaalsContact C-N 3.29Å; L248-T250 PolarHBondContact O-N 3.41Å; T250-R252 VanDerWaalsContact C-N 3.27Å; T250-R252 PolarHBondContact O-N 3.44Å; T250-G253 PolarHBondContact O-N 3.34Å; T250-G253 VanDerWaalsContact O-N 3.08Å; T250-F255 HydrophobicContact CG2-CD1 4.01Å; T250-F255 HydrophobicContact CG2-CE1 3.71Å
251	Q	89.5	Confident	91.6	Very high	86 Å²	86	43.6 Å²	43.6	40%	0.402	22%	0.216	S	C	.	.	H	α-helix	trans	-61.3	-37.2	176.9	-74.7	174.1	-9.5	0	0	111.9	L247 L248 G253	L247-Q251 HydrophobicContact CD1-CG 4.3Å; L247-Q251 HydrophobicContact CG-CG 4.41Å; L247-Q251 WeakPolarHBondContact O-CB 3.31Å; L247-Q251 WeakPolarHBondContact O-CG 3.25Å; L247-Q251 PolarHBondContact O-N 3.37Å; L248-Q251 PolarHBondContact O-N 2.89Å; Q251-G253 PolarHBondContact O-N 3.08Å
252	R	89.2	Confident	91.5	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.015	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-8	176.7	-167.6	171.8	151.1	137.3	-0.6	114.2	Q178 D225 N226 F229 L248 C249 T250 E254	Q178-R252 VanDerWaalsContact O-CA 3.24Å; Q178-R252 WeakPolarHBondContact O-CA 3.36Å; D225-R252 PolarHBondContact O-NH1 2.86Å; N226-R252 PolarHBondContact OD1-NH2 2.9Å; F229-R252 VanDerWaalsContact CG-NH1 3.34Å; F229-R252 HydrophobicContact CZ-CB 4.45Å; L248-R252 WeakPolarHBondContact O-CB 3.29Å; L248-R252 PolarHBondContact O-N 3.38Å; C249-R252 PolarHBondContact O-N 3.27Å; T250-R252 VanDerWaalsContact C-N 3.27Å; T250-R252 PolarHBondContact O-N 3.44Å; R252-E254 HydrophobicContact CB-CG 4.5Å; R252-E254 HydrophobicContact CG-CG 4.24Å; R252-E254 IonicContact CZ-OE1 3.63Å; R252-E254 IonicContact NE-OE1 3.33Å; R252-E254 PolarHBondContact NE-OE1 3.45Å; R252-E254 IonicContact NH2-OE1 3.64Å; R252-E254 PolarHBondContact NH2-OE1 2.92Å
253	G	87.7	Confident	91.3	Very high	18 Å²	18	44.7 Å²	44.7	19%	0.186	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	9.5	-175.6	0	0	0	0	0	114.7	C249 T250 Q251 F255	C249-G253 PolarHBondContact O-N 3.11Å; T250-G253 PolarHBondContact O-N 3.34Å; T250-G253 VanDerWaalsContact O-N 3.08Å; Q251-G253 PolarHBondContact O-N 3.08Å; G253-F255 VanDerWaalsContact C-N 3.32Å; G253-F255 WeakPolarHBondContact O-CD2 3.46Å; G253-F255 PolarHBondContact O-N 3.32Å
254	E	90.6	Very high	90.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.			trans	-92.6	58.1	-179.6	-59.1	-172.9	180	0	0	111.5	A181 C249 R252 W256 R257 A258	A181-E254 HydrophobicContact CB-CG 3.93Å; C249-E254 CarbonylContact O-C 3.58Å; C249-E254 WeakPolarHBondContact O-CA 3.46Å; C249-E254 PolarHBondContact O-N 3.48Å; R252-E254 HydrophobicContact CB-CG 4.5Å; R252-E254 HydrophobicContact CG-CG 4.24Å; R252-E254 IonicContact CZ-OE1 3.63Å; R252-E254 IonicContact NE-OE1 3.33Å; R252-E254 PolarHBondContact NE-OE1 3.45Å; R252-E254 IonicContact NH2-OE1 3.64Å; R252-E254 PolarHBondContact NH2-OE1 2.92Å; E254-W256 HydrophobicContact CB-CD2 4.43Å; E254-W256 HydrophobicContact CB-CH2 4.02Å; E254-W256 HydrophobicContact CB-CZ2 3.73Å; E254-W256 HydrophobicContact CB-CZ3 4.46Å; E254-W256 HydrophobicContact CG-CH2 3.76Å; E254-W256 HydrophobicContact CG-CZ2 3.58Å; E254-W256 PolarHBondContact O-N 3.48Å; E254-R257 HydrophobicContact CB-CB 4.37Å; E254-R257 PolarHBondContact O-N 2.89Å; E254-R257 IonicContact OE2-CZ 3.71Å; E254-R257 IonicContact OE2-NE 3.2Å; E254-R257 IonicContact OE2-NH1 3.51Å; E254-R257 PolarHBondContact OE2-NH1 3.08Å; E254-R257 IonicContact OE2-NH2 2.89Å; E254-R257 PolarHBondContact OE2-NH2 2.89Å; E254-A258 PolarHBondContact O-N 3.4Å
255	F	89.9	Confident	90.7	Very high	122 Å²	122	43.5 Å²	43.5	54%	0.535	21%	0.212	S	C	.	.	H	α-helix	trans	-58	-33.4	-175.4	-54.2	-75.6	0	0	0	113.2	T250 G253 R257 A258 I259	T250-F255 HydrophobicContact CG2-CD1 4.01Å; T250-F255 HydrophobicContact CG2-CE1 3.71Å; G253-F255 VanDerWaalsContact C-N 3.32Å; G253-F255 WeakPolarHBondContact O-CD2 3.46Å; G253-F255 PolarHBondContact O-N 3.32Å; F255-R257 VanDerWaalsContact C-N 3.25Å; F255-R257 PolarHBondContact O-N 3.05Å; F255-A258 PolarHBondContact O-N 3.03Å; F255-I259 WeakPolarHBondContact O-CD1 3.49Å; F255-I259 VanDerWaalsContact O-CG1 3.23Å; F255-I259 WeakPolarHBondContact O-CG1 3.29Å; F255-I259 PolarHBondContact O-N 2.89Å
256	W	90.9	Very high	90.4	Very high	93 Å²	93	44.8 Å²	44.8	35%	0.352	22%	0.221	S	C	.	.	H	α-helix	trans	-59.5	-38.7	176.6	60.5	89.1	0	0	0	111.6	A181 P208 E254 S260	A181-W256 HydrophobicContact CB-CH2 4.38Å; P208-W256 HydrophobicContact CB-CD2 4.48Å; P208-W256 HydrophobicContact CB-CG 4.21Å; P208-W256 HydrophobicContact CG-CB 4.19Å; P208-W256 VanDerWaalsContact CG-CD1 3.43Å; P208-W256 HydrophobicContact CG-CD2 3.54Å; P208-W256 HydrophobicContact CG-CE3 4.25Å; P208-W256 HydrophobicContact CG-CG 3.46Å; P208-W256 VanDerWaalsContact CG-CG 3.46Å; P208-W256 HydrophobicContact CG-CZ2 4.3Å; E254-W256 HydrophobicContact CB-CD2 4.43Å; E254-W256 HydrophobicContact CB-CH2 4.02Å; E254-W256 HydrophobicContact CB-CZ2 3.73Å; E254-W256 HydrophobicContact CB-CZ3 4.46Å; E254-W256 HydrophobicContact CG-CH2 3.76Å; E254-W256 HydrophobicContact CG-CZ2 3.58Å; E254-W256 PolarHBondContact O-N 3.48Å; W256-S260 PolarHBondContact O-N 3.24Å
257	R	92.3	Very high	90.1	Very high	19 Å²	19	44.7 Å²	44.7	7%	0.072	22%	0.22	C	C	.	.	H	α-helix	trans	-73.5	-43	179.2	-167.2	176	-64	148.7	10.1	110.2	F229 L233 C249 E254 F255 I259 S260 L261	F229-R257 VanDerWaalsContact CD1-NH1 3.33Å; F229-R257 VanDerWaalsContact CE1-NH1 3.27Å; L233-R257 VanDerWaalsContact CD2-CD 3.41Å; L233-R257 HydrophobicContact CD2-CG 4.18Å; C249-R257 HydrophobicContact CB-CB 4.47Å; E254-R257 HydrophobicContact CB-CB 4.37Å; E254-R257 PolarHBondContact O-N 2.89Å; E254-R257 IonicContact OE2-CZ 3.71Å; E254-R257 IonicContact OE2-NE 3.2Å; E254-R257 IonicContact OE2-NH1 3.51Å; E254-R257 PolarHBondContact OE2-NH1 3.08Å; E254-R257 IonicContact OE2-NH2 2.89Å; E254-R257 PolarHBondContact OE2-NH2 2.89Å; F255-R257 VanDerWaalsContact C-N 3.25Å; F255-R257 PolarHBondContact O-N 3.05Å; R257-I259 VanDerWaalsContact C-N 3.27Å; R257-I259 PolarHBondContact O-N 3.41Å; R257-S260 WeakPolarHBondContact CA-OG 3.32Å; R257-S260 PolarHBondContact O-N 3.49Å; R257-S260 VanDerWaalsContact O-N 3.09Å; R257-S260 PolarHBondContact O-OG 3.41Å; R257-L261 WeakPolarHBondContact O-CG 3.45Å; R257-L261 PolarHBondContact O-N 3.08Å
258	A	93	Very high	89.8	Confident	11 Å²	11	41.1 Å²	41.1	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-54.4	-45.4	173.3	0	0	0	0	0	111.6	C249 E254 F255 L261	C249-A258 HydrophobicContact CB-CB 3.79Å; E254-A258 PolarHBondContact O-N 3.4Å; F255-A258 PolarHBondContact O-N 3.03Å; A258-L261 PolarHBondContact O-N 3.22Å
259	I	91.3	Very high	89.4	Confident	122 Å²	122	44 Å²	44	63%	0.626	21%	0.212	S	C	*	.	H	α-helix	trans	-65.3	-42.2	176.4	-65.9	162.8	0	0	0	111.3	F255 R257 L261 E262	F255-I259 WeakPolarHBondContact O-CD1 3.49Å; F255-I259 VanDerWaalsContact O-CG1 3.23Å; F255-I259 WeakPolarHBondContact O-CG1 3.29Å; F255-I259 PolarHBondContact O-N 2.89Å; R257-I259 VanDerWaalsContact C-N 3.27Å; R257-I259 PolarHBondContact O-N 3.41Å; I259-L261 PolarHBondContact O-N 3.28Å; I259-E262 WeakPolarHBondContact O-CB 3.39Å; I259-E262 PolarHBondContact O-N 2.88Å
260	S	92.2	Very high	88.7	Confident	30 Å²	30	44.4 Å²	44.4	21%	0.21	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-29.2	176.9	73.6	0	0	0	0	112.8	W256 R257 E262 Y311	W256-S260 PolarHBondContact O-N 3.24Å; R257-S260 WeakPolarHBondContact CA-OG 3.32Å; R257-S260 PolarHBondContact O-N 3.49Å; R257-S260 VanDerWaalsContact O-N 3.09Å; R257-S260 PolarHBondContact O-OG 3.41Å; S260-E262 PolarHBondContact O-N 3.35Å; S260-Y311 WeakPolarHBondContact O-CE2 3.24Å; S260-Y311 VanDerWaalsContact O-CZ 3.27Å; S260-Y311 PolarHBondContact O-OH 3.31Å
261	L	93.5	Very high	87.9	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.1	176.1	-67.2	179.6	0	0	0	113.2	L233 L237 A245 Q246 R257 A258 I259 W264 I331 L335	L233-L261 HydrophobicContact CD1-CD1 4.1Å; L233-L261 HydrophobicContact CD2-CD1 4.31Å; L233-L261 HydrophobicContact CG-CD1 4.42Å; L237-L261 HydrophobicContact CD1-CD1 4.4Å; L237-L261 HydrophobicContact CD1-CD2 4.07Å; L237-L261 HydrophobicContact CD2-CD2 4.15Å; A245-L261 HydrophobicContact CB-CD1 3.92Å; Q246-L261 HydrophobicContact CG-CB 3.98Å; Q246-L261 HydrophobicContact CG-CD1 4.32Å; Q246-L261 PolarHBondContact NE2-O 2.88Å; R257-L261 WeakPolarHBondContact O-CG 3.45Å; R257-L261 PolarHBondContact O-N 3.08Å; A258-L261 PolarHBondContact O-N 3.22Å; I259-L261 PolarHBondContact O-N 3.28Å; L261-W264 PolarHBondContact O-NE1 3.16Å; L261-I331 HydrophobicContact CD2-CG2 3.83Å; L261-L335 HydrophobicContact CD2-CD1 3.82Å
262	E	89.7	Confident	87.1	Confident	70 Å²	70	41.7 Å²	41.7	33%	0.327	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-20.6	-178.4	-173.2	62.8	-172	0	0	112.7	Q246 I259 S260 W264 R265	Q246-E262 PolarHBondContact NE2-OE2 3.38Å; I259-E262 WeakPolarHBondContact O-CB 3.39Å; I259-E262 PolarHBondContact O-N 2.88Å; S260-E262 PolarHBondContact O-N 3.35Å; E262-W264 PolarHBondContact O-N 2.93Å; E262-R265 PolarHBondContact O-N 2.96Å; E262-R265 VanDerWaalsContact OE1-CD 3.25Å; E262-R265 WeakPolarHBondContact OE1-CD 3.41Å; E262-R265 IonicContact OE1-CZ 3.65Å; E262-R265 IonicContact OE1-NE 2.84Å; E262-R265 PolarHBondContact OE1-NE 3.49Å; E262-R265 IonicContact OE1-NH2 3.49Å; E262-R265 IonicContact OE2-CZ 2.69Å; E262-R265 VanDerWaalsContact OE2-CZ 3.29Å; E262-R265 IonicContact OE2-NE 3.64Å; E262-R265 PolarHBondContact OE2-NE 3.03Å; E262-R265 IonicContact OE2-NH2 2.75Å; E262-R265 PolarHBondContact OE2-NH2 3.2Å
263	G	87	Confident	85.9	Confident	12 Å²	12	43.4 Å²	43.4	12%	0.124	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.9	-169.5	0	0	0	0	0	116.2	N305 Y311	G263-N305 WeakPolarHBondContact O-CB 3.43Å; G263-N305 PolarHBondContact O-ND2 3.31Å; G263-N305 VanDerWaalsContact O-ND2 3.09Å; G263-Y311 WeakPolarHBondContact O-CD1 3.46Å
264	W	85.8	Confident	84.3	Confident	71 Å²	71	49.2 Å²	49.2	27%	0.269	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.2	178.1	72.3	-85.6	0	0	0	113.1	L242 L261 E262 R308 Y311 L335	L242-W264 HydrophobicContact CD2-CZ2 4Å; L261-W264 PolarHBondContact O-NE1 3.16Å; E262-W264 PolarHBondContact O-N 2.93Å; W264-R308 VanDerWaalsContact O-CD 3.28Å; W264-R308 WeakPolarHBondContact O-CD 3.3Å; W264-R308 PolarHBondContact O-NE 3.11Å; W264-Y311 HydrophobicContact CB-CE1 3.81Å; W264-L335 HydrophobicContact CB-CD2 4.27Å; W264-L335 HydrophobicContact CG-CD2 4.22Å
265	R	88.3	Confident	82.4	Confident	85 Å²	85	55.2 Å²	55.2	32%	0.321	27%	0.271	S	S	.	.	S	Bend	trans	-64.7	130	-171.6	-72.4	-166.4	-151.7	-111.6	1.6	111.9	E262 G304 N305	E262-R265 PolarHBondContact O-N 2.96Å; E262-R265 VanDerWaalsContact OE1-CD 3.25Å; E262-R265 WeakPolarHBondContact OE1-CD 3.41Å; E262-R265 IonicContact OE1-CZ 3.65Å; E262-R265 IonicContact OE1-NE 2.84Å; E262-R265 PolarHBondContact OE1-NE 3.49Å; E262-R265 IonicContact OE1-NH2 3.49Å; E262-R265 IonicContact OE2-CZ 2.69Å; E262-R265 VanDerWaalsContact OE2-CZ 3.29Å; E262-R265 IonicContact OE2-NE 3.64Å; E262-R265 PolarHBondContact OE2-NE 3.03Å; E262-R265 IonicContact OE2-NH2 2.75Å; E262-R265 PolarHBondContact OE2-NH2 3.2Å; R265-G304 WeakPolarHBondContact O-CA 3.42Å; R265-N305 PolarHBondContact O-N 3.35Å
266	P	86.9	Confident	80.3	Confident	27 Å²	27	54.7 Å²	54.7	18%	0.175	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-60.1	140.9	175.7	-21.9	32.3	0	0	0	112.2	E133 R134 I137 H268	E133-P266 HydrophobicContact CB-CB 4.02Å; E133-P266 HydrophobicContact CG-CB 4.45Å; E133-P266 VanDerWaalsContact OE2-CA 3.32Å; E133-P266 WeakPolarHBondContact OE2-CA 3.41Å; R134-P266 HydrophobicContact CB-CB 4.41Å; I137-P266 HydrophobicContact CD1-CB 3.6Å; I137-P266 HydrophobicContact CD1-CG 3.34Å; P266-H268 PolarHBondContact O-N 3.26Å
267	F	86.3	Confident	78	Confident	22 Å²	22	54 Å²	54	10%	0.096	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-67.3	131.8	179.1	175.8	-106.9	0	0	0	111.9	S132 E133 R134 F272 I302 E303 P306 P378	S132-F267 WeakPolarHBondContact CB-O 3.17Å; E133-F267 HydrophobicContact CB-CB 4.34Å; E133-F267 VanDerWaalsContact CB-O 3.31Å; E133-F267 WeakPolarHBondContact CB-O 3.42Å; E133-F267 PolarHBondContact N-O 3.37Å; E133-F267 PolarHBondContact OE2-N 3.05Å; R134-F267 PolarHBondContact N-O 2.9Å; F267-F272 HydrophobicContact CE1-CE2 4.14Å; F267-I302 HydrophobicContact CE2-CG2 3.99Å; F267-E303 WeakPolarHBondContact CA-O 2.95Å; F267-P306 HydrophobicContact CD2-CB 3.95Å; F267-P306 HydrophobicContact CD2-CG 4.43Å; F267-P306 HydrophobicContact CE2-CB 4.32Å; F267-P306 HydrophobicContact CG-CB 4.25Å; F267-P378 HydrophobicContact CE1-CG 4.29Å
268	H	85.4	Confident	75.5	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.028	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139	172.3	177.4	65.8	0	0	0	112.3	S132 R134 P266 I302 E303	S132-H268 PolarHBondContact OG-ND1 2.65Å; R134-H268 HydrophobicContact CB-CB 3.78Å; R134-H268 HydrophobicContact CG-CB 4.47Å; R134-H268 VanDerWaalsContact CZ-CD2 3.44Å; R134-H268 PolarHBondContact NE-ND1 2.9Å; R134-H268 PolarHBondContact NH2-CE1 2.92Å; R134-H268 VanDerWaalsContact NH2-CE1 3.31Å; R134-H268 PolarHBondContact NH2-NE2 2.99Å; P266-H268 PolarHBondContact O-N 3.26Å; H268-I302 WeakPolarHBondContact O-CA 3.49Å; H268-E303 HydrophobicContact CB-CG 3.61Å; H268-E303 IonicContact CD2-OE1 2.76Å; H268-E303 PolarHBondContact CD2-OE1 3.43Å; H268-E303 IonicContact CG-OE1 3.48Å; H268-E303 PolarHBondContact N-O 3.36Å; H268-E303 PolarHBondContact O-N 3.49Å
269	Y	83.3	Confident	73	Confident	63 Å²	63	65.4 Å²	65.4	25%	0.247	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	111.5	171.4	176.8	-124.3	0	0	0	108.8	G271 F272 F300 I302	Y269-G271 VanDerWaalsContact CE1-CA 3.49Å; Y269-G271 PolarHBondContact O-N 3.02Å; Y269-G271 VanDerWaalsContact O-N 3.15Å; Y269-F272 AromaticContact CD1-CD1 3.79Å; Y269-F272 HydrophobicContact CD1-CD1 3.79Å; Y269-F272 AromaticContact CD1-CD2 3.93Å; Y269-F272 HydrophobicContact CD1-CD2 3.93Å; Y269-F272 AromaticContact CD1-CE1 3.84Å; Y269-F272 HydrophobicContact CD1-CE1 3.84Å; Y269-F272 AromaticContact CD1-CE2 3.99Å; Y269-F272 HydrophobicContact CD1-CE2 3.99Å; Y269-F272 AromaticContact CD1-CG 3.82Å; Y269-F272 HydrophobicContact CD1-CG 3.82Å; Y269-F272 AromaticContact CD1-CZ 3.93Å; Y269-F272 HydrophobicContact CD1-CZ 3.93Å; Y269-F272 HydrophobicContact CE1-CD1 4.29Å; Y269-F272 HydrophobicContact CE1-CE1 4.3Å; Y269-F272 HydrophobicContact CG-CD2 4.44Å; Y269-F272 PolarHBondContact O-N 3.45Å; Y269-F272 VanDerWaalsContact O-N 3.16Å; Y269-F300 HydrophobicContact CD2-CB 4.42Å; Y269-F300 HydrophobicContact CE2-CB 3.62Å; Y269-F300 HydrophobicContact CE2-CD1 4.4Å; Y269-F300 HydrophobicContact CE2-CG 4.06Å; Y269-I302 HydrophobicContact CD2-CD1 4.25Å; Y269-I302 HydrophobicContact CD2-CG1 3.49Å; Y269-I302 VanDerWaalsContact CD2-CG1 3.49Å; Y269-I302 HydrophobicContact CE2-CD1 4.29Å; Y269-I302 HydrophobicContact CE2-CG1 3.94Å
270	S	80.1	Confident	70.7	Confident	10 Å²	10	65.9 Å²	65.9	7%	0.07	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-56	-27.9	179.3	48.9	0	0	0	0	113.6	F272 V273 F300 N301	S270-F272 PolarHBondContact O-N 3.47Å; S270-F272 VanDerWaalsContact O-N 3.11Å; S270-V273 PolarHBondContact O-N 2.81Å; S270-F300 WeakPolarHBondContact OG-CA 3.48Å; S270-N301 PolarHBondContact N-O 3.21Å; S270-N301 VanDerWaalsContact N-O 3.08Å; S270-N301 PolarHBondContact OG-N 2.96Å; S270-N301 PolarHBondContact OG-O 2.8Å; S270-N301 VanDerWaalsContact OG-O 3.07Å
271	G	74	Confident	67.9	Low	31 Å²	31	72.8 Å²	72.8	32%	0.32	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-69	-6.9	179.7	0	0	0	0	0	115.3	Y269 F300	Y269-G271 VanDerWaalsContact CE1-CA 3.49Å; Y269-G271 PolarHBondContact O-N 3.02Å; Y269-G271 VanDerWaalsContact O-N 3.15Å; G271-F300 VanDerWaalsContact CA-CD1 3.47Å
272	F	71.4	Confident	65.1	Low	60 Å²	60	78.8 Å²	78.8	26%	0.263	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-85.1	-17.6	173.9	-73.2	-30.1	0	0	0	114.4	N130 F267 Y269 S270	N130-F272 HydrophobicContact CB-CD1 4.11Å; N130-F272 HydrophobicContact CB-CG 4.37Å; N130-F272 WeakPolarHBondContact O-CB 3.11Å; N130-F272 WeakPolarHBondContact O-CD2 3.37Å; N130-F272 VanDerWaalsContact O-CG 3.24Å; N130-F272 WeakPolarHBondContact O-CG 3.46Å; F267-F272 HydrophobicContact CE1-CE2 4.14Å; Y269-F272 AromaticContact CD1-CD1 3.79Å; Y269-F272 HydrophobicContact CD1-CD1 3.79Å; Y269-F272 AromaticContact CD1-CD2 3.93Å; Y269-F272 HydrophobicContact CD1-CD2 3.93Å; Y269-F272 AromaticContact CD1-CE1 3.84Å; Y269-F272 HydrophobicContact CD1-CE1 3.84Å; Y269-F272 AromaticContact CD1-CE2 3.99Å; Y269-F272 HydrophobicContact CD1-CE2 3.99Å; Y269-F272 AromaticContact CD1-CG 3.82Å; Y269-F272 HydrophobicContact CD1-CG 3.82Å; Y269-F272 AromaticContact CD1-CZ 3.93Å; Y269-F272 HydrophobicContact CD1-CZ 3.93Å; Y269-F272 HydrophobicContact CE1-CD1 4.29Å; Y269-F272 HydrophobicContact CE1-CE1 4.3Å; Y269-F272 HydrophobicContact CG-CD2 4.44Å; Y269-F272 PolarHBondContact O-N 3.45Å; Y269-F272 VanDerWaalsContact O-N 3.16Å; S270-F272 PolarHBondContact O-N 3.47Å; S270-F272 VanDerWaalsContact O-N 3.11Å
273	V	63.8	Low	62.6	Low	40 Å²	40	81.9 Å²	81.9	24%	0.242	42%	0.424	C	S	.	.			trans	-97.5	102.3	-178.3	-174.9	0	0	0	0	107.9	S270 N275 E276	S270-V273 PolarHBondContact O-N 2.81Å; V273-N275 HydrophobicContact CG1-CB 4.38Å; V273-N275 PolarHBondContact O-N 3.29Å; V273-E276 PolarHBondContact O-N 3Å
274	E	55.3	Low	60.2	Low	139 Å²	139	90.6 Å²	90.6	65%	0.65	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-56	-25	-176.5	-69.5	-175.8	166.2	0	0	112.7	S277	E274-S277 PolarHBondContact O-OG 2.82Å
275	N	50.7	Low	57.9	Low	126 Å²	126	93.8 Å²	93.8	67%	0.674	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-79.5	-16.8	-173.3	-70.7	-19.7	0	0	0	116.4	V273 S277 T278	V273-N275 HydrophobicContact CG1-CB 4.38Å; V273-N275 PolarHBondContact O-N 3.29Å; N275-S277 VanDerWaalsContact C-N 3.31Å; N275-T278 PolarHBondContact O-OG1 2.9Å
276	E	44.9	Very low	55.3	Low	112 Å²	112	95.6 Å²	95.6	52%	0.523	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-80.3	-17.5	175	-74.6	-169.5	167.5	0	0	112.4	V273 T278	V273-E276 PolarHBondContact O-N 3Å; E276-T278 PolarHBondContact O-N 3.43Å
277	S	42.5	Very low	53.1	Low	77 Å²	77	101.7 Å²	101.7	54%	0.538	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-72.8	-14.3	-179.8	67.8	0	0	0	0	113.9	E274 N275	E274-S277 PolarHBondContact O-OG 2.82Å; N275-S277 VanDerWaalsContact C-N 3.31Å
278	T	40.7	Very low	50.8	Low	99 Å²	99	109.1 Å²	109.1	61%	0.607	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-100.8	-9.2	-175.7	11.1	0	0	0	0	115.4	N275 E276	N275-T278 PolarHBondContact O-OG1 2.9Å; E276-T278 PolarHBondContact O-N 3.43Å
279	Q	40.5	Very low	48.6	Very low	172 Å²	172	116.4 Å²	116.4	80%	0.804	61%	0.607	S	S	*	*	S	Bend	trans	-90.2	-0.9	-179.1	-75.1	-170.9	3.1	0	0	115.3
280	I	42.4	Very low	46.5	Very low	132 Å²	132	118.5 Å²	118.5	68%	0.677	63%	0.631	S	S	*	*	S	Bend	trans	-108.3	51	175.1	-45.3	179.1	0	0	0	110.6
281	Q	34.3	Very low	44.6	Very low	175 Å²	175	126.1 Å²	126.1	82%	0.818	67%	0.671	S	S	*	*	S	Bend	trans	-122.9	7	169	-92.7	-169.7	8.7	0	0	115.2
282	T	33.4	Very low	43.2	Very low	126 Å²	126	134.7 Å²	134.7	77%	0.773	70%	0.695	S	S	*	*			trans	-139.5	62.1	176.2	52.5	0	0	0	0	112.9
283	I	38.1	Very low	41.8	Very low	135 Å²	135	137.8 Å²	137.8	69%	0.692	72%	0.724	S	S	*	*			trans	-107.1	94.1	147.1	-58.9	178.8	0	0	0	105.6	D285	I283-D285 WeakPolarHBondContact CG2-OD1 3.47Å; I283-D285 PolarHBondContact O-N 2.86Å
284	K	35.7	Very low	40.6	Very low	195 Å²	195	144.9 Å²	144.9	85%	0.848	75%	0.752	S	S	*	*			trans	-70.1	86.7	163	-81.9	-179.2	175	176.1	0	106.8	T286	K284-T286 VanDerWaalsContact C-N 3.31Å; K284-T286 PolarHBondContact O-N 3Å
285	D	37.5	Very low	39.9	Very low	137 Å²	137	143.6 Å²	143.6	73%	0.733	76%	0.755	S	S	*	*			trans	-72.2	95.3	162.2	-79	-26.7	0	0	0	107.9	I283 N287	I283-D285 WeakPolarHBondContact CG2-OD1 3.47Å; I283-D285 PolarHBondContact O-N 2.86Å; D285-N287 PolarHBondContact O-N 3.35Å
286	T	35.1	Very low	39.5	Very low	124 Å²	124	145.2 Å²	145.2	76%	0.761	76%	0.763	S	S	*	*			trans	-64.5	87.3	155	46.3	0	0	0	0	107.7	K284	K284-T286 VanDerWaalsContact C-N 3.31Å; K284-T286 PolarHBondContact O-N 3Å
287	N	38.9	Very low	39.6	Very low	154 Å²	154	148.2 Å²	148.2	82%	0.824	78%	0.777	S	S	*	*			trans	-154.2	105.8	155.9	-89.9	-32.2	0	0	0	109.5	D285	D285-N287 PolarHBondContact O-N 3.35Å
288	E	39.5	Very low	39.9	Very low	179 Å²	179	150.2 Å²	150.2	84%	0.836	78%	0.78	S	S	*	*			trans	-63	141.9	168.8	-63	179.2	156.8	0	0	109.7
289	N	39.5	Very low	40.8	Very low	159 Å²	159	154.4 Å²	154.4	85%	0.85	79%	0.789	S	S	*	*			trans	94.5	81	171.8	-52.9	-37.7	0	0	0	117.6
290	S	39.3	Very low	42.1	Very low	107 Å²	107	150.7 Å²	150.7	75%	0.748	77%	0.77	S	S	*	*				-164.5	121.4	127.5	51.4	0	0	0	0	112.2	Y292	S290-Y292 PolarHBondContact O-N 3.43Å
291	N	39	Very low	43.9	Very low	170 Å²	170	149.3 Å²	149.3	91%	0.909	76%	0.764	S	S	*	*			trans	-76.9	62.7	173.9	-86.4	-20.8	0	0	0	111.7
292	Y	44.4	Very low	46.3	Very low	211 Å²	211	146.7 Å²	146.7	83%	0.827	76%	0.755	S	S	*	*			trans	-142.8	90.4	163.8	-80.3	-76.7	0	0	0	109.7	S290 K294	S290-Y292 PolarHBondContact O-N 3.43Å; Y292-K294 VanDerWaalsContact C-N 3.35Å; Y292-K294 PolarHBondContact O-N 3.45Å
293	S	42.1	Very low	48.8	Very low	125 Å²	125	144.7 Å²	144.7	87%	0.874	74%	0.737	S	S	*	*			trans	-67.7	90.5	167.3	51.8	0	0	0	0	109.6
294	K	39.9	Very low	51.1	Low	189 Å²	189	139.7 Å²	139.7	82%	0.822	72%	0.718	S	S	*	*			trans	-65.3	136.4	160	-102.7	178.9	176.4	177.1	0	107.9	Y292 L296	Y292-K294 VanDerWaalsContact C-N 3.35Å; Y292-K294 PolarHBondContact O-N 3.45Å; K294-L296 PolarHBondContact O-N 2.66Å
295	P	38.6	Very low	53.4	Low	111 Å²	111	132 Å²	132	72%	0.721	69%	0.687	S	S	*	*			trans	-61.7	129.2	174.4	26.4	-30.7	0	0	0	108.2	Q297	P295-Q297 VanDerWaalsContact C-N 3.26Å; P295-Q297 PolarHBondContact O-N 2.78Å
296	L	43.9	Very low	55.4	Low	160 Å²	160	128.5 Å²	128.5	84%	0.838	67%	0.671	S	S	*	*			trans	-60.6	94.3	165.3	-94.3	98.3	0	0	0	107.4	K294 M298	K294-L296 PolarHBondContact O-N 2.66Å; L296-M298 PolarHBondContact O-N 2.61Å
297	Q	46.4	Very low	57.5	Low	175 Å²	175	126.3 Å²	126.3	82%	0.818	65%	0.654	S	S	*	*			trans	-72	105.9	164.2	-98.6	177.7	-16.3	0	0	106.8	P295 K299	P295-Q297 VanDerWaalsContact C-N 3.26Å; P295-Q297 PolarHBondContact O-N 2.78Å; Q297-K299 PolarHBondContact O-N 3.36Å
298	M	49.6	Very low	59.6	Low	120 Å²	120	119.4 Å²	119.4	59%	0.591	62%	0.616	S	S	*	*			trans	-52.4	107.7	160	-89.7	167.3	76.2	0	0	107.2	L296 F300	L296-M298 PolarHBondContact O-N 2.61Å; M298-F300 VanDerWaalsContact C-N 3.33Å; M298-F300 HydrophobicContact CB-CD2 4.48Å; M298-F300 HydrophobicContact CB-CE2 4.05Å; M298-F300 HydrophobicContact CB-CZ 4.22Å; M298-F300 HydrophobicContact CE-CE1 3.6Å; M298-F300 HydrophobicContact CE-CE2 4.35Å; M298-F300 HydrophobicContact CE-CZ 3.4Å; M298-F300 PolarHBondContact O-N 3.21Å; M298-F300 VanDerWaalsContact O-N 3.09Å; M298-F300 HydrophobicContact SD-CZ 4.39Å
299	K	58.4	Low	61.5	Low	187 Å²	187	112.1 Å²	112.1	81%	0.813	58%	0.582	S	S	*	*			trans	-85.3	84.3	-177.9	-152.7	-179.1	-174.8	-171.5	0	107	Q297 N301	Q297-K299 PolarHBondContact O-N 3.36Å; K299-N301 PolarHBondContact O-N 3.01Å
300	F	69.3	Low	63.4	Low	93 Å²	93	108 Å²	108	41%	0.408	56%	0.56	S	S	.	*			trans	-64.1	123.6	171.7	-61.8	-75.7	0	0	0	108.9	Y269 S270 G271 M298	Y269-F300 HydrophobicContact CD2-CB 4.42Å; Y269-F300 HydrophobicContact CE2-CB 3.62Å; Y269-F300 HydrophobicContact CE2-CD1 4.4Å; Y269-F300 HydrophobicContact CE2-CG 4.06Å; S270-F300 WeakPolarHBondContact OG-CA 3.48Å; G271-F300 VanDerWaalsContact CA-CD1 3.47Å; M298-F300 VanDerWaalsContact C-N 3.33Å; M298-F300 HydrophobicContact CB-CD2 4.48Å; M298-F300 HydrophobicContact CB-CE2 4.05Å; M298-F300 HydrophobicContact CB-CZ 4.22Å; M298-F300 HydrophobicContact CE-CE1 3.6Å; M298-F300 HydrophobicContact CE-CE2 4.35Å; M298-F300 HydrophobicContact CE-CZ 3.4Å; M298-F300 PolarHBondContact O-N 3.21Å; M298-F300 VanDerWaalsContact O-N 3.09Å; M298-F300 HydrophobicContact SD-CZ 4.39Å
301	N	78.5	Confident	65.7	Low	103 Å²	103	104.4 Å²	104.4	55%	0.551	53%	0.53	S	S	*	.			trans	-81.3	127.3	171.5	-66.7	-23	0	0	0	109.2	S270 K299	S270-N301 PolarHBondContact N-O 3.21Å; S270-N301 VanDerWaalsContact N-O 3.08Å; S270-N301 PolarHBondContact OG-N 2.96Å; S270-N301 PolarHBondContact OG-O 2.8Å; S270-N301 VanDerWaalsContact OG-O 3.07Å; K299-N301 PolarHBondContact O-N 3.01Å
302	I	84.8	Confident	68	Low	120 Å²	120	96.5 Å²	96.5	62%	0.615	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.3	169.7	-63.8	163.4	0	0	0	106.5	F267 H268 Y269	F267-I302 HydrophobicContact CE2-CG2 3.99Å; H268-I302 WeakPolarHBondContact O-CA 3.49Å; Y269-I302 HydrophobicContact CD2-CD1 4.25Å; Y269-I302 HydrophobicContact CD2-CG1 3.49Å; Y269-I302 VanDerWaalsContact CD2-CG1 3.49Å; Y269-I302 HydrophobicContact CE2-CD1 4.29Å; Y269-I302 HydrophobicContact CE2-CG1 3.94Å
303	E	86.2	Confident	70	Confident	84 Å²	84	86.5 Å²	86.5	39%	0.393	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	161.4	177.2	63.5	-179.9	-175.8	0	0	111.2	R134 F267 H268	R134-E303 VanDerWaalsContact CD-OE1 3.25Å; R134-E303 WeakPolarHBondContact CD-OE1 3.5Å; R134-E303 IonicContact CZ-OE1 2.67Å; R134-E303 IonicContact NE-OE1 2.73Å; R134-E303 IonicContact NH1-OE1 2.8Å; R134-E303 PolarHBondContact NH1-OE1 2.6Å; F267-E303 WeakPolarHBondContact CA-O 2.95Å; H268-E303 HydrophobicContact CB-CG 3.61Å; H268-E303 IonicContact CD2-OE1 2.76Å; H268-E303 PolarHBondContact CD2-OE1 3.43Å; H268-E303 IonicContact CG-OE1 3.48Å; H268-E303 PolarHBondContact N-O 3.36Å; H268-E303 PolarHBondContact O-N 3.49Å
304	G	86.3	Confident	72.2	Confident	30 Å²	30	83.4 Å²	83.4	31%	0.309	42%	0.424	S	S	.	.	S	Bend	trans	77.2	-177.6	177.6	0	0	0	0	0	115.2	R265	R265-G304 WeakPolarHBondContact O-CA 3.42Å
305	N	84.9	Confident	74.7	Confident	35 Å²	35	74.6 Å²	74.6	19%	0.187	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-104.6	111.9	-172.5	-179.1	6.2	0	0	0	111.3	G263 R265 M307 R308 Y311	G263-N305 WeakPolarHBondContact O-CB 3.43Å; G263-N305 PolarHBondContact O-ND2 3.31Å; G263-N305 VanDerWaalsContact O-ND2 3.09Å; R265-N305 PolarHBondContact O-N 3.35Å; N305-M307 PolarHBondContact O-N 3.14Å; N305-M307 WeakPolarHBondContact OD1-CA 3.2Å; N305-M307 WeakPolarHBondContact OD1-CB 3.29Å; N305-M307 PolarHBondContact OD1-N 3.43Å; N305-R308 PolarHBondContact O-N 3.01Å; N305-Y311 WeakPolarHBondContact ND2-CB 3.11Å
306	P	79.1	Confident	77.2	Confident	62 Å²	62	69.5 Å²	69.5	40%	0.403	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.2	175.9	26.7	-33.6	0	0	0	112.9	F267	F267-P306 HydrophobicContact CD2-CB 3.95Å; F267-P306 HydrophobicContact CD2-CG 4.43Å; F267-P306 HydrophobicContact CE2-CB 4.32Å; F267-P306 HydrophobicContact CG-CB 4.25Å
307	M	79.1	Confident	79.4	Confident	79 Å²	79	66.3 Å²	66.3	39%	0.389	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	31.6	178.6	-54.5	-67.3	-62.8	0	0	112.2	N305 I309 L310 Y311 T382	N305-M307 PolarHBondContact O-N 3.14Å; N305-M307 WeakPolarHBondContact OD1-CA 3.2Å; N305-M307 WeakPolarHBondContact OD1-CB 3.29Å; N305-M307 PolarHBondContact OD1-N 3.43Å; M307-I309 PolarHBondContact O-N 3.22Å; M307-I309 VanDerWaalsContact O-N 3.1Å; M307-L310 HydrophobicContact CB-CB 4.49Å; M307-L310 HydrophobicContact CE-CD2 4.47Å; M307-L310 PolarHBondContact O-N 3.5Å; M307-Y311 PolarHBondContact O-N 3.06Å; M307-T382 HydrophobicContact CE-CG2 3.52Å; M307-T382 HydrophobicContact SD-CG2 3.16Å; M307-T382 WeakPolarHBondContact SD-CG2 3.43Å
308	R	82.9	Confident	81.5	Confident	9 Å²	9	60.2 Å²	60.2	3%	0.034	30%	0.303	C	S	.	.	H	α-helix	trans	-51.6	-35.6	-176.1	-175	176.8	172.7	-84.2	-3.5	113.7	W264 N305 L310 Y311 K312 E363 D367	W264-R308 VanDerWaalsContact O-CD 3.28Å; W264-R308 WeakPolarHBondContact O-CD 3.3Å; W264-R308 PolarHBondContact O-NE 3.11Å; N305-R308 PolarHBondContact O-N 3.01Å; R308-L310 PolarHBondContact O-N 3.42Å; R308-Y311 WeakPolarHBondContact O-CB 3.42Å; R308-Y311 PolarHBondContact O-N 2.95Å; R308-K312 WeakPolarHBondContact O-CB 3.25Å; R308-K312 PolarHBondContact O-N 3.4Å; R308-E363 IonicContact NH2-OE1 2.76Å; R308-E363 IonicContact NH2-OE2 3.79Å; R308-E363 PolarHBondContact NH2-OE2 3.1Å; R308-D367 IonicContact CZ-OD1 3.79Å; R308-D367 IonicContact NH1-OD1 3.97Å; R308-D367 PolarHBondContact NH1-OD1 3.35Å; R308-D367 IonicContact NH1-OD2 3.52Å; R308-D367 IonicContact NH2-OD1 3.13Å
309	I	78.8	Confident	83.6	Confident	25 Å²	25	54.5 Å²	54.5	13%	0.128	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-47.3	176.7	-65.2	175.3	0	0	0	111.5	M307 Y311 K312 S313 T386 W406	M307-I309 PolarHBondContact O-N 3.22Å; M307-I309 VanDerWaalsContact O-N 3.1Å; I309-Y311 VanDerWaalsContact C-N 3.34Å; I309-K312 PolarHBondContact O-N 2.76Å; I309-S313 PolarHBondContact O-N 3.41Å; I309-S313 PolarHBondContact O-OG 3.09Å; I309-T386 HydrophobicContact CG2-CG2 4.32Å; I309-W406 HydrophobicContact CB-CH2 4.45Å; I309-W406 HydrophobicContact CG2-CH2 3.67Å; I309-W406 HydrophobicContact CG2-CZ2 4.32Å; I309-W406 HydrophobicContact CG2-CZ3 4.27Å
310	L	80.2	Confident	85.2	Confident	73 Å²	73	50.2 Å²	50.2	38%	0.382	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-43.1	178.9	177.8	62.9	0	0	0	110.7	M307 R308 K312 S313 V314 L399	M307-L310 HydrophobicContact CB-CB 4.49Å; M307-L310 HydrophobicContact CE-CD2 4.47Å; M307-L310 PolarHBondContact O-N 3.5Å; R308-L310 PolarHBondContact O-N 3.42Å; L310-K312 VanDerWaalsContact C-N 3.33Å; L310-K312 PolarHBondContact O-N 3.14Å; L310-S313 PolarHBondContact O-N 2.78Å; L310-V314 HydrophobicContact CD1-CG2 4.49Å; L310-V314 WeakPolarHBondContact O-CG2 3.48Å; L310-V314 PolarHBondContact O-N 3.02Å; L310-L399 HydrophobicContact CD1-CD1 4.1Å; L310-L399 HydrophobicContact CD1-CD2 3.85Å
311	Y	87.1	Confident	86.1	Confident	32 Å²	32	48 Å²	48	13%	0.125	25%	0.25	C	S	.	.	H	α-helix	trans	-57.7	-46.5	175.5	169.6	-92.6	0	0	0	111.8	S260 G263 W264 N305 M307 R308 I309 S313 V314 C315	S260-Y311 WeakPolarHBondContact O-CE2 3.24Å; S260-Y311 VanDerWaalsContact O-CZ 3.27Å; S260-Y311 PolarHBondContact O-OH 3.31Å; G263-Y311 WeakPolarHBondContact O-CD1 3.46Å; W264-Y311 HydrophobicContact CB-CE1 3.81Å; N305-Y311 WeakPolarHBondContact ND2-CB 3.11Å; M307-Y311 PolarHBondContact O-N 3.06Å; R308-Y311 WeakPolarHBondContact O-CB 3.42Å; R308-Y311 PolarHBondContact O-N 2.95Å; I309-Y311 VanDerWaalsContact C-N 3.34Å; Y311-S313 PolarHBondContact O-N 3.4Å; Y311-V314 PolarHBondContact O-N 3.33Å; Y311-C315 PolarHBondContact O-N 3.49Å; Y311-C315 PolarHBondContact O-SG 3.28Å
312	K	87.3	Confident	86.5	Confident	4 Å²	4	50 Å²	50	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-43.5	176.4	174.1	161.8	169.6	155.9	0	111.6	R308 I309 L310 V314 C315 W316 S336 D367 A405 W406	R308-K312 WeakPolarHBondContact O-CB 3.25Å; R308-K312 PolarHBondContact O-N 3.4Å; I309-K312 PolarHBondContact O-N 2.76Å; L310-K312 VanDerWaalsContact C-N 3.33Å; L310-K312 PolarHBondContact O-N 3.14Å; K312-V314 PolarHBondContact O-N 3.28Å; K312-C315 PolarHBondContact O-N 3.42Å; K312-W316 WeakPolarHBondContact O-CB 3.28Å; K312-W316 PolarHBondContact O-N 3.46Å; K312-S336 WeakPolarHBondContact CE-O 3.33Å; K312-S336 PolarHBondContact NZ-O 3.12Å; K312-S336 VanDerWaalsContact NZ-O 3.08Å; K312-D367 WeakPolarHBondContact CD-OD2 3.47Å; K312-D367 WeakPolarHBondContact CE-OD2 3.2Å; K312-D367 IonicContact NZ-OD2 2.62Å; K312-D367 PolarHBondContact NZ-OD2 3.01Å; K312-A405 WeakPolarHBondContact CE-O 3.4Å; K312-A405 PolarHBondContact NZ-O 3.25Å; K312-W406 HydrophobicContact CD-CH2 4.32Å; K312-W406 HydrophobicContact CD-CZ3 3.91Å; K312-W406 HydrophobicContact CG-CH2 4.32Å; K312-W406 HydrophobicContact CG-CZ3 4.41Å
313	S	86.2	Confident	86.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-44.5	175.6	-63.6	0	0	0	0	112.9	I309 L310 Y311 W316 W317	I309-S313 PolarHBondContact O-N 3.41Å; I309-S313 PolarHBondContact O-OG 3.09Å; L310-S313 PolarHBondContact O-N 2.78Å; Y311-S313 PolarHBondContact O-N 3.4Å; S313-W316 PolarHBondContact O-N 3.28Å; S313-W317 PolarHBondContact O-N 3.39Å
314	V	88.5	Confident	86.7	Confident	61 Å²	61	48.2 Å²	48.2	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-65	-43.6	177.9	174.2	0	0	0	0	111	L310 Y311 K312 W316 W317 N318	L310-V314 HydrophobicContact CD1-CG2 4.49Å; L310-V314 WeakPolarHBondContact O-CG2 3.48Å; L310-V314 PolarHBondContact O-N 3.02Å; Y311-V314 PolarHBondContact O-N 3.33Å; K312-V314 PolarHBondContact O-N 3.28Å; V314-W316 VanDerWaalsContact C-N 3.34Å; V314-W316 PolarHBondContact O-N 3.42Å; V314-W317 PolarHBondContact O-N 3.47Å; V314-N318 WeakPolarHBondContact O-CB 3.32Å; V314-N318 PolarHBondContact O-N 3.5Å
315	C	92	Very high	86.7	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.02	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-43.1	175.2	-69.4	0	0	0	0	111.4	Y311 K312 W317 N318 S319 Y332	Y311-C315 PolarHBondContact O-N 3.49Å; Y311-C315 PolarHBondContact O-SG 3.28Å; K312-C315 PolarHBondContact O-N 3.42Å; C315-W317 VanDerWaalsContact C-N 3.34Å; C315-W317 PolarHBondContact O-N 3.28Å; C315-N318 PolarHBondContact O-N 3.09Å; C315-S319 PolarHBondContact O-N 2.75Å; C315-Y332 HydrophobicContact CB-CD1 4.44Å; C315-Y332 WeakPolarHBondContact O-CB 3.36Å
316	W	91	Very high	87	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-47.3	177	-168.4	-71.8	0	0	0	111.3	K312 S313 V314 S319 E320 N338 L401 P402 A405	K312-W316 WeakPolarHBondContact O-CB 3.28Å; K312-W316 PolarHBondContact O-N 3.46Å; S313-W316 PolarHBondContact O-N 3.28Å; V314-W316 VanDerWaalsContact C-N 3.34Å; V314-W316 PolarHBondContact O-N 3.42Å; W316-S319 WeakPolarHBondContact O-CB 3.47Å; W316-S319 PolarHBondContact O-N 3.32Å; W316-S319 PolarHBondContact O-OG 3.26Å; W316-E320 PolarHBondContact NE1-OE1 3.17Å; W316-E320 PolarHBondContact O-N 3.47Å; W316-N338 HydrophobicContact CD2-CB 3.92Å; W316-N338 HydrophobicContact CE3-CB 3.78Å; W316-N338 HydrophobicContact CH2-CB 3.96Å; W316-N338 HydrophobicContact CZ2-CB 4.08Å; W316-N338 HydrophobicContact CZ3-CB 3.8Å; W316-N338 PolarHBondContact NE1-ND2 3.31Å; W316-L401 HydrophobicContact CB-CD1 4.02Å; W316-L401 HydrophobicContact CB-CD2 3.76Å; W316-L401 HydrophobicContact CD2-CD1 4.33Å; W316-L401 HydrophobicContact CD2-CD2 4.46Å; W316-L401 HydrophobicContact CE3-CD1 4.46Å; W316-L401 HydrophobicContact CG-CD1 4.15Å; W316-L401 HydrophobicContact CG-CD2 3.7Å; W316-L401 HydrophobicContact CG-CG 4.48Å; W316-P402 HydrophobicContact CH2-CG 4.46Å; W316-P402 HydrophobicContact CZ2-CG 3.64Å; W316-A405 HydrophobicContact CD2-CB 4.18Å; W316-A405 HydrophobicContact CE3-CB 3.68Å; W316-A405 HydrophobicContact CH2-CB 3.67Å; W316-A405 HydrophobicContact CZ2-CB 4.17Å; W316-A405 HydrophobicContact CZ3-CB 3.41Å; W316-A405 VanDerWaalsContact CZ3-CB 3.41Å
317	W	89.9	Confident	87.6	Confident	94 Å²	94	53.4 Å²	53.4	36%	0.356	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-40.2	178.5	-64	-23.6	0	0	0	114.1	S313 V314 C315 S319 E320 N321 G398 L399	S313-W317 PolarHBondContact O-N 3.39Å; V314-W317 PolarHBondContact O-N 3.47Å; C315-W317 VanDerWaalsContact C-N 3.34Å; C315-W317 PolarHBondContact O-N 3.28Å; W317-S319 PolarHBondContact O-N 3.34Å; W317-E320 PolarHBondContact O-N 3.01Å; W317-E320 VanDerWaalsContact O-N 3.12Å; W317-N321 PolarHBondContact O-N 3Å; W317-G398 WeakPolarHBondContact CH2-O 3.47Å; W317-G398 WeakPolarHBondContact CZ2-O 3.43Å; W317-L399 HydrophobicContact CE3-CD2 4.37Å; W317-L399 VanDerWaalsContact CH2-CA 3.49Å; W317-L399 HydrophobicContact CH2-CB 4.08Å; W317-L399 HydrophobicContact CH2-CD2 3.11Å; W317-L399 HydrophobicContact CH2-CG 3.54Å; W317-L399 HydrophobicContact CZ2-CB 4.35Å; W317-L399 HydrophobicContact CZ2-CD2 3.85Å; W317-L399 HydrophobicContact CZ2-CG 4.28Å; W317-L399 HydrophobicContact CZ3-CD2 3.38Å; W317-L399 HydrophobicContact CZ3-CG 4.2Å
318	N	91.2	Very high	88.3	Confident	47 Å²	47	51.5 Å²	51.5	25%	0.251	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-34.1	174.8	-76.8	-20	0	0	0	110.9	V314 C315 E320 N321 L324 Y332	V314-N318 WeakPolarHBondContact O-CB 3.32Å; V314-N318 PolarHBondContact O-N 3.5Å; C315-N318 PolarHBondContact O-N 3.09Å; N318-E320 VanDerWaalsContact C-N 3.31Å; N318-E320 PolarHBondContact O-N 3.25Å; N318-N321 WeakPolarHBondContact O-CB 3.44Å; N318-N321 PolarHBondContact O-N 3.37Å; N318-L324 HydrophobicContact CB-CD1 3.94Å; N318-L324 WeakPolarHBondContact O-CD1 3.37Å; N318-Y332 HydrophobicContact CB-CD1 4.39Å; N318-Y332 HydrophobicContact CB-CD2 3.53Å; N318-Y332 HydrophobicContact CB-CE2 3.92Å; N318-Y332 HydrophobicContact CB-CG 3.8Å
319	S	93.6	Very high	88.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-35.9	173.8	79.7	0	0	0	0	112.9	C315 W316 W317 R329 N338 V341	C315-S319 PolarHBondContact O-N 2.75Å; W316-S319 WeakPolarHBondContact O-CB 3.47Å; W316-S319 PolarHBondContact O-N 3.32Å; W316-S319 PolarHBondContact O-OG 3.26Å; W317-S319 PolarHBondContact O-N 3.34Å; S319-R329 WeakPolarHBondContact CB-O 3.29Å; S319-R329 WeakPolarHBondContact O-CB 3.38Å; S319-R329 VanDerWaalsContact O-CD 3.23Å; S319-R329 WeakPolarHBondContact O-CD 3.41Å; S319-R329 WeakPolarHBondContact O-CG 3.38Å; S319-R329 PolarHBondContact O-NE 3.02Å; S319-N338 PolarHBondContact OG-ND2 3.25Å; S319-V341 VanDerWaalsContact O-CG1 3.28Å; S319-V341 WeakPolarHBondContact O-CG1 3.41Å
320	E	91.3	Very high	89.6	Confident	97 Å²	97	52.2 Å²	52.2	45%	0.453	25%	0.247	S	C	.	.	H	α-helix	trans	-83.4	-11.8	178.2	-67.9	-179.8	173.6	0	0	113.3	W316 W317 N318 I322 N338 V341	W316-E320 PolarHBondContact NE1-OE1 3.17Å; W316-E320 PolarHBondContact O-N 3.47Å; W317-E320 PolarHBondContact O-N 3.01Å; W317-E320 VanDerWaalsContact O-N 3.12Å; N318-E320 VanDerWaalsContact C-N 3.31Å; N318-E320 PolarHBondContact O-N 3.25Å; E320-I322 PolarHBondContact O-N 3Å; E320-N338 PolarHBondContact OE1-ND2 3.35Å; E320-V341 HydrophobicContact CG-CG2 3.87Å
321	N	89.6	Confident	90.3	Very high	47 Å²	47	49 Å²	49	25%	0.251	23%	0.231	S	C	.	.			trans	-71.8	103.2	-178.1	-174	-3	0	0	0	111.3	W317 N318 K323 L324 R329	W317-N321 PolarHBondContact O-N 3Å; N318-N321 WeakPolarHBondContact O-CB 3.44Å; N318-N321 PolarHBondContact O-N 3.37Å; N321-K323 PolarHBondContact O-N 3.46Å; N321-K323 VanDerWaalsContact O-N 3.09Å; N321-K323 VanDerWaalsContact OD1-CB 3.27Å; N321-K323 WeakPolarHBondContact OD1-CB 3.28Å; N321-K323 PolarHBondContact OD1-N 2.8Å; N321-L324 HydrophobicContact CB-CD1 4.33Å; N321-L324 HydrophobicContact CB-CG 4.24Å; N321-L324 PolarHBondContact O-N 3.33Å; N321-R329 WeakPolarHBondContact O-CD 3.43Å
322	I	87.5	Confident	90.7	Very high	145 Å²	145	49 Å²	49	74%	0.744	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.7	-178.8	-56	165.3	0	0	0	112.4	E320 L324	E320-I322 PolarHBondContact O-N 3Å; I322-L324 VanDerWaalsContact C-N 3.26Å; I322-L324 PolarHBondContact O-N 3.37Å
323	K	85.9	Confident	91.1	Very high	151 Å²	151	48.8 Å²	48.8	66%	0.657	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.1	175.1	-61.5	-178.6	174	-174.5	0	112.8	T212 N321	T212-K323 HydrophobicContact CG2-CB 4.27Å; T212-K323 HydrophobicContact CG2-CD 4.24Å; N321-K323 PolarHBondContact O-N 3.46Å; N321-K323 VanDerWaalsContact O-N 3.09Å; N321-K323 VanDerWaalsContact OD1-CB 3.27Å; N321-K323 WeakPolarHBondContact OD1-CB 3.28Å; N321-K323 PolarHBondContact OD1-N 2.8Å
324	L	87.9	Confident	91.6	Very high	14 Å²	14	48.9 Å²	48.9	7%	0.073	23%	0.23	C	C	.	.	S	Bend	trans	-80.7	147.8	175.1	-60.4	-176.8	0	0	0	110.1	T212 N318 N321 I322 E328 R329 Y332	T212-L324 HydrophobicContact CG2-CD2 4.25Å; N318-L324 HydrophobicContact CB-CD1 3.94Å; N318-L324 WeakPolarHBondContact O-CD1 3.37Å; N321-L324 HydrophobicContact CB-CD1 4.33Å; N321-L324 HydrophobicContact CB-CG 4.24Å; N321-L324 PolarHBondContact O-N 3.33Å; I322-L324 VanDerWaalsContact C-N 3.26Å; I322-L324 PolarHBondContact O-N 3.37Å; L324-E328 HydrophobicContact CD1-CG 4.41Å; L324-R329 HydrophobicContact CB-CG 3.71Å; L324-R329 WeakPolarHBondContact O-CD 3.22Å; L324-Y332 HydrophobicContact CD1-CD2 4.17Å; L324-Y332 HydrophobicContact CD1-CE2 3.91Å
325	R	87	Confident	91.8	Very high	114 Å²	114	46.5 Å²	46.5	43%	0.43	22%	0.215	S	C	.	.			trans	-72.8	160.8	-179.9	-62.7	-153.3	-179.1	-153.6	-3.4	111.5	Q223 D227 F327 E328 R329	Q223-R325 VanDerWaalsContact NE2-CZ 3.26Å; Q223-R325 VanDerWaalsContact NE2-NE 3.15Å; D227-R325 VanDerWaalsContact OD1-CD 3.28Å; D227-R325 WeakPolarHBondContact OD1-CD 3.5Å; D227-R325 IonicContact OD1-CZ 3.76Å; D227-R325 IonicContact OD1-NE 3.89Å; D227-R325 IonicContact OD1-NH1 2.74Å; D227-R325 IonicContact OD2-CZ 3.5Å; D227-R325 IonicContact OD2-NE 3.29Å; D227-R325 IonicContact OD2-NH1 2.87Å; D227-R325 PolarHBondContact OD2-NH1 2.93Å; R325-F327 PolarHBondContact O-N 3.31Å; R325-E328 PolarHBondContact O-N 2.98Å; R325-R329 WeakPolarHBondContact O-CG 3.25Å; R325-R329 PolarHBondContact O-N 3.1Å
326	S	90.8	Very high	91.7	Very high	55 Å²	55	46.4 Å²	46.4	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-51.1	-55.7	-172.2	51.7	0	0	0	0	113.5	E328 R329 A330 I345	S326-E328 VanDerWaalsContact C-N 3.33Å; S326-E328 PolarHBondContact O-N 3.49Å; S326-R329 PolarHBondContact O-N 3Å; S326-A330 WeakPolarHBondContact O-CB 3.26Å; S326-A330 PolarHBondContact O-N 3.36Å; S326-I345 WeakPolarHBondContact O-CD1 3.43Å
327	F	92	Very high	91.8	Very high	67 Å²	67	46.7 Å²	46.7	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-69.9	-28.1	-176.5	-69.8	-65.7	0	0	0	113.7	I230 N231 F234 R325 A330 I331	I230-F327 HydrophobicContact CG2-CB 3.69Å; N231-F327 HydrophobicContact CB-CD2 3.86Å; N231-F327 HydrophobicContact CB-CE2 4.11Å; N231-F327 HydrophobicContact CB-CG 4.23Å; N231-F327 WeakPolarHBondContact OD1-CZ 3.46Å; F234-F327 HydrophobicContact CB-CB 4.29Å; F234-F327 HydrophobicContact CB-CD1 4.18Å; F234-F327 AromaticContact CD1-CD1 3.63Å; F234-F327 HydrophobicContact CD1-CD1 3.63Å; F234-F327 HydrophobicContact CD1-CE1 4.02Å; F234-F327 HydrophobicContact CE1-CD1 4.29Å; F234-F327 HydrophobicContact CE1-CE1 4.43Å; F234-F327 AromaticContact CG-CD1 3.97Å; F234-F327 HydrophobicContact CG-CD1 3.97Å; R325-F327 PolarHBondContact O-N 3.31Å; F327-A330 WeakPolarHBondContact O-CB 3.43Å; F327-A330 PolarHBondContact O-N 2.9Å; F327-I331 WeakPolarHBondContact O-CG1 3.44Å; F327-I331 PolarHBondContact O-N 3.35Å
328	E	92.7	Very high	91.9	Very high	39 Å²	39	42.2 Å²	42.2	18%	0.182	20%	0.202	C	C	.	.	H	α-helix	trans	-69.6	-44.2	173.3	-179	168.4	-158.9	0	0	111	I230 L324 R325 S326 A330 I331 Y332	I230-E328 HydrophobicContact CG2-CB 4.03Å; L324-E328 HydrophobicContact CD1-CG 4.41Å; R325-E328 PolarHBondContact O-N 2.98Å; S326-E328 VanDerWaalsContact C-N 3.33Å; S326-E328 PolarHBondContact O-N 3.49Å; E328-A330 PolarHBondContact O-N 2.65Å; E328-I331 WeakPolarHBondContact O-CB 3.24Å; E328-I331 PolarHBondContact O-N 3.04Å; E328-Y332 HydrophobicContact CG-CD2 4.12Å; E328-Y332 HydrophobicContact CG-CE2 3.55Å; E328-Y332 WeakPolarHBondContact O-CD2 3.41Å; E328-Y332 PolarHBondContact O-N 3.16Å
329	R	94.8	Very high	92.1	Very high	50 Å²	50	41 Å²	41	19%	0.189	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-37.6	170.4	-65.9	-170.2	-21.4	-137.9	4.1	111.9	S319 N321 L324 R325 S326 Y332 A333 V341 I345	S319-R329 WeakPolarHBondContact CB-O 3.29Å; S319-R329 WeakPolarHBondContact O-CB 3.38Å; S319-R329 VanDerWaalsContact O-CD 3.23Å; S319-R329 WeakPolarHBondContact O-CD 3.41Å; S319-R329 WeakPolarHBondContact O-CG 3.38Å; S319-R329 PolarHBondContact O-NE 3.02Å; N321-R329 WeakPolarHBondContact O-CD 3.43Å; L324-R329 HydrophobicContact CB-CG 3.71Å; L324-R329 WeakPolarHBondContact O-CD 3.22Å; R325-R329 WeakPolarHBondContact O-CG 3.25Å; R325-R329 PolarHBondContact O-N 3.1Å; S326-R329 PolarHBondContact O-N 3Å; R329-Y332 PolarHBondContact O-N 2.88Å; R329-A333 VanDerWaalsContact O-CB 3.27Å; R329-A333 WeakPolarHBondContact O-CB 3.39Å; R329-A333 PolarHBondContact O-N 2.71Å; R329-V341 HydrophobicContact CB-CG1 4.34Å; R329-I345 HydrophobicContact CB-CD1 3.96Å
330	A	95.4	Very high	92	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-42.1	177.7	0	0	0	0	0	111.8	F234 S326 F327 E328 Y332 A333 T334 L342 I345	F234-A330 HydrophobicContact CD2-CB 3.65Å; F234-A330 HydrophobicContact CE2-CB 3.43Å; F234-A330 VanDerWaalsContact CE2-CB 3.43Å; F234-A330 HydrophobicContact CG-CB 4.37Å; F234-A330 HydrophobicContact CZ-CB 3.98Å; S326-A330 WeakPolarHBondContact O-CB 3.26Å; S326-A330 PolarHBondContact O-N 3.36Å; F327-A330 WeakPolarHBondContact O-CB 3.43Å; F327-A330 PolarHBondContact O-N 2.9Å; E328-A330 PolarHBondContact O-N 2.65Å; A330-Y332 PolarHBondContact O-N 3.02Å; A330-A333 WeakPolarHBondContact O-CB 3.46Å; A330-A333 PolarHBondContact O-N 2.81Å; A330-T334 WeakPolarHBondContact O-CB 3.36Å; A330-T334 PolarHBondContact O-N 3.48Å; A330-T334 PolarHBondContact O-OG1 3.4Å; A330-L342 HydrophobicContact CB-CD1 4.25Å; A330-I345 HydrophobicContact CB-CB 4.48Å; A330-I345 HydrophobicContact CB-CD1 4.16Å; A330-I345 HydrophobicContact CB-CG2 3.98Å
331	I	95.7	Very high	92.2	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-52.4	172.9	-72.5	166.5	0	0	0	110.4	I230 L233 F234 L237 L261 F327 E328 A333 T334 L335	I230-I331 HydrophobicContact CG2-CD1 4.23Å; L233-I331 HydrophobicContact CB-CD1 4.25Å; L233-I331 HydrophobicContact CD2-CD1 3.9Å; L233-I331 HydrophobicContact CG-CD1 4.11Å; F234-I331 HydrophobicContact CB-CD1 4.37Å; F234-I331 HydrophobicContact CB-CG1 4Å; F234-I331 HydrophobicContact CD2-CG1 4.06Å; L237-I331 HydrophobicContact CD2-CB 4.3Å; L237-I331 HydrophobicContact CD2-CG1 4.29Å; L237-I331 HydrophobicContact CD2-CG2 3.81Å; L261-I331 HydrophobicContact CD2-CG2 3.83Å; F327-I331 WeakPolarHBondContact O-CG1 3.44Å; F327-I331 PolarHBondContact O-N 3.35Å; E328-I331 WeakPolarHBondContact O-CB 3.24Å; E328-I331 PolarHBondContact O-N 3.04Å; I331-A333 VanDerWaalsContact C-N 3.33Å; I331-A333 PolarHBondContact O-N 3.47Å; I331-T334 PolarHBondContact O-N 3.49Å; I331-L335 HydrophobicContact CG2-CD1 3.83Å; I331-L335 VanDerWaalsContact O-CG 3.32Å; I331-L335 WeakPolarHBondContact O-CG 3.5Å; I331-L335 PolarHBondContact O-N 3.03Å
332	Y	95.2	Very high	92.4	Very high	30 Å²	30	39.6 Å²	39.6	12%	0.118	19%	0.192	C	C	.	.	H	α-helix	trans	-68.2	-32.6	-179.9	-61.7	-57.9	0	0	0	112.8	C315 N318 L324 E328 R329 A330 L335 S336	C315-Y332 HydrophobicContact CB-CD1 4.44Å; C315-Y332 WeakPolarHBondContact O-CB 3.36Å; N318-Y332 HydrophobicContact CB-CD1 4.39Å; N318-Y332 HydrophobicContact CB-CD2 3.53Å; N318-Y332 HydrophobicContact CB-CE2 3.92Å; N318-Y332 HydrophobicContact CB-CG 3.8Å; L324-Y332 HydrophobicContact CD1-CD2 4.17Å; L324-Y332 HydrophobicContact CD1-CE2 3.91Å; E328-Y332 HydrophobicContact CG-CD2 4.12Å; E328-Y332 HydrophobicContact CG-CE2 3.55Å; E328-Y332 WeakPolarHBondContact O-CD2 3.41Å; E328-Y332 PolarHBondContact O-N 3.16Å; R329-Y332 PolarHBondContact O-N 2.88Å; A330-Y332 PolarHBondContact O-N 3.02Å; Y332-L335 PolarHBondContact O-N 3.37Å; Y332-S336 WeakPolarHBondContact O-CB 3.45Å; Y332-S336 PolarHBondContact O-N 3.27Å; Y332-S336 VanDerWaalsContact O-N 3.07Å; Y332-S336 PolarHBondContact O-OG 2.88Å
333	A	95.5	Very high	92.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-42.9	174.1	0	0	0	0	0	111.3	R329 A330 I331 S336 G337 N338 V341 L342	R329-A333 VanDerWaalsContact O-CB 3.27Å; R329-A333 WeakPolarHBondContact O-CB 3.39Å; R329-A333 PolarHBondContact O-N 2.71Å; A330-A333 WeakPolarHBondContact O-CB 3.46Å; A330-A333 PolarHBondContact O-N 2.81Å; I331-A333 VanDerWaalsContact C-N 3.33Å; I331-A333 PolarHBondContact O-N 3.47Å; A333-S336 PolarHBondContact O-N 3.06Å; A333-S336 PolarHBondContact O-OG 2.93Å; A333-G337 CarbonylContact O-C 3.55Å; A333-G337 WeakPolarHBondContact O-CA 3.49Å; A333-G337 PolarHBondContact O-N 3.08Å; A333-N338 HydrophobicContact CB-CB 4.22Å; A333-N338 PolarHBondContact O-N 3.43Å; A333-V341 HydrophobicContact CB-CB 4.23Å; A333-V341 HydrophobicContact CB-CG1 4.13Å; A333-L342 HydrophobicContact CB-CB 3.91Å; A333-L342 HydrophobicContact CB-CD1 4.32Å
334	T	95.2	Very high	92.9	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-43.6	175.8	-60.6	0	0	0	0	112	A330 I331 S336 W355	A330-T334 WeakPolarHBondContact O-CB 3.36Å; A330-T334 PolarHBondContact O-N 3.48Å; A330-T334 PolarHBondContact O-OG1 3.4Å; I331-T334 PolarHBondContact O-N 3.49Å; T334-S336 VanDerWaalsContact C-N 3.34Å; T334-S336 PolarHBondContact O-N 3.43Å; T334-W355 HydrophobicContact CG2-CH2 3.47Å; T334-W355 VanDerWaalsContact CG2-CH2 3.47Å; T334-W355 HydrophobicContact CG2-CZ2 3.7Å; T334-W355 WeakPolarHBondContact OG1-CH2 3.41Å
335	L	93	Very high	93.1	Very high	11 Å²	11	33.4 Å²	33.4	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-74.4	-21.8	-178.1	-65.7	165.4	0	0	0	113.7	L237 L242 L261 W264 I331 Y332	L237-L335 HydrophobicContact CD2-CD1 4.19Å; L237-L335 HydrophobicContact CD2-CD2 4.16Å; L237-L335 HydrophobicContact CD2-CG 4.04Å; L242-L335 HydrophobicContact CD2-CD2 4.37Å; L261-L335 HydrophobicContact CD2-CD1 3.82Å; W264-L335 HydrophobicContact CB-CD2 4.27Å; W264-L335 HydrophobicContact CG-CD2 4.22Å; I331-L335 HydrophobicContact CG2-CD1 3.83Å; I331-L335 VanDerWaalsContact O-CG 3.32Å; I331-L335 WeakPolarHBondContact O-CG 3.5Å; I331-L335 PolarHBondContact O-N 3.03Å; Y332-L335 PolarHBondContact O-N 3.37Å
336	S	91.2	Very high	93.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-101.9	-14.7	178.7	58.1	0	0	0	0	114	K312 Y332 A333 T334	K312-S336 WeakPolarHBondContact CE-O 3.33Å; K312-S336 PolarHBondContact NZ-O 3.12Å; K312-S336 VanDerWaalsContact NZ-O 3.08Å; Y332-S336 WeakPolarHBondContact O-CB 3.45Å; Y332-S336 PolarHBondContact O-N 3.27Å; Y332-S336 VanDerWaalsContact O-N 3.07Å; Y332-S336 PolarHBondContact O-OG 2.88Å; A333-S336 PolarHBondContact O-N 3.06Å; A333-S336 PolarHBondContact O-OG 2.93Å; T334-S336 VanDerWaalsContact C-N 3.34Å; T334-S336 PolarHBondContact O-N 3.43Å
337	G	91.8	Very high	92.8	Very high	11 Å²	11	28.8 Å²	28.8	11%	0.113	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	23.8	-171.7	0	0	0	0	0	114.1	A333 L339	A333-G337 CarbonylContact O-C 3.55Å; A333-G337 WeakPolarHBondContact O-CA 3.49Å; A333-G337 PolarHBondContact O-N 3.08Å; G337-L339 PolarHBondContact O-N 2.94Å
338	N	93.8	Very high	92.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.			trans	-76.3	86.3	178.2	-169.1	-14.3	0	0	0	111.9	W316 S319 E320 A333 N340 V341 L342	W316-N338 HydrophobicContact CD2-CB 3.92Å; W316-N338 HydrophobicContact CE3-CB 3.78Å; W316-N338 HydrophobicContact CH2-CB 3.96Å; W316-N338 HydrophobicContact CZ2-CB 4.08Å; W316-N338 HydrophobicContact CZ3-CB 3.8Å; W316-N338 PolarHBondContact NE1-ND2 3.31Å; S319-N338 PolarHBondContact OG-ND2 3.25Å; E320-N338 PolarHBondContact OE1-ND2 3.35Å; A333-N338 HydrophobicContact CB-CB 4.22Å; A333-N338 PolarHBondContact O-N 3.43Å; N338-N340 VanDerWaalsContact C-N 3.32Å; N338-N340 PolarHBondContact O-N 3.06Å; N338-N340 PolarHBondContact OD1-N 2.75Å; N338-V341 WeakPolarHBondContact ND2-CG2 3.45Å; N338-V341 PolarHBondContact O-N 3.26Å; N338-V341 PolarHBondContact OD1-N 3.3Å; N338-L342 VanDerWaalsContact O-CB 3.31Å; N338-L342 WeakPolarHBondContact O-CB 3.44Å; N338-L342 PolarHBondContact O-N 3.43Å; N338-L342 VanDerWaalsContact O-N 3.07Å
339	L	94	Very high	92.1	Very high	21 Å²	21	26.7 Å²	26.7	11%	0.11	14%	0.142	C	C	.	.	H	α-helix	trans	-57.4	-40.2	-180	178.1	63.9	0	0	0	113.7	G337 V341 L342 S343 A356 H357 A360 W411	G337-L339 PolarHBondContact O-N 2.94Å; L339-V341 VanDerWaalsContact C-N 3.32Å; L339-V341 PolarHBondContact O-N 3.03Å; L339-L342 PolarHBondContact O-N 2.93Å; L339-S343 VanDerWaalsContact O-CB 3.27Å; L339-S343 WeakPolarHBondContact O-CB 3.5Å; L339-S343 PolarHBondContact O-N 3.12Å; L339-S343 PolarHBondContact O-OG 3.33Å; L339-A356 HydrophobicContact CD1-CB 4.29Å; L339-H357 HydrophobicContact CD1-CB 4.42Å; L339-H357 WeakPolarHBondContact CD2-ND1 3.15Å; L339-A360 HydrophobicContact CB-CB 3.81Å; L339-A360 HydrophobicContact CD1-CB 4.35Å; L339-A360 HydrophobicContact CG-CB 4.49Å; L339-W411 HydrophobicContact CD2-CH2 3.59Å; L339-W411 HydrophobicContact CD2-CZ2 4.33Å; L339-W411 HydrophobicContact CD2-CZ3 4.16Å
340	N	92.7	Very high	91.8	Very high	97 Å²	97	24.3 Å²	24.3	52%	0.519	13%	0.133	S	C	.	.	H	α-helix	trans	-62.6	-43.3	-173	-71.6	-23.8	0	0	0	111.1	N338 S343 Q344	N338-N340 VanDerWaalsContact C-N 3.32Å; N338-N340 PolarHBondContact O-N 3.06Å; N338-N340 PolarHBondContact OD1-N 2.75Å; N340-S343 PolarHBondContact O-OG 3.1Å; N340-Q344 VanDerWaalsContact O-CD 3.26Å; N340-Q344 WeakPolarHBondContact O-CG 3.09Å; N340-Q344 PolarHBondContact O-NE2 2.63Å
341	V	94.1	Very high	91.6	Very high	15 Å²	15	25.4 Å²	25.4	9%	0.091	14%	0.14	C	C	.	.	H	α-helix	trans	-73.8	-45.1	176.5	174.9	0	0	0	0	110.5	S319 E320 R329 A333 N338 L339 S343 Q344 I345	S319-V341 VanDerWaalsContact O-CG1 3.28Å; S319-V341 WeakPolarHBondContact O-CG1 3.41Å; E320-V341 HydrophobicContact CG-CG2 3.87Å; R329-V341 HydrophobicContact CB-CG1 4.34Å; A333-V341 HydrophobicContact CB-CB 4.23Å; A333-V341 HydrophobicContact CB-CG1 4.13Å; N338-V341 WeakPolarHBondContact ND2-CG2 3.45Å; N338-V341 PolarHBondContact O-N 3.26Å; N338-V341 PolarHBondContact OD1-N 3.3Å; L339-V341 VanDerWaalsContact C-N 3.32Å; L339-V341 PolarHBondContact O-N 3.03Å; V341-S343 PolarHBondContact O-N 2.9Å; V341-Q344 PolarHBondContact O-N 3.49Å; V341-I345 HydrophobicContact CG1-CD1 3.55Å; V341-I345 WeakPolarHBondContact O-CD1 3.44Å; V341-I345 WeakPolarHBondContact O-CG1 3.46Å; V341-I345 PolarHBondContact O-N 3.17Å
342	L	94.4	Very high	91.4	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-46.5	-174.4	-171.7	57.5	0	0	0	112.4	F234 A330 A333 N338 L339 Q344 I345 L346 W355 A356	F234-L342 HydrophobicContact CE2-CD1 4.23Å; F234-L342 HydrophobicContact CZ-CD1 4.3Å; A330-L342 HydrophobicContact CB-CD1 4.25Å; A333-L342 HydrophobicContact CB-CB 3.91Å; A333-L342 HydrophobicContact CB-CD1 4.32Å; N338-L342 VanDerWaalsContact O-CB 3.31Å; N338-L342 WeakPolarHBondContact O-CB 3.44Å; N338-L342 PolarHBondContact O-N 3.43Å; N338-L342 VanDerWaalsContact O-N 3.07Å; L339-L342 PolarHBondContact O-N 2.93Å; L342-Q344 PolarHBondContact O-N 3.42Å; L342-I345 PolarHBondContact O-N 3.12Å; L342-L346 HydrophobicContact CD1-CD1 3.92Å; L342-L346 HydrophobicContact CD1-CG 4.12Å; L342-L346 HydrophobicContact CD2-CD1 4.5Å; L342-L346 HydrophobicContact CG-CD1 3.75Å; L342-L346 HydrophobicContact CG-CG 4.38Å; L342-L346 WeakPolarHBondContact O-CG 3.41Å; L342-L346 PolarHBondContact O-N 2.99Å; L342-W355 HydrophobicContact CD1-CZ3 4.16Å; L342-W355 HydrophobicContact CD2-CE3 4.43Å; L342-W355 HydrophobicContact CD2-CH2 4.4Å; L342-W355 HydrophobicContact CD2-CZ3 3.81Å; L342-W355 HydrophobicContact CG-CZ3 4.32Å; L342-A356 HydrophobicContact CD2-CB 3.75Å; L342-A356 HydrophobicContact CG-CB 3.95Å
343	S	92.2	Very high	91.3	Very high	14 Å²	14	24.9 Å²	24.9	10%	0.098	14%	0.139	C	C	.	.	H	α-helix	trans	-66.6	-19	179.7	62.5	0	0	0	0	114.5	L339 N340 V341 Q353 R423	L339-S343 VanDerWaalsContact O-CB 3.27Å; L339-S343 WeakPolarHBondContact O-CB 3.5Å; L339-S343 PolarHBondContact O-N 3.12Å; L339-S343 PolarHBondContact O-OG 3.33Å; N340-S343 PolarHBondContact O-OG 3.1Å; V341-S343 PolarHBondContact O-N 2.9Å; S343-Q353 PolarHBondContact O-NE2 3.48Å; S343-R423 PolarHBondContact O-NH2 3.24Å
344	Q	92.1	Very high	91.3	Very high	135 Å²	135	24.9 Å²	24.9	63%	0.631	14%	0.139	S	C	*	.	H	α-helix	trans	-84	-30.6	175	-71.4	173.9	15	0	0	112.5	N340 V341 L342	N340-Q344 VanDerWaalsContact O-CD 3.26Å; N340-Q344 WeakPolarHBondContact O-CG 3.09Å; N340-Q344 PolarHBondContact O-NE2 2.63Å; V341-Q344 PolarHBondContact O-N 3.49Å; L342-Q344 PolarHBondContact O-N 3.42Å
345	I	91.4	Very high	91.3	Very high	31 Å²	31	24.8 Å²	24.8	16%	0.159	14%	0.138	C	C	.	.	H	α-helix	trans	-87.9	-36.9	-176.2	-62.6	164.2	0	0	0	111.1	S326 R329 A330 V341 L342	S326-I345 WeakPolarHBondContact O-CD1 3.43Å; R329-I345 HydrophobicContact CB-CD1 3.96Å; A330-I345 HydrophobicContact CB-CB 4.48Å; A330-I345 HydrophobicContact CB-CD1 4.16Å; A330-I345 HydrophobicContact CB-CG2 3.98Å; V341-I345 HydrophobicContact CG1-CD1 3.55Å; V341-I345 WeakPolarHBondContact O-CD1 3.44Å; V341-I345 WeakPolarHBondContact O-CG1 3.46Å; V341-I345 PolarHBondContact O-N 3.17Å; L342-I345 PolarHBondContact O-N 3.12Å
346	L	89	Confident	91.4	Very high	9 Å²	9	24.2 Å²	24.2	5%	0.047	14%	0.136	C	C	.	.	S	Bend	trans	-66.3	150.9	179	-76.3	172.4	0	0	0	112.5	F234 L342 D352 W355 A356	F234-L346 HydrophobicContact CE1-CD2 3.8Å; F234-L346 HydrophobicContact CZ-CD2 3.62Å; F234-L346 HydrophobicContact CZ-CG 4.47Å; L342-L346 HydrophobicContact CD1-CD1 3.92Å; L342-L346 HydrophobicContact CD1-CG 4.12Å; L342-L346 HydrophobicContact CD2-CD1 4.5Å; L342-L346 HydrophobicContact CG-CD1 3.75Å; L342-L346 HydrophobicContact CG-CG 4.38Å; L342-L346 WeakPolarHBondContact O-CG 3.41Å; L342-L346 PolarHBondContact O-N 2.99Å; L346-D352 HydrophobicContact CB-CB 4.24Å; L346-D352 HydrophobicContact CD1-CB 4.26Å; L346-D352 HydrophobicContact CD2-CB 4.23Å; L346-D352 HydrophobicContact CG-CB 4.5Å; L346-W355 HydrophobicContact CD1-CE3 4.01Å; L346-W355 HydrophobicContact CD1-CZ3 4.02Å; L346-A356 HydrophobicContact CD1-CB 3.65Å
347	P	83.5	Confident	91.7	Very high	62 Å²	62	24.8 Å²	24.8	40%	0.403	14%	0.138	S	C	.	.			trans	-52.9	149.7	167.6	-23.2	34.1	0	0	0	111.7	S349 Q353	P347-S349 PolarHBondContact O-N 3.44Å; P347-Q353 PolarHBondContact O-NE2 3.3Å
348	T	83.8	Confident	91.8	Very high	62 Å²	62	24.2 Å²	24.2	38%	0.38	13%	0.133	S	C	.	.	S	Bend	trans	-79.7	58.2	170.8	56.7	0	0	0	0	110.1	S446	T348-S446 WeakPolarHBondContact O-CA 3.4Å; T348-S446 VanDerWaalsContact O-CB 3.27Å; T348-S446 WeakPolarHBondContact O-CB 3.46Å; T348-S446 PolarHBondContact O-OG 3.46Å
349	S	84.4	Confident	91.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.007	14%	0.14	C	C	.	.			trans	-103.6	154.7	171.6	60.7	0	0	0	0	109.6	P347 T351 D352 Q353	P347-S349 PolarHBondContact O-N 3.44Å; S349-T351 VanDerWaalsContact C-N 3.34Å; S349-T351 PolarHBondContact OG-OG1 3.36Å; S349-D352 VanDerWaalsContact OG-CB 3.25Å; S349-D352 WeakPolarHBondContact OG-CB 3.07Å; S349-D352 VanDerWaalsContact OG-CG 3.31Å; S349-D352 PolarHBondContact OG-N 3.03Å; S349-D352 PolarHBondContact OG-OD2 2.87Å; S349-Q353 WeakPolarHBondContact O-CB 3.14Å; S349-Q353 VanDerWaalsContact O-CG 3.23Å; S349-Q353 WeakPolarHBondContact O-CG 3.42Å; S349-Q353 PolarHBondContact O-N 3.01Å; S349-Q353 VanDerWaalsContact O-N 3.16Å
350	W	90	Very high	91.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-43.6	177.7	-175.2	94.8	0	0	0	111.1	W156 D352 T354 F417 L424 W426 Y489 Q492	W156-W350 HydrophobicContact CZ3-CZ3 4.39Å; W350-D352 PolarHBondContact O-N 3.46Å; W350-T354 HydrophobicContact CH2-CG2 4.18Å; W350-T354 HydrophobicContact CZ2-CG2 4.41Å; W350-T354 HydrophobicContact CZ3-CG2 4.46Å; W350-T354 VanDerWaalsContact O-CB 3.23Å; W350-T354 WeakPolarHBondContact O-CB 3.39Å; W350-T354 PolarHBondContact O-N 3.3Å; W350-T354 PolarHBondContact O-OG1 3Å; W350-F417 HydrophobicContact CH2-CE1 4.3Å; W350-F417 HydrophobicContact CZ2-CD1 4.28Å; W350-F417 AromaticContact CZ2-CE1 3.65Å; W350-F417 HydrophobicContact CZ2-CE1 3.65Å; W350-L424 HydrophobicContact CB-CD1 4.16Å; W350-L424 HydrophobicContact CG-CD1 4.49Å; W350-W426 HydrophobicContact CB-CH2 4.31Å; W350-Y489 HydrophobicContact CB-CD2 4.14Å; W350-Y489 HydrophobicContact CB-CE2 4.02Å; W350-Y489 HydrophobicContact CB-CG 4.44Å; W350-Y489 AromaticContact CD2-CD1 3.95Å; W350-Y489 HydrophobicContact CD2-CD1 3.95Å; W350-Y489 HydrophobicContact CD2-CE1 4.44Å; W350-Y489 HydrophobicContact CD2-CG 4.07Å; W350-Y489 AromaticContact CE3-CD1 3.79Å; W350-Y489 HydrophobicContact CE3-CD1 3.79Å; W350-Y489 HydrophobicContact CE3-CE1 4.05Å; W350-Y489 HydrophobicContact CE3-CG 4.38Å; W350-Y489 HydrophobicContact CG-CD1 4.32Å; W350-Y489 HydrophobicContact CG-CD2 4.2Å; W350-Y489 HydrophobicContact CG-CG 4.09Å; W350-Y489 HydrophobicContact CZ3-CD1 4.29Å; W350-Q492 HydrophobicContact CH2-CB 4.03Å
351	T	90.3	Very high	91.9	Very high	23 Å²	23	21 Å²	21	14%	0.141	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-46.2	-178.4	54.5	0	0	0	0	112.8	L157 R238 S349 W355	L157-T351 HydrophobicContact CD2-CG2 4.36Å; R238-T351 PolarHBondContact NH2-O 3.28Å; S349-T351 VanDerWaalsContact C-N 3.34Å; S349-T351 PolarHBondContact OG-OG1 3.36Å; T351-W355 WeakPolarHBondContact O-CB 3.33Å; T351-W355 PolarHBondContact O-N 2.95Å; T351-W355 VanDerWaalsContact O-N 3.07Å
352	D	90.9	Very high	91.9	Very high	25 Å²	25	20.5 Å²	20.5	13%	0.134	11%	0.11	C	C	.	.	H	α-helix	trans	-75.5	-38.7	-177.3	-68.4	-41.8	0	0	0	112.7	R238 L346 S349 W350 A356	R238-D352 IonicContact CZ-OD1 3.06Å; R238-D352 IonicContact NE-OD1 3.74Å; R238-D352 PolarHBondContact NE-OD1 3.3Å; R238-D352 IonicContact NH2-OD1 2.75Å; R238-D352 PolarHBondContact NH2-OD1 3.06Å; R238-D352 VanDerWaalsContact NH2-OD1 3.07Å; L346-D352 HydrophobicContact CB-CB 4.24Å; L346-D352 HydrophobicContact CD1-CB 4.26Å; L346-D352 HydrophobicContact CD2-CB 4.23Å; L346-D352 HydrophobicContact CG-CB 4.5Å; S349-D352 VanDerWaalsContact OG-CB 3.25Å; S349-D352 WeakPolarHBondContact OG-CB 3.07Å; S349-D352 VanDerWaalsContact OG-CG 3.31Å; S349-D352 PolarHBondContact OG-N 3.03Å; S349-D352 PolarHBondContact OG-OD2 2.87Å; W350-D352 PolarHBondContact O-N 3.46Å; D352-A356 WeakPolarHBondContact O-CB 3.37Å; D352-A356 PolarHBondContact O-N 3.4Å
353	Q	93.8	Very high	91.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.8	-45.5	177	-62.8	-61	-42	0	0	110.5	S343 P347 S349 W355 A356 H357 V420 R423 L424	S343-Q353 PolarHBondContact O-NE2 3.48Å; P347-Q353 PolarHBondContact O-NE2 3.3Å; S349-Q353 WeakPolarHBondContact O-CB 3.14Å; S349-Q353 VanDerWaalsContact O-CG 3.23Å; S349-Q353 WeakPolarHBondContact O-CG 3.42Å; S349-Q353 PolarHBondContact O-N 3.01Å; S349-Q353 VanDerWaalsContact O-N 3.16Å; Q353-W355 VanDerWaalsContact C-N 3.33Å; Q353-W355 PolarHBondContact O-N 2.96Å; Q353-A356 PolarHBondContact O-N 3.22Å; Q353-H357 WeakPolarHBondContact O-CB 3.38Å; Q353-H357 PolarHBondContact O-CD2 2.96Å; Q353-H357 PolarHBondContact O-N 3.03Å; Q353-V420 HydrophobicContact CB-CG1 4.12Å; Q353-V420 HydrophobicContact CB-CG2 4.35Å; Q353-R423 HydrophobicContact CG-CG 4.44Å; Q353-L424 HydrophobicContact CG-CD2 4.11Å
354	T	95.1	Very high	91.6	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.4	-46.7	175.2	-60.9	0	0	0	0	111.1	L153 L157 W350 A356 H357 C358 F417	L153-T354 HydrophobicContact CD2-CG2 3.94Å; L157-T354 HydrophobicContact CD1-CG2 3.92Å; W350-T354 HydrophobicContact CH2-CG2 4.18Å; W350-T354 HydrophobicContact CZ2-CG2 4.41Å; W350-T354 HydrophobicContact CZ3-CG2 4.46Å; W350-T354 VanDerWaalsContact O-CB 3.23Å; W350-T354 WeakPolarHBondContact O-CB 3.39Å; W350-T354 PolarHBondContact O-N 3.3Å; W350-T354 PolarHBondContact O-OG1 3Å; T354-A356 PolarHBondContact O-N 2.7Å; T354-H357 PolarHBondContact O-N 3.27Å; T354-C358 WeakPolarHBondContact O-CB 3.41Å; T354-C358 PolarHBondContact O-N 3.35Å; T354-C358 PolarHBondContact O-SG 3.32Å; T354-F417 HydrophobicContact CG2-CE1 3.94Å
355	W	96	Very high	91.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-57.6	-49.1	176.1	174.2	81.9	0	0	0	112.3	L157 E158 F234 R238 T334 L342 L346 T351 Q353 H357 C358 R359	L157-W355 HydrophobicContact CB-CB 4.36Å; L157-W355 HydrophobicContact CD1-CB 3.82Å; E158-W355 PolarHBondContact OE1-NE1 2.88Å; F234-W355 HydrophobicContact CZ-CZ3 4.48Å; R238-W355 HydrophobicContact CB-CH2 4.45Å; R238-W355 VanDerWaalsContact CD-CD2 3.44Å; R238-W355 VanDerWaalsContact CD-CE3 3.42Å; T334-W355 HydrophobicContact CG2-CH2 3.47Å; T334-W355 VanDerWaalsContact CG2-CH2 3.47Å; T334-W355 HydrophobicContact CG2-CZ2 3.7Å; T334-W355 WeakPolarHBondContact OG1-CH2 3.41Å; L342-W355 HydrophobicContact CD1-CZ3 4.16Å; L342-W355 HydrophobicContact CD2-CE3 4.43Å; L342-W355 HydrophobicContact CD2-CH2 4.4Å; L342-W355 HydrophobicContact CD2-CZ3 3.81Å; L342-W355 HydrophobicContact CG-CZ3 4.32Å; L346-W355 HydrophobicContact CD1-CE3 4.01Å; L346-W355 HydrophobicContact CD1-CZ3 4.02Å; T351-W355 WeakPolarHBondContact O-CB 3.33Å; T351-W355 PolarHBondContact O-N 2.95Å; T351-W355 VanDerWaalsContact O-N 3.07Å; Q353-W355 VanDerWaalsContact C-N 3.33Å; Q353-W355 PolarHBondContact O-N 2.96Å; W355-H357 PolarHBondContact O-N 2.75Å; W355-C358 PolarHBondContact O-N 3.3Å; W355-R359 WeakPolarHBondContact O-CB 3.45Å; W355-R359 PolarHBondContact O-N 3.03Å
356	A	95.8	Very high	91.3	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.9	-43.3	-178.4	0	0	0	0	0	112.5	L339 L342 L346 D352 Q353 T354 A360	L339-A356 HydrophobicContact CD1-CB 4.29Å; L342-A356 HydrophobicContact CD2-CB 3.75Å; L342-A356 HydrophobicContact CG-CB 3.95Å; L346-A356 HydrophobicContact CD1-CB 3.65Å; D352-A356 WeakPolarHBondContact O-CB 3.37Å; D352-A356 PolarHBondContact O-N 3.4Å; Q353-A356 PolarHBondContact O-N 3.22Å; T354-A356 PolarHBondContact O-N 2.7Å; A356-A360 WeakPolarHBondContact O-CB 3.29Å; A356-A360 PolarHBondContact O-N 3.07Å
357	H	95.7	Very high	91.1	Very high	11 Å²	11	16.1 Å²	16.1	5%	0.051	9%	0.086	C	C	.	.	H	α-helix	trans	-68.9	-45.6	179.2	-78.5	-80.9	0	0	0	112.1	L339 Q353 T354 W355 A360 L361 W411 V416 V420	L339-H357 HydrophobicContact CD1-CB 4.42Å; L339-H357 WeakPolarHBondContact CD2-ND1 3.15Å; Q353-H357 WeakPolarHBondContact O-CB 3.38Å; Q353-H357 PolarHBondContact O-CD2 2.96Å; Q353-H357 PolarHBondContact O-N 3.03Å; T354-H357 PolarHBondContact O-N 3.27Å; W355-H357 PolarHBondContact O-N 2.75Å; H357-A360 PolarHBondContact O-N 3.33Å; H357-L361 WeakPolarHBondContact O-CB 3.47Å; H357-L361 PolarHBondContact O-N 2.91Å; H357-W411 HydrophobicContact CB-CH2 4.32Å; H357-W411 HydrophobicContact CB-CZ2 4.09Å; H357-W411 AromaticContact ND1-CH2 3.88Å; H357-W411 AromaticContact ND1-CZ2 3.63Å; H357-W411 WeakPolarHBondContact O-CH2 3.26Å; H357-V416 HydrophobicContact CB-CG1 3.57Å; H357-V420 HydrophobicContact CB-CG2 4.15Å
358	C	95.7	Very high	91.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.5	-44.4	176.5	-70	0	0	0	0	111.6	I154 T354 W355 A360 L361 V362	I154-C358 HydrophobicContact CD1-CB 4.04Å; I154-C358 HydrophobicContact CG1-CB 3.69Å; T354-C358 WeakPolarHBondContact O-CB 3.41Å; T354-C358 PolarHBondContact O-N 3.35Å; T354-C358 PolarHBondContact O-SG 3.32Å; W355-C358 PolarHBondContact O-N 3.3Å; C358-A360 PolarHBondContact O-N 3.24Å; C358-L361 WeakPolarHBondContact O-CB 3.14Å; C358-L361 PolarHBondContact O-N 3.31Å; C358-V362 WeakPolarHBondContact O-CG2 3.39Å; C358-V362 PolarHBondContact O-N 3.46Å
359	R	94.5	Very high	91	Very high	39 Å²	39	13.4 Å²	13.4	15%	0.147	7%	0.071	C	C	.	.	H	α-helix	trans	-63	-41.5	178.8	-178.2	165.9	-88.7	-82.7	0.1	112	I154 E158 W355 E363	I154-R359 HydrophobicContact CD1-CB 4.18Å; E158-R359 IonicContact OE1-CZ 2.82Å; E158-R359 VanDerWaalsContact OE1-CZ 3.31Å; E158-R359 IonicContact OE1-NE 2.62Å; E158-R359 PolarHBondContact OE1-NE 3.42Å; E158-R359 IonicContact OE1-NH2 3.57Å; E158-R359 PolarHBondContact OE1-NH2 2.92Å; E158-R359 IonicContact OE2-NH2 3.69Å; W355-R359 WeakPolarHBondContact O-CB 3.45Å; W355-R359 PolarHBondContact O-N 3.03Å; R359-E363 WeakPolarHBondContact O-CB 2.96Å; R359-E363 WeakPolarHBondContact O-CG 3.35Å; R359-E363 PolarHBondContact O-N 3.4Å
360	A	93.6	Very high	90.7	Very high	7 Å²	7	14.3 Å²	14.3	6%	0.058	8%	0.076	C	C	.	.	H	α-helix	trans	-63.8	-40.2	174.2	0	0	0	0	0	112.3	L339 A356 H357 C358 A364 W411	L339-A360 HydrophobicContact CB-CB 3.81Å; L339-A360 HydrophobicContact CD1-CB 4.35Å; L339-A360 HydrophobicContact CG-CB 4.49Å; A356-A360 WeakPolarHBondContact O-CB 3.29Å; A356-A360 PolarHBondContact O-N 3.07Å; H357-A360 PolarHBondContact O-N 3.33Å; C358-A360 PolarHBondContact O-N 3.24Å; A360-A364 VanDerWaalsContact O-CB 3.32Å; A360-A364 WeakPolarHBondContact O-CB 3.29Å; A360-A364 PolarHBondContact O-N 3.38Å; A360-W411 HydrophobicContact CB-CH2 4.19Å; A360-W411 HydrophobicContact CB-CZ3 4.15Å
361	L	93.5	Very high	90	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.021	9%	0.089	C	C	.	.	H	α-helix	trans	-60.7	-53	175.6	173.5	64.7	0	0	0	111.2	H357 C358 E363 A364 R365 P408 W411 V416	H357-L361 WeakPolarHBondContact O-CB 3.47Å; H357-L361 PolarHBondContact O-N 2.91Å; C358-L361 WeakPolarHBondContact O-CB 3.14Å; C358-L361 PolarHBondContact O-N 3.31Å; L361-E363 PolarHBondContact O-N 2.94Å; L361-A364 PolarHBondContact O-N 2.95Å; L361-R365 HydrophobicContact CD1-CG 4.08Å; L361-R365 WeakPolarHBondContact O-CG 3.39Å; L361-R365 PolarHBondContact O-N 2.7Å; L361-P408 HydrophobicContact CD1-CB 4.06Å; L361-W411 HydrophobicContact CB-CE3 4.31Å; L361-W411 HydrophobicContact CB-CH2 4.45Å; L361-W411 HydrophobicContact CB-CZ3 4.27Å; L361-W411 HydrophobicContact CD1-CB 4.02Å; L361-W411 HydrophobicContact CD1-CD2 4.09Å; L361-W411 HydrophobicContact CD1-CE3 4.19Å; L361-W411 HydrophobicContact CD1-CG 4.01Å; L361-W411 VanDerWaalsContact CD1-O 3.25Å; L361-W411 WeakPolarHBondContact CD1-O 3.18Å; L361-V416 HydrophobicContact CB-CG2 4.19Å; L361-V416 HydrophobicContact CD2-CG2 3.66Å; L361-V416 HydrophobicContact CG-CG2 4.48Å
362	V	93.7	Very high	89.2	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.024	11%	0.111	C	C	.	.	H	α-helix	trans	-59.2	-48.9	-178.5	168.8	0	0	0	0	111	Y141 L147 A150 I154 C358 A364 R365 V366	Y141-V362 WeakPolarHBondContact OH-CG1 3.08Å; L147-V362 HydrophobicContact CD1-CB 4.27Å; L147-V362 HydrophobicContact CD1-CG1 4.15Å; L147-V362 HydrophobicContact CD1-CG2 4.02Å; A150-V362 HydrophobicContact CB-CG2 3.95Å; I154-V362 HydrophobicContact CD1-CB 4.14Å; I154-V362 HydrophobicContact CD1-CG2 3.68Å; C358-V362 WeakPolarHBondContact O-CG2 3.39Å; C358-V362 PolarHBondContact O-N 3.46Å; V362-A364 VanDerWaalsContact C-N 3.32Å; V362-A364 PolarHBondContact O-N 3.31Å; V362-R365 PolarHBondContact O-N 3.12Å; V362-V366 HydrophobicContact CG1-CG2 4.4Å; V362-V366 WeakPolarHBondContact O-CB 3.31Å; V362-V366 WeakPolarHBondContact O-CG2 3.28Å; V362-V366 PolarHBondContact O-N 3.32Å
363	E	91.3	Very high	88.2	Confident	21 Å²	21	21.6 Å²	21.6	10%	0.098	12%	0.115	C	C	.	.	H	α-helix	trans	-58	-42.8	177.5	-79.4	-66.6	153.2	0	0	112.2	R308 R359 L361 D367	R308-E363 IonicContact NH2-OE1 2.76Å; R308-E363 IonicContact NH2-OE2 3.79Å; R308-E363 PolarHBondContact NH2-OE2 3.1Å; R359-E363 WeakPolarHBondContact O-CB 2.96Å; R359-E363 WeakPolarHBondContact O-CG 3.35Å; R359-E363 PolarHBondContact O-N 3.4Å; L361-E363 PolarHBondContact O-N 2.94Å; E363-D367 WeakPolarHBondContact O-CB 3.29Å; E363-D367 PolarHBondContact O-N 3.47Å
364	A	89.2	Confident	86.3	Confident	5 Å²	5	25.3 Å²	25.3	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-68.1	-39.3	178.2	0	0	0	0	0	112.6	A360 L361 V362 S368 P408	A360-A364 VanDerWaalsContact O-CB 3.32Å; A360-A364 WeakPolarHBondContact O-CB 3.29Å; A360-A364 PolarHBondContact O-N 3.38Å; L361-A364 PolarHBondContact O-N 2.95Å; V362-A364 VanDerWaalsContact C-N 3.32Å; V362-A364 PolarHBondContact O-N 3.31Å; A364-S368 VanDerWaalsContact O-CB 3.27Å; A364-S368 WeakPolarHBondContact O-CB 3.35Å; A364-S368 PolarHBondContact O-N 3.3Å; A364-P408 HydrophobicContact CB-CB 4.06Å
365	R	90	Very high	84.3	Confident	63 Å²	63	32.5 Å²	32.5	24%	0.238	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-42.6	176.7	-68.7	-158.3	94.4	175.5	19.2	111.9	D144 E146 L147 L361 V362 S369 P408	D144-R365 IonicContact OD1-NH1 3.44Å; D144-R365 IonicContact OD2-CZ 3.46Å; D144-R365 VanDerWaalsContact OD2-CZ 3.25Å; D144-R365 IonicContact OD2-NE 2.64Å; D144-R365 IonicContact OD2-NH1 2.81Å; D144-R365 PolarHBondContact OD2-NH1 3.03Å; D144-R365 IonicContact OD2-NH2 2.83Å; E146-R365 IonicContact OE2-CZ 3.3Å; E146-R365 IonicContact OE2-NH1 2.91Å; E146-R365 PolarHBondContact OE2-NH1 3.06Å; E146-R365 IonicContact OE2-NH2 2.65Å; L147-R365 HydrophobicContact CD1-CB 3.79Å; L147-R365 HydrophobicContact CD1-CG 4.3Å; L361-R365 HydrophobicContact CD1-CG 4.08Å; L361-R365 WeakPolarHBondContact O-CG 3.39Å; L361-R365 PolarHBondContact O-N 2.7Å; V362-R365 PolarHBondContact O-N 3.12Å; R365-S369 WeakPolarHBondContact O-CB 3.37Å; R365-S369 PolarHBondContact O-N 3.24Å; R365-S369 PolarHBondContact O-OG 3.14Å; R365-P408 HydrophobicContact CG-CB 4.15Å; R365-P408 HydrophobicContact CG-CG 3.99Å
366	V	88.4	Confident	82.1	Confident	8 Å²	8	33.3 Å²	33.3	5%	0.048	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-50.8	175.9	165.2	0	0	0	0	110.3	I137 L140 V362 S368 S369 L370	I137-V366 HydrophobicContact CD1-CG1 3.8Å; I137-V366 HydrophobicContact CG1-CG1 3.78Å; L140-V366 HydrophobicContact CD2-CG2 4.26Å; V362-V366 HydrophobicContact CG1-CG2 4.4Å; V362-V366 WeakPolarHBondContact O-CB 3.31Å; V362-V366 WeakPolarHBondContact O-CG2 3.28Å; V362-V366 PolarHBondContact O-N 3.32Å; V366-S368 PolarHBondContact O-N 3.26Å; V366-S369 PolarHBondContact O-N 3.24Å; V366-L370 HydrophobicContact CG1-CD1 3.97Å; V366-L370 HydrophobicContact CG1-CG 4.44Å; V366-L370 WeakPolarHBondContact O-CG 3.35Å; V366-L370 PolarHBondContact O-N 2.98Å
367	D	84.9	Confident	79.9	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-40.5	-179.1	-80.9	-8.4	0	0	0	113.1	R308 K312 E363 S369 L370 R371 W406	R308-D367 IonicContact CZ-OD1 3.79Å; R308-D367 IonicContact NH1-OD1 3.97Å; R308-D367 PolarHBondContact NH1-OD1 3.35Å; R308-D367 IonicContact NH1-OD2 3.52Å; R308-D367 IonicContact NH2-OD1 3.13Å; K312-D367 WeakPolarHBondContact CD-OD2 3.47Å; K312-D367 WeakPolarHBondContact CE-OD2 3.2Å; K312-D367 IonicContact NZ-OD2 2.62Å; K312-D367 PolarHBondContact NZ-OD2 3.01Å; E363-D367 WeakPolarHBondContact O-CB 3.29Å; E363-D367 PolarHBondContact O-N 3.47Å; D367-S369 VanDerWaalsContact C-N 3.29Å; D367-S369 PolarHBondContact O-N 2.62Å; D367-L370 PolarHBondContact O-N 3.08Å; D367-R371 WeakPolarHBondContact O-CB 3.41Å; D367-R371 WeakPolarHBondContact O-CG 3.5Å; D367-R371 PolarHBondContact O-N 3.15Å; D367-W406 HydrophobicContact CB-CE3 4.32Å
368	S	83.1	Confident	77.8	Confident	41 Å²	41	37.4 Å²	37.4	29%	0.287	21%	0.209	S	C	.	.	H	α-helix	trans	-57.7	-45.4	174.9	-174.2	0	0	0	0	111.2	A364 V366 R371 S372 W406	A364-S368 VanDerWaalsContact O-CB 3.27Å; A364-S368 WeakPolarHBondContact O-CB 3.35Å; A364-S368 PolarHBondContact O-N 3.3Å; V366-S368 PolarHBondContact O-N 3.26Å; S368-R371 PolarHBondContact O-N 3.28Å; S368-S372 PolarHBondContact O-N 3.45Å; S368-W406 WeakPolarHBondContact CA-O 3.35Å; S368-W406 PolarHBondContact N-O 3.18Å; S368-W406 VanDerWaalsContact N-O 3.17Å
369	S	80.9	Confident	75.6	Confident	26 Å²	26	38.5 Å²	38.5	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-46.7	179.9	-58.8	0	0	0	0	111.7	L140 R365 V366 D367 R371 S372 L373	L140-S369 WeakPolarHBondContact CD2-OG 3.4Å; R365-S369 WeakPolarHBondContact O-CB 3.37Å; R365-S369 PolarHBondContact O-N 3.24Å; R365-S369 PolarHBondContact O-OG 3.14Å; V366-S369 PolarHBondContact O-N 3.24Å; D367-S369 VanDerWaalsContact C-N 3.29Å; D367-S369 PolarHBondContact O-N 2.62Å; S369-R371 VanDerWaalsContact C-N 3.32Å; S369-R371 PolarHBondContact O-N 3.05Å; S369-S372 PolarHBondContact O-N 3.28Å; S369-S372 VanDerWaalsContact O-N 3.1Å; S369-S372 PolarHBondContact O-OG 3.31Å; S369-L373 PolarHBondContact O-N 3.42Å
370	L	79	Confident	73.2	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.105	23%	0.228	C	C	.	.	H	α-helix	trans	-59.7	-42.2	176.5	-70.9	175.1	0	0	0	112	E133 I136 I137 V366 D367 S372 L373	E133-L370 HydrophobicContact CB-CD2 4.44Å; E133-L370 HydrophobicContact CG-CD1 3.63Å; E133-L370 HydrophobicContact CG-CD2 3.5Å; E133-L370 HydrophobicContact CG-CG 4.17Å; I136-L370 HydrophobicContact CB-CD2 3.94Å; I136-L370 HydrophobicContact CD1-CD2 4.15Å; I136-L370 HydrophobicContact CG2-CD2 3.76Å; I137-L370 HydrophobicContact CD1-CD1 4.21Å; I137-L370 HydrophobicContact CG1-CD1 4.36Å; I137-L370 HydrophobicContact CG1-CD2 4.19Å; I137-L370 HydrophobicContact CG1-CG 4.44Å; V366-L370 HydrophobicContact CG1-CD1 3.97Å; V366-L370 HydrophobicContact CG1-CG 4.44Å; V366-L370 WeakPolarHBondContact O-CG 3.35Å; V366-L370 PolarHBondContact O-N 2.98Å; D367-L370 PolarHBondContact O-N 3.08Å; L370-S372 VanDerWaalsContact C-N 3.26Å; L370-S372 PolarHBondContact O-N 3.3Å; L370-L373 PolarHBondContact O-N 3.1Å
371	R	74.8	Confident	70.8	Confident	71 Å²	71	45.4 Å²	45.4	27%	0.268	26%	0.26	S	S	.	.	H	α-helix	trans	-70.6	-20.2	177.8	-68.5	176.3	94.2	-138.9	7.4	113.1	D367 S368 S369 L374	D367-R371 WeakPolarHBondContact O-CB 3.41Å; D367-R371 WeakPolarHBondContact O-CG 3.5Å; D367-R371 PolarHBondContact O-N 3.15Å; S368-R371 PolarHBondContact O-N 3.28Å; S369-R371 VanDerWaalsContact C-N 3.32Å; S369-R371 PolarHBondContact O-N 3.05Å; R371-L374 VanDerWaalsContact O-CD2 3.25Å; R371-L374 WeakPolarHBondContact O-CD2 3.12Å; R371-L374 WeakPolarHBondContact O-CG 3.21Å
372	S	73.8	Confident	68.4	Low	87 Å²	87	46.5 Å²	46.5	61%	0.608	27%	0.266	S	S	*	.	H	α-helix	trans	-78.8	-25	174.8	79.1	0	0	0	0	112.9	S368 S369 L370 L374	S368-S372 PolarHBondContact O-N 3.45Å; S369-S372 PolarHBondContact O-N 3.28Å; S369-S372 VanDerWaalsContact O-N 3.1Å; S369-S372 PolarHBondContact O-OG 3.31Å; L370-S372 VanDerWaalsContact C-N 3.26Å; L370-S372 PolarHBondContact O-N 3.3Å; S372-L374 PolarHBondContact O-N 3.22Å
373	L	68.9	Low	66.1	Low	42 Å²	42	47.1 Å²	47.1	22%	0.22	27%	0.27	C	S	.	.			trans	-101.5	36.5	-170.7	-66.1	163.9	0	0	0	113.3	L126 I136 S369 L370 N375 T376	L126-L373 HydrophobicContact CB-CD2 4.22Å; L126-L373 HydrophobicContact CD2-CD1 3.42Å; L126-L373 VanDerWaalsContact CD2-CD1 3.42Å; L126-L373 HydrophobicContact CD2-CD2 3.97Å; L126-L373 HydrophobicContact CD2-CG 4.35Å; I136-L373 HydrophobicContact CG2-CD1 3.33Å; S369-L373 PolarHBondContact O-N 3.42Å; L370-L373 PolarHBondContact O-N 3.1Å; L373-N375 PolarHBondContact O-N 3.17Å; L373-T376 PolarHBondContact O-N 3.23Å; L373-T376 PolarHBondContact O-OG1 3.42Å
374	L	55.1	Low	63.8	Low	78 Å²	78	48 Å²	48	41%	0.408	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-12.1	-168.9	-61.8	166.1	0	0	0	117	R371 S372 L383	R371-L374 VanDerWaalsContact O-CD2 3.25Å; R371-L374 WeakPolarHBondContact O-CD2 3.12Å; R371-L374 WeakPolarHBondContact O-CG 3.21Å; S372-L374 PolarHBondContact O-N 3.22Å; L374-L383 HydrophobicContact CD2-CD1 3.2Å; L374-L383 HydrophobicContact CD2-CD2 3.62Å; L374-L383 HydrophobicContact CD2-CG 3.97Å
375	N	53	Low	61.6	Low	152 Å²	152	51.9 Å²	51.9	81%	0.813	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	9.2	-179	-63.3	-17.3	0	0	0	114.3	L373	L373-N375 PolarHBondContact O-N 3.17Å
376	T	49.2	Very low	59.5	Low	16 Å²	16	50.6 Å²	50.6	10%	0.098	30%	0.303	C	S	.	.	S	Bend	trans	-114.1	89.9	-170.8	52.2	0	0	0	0	112.1	I136 L373	I136-T376 HydrophobicContact CD1-CG2 4.29Å; I136-T376 WeakPolarHBondContact CD1-OG1 3.42Å; L373-T376 PolarHBondContact O-N 3.23Å; L373-T376 PolarHBondContact O-OG1 3.42Å
377	G	50.6	Low	57.4	Low	18 Å²	18	52.4 Å²	52.4	19%	0.186	32%	0.323	C	S	.	.	S	Bend	trans	98.5	-177.4	171.5	0	0	0	0	0	116.2	R379	G377-R379 PolarHBondContact O-N 3.48Å
378	P	49.9	Very low	55.6	Low	80 Å²	80	61 Å²	61	52%	0.519	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-63.8	9.2	-173	25	-33.8	0	0	0	115.4	F267 A380	F267-P378 HydrophobicContact CE1-CG 4.29Å; P378-A380 VanDerWaalsContact C-N 3.33Å; P378-A380 PolarHBondContact O-N 3.37Å
379	R	50.8	Low	53.4	Low	22 Å²	22	62.9 Å²	62.9	8%	0.083	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-72.3	-17.1	-178.7	-77.7	-171	170.4	63.7	31.1	115.4	E133 G377 D381 T382 L383	E133-R379 VanDerWaalsContact CB-NH1 3.33Å; E133-R379 IonicContact OE1-CZ 2.74Å; E133-R379 IonicContact OE1-NE 4Å; E133-R379 PolarHBondContact OE1-NE 2.99Å; E133-R379 IonicContact OE1-NH1 2.66Å; E133-R379 IonicContact OE1-NH2 3.99Å; E133-R379 PolarHBondContact OE1-NH2 2.9Å; E133-R379 IonicContact OE2-CZ 3.75Å; E133-R379 IonicContact OE2-NH2 3.07Å; E133-R379 PolarHBondContact OE2-NH2 2.78Å; G377-R379 PolarHBondContact O-N 3.48Å; R379-D381 PolarHBondContact O-N 3.21Å; R379-T382 WeakPolarHBondContact CA-OG1 3.36Å; R379-T382 PolarHBondContact O-N 3.11Å; R379-T382 PolarHBondContact O-OG1 3.11Å; R379-L383 HydrophobicContact CB-CD1 4.42Å; R379-L383 PolarHBondContact O-N 2.98Å
380	A	43.2	Very low	51.3	Low	55 Å²	55	65 Å²	65	46%	0.455	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-53	-30.4	-179.1	0	0	0	0	0	112.5	P378 T389	P378-A380 VanDerWaalsContact C-N 3.33Å; P378-A380 PolarHBondContact O-N 3.37Å; A380-T389 PolarHBondContact O-OG1 2.88Å
381	D	42.8	Very low	49.4	Very low	136 Å²	136	73.9 Å²	73.9	73%	0.727	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-88.5	-25.3	-179.8	-67.6	-20.4	0	0	0	113.9	R379 A384	R379-D381 PolarHBondContact O-N 3.21Å; D381-A384 WeakPolarHBondContact O-CB 3.37Å; D381-A384 PolarHBondContact O-N 3.18Å
382	T	43.4	Very low	47.9	Very low	27 Å²	27	80.4 Å²	80.4	17%	0.166	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-82.8	-24.8	-179.3	40.5	0	0	0	0	114.5	M307 R379 A384 V385	M307-T382 HydrophobicContact CE-CG2 3.52Å; M307-T382 HydrophobicContact SD-CG2 3.16Å; M307-T382 WeakPolarHBondContact SD-CG2 3.43Å; R379-T382 WeakPolarHBondContact CA-OG1 3.36Å; R379-T382 PolarHBondContact O-N 3.11Å; R379-T382 PolarHBondContact O-OG1 3.11Å; T382-A384 PolarHBondContact O-N 3.33Å; T382-V385 PolarHBondContact O-N 3.48Å; T382-V385 VanDerWaalsContact O-N 3.16Å
383	L	45.1	Very low	46.3	Very low	17 Å²	17	85.9 Å²	85.9	9%	0.089	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-67.3	-11.9	168.4	-82.1	133.6	0	0	0	113.1	L374 R379 V385 T386 G387	L374-L383 HydrophobicContact CD2-CD1 3.2Å; L374-L383 HydrophobicContact CD2-CD2 3.62Å; L374-L383 HydrophobicContact CD2-CG 3.97Å; R379-L383 HydrophobicContact CB-CD1 4.42Å; R379-L383 PolarHBondContact O-N 2.98Å; L383-V385 PolarHBondContact O-N 3.11Å; L383-T386 PolarHBondContact O-N 2.91Å; L383-G387 PolarHBondContact O-N 3.42Å
384	A	44.6	Very low	44.7	Very low	40 Å²	40	89.1 Å²	89.1	33%	0.331	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-62.4	-17.7	169.5	0	0	0	0	0	112.7	D381 T382 T389	D381-A384 WeakPolarHBondContact O-CB 3.37Å; D381-A384 PolarHBondContact O-N 3.18Å; T382-A384 PolarHBondContact O-N 3.33Å; A384-T389 PolarHBondContact N-OG1 3.38Å
385	V	42.2	Very low	43.8	Very low	87 Å²	87	91.8 Å²	91.8	53%	0.527	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-90.1	-24.7	-178.8	-175.5	0	0	0	0	113	T382 L383 L399	T382-V385 PolarHBondContact O-N 3.48Å; T382-V385 VanDerWaalsContact O-N 3.16Å; L383-V385 PolarHBondContact O-N 3.11Å; V385-L399 HydrophobicContact CG1-CD1 3.88Å
386	T	46.6	Very low	43	Very low	36 Å²	36	90.7 Å²	90.7	22%	0.221	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	4.9	-166.2	61.8	0	0	0	0	117.6	I309 L383	I309-T386 HydrophobicContact CG2-CG2 4.32Å; L383-T386 PolarHBondContact O-N 2.91Å
387	G	44.1	Very low	42.7	Very low	46 Å²	46	93.5 Å²	93.5	47%	0.474	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-167.4	10.2	-176.6	0	0	0	0	0	121.8	L383	L383-G387 PolarHBondContact O-N 3.42Å
388	K	46.1	Very low	42.6	Very low	185 Å²	185	95 Å²	95	80%	0.804	54%	0.536	S	S	*	.			trans	94.8	99.8	177	-60.2	178.3	178.2	172.7	0	116.5
389	T	37.2	Very low	42.9	Very low	79 Å²	79	93.1 Å²	93.1	49%	0.485	52%	0.521	S	S	.	.			trans	-149.9	51.9	153	49.9	0	0	0	0	112.6	A380 A384	A380-T389 PolarHBondContact O-OG1 2.88Å; A384-T389 PolarHBondContact N-OG1 3.38Å
390	S	37.4	Very low	43.7	Very low	70 Å²	70	96.1 Å²	96.1	49%	0.49	55%	0.545	S	S	.	.			trans	-176.9	143.2	158.5	-177.5	0	0	0	0	111.9	Y392	S390-Y392 PolarHBondContact O-N 2.8Å; S390-Y392 PolarHBondContact OG-N 3Å
391	K	39.7	Very low	45.2	Very low	208 Å²	208	94.4 Å²	94.4	90%	0.904	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-7.2	174.9	-102.9	-178.3	179.6	177.5	0	114.3
392	Y	42.7	Very low	47.2	Very low	207 Å²	207	90.9 Å²	90.9	81%	0.812	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-1.7	-169	-64.1	-77.5	0	0	0	115.4	S390	S390-Y392 PolarHBondContact O-N 2.8Å; S390-Y392 PolarHBondContact OG-N 3Å
393	W	40.3	Very low	48.9	Very low	202 Å²	202	96.8 Å²	96.8	77%	0.765	54%	0.539	S	S	*	.	S	Bend	trans	-110.7	113.3	174.3	-80.4	83.7	0	0	0	109.5
394	P	34.5	Very low	50.6	Low	110 Å²	110	99.3 Å²	99.3	71%	0.714	56%	0.558	S	S	*	*			trans	-67.4	145.5	176.9	30.5	-32.8	0	0	0	109.4
395	L	36.5	Very low	52.3	Low	135 Å²	135	97.5 Å²	97.5	71%	0.707	54%	0.543	S	S	*	.	S	Bend	trans	-51.9	148.4	171.9	-74.2	95	0	0	0	110.4
396	D	37	Very low	54.2	Low	129 Å²	129	94 Å²	94	69%	0.69	52%	0.52	S	S	*	.			trans	83.8	57	166.3	-46.5	-32.2	0	0	0	117.1	G398	D396-G398 PolarHBondContact O-N 3.38Å
397	G	42	Very low	56	Low	75 Å²	75	94 Å²	94	77%	0.773	52%	0.52	S	S	*	.	S	Bend	trans	-70.7	22.4	156.1	0	0	0	0	0	114	L399	G397-L399 PolarHBondContact O-N 2.92Å; G397-L399 VanDerWaalsContact O-N 3.12Å
398	G	47.7	Very low	57.6	Low	50 Å²	50	93.1 Å²	93.1	52%	0.515	51%	0.506	S	S	.	.	S	Bend	trans	71.1	-2.5	179.8	0	0	0	0	0	116.1	W317 D396	W317-G398 WeakPolarHBondContact CH2-O 3.47Å; W317-G398 WeakPolarHBondContact CZ2-O 3.43Å; D396-G398 PolarHBondContact O-N 3.38Å
399	L	57	Low	59.2	Low	40 Å²	40	86.8 Å²	86.8	21%	0.209	49%	0.493	C	S	.	.			trans	-89.3	11.1	-174.7	-80	160.8	0	0	0	116.2	L310 W317 V385 G397	L310-L399 HydrophobicContact CD1-CD1 4.1Å; L310-L399 HydrophobicContact CD1-CD2 3.85Å; W317-L399 HydrophobicContact CE3-CD2 4.37Å; W317-L399 VanDerWaalsContact CH2-CA 3.49Å; W317-L399 HydrophobicContact CH2-CB 4.08Å; W317-L399 HydrophobicContact CH2-CD2 3.11Å; W317-L399 HydrophobicContact CH2-CG 3.54Å; W317-L399 HydrophobicContact CZ2-CB 4.35Å; W317-L399 HydrophobicContact CZ2-CD2 3.85Å; W317-L399 HydrophobicContact CZ2-CG 4.28Å; W317-L399 HydrophobicContact CZ3-CD2 3.38Å; W317-L399 HydrophobicContact CZ3-CG 4.2Å; V385-L399 HydrophobicContact CG1-CD1 3.88Å; G397-L399 PolarHBondContact O-N 2.92Å; G397-L399 VanDerWaalsContact O-N 3.12Å
400	S	68.2	Low	61.1	Low	84 Å²	84	90.7 Å²	90.7	59%	0.587	51%	0.511	S	S	*	.			trans	-75	132.1	-179.6	51.1	0	0	0	0	111.5
401	L	75.3	Confident	63.2	Low	20 Å²	20	88.2 Å²	88.2	11%	0.105	49%	0.491	C	S	.	.			trans	-104.3	156.9	169.4	-59.5	-175	0	0	0	109.5	W316 A405 W406	W316-L401 HydrophobicContact CB-CD1 4.02Å; W316-L401 HydrophobicContact CB-CD2 3.76Å; W316-L401 HydrophobicContact CD2-CD1 4.33Å; W316-L401 HydrophobicContact CD2-CD2 4.46Å; W316-L401 HydrophobicContact CE3-CD1 4.46Å; W316-L401 HydrophobicContact CG-CD1 4.15Å; W316-L401 HydrophobicContact CG-CD2 3.7Å; W316-L401 HydrophobicContact CG-CG 4.48Å; L401-A405 HydrophobicContact CB-CB 3.77Å; L401-A405 HydrophobicContact CD1-CB 3.86Å; L401-A405 HydrophobicContact CG-CB 4.49Å; L401-W406 HydrophobicContact CB-CZ2 4.19Å; L401-W406 HydrophobicContact CD1-CH2 3.96Å; L401-W406 HydrophobicContact CD1-CZ2 3.4Å; L401-W406 HydrophobicContact CG-CZ2 3.92Å
402	P	82.8	Confident	65.6	Low	61 Å²	61	80.8 Å²	80.8	40%	0.396	46%	0.463	S	S	.	.			trans	-58.1	154.2	171.3	25.8	-35.4	0	0	0	111.5	W316 S404 A405	W316-P402 HydrophobicContact CH2-CG 4.46Å; W316-P402 HydrophobicContact CZ2-CG 3.64Å; P402-S404 PolarHBondContact O-N 3.21Å; P402-A405 VanDerWaalsContact O-CB 3.23Å; P402-A405 WeakPolarHBondContact O-CB 3.3Å; P402-A405 PolarHBondContact O-N 2.93Å
403	E	79.5	Confident	68	Low	152 Å²	152	71.1 Å²	71.1	71%	0.71	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-57.1	-35.1	-179.5	-177.9	162	-160.4	0	0	112.5	A405 W406 T407	E403-A405 PolarHBondContact O-N 3.29Å; E403-W406 PolarHBondContact O-N 2.83Å; E403-T407 WeakPolarHBondContact CG-OG1 3.37Å; E403-T407 PolarHBondContact O-N 3.24Å; E403-T407 PolarHBondContact O-OG1 3.31Å
404	S	81.6	Confident	70.5	Confident	70 Å²	70	64.6 Å²	64.6	49%	0.49	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-57.9	-18.3	174.5	62.5	0	0	0	0	114.8	P402 W406	P402-S404 PolarHBondContact O-N 3.21Å; S404-W406 VanDerWaalsContact C-N 3.3Å
405	A	80.4	Confident	73.2	Confident	2 Å²	2	62.4 Å²	62.4	2%	0.017	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-75.7	-22.2	175.1	0	0	0	0	0	112.3	K312 W316 L401 P402 E403	K312-A405 WeakPolarHBondContact CE-O 3.4Å; K312-A405 PolarHBondContact NZ-O 3.25Å; W316-A405 HydrophobicContact CD2-CB 4.18Å; W316-A405 HydrophobicContact CE3-CB 3.68Å; W316-A405 HydrophobicContact CH2-CB 3.67Å; W316-A405 HydrophobicContact CZ2-CB 4.17Å; W316-A405 HydrophobicContact CZ3-CB 3.41Å; W316-A405 VanDerWaalsContact CZ3-CB 3.41Å; L401-A405 HydrophobicContact CB-CB 3.77Å; L401-A405 HydrophobicContact CD1-CB 3.86Å; L401-A405 HydrophobicContact CG-CB 4.49Å; P402-A405 VanDerWaalsContact O-CB 3.23Å; P402-A405 WeakPolarHBondContact O-CB 3.3Å; P402-A405 PolarHBondContact O-N 2.93Å; E403-A405 PolarHBondContact O-N 3.29Å
406	W	82	Confident	76	Confident	14 Å²	14	56 Å²	56	5%	0.053	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-31.8	-169.3	-56.4	113.4	0	0	0	114	I309 K312 D367 S368 L401 E403 S404	I309-W406 HydrophobicContact CB-CH2 4.45Å; I309-W406 HydrophobicContact CG2-CH2 3.67Å; I309-W406 HydrophobicContact CG2-CZ2 4.32Å; I309-W406 HydrophobicContact CG2-CZ3 4.27Å; K312-W406 HydrophobicContact CD-CH2 4.32Å; K312-W406 HydrophobicContact CD-CZ3 3.91Å; K312-W406 HydrophobicContact CG-CH2 4.32Å; K312-W406 HydrophobicContact CG-CZ3 4.41Å; D367-W406 HydrophobicContact CB-CE3 4.32Å; S368-W406 WeakPolarHBondContact CA-O 3.35Å; S368-W406 PolarHBondContact N-O 3.18Å; S368-W406 VanDerWaalsContact N-O 3.17Å; L401-W406 HydrophobicContact CB-CZ2 4.19Å; L401-W406 HydrophobicContact CD1-CH2 3.96Å; L401-W406 HydrophobicContact CD1-CZ2 3.4Å; L401-W406 HydrophobicContact CG-CZ2 3.92Å; E403-W406 PolarHBondContact O-N 2.83Å; S404-W406 VanDerWaalsContact C-N 3.3Å
407	T	83.5	Confident	78.8	Confident	36 Å²	36	49.9 Å²	49.9	22%	0.221	33%	0.326	C	S	.	.			trans	-124.9	136.4	-179.4	58.3	0	0	0	0	109.2	E403 G409	E403-T407 WeakPolarHBondContact CG-OG1 3.37Å; E403-T407 PolarHBondContact O-N 3.24Å; E403-T407 PolarHBondContact O-OG1 3.31Å; T407-G409 PolarHBondContact O-N 3.1Å
408	P	78.6	Confident	81.2	Confident	26 Å²	26	48.9 Å²	48.9	17%	0.169	31%	0.311	C	S	.	.			trans	-69.8	-17.9	178.5	31.7	-38.8	0	0	0	111.8	L361 A364 R365 W411	L361-P408 HydrophobicContact CD1-CB 4.06Å; A364-P408 HydrophobicContact CB-CB 4.06Å; R365-P408 HydrophobicContact CG-CB 4.15Å; R365-P408 HydrophobicContact CG-CG 3.99Å; P408-W411 HydrophobicContact CB-CB 4.29Å; P408-W411 WeakPolarHBondContact O-CB 3.36Å
409	G	79.8	Confident	83.4	Confident	52 Å²	52	51.8 Å²	51.8	54%	0.536	31%	0.306	S	S	.	.			trans	68.8	-146.5	-161.5	0	0	0	0	0	110.5	T407 W411	T407-G409 PolarHBondContact O-N 3.1Å; G409-W411 PolarHBondContact O-N 3.01Å
410	D	76	Confident	85.1	Confident	161 Å²	161	49.9 Å²	49.9	86%	0.861	30%	0.296	S	S	*	.	S	Bend	trans	-83.8	25.8	174.9	-57.7	-36.7	0	0	0	112.4	T412	D410-T412 PolarHBondContact O-N 3.01Å
411	W	82.1	Confident	86.2	Confident	18 Å²	18	47.4 Å²	47.4	7%	0.068	28%	0.276	C	S	.	.			trans	-75.6	110.1	-171.1	-164	4.5	0	0	0	111	L339 H357 A360 L361 P408 G409 V416	L339-W411 HydrophobicContact CD2-CH2 3.59Å; L339-W411 HydrophobicContact CD2-CZ2 4.33Å; L339-W411 HydrophobicContact CD2-CZ3 4.16Å; H357-W411 HydrophobicContact CB-CH2 4.32Å; H357-W411 HydrophobicContact CB-CZ2 4.09Å; H357-W411 AromaticContact ND1-CH2 3.88Å; H357-W411 AromaticContact ND1-CZ2 3.63Å; H357-W411 WeakPolarHBondContact O-CH2 3.26Å; A360-W411 HydrophobicContact CB-CH2 4.19Å; A360-W411 HydrophobicContact CB-CZ3 4.15Å; L361-W411 HydrophobicContact CB-CE3 4.31Å; L361-W411 HydrophobicContact CB-CH2 4.45Å; L361-W411 HydrophobicContact CB-CZ3 4.27Å; L361-W411 HydrophobicContact CD1-CB 4.02Å; L361-W411 HydrophobicContact CD1-CD2 4.09Å; L361-W411 HydrophobicContact CD1-CE3 4.19Å; L361-W411 HydrophobicContact CD1-CG 4.01Å; L361-W411 VanDerWaalsContact CD1-O 3.25Å; L361-W411 WeakPolarHBondContact CD1-O 3.18Å; P408-W411 HydrophobicContact CB-CB 4.29Å; P408-W411 WeakPolarHBondContact O-CB 3.36Å; G409-W411 PolarHBondContact O-N 3.01Å; W411-V416 HydrophobicContact CD2-CG2 4.5Å; W411-V416 HydrophobicContact CZ2-CB 4.45Å; W411-V416 HydrophobicContact CZ2-CG2 3.62Å; W411-V416 VanDerWaalsContact NE1-CG2 3.32Å; W411-V416 VanDerWaalsContact NE1-N 3.19Å
412	T	90.3	Very high	87	Confident	52 Å²	52	50.3 Å²	50.3	32%	0.319	30%	0.303	S	S	.	.			trans	-95	171.7	172.8	65.6	0	0	0	0	112.1	D410 S414 D415 V416	D410-T412 PolarHBondContact O-N 3.01Å; T412-S414 VanDerWaalsContact C-N 3.25Å; T412-S414 PolarHBondContact O-N 3.18Å; T412-S414 PolarHBondContact OG1-N 3.46Å; T412-D415 WeakPolarHBondContact CB-OD2 3.42Å; T412-D415 PolarHBondContact N-OD2 3.14Å; T412-D415 WeakPolarHBondContact O-CB 3.32Å; T412-D415 PolarHBondContact O-N 3.46Å; T412-D415 VanDerWaalsContact OG1-CG 3.31Å; T412-D415 PolarHBondContact OG1-N 3.12Å; T412-D415 PolarHBondContact OG1-OD2 3.39Å; T412-V416 PolarHBondContact O-N 2.91Å; T412-V416 VanDerWaalsContact O-N 3.08Å
413	L	92.3	Very high	87.3	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-31.7	171.9	-171.1	63.7	0	0	0	112.5	E146 A150 D415 V416 F417 M496 L497	E146-L413 HydrophobicContact CG-CB 4.32Å; E146-L413 PolarHBondContact OE1-N 2.96Å; A150-L413 HydrophobicContact CB-CD1 4.36Å; L413-D415 VanDerWaalsContact C-N 3.34Å; L413-D415 PolarHBondContact O-N 3.36Å; L413-V416 HydrophobicContact CD1-CB 4.36Å; L413-V416 WeakPolarHBondContact O-CB 3.39Å; L413-V416 PolarHBondContact O-N 3.33Å; L413-F417 HydrophobicContact CD1-CE2 4.21Å; L413-F417 HydrophobicContact CD2-CE2 4.37Å; L413-F417 HydrophobicContact CG-CD2 4.39Å; L413-F417 HydrophobicContact CG-CE2 3.92Å; L413-F417 VanDerWaalsContact O-CD2 3.28Å; L413-F417 WeakPolarHBondContact O-CD2 3.2Å; L413-F417 PolarHBondContact O-N 3.27Å; L413-M496 HydrophobicContact CD2-CB 4Å; L413-M496 HydrophobicContact CD2-CE 3.48Å; L413-M496 VanDerWaalsContact CD2-CE 3.48Å; L413-L497 HydrophobicContact CG-CD2 4.39Å
414	S	92.6	Very high	87.7	Confident	64 Å²	64	46.2 Å²	46.2	45%	0.448	28%	0.275	S	S	.	.	H	α-helix	trans	-61.4	-44.1	173.4	-178.4	0	0	0	0	111.6	T412 V416 F417 A418	T412-S414 VanDerWaalsContact C-N 3.25Å; T412-S414 PolarHBondContact O-N 3.18Å; T412-S414 PolarHBondContact OG1-N 3.46Å; S414-V416 VanDerWaalsContact C-N 3.29Å; S414-V416 PolarHBondContact O-N 2.93Å; S414-F417 PolarHBondContact O-N 2.96Å; S414-A418 PolarHBondContact O-N 2.91Å
415	D	93	Very high	87.9	Confident	64 Å²	64	46 Å²	46	34%	0.342	28%	0.284	S	S	.	.	H	α-helix	trans	-67.2	-29.5	176.6	-65.7	-52.7	0	0	0	112.4	T412 L413 A418 R419	T412-D415 WeakPolarHBondContact CB-OD2 3.42Å; T412-D415 PolarHBondContact N-OD2 3.14Å; T412-D415 WeakPolarHBondContact O-CB 3.32Å; T412-D415 PolarHBondContact O-N 3.46Å; T412-D415 VanDerWaalsContact OG1-CG 3.31Å; T412-D415 PolarHBondContact OG1-N 3.12Å; T412-D415 PolarHBondContact OG1-OD2 3.39Å; L413-D415 VanDerWaalsContact C-N 3.34Å; L413-D415 PolarHBondContact O-N 3.36Å; D415-A418 PolarHBondContact O-N 3.48Å; D415-R419 WeakPolarHBondContact O-CB 3.49Å; D415-R419 VanDerWaalsContact O-CG 3.23Å; D415-R419 WeakPolarHBondContact O-CG 3.34Å; D415-R419 PolarHBondContact O-N 3Å
416	V	94.1	Very high	88.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.6	-54.3	170.4	165.4	0	0	0	0	109.7	H357 L361 W411 T412 L413 S414 A418 R419 V420	H357-V416 HydrophobicContact CB-CG1 3.57Å; L361-V416 HydrophobicContact CB-CG2 4.19Å; L361-V416 HydrophobicContact CD2-CG2 3.66Å; L361-V416 HydrophobicContact CG-CG2 4.48Å; W411-V416 HydrophobicContact CD2-CG2 4.5Å; W411-V416 HydrophobicContact CZ2-CB 4.45Å; W411-V416 HydrophobicContact CZ2-CG2 3.62Å; W411-V416 VanDerWaalsContact NE1-CG2 3.32Å; W411-V416 VanDerWaalsContact NE1-N 3.19Å; T412-V416 PolarHBondContact O-N 2.91Å; T412-V416 VanDerWaalsContact O-N 3.08Å; L413-V416 HydrophobicContact CD1-CB 4.36Å; L413-V416 WeakPolarHBondContact O-CB 3.39Å; L413-V416 PolarHBondContact O-N 3.33Å; S414-V416 VanDerWaalsContact C-N 3.29Å; S414-V416 PolarHBondContact O-N 2.93Å; V416-A418 VanDerWaalsContact C-N 3.32Å; V416-A418 PolarHBondContact O-N 3.43Å; V416-R419 PolarHBondContact O-N 3.48Å; V416-R419 VanDerWaalsContact O-N 3.13Å; V416-V420 HydrophobicContact CG1-CG2 4.36Å; V416-V420 WeakPolarHBondContact O-CG2 3.34Å; V416-V420 PolarHBondContact O-N 3.23Å
417	F	95.2	Very high	88.4	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-39	180	-70	-66	0	0	0	112.2	L153 W350 T354 L413 S414 R419 V420 D421 Q493 M496 L497	L153-F417 HydrophobicContact CD2-CZ 3.98Å; W350-F417 HydrophobicContact CH2-CE1 4.3Å; W350-F417 HydrophobicContact CZ2-CD1 4.28Å; W350-F417 AromaticContact CZ2-CE1 3.65Å; W350-F417 HydrophobicContact CZ2-CE1 3.65Å; T354-F417 HydrophobicContact CG2-CE1 3.94Å; L413-F417 HydrophobicContact CD1-CE2 4.21Å; L413-F417 HydrophobicContact CD2-CE2 4.37Å; L413-F417 HydrophobicContact CG-CD2 4.39Å; L413-F417 HydrophobicContact CG-CE2 3.92Å; L413-F417 VanDerWaalsContact O-CD2 3.28Å; L413-F417 WeakPolarHBondContact O-CD2 3.2Å; L413-F417 PolarHBondContact O-N 3.27Å; S414-F417 PolarHBondContact O-N 2.96Å; F417-R419 VanDerWaalsContact C-N 3.3Å; F417-R419 PolarHBondContact O-N 3.08Å; F417-V420 PolarHBondContact O-N 3.08Å; F417-D421 WeakPolarHBondContact O-CB 3.43Å; F417-D421 VanDerWaalsContact O-CG 3.23Å; F417-D421 PolarHBondContact O-N 2.88Å; F417-Q493 HydrophobicContact CB-CG 4.29Å; F417-Q493 HydrophobicContact CD1-CB 4.32Å; F417-Q493 HydrophobicContact CD1-CG 3.85Å; F417-Q493 HydrophobicContact CD2-CG 3.96Å; F417-Q493 HydrophobicContact CE1-CB 4.19Å; F417-Q493 HydrophobicContact CE1-CG 4.12Å; F417-Q493 HydrophobicContact CE2-CG 4.2Å; F417-Q493 HydrophobicContact CG-CG 3.76Å; F417-Q493 HydrophobicContact CZ-CB 4.39Å; F417-Q493 HydrophobicContact CZ-CG 4.28Å; F417-M496 HydrophobicContact CE2-CB 3.97Å; F417-M496 HydrophobicContact CE2-CG 4.5Å; F417-M496 HydrophobicContact CZ-CB 4.18Å; F417-M496 HydrophobicContact CZ-CG 4.23Å; F417-L497 HydrophobicContact CD2-CD1 3.91Å; F417-L497 HydrophobicContact CD2-CD2 3.94Å; F417-L497 HydrophobicContact CD2-CG 3.97Å; F417-L497 HydrophobicContact CE2-CD2 4.18Å; F417-L497 HydrophobicContact CE2-CG 4.13Å
418	A	94	Very high	88.7	Confident	54 Å²	54	46.1 Å²	46.1	45%	0.446	29%	0.285	S	S	.	.	H	α-helix	trans	-61	-37.8	174.6	0	0	0	0	0	112.8	S414 D415 V416 A422	S414-A418 PolarHBondContact O-N 2.91Å; D415-A418 PolarHBondContact O-N 3.48Å; V416-A418 VanDerWaalsContact C-N 3.32Å; V416-A418 PolarHBondContact O-N 3.43Å; A418-A422 WeakPolarHBondContact O-CB 3.37Å; A418-A422 PolarHBondContact O-N 3.11Å
419	R	93.4	Very high	89.1	Confident	112 Å²	112	46.2 Å²	46.2	42%	0.423	28%	0.284	S	S	.	.	H	α-helix	trans	-70.9	-39.1	175.2	-71.6	174.1	-169.7	-161.9	4.5	112.1	D415 V416 F417 A422 R423	D415-R419 WeakPolarHBondContact O-CB 3.49Å; D415-R419 VanDerWaalsContact O-CG 3.23Å; D415-R419 WeakPolarHBondContact O-CG 3.34Å; D415-R419 PolarHBondContact O-N 3Å; V416-R419 PolarHBondContact O-N 3.48Å; V416-R419 VanDerWaalsContact O-N 3.13Å; F417-R419 VanDerWaalsContact C-N 3.3Å; F417-R419 PolarHBondContact O-N 3.08Å; R419-A422 PolarHBondContact O-N 2.87Å; R419-R423 WeakPolarHBondContact O-CB 3.4Å; R419-R423 PolarHBondContact O-N 2.9Å
420	V	93.4	Very high	89.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-49.4	173.3	171.4	0	0	0	0	109.6	Q353 H357 V416 F417 A422 R423 L424	Q353-V420 HydrophobicContact CB-CG1 4.12Å; Q353-V420 HydrophobicContact CB-CG2 4.35Å; H357-V420 HydrophobicContact CB-CG2 4.15Å; V416-V420 HydrophobicContact CG1-CG2 4.36Å; V416-V420 WeakPolarHBondContact O-CG2 3.34Å; V416-V420 PolarHBondContact O-N 3.23Å; F417-V420 PolarHBondContact O-N 3.08Å; V420-A422 VanDerWaalsContact C-N 3.34Å; V420-A422 PolarHBondContact O-N 3.4Å; V420-R423 WeakPolarHBondContact O-CB 3.4Å; V420-R423 PolarHBondContact O-N 3.01Å; V420-L424 HydrophobicContact CG1-CD1 3.67Å; V420-L424 HydrophobicContact CG1-CG 4.22Å; V420-L424 WeakPolarHBondContact O-CB 3.38Å; V420-L424 VanDerWaalsContact O-CG 3.3Å; V420-L424 WeakPolarHBondContact O-CG 3.2Å; V420-L424 PolarHBondContact O-N 3.29Å
421	D	91.4	Very high	89.8	Confident	31 Å²	31	36.9 Å²	36.9	17%	0.166	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-44.8	178.1	-71.2	-18.3	0	0	0	111.6	F417 R423 L424 G425 W426 S427	F417-D421 WeakPolarHBondContact O-CB 3.43Å; F417-D421 VanDerWaalsContact O-CG 3.23Å; F417-D421 PolarHBondContact O-N 2.88Å; D421-R423 VanDerWaalsContact C-N 3.31Å; D421-R423 PolarHBondContact O-N 3.14Å; D421-L424 PolarHBondContact O-N 3.14Å; D421-G425 WeakPolarHBondContact O-CA 3.3Å; D421-G425 PolarHBondContact O-N 3.45Å; D421-W426 WeakPolarHBondContact CA-O 3.46Å; D421-W426 PolarHBondContact O-N 2.9Å; D421-S427 WeakPolarHBondContact OD1-CA 3.5Å; D421-S427 WeakPolarHBondContact OD1-CB 3.45Å; D421-S427 WeakPolarHBondContact OD2-CB 3.13Å
422	A	91.7	Very high	90	Very high	81 Å²	81	36.2 Å²	36.2	67%	0.669	22%	0.223	S	C	*	.	H	α-helix	trans	-62.6	-37.2	176.1	0	0	0	0	0	112.4	A418 R419 V420	A418-A422 WeakPolarHBondContact O-CB 3.37Å; A418-A422 PolarHBondContact O-N 3.11Å; R419-A422 PolarHBondContact O-N 2.87Å; V420-A422 VanDerWaalsContact C-N 3.34Å; V420-A422 PolarHBondContact O-N 3.4Å
423	R	89.1	Confident	89.8	Confident	107 Å²	107	39.6 Å²	39.6	40%	0.404	24%	0.235	S	C	.	.	H	α-helix	trans	-71.9	-39	179.5	-178.8	60	-179.3	124.5	-1	112.4	S343 Q353 R419 V420 D421	S343-R423 PolarHBondContact O-NH2 3.24Å; Q353-R423 HydrophobicContact CG-CG 4.44Å; R419-R423 WeakPolarHBondContact O-CB 3.4Å; R419-R423 PolarHBondContact O-N 2.9Å; V420-R423 WeakPolarHBondContact O-CB 3.4Å; V420-R423 PolarHBondContact O-N 3.01Å; D421-R423 VanDerWaalsContact C-N 3.31Å; D421-R423 PolarHBondContact O-N 3.14Å
424	L	86.6	Confident	89.1	Confident	21 Å²	21	45.6 Å²	45.6	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-76.5	-26.3	177.4	-65.6	178	0	0	0	112	W350 Q353 V420 D421 W426	W350-L424 HydrophobicContact CB-CD1 4.16Å; W350-L424 HydrophobicContact CG-CD1 4.49Å; Q353-L424 HydrophobicContact CG-CD2 4.11Å; V420-L424 HydrophobicContact CG1-CD1 3.67Å; V420-L424 HydrophobicContact CG1-CG 4.22Å; V420-L424 WeakPolarHBondContact O-CB 3.38Å; V420-L424 VanDerWaalsContact O-CG 3.3Å; V420-L424 WeakPolarHBondContact O-CG 3.2Å; V420-L424 PolarHBondContact O-N 3.29Å; D421-L424 PolarHBondContact O-N 3.14Å; L424-W426 VanDerWaalsContact C-N 3.26Å; L424-W426 HydrophobicContact CB-CD2 4.48Å; L424-W426 HydrophobicContact CB-CG 4.36Å; L424-W426 HydrophobicContact CD1-CH2 4.31Å; L424-W426 HydrophobicContact CD1-CZ2 3.85Å; L424-W426 VanDerWaalsContact O-CD1 3.24Å
425	G	86.9	Confident	87.9	Confident	66 Å²	66	43.1 Å²	43.1	68%	0.68	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	12.3	-175	0	0	0	0	0	113.4	D421	D421-G425 WeakPolarHBondContact O-CA 3.3Å; D421-G425 PolarHBondContact O-N 3.45Å
426	W	85.2	Confident	86.2	Confident	18 Å²	18	45.6 Å²	45.6	7%	0.068	26%	0.257	C	S	.	.			trans	-153.2	156	177.4	62.3	-91	0	0	0	109.4	W350 D421 L424 A428 V443 S446 Y489	W350-W426 HydrophobicContact CB-CH2 4.31Å; D421-W426 WeakPolarHBondContact CA-O 3.46Å; D421-W426 PolarHBondContact O-N 2.9Å; L424-W426 VanDerWaalsContact C-N 3.26Å; L424-W426 HydrophobicContact CB-CD2 4.48Å; L424-W426 HydrophobicContact CB-CG 4.36Å; L424-W426 HydrophobicContact CD1-CH2 4.31Å; L424-W426 HydrophobicContact CD1-CZ2 3.85Å; L424-W426 VanDerWaalsContact O-CD1 3.24Å; W426-A428 HydrophobicContact CZ3-CB 4.35Å; W426-V443 HydrophobicContact CB-CG2 4.27Å; W426-V443 HydrophobicContact CD2-CG2 4.26Å; W426-V443 HydrophobicContact CG-CG2 4.06Å; W426-S446 WeakPolarHBondContact CZ2-OG 3.41Å; W426-Y489 AromaticContact CH2-CD2 3.95Å; W426-Y489 HydrophobicContact CH2-CD2 3.95Å; W426-Y489 HydrophobicContact CH2-CE2 4.28Å; W426-Y489 HydrophobicContact CZ3-CD2 4.49Å
427	S	88.2	Confident	84	Confident	35 Å²	35	52.9 Å²	52.9	25%	0.245	30%	0.295	C	S	.	.			trans	-124	147.4	172.4	67.2	0	0	0	0	109.9	D421 I429 G430 C431	D421-S427 WeakPolarHBondContact OD1-CA 3.5Å; D421-S427 WeakPolarHBondContact OD1-CB 3.45Å; D421-S427 WeakPolarHBondContact OD2-CB 3.13Å; S427-I429 PolarHBondContact O-N 3.05Å; S427-G430 PolarHBondContact O-N 3.44Å; S427-G430 WeakPolarHBondContact OG-CA 3.31Å; S427-G430 PolarHBondContact OG-N 3.25Å; S427-G430 VanDerWaalsContact OG-N 3.13Å; S427-C431 WeakPolarHBondContact O-CB 3.48Å; S427-C431 PolarHBondContact O-N 3.04Å; S427-C431 PolarHBondContact O-SG 3.13Å
428	A	88	Confident	81.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-49.3	-177	0	0	0	0	0	111.6	W426 C431 L432 A490	W426-A428 HydrophobicContact CZ3-CB 4.35Å; A428-C431 WeakPolarHBondContact O-CB 3.49Å; A428-C431 PolarHBondContact O-N 3Å; A428-L432 WeakPolarHBondContact O-CG 3.14Å; A428-L432 PolarHBondContact O-N 2.85Å; A428-L432 VanDerWaalsContact O-N 3.13Å; A428-A490 HydrophobicContact CB-CB 3.98Å
429	I	88.2	Confident	79.1	Confident	29 Å²	29	61.4 Å²	61.4	15%	0.149	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-45.4	176.9	-62.8	170.7	0	0	0	110.9	S427 C431 L432 E433 A490	S427-I429 PolarHBondContact O-N 3.05Å; I429-C431 PolarHBondContact O-N 2.87Å; I429-L432 WeakPolarHBondContact O-CB 3.46Å; I429-L432 PolarHBondContact O-N 3.27Å; I429-E433 HydrophobicContact CG2-CG 4.45Å; I429-E433 WeakPolarHBondContact O-CG 3.41Å; I429-E433 PolarHBondContact O-N 3.1Å; I429-A490 HydrophobicContact CG1-CB 3.97Å
430	G	86.8	Confident	77.1	Confident	11 Å²	11	56.6 Å²	56.6	11%	0.113	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-27	179.2	0	0	0	0	0	113.4	S427 K434	S427-G430 PolarHBondContact O-N 3.44Å; S427-G430 WeakPolarHBondContact OG-CA 3.31Å; S427-G430 PolarHBondContact OG-N 3.25Å; S427-G430 VanDerWaalsContact OG-N 3.13Å; G430-K434 WeakPolarHBondContact O-CG 3.41Å; G430-K434 PolarHBondContact O-N 3.46Å
431	C	83.4	Confident	75.1	Confident	6 Å²	6	63.5 Å²	63.5	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-68.4	-42.2	169.5	-75.9	0	0	0	0	111.6	S427 A428 I429 K434 C435 L438 V443 C486	S427-C431 WeakPolarHBondContact O-CB 3.48Å; S427-C431 PolarHBondContact O-N 3.04Å; S427-C431 PolarHBondContact O-SG 3.13Å; A428-C431 WeakPolarHBondContact O-CB 3.49Å; A428-C431 PolarHBondContact O-N 3Å; I429-C431 PolarHBondContact O-N 2.87Å; C431-K434 PolarHBondContact O-N 2.77Å; C431-C435 PolarHBondContact O-N 3.25Å; C431-C435 PolarHBondContact O-SG 3.38Å; C431-C435 VanDerWaalsContact O-SG 3.4Å; C431-L438 HydrophobicContact CB-CD1 4.32Å; C431-L438 WeakPolarHBondContact O-CD1 3.27Å; C431-V443 WeakPolarHBondContact SG-CG2 3.49Å; C431-C486 HydrophobicContact CB-CB 4.33Å
432	L	86.4	Confident	73.2	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-40.5	178.7	-63.2	173.7	0	0	0	112.3	A428 I429 K434 C435 I483 C486 I487 A490 T506 L507 V510	A428-L432 WeakPolarHBondContact O-CG 3.14Å; A428-L432 PolarHBondContact O-N 2.85Å; A428-L432 VanDerWaalsContact O-N 3.13Å; I429-L432 WeakPolarHBondContact O-CB 3.46Å; I429-L432 PolarHBondContact O-N 3.27Å; L432-K434 VanDerWaalsContact C-N 3.31Å; L432-K434 PolarHBondContact O-N 3.11Å; L432-C435 WeakPolarHBondContact O-CB 3.49Å; L432-C435 PolarHBondContact O-N 3.33Å; L432-C435 PolarHBondContact O-SG 3.14Å; L432-I483 HydrophobicContact CD2-CG2 3.81Å; L432-C486 HydrophobicContact CD2-CB 3.89Å; L432-C486 HydrophobicContact CG-CB 4.08Å; L432-I487 HydrophobicContact CD1-CG1 4.27Å; L432-I487 HydrophobicContact CD2-CG1 3.81Å; L432-A490 HydrophobicContact CD1-CB 3.96Å; L432-T506 HydrophobicContact CB-CG2 3.45Å; L432-T506 VanDerWaalsContact CB-CG2 3.45Å; L432-L507 HydrophobicContact CD1-CD2 4.15Å; L432-V510 HydrophobicContact CB-CG2 4.22Å; L432-V510 WeakPolarHBondContact O-CG2 3.38Å
433	E	85.8	Confident	71.4	Confident	122 Å²	122	61.5 Å²	61.5	57%	0.57	31%	0.314	S	S	*	.	H	α-helix	trans	-61	-38.1	176.1	-70	175.5	166.4	0	0	112.7	I429 T506	I429-E433 HydrophobicContact CG2-CG 4.45Å; I429-E433 WeakPolarHBondContact O-CG 3.41Å; I429-E433 PolarHBondContact O-N 3.1Å; E433-T506 HydrophobicContact CG-CG2 3.75Å
434	K	77.1	Confident	69.6	Low	131 Å²	131	58.1 Å²	58.1	57%	0.57	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	11.9	-176.2	-65.5	173.4	-172.5	169.3	0	113.6	G430 C431 L432 N436 N437 L438	G430-K434 WeakPolarHBondContact O-CG 3.41Å; G430-K434 PolarHBondContact O-N 3.46Å; C431-K434 PolarHBondContact O-N 2.77Å; L432-K434 VanDerWaalsContact C-N 3.31Å; L432-K434 PolarHBondContact O-N 3.11Å; K434-N436 PolarHBondContact O-N 2.82Å; K434-N437 PolarHBondContact O-N 3.09Å; K434-L438 HydrophobicContact CB-CD1 3.57Å; K434-L438 HydrophobicContact CB-CD2 4.49Å; K434-L438 HydrophobicContact CB-CG 3.75Å; K434-L438 WeakPolarHBondContact O-CD1 3.43Å
435	C	67.4	Low	68.1	Low	13 Å²	13	66.7 Å²	66.7	9%	0.088	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-17.1	-177.3	-84	0	0	0	0	115.1	C431 L432 V510	C431-C435 PolarHBondContact O-N 3.25Å; C431-C435 PolarHBondContact O-SG 3.38Å; C431-C435 VanDerWaalsContact O-SG 3.4Å; L432-C435 WeakPolarHBondContact O-CB 3.49Å; L432-C435 PolarHBondContact O-N 3.33Å; L432-C435 PolarHBondContact O-SG 3.14Å; C435-V510 HydrophobicContact CB-CG2 4.43Å
436	N	57.3	Low	66.5	Low	116 Å²	116	63.7 Å²	63.7	62%	0.62	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-22.6	172.4	-82.9	-34.6	0	0	0	115.4	K434 K513	K434-N436 PolarHBondContact O-N 2.82Å; N436-K513 PolarHBondContact ND2-NZ 3.21Å; N436-K513 WeakPolarHBondContact OD1-CE 3.12Å; N436-K513 PolarHBondContact OD1-NZ 2.9Å
437	N	48	Very low	64.8	Low	153 Å²	153	63 Å²	63	82%	0.818	30%	0.302	S	S	*	.	S	Bend	trans	-143.5	20.7	-163.7	-78.3	-41.6	0	0	0	115	K434	K434-N437 PolarHBondContact O-N 3.09Å
438	L	44.2	Very low	62.7	Low	34 Å²	34	63.7 Å²	63.7	18%	0.178	30%	0.302	C	S	.	.			trans	-89	119	-170.3	-94.6	155.4	0	0	0	114.6	C431 K434 M440	C431-L438 HydrophobicContact CB-CD1 4.32Å; C431-L438 WeakPolarHBondContact O-CD1 3.27Å; K434-L438 HydrophobicContact CB-CD1 3.57Å; K434-L438 HydrophobicContact CB-CD2 4.49Å; K434-L438 HydrophobicContact CB-CG 3.75Å; K434-L438 WeakPolarHBondContact O-CD1 3.43Å; L438-M440 PolarHBondContact O-N 3.29Å
439	R	42.3	Very low	60.8	Low	200 Å²	200	66.6 Å²	66.6	76%	0.755	32%	0.317	S	S	*	.			trans	-69.6	101.1	156.2	-83.8	-177.9	173.1	173.8	-1.8	109.2	K441	R439-K441 PolarHBondContact O-N 2.84Å
440	M	52	Low	58.9	Low	10 Å²	10	66.3 Å²	66.3	5%	0.049	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	1	-168.8	-113	-162.7	-173.2	0	0	116.6	L438 S442 V443 L444 P478 A482 I483	L438-M440 PolarHBondContact O-N 3.29Å; M440-S442 VanDerWaalsContact C-N 3.26Å; M440-S442 PolarHBondContact O-N 2.85Å; M440-S442 VanDerWaalsContact O-N 3.12Å; M440-V443 HydrophobicContact CG-CB 4.37Å; M440-V443 PolarHBondContact O-N 2.92Å; M440-L444 HydrophobicContact CB-CD1 3.88Å; M440-L444 HydrophobicContact CB-CG 4.07Å; M440-L444 VanDerWaalsContact O-CB 3.26Å; M440-L444 WeakPolarHBondContact O-CB 3.32Å; M440-L444 WeakPolarHBondContact O-CD1 3.41Å; M440-L444 WeakPolarHBondContact O-CG 3.3Å; M440-L444 PolarHBondContact O-N 3.46Å; M440-L444 HydrophobicContact SD-CG 4.47Å; M440-P478 HydrophobicContact CB-CB 4.37Å; M440-P478 HydrophobicContact CE-CB 3.36Å; M440-P478 HydrophobicContact CG-CB 3.74Å; M440-P478 WeakPolarHBondContact SD-CA 3.24Å; M440-P478 HydrophobicContact SD-CB 3.21Å; M440-P478 WeakPolarHBondContact SD-CB 3.48Å; M440-A482 HydrophobicContact CE-CB 3.42Å; M440-A482 VanDerWaalsContact CE-CB 3.42Å; M440-A482 HydrophobicContact SD-CB 3.28Å; M440-A482 WeakPolarHBondContact SD-CB 3.33Å; M440-I483 HydrophobicContact CE-CG1 3.74Å
441	K	51	Low	57.1	Low	146 Å²	146	70.1 Å²	70.1	64%	0.635	33%	0.33	S	S	*	.	H	α-helix	trans	-57.4	-31.8	-173.7	-73.6	-173.7	177.2	-178.8	0	114.4	R439 R445	R439-K441 PolarHBondContact O-N 2.84Å; K441-R445 PolarHBondContact O-N 2.86Å
442	S	50.9	Low	55.3	Low	68 Å²	68	71 Å²	71	48%	0.476	33%	0.334	S	S	.	.	H	α-helix	trans	-77.6	-43.9	177.7	52.1	0	0	0	0	113.2	M440 R445 S446	M440-S442 VanDerWaalsContact C-N 3.26Å; M440-S442 PolarHBondContact O-N 2.85Å; M440-S442 VanDerWaalsContact O-N 3.12Å; S442-R445 PolarHBondContact O-N 3.47Å; S442-S446 PolarHBondContact O-N 3.37Å
443	V	54.8	Low	53.3	Low	1 Å²	1	74.8 Å²	74.8	1%	0.006	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-45.3	175.9	-178.9	0	0	0	0	109.9	W426 C431 M440 R445 S446 A447	W426-V443 HydrophobicContact CB-CG2 4.27Å; W426-V443 HydrophobicContact CD2-CG2 4.26Å; W426-V443 HydrophobicContact CG-CG2 4.06Å; C431-V443 WeakPolarHBondContact SG-CG2 3.49Å; M440-V443 HydrophobicContact CG-CB 4.37Å; M440-V443 PolarHBondContact O-N 2.92Å; V443-R445 PolarHBondContact O-N 2.72Å; V443-S446 PolarHBondContact O-N 2.99Å; V443-S446 VanDerWaalsContact O-N 3.16Å; V443-A447 WeakPolarHBondContact O-CB 3.42Å; V443-A447 PolarHBondContact O-N 3.23Å
444	L	52	Low	51.2	Low	36 Å²	36	73.6 Å²	73.6	19%	0.188	35%	0.35	C	S	.	.	H	α-helix	trans	-55.5	-49.3	175.9	-75	168.2	0	0	0	111	M440 S446 M448 A482	M440-L444 HydrophobicContact CB-CD1 3.88Å; M440-L444 HydrophobicContact CB-CG 4.07Å; M440-L444 VanDerWaalsContact O-CB 3.26Å; M440-L444 WeakPolarHBondContact O-CB 3.32Å; M440-L444 WeakPolarHBondContact O-CD1 3.41Å; M440-L444 WeakPolarHBondContact O-CG 3.3Å; M440-L444 PolarHBondContact O-N 3.46Å; M440-L444 HydrophobicContact SD-CG 4.47Å; L444-S446 VanDerWaalsContact C-N 3.29Å; L444-S446 PolarHBondContact O-N 2.88Å; L444-M448 HydrophobicContact CB-CG 4.31Å; L444-M448 HydrophobicContact CB-SD 3.63Å; L444-M448 HydrophobicContact CD2-CE 3.62Å; L444-M448 HydrophobicContact CD2-CG 4.23Å; L444-M448 HydrophobicContact CD2-SD 3.82Å; L444-M448 HydrophobicContact CG-SD 4.26Å; L444-M448 WeakPolarHBondContact O-CA 3.28Å; L444-M448 WeakPolarHBondContact O-CB 3.45Å; L444-M448 WeakPolarHBondContact O-CG 3.36Å; L444-M448 PolarHBondContact O-N 3.15Å; L444-A482 HydrophobicContact CD2-CB 3.84Å
445	R	54.6	Low	49.2	Very low	201 Å²	201	72.2 Å²	72.2	76%	0.758	35%	0.348	S	S	*	.	H	α-helix	trans	-62.9	-31.4	179	-78.6	-176.9	-179.7	-176.9	0.3	114.6	K441 S442 V443 N449	K441-R445 PolarHBondContact O-N 2.86Å; S442-R445 PolarHBondContact O-N 3.47Å; V443-R445 PolarHBondContact O-N 2.72Å; R445-N449 PolarHBondContact O-ND2 3.14Å
446	S	53.6	Low	47.7	Very low	4 Å²	4	74 Å²	74	3%	0.028	36%	0.359	C	S	.	.	H	α-helix	trans	-81.7	-46.1	-178.6	-173.5	0	0	0	0	111.9	T348 W426 S442 V443 L444	T348-S446 WeakPolarHBondContact O-CA 3.4Å; T348-S446 VanDerWaalsContact O-CB 3.27Å; T348-S446 WeakPolarHBondContact O-CB 3.46Å; T348-S446 PolarHBondContact O-OG 3.46Å; W426-S446 WeakPolarHBondContact CZ2-OG 3.41Å; S442-S446 PolarHBondContact O-N 3.37Å; V443-S446 PolarHBondContact O-N 2.99Å; V443-S446 VanDerWaalsContact O-N 3.16Å; L444-S446 VanDerWaalsContact C-N 3.29Å; L444-S446 PolarHBondContact O-N 2.88Å
447	A	48.4	Very low	46.5	Very low	3 Å²	3	72.8 Å²	72.8	3%	0.025	36%	0.36	C	S	.	.	H	α-helix	trans	-77.1	-33.1	178.2	0	0	0	0	0	113	V443 N449 D450 Y485 Y489	V443-A447 WeakPolarHBondContact O-CB 3.42Å; V443-A447 PolarHBondContact O-N 3.23Å; A447-N449 VanDerWaalsContact C-N 3.31Å; A447-N449 PolarHBondContact O-N 2.99Å; A447-D450 CarbonylContact O-C 3.54Å; A447-D450 WeakPolarHBondContact O-CA 3.41Å; A447-D450 WeakPolarHBondContact O-CB 3.33Å; A447-D450 PolarHBondContact O-N 3.37Å; A447-Y485 HydrophobicContact CB-CD2 4.34Å; A447-Y485 HydrophobicContact CB-CG 4.21Å; A447-Y489 HydrophobicContact CB-CE2 4.46Å
448	M	44.4	Very low	45.9	Very low	50 Å²	50	74.7 Å²	74.7	25%	0.246	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.2	-179.7	-67.5	172	136.6	0	0	113.4	L444 D450 M453	L444-M448 HydrophobicContact CB-CG 4.31Å; L444-M448 HydrophobicContact CB-SD 3.63Å; L444-M448 HydrophobicContact CD2-CE 3.62Å; L444-M448 HydrophobicContact CD2-CG 4.23Å; L444-M448 HydrophobicContact CD2-SD 3.82Å; L444-M448 HydrophobicContact CG-SD 4.26Å; L444-M448 WeakPolarHBondContact O-CA 3.28Å; L444-M448 WeakPolarHBondContact O-CB 3.45Å; L444-M448 WeakPolarHBondContact O-CG 3.36Å; L444-M448 PolarHBondContact O-N 3.15Å; M448-D450 PolarHBondContact O-N 3.49Å; M448-M453 HydrophobicContact CB-CE 3.79Å; M448-M453 HydrophobicContact CB-SD 4.34Å; M448-M453 WeakPolarHBondContact O-CE 3.23Å
449	N	48.7	Very low	45.3	Very low	60 Å²	60	78 Å²	78	32%	0.321	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.9	167.5	-80.6	-26.7	0	0	0	111.5	R445 A447 F451	R445-N449 PolarHBondContact O-ND2 3.14Å; A447-N449 VanDerWaalsContact C-N 3.31Å; A447-N449 PolarHBondContact O-N 2.99Å; N449-F451 PolarHBondContact O-N 2.94Å
450	D	48	Very low	44.7	Very low	24 Å²	24	77.7 Å²	77.7	13%	0.128	37%	0.374	C	S	.	.	S	Bend	trans	-91.7	73.6	170.1	-63.7	-39.2	0	0	0	109.8	A447 M448 L452 Y485 Y489	A447-D450 CarbonylContact O-C 3.54Å; A447-D450 WeakPolarHBondContact O-CA 3.41Å; A447-D450 WeakPolarHBondContact O-CB 3.33Å; A447-D450 PolarHBondContact O-N 3.37Å; M448-D450 PolarHBondContact O-N 3.49Å; D450-L452 PolarHBondContact O-N 3.46Å; D450-Y485 HydrophobicContact CB-CE1 4.49Å; D450-Y485 PolarHBondContact O-OH 3.41Å; D450-Y489 PolarHBondContact OD2-OH 2.89Å
451	F	49.9	Very low	43.5	Very low	91 Å²	91	82.1 Å²	82.1	40%	0.399	40%	0.402	S	S	.	.	S	Bend	trans	66.3	-23.6	155.1	-69.1	-88.7	0	0	0	121.6	M1 R88 E92 N449 M453	M1-F451 HydrophobicContact SD-CE1 4.3Å; M1-F451 HydrophobicContact SD-CZ 3.94Å; R88-F451 PolarHBondContact NH2-O 3.33Å; E92-F451 VanDerWaalsContact OE1-O 3.14Å; E92-F451 VanDerWaalsContact OE2-O 3.05Å; N449-F451 PolarHBondContact O-N 2.94Å; F451-M453 PolarHBondContact O-N 2.65Å; F451-M453 VanDerWaalsContact O-N 3.17Å
452	L	45.4	Very low	42.4	Very low	24 Å²	24	82 Å²	82	13%	0.126	41%	0.409	C	S	.	.			trans	-81.5	94	169.5	-83.8	174.9	0	0	0	110.2	N89 E92 D450 Y481 Y485	N89-L452 HydrophobicContact CB-CD2 4.02Å; N89-L452 WeakPolarHBondContact OD1-CD2 3.32Å; E92-L452 HydrophobicContact CB-CD2 4.23Å; E92-L452 HydrophobicContact CB-CG 4.4Å; E92-L452 WeakPolarHBondContact OE2-CA 3.42Å; E92-L452 WeakPolarHBondContact OE2-CD2 3.35Å; E92-L452 WeakPolarHBondContact OE2-CG 3.34Å; E92-L452 PolarHBondContact OE2-N 3.11Å; D450-L452 PolarHBondContact O-N 3.46Å; L452-Y481 HydrophobicContact CD1-CD1 4.3Å; L452-Y485 HydrophobicContact CB-CE2 3.82Å; L452-Y485 WeakPolarHBondContact CB-OH 3.41Å; L452-Y485 HydrophobicContact CD1-CD2 4.16Å; L452-Y485 HydrophobicContact CD1-CE2 3.17Å; L452-Y485 WeakPolarHBondContact CD1-OH 3.35Å; L452-Y485 HydrophobicContact CG-CE2 3.81Å; L452-Y485 WeakPolarHBondContact CG-OH 3.18Å; L452-Y485 PolarHBondContact N-OH 3.43Å
453	M	42.9	Very low	41.3	Very low	84 Å²	84	86.6 Å²	86.6	41%	0.414	43%	0.428	S	S	.	.			trans	-118.2	148.1	175	-84.7	-73.7	-178.5	0	0	112.9	R88 M448 F451	R88-M453 PolarHBondContact NH1-O 3.32Å; R88-M453 PolarHBondContact NH2-O 3.31Å; M448-M453 HydrophobicContact CB-CE 3.79Å; M448-M453 HydrophobicContact CB-SD 4.34Å; M448-M453 WeakPolarHBondContact O-CE 3.23Å; F451-M453 PolarHBondContact O-N 2.65Å; F451-M453 VanDerWaalsContact O-N 3.17Å
454	D	41.5	Very low	40.1	Very low	97 Å²	97	93.8 Å²	93.8	52%	0.519	47%	0.466	S	S	.	.			trans	119.3	37.6	153.6	-134.7	17.7	0	0	0	118.6	T456	D454-T456 PolarHBondContact O-N 3.16Å; D454-T456 PolarHBondContact OD1-OG1 2.89Å
455	D	36.8	Very low	39.1	Very low	101 Å²	101	100.2 Å²	100.2	54%	0.54	50%	0.499	S	S	.	.			trans	-76.8	11.1	151.5	-85	-23.1	0	0	0	112.3	S457 Y458	D455-S457 PolarHBondContact O-N 3.4Å; D455-Y458 PolarHBondContact O-N 3.4Å
456	T	35	Very low	37.9	Very low	52 Å²	52	94.5 Å²	94.5	32%	0.319	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	0.2	179.3	20.5	0	0	0	0	114.8	D454 Y458 Y460	D454-T456 PolarHBondContact O-N 3.16Å; D454-T456 PolarHBondContact OD1-OG1 2.89Å; T456-Y458 PolarHBondContact O-N 3.47Å; T456-Y460 HydrophobicContact CG2-CD2 3.83Å; T456-Y460 HydrophobicContact CG2-CE2 3.7Å
457	S	33	Very low	36.7	Very low	90 Å²	90	97.9 Å²	97.9	63%	0.629	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-5.5	170.3	61.7	0	0	0	0	114.4	D455	D455-S457 PolarHBondContact O-N 3.4Å
458	Y	35.5	Very low	35.8	Very low	192 Å²	192	102.2 Å²	102.2	75%	0.753	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-9.1	176.2	-73.5	-79.1	0	0	0	115.3	D455 T456	D455-Y458 PolarHBondContact O-N 3.4Å; T456-Y458 PolarHBondContact O-N 3.47Å
459	L	31	Very low	35.1	Very low	104 Å²	104	103.3 Å²	103.3	55%	0.545	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.9	-0.8	-173.7	-74.6	168.1	0	0	0	115.3
460	Y	29.3	Very low	34.2	Very low	193 Å²	193	105.2 Å²	105.2	76%	0.757	63%	0.631	S	S	*	*	S	Bend	trans	-118.4	37.4	176.6	-76.6	-73.9	0	0	0	114.1	T456	T456-Y460 HydrophobicContact CG2-CD2 3.83Å; T456-Y460 HydrophobicContact CG2-CE2 3.7Å
461	T	27.2	Very low	33.3	Very low	103 Å²	103	112.2 Å²	112.2	63%	0.632	67%	0.669	S	S	*	*	S	Bend	trans	-114.6	114.6	154.5	57.4	0	0	0	0	108.2
462	N	27.1	Very low	32.3	Very low	145 Å²	145	111 Å²	111	78%	0.775	68%	0.682	S	S	*	*			trans	95.7	57.7	172.2	-48	-27.8	0	0	0	117.5
463	D	29	Very low	31.5	Very low	163 Å²	163	117.2 Å²	117.2	87%	0.872	72%	0.715	S	S	*	*			trans	-123.7	39	152.3	-102.4	-13.7	0	0	0	111.4
464	D	29	Very low	31	Very low	152 Å²	152	120.2 Å²	120.2	81%	0.813	73%	0.733	S	S	*	*	S	Bend	trans	-138.2	95.6	158.6	-90.9	-36.1	0	0	0	107.6
465	I	31.4	Very low	30.7	Very low	172 Å²	172	123.1 Å²	123.1	88%	0.882	75%	0.746	S	S	*	*	S	Bend	trans	157.8	115.5	147.2	-77.6	153.9	0	0	0	107.5
466	G	29.5	Very low	31	Very low	80 Å²	80	124.1 Å²	124.1	83%	0.825	75%	0.747	S	S	*	*			trans	-61.8	150.6	-178.8	0	0	0	0	0	114.5
467	G	27.9	Very low	31.5	Very low	76 Å²	76	125.7 Å²	125.7	78%	0.784	76%	0.76	S	S	*	*			trans	165.1	112.5	168.8	0	0	0	0	0	111.6
468	G	28.8	Very low	32.4	Very low	93 Å²	93	122 Å²	122	96%	0.959	73%	0.734	S	S	*	*			trans	-61.2	143.9	-179.5	0	0	0	0	0	113.8
469	G	29.8	Very low	34	Very low	74 Å²	74	114.3 Å²	114.3	76%	0.763	71%	0.708	S	S	*	*			trans	-171.8	90.5	172.1	0	0	0	0	0	110.1	N471	G469-N471 PolarHBondContact O-N 2.61Å; G469-N471 VanDerWaalsContact O-N 3.16Å
470	A	31	Very low	36.2	Very low	100 Å²	100	110.1 Å²	110.1	83%	0.826	69%	0.687	S	S	*	*			trans	-68.7	102.9	164.7	0	0	0	0	0	108.2
471	N	27.7	Very low	38.5	Very low	171 Å²	171	103.2 Å²	103.2	91%	0.914	66%	0.66	S	S	*	*			trans	169.6	107.1	151.6	-88.6	-17	0	0	0	109.6	G469	G469-N471 PolarHBondContact O-N 2.61Å; G469-N471 VanDerWaalsContact O-N 3.16Å
472	G	30	Very low	40.8	Very low	66 Å²	66	98.5 Å²	98.5	68%	0.68	63%	0.631	S	S	*	*			trans	179.3	79.7	175.7	0	0	0	0	0	111	D474	G472-D474 PolarHBondContact O-N 3.16Å; G472-D474 VanDerWaalsContact O-N 3.11Å
473	N	28.6	Very low	43.4	Very low	154 Å²	154	91.9 Å²	91.9	82%	0.824	60%	0.596	S	S	*	*			trans	-78.8	65.6	171.3	-87.8	-19.5	0	0	0	110.1	M475	N473-M475 PolarHBondContact O-N 3.37Å; N473-M475 VanDerWaalsContact O-N 3.15Å
474	D	33.2	Very low	46.2	Very low	147 Å²	147	84.3 Å²	84.3	79%	0.786	56%	0.555	S	S	*	*			trans	-84.9	89.4	168.9	-71.2	-26.7	0	0	0	108.7	G472 E476	G472-D474 PolarHBondContact O-N 3.16Å; G472-D474 VanDerWaalsContact O-N 3.11Å; D474-E476 VanDerWaalsContact C-N 3.25Å; D474-E476 PolarHBondContact O-N 3.49Å
475	M	35	Very low	48.9	Very low	158 Å²	158	77.9 Å²	77.9	78%	0.778	52%	0.52	S	S	*	.			trans	-67.3	83.3	164.5	-76.5	-75.8	-165.7	0	0	108.4	N473 S477	N473-M475 PolarHBondContact O-N 3.37Å; N473-M475 VanDerWaalsContact O-N 3.15Å; M475-S477 PolarHBondContact O-N 3.05Å
476	E	42.9	Very low	51.6	Low	121 Å²	121	69.8 Å²	69.8	57%	0.565	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-66.9	117.8	170.3	-74.3	176.5	155.5	0	0	109.3	D474	D474-E476 VanDerWaalsContact C-N 3.25Å; D474-E476 PolarHBondContact O-N 3.49Å
477	S	45.2	Very low	54.6	Low	85 Å²	85	66 Å²	66	59%	0.594	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-58.6	149.8	174.1	44.1	0	0	0	0	111.3	M475 S479	M475-S477 PolarHBondContact O-N 3.05Å; S477-S479 PolarHBondContact O-N 3.23Å
478	P	52.1	Low	57.7	Low	12 Å²	12	62.3 Å²	62.3	8%	0.078	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-56.7	130.2	175.8	22.5	-32.7	0	0	0	111	M440 V480 I483	M440-P478 HydrophobicContact CB-CB 4.37Å; M440-P478 HydrophobicContact CE-CB 3.36Å; M440-P478 HydrophobicContact CG-CB 3.74Å; M440-P478 WeakPolarHBondContact SD-CA 3.24Å; M440-P478 HydrophobicContact SD-CB 3.21Å; M440-P478 WeakPolarHBondContact SD-CB 3.48Å; P478-V480 PolarHBondContact O-N 3.35Å; P478-I483 HydrophobicContact CB-CD1 4.49Å; P478-I483 HydrophobicContact CG-CD1 4.37Å
479	S	69.2	Low	60.7	Low	31 Å²	31	58.1 Å²	58.1	22%	0.217	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-60.2	127.6	170.7	176.5	0	0	0	0	108.8	S477 Y481 A482 I483	S477-S479 PolarHBondContact O-N 3.23Å; S479-Y481 PolarHBondContact O-N 3.47Å; S479-A482 PolarHBondContact O-N 3.35Å; S479-I483 PolarHBondContact O-N 3.44Å
480	V	76.5	Confident	63.7	Low	17 Å²	17	54.6 Å²	54.6	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-51.5	-33.9	-178.8	67.6	0	0	0	0	112	P478 A482 I483 I484 L514 Y517 V545	P478-V480 PolarHBondContact O-N 3.35Å; V480-A482 VanDerWaalsContact C-N 3.34Å; V480-A482 PolarHBondContact O-N 3.31Å; V480-I483 WeakPolarHBondContact O-CB 3.49Å; V480-I483 PolarHBondContact O-N 3.18Å; V480-I483 VanDerWaalsContact O-N 3.1Å; V480-I484 WeakPolarHBondContact O-CG1 3.41Å; V480-I484 PolarHBondContact O-N 2.94Å; V480-L514 HydrophobicContact CG2-CD1 3.84Å; V480-Y517 HydrophobicContact CB-CG 4.4Å; V480-Y517 HydrophobicContact CG2-CD2 4.42Å; V480-Y517 HydrophobicContact CG2-CG 4.17Å; V480-V545 HydrophobicContact CG2-CG2 4.08Å
481	Y	76.9	Confident	66.7	Low	47 Å²	47	49.9 Å²	49.9	18%	0.184	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-36	179	-61.7	-70	0	0	0	113.4	N89 L452 S479 I483 I484 Y485 V544	N89-Y481 HydrophobicContact CB-CE1 4.25Å; N89-Y481 WeakPolarHBondContact ND2-CE1 3.46Å; N89-Y481 PolarHBondContact ND2-OH 2.89Å; L452-Y481 HydrophobicContact CD1-CD1 4.3Å; S479-Y481 PolarHBondContact O-N 3.47Å; Y481-I483 VanDerWaalsContact C-N 3.33Å; Y481-I484 HydrophobicContact CD1-CD1 4.47Å; Y481-I484 WeakPolarHBondContact O-CB 3.32Å; Y481-I484 PolarHBondContact O-N 2.69Å; Y481-Y485 VanDerWaalsContact O-CD2 3.28Å; Y481-Y485 WeakPolarHBondContact O-CD2 3.36Å; Y481-Y485 PolarHBondContact O-N 3.43Å; Y481-V544 HydrophobicContact CD1-CG1 4.24Å; Y481-V544 HydrophobicContact CE1-CB 4.11Å; Y481-V544 HydrophobicContact CE1-CG1 3.96Å; Y481-V544 HydrophobicContact CE1-CG2 4.11Å
482	A	75.8	Confident	69.9	Low	4 Å²	4	41.9 Å²	41.9	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-72	-29.8	175.5	0	0	0	0	0	111.8	M440 L444 S479 V480 I484 Y485 C486	M440-A482 HydrophobicContact CE-CB 3.42Å; M440-A482 VanDerWaalsContact CE-CB 3.42Å; M440-A482 HydrophobicContact SD-CB 3.28Å; M440-A482 WeakPolarHBondContact SD-CB 3.33Å; L444-A482 HydrophobicContact CD2-CB 3.84Å; S479-A482 PolarHBondContact O-N 3.35Å; V480-A482 VanDerWaalsContact C-N 3.34Å; V480-A482 PolarHBondContact O-N 3.31Å; A482-I484 VanDerWaalsContact C-N 3.33Å; A482-Y485 PolarHBondContact O-N 3.14Å; A482-C486 PolarHBondContact O-N 3.21Å; A482-C486 PolarHBondContact O-SG 2.88Å
483	I	82.5	Confident	73	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-44.1	169.1	-57.1	178.8	0	0	0	109.4	L432 M440 P478 S479 V480 Y481 Y485 C486 I487 V510	L432-I483 HydrophobicContact CD2-CG2 3.81Å; M440-I483 HydrophobicContact CE-CG1 3.74Å; P478-I483 HydrophobicContact CB-CD1 4.49Å; P478-I483 HydrophobicContact CG-CD1 4.37Å; S479-I483 PolarHBondContact O-N 3.44Å; V480-I483 WeakPolarHBondContact O-CB 3.49Å; V480-I483 PolarHBondContact O-N 3.18Å; V480-I483 VanDerWaalsContact O-N 3.1Å; Y481-I483 VanDerWaalsContact C-N 3.33Å; I483-Y485 PolarHBondContact O-N 3.29Å; I483-C486 WeakPolarHBondContact O-CB 3.36Å; I483-C486 PolarHBondContact O-N 3.46Å; I483-C486 VanDerWaalsContact O-N 3.15Å; I483-I487 HydrophobicContact CG2-CD1 4.19Å; I483-I487 HydrophobicContact CG2-CG1 4.48Å; I483-I487 WeakPolarHBondContact O-CG1 3.45Å; I483-I487 PolarHBondContact O-N 2.89Å; I483-V510 HydrophobicContact CG2-CG1 4.01Å
484	I	87.6	Confident	76.1	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-45.5	178.1	-65.1	172.2	0	0	0	111.3	M93 V480 Y481 A482 C486 I487 F488 V544 V545 T548	M93-I484 HydrophobicContact SD-CG2 3.95Å; V480-I484 WeakPolarHBondContact O-CG1 3.41Å; V480-I484 PolarHBondContact O-N 2.94Å; Y481-I484 HydrophobicContact CD1-CD1 4.47Å; Y481-I484 WeakPolarHBondContact O-CB 3.32Å; Y481-I484 PolarHBondContact O-N 2.69Å; A482-I484 VanDerWaalsContact C-N 3.33Å; I484-C486 PolarHBondContact O-N 3.34Å; I484-I487 WeakPolarHBondContact O-CB 3.24Å; I484-I487 PolarHBondContact O-N 2.91Å; I484-I487 VanDerWaalsContact O-N 3.15Å; I484-F488 HydrophobicContact CG2-CD2 3.96Å; I484-F488 HydrophobicContact CG2-CE2 3.93Å; I484-F488 WeakPolarHBondContact O-CD2 3.37Å; I484-F488 PolarHBondContact O-N 3.04Å; I484-V544 HydrophobicContact CD1-CG1 3.84Å; I484-V545 HydrophobicContact CD1-CG2 4.41Å; I484-T548 HydrophobicContact CG1-CG2 4.34Å; I484-T548 HydrophobicContact CG2-CG2 4.17Å
485	Y	84.8	Confident	79	Confident	17 Å²	17	25.4 Å²	25.4	7%	0.067	13%	0.134	C	C	.	.	H	α-helix	trans	-60.2	-44.8	173.3	-83.2	-77.5	0	0	0	113	L96 A447 D450 L452 Y481 A482 I483 I487 F488 Y489	L96-Y485 HydrophobicContact CD2-CD1 4.1Å; L96-Y485 HydrophobicContact CD2-CE1 4.13Å; A447-Y485 HydrophobicContact CB-CD2 4.34Å; A447-Y485 HydrophobicContact CB-CG 4.21Å; D450-Y485 HydrophobicContact CB-CE1 4.49Å; D450-Y485 PolarHBondContact O-OH 3.41Å; L452-Y485 HydrophobicContact CB-CE2 3.82Å; L452-Y485 WeakPolarHBondContact CB-OH 3.41Å; L452-Y485 HydrophobicContact CD1-CD2 4.16Å; L452-Y485 HydrophobicContact CD1-CE2 3.17Å; L452-Y485 WeakPolarHBondContact CD1-OH 3.35Å; L452-Y485 HydrophobicContact CG-CE2 3.81Å; L452-Y485 WeakPolarHBondContact CG-OH 3.18Å; L452-Y485 PolarHBondContact N-OH 3.43Å; Y481-Y485 VanDerWaalsContact O-CD2 3.28Å; Y481-Y485 WeakPolarHBondContact O-CD2 3.36Å; Y481-Y485 PolarHBondContact O-N 3.43Å; A482-Y485 PolarHBondContact O-N 3.14Å; I483-Y485 PolarHBondContact O-N 3.29Å; Y485-I487 PolarHBondContact O-N 3.06Å; Y485-F488 PolarHBondContact O-N 3.16Å; Y485-F488 VanDerWaalsContact O-N 3.13Å; Y485-Y489 HydrophobicContact CD1-CE1 4.45Å; Y485-Y489 HydrophobicContact CD1-CE2 4.15Å; Y485-Y489 AromaticContact CD1-CZ 3.81Å; Y485-Y489 WeakPolarHBondContact O-CD2 3.48Å; Y485-Y489 PolarHBondContact O-N 2.89Å
486	C	88	Confident	81.8	Confident	2 Å²	2	18.2 Å²	18.2	1%	0.014	10%	0.099	C	C	.	.	H	α-helix	trans	-59.8	-36.1	176.4	-69	0	0	0	0	111.4	C431 L432 A482 I483 I484 A490	C431-C486 HydrophobicContact CB-CB 4.33Å; L432-C486 HydrophobicContact CD2-CB 3.89Å; L432-C486 HydrophobicContact CG-CB 4.08Å; A482-C486 PolarHBondContact O-N 3.21Å; A482-C486 PolarHBondContact O-SG 2.88Å; I483-C486 WeakPolarHBondContact O-CB 3.36Å; I483-C486 PolarHBondContact O-N 3.46Å; I483-C486 VanDerWaalsContact O-N 3.15Å; I484-C486 PolarHBondContact O-N 3.34Å; C486-A490 WeakPolarHBondContact O-CB 3.41Å; C486-A490 PolarHBondContact O-N 3.43Å
487	I	92.3	Very high	84.1	Confident	0 Å²	0	15 Å²	15	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.7	-51.3	172.7	-70.1	170.1	0	0	0	110.3	L432 I483 I484 Y485 A490 V491 L507 L514 T548 L552	L432-I487 HydrophobicContact CD1-CG1 4.27Å; L432-I487 HydrophobicContact CD2-CG1 3.81Å; I483-I487 HydrophobicContact CG2-CD1 4.19Å; I483-I487 HydrophobicContact CG2-CG1 4.48Å; I483-I487 WeakPolarHBondContact O-CG1 3.45Å; I483-I487 PolarHBondContact O-N 2.89Å; I484-I487 WeakPolarHBondContact O-CB 3.24Å; I484-I487 PolarHBondContact O-N 2.91Å; I484-I487 VanDerWaalsContact O-N 3.15Å; Y485-I487 PolarHBondContact O-N 3.06Å; I487-A490 PolarHBondContact O-N 3.28Å; I487-V491 VanDerWaalsContact O-CG2 3.3Å; I487-V491 WeakPolarHBondContact O-CG2 3.4Å; I487-V491 PolarHBondContact O-N 2.89Å; I487-L507 HydrophobicContact CG1-CD2 3.93Å; I487-L507 HydrophobicContact CG2-CD2 4.18Å; I487-L514 HydrophobicContact CD1-CD2 4.04Å; I487-T548 HydrophobicContact CD1-CG2 4.31Å; I487-L552 HydrophobicContact CD1-CD1 4.45Å; I487-L552 HydrophobicContact CG2-CD1 3.96Å; I487-L552 HydrophobicContact CG2-CD2 3.7Å; I487-L552 HydrophobicContact CG2-CG 4.13Å
488	F	93.2	Very high	86.2	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-64.6	-43.8	-179	-84.6	-79.4	0	0	0	113.4	M93 L96 E97 T100 I484 Y485 A490 V491 Q492 T548 F551	M93-F488 HydrophobicContact CE-CE2 3.41Å; M93-F488 VanDerWaalsContact CE-CE2 3.41Å; M93-F488 HydrophobicContact CE-CZ 3.27Å; M93-F488 HydrophobicContact SD-CE2 3.48Å; M93-F488 WeakPolarHBondContact SD-CE2 3.35Å; M93-F488 HydrophobicContact SD-CZ 3.9Å; L96-F488 HydrophobicContact CD1-CB 4.27Å; L96-F488 HydrophobicContact CD1-CG 4.36Å; L96-F488 HydrophobicContact CD2-CB 3.78Å; L96-F488 HydrophobicContact CD2-CD1 4.17Å; L96-F488 HydrophobicContact CD2-CD2 3.22Å; L96-F488 HydrophobicContact CD2-CE2 3.81Å; L96-F488 HydrophobicContact CD2-CG 3.43Å; L96-F488 VanDerWaalsContact CD2-CG 3.43Å; L96-F488 HydrophobicContact CD2-CZ 4.47Å; L96-F488 HydrophobicContact CG-CB 3.99Å; L96-F488 HydrophobicContact CG-CD1 3.81Å; L96-F488 HydrophobicContact CG-CD2 3.81Å; L96-F488 HydrophobicContact CG-CE1 4.22Å; L96-F488 HydrophobicContact CG-CE2 4.24Å; L96-F488 HydrophobicContact CG-CG 3.57Å; L96-F488 HydrophobicContact CG-CZ 4.42Å; E97-F488 HydrophobicContact CB-CE1 4.23Å; E97-F488 HydrophobicContact CB-CZ 4.18Å; T100-F488 HydrophobicContact CG2-CD1 4.25Å; T100-F488 VanDerWaalsContact OG1-CD1 3.29Å; T100-F488 WeakPolarHBondContact OG1-CD1 3.43Å; I484-F488 HydrophobicContact CG2-CD2 3.96Å; I484-F488 HydrophobicContact CG2-CE2 3.93Å; I484-F488 WeakPolarHBondContact O-CD2 3.37Å; I484-F488 PolarHBondContact O-N 3.04Å; Y485-F488 PolarHBondContact O-N 3.16Å; Y485-F488 VanDerWaalsContact O-N 3.13Å; F488-A490 VanDerWaalsContact C-N 3.31Å; F488-A490 PolarHBondContact O-N 3.38Å; F488-V491 PolarHBondContact O-N 2.93Å; F488-Q492 WeakPolarHBondContact O-CB 3.5Å; F488-Q492 WeakPolarHBondContact O-CG 3.49Å; F488-Q492 PolarHBondContact O-N 3.2Å; F488-T548 HydrophobicContact CE2-CG2 4.37Å; F488-F551 HydrophobicContact CD1-CD1 4.34Å; F488-F551 AromaticContact CD1-CE1 3.81Å; F488-F551 HydrophobicContact CD1-CE1 3.81Å; F488-F551 HydrophobicContact CD1-CZ 4.14Å; F488-F551 AromaticContact CE1-CD1 3.47Å; F488-F551 HydrophobicContact CE1-CD1 3.47Å; F488-F551 VanDerWaalsContact CE1-CD1 3.47Å; F488-F551 HydrophobicContact CE1-CD2 4.24Å; F488-F551 AromaticContact CE1-CE1 3.3Å; F488-F551 HydrophobicContact CE1-CE1 3.3Å; F488-F551 HydrophobicContact CE1-CE2 4.11Å; F488-F551 AromaticContact CE1-CG 3.94Å; F488-F551 HydrophobicContact CE1-CG 3.94Å; F488-F551 AromaticContact CE1-CZ 3.65Å; F488-F551 HydrophobicContact CE1-CZ 3.65Å; F488-F551 HydrophobicContact CE2-CD1 4.35Å; F488-F551 HydrophobicContact CZ-CB 4.43Å; F488-F551 AromaticContact CZ-CD1 3.47Å; F488-F551 HydrophobicContact CZ-CD1 3.47Å; F488-F551 VanDerWaalsContact CZ-CD1 3.47Å; F488-F551 AromaticContact CZ-CE1 3.8Å; F488-F551 HydrophobicContact CZ-CE1 3.8Å; F488-F551 AromaticContact CZ-CG 3.89Å; F488-F551 HydrophobicContact CZ-CG 3.89Å; F488-F551 HydrophobicContact CZ-CZ 4.48Å
489	Y	91.8	Very high	87.9	Confident	5 Å²	5	19.7 Å²	19.7	2%	0.02	10%	0.098	C	C	.	.	H	α-helix	trans	-64.4	-37.8	175.8	-62.6	-29	0	0	0	111.8	W350 W426 A447 D450 Y485 Q492 Q493	W350-Y489 HydrophobicContact CB-CD2 4.14Å; W350-Y489 HydrophobicContact CB-CE2 4.02Å; W350-Y489 HydrophobicContact CB-CG 4.44Å; W350-Y489 AromaticContact CD2-CD1 3.95Å; W350-Y489 HydrophobicContact CD2-CD1 3.95Å; W350-Y489 HydrophobicContact CD2-CE1 4.44Å; W350-Y489 HydrophobicContact CD2-CG 4.07Å; W350-Y489 AromaticContact CE3-CD1 3.79Å; W350-Y489 HydrophobicContact CE3-CD1 3.79Å; W350-Y489 HydrophobicContact CE3-CE1 4.05Å; W350-Y489 HydrophobicContact CE3-CG 4.38Å; W350-Y489 HydrophobicContact CG-CD1 4.32Å; W350-Y489 HydrophobicContact CG-CD2 4.2Å; W350-Y489 HydrophobicContact CG-CG 4.09Å; W350-Y489 HydrophobicContact CZ3-CD1 4.29Å; W426-Y489 AromaticContact CH2-CD2 3.95Å; W426-Y489 HydrophobicContact CH2-CD2 3.95Å; W426-Y489 HydrophobicContact CH2-CE2 4.28Å; W426-Y489 HydrophobicContact CZ3-CD2 4.49Å; A447-Y489 HydrophobicContact CB-CE2 4.46Å; D450-Y489 PolarHBondContact OD2-OH 2.89Å; Y485-Y489 HydrophobicContact CD1-CE1 4.45Å; Y485-Y489 HydrophobicContact CD1-CE2 4.15Å; Y485-Y489 AromaticContact CD1-CZ 3.81Å; Y485-Y489 WeakPolarHBondContact O-CD2 3.48Å; Y485-Y489 PolarHBondContact O-N 2.89Å; Y489-Q492 PolarHBondContact O-N 2.98Å; Y489-Q493 VanDerWaalsContact O-CB 3.3Å; Y489-Q493 WeakPolarHBondContact O-CB 3.48Å; Y489-Q493 PolarHBondContact O-N 3.33Å
490	A	93	Very high	88.9	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-42.9	173.7	0	0	0	0	0	111.3	A428 I429 L432 C486 I487 F488 Q492 Q493 T494 F503	A428-A490 HydrophobicContact CB-CB 3.98Å; I429-A490 HydrophobicContact CG1-CB 3.97Å; L432-A490 HydrophobicContact CD1-CB 3.96Å; C486-A490 WeakPolarHBondContact O-CB 3.41Å; C486-A490 PolarHBondContact O-N 3.43Å; I487-A490 PolarHBondContact O-N 3.28Å; F488-A490 VanDerWaalsContact C-N 3.31Å; F488-A490 PolarHBondContact O-N 3.38Å; A490-Q492 PolarHBondContact O-N 3.46Å; A490-Q493 PolarHBondContact O-N 2.96Å; A490-T494 WeakPolarHBondContact O-CB 3.44Å; A490-T494 PolarHBondContact O-N 3.27Å; A490-T494 PolarHBondContact O-OG1 2.67Å; A490-T494 VanDerWaalsContact O-OG1 3.06Å; A490-F503 HydrophobicContact CB-CD2 3.88Å; A490-F503 HydrophobicContact CB-CE2 3.63Å
491	V	95.3	Very high	89.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58	-49.1	174.1	168.1	0	0	0	0	111.2	T100 I487 F488 Q493 T494 I495 F503 F551 L552 F555	T100-V491 HydrophobicContact CG2-CG1 3.94Å; I487-V491 VanDerWaalsContact O-CG2 3.3Å; I487-V491 WeakPolarHBondContact O-CG2 3.4Å; I487-V491 PolarHBondContact O-N 2.89Å; F488-V491 PolarHBondContact O-N 2.93Å; V491-Q493 PolarHBondContact O-N 3.15Å; V491-T494 PolarHBondContact O-N 3.07Å; V491-I495 WeakPolarHBondContact O-CB 3.48Å; V491-I495 PolarHBondContact O-N 2.89Å; V491-F503 HydrophobicContact CB-CZ 4.4Å; V491-F503 HydrophobicContact CG2-CE2 4.11Å; V491-F503 HydrophobicContact CG2-CZ 3.52Å; V491-F551 HydrophobicContact CG1-CE1 4.35Å; V491-F551 HydrophobicContact CG1-CZ 4Å; V491-F551 HydrophobicContact CG2-CE1 4.12Å; V491-L552 HydrophobicContact CG2-CD2 4.17Å; V491-F555 HydrophobicContact CB-CE1 4.42Å; V491-F555 HydrophobicContact CB-CZ 4.49Å; V491-F555 HydrophobicContact CG1-CD1 4.31Å; V491-F555 HydrophobicContact CG1-CD2 4.28Å; V491-F555 HydrophobicContact CG1-CE1 3.85Å; V491-F555 HydrophobicContact CG1-CE2 3.84Å; V491-F555 HydrophobicContact CG1-CG 4.5Å; V491-F555 HydrophobicContact CG1-CZ 3.58Å; V491-F555 HydrophobicContact CG2-CD1 4.19Å; V491-F555 HydrophobicContact CG2-CE1 3.92Å; V491-F555 HydrophobicContact CG2-CZ 4.47Å
492	Q	94.7	Very high	89.9	Confident	3 Å²	3	23.3 Å²	23.3	1%	0.014	12%	0.12	C	C	.	.	H	α-helix	trans	-63.7	-40.9	-179.1	-68	159.5	8.4	0	0	111.7	T100 L103 W156 W350 F488 Y489 A490 I495 M496	T100-Q492 HydrophobicContact CG2-CG 3.96Å; T100-Q492 PolarHBondContact OG1-NE2 2.85Å; L103-Q492 HydrophobicContact CD2-CB 4.13Å; L103-Q492 HydrophobicContact CD2-CG 4.09Å; W156-Q492 HydrophobicContact CH2-CG 4.13Å; W350-Q492 HydrophobicContact CH2-CB 4.03Å; F488-Q492 WeakPolarHBondContact O-CB 3.5Å; F488-Q492 WeakPolarHBondContact O-CG 3.49Å; F488-Q492 PolarHBondContact O-N 3.2Å; Y489-Q492 PolarHBondContact O-N 2.98Å; A490-Q492 PolarHBondContact O-N 3.46Å; Q492-I495 WeakPolarHBondContact O-CG2 3.27Å; Q492-M496 VanDerWaalsContact O-CG 3.26Å; Q492-M496 WeakPolarHBondContact O-CG 3.49Å
493	Q	94.4	Very high	90.6	Very high	16 Å²	16	23.2 Å²	23.2	8%	0.075	12%	0.119	C	C	.	.	H	α-helix	trans	-68.6	-47	175.3	177.2	176.5	-7.4	0	0	111.8	F417 Y489 A490 V491 I495 M496 L497	F417-Q493 HydrophobicContact CB-CG 4.29Å; F417-Q493 HydrophobicContact CD1-CB 4.32Å; F417-Q493 HydrophobicContact CD1-CG 3.85Å; F417-Q493 HydrophobicContact CD2-CG 3.96Å; F417-Q493 HydrophobicContact CE1-CB 4.19Å; F417-Q493 HydrophobicContact CE1-CG 4.12Å; F417-Q493 HydrophobicContact CE2-CG 4.2Å; F417-Q493 HydrophobicContact CG-CG 3.76Å; F417-Q493 HydrophobicContact CZ-CB 4.39Å; F417-Q493 HydrophobicContact CZ-CG 4.28Å; Y489-Q493 VanDerWaalsContact O-CB 3.3Å; Y489-Q493 WeakPolarHBondContact O-CB 3.48Å; Y489-Q493 PolarHBondContact O-N 3.33Å; A490-Q493 PolarHBondContact O-N 2.96Å; V491-Q493 PolarHBondContact O-N 3.15Å; Q493-I495 VanDerWaalsContact C-N 3.33Å; Q493-I495 PolarHBondContact O-N 3.16Å; Q493-M496 WeakPolarHBondContact O-CB 3.48Å; Q493-M496 PolarHBondContact O-N 2.87Å; Q493-L497 HydrophobicContact CG-CD1 3.91Å; Q493-L497 WeakPolarHBondContact O-CG 3.19Å; Q493-L497 PolarHBondContact O-N 3.43Å
494	T	93.4	Very high	91.1	Very high	4 Å²	4	23 Å²	23	3%	0.025	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-39.8	-177.1	-74	0	0	0	0	111.6	A490 V491 M496 L497 K498 N499 Y500 F503	A490-T494 WeakPolarHBondContact O-CB 3.44Å; A490-T494 PolarHBondContact O-N 3.27Å; A490-T494 PolarHBondContact O-OG1 2.67Å; A490-T494 VanDerWaalsContact O-OG1 3.06Å; V491-T494 PolarHBondContact O-N 3.07Å; T494-M496 VanDerWaalsContact C-N 3.27Å; T494-M496 PolarHBondContact O-N 3.32Å; T494-L497 PolarHBondContact O-N 3.08Å; T494-K498 PolarHBondContact O-N 3.43Å; T494-N499 VanDerWaalsContact CG2-O 3.24Å; T494-N499 WeakPolarHBondContact CG2-O 3.22Å; T494-Y500 HydrophobicContact CG2-CD1 3.5Å; T494-Y500 VanDerWaalsContact CG2-CD1 3.5Å; T494-Y500 HydrophobicContact CG2-CE1 3.94Å; T494-F503 HydrophobicContact CG2-CB 4.01Å; T494-F503 HydrophobicContact CG2-CD1 3.75Å; T494-F503 HydrophobicContact CG2-CE1 4.38Å; T494-F503 HydrophobicContact CG2-CG 3.82Å; T494-F503 WeakPolarHBondContact OG1-CB 3.34Å; T494-F503 WeakPolarHBondContact OG1-CD2 3.49Å; T494-F503 WeakPolarHBondContact OG1-CG 3.43Å
495	I	93.4	Very high	91.2	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-67.3	-32.2	180	-148.1	169	0	0	0	112.4	I104 I107 Y108 R111 V491 Q492 Q493 F555	I104-I495 HydrophobicContact CB-CD1 4Å; I104-I495 HydrophobicContact CD1-CD1 3.94Å; I104-I495 HydrophobicContact CG1-CD1 3.46Å; I104-I495 VanDerWaalsContact CG1-CD1 3.46Å; I104-I495 HydrophobicContact CG2-CD1 3.79Å; I107-I495 HydrophobicContact CD1-CG2 3.75Å; Y108-I495 HydrophobicContact CD2-CD1 4.29Å; Y108-I495 HydrophobicContact CE2-CD1 3.66Å; Y108-I495 HydrophobicContact CE2-CG1 3.88Å; R111-I495 PolarHBondContact NH1-O 3.41Å; R111-I495 PolarHBondContact NH2-O 3.1Å; V491-I495 WeakPolarHBondContact O-CB 3.48Å; V491-I495 PolarHBondContact O-N 2.89Å; Q492-I495 WeakPolarHBondContact O-CG2 3.27Å; Q493-I495 VanDerWaalsContact C-N 3.33Å; Q493-I495 PolarHBondContact O-N 3.16Å; I495-F555 HydrophobicContact CD1-CE2 3.83Å; I495-F555 HydrophobicContact CD1-CZ 4.45Å
496	M	94	Very high	91.5	Very high	7 Å²	7	27 Å²	27	3%	0.034	14%	0.14	C	C	.	.	H	α-helix	trans	-69.1	-40.1	172.9	-68	-58.7	-52.5	0	0	111.8	I107 E149 L153 L413 F417 Q492 Q493 T494	I107-M496 HydrophobicContact CD1-CG 4.46Å; I107-M496 HydrophobicContact CD1-SD 3.3Å; I107-M496 WeakPolarHBondContact CD1-SD 3.49Å; I107-M496 HydrophobicContact CG1-SD 4.1Å; E149-M496 HydrophobicContact CB-CE 3.89Å; E149-M496 WeakPolarHBondContact O-CE 3.41Å; L153-M496 HydrophobicContact CB-CE 3.98Å; L153-M496 HydrophobicContact CB-SD 4.11Å; L153-M496 HydrophobicContact CD1-CG 4.33Å; L153-M496 HydrophobicContact CD1-SD 4.26Å; L153-M496 HydrophobicContact CD2-CE 4.23Å; L153-M496 HydrophobicContact CD2-CG 4.15Å; L153-M496 HydrophobicContact CD2-SD 4.35Å; L153-M496 HydrophobicContact CG-SD 4.48Å; L413-M496 HydrophobicContact CD2-CB 4Å; L413-M496 HydrophobicContact CD2-CE 3.48Å; L413-M496 VanDerWaalsContact CD2-CE 3.48Å; F417-M496 HydrophobicContact CE2-CB 3.97Å; F417-M496 HydrophobicContact CE2-CG 4.5Å; F417-M496 HydrophobicContact CZ-CB 4.18Å; F417-M496 HydrophobicContact CZ-CG 4.23Å; Q492-M496 VanDerWaalsContact O-CG 3.26Å; Q492-M496 WeakPolarHBondContact O-CG 3.49Å; Q493-M496 WeakPolarHBondContact O-CB 3.48Å; Q493-M496 PolarHBondContact O-N 2.87Å; T494-M496 VanDerWaalsContact C-N 3.27Å; T494-M496 PolarHBondContact O-N 3.32Å
497	L	92.5	Very high	91.7	Very high	55 Å²	55	26.9 Å²	26.9	29%	0.288	14%	0.14	S	C	.	.	H	α-helix	trans	-88.8	-11.9	-175.4	-63.2	-179.8	0	0	0	114.7	L413 F417 Q493 T494 N499	L413-L497 HydrophobicContact CG-CD2 4.39Å; F417-L497 HydrophobicContact CD2-CD1 3.91Å; F417-L497 HydrophobicContact CD2-CD2 3.94Å; F417-L497 HydrophobicContact CD2-CG 3.97Å; F417-L497 HydrophobicContact CE2-CD2 4.18Å; F417-L497 HydrophobicContact CE2-CG 4.13Å; Q493-L497 HydrophobicContact CG-CD1 3.91Å; Q493-L497 WeakPolarHBondContact O-CG 3.19Å; Q493-L497 PolarHBondContact O-N 3.43Å; T494-L497 PolarHBondContact O-N 3.08Å; L497-N499 PolarHBondContact O-N 2.93Å
498	K	88.6	Confident	91.6	Very high	105 Å²	105	27.1 Å²	27.1	46%	0.457	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	31.7	-175	-58.6	-176.5	177	-175.7	0	114	R111 T494	R111-K498 VanDerWaalsContact NH2-CE 3.29Å; T494-K498 PolarHBondContact O-N 3.43Å
499	N	87.3	Confident	91.4	Very high	90 Å²	90	31 Å²	31	48%	0.481	16%	0.163	S	C	.	.			trans	-110.5	93.5	177.4	-173.1	-11.2	0	0	0	110.4	T494 L497	T494-N499 VanDerWaalsContact CG2-O 3.24Å; T494-N499 WeakPolarHBondContact CG2-O 3.22Å; L497-N499 PolarHBondContact O-N 2.93Å
500	Y	90.3	Very high	91.3	Very high	22 Å²	22	31 Å²	31	9%	0.086	16%	0.163	C	C	.	.			trans	-92.1	-29	-170.3	-53.8	-59.8	0	0	0	114.1	Y108 T494 F503 L504 L559 D563	Y108-Y500 PolarHBondContact OH-OH 3.26Å; Y108-Y500 VanDerWaalsContact OH-OH 3.13Å; T494-Y500 HydrophobicContact CG2-CD1 3.5Å; T494-Y500 VanDerWaalsContact CG2-CD1 3.5Å; T494-Y500 HydrophobicContact CG2-CE1 3.94Å; Y500-F503 PolarHBondContact O-N 3.42Å; Y500-L504 WeakPolarHBondContact O-CB 3.48Å; Y500-L504 VanDerWaalsContact O-CG 3.29Å; Y500-L504 WeakPolarHBondContact O-CG 3.41Å; Y500-L504 PolarHBondContact O-N 3.26Å; Y500-L559 HydrophobicContact CD1-CD1 4.05Å; Y500-L559 HydrophobicContact CE1-CD1 4.06Å; Y500-L559 HydrophobicContact CE1-CD2 3.92Å; Y500-D563 HydrophobicContact CE2-CB 4.2Å; Y500-D563 WeakPolarHBondContact CE2-OD2 3.23Å; Y500-D563 PolarHBondContact OH-OD2 3.21Å
501	D	87.4	Confident	91.2	Very high	98 Å²	98	31 Å²	31	52%	0.524	16%	0.163	S	C	.	.	H	α-helix	trans	-61.7	-55.5	-168.2	-66.9	-27.1	0	0	0	113.3	F503 L504 L505	D501-F503 VanDerWaalsContact C-N 3.26Å; D501-F503 PolarHBondContact O-N 3.33Å; D501-L504 PolarHBondContact O-N 3.38Å; D501-L505 WeakPolarHBondContact O-CB 3.36Å; D501-L505 PolarHBondContact O-N 3.37Å; D501-L505 VanDerWaalsContact O-N 3.09Å
502	S	87	Confident	90.8	Very high	51 Å²	51	31.1 Å²	31.1	36%	0.357	16%	0.164	S	C	.	.	H	α-helix	trans	-65.9	-35.1	-179.2	70.6	0	0	0	0	111.5	T506	S502-T506 VanDerWaalsContact O-CB 3.29Å; S502-T506 WeakPolarHBondContact O-CB 3.42Å; S502-T506 PolarHBondContact O-N 3.43Å; S502-T506 PolarHBondContact O-OG1 2.8Å
503	F	91.5	Very high	90.3	Very high	1 Å²	1	32.2 Å²	32.2	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-66.9	-49.9	179.3	164.8	-100.2	0	0	0	111.8	A490 V491 T494 Y500 D501 T506 L507 F555	A490-F503 HydrophobicContact CB-CD2 3.88Å; A490-F503 HydrophobicContact CB-CE2 3.63Å; V491-F503 HydrophobicContact CB-CZ 4.4Å; V491-F503 HydrophobicContact CG2-CE2 4.11Å; V491-F503 HydrophobicContact CG2-CZ 3.52Å; T494-F503 HydrophobicContact CG2-CB 4.01Å; T494-F503 HydrophobicContact CG2-CD1 3.75Å; T494-F503 HydrophobicContact CG2-CE1 4.38Å; T494-F503 HydrophobicContact CG2-CG 3.82Å; T494-F503 WeakPolarHBondContact OG1-CB 3.34Å; T494-F503 WeakPolarHBondContact OG1-CD2 3.49Å; T494-F503 WeakPolarHBondContact OG1-CG 3.43Å; Y500-F503 PolarHBondContact O-N 3.42Å; D501-F503 VanDerWaalsContact C-N 3.26Å; D501-F503 PolarHBondContact O-N 3.33Å; F503-T506 PolarHBondContact O-N 3.06Å; F503-L507 HydrophobicContact CD1-CD1 4.38Å; F503-L507 HydrophobicContact CD2-CG 4.43Å; F503-L507 HydrophobicContact CE1-CD1 3.53Å; F503-L507 HydrophobicContact CE1-CG 4.28Å; F503-L507 HydrophobicContact CE2-CD1 3.79Å; F503-L507 HydrophobicContact CE2-CD2 4.36Å; F503-L507 HydrophobicContact CE2-CG 3.9Å; F503-L507 HydrophobicContact CZ-CD1 3.18Å; F503-L507 HydrophobicContact CZ-CG 3.83Å; F503-L507 PolarHBondContact O-N 3.02Å; F503-F555 AromaticContact CE1-CE1 3.9Å; F503-F555 HydrophobicContact CE1-CE1 3.9Å; F503-F555 HydrophobicContact CZ-CE1 4.2Å
504	L	92.1	Very high	89.9	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-67.3	-39.8	-178.9	-70.6	175	0	0	0	111.6	Y500 D501 T506 L507 A508 V556 I566 I574	Y500-L504 WeakPolarHBondContact O-CB 3.48Å; Y500-L504 VanDerWaalsContact O-CG 3.29Å; Y500-L504 WeakPolarHBondContact O-CG 3.41Å; Y500-L504 PolarHBondContact O-N 3.26Å; D501-L504 PolarHBondContact O-N 3.38Å; L504-T506 VanDerWaalsContact C-N 3.3Å; L504-T506 PolarHBondContact O-N 3.01Å; L504-L507 PolarHBondContact O-N 3.27Å; L504-A508 WeakPolarHBondContact O-CB 3.41Å; L504-A508 PolarHBondContact O-N 3.47Å; L504-V556 HydrophobicContact CD2-CG1 3.91Å; L504-I566 HydrophobicContact CD1-CG2 3.54Å; L504-I574 HydrophobicContact CD2-CD1 4.08Å
505	L	90.8	Very high	89.7	Confident	94 Å²	94	31.4 Å²	31.4	49%	0.492	16%	0.164	S	C	.	.	H	α-helix	trans	-61	-42.7	173.6	-179.3	62.7	0	0	0	111.2	D501 A508 N509	D501-L505 WeakPolarHBondContact O-CB 3.36Å; D501-L505 PolarHBondContact O-N 3.37Å; D501-L505 VanDerWaalsContact O-N 3.09Å; L505-A508 PolarHBondContact O-N 3.08Å; L505-N509 VanDerWaalsContact O-CG 3.31Å; L505-N509 PolarHBondContact O-N 3.33Å; L505-N509 VanDerWaalsContact O-N 3.12Å; L505-N509 PolarHBondContact O-ND2 3.19Å
506	T	90.9	Very high	89.2	Confident	11 Å²	11	32 Å²	32	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-44	177.3	-59.5	0	0	0	0	111.2	L432 E433 S502 F503 L504 N509 V510	L432-T506 HydrophobicContact CB-CG2 3.45Å; L432-T506 VanDerWaalsContact CB-CG2 3.45Å; E433-T506 HydrophobicContact CG-CG2 3.75Å; S502-T506 VanDerWaalsContact O-CB 3.29Å; S502-T506 WeakPolarHBondContact O-CB 3.42Å; S502-T506 PolarHBondContact O-N 3.43Å; S502-T506 PolarHBondContact O-OG1 2.8Å; F503-T506 PolarHBondContact O-N 3.06Å; L504-T506 VanDerWaalsContact C-N 3.3Å; L504-T506 PolarHBondContact O-N 3.01Å; T506-N509 PolarHBondContact O-N 2.93Å; T506-V510 WeakPolarHBondContact O-CG2 3.46Å; T506-V510 PolarHBondContact O-N 3.39Å
507	L	92.2	Very high	88.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-48.9	175	-80	-170.8	0	0	0	111.9	L432 I487 F503 L504 N509 V510 M511 L552 I574	L432-L507 HydrophobicContact CD1-CD2 4.15Å; I487-L507 HydrophobicContact CG1-CD2 3.93Å; I487-L507 HydrophobicContact CG2-CD2 4.18Å; F503-L507 HydrophobicContact CD1-CD1 4.38Å; F503-L507 HydrophobicContact CD2-CG 4.43Å; F503-L507 HydrophobicContact CE1-CD1 3.53Å; F503-L507 HydrophobicContact CE1-CG 4.28Å; F503-L507 HydrophobicContact CE2-CD1 3.79Å; F503-L507 HydrophobicContact CE2-CD2 4.36Å; F503-L507 HydrophobicContact CE2-CG 3.9Å; F503-L507 HydrophobicContact CZ-CD1 3.18Å; F503-L507 HydrophobicContact CZ-CG 3.83Å; F503-L507 PolarHBondContact O-N 3.02Å; L504-L507 PolarHBondContact O-N 3.27Å; L507-N509 PolarHBondContact O-N 3.5Å; L507-V510 PolarHBondContact O-N 2.95Å; L507-M511 HydrophobicContact CB-CE 4.2Å; L507-M511 HydrophobicContact CD2-CE 4.21Å; L507-M511 WeakPolarHBondContact O-CE 3.2Å; L507-M511 WeakPolarHBondContact O-CG 3.46Å; L507-M511 PolarHBondContact O-N 3.35Å; L507-L552 HydrophobicContact CD1-CD2 3.86Å; L507-I574 HydrophobicContact CB-CD1 4.02Å; L507-I574 HydrophobicContact CB-CG1 4.5Å; L507-I574 HydrophobicContact CD1-CD1 4.02Å
508	A	90.7	Very high	88.2	Confident	6 Å²	6	34.2 Å²	34.2	5%	0.05	17%	0.174	C	C	.	.	H	α-helix	trans	-54.2	-42.1	179.1	0	0	0	0	0	111.7	L504 L505 V510 M511 P512 E573	L504-A508 WeakPolarHBondContact O-CB 3.41Å; L504-A508 PolarHBondContact O-N 3.47Å; L505-A508 PolarHBondContact O-N 3.08Å; A508-V510 VanDerWaalsContact C-N 3.29Å; A508-V510 PolarHBondContact O-N 2.86Å; A508-M511 PolarHBondContact O-N 3.27Å; A508-P512 WeakPolarHBondContact O-CD 3.44Å; A508-E573 HydrophobicContact CB-CB 3.88Å; A508-E573 HydrophobicContact CB-CG 4.23Å
509	N	88.4	Confident	88	Confident	82 Å²	82	29.2 Å²	29.2	44%	0.439	15%	0.152	S	C	.	.	H	α-helix	trans	-69.5	-21.3	177.3	-71	-36.9	0	0	0	114.4	L505 T506 L507	L505-N509 VanDerWaalsContact O-CG 3.31Å; L505-N509 PolarHBondContact O-N 3.33Å; L505-N509 VanDerWaalsContact O-N 3.12Å; L505-N509 PolarHBondContact O-ND2 3.19Å; T506-N509 PolarHBondContact O-N 2.93Å; L507-N509 PolarHBondContact O-N 3.5Å
510	V	88.7	Confident	87.3	Confident	5 Å²	5	26.4 Å²	26.4	3%	0.03	14%	0.144	C	C	.	.	H	α-helix	trans	-89.1	-23.7	177.2	173.9	0	0	0	0	111.8	L432 C435 I483 T506 L507 A508 K513 L514	L432-V510 HydrophobicContact CB-CG2 4.22Å; L432-V510 WeakPolarHBondContact O-CG2 3.38Å; C435-V510 HydrophobicContact CB-CG2 4.43Å; I483-V510 HydrophobicContact CG2-CG1 4.01Å; T506-V510 WeakPolarHBondContact O-CG2 3.46Å; T506-V510 PolarHBondContact O-N 3.39Å; L507-V510 PolarHBondContact O-N 2.95Å; A508-V510 VanDerWaalsContact C-N 3.29Å; A508-V510 PolarHBondContact O-N 2.86Å; V510-K513 PolarHBondContact O-N 2.95Å; V510-L514 PolarHBondContact O-N 3.29Å; V510-L514 VanDerWaalsContact O-N 3.12Å
511	M	91.4	Very high	86.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-54.1	-47.7	-175.2	-69.3	-54.2	105.4	0	0	114.5	L507 A508 K513 L514 V515 L530 L549 L552 I574 A577	L507-M511 HydrophobicContact CB-CE 4.2Å; L507-M511 HydrophobicContact CD2-CE 4.21Å; L507-M511 WeakPolarHBondContact O-CE 3.2Å; L507-M511 WeakPolarHBondContact O-CG 3.46Å; L507-M511 PolarHBondContact O-N 3.35Å; A508-M511 PolarHBondContact O-N 3.27Å; M511-K513 VanDerWaalsContact C-N 3.28Å; M511-K513 PolarHBondContact O-N 3.29Å; M511-L514 HydrophobicContact CE-CD2 4.42Å; M511-L514 PolarHBondContact O-N 2.69Å; M511-L514 VanDerWaalsContact O-N 3.15Å; M511-V515 WeakPolarHBondContact O-CG2 2.91Å; M511-V515 PolarHBondContact O-N 3.07Å; M511-L530 HydrophobicContact CB-CD1 3.64Å; M511-L549 HydrophobicContact SD-CD2 3.72Å; M511-L552 HydrophobicContact CE-CD1 3.8Å; M511-L552 HydrophobicContact SD-CD1 4.33Å; M511-I574 HydrophobicContact CG-CG1 4.01Å; M511-I574 HydrophobicContact SD-CB 4.49Å; M511-I574 HydrophobicContact SD-CG1 4.12Å; M511-A577 HydrophobicContact CB-CB 3.87Å; M511-A577 HydrophobicContact CG-CB 4.03Å; M511-A577 HydrophobicContact SD-CB 3.87Å
512	P	87.6	Confident	84.9	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-55.1	-43.5	179.7	-22.4	29.1	0	0	0	113	A508 V515 C516 D526 T528 L530	A508-P512 WeakPolarHBondContact O-CD 3.44Å; P512-V515 PolarHBondContact O-N 3.39Å; P512-C516 PolarHBondContact O-N 2.85Å; P512-C516 PolarHBondContact O-SG 3.24Å; P512-D526 WeakPolarHBondContact CB-OD1 3.34Å; P512-T528 HydrophobicContact CG-CG2 3.64Å; P512-L530 HydrophobicContact CB-CD2 4.42Å; P512-L530 HydrophobicContact CB-CG 4.46Å; P512-L530 HydrophobicContact CG-CD1 4.47Å; P512-L530 HydrophobicContact CG-CG 4.09Å
513	K	83.3	Confident	83.9	Confident	27 Å²	27	27.4 Å²	27.4	12%	0.117	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-44.6	178.2	-65.9	177.1	-171.7	154.3	0	112.2	N436 V510 M511 V515 C516 Y517 D526	N436-K513 PolarHBondContact ND2-NZ 3.21Å; N436-K513 WeakPolarHBondContact OD1-CE 3.12Å; N436-K513 PolarHBondContact OD1-NZ 2.9Å; V510-K513 PolarHBondContact O-N 2.95Å; M511-K513 VanDerWaalsContact C-N 3.28Å; M511-K513 PolarHBondContact O-N 3.29Å; K513-V515 PolarHBondContact O-N 3.43Å; K513-C516 WeakPolarHBondContact O-CB 2.98Å; K513-C516 PolarHBondContact O-N 3.21Å; K513-C516 VanDerWaalsContact O-N 3.16Å; K513-Y517 HydrophobicContact CB-CD2 4.48Å; K513-Y517 HydrophobicContact CB-CE2 4.47Å; K513-Y517 WeakPolarHBondContact O-CD2 3.39Å; K513-Y517 PolarHBondContact O-N 3.16Å; K513-D526 WeakPolarHBondContact CG-OD1 3.11Å
514	L	87.4	Confident	82.7	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-39.9	179.8	-171.9	62.3	0	0	0	110.3	V480 I487 V510 M511 Y517 G518 V545 L549	V480-L514 HydrophobicContact CG2-CD1 3.84Å; I487-L514 HydrophobicContact CD1-CD2 4.04Å; V510-L514 PolarHBondContact O-N 3.29Å; V510-L514 VanDerWaalsContact O-N 3.12Å; M511-L514 HydrophobicContact CE-CD2 4.42Å; M511-L514 PolarHBondContact O-N 2.69Å; M511-L514 VanDerWaalsContact O-N 3.15Å; L514-Y517 PolarHBondContact O-N 2.84Å; L514-G518 PolarHBondContact O-N 3.37Å; L514-V545 HydrophobicContact CD1-CG1 3.9Å; L514-V545 HydrophobicContact CD1-CG2 4.15Å; L514-V545 HydrophobicContact CD2-CG1 4.44Å; L514-V545 HydrophobicContact CG-CG1 3.72Å; L514-L549 HydrophobicContact CD2-CD2 3.75Å; L514-L549 HydrophobicContact CD2-CG 4.26Å; L514-L549 HydrophobicContact CG-CD2 4.49Å
515	V	88	Confident	81.3	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.9	-46.2	173.3	177.5	0	0	0	0	111.8	M511 P512 K513 Y517 G518 L519 V524 L530 L549 A577 C580 F581	M511-V515 WeakPolarHBondContact O-CG2 2.91Å; M511-V515 PolarHBondContact O-N 3.07Å; P512-V515 PolarHBondContact O-N 3.39Å; K513-V515 PolarHBondContact O-N 3.43Å; V515-Y517 VanDerWaalsContact C-N 3.31Å; V515-Y517 PolarHBondContact O-N 2.63Å; V515-G518 PolarHBondContact O-N 2.73Å; V515-L519 HydrophobicContact CG1-CD1 3.67Å; V515-L519 HydrophobicContact CG1-CG 4.28Å; V515-L519 WeakPolarHBondContact O-CB 3.18Å; V515-L519 PolarHBondContact O-N 2.84Å; V515-V524 HydrophobicContact CG1-CB 3.99Å; V515-V524 HydrophobicContact CG1-CG1 4.26Å; V515-V524 HydrophobicContact CG1-CG2 3.64Å; V515-L530 HydrophobicContact CG2-CD2 4.32Å; V515-L549 HydrophobicContact CG2-CD1 4.3Å; V515-A577 HydrophobicContact CG2-CB 3.63Å; V515-C580 HydrophobicContact CG1-CB 3.82Å; V515-F581 HydrophobicContact CG1-CE2 4.47Å; V515-F581 HydrophobicContact CG2-CE2 4.49Å
516	C	84.2	Confident	80.4	Confident	13 Å²	13	30 Å²	30	9%	0.088	17%	0.173	C	C	.	.	H	α-helix	trans	-58	-42.1	175.2	-69.4	0	0	0	0	112.2	P512 K513 G520 V524	P512-C516 PolarHBondContact O-N 2.85Å; P512-C516 PolarHBondContact O-SG 3.24Å; K513-C516 WeakPolarHBondContact O-CB 2.98Å; K513-C516 PolarHBondContact O-N 3.21Å; K513-C516 VanDerWaalsContact O-N 3.16Å; C516-G520 CarbonylContact O-C 3.59Å; C516-G520 VanDerWaalsContact O-C 3.32Å; C516-G520 WeakPolarHBondContact O-CA 3.33Å; C516-G520 PolarHBondContact O-N 3.28Å; C516-V524 PolarHBondContact SG-O 2.92Å
517	Y	81.3	Confident	79.5	Confident	108 Å²	108	33 Å²	33	42%	0.424	19%	0.191	S	C	.	.	H	α-helix	trans	-62.6	-47.5	176.8	-84.3	-67.7	0	0	0	112.1	V480 K513 L514 V515	V480-Y517 HydrophobicContact CB-CG 4.4Å; V480-Y517 HydrophobicContact CG2-CD2 4.42Å; V480-Y517 HydrophobicContact CG2-CG 4.17Å; K513-Y517 HydrophobicContact CB-CD2 4.48Å; K513-Y517 HydrophobicContact CB-CE2 4.47Å; K513-Y517 WeakPolarHBondContact O-CD2 3.39Å; K513-Y517 PolarHBondContact O-N 3.16Å; L514-Y517 PolarHBondContact O-N 2.84Å; V515-Y517 VanDerWaalsContact C-N 3.31Å; V515-Y517 PolarHBondContact O-N 2.63Å
518	G	83.3	Confident	78.6	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-85.7	-17.4	-172.8	0	0	0	0	0	115.2	L514 V515 T541 D542	L514-G518 PolarHBondContact O-N 3.37Å; V515-G518 PolarHBondContact O-N 2.73Å; G518-T541 CarbonylContact O-C 3.41Å; G518-T541 WeakPolarHBondContact O-CA 3.32Å; G518-D542 PolarHBondContact O-N 3.45Å
519	L	84.3	Confident	78.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-102.4	-22.3	173	-64.8	-178	0	0	0	113	V515 I523 V524 G539 T541 C580 F581 V584	V515-L519 HydrophobicContact CG1-CD1 3.67Å; V515-L519 HydrophobicContact CG1-CG 4.28Å; V515-L519 WeakPolarHBondContact O-CB 3.18Å; V515-L519 PolarHBondContact O-N 2.84Å; L519-I523 HydrophobicContact CB-CB 4.33Å; L519-I523 HydrophobicContact CB-CD1 4.15Å; L519-I523 HydrophobicContact CB-CG2 4.4Å; L519-I523 HydrophobicContact CD1-CG2 4.26Å; L519-I523 WeakPolarHBondContact O-CD1 3.43Å; L519-V524 HydrophobicContact CD1-CG2 4.32Å; L519-G539 WeakPolarHBondContact O-CA 3.48Å; L519-T541 HydrophobicContact CD2-CG2 3.81Å; L519-C580 HydrophobicContact CD1-CB 3.98Å; L519-F581 HydrophobicContact CD1-CD2 4.28Å; L519-F581 HydrophobicContact CD1-CE2 4.27Å; L519-F581 HydrophobicContact CD2-CD1 3.76Å; L519-F581 HydrophobicContact CD2-CD2 4.13Å; L519-F581 HydrophobicContact CD2-CE1 3.7Å; L519-F581 HydrophobicContact CD2-CE2 4.07Å; L519-F581 HydrophobicContact CD2-CG 3.99Å; L519-F581 HydrophobicContact CD2-CZ 3.86Å; L519-F581 HydrophobicContact CG-CD2 4.12Å; L519-F581 HydrophobicContact CG-CE1 4.21Å; L519-F581 HydrophobicContact CG-CE2 3.77Å; L519-F581 HydrophobicContact CG-CG 4.48Å; L519-F581 HydrophobicContact CG-CZ 3.83Å; L519-V584 HydrophobicContact CD1-CG2 4.1Å; L519-V584 HydrophobicContact CD2-CB 4.33Å; L519-V584 HydrophobicContact CD2-CG1 4.28Å; L519-V584 HydrophobicContact CD2-CG2 4.32Å
520	G	73.5	Confident	78.1	Confident	30 Å²	30	36.8 Å²	36.8	31%	0.309	22%	0.218	S	C	.	.			trans	98.3	153.5	-175.9	0	0	0	0	0	113.6	C516 G522 I523	C516-G520 CarbonylContact O-C 3.59Å; C516-G520 VanDerWaalsContact O-C 3.32Å; C516-G520 WeakPolarHBondContact O-CA 3.33Å; C516-G520 PolarHBondContact O-N 3.28Å; G520-G522 PolarHBondContact O-N 3.47Å; G520-I523 PolarHBondContact O-N 3.39Å
521	D	65.2	Low	77.9	Confident	151 Å²	151	40.3 Å²	40.3	81%	0.807	23%	0.234	S	C	*	.	B	Isolated β-bridge	trans	-60.2	128.5	-172.9	-82.6	-21.9	0	0	0	113.3
522	G	61.1	Low	77.6	Confident	36 Å²	36	41.1 Å²	41.1	37%	0.371	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	8.1	172.6	0	0	0	0	0	115.7	G520 K537	G520-G522 PolarHBondContact O-N 3.47Å; G522-K537 WeakPolarHBondContact O-CD 3.37Å; G522-K537 PolarHBondContact O-NZ 3.18Å
523	I	66.6	Low	77.5	Confident	6 Å²	6	41 Å²	41	3%	0.031	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-45.5	163.1	-58.2	-163.4	0	0	0	110	L519 G520 P533 N534 K537 V584	L519-I523 HydrophobicContact CB-CB 4.33Å; L519-I523 HydrophobicContact CB-CD1 4.15Å; L519-I523 HydrophobicContact CB-CG2 4.4Å; L519-I523 HydrophobicContact CD1-CG2 4.26Å; L519-I523 WeakPolarHBondContact O-CD1 3.43Å; G520-I523 PolarHBondContact O-N 3.39Å; I523-P533 HydrophobicContact CG2-CB 3.87Å; I523-N534 WeakPolarHBondContact O-CB 3.38Å; I523-N534 PolarHBondContact O-N 2.87Å; I523-K537 HydrophobicContact CD1-CB 4.39Å; I523-K537 WeakPolarHBondContact CD1-O 3.49Å; I523-K537 HydrophobicContact CG1-CB 4Å; I523-V584 HydrophobicContact CG2-CG2 4.42Å
524	V	65.3	Low	77.2	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.018	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-121.3	134.2	174.7	179.9	0	0	0	0	107.9	V515 C516 L519 L530 P533	V515-V524 HydrophobicContact CG1-CB 3.99Å; V515-V524 HydrophobicContact CG1-CG1 4.26Å; V515-V524 HydrophobicContact CG1-CG2 3.64Å; C516-V524 PolarHBondContact SG-O 2.92Å; L519-V524 HydrophobicContact CD1-CG2 4.32Å; V524-L530 HydrophobicContact CG1-CD2 3.74Å; V524-P533 HydrophobicContact CG2-CB 3.84Å
525	P	64.2	Low	76.5	Confident	54 Å²	54	44.4 Å²	44.4	35%	0.351	26%	0.258	S	S	.	.			trans	-71.5	138.4	172.4	29.3	-32.2	0	0	0	110	V527 Q531	P525-V527 HydrophobicContact CB-CG2 4.04Å; P525-V527 PolarHBondContact O-N 3.18Å; P525-Q531 HydrophobicContact CG-CB 4.46Å
526	D	70.2	Confident	75.4	Confident	94 Å²	94	50.5 Å²	50.5	50%	0.503	29%	0.291	S	S	.	.	S	Bend	trans	-73.8	71.2	174.5	-172.4	20.7	0	0	0	110.2	P512 K513	P512-D526 WeakPolarHBondContact CB-OD1 3.34Å; K513-D526 WeakPolarHBondContact CG-OD1 3.11Å
527	V	72.4	Confident	74.3	Confident	74 Å²	74	54.9 Å²	54.9	45%	0.448	31%	0.308	S	S	.	.			trans	-137.2	138.3	-176.1	-177.3	0	0	0	0	108.5	P525 P529	P525-V527 HydrophobicContact CB-CG2 4.04Å; P525-V527 PolarHBondContact O-N 3.18Å; V527-P529 CarbonylContact O-C 3.58Å
528	T	74.6	Confident	73.1	Confident	77 Å²	77	56.9 Å²	56.9	47%	0.472	33%	0.331	S	S	.	.	S	Bend	trans	-99.7	132.7	168.1	43.9	0	0	0	0	109.6	P512	P512-T528 HydrophobicContact CG-CG2 3.64Å
529	P	81.6	Confident	72	Confident	84 Å²	84	58 Å²	58	55%	0.545	34%	0.343	S	S	.	.	S	Bend	cis	-73.2	155.6	-2.6	31.9	-35.6	0	0	0	113	V527 Q531 E573	V527-P529 CarbonylContact O-C 3.58Å; P529-Q531 PolarHBondContact O-N 3.22Å; P529-E573 WeakPolarHBondContact CB-OE1 3.34Å
530	L	85.9	Confident	71.3	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.026	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-55.8	135.4	176.4	-93.9	151.7	0	0	0	111.4	M511 P512 V515 V524 E573 K576 A577 W607	M511-L530 HydrophobicContact CB-CD1 3.64Å; P512-L530 HydrophobicContact CB-CD2 4.42Å; P512-L530 HydrophobicContact CB-CG 4.46Å; P512-L530 HydrophobicContact CG-CD1 4.47Å; P512-L530 HydrophobicContact CG-CG 4.09Å; V515-L530 HydrophobicContact CG2-CD2 4.32Å; V524-L530 HydrophobicContact CG1-CD2 3.74Å; L530-E573 WeakPolarHBondContact CB-OE2 3.49Å; L530-E573 WeakPolarHBondContact CD1-O 3.28Å; L530-E573 PolarHBondContact N-OE2 3.02Å; L530-K576 HydrophobicContact CB-CB 4.15Å; L530-K576 HydrophobicContact CB-CD 4.38Å; L530-K576 HydrophobicContact CD1-CB 4.43Å; L530-A577 HydrophobicContact CD1-CB 3.88Å; L530-W607 HydrophobicContact CB-CZ2 4.48Å
531	Q	85.4	Confident	71.6	Confident	79 Å²	79	64.8 Å²	64.8	37%	0.369	37%	0.373	S	S	.	.			trans	-106	153.2	174.7	-62.4	-164.9	-35	0	0	110.8	P525 P529	P525-Q531 HydrophobicContact CG-CB 4.46Å; P529-Q531 PolarHBondContact O-N 3.22Å
532	P	85.2	Confident	72.5	Confident	17 Å²	17	59.7 Å²	59.7	11%	0.11	35%	0.346	C	S	.	.			trans	-55.5	145.4	174.5	-25.2	34	0	0	0	112.8	W607 W610	P532-W607 HydrophobicContact CG-CD2 4.08Å; P532-W607 HydrophobicContact CG-CE3 4.46Å; P532-W607 HydrophobicContact CG-CG 4.4Å; P532-W607 HydrophobicContact CG-CZ2 4.28Å; P532-W610 HydrophobicContact CB-CB 4Å; P532-W610 HydrophobicContact CB-CD2 3.71Å; P532-W610 HydrophobicContact CB-CG 3.38Å; P532-W610 HydrophobicContact CG-CB 4.15Å; P532-W610 HydrophobicContact CG-CD2 4.31Å; P532-W610 HydrophobicContact CG-CG 3.99Å
533	P	85.3	Confident	73.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.334	C	S	.	.			trans	-70.7	147.2	-172.9	29.3	-36.2	0	0	0	113	I523 V524 L535 C580 I583 V584 W610	I523-P533 HydrophobicContact CG2-CB 3.87Å; V524-P533 HydrophobicContact CG2-CB 3.84Å; P533-L535 PolarHBondContact O-N 3.44Å; P533-C580 HydrophobicContact CG-CB 4.39Å; P533-I583 HydrophobicContact CG-CB 4.08Å; P533-I583 HydrophobicContact CG-CG2 3.64Å; P533-V584 HydrophobicContact CB-CG2 4.1Å; P533-V584 HydrophobicContact CG-CG2 4.17Å; P533-W610 PolarHBondContact O-NE1 3.31Å
534	N	76.9	Confident	74.6	Confident	61 Å²	61	59.1 Å²	59.1	33%	0.326	33%	0.334	S	S	.	.			trans	-81	98.5	172.6	-170.5	-14	0	0	0	110.8	I523 N536 K537	I523-N534 WeakPolarHBondContact O-CB 3.38Å; I523-N534 PolarHBondContact O-N 2.87Å; N534-N536 PolarHBondContact O-N 3.47Å; N534-N536 WeakPolarHBondContact OD1-CB 3.43Å; N534-N536 PolarHBondContact OD1-N 3.19Å; N534-N536 PolarHBondContact OD1-ND2 3.39Å; N534-K537 PolarHBondContact O-N 2.91Å
535	L	71.9	Confident	75.8	Confident	38 Å²	38	59 Å²	59	20%	0.199	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-6.6	-174.8	-71.8	164	0	0	0	114.8	P533 K537 I583 V584 E614	P533-L535 PolarHBondContact O-N 3.44Å; L535-K537 PolarHBondContact O-N 2.99Å; L535-I583 HydrophobicContact CD1-CG2 3.76Å; L535-I583 HydrophobicContact CD2-CG2 4.02Å; L535-I583 HydrophobicContact CG-CG2 4.22Å; L535-V584 HydrophobicContact CD2-CB 4.5Å; L535-V584 HydrophobicContact CD2-CG2 4.01Å; L535-E614 HydrophobicContact CD1-CB 4.25Å; L535-E614 HydrophobicContact CD1-CG 3.6Å
536	N	64.8	Low	77.1	Confident	129 Å²	129	56.5 Å²	56.5	69%	0.69	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.9	174.3	-62.7	-61.7	0	0	0	113.2	N534	N534-N536 PolarHBondContact O-N 3.47Å; N534-N536 WeakPolarHBondContact OD1-CB 3.43Å; N534-N536 PolarHBondContact OD1-N 3.19Å; N534-N536 PolarHBondContact OD1-ND2 3.39Å
537	K	61.7	Low	78.2	Confident	104 Å²	104	52 Å²	52	45%	0.452	29%	0.293	S	S	.	.	S	Bend	trans	-114.9	118.5	179.4	-67.8	-177.5	-176.5	174.1	0	109.3	G522 I523 N534 L535 G539	G522-K537 WeakPolarHBondContact O-CD 3.37Å; G522-K537 PolarHBondContact O-NZ 3.18Å; I523-K537 HydrophobicContact CD1-CB 4.39Å; I523-K537 WeakPolarHBondContact CD1-O 3.49Å; I523-K537 HydrophobicContact CG1-CB 4Å; N534-K537 PolarHBondContact O-N 2.91Å; L535-K537 PolarHBondContact O-N 2.99Å; K537-G539 PolarHBondContact O-N 3.16Å
538	V	55.5	Low	79.2	Confident	150 Å²	150	48.5 Å²	48.5	91%	0.909	27%	0.271	S	S	*	.			trans	-89.6	104.9	175.3	-176.3	0	0	0	0	107.9
539	G	59.7	Low	80.2	Confident	25 Å²	25	44.8 Å²	44.8	26%	0.258	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-98.7	155.4	171.8	0	0	0	0	0	111.4	L519 K537	L519-G539 WeakPolarHBondContact O-CA 3.48Å; K537-G539 PolarHBondContact O-N 3.16Å
540	N	69.8	Low	80.8	Confident	142 Å²	142	40.8 Å²	40.8	76%	0.759	22%	0.223	S	C	*	.	P	Polyproline II helix	trans	-81.3	119.9	173.5	-148.9	35.3	0	0	0	108
541	T	80.2	Confident	81.3	Confident	32 Å²	32	40.6 Å²	40.6	20%	0.196	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-78	126.1	-174.9	55.5	0	0	0	0	111.8	G518 L519 Q543 V584	G518-T541 CarbonylContact O-C 3.41Å; G518-T541 WeakPolarHBondContact O-CA 3.32Å; L519-T541 HydrophobicContact CD2-CG2 3.81Å; T541-Q543 PolarHBondContact O-N 3.01Å; T541-V584 HydrophobicContact CG2-CG1 4.21Å
542	D	84.2	Confident	81.8	Confident	43 Å²	43	36.8 Å²	36.8	23%	0.23	20%	0.204	C	C	.	.			trans	-76.6	109.4	169.9	-166.8	-37	0	0	0	110.1	G518 V544 V545 C546	G518-D542 PolarHBondContact O-N 3.45Å; D542-V544 VanDerWaalsContact C-N 3.26Å; D542-V544 PolarHBondContact O-N 2.96Å; D542-V544 WeakPolarHBondContact OD1-CB 3.43Å; D542-V544 PolarHBondContact OD1-N 3.38Å; D542-V545 HydrophobicContact CB-CB 4.23Å; D542-V545 HydrophobicContact CB-CG2 3.99Å; D542-V545 PolarHBondContact O-N 3.42Å; D542-C546 PolarHBondContact O-N 3.46Å
543	Q	85.9	Confident	82.4	Confident	27 Å²	27	36 Å²	36	13%	0.126	20%	0.199	C	C	.	.	H	α-helix	trans	-64.7	-29.3	-178.6	-66.6	-66.2	-1.2	0	0	112.9	D34 I90 T541 V545 C546 H547	D34-Q543 HydrophobicContact CB-CG 3.96Å; D34-Q543 PolarHBondContact OD2-NE2 2.85Å; I90-Q543 HydrophobicContact CD1-CB 3.91Å; I90-Q543 HydrophobicContact CG1-CB 4.35Å; T541-Q543 PolarHBondContact O-N 3.01Å; Q543-V545 VanDerWaalsContact C-N 3.35Å; Q543-C546 PolarHBondContact O-N 2.92Å; Q543-H547 PolarHBondContact O-CD2 3.41Å; Q543-H547 PolarHBondContact O-N 3Å
544	V	86.7	Confident	82.8	Confident	4 Å²	4	36 Å²	36	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-67.8	-40.8	178.5	-175	0	0	0	0	110.1	N89 I90 M93 Y481 I484 D542 T548	N89-V544 HydrophobicContact CB-CG2 3.82Å; I90-V544 HydrophobicContact CG1-CG2 3.95Å; M93-V544 HydrophobicContact CB-CG1 3.9Å; M93-V544 HydrophobicContact CG-CG1 3.93Å; Y481-V544 HydrophobicContact CD1-CG1 4.24Å; Y481-V544 HydrophobicContact CE1-CB 4.11Å; Y481-V544 HydrophobicContact CE1-CG1 3.96Å; Y481-V544 HydrophobicContact CE1-CG2 4.11Å; I484-V544 HydrophobicContact CD1-CG1 3.84Å; D542-V544 VanDerWaalsContact C-N 3.26Å; D542-V544 PolarHBondContact O-N 2.96Å; D542-V544 WeakPolarHBondContact OD1-CB 3.43Å; D542-V544 PolarHBondContact OD1-N 3.38Å; V544-T548 PolarHBondContact O-N 2.9Å; V544-T548 PolarHBondContact O-OG1 2.95Å
545	V	89.5	Confident	83.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-44.7	173.7	176.9	0	0	0	0	110.8	V480 I484 L514 D542 Q543 H547 T548 L549 F581	V480-V545 HydrophobicContact CG2-CG2 4.08Å; I484-V545 HydrophobicContact CD1-CG2 4.41Å; L514-V545 HydrophobicContact CD1-CG1 3.9Å; L514-V545 HydrophobicContact CD1-CG2 4.15Å; L514-V545 HydrophobicContact CD2-CG1 4.44Å; L514-V545 HydrophobicContact CG-CG1 3.72Å; D542-V545 HydrophobicContact CB-CB 4.23Å; D542-V545 HydrophobicContact CB-CG2 3.99Å; D542-V545 PolarHBondContact O-N 3.42Å; Q543-V545 VanDerWaalsContact C-N 3.35Å; V545-H547 PolarHBondContact O-N 3.3Å; V545-T548 WeakPolarHBondContact O-CB 3.44Å; V545-T548 PolarHBondContact O-N 3.39Å; V545-T548 VanDerWaalsContact O-N 3.11Å; V545-L549 HydrophobicContact CG1-CD1 4.01Å; V545-L549 HydrophobicContact CG1-CG 4.32Å; V545-L549 WeakPolarHBondContact O-CG 3.44Å; V545-L549 PolarHBondContact O-N 3.48Å; V545-F581 HydrophobicContact CB-CZ 4.13Å; V545-F581 HydrophobicContact CG1-CE1 4.47Å; V545-F581 HydrophobicContact CG1-CE2 4.08Å; V545-F581 HydrophobicContact CG1-CZ 3.63Å
546	C	91.6	Very high	84.7	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-58.1	-46.8	178	-165.7	0	0	0	0	112	F39 D542 Q543 T548 L549 R550 F581	F39-C546 VanDerWaalsContact CE1-SG 3.56Å; F39-C546 HydrophobicContact CZ-CB 4.18Å; F39-C546 WeakPolarHBondContact CZ-SG 3.46Å; D542-C546 PolarHBondContact O-N 3.46Å; Q543-C546 PolarHBondContact O-N 2.92Å; C546-T548 VanDerWaalsContact C-N 3.32Å; C546-T548 PolarHBondContact O-N 3.47Å; C546-L549 PolarHBondContact O-N 2.87Å; C546-R550 WeakPolarHBondContact O-CB 3.47Å; C546-R550 PolarHBondContact O-N 3.28Å; C546-F581 HydrophobicContact CB-CD1 3.65Å; C546-F581 HydrophobicContact CB-CE1 3.96Å; C546-F581 HydrophobicContact CB-CG 4.37Å
547	H	92.6	Very high	86	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.1	-39	174.4	-78.9	-60.3	0	0	0	112.5	D34 G35 F39 M93 Q543 V545 R550 F551	D34-H547 PolarHBondContact O-NE2 3.14Å; G35-H547 PolarHBondContact O-CE1 3Å; F39-H547 AromaticContact CZ-CE1 3.8Å; M93-H547 HydrophobicContact CE-CB 4.2Å; M93-H547 HydrophobicContact CG-CB 4.05Å; Q543-H547 PolarHBondContact O-CD2 3.41Å; Q543-H547 PolarHBondContact O-N 3Å; V545-H547 PolarHBondContact O-N 3.3Å; H547-R550 WeakPolarHBondContact O-CB 3.25Å; H547-R550 PolarHBondContact O-N 3.37Å; H547-F551 WeakPolarHBondContact O-CB 3.24Å; H547-F551 PolarHBondContact O-N 3.16Å
548	T	93.9	Very high	87.5	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.4	-43.2	176.3	-54.9	0	0	0	0	111.5	M93 I484 I487 F488 V544 V545 C546 F551 L552	M93-T548 WeakPolarHBondContact CE-OG1 3.5Å; M93-T548 PolarHBondContact SD-OG1 2.91Å; I484-T548 HydrophobicContact CG1-CG2 4.34Å; I484-T548 HydrophobicContact CG2-CG2 4.17Å; I487-T548 HydrophobicContact CD1-CG2 4.31Å; F488-T548 HydrophobicContact CE2-CG2 4.37Å; V544-T548 PolarHBondContact O-N 2.9Å; V544-T548 PolarHBondContact O-OG1 2.95Å; V545-T548 WeakPolarHBondContact O-CB 3.44Å; V545-T548 PolarHBondContact O-N 3.39Å; V545-T548 VanDerWaalsContact O-N 3.11Å; C546-T548 VanDerWaalsContact C-N 3.32Å; C546-T548 PolarHBondContact O-N 3.47Å; T548-F551 WeakPolarHBondContact O-CB 3.31Å; T548-F551 PolarHBondContact O-N 3.47Å; T548-L552 HydrophobicContact CG2-CD1 4.37Å; T548-L552 WeakPolarHBondContact O-CB 3.47Å; T548-L552 WeakPolarHBondContact O-CG 3.26Å; T548-L552 PolarHBondContact O-N 2.79Å
549	L	95.4	Very high	89.2	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.9	-37.4	178.4	-69.4	175.1	0	0	0	112.4	M511 L514 V515 V545 C546 L552 T553 A577 Y578 F581	M511-L549 HydrophobicContact SD-CD2 3.72Å; L514-L549 HydrophobicContact CD2-CD2 3.75Å; L514-L549 HydrophobicContact CD2-CG 4.26Å; L514-L549 HydrophobicContact CG-CD2 4.49Å; V515-L549 HydrophobicContact CG2-CD1 4.3Å; V545-L549 HydrophobicContact CG1-CD1 4.01Å; V545-L549 HydrophobicContact CG1-CG 4.32Å; V545-L549 WeakPolarHBondContact O-CG 3.44Å; V545-L549 PolarHBondContact O-N 3.48Å; C546-L549 PolarHBondContact O-N 2.87Å; L549-L552 PolarHBondContact O-N 3.3Å; L549-T553 WeakPolarHBondContact O-CB 3.41Å; L549-T553 PolarHBondContact O-N 3.15Å; L549-T553 PolarHBondContact O-OG1 2.95Å; L549-A577 HydrophobicContact CD1-CB 4.44Å; L549-A577 HydrophobicContact CD2-CB 3.74Å; L549-Y578 HydrophobicContact CB-CD2 4.02Å; L549-Y578 HydrophobicContact CB-CG 4.39Å; L549-F581 HydrophobicContact CD1-CD2 3.48Å; L549-F581 VanDerWaalsContact CD1-CD2 3.48Å; L549-F581 HydrophobicContact CD1-CE2 3.36Å; L549-F581 HydrophobicContact CD1-CG 4.42Å; L549-F581 HydrophobicContact CD1-CZ 4.23Å
550	R	95.1	Very high	90.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.2	-52.1	170.8	177.5	-163	75	107.4	-8.9	110.8	F39 E97 C546 H547 L552 T553 H554 Y578	F39-R550 HydrophobicContact CD1-CB 4.09Å; F39-R550 HydrophobicContact CD1-CG 3.92Å; F39-R550 HydrophobicContact CE1-CB 4.01Å; F39-R550 HydrophobicContact CE1-CG 4.29Å; E97-R550 IonicContact OE1-CZ 2.71Å; E97-R550 VanDerWaalsContact OE1-CZ 3.29Å; E97-R550 IonicContact OE1-NH1 3.79Å; E97-R550 IonicContact OE1-NH2 3.35Å; E97-R550 PolarHBondContact OE1-NH2 2.99Å; E97-R550 IonicContact OE2-CZ 3.61Å; E97-R550 IonicContact OE2-NE 2.9Å; E97-R550 IonicContact OE2-NH2 3Å; E97-R550 PolarHBondContact OE2-NH2 2.97Å; C546-R550 WeakPolarHBondContact O-CB 3.47Å; C546-R550 PolarHBondContact O-N 3.28Å; H547-R550 WeakPolarHBondContact O-CB 3.25Å; H547-R550 PolarHBondContact O-N 3.37Å; R550-L552 PolarHBondContact O-N 2.8Å; R550-T553 PolarHBondContact O-N 3.12Å; R550-H554 PolarHBondContact O-CD2 3.48Å; R550-H554 VanDerWaalsContact O-CD2 3.3Å; R550-H554 PolarHBondContact O-N 3.41Å; R550-Y578 HydrophobicContact CB-CD2 4.34Å; R550-Y578 HydrophobicContact CB-CE2 3.77Å; R550-Y578 HydrophobicContact CG-CE2 4.48Å
551	F	96.6	Very high	91.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-53.3	-53.5	176.5	166	-108.8	0	0	0	111	E97 T100 W101 F488 V491 H547 T548 T553 H554 F555	E97-F551 HydrophobicContact CB-CD2 4.46Å; E97-F551 HydrophobicContact CG-CB 4.27Å; E97-F551 HydrophobicContact CG-CD2 3.63Å; E97-F551 HydrophobicContact CG-CE2 4.34Å; E97-F551 HydrophobicContact CG-CG 4.18Å; T100-F551 HydrophobicContact CG2-CE2 4.21Å; T100-F551 HydrophobicContact CG2-CZ 3.7Å; W101-F551 HydrophobicContact CD2-CE2 4.3Å; W101-F551 AromaticContact CE2-CD2 3.74Å; W101-F551 AromaticContact CE2-CE2 3.74Å; W101-F551 AromaticContact CZ2-CD2 3.92Å; W101-F551 HydrophobicContact CZ2-CD2 3.92Å; W101-F551 AromaticContact CZ2-CE2 3.98Å; W101-F551 HydrophobicContact CZ2-CE2 3.98Å; W101-F551 AromaticContact NE1-CD2 3.46Å; W101-F551 AromaticContact NE1-CE2 3.76Å; F488-F551 HydrophobicContact CD1-CD1 4.34Å; F488-F551 AromaticContact CD1-CE1 3.81Å; F488-F551 HydrophobicContact CD1-CE1 3.81Å; F488-F551 HydrophobicContact CD1-CZ 4.14Å; F488-F551 AromaticContact CE1-CD1 3.47Å; F488-F551 HydrophobicContact CE1-CD1 3.47Å; F488-F551 VanDerWaalsContact CE1-CD1 3.47Å; F488-F551 HydrophobicContact CE1-CD2 4.24Å; F488-F551 AromaticContact CE1-CE1 3.3Å; F488-F551 HydrophobicContact CE1-CE1 3.3Å; F488-F551 HydrophobicContact CE1-CE2 4.11Å; F488-F551 AromaticContact CE1-CG 3.94Å; F488-F551 HydrophobicContact CE1-CG 3.94Å; F488-F551 AromaticContact CE1-CZ 3.65Å; F488-F551 HydrophobicContact CE1-CZ 3.65Å; F488-F551 HydrophobicContact CE2-CD1 4.35Å; F488-F551 HydrophobicContact CZ-CB 4.43Å; F488-F551 AromaticContact CZ-CD1 3.47Å; F488-F551 HydrophobicContact CZ-CD1 3.47Å; F488-F551 VanDerWaalsContact CZ-CD1 3.47Å; F488-F551 AromaticContact CZ-CE1 3.8Å; F488-F551 HydrophobicContact CZ-CE1 3.8Å; F488-F551 AromaticContact CZ-CG 3.89Å; F488-F551 HydrophobicContact CZ-CG 3.89Å; F488-F551 HydrophobicContact CZ-CZ 4.48Å; V491-F551 HydrophobicContact CG1-CE1 4.35Å; V491-F551 HydrophobicContact CG1-CZ 4Å; V491-F551 HydrophobicContact CG2-CE1 4.12Å; H547-F551 WeakPolarHBondContact O-CB 3.24Å; H547-F551 PolarHBondContact O-N 3.16Å; T548-F551 WeakPolarHBondContact O-CB 3.31Å; T548-F551 PolarHBondContact O-N 3.47Å; F551-T553 VanDerWaalsContact C-N 3.32Å; F551-T553 PolarHBondContact O-N 3.22Å; F551-H554 PolarHBondContact O-N 2.82Å; F551-F555 HydrophobicContact CZ-CB 4.43Å; F551-F555 VanDerWaalsContact O-CB 3.27Å; F551-F555 WeakPolarHBondContact O-CB 3.36Å; F551-F555 PolarHBondContact O-N 2.61Å
552	L	96.5	Very high	91.9	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.5	-40.5	-179.3	-75.1	177.5	0	0	0	112.6	I487 V491 L507 M511 T548 L549 R550 F555 V556 I574	I487-L552 HydrophobicContact CD1-CD1 4.45Å; I487-L552 HydrophobicContact CG2-CD1 3.96Å; I487-L552 HydrophobicContact CG2-CD2 3.7Å; I487-L552 HydrophobicContact CG2-CG 4.13Å; V491-L552 HydrophobicContact CG2-CD2 4.17Å; L507-L552 HydrophobicContact CD1-CD2 3.86Å; M511-L552 HydrophobicContact CE-CD1 3.8Å; M511-L552 HydrophobicContact SD-CD1 4.33Å; T548-L552 HydrophobicContact CG2-CD1 4.37Å; T548-L552 WeakPolarHBondContact O-CB 3.47Å; T548-L552 WeakPolarHBondContact O-CG 3.26Å; T548-L552 PolarHBondContact O-N 2.79Å; L549-L552 PolarHBondContact O-N 3.3Å; R550-L552 PolarHBondContact O-N 2.8Å; L552-F555 WeakPolarHBondContact O-CB 3.34Å; L552-F555 PolarHBondContact O-N 2.75Å; L552-V556 WeakPolarHBondContact O-CG2 3.29Å; L552-V556 PolarHBondContact O-N 2.91Å; L552-I574 HydrophobicContact CB-CG2 3.68Å
553	T	96.1	Very high	91.8	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.7	-49.7	176.5	-63.8	0	0	0	0	111.2	L549 R550 F551 F555 V556 L557 I575 Y578 Y594	L549-T553 WeakPolarHBondContact O-CB 3.41Å; L549-T553 PolarHBondContact O-N 3.15Å; L549-T553 PolarHBondContact O-OG1 2.95Å; R550-T553 PolarHBondContact O-N 3.12Å; F551-T553 VanDerWaalsContact C-N 3.32Å; F551-T553 PolarHBondContact O-N 3.22Å; T553-F555 VanDerWaalsContact C-N 3.31Å; T553-F555 PolarHBondContact O-N 3.4Å; T553-V556 VanDerWaalsContact O-CG2 3.25Å; T553-V556 WeakPolarHBondContact O-CG2 3.48Å; T553-V556 PolarHBondContact O-N 3.31Å; T553-L557 HydrophobicContact CG2-CD1 4.07Å; T553-L557 WeakPolarHBondContact O-CB 3.38Å; T553-L557 VanDerWaalsContact O-CG 3.24Å; T553-L557 WeakPolarHBondContact O-CG 3.36Å; T553-L557 PolarHBondContact O-N 3.01Å; T553-I575 HydrophobicContact CG2-CG1 4.22Å; T553-Y578 HydrophobicContact CG2-CD1 3.98Å; T553-Y578 VanDerWaalsContact OG1-CB 3.22Å; T553-Y578 WeakPolarHBondContact OG1-CB 3.37Å; T553-Y594 HydrophobicContact CG2-CD1 3.75Å; T553-Y594 HydrophobicContact CG2-CE1 3.73Å
554	H	95.4	Very high	91.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.1	-32.7	177.7	-79.4	-83.5	0	0	0	112.7	F42 Y60 W101 R550 F551 F558 Y594	F42-H554 HydrophobicContact CD1-CB 4.36Å; F42-H554 AromaticContact CD1-CD2 3.95Å; F42-H554 AromaticContact CD1-CG 3.92Å; Y60-H554 HydrophobicContact CE2-CB 3.96Å; Y60-H554 AromaticContact CZ-ND1 3.54Å; Y60-H554 PolarHBondContact OH-ND1 3.49Å; W101-H554 HydrophobicContact CH2-CB 4.33Å; W101-H554 HydrophobicContact CZ2-CB 3.98Å; R550-H554 PolarHBondContact O-CD2 3.48Å; R550-H554 VanDerWaalsContact O-CD2 3.3Å; R550-H554 PolarHBondContact O-N 3.41Å; F551-H554 PolarHBondContact O-N 2.82Å; H554-F558 VanDerWaalsContact O-CB 3.26Å; H554-F558 WeakPolarHBondContact O-CB 3.35Å; H554-F558 PolarHBondContact O-N 3.26Å; H554-Y594 PolarHBondContact CE1-OH 3.34Å; H554-Y594 AromaticContact NE2-CE1 3.92Å; H554-Y594 AromaticContact NE2-CZ 3.68Å; H554-Y594 PolarHBondContact NE2-OH 3.06Å
555	F	95	Very high	90.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-48.4	173.9	176.1	-117.2	0	0	0	111.5	W101 I104 V491 I495 F503 F551 L552 T553 F558 L559	W101-F555 HydrophobicContact CH2-CB 4.32Å; I104-F555 HydrophobicContact CD1-CD2 3.6Å; I104-F555 HydrophobicContact CD1-CE2 3.7Å; V491-F555 HydrophobicContact CB-CE1 4.42Å; V491-F555 HydrophobicContact CB-CZ 4.49Å; V491-F555 HydrophobicContact CG1-CD1 4.31Å; V491-F555 HydrophobicContact CG1-CD2 4.28Å; V491-F555 HydrophobicContact CG1-CE1 3.85Å; V491-F555 HydrophobicContact CG1-CE2 3.84Å; V491-F555 HydrophobicContact CG1-CG 4.5Å; V491-F555 HydrophobicContact CG1-CZ 3.58Å; V491-F555 HydrophobicContact CG2-CD1 4.19Å; V491-F555 HydrophobicContact CG2-CE1 3.92Å; V491-F555 HydrophobicContact CG2-CZ 4.47Å; I495-F555 HydrophobicContact CD1-CE2 3.83Å; I495-F555 HydrophobicContact CD1-CZ 4.45Å; F503-F555 AromaticContact CE1-CE1 3.9Å; F503-F555 HydrophobicContact CE1-CE1 3.9Å; F503-F555 HydrophobicContact CZ-CE1 4.2Å; F551-F555 HydrophobicContact CZ-CB 4.43Å; F551-F555 VanDerWaalsContact O-CB 3.27Å; F551-F555 WeakPolarHBondContact O-CB 3.36Å; F551-F555 PolarHBondContact O-N 2.61Å; L552-F555 WeakPolarHBondContact O-CB 3.34Å; L552-F555 PolarHBondContact O-N 2.75Å; T553-F555 VanDerWaalsContact C-N 3.31Å; T553-F555 PolarHBondContact O-N 3.4Å; F555-F558 PolarHBondContact O-N 2.83Å; F555-L559 HydrophobicContact CD1-CD1 4.06Å; F555-L559 HydrophobicContact CD2-CD1 4.44Å; F555-L559 HydrophobicContact CD2-CG 4.17Å; F555-L559 HydrophobicContact CE1-CD1 3.42Å; F555-L559 VanDerWaalsContact CE1-CD1 3.42Å; F555-L559 HydrophobicContact CE1-CG 4.19Å; F555-L559 HydrophobicContact CE2-CD1 3.85Å; F555-L559 HydrophobicContact CE2-CD2 3.97Å; F555-L559 HydrophobicContact CE2-CG 3.75Å; F555-L559 HydrophobicContact CZ-CD1 3.31Å; F555-L559 HydrophobicContact CZ-CD2 4.1Å; F555-L559 HydrophobicContact CZ-CG 3.77Å; F555-L559 WeakPolarHBondContact O-CB 3.27Å; F555-L559 WeakPolarHBondContact O-CG 3.42Å; F555-L559 PolarHBondContact O-N 3.38Å
556	V	93.5	Very high	90.1	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-70.1	-34	178.6	-61.8	0	0	0	0	113	L504 L552 T553 L559 K560 I574 I575	L504-V556 HydrophobicContact CD2-CG1 3.91Å; L552-V556 WeakPolarHBondContact O-CG2 3.29Å; L552-V556 PolarHBondContact O-N 2.91Å; T553-V556 VanDerWaalsContact O-CG2 3.25Å; T553-V556 WeakPolarHBondContact O-CG2 3.48Å; T553-V556 PolarHBondContact O-N 3.31Å; V556-L559 PolarHBondContact O-N 3.44Å; V556-K560 VanDerWaalsContact O-CB 3.32Å; V556-K560 WeakPolarHBondContact O-CB 3.31Å; V556-K560 PolarHBondContact O-N 3.42Å; V556-I574 HydrophobicContact CG1-CD1 3.69Å; V556-I574 HydrophobicContact CG1-CG2 4.44Å; V556-I574 HydrophobicContact CG2-CG2 4.26Å; V556-I575 HydrophobicContact CG2-CG1 4.42Å
557	L	92.3	Very high	89.6	Confident	18 Å²	18	24.6 Å²	24.6	9%	0.094	15%	0.147	C	C	.	.	H	α-helix	trans	-63	-43.1	172.4	-72.2	173.3	0	0	0	111.4	W46 T553 S561 I575 Y594 A597	W46-L557 VanDerWaalsContact CH2-C 3.46Å; W46-L557 HydrophobicContact CH2-CB 4.15Å; W46-L557 VanDerWaalsContact CH2-O 3.32Å; W46-L557 WeakPolarHBondContact CH2-O 3.46Å; W46-L557 HydrophobicContact CZ2-CB 3.69Å; W46-L557 WeakPolarHBondContact CZ2-O 3.3Å; T553-L557 HydrophobicContact CG2-CD1 4.07Å; T553-L557 WeakPolarHBondContact O-CB 3.38Å; T553-L557 VanDerWaalsContact O-CG 3.24Å; T553-L557 WeakPolarHBondContact O-CG 3.36Å; T553-L557 PolarHBondContact O-N 3.01Å; L557-S561 PolarHBondContact O-N 3.47Å; L557-S561 PolarHBondContact O-OG 3.34Å; L557-I575 HydrophobicContact CD2-CD1 4.16Å; L557-Y594 HydrophobicContact CD1-CD1 4.48Å; L557-Y594 HydrophobicContact CD1-CE1 4.23Å; L557-A597 HydrophobicContact CD2-CB 4.21Å
558	F	92.8	Very high	89.1	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-51.6	173.9	174.3	-97.5	0	0	0	111.4	W46 L53 I56 P57 W101 I104 Y108 H554 F555 K560 S561 A562	W46-F558 HydrophobicContact CH2-CB 4.29Å; W46-F558 HydrophobicContact CZ3-CB 4.08Å; W46-F558 HydrophobicContact CZ3-CD2 4.39Å; L53-F558 HydrophobicContact CD1-CD2 3.7Å; L53-F558 HydrophobicContact CD1-CE2 3.81Å; L53-F558 HydrophobicContact CG-CD2 4.26Å; L53-F558 HydrophobicContact CG-CE2 3.84Å; I56-F558 HydrophobicContact CG2-CD2 4.28Å; P57-F558 HydrophobicContact CG-CD2 4.01Å; P57-F558 HydrophobicContact CG-CE1 4.3Å; P57-F558 HydrophobicContact CG-CE2 3.46Å; P57-F558 VanDerWaalsContact CG-CE2 3.46Å; P57-F558 HydrophobicContact CG-CZ 3.63Å; W101-F558 HydrophobicContact CH2-CB 4.43Å; W101-F558 HydrophobicContact CZ3-CG 4.45Å; I104-F558 HydrophobicContact CG2-CD1 4.12Å; I104-F558 HydrophobicContact CG2-CE1 3.58Å; I104-F558 HydrophobicContact CG2-CZ 4.13Å; Y108-F558 HydrophobicContact CD1-CE1 4.21Å; Y108-F558 AromaticContact CD1-CZ 3.95Å; Y108-F558 HydrophobicContact CD1-CZ 3.95Å; Y108-F558 AromaticContact CD2-CE1 3.65Å; Y108-F558 HydrophobicContact CD2-CE1 3.65Å; Y108-F558 AromaticContact CD2-CZ 3.86Å; Y108-F558 HydrophobicContact CD2-CZ 3.86Å; Y108-F558 HydrophobicContact CE1-CE1 4.18Å; Y108-F558 HydrophobicContact CE1-CZ 4.33Å; Y108-F558 AromaticContact CE2-CE1 3.62Å; Y108-F558 HydrophobicContact CE2-CE1 3.62Å; Y108-F558 HydrophobicContact CE2-CZ 4.24Å; Y108-F558 AromaticContact CG-CE1 3.93Å; Y108-F558 HydrophobicContact CG-CE1 3.93Å; Y108-F558 AromaticContact CG-CZ 3.68Å; Y108-F558 HydrophobicContact CG-CZ 3.68Å; Y108-F558 AromaticContact CZ-CE1 3.87Å; H554-F558 VanDerWaalsContact O-CB 3.26Å; H554-F558 WeakPolarHBondContact O-CB 3.35Å; H554-F558 PolarHBondContact O-N 3.26Å; F555-F558 PolarHBondContact O-N 2.83Å; F558-K560 VanDerWaalsContact C-N 3.35Å; F558-K560 PolarHBondContact O-N 3.26Å; F558-S561 PolarHBondContact O-N 2.89Å; F558-S561 VanDerWaalsContact O-N 3.11Å; F558-A562 HydrophobicContact CE1-CB 4.47Å; F558-A562 HydrophobicContact CZ-CB 4.48Å; F558-A562 WeakPolarHBondContact O-CB 3.4Å; F558-A562 PolarHBondContact O-N 2.87Å
559	L	90.9	Very high	88.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-45.2	178.5	-76.3	-174.8	0	0	0	111.7	Y108 Y500 F555 V556 S561 A562 D563 I566	Y108-L559 WeakPolarHBondContact OH-CD2 3.35Å; Y500-L559 HydrophobicContact CD1-CD1 4.05Å; Y500-L559 HydrophobicContact CE1-CD1 4.06Å; Y500-L559 HydrophobicContact CE1-CD2 3.92Å; F555-L559 HydrophobicContact CD1-CD1 4.06Å; F555-L559 HydrophobicContact CD2-CD1 4.44Å; F555-L559 HydrophobicContact CD2-CG 4.17Å; F555-L559 HydrophobicContact CE1-CD1 3.42Å; F555-L559 VanDerWaalsContact CE1-CD1 3.42Å; F555-L559 HydrophobicContact CE1-CG 4.19Å; F555-L559 HydrophobicContact CE2-CD1 3.85Å; F555-L559 HydrophobicContact CE2-CD2 3.97Å; F555-L559 HydrophobicContact CE2-CG 3.75Å; F555-L559 HydrophobicContact CZ-CD1 3.31Å; F555-L559 HydrophobicContact CZ-CD2 4.1Å; F555-L559 HydrophobicContact CZ-CG 3.77Å; F555-L559 WeakPolarHBondContact O-CB 3.27Å; F555-L559 WeakPolarHBondContact O-CG 3.42Å; F555-L559 PolarHBondContact O-N 3.38Å; V556-L559 PolarHBondContact O-N 3.44Å; L559-S561 PolarHBondContact O-N 3.2Å; L559-A562 PolarHBondContact O-N 3.2Å; L559-A562 VanDerWaalsContact O-N 3.11Å; L559-D563 PolarHBondContact O-N 3.32Å; L559-I566 HydrophobicContact CB-CD1 3.44Å; L559-I566 VanDerWaalsContact CB-CD1 3.44Å; L559-I566 HydrophobicContact CD1-CD1 4.48Å; L559-I566 WeakPolarHBondContact O-CD1 3.49Å
560	K	88.9	Confident	88.3	Confident	70 Å²	70	36.2 Å²	36.2	30%	0.304	21%	0.205	S	C	.	.	H	α-helix	trans	-63.5	-28.7	179.2	-174.2	63.2	168.4	-176	0	113	V556 F558 I566 D568	V556-K560 VanDerWaalsContact O-CB 3.32Å; V556-K560 WeakPolarHBondContact O-CB 3.31Å; V556-K560 PolarHBondContact O-N 3.42Å; F558-K560 VanDerWaalsContact C-N 3.35Å; F558-K560 PolarHBondContact O-N 3.26Å; K560-I566 HydrophobicContact CD-CB 4Å; K560-I566 HydrophobicContact CD-CG2 4.46Å; K560-I566 PolarHBondContact NZ-O 2.92Å; K560-D568 WeakPolarHBondContact CE-OD1 3.49Å; K560-D568 IonicContact NZ-OD1 3.59Å; K560-D568 PolarHBondContact NZ-OD1 2.87Å
561	S	88.8	Confident	87.9	Confident	68 Å²	68	37.1 Å²	37.1	48%	0.476	21%	0.209	S	C	.	.	H	α-helix	trans	-81.7	-28.2	176.6	-54.2	0	0	0	0	112.3	W46 L557 F558 L559	W46-S561 WeakPolarHBondContact CH2-OG 3.15Å; W46-S561 WeakPolarHBondContact CZ2-OG 3.16Å; L557-S561 PolarHBondContact O-N 3.47Å; L557-S561 PolarHBondContact O-OG 3.34Å; F558-S561 PolarHBondContact O-N 2.89Å; F558-S561 VanDerWaalsContact O-N 3.11Å; L559-S561 PolarHBondContact O-N 3.2Å
562	A	87.9	Confident	87.7	Confident	27 Å²	27	37.2 Å²	37.2	22%	0.223	21%	0.21	C	C	.	.	H	α-helix	trans	-89.2	-40.7	-178.4	0	0	0	0	0	112.8	L53 Y108 F558 L559	L53-A562 HydrophobicContact CD2-CB 3.79Å; Y108-A562 HydrophobicContact CD1-CB 4.2Å; Y108-A562 HydrophobicContact CE1-CB 3.53Å; F558-A562 HydrophobicContact CE1-CB 4.47Å; F558-A562 HydrophobicContact CZ-CB 4.48Å; F558-A562 WeakPolarHBondContact O-CB 3.4Å; F558-A562 PolarHBondContact O-N 2.87Å; L559-A562 PolarHBondContact O-N 3.2Å; L559-A562 VanDerWaalsContact O-N 3.11Å
563	D	81.9	Confident	87.5	Confident	43 Å²	43	37.8 Å²	37.8	23%	0.23	21%	0.213	C	C	.	.			trans	-122.2	120.7	-174.9	-63.7	-48.6	0	0	0	109.3	Y108 Y500 L559 D565 I566	Y108-D563 PolarHBondContact OH-OD2 3.17Å; Y500-D563 HydrophobicContact CE2-CB 4.2Å; Y500-D563 WeakPolarHBondContact CE2-OD2 3.23Å; Y500-D563 PolarHBondContact OH-OD2 3.21Å; L559-D563 PolarHBondContact O-N 3.32Å; D563-D565 VanDerWaalsContact C-N 3.32Å; D563-D565 PolarHBondContact O-N 3.45Å; D563-I566 HydrophobicContact CB-CD1 4.38Å
564	S	70.9	Confident	87.4	Confident	97 Å²	97	37.8 Å²	37.8	68%	0.678	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.3	-172.7	51.1	0	0	0	0	114.8	I566	S564-I566 VanDerWaalsContact C-N 3.3Å; S564-I566 PolarHBondContact O-N 2.9Å
565	D	76.6	Confident	87.4	Confident	140 Å²	140	37.8 Å²	37.8	75%	0.749	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	21.2	-160.5	-60.5	-11.7	0	0	0	113.8	D563	D563-D565 VanDerWaalsContact C-N 3.32Å; D563-D565 PolarHBondContact O-N 3.45Å
566	I	78.6	Confident	87.4	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.031	22%	0.215	C	C	.	.			trans	-87.8	127.3	-172.8	-63.4	-179.2	0	0	0	111.6	L504 L559 K560 D563 S564	L504-I566 HydrophobicContact CD1-CG2 3.54Å; L559-I566 HydrophobicContact CB-CD1 3.44Å; L559-I566 VanDerWaalsContact CB-CD1 3.44Å; L559-I566 HydrophobicContact CD1-CD1 4.48Å; L559-I566 WeakPolarHBondContact O-CD1 3.49Å; K560-I566 HydrophobicContact CD-CB 4Å; K560-I566 HydrophobicContact CD-CG2 4.46Å; K560-I566 PolarHBondContact NZ-O 2.92Å; D563-I566 HydrophobicContact CB-CD1 4.38Å; S564-I566 VanDerWaalsContact C-N 3.3Å; S564-I566 PolarHBondContact O-N 2.9Å
567	P	81.5	Confident	87.5	Confident	46 Å²	46	38.2 Å²	38.2	30%	0.299	21%	0.214	S	C	.	.			trans	-68.3	132.5	-177.2	25.3	-33.1	0	0	0	112.9	E569	P567-E569 PolarHBondContact O-N 2.92Å
568	D	83.3	Confident	87.6	Confident	73 Å²	73	37.4 Å²	37.4	39%	0.39	21%	0.21	S	C	.	.	H	α-helix	trans	-67.8	-33.6	-171.1	-72.8	-6.7	0	0	0	114	K560 Y571 S572 P599	K560-D568 WeakPolarHBondContact CE-OD1 3.49Å; K560-D568 IonicContact NZ-OD1 3.59Å; K560-D568 PolarHBondContact NZ-OD1 2.87Å; D568-Y571 VanDerWaalsContact CA-CD1 3.47Å; D568-Y571 VanDerWaalsContact CA-CE1 3.4Å; D568-Y571 HydrophobicContact CB-CD1 4.43Å; D568-Y571 HydrophobicContact CB-CE1 3.87Å; D568-Y571 VanDerWaalsContact O-CD1 3.31Å; D568-Y571 WeakPolarHBondContact O-CD1 3.41Å; D568-Y571 WeakPolarHBondContact O-CE1 3.4Å; D568-Y571 WeakPolarHBondContact OD1-CE1 3.34Å; D568-S572 WeakPolarHBondContact O-CB 3.38Å; D568-S572 PolarHBondContact O-N 2.92Å; D568-P599 HydrophobicContact CB-CB 4.18Å; D568-P599 HydrophobicContact CB-CG 4.25Å
569	E	85.2	Confident	87.7	Confident	157 Å²	157	37.4 Å²	37.4	73%	0.734	21%	0.21	S	C	*	.	H	α-helix	trans	-66.4	-47	-176.5	-168.6	171.1	-166.8	0	0	112	P567 S572 E573	P567-E569 PolarHBondContact O-N 2.92Å; E569-S572 PolarHBondContact O-N 2.81Å; E569-S572 PolarHBondContact O-OG 3.03Å; E569-E573 PolarHBondContact O-N 3.29Å
570	S	85.6	Confident	87.8	Confident	14 Å²	14	37.4 Å²	37.4	10%	0.098	21%	0.21	C	C	.	.	H	α-helix	trans	-69.7	-39.6	-174.9	-64.4	0	0	0	0	112.8	S572	S570-S572 VanDerWaalsContact C-N 3.32Å
571	Y	87.3	Confident	88	Confident	19 Å²	19	34 Å²	34	8%	0.075	20%	0.195	C	C	.	.	H	α-helix	trans	-70.9	-31.7	176.8	91.5	-104.6	0	0	0	111.6	D568 E573 I574 I575 P599	D568-Y571 VanDerWaalsContact CA-CD1 3.47Å; D568-Y571 VanDerWaalsContact CA-CE1 3.4Å; D568-Y571 HydrophobicContact CB-CD1 4.43Å; D568-Y571 HydrophobicContact CB-CE1 3.87Å; D568-Y571 VanDerWaalsContact O-CD1 3.31Å; D568-Y571 WeakPolarHBondContact O-CD1 3.41Å; D568-Y571 WeakPolarHBondContact O-CE1 3.4Å; D568-Y571 WeakPolarHBondContact OD1-CE1 3.34Å; Y571-E573 VanDerWaalsContact C-N 3.28Å; Y571-E573 PolarHBondContact O-N 3.49Å; Y571-I574 PolarHBondContact O-N 3.22Å; Y571-I574 VanDerWaalsContact O-N 3.15Å; Y571-I575 HydrophobicContact CD2-CD1 3.62Å; Y571-I575 HydrophobicContact CD2-CG1 4.19Å; Y571-I575 HydrophobicContact CE2-CD1 3.59Å; Y571-I575 PolarHBondContact O-N 3.31Å; Y571-P599 HydrophobicContact CE1-CG 4.45Å; Y571-P599 VanDerWaalsContact OH-CB 3.29Å; Y571-P599 WeakPolarHBondContact OH-CB 3.38Å; Y571-P599 VanDerWaalsContact OH-CD 3.31Å; Y571-P599 WeakPolarHBondContact OH-CD 3.4Å
572	S	92.4	Very high	88.1	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-37.6	179.5	80.7	0	0	0	0	112	D568 E569 S570 I574 I575 K576	D568-S572 WeakPolarHBondContact O-CB 3.38Å; D568-S572 PolarHBondContact O-N 2.92Å; E569-S572 PolarHBondContact O-N 2.81Å; E569-S572 PolarHBondContact O-OG 3.03Å; S570-S572 VanDerWaalsContact C-N 3.32Å; S572-I574 VanDerWaalsContact C-N 3.31Å; S572-I574 PolarHBondContact O-N 3.11Å; S572-I575 PolarHBondContact O-N 3.01Å; S572-K576 WeakPolarHBondContact O-CB 3.46Å; S572-K576 WeakPolarHBondContact O-CG 3.19Å; S572-K576 PolarHBondContact O-N 3.17Å
573	E	92.7	Very high	88.3	Confident	12 Å²	12	29.7 Å²	29.7	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-33.8	177.7	-67.2	-58.8	121	0	0	112.7	A508 P529 L530 E569 Y571 K576 A577	A508-E573 HydrophobicContact CB-CB 3.88Å; A508-E573 HydrophobicContact CB-CG 4.23Å; P529-E573 WeakPolarHBondContact CB-OE1 3.34Å; L530-E573 WeakPolarHBondContact CB-OE2 3.49Å; L530-E573 WeakPolarHBondContact CD1-O 3.28Å; L530-E573 PolarHBondContact N-OE2 3.02Å; E569-E573 PolarHBondContact O-N 3.29Å; Y571-E573 VanDerWaalsContact C-N 3.28Å; Y571-E573 PolarHBondContact O-N 3.49Å; E573-K576 WeakPolarHBondContact OE1-CD 3.41Å; E573-K576 IonicContact OE1-NZ 2.78Å; E573-K576 PolarHBondContact OE1-NZ 3.36Å; E573-A577 WeakPolarHBondContact O-CB 3.36Å; E573-A577 PolarHBondContact O-N 3.38Å
574	I	94.2	Very high	88.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69	-43.9	176.7	-63.7	166.5	0	0	0	110.5	L504 L507 M511 L552 V556 Y571 S572 A577 Y578	L504-I574 HydrophobicContact CD2-CD1 4.08Å; L507-I574 HydrophobicContact CB-CD1 4.02Å; L507-I574 HydrophobicContact CB-CG1 4.5Å; L507-I574 HydrophobicContact CD1-CD1 4.02Å; M511-I574 HydrophobicContact CG-CG1 4.01Å; M511-I574 HydrophobicContact SD-CB 4.49Å; M511-I574 HydrophobicContact SD-CG1 4.12Å; L552-I574 HydrophobicContact CB-CG2 3.68Å; V556-I574 HydrophobicContact CG1-CD1 3.69Å; V556-I574 HydrophobicContact CG1-CG2 4.44Å; V556-I574 HydrophobicContact CG2-CG2 4.26Å; Y571-I574 PolarHBondContact O-N 3.22Å; Y571-I574 VanDerWaalsContact O-N 3.15Å; S572-I574 VanDerWaalsContact C-N 3.31Å; S572-I574 PolarHBondContact O-N 3.11Å; I574-A577 WeakPolarHBondContact O-CB 3.38Å; I574-A577 PolarHBondContact O-N 2.97Å; I574-Y578 PolarHBondContact O-N 3.26Å
575	I	95.4	Very high	89.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.4	-44.3	176	-58.5	-175.6	0	0	0	110.5	T553 V556 L557 Y571 S572 A577 Y578 L579 A597 L598	T553-I575 HydrophobicContact CG2-CG1 4.22Å; V556-I575 HydrophobicContact CG2-CG1 4.42Å; L557-I575 HydrophobicContact CD2-CD1 4.16Å; Y571-I575 HydrophobicContact CD2-CD1 3.62Å; Y571-I575 HydrophobicContact CD2-CG1 4.19Å; Y571-I575 HydrophobicContact CE2-CD1 3.59Å; Y571-I575 PolarHBondContact O-N 3.31Å; S572-I575 PolarHBondContact O-N 3.01Å; I575-A577 VanDerWaalsContact C-N 3.27Å; I575-A577 PolarHBondContact O-N 2.92Å; I575-Y578 PolarHBondContact O-N 3.42Å; I575-L579 HydrophobicContact CG2-CD1 4.01Å; I575-L579 HydrophobicContact CG2-CG 4.3Å; I575-L579 WeakPolarHBondContact O-CB 3.28Å; I575-L579 WeakPolarHBondContact O-CG 3.26Å; I575-L579 PolarHBondContact O-N 2.69Å; I575-A597 HydrophobicContact CD1-CB 4.4Å; I575-L598 HydrophobicContact CB-CD2 3.88Å; I575-L598 HydrophobicContact CG2-CD2 3.77Å; I575-L598 HydrophobicContact CG2-CG 4.45Å
576	K	95.4	Very high	89.8	Confident	10 Å²	10	28.1 Å²	28.1	4%	0.043	14%	0.14	C	C	.	.	H	α-helix	trans	-56.2	-41	175.5	-74	174.5	-163.4	172.1	0	112.1	L530 S572 E573 Y578 L579 C580 L598 W607	L530-K576 HydrophobicContact CB-CB 4.15Å; L530-K576 HydrophobicContact CB-CD 4.38Å; L530-K576 HydrophobicContact CD1-CB 4.43Å; S572-K576 WeakPolarHBondContact O-CB 3.46Å; S572-K576 WeakPolarHBondContact O-CG 3.19Å; S572-K576 PolarHBondContact O-N 3.17Å; E573-K576 WeakPolarHBondContact OE1-CD 3.41Å; E573-K576 IonicContact OE1-NZ 2.78Å; E573-K576 PolarHBondContact OE1-NZ 3.36Å; K576-Y578 PolarHBondContact O-N 2.81Å; K576-L579 WeakPolarHBondContact O-CB 2.94Å; K576-L579 PolarHBondContact O-N 3.15Å; K576-C580 PolarHBondContact O-N 2.79Å; K576-C580 PolarHBondContact O-SG 3.18Å; K576-C580 VanDerWaalsContact O-SG 3.37Å; K576-L598 HydrophobicContact CG-CD2 4.22Å; K576-W607 HydrophobicContact CB-CH2 3.56Å; K576-W607 HydrophobicContact CB-CZ2 3.56Å; K576-W607 HydrophobicContact CB-CZ3 4.25Å; K576-W607 HydrophobicContact CD-CZ2 3.67Å; K576-W607 HydrophobicContact CG-CD2 4.31Å; K576-W607 HydrophobicContact CG-CH2 3.94Å; K576-W607 HydrophobicContact CG-CZ2 3.45Å; K576-W607 VanDerWaalsContact CG-CZ2 3.45Å; K576-W607 WeakPolarHBondContact O-CH2 3.36Å; K576-W607 WeakPolarHBondContact O-CZ3 3.49Å
577	A	94.3	Very high	90.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-44.5	178.1	0	0	0	0	0	112.4	M511 V515 L530 L549 E573 I574 I575 C580	M511-A577 HydrophobicContact CB-CB 3.87Å; M511-A577 HydrophobicContact CG-CB 4.03Å; M511-A577 HydrophobicContact SD-CB 3.87Å; V515-A577 HydrophobicContact CG2-CB 3.63Å; L530-A577 HydrophobicContact CD1-CB 3.88Å; L549-A577 HydrophobicContact CD1-CB 4.44Å; L549-A577 HydrophobicContact CD2-CB 3.74Å; E573-A577 WeakPolarHBondContact O-CB 3.36Å; E573-A577 PolarHBondContact O-N 3.38Å; I574-A577 WeakPolarHBondContact O-CB 3.38Å; I574-A577 PolarHBondContact O-N 2.97Å; I575-A577 VanDerWaalsContact C-N 3.27Å; I575-A577 PolarHBondContact O-N 2.92Å; A577-C580 WeakPolarHBondContact O-CB 2.93Å; A577-C580 PolarHBondContact O-N 3.29Å
578	Y	95.5	Very high	90.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.9	-38.9	175.3	-177.9	-134	0	0	0	112.3	F39 L549 R550 T553 I574 I575 K576 C580 F581 L582 Y594	F39-Y578 HydrophobicContact CD1-CE2 4.1Å; F39-Y578 WeakPolarHBondContact CD1-OH 3.47Å; F39-Y578 HydrophobicContact CE1-CE2 4.21Å; L549-Y578 HydrophobicContact CB-CD2 4.02Å; L549-Y578 HydrophobicContact CB-CG 4.39Å; R550-Y578 HydrophobicContact CB-CD2 4.34Å; R550-Y578 HydrophobicContact CB-CE2 3.77Å; R550-Y578 HydrophobicContact CG-CE2 4.48Å; T553-Y578 HydrophobicContact CG2-CD1 3.98Å; T553-Y578 VanDerWaalsContact OG1-CB 3.22Å; T553-Y578 WeakPolarHBondContact OG1-CB 3.37Å; I574-Y578 PolarHBondContact O-N 3.26Å; I575-Y578 PolarHBondContact O-N 3.42Å; K576-Y578 PolarHBondContact O-N 2.81Å; Y578-C580 PolarHBondContact O-N 3.05Å; Y578-F581 PolarHBondContact O-N 3.1Å; Y578-L582 HydrophobicContact CD1-CD1 3.93Å; Y578-L582 HydrophobicContact CD1-CG 4.44Å; Y578-L582 HydrophobicContact CD2-CG 4.39Å; Y578-L582 HydrophobicContact CE1-CD1 3.61Å; Y578-L582 HydrophobicContact CE1-CD2 4.38Å; Y578-L582 HydrophobicContact CE1-CG 4.14Å; Y578-L582 HydrophobicContact CE2-CD1 4.44Å; Y578-L582 HydrophobicContact CE2-CD2 4Å; Y578-L582 HydrophobicContact CE2-CG 4.06Å; Y578-L582 HydrophobicContact CG-CD1 4.48Å; Y578-L582 PolarHBondContact O-N 3.12Å; Y578-L582 VanDerWaalsContact O-N 3.11Å; Y578-Y594 HydrophobicContact CD1-CD2 4.4Å; Y578-Y594 HydrophobicContact CD1-CE1 4.49Å; Y578-Y594 HydrophobicContact CD1-CE2 4.43Å; Y578-Y594 HydrophobicContact CD1-CG 4.46Å; Y578-Y594 HydrophobicContact CE1-CD1 4.48Å; Y578-Y594 AromaticContact CE1-CD2 3.97Å; Y578-Y594 HydrophobicContact CE1-CD2 3.97Å; Y578-Y594 HydrophobicContact CE1-CE1 4.14Å; Y578-Y594 AromaticContact CE1-CE2 3.62Å; Y578-Y594 HydrophobicContact CE1-CE2 3.62Å; Y578-Y594 HydrophobicContact CE1-CG 4.4Å; Y578-Y594 AromaticContact CE1-CZ 3.7Å
579	L	95	Very high	91.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.4	-36.3	173.6	-79.7	170.3	0	0	0	112.3	I575 K576 F581 L582 I583 V591 V595 L598 W607	I575-L579 HydrophobicContact CG2-CD1 4.01Å; I575-L579 HydrophobicContact CG2-CG 4.3Å; I575-L579 WeakPolarHBondContact O-CB 3.28Å; I575-L579 WeakPolarHBondContact O-CG 3.26Å; I575-L579 PolarHBondContact O-N 2.69Å; K576-L579 WeakPolarHBondContact O-CB 2.94Å; K576-L579 PolarHBondContact O-N 3.15Å; L579-F581 VanDerWaalsContact C-N 3.28Å; L579-F581 PolarHBondContact O-N 3.49Å; L579-L582 HydrophobicContact CD2-CD1 4.47Å; L579-L582 PolarHBondContact O-N 3.22Å; L579-I583 HydrophobicContact CB-CD1 4.48Å; L579-I583 VanDerWaalsContact O-CB 3.28Å; L579-I583 WeakPolarHBondContact O-CB 3.21Å; L579-I583 WeakPolarHBondContact O-CG1 3.2Å; L579-I583 PolarHBondContact O-N 3.45Å; L579-V591 HydrophobicContact CD2-CG1 4.45Å; L579-V595 HydrophobicContact CD1-CG2 3.82Å; L579-V595 HydrophobicContact CD2-CG2 3.64Å; L579-V595 HydrophobicContact CG-CG2 4.39Å; L579-L598 HydrophobicContact CD1-CD1 4.04Å; L579-L598 HydrophobicContact CD1-CD2 4.49Å; L579-L598 HydrophobicContact CD1-CG 4.37Å; L579-W607 HydrophobicContact CB-CE3 3.85Å; L579-W607 HydrophobicContact CB-CZ3 3.71Å; L579-W607 HydrophobicContact CD1-CE3 4.01Å
580	C	93.1	Very high	91.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-55.4	-43.1	174.3	-69.9	0	0	0	0	112.3	V515 L519 P533 K576 A577 Y578 V584	V515-C580 HydrophobicContact CG1-CB 3.82Å; L519-C580 HydrophobicContact CD1-CB 3.98Å; P533-C580 HydrophobicContact CG-CB 4.39Å; K576-C580 PolarHBondContact O-N 2.79Å; K576-C580 PolarHBondContact O-SG 3.18Å; K576-C580 VanDerWaalsContact O-SG 3.37Å; A577-C580 WeakPolarHBondContact O-CB 2.93Å; A577-C580 PolarHBondContact O-N 3.29Å; Y578-C580 PolarHBondContact O-N 3.05Å; C580-V584 VanDerWaalsContact O-CG2 3.29Å; C580-V584 WeakPolarHBondContact O-CG2 3.49Å; C580-V584 PolarHBondContact O-N 3.27Å; C580-V584 VanDerWaalsContact O-N 3.13Å
581	F	91.9	Very high	92	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.6	-45.3	177.3	-82	-105.9	0	0	0	112	V515 L519 V545 C546 L549 Y578 L579 I583 V584 N585	V515-F581 HydrophobicContact CG1-CE2 4.47Å; V515-F581 HydrophobicContact CG2-CE2 4.49Å; L519-F581 HydrophobicContact CD1-CD2 4.28Å; L519-F581 HydrophobicContact CD1-CE2 4.27Å; L519-F581 HydrophobicContact CD2-CD1 3.76Å; L519-F581 HydrophobicContact CD2-CD2 4.13Å; L519-F581 HydrophobicContact CD2-CE1 3.7Å; L519-F581 HydrophobicContact CD2-CE2 4.07Å; L519-F581 HydrophobicContact CD2-CG 3.99Å; L519-F581 HydrophobicContact CD2-CZ 3.86Å; L519-F581 HydrophobicContact CG-CD2 4.12Å; L519-F581 HydrophobicContact CG-CE1 4.21Å; L519-F581 HydrophobicContact CG-CE2 3.77Å; L519-F581 HydrophobicContact CG-CG 4.48Å; L519-F581 HydrophobicContact CG-CZ 3.83Å; V545-F581 HydrophobicContact CB-CZ 4.13Å; V545-F581 HydrophobicContact CG1-CE1 4.47Å; V545-F581 HydrophobicContact CG1-CE2 4.08Å; V545-F581 HydrophobicContact CG1-CZ 3.63Å; C546-F581 HydrophobicContact CB-CD1 3.65Å; C546-F581 HydrophobicContact CB-CE1 3.96Å; C546-F581 HydrophobicContact CB-CG 4.37Å; L549-F581 HydrophobicContact CD1-CD2 3.48Å; L549-F581 VanDerWaalsContact CD1-CD2 3.48Å; L549-F581 HydrophobicContact CD1-CE2 3.36Å; L549-F581 HydrophobicContact CD1-CG 4.42Å; L549-F581 HydrophobicContact CD1-CZ 4.23Å; Y578-F581 PolarHBondContact O-N 3.1Å; L579-F581 VanDerWaalsContact C-N 3.28Å; L579-F581 PolarHBondContact O-N 3.49Å; F581-I583 VanDerWaalsContact C-N 3.29Å; F581-I583 PolarHBondContact O-N 3.39Å; F581-V584 PolarHBondContact O-N 3.31Å; F581-N585 WeakPolarHBondContact O-CB 3.45Å; F581-N585 PolarHBondContact O-N 2.82Å
582	L	92	Very high	92.3	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-61.5	-38.7	179.1	-65.1	179.6	0	0	0	112.3	Y578 L579 N585 K586 E587 L590 V591 Y594	Y578-L582 HydrophobicContact CD1-CD1 3.93Å; Y578-L582 HydrophobicContact CD1-CG 4.44Å; Y578-L582 HydrophobicContact CD2-CG 4.39Å; Y578-L582 HydrophobicContact CE1-CD1 3.61Å; Y578-L582 HydrophobicContact CE1-CD2 4.38Å; Y578-L582 HydrophobicContact CE1-CG 4.14Å; Y578-L582 HydrophobicContact CE2-CD1 4.44Å; Y578-L582 HydrophobicContact CE2-CD2 4Å; Y578-L582 HydrophobicContact CE2-CG 4.06Å; Y578-L582 HydrophobicContact CG-CD1 4.48Å; Y578-L582 PolarHBondContact O-N 3.12Å; Y578-L582 VanDerWaalsContact O-N 3.11Å; L579-L582 HydrophobicContact CD2-CD1 4.47Å; L579-L582 PolarHBondContact O-N 3.22Å; L582-N585 PolarHBondContact O-N 2.8Å; L582-K586 PolarHBondContact O-N 3.28Å; L582-E587 HydrophobicContact CB-CB 4.43Å; L582-E587 HydrophobicContact CD2-CB 4.04Å; L582-E587 HydrophobicContact CD2-CG 4.19Å; L582-E587 PolarHBondContact O-N 3.43Å; L582-L590 HydrophobicContact CD1-CB 3.92Å; L582-L590 HydrophobicContact CD2-CB 4.15Å; L582-L590 HydrophobicContact CD2-CD1 3.93Å; L582-V591 HydrophobicContact CB-CG2 3.65Å; L582-Y594 HydrophobicContact CD1-CD2 3.41Å; L582-Y594 VanDerWaalsContact CD1-CD2 3.41Å; L582-Y594 HydrophobicContact CD1-CE2 3.91Å; L582-Y594 HydrophobicContact CD1-CG 4.28Å
583	I	91.1	Very high	92.4	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-66.3	-45.2	176.7	-73	169.1	0	0	0	110.7	P533 L535 L579 F581 N585 K586 V591 W607 F611	P533-I583 HydrophobicContact CG-CB 4.08Å; P533-I583 HydrophobicContact CG-CG2 3.64Å; L535-I583 HydrophobicContact CD1-CG2 3.76Å; L535-I583 HydrophobicContact CD2-CG2 4.02Å; L535-I583 HydrophobicContact CG-CG2 4.22Å; L579-I583 HydrophobicContact CB-CD1 4.48Å; L579-I583 VanDerWaalsContact O-CB 3.28Å; L579-I583 WeakPolarHBondContact O-CB 3.21Å; L579-I583 WeakPolarHBondContact O-CG1 3.2Å; L579-I583 PolarHBondContact O-N 3.45Å; F581-I583 VanDerWaalsContact C-N 3.29Å; F581-I583 PolarHBondContact O-N 3.39Å; I583-N585 VanDerWaalsContact C-N 3.34Å; I583-K586 PolarHBondContact O-N 2.94Å; I583-V591 HydrophobicContact CG1-CG1 4.04Å; I583-V591 HydrophobicContact CG1-CG2 3.95Å; I583-W607 HydrophobicContact CD1-CE3 3.95Å; I583-W607 HydrophobicContact CD1-CZ3 4.23Å; I583-F611 HydrophobicContact CB-CD2 4.39Å; I583-F611 HydrophobicContact CG1-CB 4.36Å; I583-F611 HydrophobicContact CG1-CD2 4.05Å; I583-F611 HydrophobicContact CG1-CG 4.48Å; I583-F611 HydrophobicContact CG2-CD2 4.12Å
584	V	87.9	Confident	92.6	Very high	31 Å²	31	23.9 Å²	23.9	19%	0.188	12%	0.117	C	C	.	.	H	α-helix	trans	-64.3	-39.6	176.9	170	0	0	0	0	111.6	L519 I523 P533 L535 T541 C580 F581 K586	L519-V584 HydrophobicContact CD1-CG2 4.1Å; L519-V584 HydrophobicContact CD2-CB 4.33Å; L519-V584 HydrophobicContact CD2-CG1 4.28Å; L519-V584 HydrophobicContact CD2-CG2 4.32Å; I523-V584 HydrophobicContact CG2-CG2 4.42Å; P533-V584 HydrophobicContact CB-CG2 4.1Å; P533-V584 HydrophobicContact CG-CG2 4.17Å; L535-V584 HydrophobicContact CD2-CB 4.5Å; L535-V584 HydrophobicContact CD2-CG2 4.01Å; T541-V584 HydrophobicContact CG2-CG1 4.21Å; C580-V584 VanDerWaalsContact O-CG2 3.29Å; C580-V584 WeakPolarHBondContact O-CG2 3.49Å; C580-V584 PolarHBondContact O-N 3.27Å; C580-V584 VanDerWaalsContact O-N 3.13Å; F581-V584 PolarHBondContact O-N 3.31Å; V584-K586 VanDerWaalsContact C-N 3.25Å; V584-K586 PolarHBondContact O-N 3.2Å
585	N	86	Confident	92.6	Very high	56 Å²	56	23.9 Å²	23.9	30%	0.299	12%	0.117	S	C	.	.	H	α-helix	trans	-78.1	-6.3	177.8	-67.9	-11.4	0	0	0	113.6	F581 L582 I583 E587	F581-N585 WeakPolarHBondContact O-CB 3.45Å; F581-N585 PolarHBondContact O-N 2.82Å; L582-N585 PolarHBondContact O-N 2.8Å; I583-N585 VanDerWaalsContact C-N 3.34Å; N585-E587 VanDerWaalsContact C-N 3.32Å; N585-E587 HydrophobicContact CB-CG 4.07Å; N585-E587 PolarHBondContact O-N 3.25Å
586	K	87	Confident	92.6	Very high	160 Å²	160	25.3 Å²	25.3	70%	0.696	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	35.1	-178.6	-55.1	-176.2	177.8	-175.3	0	114.5	L582 I583 V584 T588	L582-K586 PolarHBondContact O-N 3.28Å; I583-K586 PolarHBondContact O-N 2.94Å; V584-K586 VanDerWaalsContact C-N 3.25Å; V584-K586 PolarHBondContact O-N 3.2Å; K586-T588 VanDerWaalsContact C-N 3.28Å; K586-T588 PolarHBondContact O-N 3.26Å
587	E	88.8	Confident	92.4	Very high	83 Å²	83	25.9 Å²	25.9	39%	0.388	13%	0.134	S	C	.	.			trans	-76.3	73.2	177.5	-68	-65.2	169	0	0	111.7	L582 N585 D589 L590 V591	L582-E587 HydrophobicContact CB-CB 4.43Å; L582-E587 HydrophobicContact CD2-CB 4.04Å; L582-E587 HydrophobicContact CD2-CG 4.19Å; L582-E587 PolarHBondContact O-N 3.43Å; N585-E587 VanDerWaalsContact C-N 3.32Å; N585-E587 HydrophobicContact CB-CG 4.07Å; N585-E587 PolarHBondContact O-N 3.25Å; E587-D589 PolarHBondContact O-N 3.38Å; E587-L590 HydrophobicContact CB-CB 4.12Å; E587-L590 HydrophobicContact CB-CD1 4.13Å; E587-L590 HydrophobicContact CB-CG 4.36Å; E587-L590 HydrophobicContact CG-CD1 4.4Å; E587-L590 PolarHBondContact O-N 3.22Å; E587-L590 VanDerWaalsContact O-N 3.12Å; E587-V591 WeakPolarHBondContact O-CG2 3.36Å; E587-V591 PolarHBondContact O-N 2.84Å
588	T	91	Very high	92.4	Very high	38 Å²	38	26.1 Å²	26.1	23%	0.233	14%	0.135	C	C	.	.	H	α-helix	trans	-48.8	-50.9	-169.4	53.8	0	0	0	0	114.5	K586 L590 V591 A592 F611	K586-T588 VanDerWaalsContact C-N 3.28Å; K586-T588 PolarHBondContact O-N 3.26Å; T588-L590 VanDerWaalsContact C-N 3.35Å; T588-L590 PolarHBondContact O-N 2.92Å; T588-V591 PolarHBondContact O-N 2.84Å; T588-A592 PolarHBondContact O-N 3.24Å; T588-A592 VanDerWaalsContact O-N 3.14Å; T588-F611 HydrophobicContact CG2-CE1 4.35Å; T588-F611 HydrophobicContact CG2-CZ 3.85Å
589	D	91.8	Very high	92.1	Very high	80 Å²	80	28 Å²	28	43%	0.428	15%	0.147	S	C	.	.	H	α-helix	trans	-66.8	-35.8	-176.9	-65.2	-33.4	0	0	0	112.5	E587 Y593 H623 L627	E587-D589 PolarHBondContact O-N 3.38Å; D589-Y593 PolarHBondContact O-N 3.11Å; D589-H623 IonicContact OD1-CE1 3.84Å; D589-H623 IonicContact OD1-NE2 3.57Å; D589-H623 PolarHBondContact OD1-NE2 3.36Å; D589-L627 WeakPolarHBondContact OD1-CD1 3.06Å
590	L	94.1	Very high	91.8	Very high	9 Å²	9	32.1 Å²	32.1	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-74.2	-44.1	178.3	-60.9	-178	0	0	0	110.9	F39 P40 C43 L582 E587 T588 A592 Y593 Y594	F39-L590 HydrophobicContact CB-CD1 3.8Å; P40-L590 HydrophobicContact CB-CD2 4.49Å; C43-L590 HydrophobicContact CB-CD2 3.68Å; L582-L590 HydrophobicContact CD1-CB 3.92Å; L582-L590 HydrophobicContact CD2-CB 4.15Å; L582-L590 HydrophobicContact CD2-CD1 3.93Å; E587-L590 HydrophobicContact CB-CB 4.12Å; E587-L590 HydrophobicContact CB-CD1 4.13Å; E587-L590 HydrophobicContact CB-CG 4.36Å; E587-L590 HydrophobicContact CG-CD1 4.4Å; E587-L590 PolarHBondContact O-N 3.22Å; E587-L590 VanDerWaalsContact O-N 3.12Å; T588-L590 VanDerWaalsContact C-N 3.35Å; T588-L590 PolarHBondContact O-N 2.92Å; L590-A592 VanDerWaalsContact C-N 3.32Å; L590-A592 PolarHBondContact O-N 2.76Å; L590-Y593 PolarHBondContact O-N 2.67Å; L590-Y593 VanDerWaalsContact O-N 3.14Å; L590-Y594 HydrophobicContact CB-CD2 4.2Å; L590-Y594 HydrophobicContact CB-CE2 4.11Å; L590-Y594 HydrophobicContact CD2-CE2 4.26Å; L590-Y594 WeakPolarHBondContact O-CD2 3.49Å; L590-Y594 PolarHBondContact O-N 2.98Å
591	V	94.7	Very high	91.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-55.5	-49.5	176.7	173.6	0	0	0	0	110.2	L579 L582 I583 E587 T588 Y593 Y594 V595 Y608 F611	L579-V591 HydrophobicContact CD2-CG1 4.45Å; L582-V591 HydrophobicContact CB-CG2 3.65Å; I583-V591 HydrophobicContact CG1-CG1 4.04Å; I583-V591 HydrophobicContact CG1-CG2 3.95Å; E587-V591 WeakPolarHBondContact O-CG2 3.36Å; E587-V591 PolarHBondContact O-N 2.84Å; T588-V591 PolarHBondContact O-N 2.84Å; V591-Y593 VanDerWaalsContact C-N 3.28Å; V591-Y593 PolarHBondContact O-N 2.89Å; V591-Y594 PolarHBondContact O-N 3.44Å; V591-V595 HydrophobicContact CG1-CG2 4.05Å; V591-V595 WeakPolarHBondContact O-CB 3.46Å; V591-V595 WeakPolarHBondContact O-CG2 3.5Å; V591-V595 PolarHBondContact O-N 2.85Å; V591-Y608 HydrophobicContact CG1-CD2 4.18Å; V591-Y608 HydrophobicContact CG1-CE2 4.31Å; V591-F611 HydrophobicContact CB-CD1 4.48Å; V591-F611 HydrophobicContact CB-CE1 4.38Å; V591-F611 HydrophobicContact CG1-CB 4.23Å; V591-F611 HydrophobicContact CG1-CD1 3.79Å; V591-F611 HydrophobicContact CG1-CD2 4.26Å; V591-F611 HydrophobicContact CG1-CE1 4.18Å; V591-F611 HydrophobicContact CG1-CG 3.82Å; V591-F611 HydrophobicContact CG2-CE2 4.36Å; V591-F611 HydrophobicContact CG2-CZ 4.49Å
592	A	94.2	Very high	91.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.8	-41.7	179.4	0	0	0	0	0	112.3	T588 L590 S596 Y608 L627 Y631	T588-A592 PolarHBondContact O-N 3.24Å; T588-A592 VanDerWaalsContact O-N 3.14Å; L590-A592 VanDerWaalsContact C-N 3.32Å; L590-A592 PolarHBondContact O-N 2.76Å; A592-S596 PolarHBondContact O-N 3.46Å; A592-Y608 HydrophobicContact CB-CE2 3.87Å; A592-L627 HydrophobicContact CB-CB 3.86Å; A592-L627 HydrophobicContact CB-CD1 3.94Å; A592-L627 HydrophobicContact CB-CG 4.49Å; A592-Y631 HydrophobicContact CB-CD2 3.85Å; A592-Y631 HydrophobicContact CB-CE2 3.73Å
593	Y	94.9	Very high	91.6	Very high	31 Å²	31	41.6 Å²	41.6	12%	0.122	23%	0.225	C	C	.	.	H	α-helix	trans	-67.1	-54.4	178.4	180	-106.3	0	0	0	112.9	C43 W46 K47 D589 L590 V591 V595 S596 A597 Y631	C43-Y593 WeakPolarHBondContact SG-CD1 3.46Å; W46-Y593 AromaticContact CD1-CZ 3.96Å; W46-Y593 PolarHBondContact NE1-OH 3.26Å; K47-Y593 HydrophobicContact CD-CD2 4.31Å; K47-Y593 HydrophobicContact CD-CE2 4.28Å; K47-Y593 HydrophobicContact CG-CD2 4.38Å; K47-Y593 HydrophobicContact CG-CE2 3.85Å; D589-Y593 PolarHBondContact O-N 3.11Å; L590-Y593 PolarHBondContact O-N 2.67Å; L590-Y593 VanDerWaalsContact O-N 3.14Å; V591-Y593 VanDerWaalsContact C-N 3.28Å; V591-Y593 PolarHBondContact O-N 2.89Å; Y593-V595 VanDerWaalsContact C-N 3.29Å; Y593-V595 PolarHBondContact O-N 2.92Å; Y593-S596 WeakPolarHBondContact O-CB 3.48Å; Y593-S596 PolarHBondContact O-N 3.32Å; Y593-S596 PolarHBondContact O-OG 3.41Å; Y593-A597 PolarHBondContact O-N 3.32Å; Y593-Y631 HydrophobicContact CD2-CD1 4.26Å; Y593-Y631 AromaticContact CD2-CE1 3.61Å; Y593-Y631 HydrophobicContact CD2-CE1 3.61Å; Y593-Y631 HydrophobicContact CE2-CE1 4.45Å; Y593-Y631 HydrophobicContact CG-CE1 4.49Å
594	Y	95.7	Very high	91.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-71.3	-26.2	-175.4	-68.1	-73.9	0	0	0	112.6	T553 H554 L557 Y578 L582 L590 V591 S596 A597	T553-Y594 HydrophobicContact CG2-CD1 3.75Å; T553-Y594 HydrophobicContact CG2-CE1 3.73Å; H554-Y594 PolarHBondContact CE1-OH 3.34Å; H554-Y594 AromaticContact NE2-CE1 3.92Å; H554-Y594 AromaticContact NE2-CZ 3.68Å; H554-Y594 PolarHBondContact NE2-OH 3.06Å; L557-Y594 HydrophobicContact CD1-CD1 4.48Å; L557-Y594 HydrophobicContact CD1-CE1 4.23Å; Y578-Y594 HydrophobicContact CD1-CD2 4.4Å; Y578-Y594 HydrophobicContact CD1-CE1 4.49Å; Y578-Y594 HydrophobicContact CD1-CE2 4.43Å; Y578-Y594 HydrophobicContact CD1-CG 4.46Å; Y578-Y594 HydrophobicContact CE1-CD1 4.48Å; Y578-Y594 AromaticContact CE1-CD2 3.97Å; Y578-Y594 HydrophobicContact CE1-CD2 3.97Å; Y578-Y594 HydrophobicContact CE1-CE1 4.14Å; Y578-Y594 AromaticContact CE1-CE2 3.62Å; Y578-Y594 HydrophobicContact CE1-CE2 3.62Å; Y578-Y594 HydrophobicContact CE1-CG 4.4Å; Y578-Y594 AromaticContact CE1-CZ 3.7Å; L582-Y594 HydrophobicContact CD1-CD2 3.41Å; L582-Y594 VanDerWaalsContact CD1-CD2 3.41Å; L582-Y594 HydrophobicContact CD1-CE2 3.91Å; L582-Y594 HydrophobicContact CD1-CG 4.28Å; L590-Y594 HydrophobicContact CB-CD2 4.2Å; L590-Y594 HydrophobicContact CB-CE2 4.11Å; L590-Y594 HydrophobicContact CD2-CE2 4.26Å; L590-Y594 WeakPolarHBondContact O-CD2 3.49Å; L590-Y594 PolarHBondContact O-N 2.98Å; V591-Y594 PolarHBondContact O-N 3.44Å; Y594-S596 VanDerWaalsContact C-N 3.35Å; Y594-A597 WeakPolarHBondContact O-CB 3.21Å; Y594-A597 PolarHBondContact O-N 2.88Å
595	V	95.9	Very high	92.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-41.3	168.9	-179.8	0	0	0	0	110.2	L579 V591 Y593 A597 L598 Q604 W607 Y608 F633	L579-V595 HydrophobicContact CD1-CG2 3.82Å; L579-V595 HydrophobicContact CD2-CG2 3.64Å; L579-V595 HydrophobicContact CG-CG2 4.39Å; V591-V595 HydrophobicContact CG1-CG2 4.05Å; V591-V595 WeakPolarHBondContact O-CB 3.46Å; V591-V595 WeakPolarHBondContact O-CG2 3.5Å; V591-V595 PolarHBondContact O-N 2.85Å; Y593-V595 VanDerWaalsContact C-N 3.29Å; Y593-V595 PolarHBondContact O-N 2.92Å; V595-A597 PolarHBondContact O-N 3.33Å; V595-A597 VanDerWaalsContact O-N 3.16Å; V595-L598 HydrophobicContact CG1-CD1 4.27Å; V595-L598 WeakPolarHBondContact O-CB 3.45Å; V595-L598 PolarHBondContact O-N 3.02Å; V595-Q604 HydrophobicContact CG1-CB 4.13Å; V595-Q604 VanDerWaalsContact CG1-O 3.24Å; V595-Q604 WeakPolarHBondContact CG1-O 3.48Å; V595-Q604 WeakPolarHBondContact O-CG 3.32Å; V595-W607 HydrophobicContact CG1-CB 4.22Å; V595-W607 HydrophobicContact CG2-CB 4.21Å; V595-Y608 HydrophobicContact CG2-CD2 4.44Å; V595-F633 HydrophobicContact CB-CE1 4.48Å; V595-F633 HydrophobicContact CB-CZ 4.09Å; V595-F633 HydrophobicContact CG1-CE1 3.83Å; V595-F633 HydrophobicContact CG1-CZ 3.93Å
596	S	93.4	Very high	92.4	Very high	31 Å²	31	44.3 Å²	44.3	22%	0.217	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-21	175.9	77.8	0	0	0	0	113.8	A592 Y593 Y594 L598 Q604	A592-S596 PolarHBondContact O-N 3.46Å; Y593-S596 WeakPolarHBondContact O-CB 3.48Å; Y593-S596 PolarHBondContact O-N 3.32Å; Y593-S596 PolarHBondContact O-OG 3.41Å; Y594-S596 VanDerWaalsContact C-N 3.35Å; S596-L598 VanDerWaalsContact C-N 3.32Å; S596-Q604 PolarHBondContact O-NE2 2.8Å
597	A	92.4	Very high	92.7	Very high	22 Å²	22	36.8 Å²	36.8	18%	0.182	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-4.1	176	0	0	0	0	0	114	L557 I575 Y593 Y594 V595	L557-A597 HydrophobicContact CD2-CB 4.21Å; I575-A597 HydrophobicContact CD1-CB 4.4Å; Y593-A597 PolarHBondContact O-N 3.32Å; Y594-A597 WeakPolarHBondContact O-CB 3.21Å; Y594-A597 PolarHBondContact O-N 2.88Å; V595-A597 PolarHBondContact O-N 3.33Å; V595-A597 VanDerWaalsContact O-N 3.16Å
598	L	93.2	Very high	93	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	18%	0.183	C	C	.	.	S	Bend	trans	-73	146.5	172.7	-65.4	176.2	0	0	0	110.8	I575 K576 L579 V595 S596 N600 L603 Q604 W607	I575-L598 HydrophobicContact CB-CD2 3.88Å; I575-L598 HydrophobicContact CG2-CD2 3.77Å; I575-L598 HydrophobicContact CG2-CG 4.45Å; K576-L598 HydrophobicContact CG-CD2 4.22Å; L579-L598 HydrophobicContact CD1-CD1 4.04Å; L579-L598 HydrophobicContact CD1-CD2 4.49Å; L579-L598 HydrophobicContact CD1-CG 4.37Å; V595-L598 HydrophobicContact CG1-CD1 4.27Å; V595-L598 WeakPolarHBondContact O-CB 3.45Å; V595-L598 PolarHBondContact O-N 3.02Å; S596-L598 VanDerWaalsContact C-N 3.32Å; L598-N600 PolarHBondContact O-N 3.09Å; L598-L603 HydrophobicContact CD1-CB 4.35Å; L598-Q604 HydrophobicContact CB-CG 4.05Å; L598-Q604 PolarHBondContact O-NE2 2.93Å; L598-W607 HydrophobicContact CD1-CB 4.42Å; L598-W607 HydrophobicContact CD1-CG 4.27Å
599	P	89.5	Confident	93.1	Very high	39 Å²	39	31 Å²	31	25%	0.253	17%	0.172	S	C	.	.	S	Bend	trans	-68.6	-38	-170.8	20.1	-28	0	0	0	114.1	D568 Y571	D568-P599 HydrophobicContact CB-CB 4.18Å; D568-P599 HydrophobicContact CB-CG 4.25Å; Y571-P599 HydrophobicContact CE1-CG 4.45Å; Y571-P599 VanDerWaalsContact OH-CB 3.29Å; Y571-P599 WeakPolarHBondContact OH-CB 3.38Å; Y571-P599 VanDerWaalsContact OH-CD 3.31Å; Y571-P599 WeakPolarHBondContact OH-CD 3.4Å
600	N	89.3	Confident	93	Very high	88 Å²	88	30.2 Å²	30.2	47%	0.471	16%	0.163	S	C	.	.			trans	-106.1	130.8	-168.5	-60.5	-28.3	0	0	0	111.6	L598 S602 L603 Q604	L598-N600 PolarHBondContact O-N 3.09Å; N600-S602 PolarHBondContact O-N 3.44Å; N600-S602 VanDerWaalsContact O-N 3.16Å; N600-L603 HydrophobicContact CB-CB 4.28Å; N600-L603 HydrophobicContact CB-CD1 4.02Å; N600-L603 HydrophobicContact CB-CG 4.11Å; N600-L603 WeakPolarHBondContact O-CB 3.43Å; N600-L603 PolarHBondContact O-N 2.8Å; N600-Q604 WeakPolarHBondContact O-CG 3.32Å; N600-Q604 PolarHBondContact O-N 3.05Å
601	E	91.7	Very high	92.9	Very high	77 Å²	77	30.3 Å²	30.3	36%	0.36	16%	0.163	S	C	.	.	H	α-helix	trans	-52.6	-39.6	175.2	-167.6	-163.9	174.7	0	0	111.7	L603 Q604 I605 N634 K637	E601-L603 PolarHBondContact O-N 3.29Å; E601-Q604 WeakPolarHBondContact O-CB 3.3Å; E601-Q604 PolarHBondContact O-N 2.82Å; E601-I605 HydrophobicContact CG-CD1 3.82Å; E601-I605 HydrophobicContact CG-CG1 4.48Å; E601-I605 WeakPolarHBondContact O-CB 3.32Å; E601-I605 VanDerWaalsContact O-CG1 3.31Å; E601-I605 WeakPolarHBondContact O-CG1 3.39Å; E601-I605 PolarHBondContact O-N 3.29Å; E601-N634 WeakPolarHBondContact OE1-CB 3.33Å; E601-N634 PolarHBondContact OE1-ND2 2.95Å; E601-K637 WeakPolarHBondContact OE1-CD 3.37Å; E601-K637 IonicContact OE1-NZ 3.58Å; E601-K637 PolarHBondContact OE1-NZ 3.11Å; E601-K637 IonicContact OE2-NZ 3.77Å; E601-K637 PolarHBondContact OE2-NZ 3.32Å
602	S	91	Very high	92.7	Very high	95 Å²	95	30.3 Å²	30.3	66%	0.664	16%	0.163	S	C	*	.	H	α-helix	trans	-60.8	-41.5	177.6	-56.1	0	0	0	0	112.8	N600 E606	N600-S602 PolarHBondContact O-N 3.44Å; N600-S602 VanDerWaalsContact O-N 3.16Å; S602-E606 VanDerWaalsContact O-CB 3.32Å; S602-E606 WeakPolarHBondContact O-CB 3.45Å; S602-E606 PolarHBondContact O-N 3.11Å
603	L	91.1	Very high	92.4	Very high	29 Å²	29	31.1 Å²	31.1	15%	0.152	17%	0.169	C	C	.	.	H	α-helix	trans	-70.5	-41	176.9	-71.3	173.1	0	0	0	110.9	L598 N600 E601 I605 E606 W607	L598-L603 HydrophobicContact CD1-CB 4.35Å; N600-L603 HydrophobicContact CB-CB 4.28Å; N600-L603 HydrophobicContact CB-CD1 4.02Å; N600-L603 HydrophobicContact CB-CG 4.11Å; N600-L603 WeakPolarHBondContact O-CB 3.43Å; N600-L603 PolarHBondContact O-N 2.8Å; E601-L603 PolarHBondContact O-N 3.29Å; L603-I605 VanDerWaalsContact C-N 3.33Å; L603-I605 PolarHBondContact O-N 3.3Å; L603-E606 PolarHBondContact O-N 3.14Å; L603-W607 WeakPolarHBondContact O-CB 3.47Å; L603-W607 VanDerWaalsContact O-CD1 3.3Å; L603-W607 PolarHBondContact O-N 2.96Å
604	Q	95.1	Very high	91.7	Very high	35 Å²	35	32.4 Å²	32.4	16%	0.164	18%	0.176	C	C	.	.	H	α-helix	trans	-57.7	-47.6	175.9	-64.1	178.5	0.4	0	0	111	V595 S596 L598 N600 E601 Y608 F633	V595-Q604 HydrophobicContact CG1-CB 4.13Å; V595-Q604 VanDerWaalsContact CG1-O 3.24Å; V595-Q604 WeakPolarHBondContact CG1-O 3.48Å; V595-Q604 WeakPolarHBondContact O-CG 3.32Å; S596-Q604 PolarHBondContact O-NE2 2.8Å; L598-Q604 HydrophobicContact CB-CG 4.05Å; L598-Q604 PolarHBondContact O-NE2 2.93Å; N600-Q604 WeakPolarHBondContact O-CG 3.32Å; N600-Q604 PolarHBondContact O-N 3.05Å; E601-Q604 WeakPolarHBondContact O-CB 3.3Å; E601-Q604 PolarHBondContact O-N 2.82Å; Q604-Y608 VanDerWaalsContact O-CB 3.29Å; Q604-Y608 WeakPolarHBondContact O-CB 3.46Å; Q604-Y608 PolarHBondContact O-N 3.32Å; Q604-F633 HydrophobicContact CB-CD1 4.35Å; Q604-F633 HydrophobicContact CB-CE1 3.89Å
605	I	93.5	Very high	91.2	Very high	18 Å²	18	33 Å²	33	9%	0.092	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-45.6	178.2	-69.4	162.2	0	0	0	110.8	E601 L603 S609 K637	E601-I605 HydrophobicContact CG-CD1 3.82Å; E601-I605 HydrophobicContact CG-CG1 4.48Å; E601-I605 WeakPolarHBondContact O-CB 3.32Å; E601-I605 VanDerWaalsContact O-CG1 3.31Å; E601-I605 WeakPolarHBondContact O-CG1 3.39Å; E601-I605 PolarHBondContact O-N 3.29Å; L603-I605 VanDerWaalsContact C-N 3.33Å; L603-I605 PolarHBondContact O-N 3.3Å; I605-S609 WeakPolarHBondContact O-CB 3.32Å; I605-S609 PolarHBondContact O-N 3.29Å; I605-S609 PolarHBondContact O-OG 2.95Å; I605-K637 HydrophobicContact CD1-CB 3.61Å; I605-K637 HydrophobicContact CD1-CD 3.72Å; I605-K637 HydrophobicContact CD1-CG 4.36Å
606	E	92.3	Very high	90.3	Very high	92 Å²	92	38.5 Å²	38.5	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-58.1	-49.9	179.9	179.9	-176.2	-168.2	0	0	112.1	S602 L603 S609 W610	S602-E606 VanDerWaalsContact O-CB 3.32Å; S602-E606 WeakPolarHBondContact O-CB 3.45Å; S602-E606 PolarHBondContact O-N 3.11Å; L603-E606 PolarHBondContact O-N 3.14Å; E606-S609 PolarHBondContact O-OG 3.16Å; E606-W610 WeakPolarHBondContact O-CB 3.39Å; E606-W610 PolarHBondContact O-N 2.89Å; E606-W610 VanDerWaalsContact O-N 3.1Å
607	W	93.8	Very high	89.9	Confident	1 Å²	1	42.4 Å²	42.4	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-73.5	-43.4	-175.7	-81.3	69.6	0	0	0	112.3	L530 P532 K576 L579 I583 V595 L598 L603 W610 F611	L530-W607 HydrophobicContact CB-CZ2 4.48Å; P532-W607 HydrophobicContact CG-CD2 4.08Å; P532-W607 HydrophobicContact CG-CE3 4.46Å; P532-W607 HydrophobicContact CG-CG 4.4Å; P532-W607 HydrophobicContact CG-CZ2 4.28Å; K576-W607 HydrophobicContact CB-CH2 3.56Å; K576-W607 HydrophobicContact CB-CZ2 3.56Å; K576-W607 HydrophobicContact CB-CZ3 4.25Å; K576-W607 HydrophobicContact CD-CZ2 3.67Å; K576-W607 HydrophobicContact CG-CD2 4.31Å; K576-W607 HydrophobicContact CG-CH2 3.94Å; K576-W607 HydrophobicContact CG-CZ2 3.45Å; K576-W607 VanDerWaalsContact CG-CZ2 3.45Å; K576-W607 WeakPolarHBondContact O-CH2 3.36Å; K576-W607 WeakPolarHBondContact O-CZ3 3.49Å; L579-W607 HydrophobicContact CB-CE3 3.85Å; L579-W607 HydrophobicContact CB-CZ3 3.71Å; L579-W607 HydrophobicContact CD1-CE3 4.01Å; I583-W607 HydrophobicContact CD1-CE3 3.95Å; I583-W607 HydrophobicContact CD1-CZ3 4.23Å; V595-W607 HydrophobicContact CG1-CB 4.22Å; V595-W607 HydrophobicContact CG2-CB 4.21Å; L598-W607 HydrophobicContact CD1-CB 4.42Å; L598-W607 HydrophobicContact CD1-CG 4.27Å; L603-W607 WeakPolarHBondContact O-CB 3.47Å; L603-W607 VanDerWaalsContact O-CD1 3.3Å; L603-W607 PolarHBondContact O-N 2.96Å; W607-W610 PolarHBondContact O-N 3.4Å; W607-F611 PolarHBondContact O-N 3.28Å; W607-F611 VanDerWaalsContact O-N 3.14Å
608	Y	94.9	Very high	89.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-71.5	-38.9	179.3	-157.4	-130.6	0	0	0	111.5	V591 A592 V595 Q604 W610 F611 L612 C624 A628 F633 L638	V591-Y608 HydrophobicContact CG1-CD2 4.18Å; V591-Y608 HydrophobicContact CG1-CE2 4.31Å; A592-Y608 HydrophobicContact CB-CE2 3.87Å; V595-Y608 HydrophobicContact CG2-CD2 4.44Å; Q604-Y608 VanDerWaalsContact O-CB 3.29Å; Q604-Y608 WeakPolarHBondContact O-CB 3.46Å; Q604-Y608 PolarHBondContact O-N 3.32Å; Y608-W610 VanDerWaalsContact C-N 3.29Å; Y608-W610 PolarHBondContact O-N 3.42Å; Y608-F611 HydrophobicContact CD2-CD1 4.15Å; Y608-F611 AromaticContact CE2-CD1 3.91Å; Y608-F611 HydrophobicContact CE2-CD1 3.91Å; Y608-F611 HydrophobicContact CE2-CE1 4.38Å; Y608-F611 PolarHBondContact O-N 3.39Å; Y608-L612 HydrophobicContact CD1-CD1 3.81Å; Y608-L612 HydrophobicContact CD1-CG 4.18Å; Y608-L612 HydrophobicContact CE1-CD1 3.81Å; Y608-L612 HydrophobicContact CE1-CD2 4.15Å; Y608-L612 HydrophobicContact CE1-CG 4.12Å; Y608-L612 HydrophobicContact CE2-CD2 4.49Å; Y608-L612 HydrophobicContact CG-CD1 4.48Å; Y608-L612 HydrophobicContact CG-CG 4.45Å; Y608-L612 WeakPolarHBondContact O-CB 3.4Å; Y608-L612 VanDerWaalsContact O-CG 3.24Å; Y608-L612 WeakPolarHBondContact O-CG 3.31Å; Y608-L612 PolarHBondContact O-N 2.74Å; Y608-C624 PolarHBondContact OH-O 2.93Å; Y608-A628 HydrophobicContact CE1-CB 3.8Å; Y608-F633 HydrophobicContact CD1-CD1 4.35Å; Y608-F633 HydrophobicContact CD1-CE1 4.18Å; Y608-F633 HydrophobicContact CD1-CZ 4.4Å; Y608-F633 HydrophobicContact CG-CE1 4.22Å; Y608-F633 HydrophobicContact CG-CZ 4.4Å; Y608-L638 HydrophobicContact CD1-CD1 3.82Å; Y608-L638 HydrophobicContact CD1-CD2 3.63Å; Y608-L638 HydrophobicContact CD1-CG 4.35Å; Y608-L638 HydrophobicContact CE1-CD2 4.01Å; Y608-L638 HydrophobicContact CG-CD1 4.37Å
609	S	93	Very high	89	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-65.1	-35.1	176.2	75.4	0	0	0	0	112.1	I605 E606 L612 S613 S641 L645	I605-S609 WeakPolarHBondContact O-CB 3.32Å; I605-S609 PolarHBondContact O-N 3.29Å; I605-S609 PolarHBondContact O-OG 2.95Å; E606-S609 PolarHBondContact O-OG 3.16Å; S609-L612 PolarHBondContact O-N 2.91Å; S609-S613 WeakPolarHBondContact O-CB 3.43Å; S609-S613 PolarHBondContact O-N 2.9Å; S609-S641 WeakPolarHBondContact CB-OG 3.47Å; S609-S641 PolarHBondContact OG-OG 2.84Å; S609-L645 WeakPolarHBondContact OG-CD1 3.24Å
610	W	90.5	Very high	88.9	Confident	63 Å²	63	53 Å²	53	24%	0.239	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-49.9	172.2	-176.1	-91.6	0	0	0	111.7	P532 P533 E606 W607 Y608 S613 L645	P532-W610 HydrophobicContact CB-CB 4Å; P532-W610 HydrophobicContact CB-CD2 3.71Å; P532-W610 HydrophobicContact CB-CG 3.38Å; P532-W610 HydrophobicContact CG-CB 4.15Å; P532-W610 HydrophobicContact CG-CD2 4.31Å; P532-W610 HydrophobicContact CG-CG 3.99Å; P533-W610 PolarHBondContact O-NE1 3.31Å; E606-W610 WeakPolarHBondContact O-CB 3.39Å; E606-W610 PolarHBondContact O-N 2.89Å; E606-W610 VanDerWaalsContact O-N 3.1Å; W607-W610 PolarHBondContact O-N 3.4Å; Y608-W610 VanDerWaalsContact C-N 3.29Å; Y608-W610 PolarHBondContact O-N 3.42Å; W610-S613 PolarHBondContact O-N 3.15Å; W610-S613 PolarHBondContact O-OG 3.34Å; W610-L645 HydrophobicContact CB-CD1 4.47Å; W610-L645 HydrophobicContact CE3-CD1 4.37Å; W610-L645 HydrophobicContact CE3-CD2 4.22Å; W610-L645 HydrophobicContact CZ3-CD2 4.43Å
611	F	91.5	Very high	88.9	Confident	10 Å²	10	50 Å²	50	4%	0.044	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-49.5	176.4	173.3	-111.5	0	0	0	112.1	I583 T588 V591 W607 Y608 S613 E614 I615	I583-F611 HydrophobicContact CB-CD2 4.39Å; I583-F611 HydrophobicContact CG1-CB 4.36Å; I583-F611 HydrophobicContact CG1-CD2 4.05Å; I583-F611 HydrophobicContact CG1-CG 4.48Å; I583-F611 HydrophobicContact CG2-CD2 4.12Å; T588-F611 HydrophobicContact CG2-CE1 4.35Å; T588-F611 HydrophobicContact CG2-CZ 3.85Å; V591-F611 HydrophobicContact CB-CD1 4.48Å; V591-F611 HydrophobicContact CB-CE1 4.38Å; V591-F611 HydrophobicContact CG1-CB 4.23Å; V591-F611 HydrophobicContact CG1-CD1 3.79Å; V591-F611 HydrophobicContact CG1-CD2 4.26Å; V591-F611 HydrophobicContact CG1-CE1 4.18Å; V591-F611 HydrophobicContact CG1-CG 3.82Å; V591-F611 HydrophobicContact CG2-CE2 4.36Å; V591-F611 HydrophobicContact CG2-CZ 4.49Å; W607-F611 PolarHBondContact O-N 3.28Å; W607-F611 VanDerWaalsContact O-N 3.14Å; Y608-F611 HydrophobicContact CD2-CD1 4.15Å; Y608-F611 AromaticContact CE2-CD1 3.91Å; Y608-F611 HydrophobicContact CE2-CD1 3.91Å; Y608-F611 HydrophobicContact CE2-CE1 4.38Å; Y608-F611 PolarHBondContact O-N 3.39Å; F611-S613 VanDerWaalsContact C-N 3.26Å; F611-S613 PolarHBondContact O-N 3.38Å; F611-E614 PolarHBondContact O-N 3.38Å; F611-I615 HydrophobicContact CD1-CD1 4.4Å; F611-I615 HydrophobicContact CE1-CD1 3.91Å; F611-I615 HydrophobicContact CZ-CD1 4.27Å
612	L	90.8	Very high	88.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-32.9	-179.8	-69.9	-178.1	0	0	0	112.8	Y608 S609 E614 I615 C624 L625 L638 V642 W722	Y608-L612 HydrophobicContact CD1-CD1 3.81Å; Y608-L612 HydrophobicContact CD1-CG 4.18Å; Y608-L612 HydrophobicContact CE1-CD1 3.81Å; Y608-L612 HydrophobicContact CE1-CD2 4.15Å; Y608-L612 HydrophobicContact CE1-CG 4.12Å; Y608-L612 HydrophobicContact CE2-CD2 4.49Å; Y608-L612 HydrophobicContact CG-CD1 4.48Å; Y608-L612 HydrophobicContact CG-CG 4.45Å; Y608-L612 WeakPolarHBondContact O-CB 3.4Å; Y608-L612 VanDerWaalsContact O-CG 3.24Å; Y608-L612 WeakPolarHBondContact O-CG 3.31Å; Y608-L612 PolarHBondContact O-N 2.74Å; S609-L612 PolarHBondContact O-N 2.91Å; L612-E614 PolarHBondContact O-N 2.94Å; L612-I615 HydrophobicContact CD2-CD1 3.84Å; L612-I615 PolarHBondContact O-N 3.31Å; L612-C624 HydrophobicContact CD2-CB 3.4Å; L612-L625 HydrophobicContact CD1-CD2 4.36Å; L612-L638 HydrophobicContact CD1-CD1 4.08Å; L612-L638 HydrophobicContact CD1-CD2 3.86Å; L612-L638 HydrophobicContact CD1-CG 3.99Å; L612-V642 HydrophobicContact CB-CG2 3.74Å; L612-V642 HydrophobicContact CD1-CG2 4.01Å; L612-W722 HydrophobicContact CB-CH2 3.73Å; L612-W722 HydrophobicContact CB-CZ2 4.32Å; L612-W722 HydrophobicContact CB-CZ3 4.14Å; L612-W722 HydrophobicContact CD1-CZ3 4.13Å; L612-W722 HydrophobicContact CD2-CH2 4.04Å; L612-W722 HydrophobicContact CD2-CZ3 4.21Å; L612-W722 HydrophobicContact CG-CH2 4.3Å; L612-W722 HydrophobicContact CG-CZ3 4.4Å; L612-W722 WeakPolarHBondContact O-CH2 3.34Å; L612-W722 WeakPolarHBondContact O-CZ2 3.26Å
613	S	86.2	Confident	88.8	Confident	18 Å²	18	51.5 Å²	51.5	13%	0.126	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.4	-178	73.1	0	0	0	0	114.7	S609 W610 F611 R649	S609-S613 WeakPolarHBondContact O-CB 3.43Å; S609-S613 PolarHBondContact O-N 2.9Å; W610-S613 PolarHBondContact O-N 3.15Å; W610-S613 PolarHBondContact O-OG 3.34Å; F611-S613 VanDerWaalsContact C-N 3.26Å; F611-S613 PolarHBondContact O-N 3.38Å; S613-R649 PolarHBondContact OG-NH2 3.21Å
614	E	81.7	Confident	88.9	Confident	58 Å²	58	50.1 Å²	50.1	27%	0.271	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-11.2	177.3	-68.1	-83.9	-174.7	0	0	113.3	L535 F611 L612 N616 R649	L535-E614 HydrophobicContact CD1-CB 4.25Å; L535-E614 HydrophobicContact CD1-CG 3.6Å; F611-E614 PolarHBondContact O-N 3.38Å; L612-E614 PolarHBondContact O-N 2.94Å; E614-N616 PolarHBondContact O-N 3.14Å; E614-R649 IonicContact OE1-CZ 3.72Å; E614-R649 IonicContact OE1-NH1 2.82Å; E614-R649 PolarHBondContact OE1-NH1 2.86Å; E614-R649 IonicContact OE1-NH2 3.59Å; E614-R649 IonicContact OE2-NH1 2.64Å
615	I	83.4	Confident	88.7	Confident	11 Å²	11	48.7 Å²	48.7	6%	0.056	25%	0.245	C	C	.	.			trans	-78.8	114	-178.9	-56.5	-176.8	0	0	0	108.9	F611 L612 E620 R621 C624 W722	F611-I615 HydrophobicContact CD1-CD1 4.4Å; F611-I615 HydrophobicContact CE1-CD1 3.91Å; F611-I615 HydrophobicContact CZ-CD1 4.27Å; L612-I615 HydrophobicContact CD2-CD1 3.84Å; L612-I615 PolarHBondContact O-N 3.31Å; I615-E620 HydrophobicContact CG2-CB 3.58Å; I615-R621 HydrophobicContact CB-CG 4.3Å; I615-R621 HydrophobicContact CG2-CG 3.72Å; I615-R621 VanDerWaalsContact O-CZ 3.32Å; I615-R621 PolarHBondContact O-NE 3.45Å; I615-R621 PolarHBondContact O-NH2 3.45Å; I615-C624 HydrophobicContact CD1-CB 4.15Å; I615-C624 WeakPolarHBondContact CD1-SG 3.5Å; I615-W722 HydrophobicContact CB-CH2 4.43Å
616	N	78.7	Confident	88.7	Confident	117 Å²	117	49.7 Å²	49.7	63%	0.626	25%	0.254	S	S	*	.			trans	-96.5	-26.9	-178.3	-67.3	-43.6	0	0	0	113.1	E614	E614-N616 PolarHBondContact O-N 3.14Å
617	H	83.3	Confident	88.7	Confident	113 Å²	113	45.9 Å²	45.9	52%	0.523	24%	0.236	S	C	.	.			trans	-84	130.4	-174.5	-71.5	-64.4	0	0	0	112.2	T619 E620 R621	H617-T619 VanDerWaalsContact C-N 3.35Å; H617-T619 PolarHBondContact O-N 2.73Å; H617-E620 HydrophobicContact CB-CB 4.29Å; H617-E620 HydrophobicContact CB-CG 4.16Å; H617-E620 PolarHBondContact O-N 3.46Å; H617-R621 WeakPolarHBondContact O-CG 3.29Å; H617-R621 PolarHBondContact O-N 3.37Å; H617-R621 VanDerWaalsContact O-N 3.08Å
618	P	82.3	Confident	88.6	Confident	93 Å²	93	45.9 Å²	45.9	60%	0.604	24%	0.236	S	C	*	.	H	α-helix	trans	-64.1	-37	-173.2	24.8	-33.9	0	0	0	113.2	R621 E622	P618-R621 PolarHBondContact O-N 3.25Å; P618-E622 PolarHBondContact O-N 3.44Å; P618-E622 VanDerWaalsContact O-N 3.08Å
619	T	86	Confident	88.5	Confident	104 Å²	104	49.5 Å²	49.5	64%	0.638	26%	0.258	S	S	*	.	H	α-helix	trans	-65.5	-39.4	177.8	49.2	0	0	0	0	112.1	H617 E622 H623	H617-T619 VanDerWaalsContact C-N 3.35Å; H617-T619 PolarHBondContact O-N 2.73Å; T619-E622 PolarHBondContact O-N 2.9Å; T619-H623 PolarHBondContact O-N 3.23Å; T619-H623 VanDerWaalsContact O-N 3.08Å
620	E	86.3	Confident	88.5	Confident	91 Å²	91	55.2 Å²	55.2	43%	0.425	29%	0.289	S	S	.	.	H	α-helix	trans	-68.5	-37.9	175.9	-69.6	175.3	-171.8	0	0	111.3	I615 H617 E622 H623 C624	I615-E620 HydrophobicContact CG2-CB 3.58Å; H617-E620 HydrophobicContact CB-CB 4.29Å; H617-E620 HydrophobicContact CB-CG 4.16Å; H617-E620 PolarHBondContact O-N 3.46Å; E620-E622 PolarHBondContact O-N 3.32Å; E620-H623 PolarHBondContact O-N 2.87Å; E620-C624 PolarHBondContact O-N 2.67Å; E620-C624 PolarHBondContact O-SG 3.49Å
621	R	89.3	Confident	88.5	Confident	23 Å²	23	55.5 Å²	55.5	9%	0.087	29%	0.29	C	S	.	.	H	α-helix	trans	-60.6	-46.5	174.8	-65	-176.3	178.9	172.4	-3.4	111.5	I615 H617 P618 H623 C624 L625 I718 W722	I615-R621 HydrophobicContact CB-CG 4.3Å; I615-R621 HydrophobicContact CG2-CG 3.72Å; I615-R621 VanDerWaalsContact O-CZ 3.32Å; I615-R621 PolarHBondContact O-NE 3.45Å; I615-R621 PolarHBondContact O-NH2 3.45Å; H617-R621 WeakPolarHBondContact O-CG 3.29Å; H617-R621 PolarHBondContact O-N 3.37Å; H617-R621 VanDerWaalsContact O-N 3.08Å; P618-R621 PolarHBondContact O-N 3.25Å; R621-H623 VanDerWaalsContact C-N 3.33Å; R621-H623 PolarHBondContact O-N 3.15Å; R621-C624 PolarHBondContact O-N 3.03Å; R621-L625 WeakPolarHBondContact O-CB 3.4Å; R621-L625 VanDerWaalsContact O-CG 3.24Å; R621-L625 WeakPolarHBondContact O-CG 3.42Å; R621-L625 PolarHBondContact O-N 3.25Å; R621-I718 VanDerWaalsContact NH1-CG2 3.28Å; R621-I718 PolarHBondContact NH1-O 2.85Å; R621-W722 HydrophobicContact CB-CH2 3.9Å; R621-W722 HydrophobicContact CB-CZ2 4.44Å; R621-W722 HydrophobicContact CB-CZ3 4Å; R621-W722 VanDerWaalsContact CD-CZ2 3.44Å; R621-W722 HydrophobicContact CG-CH2 3.44Å; R621-W722 VanDerWaalsContact CG-CH2 3.44Å; R621-W722 HydrophobicContact CG-CZ2 3.58Å; R621-W722 HydrophobicContact CG-CZ3 4.02Å; R621-W722 VanDerWaalsContact NE-CZ2 3.31Å
622	E	88.9	Confident	88.5	Confident	126 Å²	126	58 Å²	58	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-60.9	-44	178.1	-169.5	175.4	-176.1	0	0	111.1	P618 T619 E620 L625 S626 Y725	P618-E622 PolarHBondContact O-N 3.44Å; P618-E622 VanDerWaalsContact O-N 3.08Å; T619-E622 PolarHBondContact O-N 2.9Å; E620-E622 PolarHBondContact O-N 3.32Å; E622-L625 PolarHBondContact O-N 3.15Å; E622-S626 WeakPolarHBondContact O-CB 3.29Å; E622-S626 PolarHBondContact O-N 3.02Å; E622-Y725 HydrophobicContact CG-CE2 4.17Å
623	H	92.3	Very high	88.5	Confident	79 Å²	79	58.7 Å²	58.7	37%	0.366	32%	0.322	S	S	.	.	H	α-helix	trans	-57.8	-52.3	173.6	-176.3	59.5	0	0	0	111.7	D589 T619 E620 R621 L625 S626 L627	D589-H623 IonicContact OD1-CE1 3.84Å; D589-H623 IonicContact OD1-NE2 3.57Å; D589-H623 PolarHBondContact OD1-NE2 3.36Å; T619-H623 PolarHBondContact O-N 3.23Å; T619-H623 VanDerWaalsContact O-N 3.08Å; E620-H623 PolarHBondContact O-N 2.87Å; R621-H623 VanDerWaalsContact C-N 3.33Å; R621-H623 PolarHBondContact O-N 3.15Å; H623-L625 VanDerWaalsContact C-N 3.33Å; H623-L625 PolarHBondContact O-N 3.34Å; H623-S626 WeakPolarHBondContact O-CB 3.29Å; H623-S626 PolarHBondContact O-N 3.05Å; H623-S626 VanDerWaalsContact O-N 3.1Å; H623-S626 PolarHBondContact O-OG 3.36Å; H623-L627 WeakPolarHBondContact O-CG 3.18Å; H623-L627 PolarHBondContact O-N 3.02Å
624	C	92.6	Very high	88.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-32.2	-178.4	-64.3	0	0	0	0	113.5	Y608 L612 I615 E620 R621 A628	Y608-C624 PolarHBondContact OH-O 2.93Å; L612-C624 HydrophobicContact CD2-CB 3.4Å; I615-C624 HydrophobicContact CD1-CB 4.15Å; I615-C624 WeakPolarHBondContact CD1-SG 3.5Å; E620-C624 PolarHBondContact O-N 2.67Å; E620-C624 PolarHBondContact O-SG 3.49Å; R621-C624 PolarHBondContact O-N 3.03Å; C624-A628 PolarHBondContact O-N 3.25Å
625	L	91.3	Very high	89.1	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.026	33%	0.325	C	S	.	.	H	α-helix	trans	-71.3	-35.8	172.5	-67.7	175.2	0	0	0	111.5	L612 R621 E622 H623 L627 A628 V629 L635 T639 W722 Y725	L612-L625 HydrophobicContact CD1-CD2 4.36Å; R621-L625 WeakPolarHBondContact O-CB 3.4Å; R621-L625 VanDerWaalsContact O-CG 3.24Å; R621-L625 WeakPolarHBondContact O-CG 3.42Å; R621-L625 PolarHBondContact O-N 3.25Å; E622-L625 PolarHBondContact O-N 3.15Å; H623-L625 VanDerWaalsContact C-N 3.33Å; H623-L625 PolarHBondContact O-N 3.34Å; L625-L627 VanDerWaalsContact C-N 3.33Å; L625-L627 PolarHBondContact O-N 3.15Å; L625-A628 VanDerWaalsContact O-CB 3.26Å; L625-A628 WeakPolarHBondContact O-CB 3.46Å; L625-A628 PolarHBondContact O-N 3.41Å; L625-A628 VanDerWaalsContact O-N 3.16Å; L625-V629 WeakPolarHBondContact O-CG2 3.3Å; L625-V629 PolarHBondContact O-N 3.29Å; L625-L635 HydrophobicContact CD2-CD1 3.81Å; L625-T639 HydrophobicContact CD2-CG2 4.16Å; L625-W722 HydrophobicContact CD1-CE3 4.07Å; L625-W722 HydrophobicContact CD1-CZ3 4.2Å; L625-W722 HydrophobicContact CD2-CE3 4.15Å; L625-W722 HydrophobicContact CD2-CZ3 4.02Å; L625-W722 HydrophobicContact CG-CE3 4.33Å; L625-W722 HydrophobicContact CG-CZ3 4.05Å; L625-Y725 HydrophobicContact CB-CD1 4.38Å; L625-Y725 HydrophobicContact CB-CD2 4.12Å; L625-Y725 HydrophobicContact CB-CE1 4.22Å; L625-Y725 HydrophobicContact CB-CE2 3.96Å; L625-Y725 HydrophobicContact CB-CG 4.33Å; L625-Y725 HydrophobicContact CD1-CD1 4.24Å; L625-Y725 HydrophobicContact CD1-CD2 3.72Å; L625-Y725 HydrophobicContact CD1-CE2 4.4Å; L625-Y725 HydrophobicContact CD1-CG 3.62Å
626	S	92.7	Very high	89.3	Confident	38 Å²	38	60.3 Å²	60.3	27%	0.266	33%	0.334	S	S	.	.	H	α-helix	trans	-62.6	-40.9	173	83.1	0	0	0	0	111.7	E622 H623 A628 V629 N630	E622-S626 WeakPolarHBondContact O-CB 3.29Å; E622-S626 PolarHBondContact O-N 3.02Å; H623-S626 WeakPolarHBondContact O-CB 3.29Å; H623-S626 PolarHBondContact O-N 3.05Å; H623-S626 VanDerWaalsContact O-N 3.1Å; H623-S626 PolarHBondContact O-OG 3.36Å; S626-A628 VanDerWaalsContact C-N 3.32Å; S626-A628 PolarHBondContact O-N 2.95Å; S626-V629 PolarHBondContact O-N 3.48Å; S626-N630 VanDerWaalsContact O-CG 3.24Å; S626-N630 PolarHBondContact O-N 3.33Å; S626-N630 PolarHBondContact O-ND2 2.61Å
627	L	92.4	Very high	89.9	Confident	13 Å²	13	58.9 Å²	58.9	7%	0.068	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-40.3	172.3	-66.8	174.7	0	0	0	111.4	D589 A592 H623 L625 V629 N630 Y631	D589-L627 WeakPolarHBondContact OD1-CD1 3.06Å; A592-L627 HydrophobicContact CB-CB 3.86Å; A592-L627 HydrophobicContact CB-CD1 3.94Å; A592-L627 HydrophobicContact CB-CG 4.49Å; H623-L627 WeakPolarHBondContact O-CG 3.18Å; H623-L627 PolarHBondContact O-N 3.02Å; L625-L627 VanDerWaalsContact C-N 3.33Å; L625-L627 PolarHBondContact O-N 3.15Å; L627-V629 VanDerWaalsContact C-N 3.28Å; L627-V629 PolarHBondContact O-N 3.11Å; L627-N630 PolarHBondContact O-N 3.05Å; L627-Y631 HydrophobicContact CB-CD2 4.42Å; L627-Y631 HydrophobicContact CB-CE2 4.36Å; L627-Y631 HydrophobicContact CD2-CE2 4.29Å; L627-Y631 WeakPolarHBondContact O-CD2 3.37Å; L627-Y631 PolarHBondContact O-N 2.95Å
628	A	92.8	Very high	90.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-42.6	176.5	0	0	0	0	0	111.5	Y608 C624 L625 S626 G632 F633 L638	Y608-A628 HydrophobicContact CE1-CB 3.8Å; C624-A628 PolarHBondContact O-N 3.25Å; L625-A628 VanDerWaalsContact O-CB 3.26Å; L625-A628 WeakPolarHBondContact O-CB 3.46Å; L625-A628 PolarHBondContact O-N 3.41Å; L625-A628 VanDerWaalsContact O-N 3.16Å; S626-A628 VanDerWaalsContact C-N 3.32Å; S626-A628 PolarHBondContact O-N 2.95Å; A628-G632 PolarHBondContact O-N 3.16Å; A628-F633 HydrophobicContact CB-CB 4.07Å; A628-F633 HydrophobicContact CB-CD2 4.26Å; A628-F633 HydrophobicContact CB-CG 4.34Å; A628-F633 WeakPolarHBondContact O-CB 3.37Å; A628-F633 WeakPolarHBondContact O-CD2 3.47Å; A628-F633 PolarHBondContact O-N 3.37Å; A628-L638 HydrophobicContact CB-CD2 3.86Å
629	V	92.1	Very high	90.7	Very high	76 Å²	76	49.1 Å²	49.1	46%	0.461	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-45	176.3	175.1	0	0	0	0	110.8	L625 S626 L627 Y631 G632 Y725	L625-V629 WeakPolarHBondContact O-CG2 3.3Å; L625-V629 PolarHBondContact O-N 3.29Å; S626-V629 PolarHBondContact O-N 3.48Å; L627-V629 VanDerWaalsContact C-N 3.28Å; L627-V629 PolarHBondContact O-N 3.11Å; V629-Y631 VanDerWaalsContact C-N 3.29Å; V629-Y631 PolarHBondContact O-N 2.69Å; V629-G632 PolarHBondContact O-N 3.25Å; V629-G632 VanDerWaalsContact O-N 3.11Å; V629-Y725 HydrophobicContact CG2-CE1 4.42Å
630	N	92.5	Very high	90.9	Very high	122 Å²	122	45.9 Å²	45.9	65%	0.652	25%	0.245	S	C	*	.	H	α-helix	trans	-62	-35.4	-178.8	-68.1	-21.8	0	0	0	113.1	S626 L627	S626-N630 VanDerWaalsContact O-CG 3.24Å; S626-N630 PolarHBondContact O-N 3.33Å; S626-N630 PolarHBondContact O-ND2 2.61Å; L627-N630 PolarHBondContact O-N 3.05Å
631	Y	91.4	Very high	91.1	Very high	68 Å²	68	42.2 Å²	42.2	27%	0.267	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	8.4	178	-63.8	-59.5	0	0	0	113.8	K47 A592 Y593 L627 V629	K47-Y631 PolarHBondContact NZ-OH 2.95Å; A592-Y631 HydrophobicContact CB-CD2 3.85Å; A592-Y631 HydrophobicContact CB-CE2 3.73Å; Y593-Y631 HydrophobicContact CD2-CD1 4.26Å; Y593-Y631 AromaticContact CD2-CE1 3.61Å; Y593-Y631 HydrophobicContact CD2-CE1 3.61Å; Y593-Y631 HydrophobicContact CE2-CE1 4.45Å; Y593-Y631 HydrophobicContact CG-CE1 4.49Å; L627-Y631 HydrophobicContact CB-CD2 4.42Å; L627-Y631 HydrophobicContact CB-CE2 4.36Å; L627-Y631 HydrophobicContact CD2-CE2 4.29Å; L627-Y631 WeakPolarHBondContact O-CD2 3.37Å; L627-Y631 PolarHBondContact O-N 2.95Å; V629-Y631 VanDerWaalsContact C-N 3.29Å; V629-Y631 PolarHBondContact O-N 2.69Å
632	G	90.9	Very high	91.1	Very high	64 Å²	64	41.1 Å²	41.1	66%	0.66	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	22	171.1	0	0	0	0	0	115.7	A628 V629	A628-G632 PolarHBondContact O-N 3.16Å; V629-G632 PolarHBondContact O-N 3.25Å; V629-G632 VanDerWaalsContact O-N 3.11Å
633	F	91.3	Very high	91.1	Very high	14 Å²	14	35.3 Å²	35.3	6%	0.061	20%	0.198	C	C	.	.			trans	-66.3	145.7	176.6	-72.3	-100	0	0	0	111.8	V595 Q604 Y608 A628 L635 L638	V595-F633 HydrophobicContact CB-CE1 4.48Å; V595-F633 HydrophobicContact CB-CZ 4.09Å; V595-F633 HydrophobicContact CG1-CE1 3.83Å; V595-F633 HydrophobicContact CG1-CZ 3.93Å; Q604-F633 HydrophobicContact CB-CD1 4.35Å; Q604-F633 HydrophobicContact CB-CE1 3.89Å; Y608-F633 HydrophobicContact CD1-CD1 4.35Å; Y608-F633 HydrophobicContact CD1-CE1 4.18Å; Y608-F633 HydrophobicContact CD1-CZ 4.4Å; Y608-F633 HydrophobicContact CG-CE1 4.22Å; Y608-F633 HydrophobicContact CG-CZ 4.4Å; A628-F633 HydrophobicContact CB-CB 4.07Å; A628-F633 HydrophobicContact CB-CD2 4.26Å; A628-F633 HydrophobicContact CB-CG 4.34Å; A628-F633 WeakPolarHBondContact O-CB 3.37Å; A628-F633 WeakPolarHBondContact O-CD2 3.47Å; A628-F633 PolarHBondContact O-N 3.37Å; F633-L635 PolarHBondContact O-N 3.39Å; F633-L638 HydrophobicContact CB-CD2 4.48Å
634	N	90.1	Very high	90.8	Very high	62 Å²	62	35.5 Å²	35.5	33%	0.332	20%	0.196	S	C	.	.			trans	-72.2	93.9	169.3	-170.7	-39.8	0	0	0	110.3	E601 S636 K637 L638	E601-N634 WeakPolarHBondContact OE1-CB 3.33Å; E601-N634 PolarHBondContact OE1-ND2 2.95Å; N634-S636 VanDerWaalsContact C-N 3.28Å; N634-S636 PolarHBondContact O-N 3.11Å; N634-S636 PolarHBondContact OD1-N 3.26Å; N634-K637 HydrophobicContact CB-CB 4.3Å; N634-K637 HydrophobicContact CB-CD 4.27Å; N634-K637 HydrophobicContact CB-CG 4.39Å; N634-K637 PolarHBondContact O-N 3.46Å; N634-K637 PolarHBondContact OD1-N 3.11Å; N634-K637 VanDerWaalsContact OD1-N 3.16Å; N634-L638 VanDerWaalsContact O-CB 3.29Å; N634-L638 WeakPolarHBondContact O-CB 3.39Å; N634-L638 PolarHBondContact O-N 3.11Å
635	L	90.2	Very high	90.5	Very high	24 Å²	24	36.2 Å²	36.2	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-54.7	-42.3	-175.4	-173.8	66.9	0	0	0	112.7	L625 F633 L638 T639 Y725 N726	L625-L635 HydrophobicContact CD2-CD1 3.81Å; F633-L635 PolarHBondContact O-N 3.39Å; L635-L638 PolarHBondContact O-N 3.05Å; L635-T639 HydrophobicContact CD1-CG2 4.13Å; L635-T639 HydrophobicContact CG-CG2 4.4Å; L635-T639 WeakPolarHBondContact O-CG2 3.39Å; L635-T639 PolarHBondContact O-N 3.24Å; L635-T639 PolarHBondContact O-OG1 3.28Å; L635-Y725 HydrophobicContact CD1-CD1 4.34Å; L635-Y725 HydrophobicContact CD1-CE1 4.5Å; L635-Y725 HydrophobicContact CD2-CD1 3.76Å; L635-Y725 HydrophobicContact CD2-CE1 3.91Å; L635-N726 HydrophobicContact CD2-CB 3.9Å
636	S	88.9	Confident	90.1	Very high	34 Å²	34	37 Å²	37	24%	0.238	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-43.1	-177	-56	0	0	0	0	112.4	N634 T639 R640 N726 Q729	N634-S636 VanDerWaalsContact C-N 3.28Å; N634-S636 PolarHBondContact O-N 3.11Å; N634-S636 PolarHBondContact OD1-N 3.26Å; S636-T639 PolarHBondContact O-OG1 2.81Å; S636-R640 VanDerWaalsContact O-CB 3.26Å; S636-R640 WeakPolarHBondContact O-CB 3.41Å; S636-R640 PolarHBondContact O-N 3.34Å; S636-N726 PolarHBondContact OG-ND2 3.02Å; S636-Q729 PolarHBondContact O-NE2 3.44Å
637	K	89.9	Confident	89.5	Confident	87 Å²	87	38 Å²	38	38%	0.378	21%	0.205	S	C	.	.	H	α-helix	trans	-67.7	-38.7	174.8	-66.4	-178.8	-173.1	168.8	0	111.4	E601 I605 N634 S641	E601-K637 WeakPolarHBondContact OE1-CD 3.37Å; E601-K637 IonicContact OE1-NZ 3.58Å; E601-K637 PolarHBondContact OE1-NZ 3.11Å; E601-K637 IonicContact OE2-NZ 3.77Å; E601-K637 PolarHBondContact OE2-NZ 3.32Å; I605-K637 HydrophobicContact CD1-CB 3.61Å; I605-K637 HydrophobicContact CD1-CD 3.72Å; I605-K637 HydrophobicContact CD1-CG 4.36Å; N634-K637 HydrophobicContact CB-CB 4.3Å; N634-K637 HydrophobicContact CB-CD 4.27Å; N634-K637 HydrophobicContact CB-CG 4.39Å; N634-K637 PolarHBondContact O-N 3.46Å; N634-K637 PolarHBondContact OD1-N 3.11Å; N634-K637 VanDerWaalsContact OD1-N 3.16Å; K637-S641 WeakPolarHBondContact O-CB 3.11Å; K637-S641 PolarHBondContact O-N 3.19Å
638	L	92.2	Very high	88.8	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-55.7	-179.9	178.5	68	0	0	0	111.7	Y608 L612 A628 F633 N634 L635 R640 S641 V642	Y608-L638 HydrophobicContact CD1-CD1 3.82Å; Y608-L638 HydrophobicContact CD1-CD2 3.63Å; Y608-L638 HydrophobicContact CD1-CG 4.35Å; Y608-L638 HydrophobicContact CE1-CD2 4.01Å; Y608-L638 HydrophobicContact CG-CD1 4.37Å; L612-L638 HydrophobicContact CD1-CD1 4.08Å; L612-L638 HydrophobicContact CD1-CD2 3.86Å; L612-L638 HydrophobicContact CD1-CG 3.99Å; A628-L638 HydrophobicContact CB-CD2 3.86Å; F633-L638 HydrophobicContact CB-CD2 4.48Å; N634-L638 VanDerWaalsContact O-CB 3.29Å; N634-L638 WeakPolarHBondContact O-CB 3.39Å; N634-L638 PolarHBondContact O-N 3.11Å; L635-L638 PolarHBondContact O-N 3.05Å; L638-R640 VanDerWaalsContact C-N 3.28Å; L638-R640 PolarHBondContact O-N 3.31Å; L638-S641 WeakPolarHBondContact O-CB 3.38Å; L638-S641 PolarHBondContact O-N 3.31Å; L638-S641 VanDerWaalsContact O-N 3.11Å; L638-V642 WeakPolarHBondContact O-CG2 2.96Å; L638-V642 PolarHBondContact O-N 3.45Å
639	T	91.7	Very high	87.9	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-37.8	-179.3	55.8	0	0	0	0	111.4	L625 L635 S636 V642 V643 W722 Q729	L625-T639 HydrophobicContact CD2-CG2 4.16Å; L635-T639 HydrophobicContact CD1-CG2 4.13Å; L635-T639 HydrophobicContact CG-CG2 4.4Å; L635-T639 WeakPolarHBondContact O-CG2 3.39Å; L635-T639 PolarHBondContact O-N 3.24Å; L635-T639 PolarHBondContact O-OG1 3.28Å; S636-T639 PolarHBondContact O-OG1 2.81Å; T639-V642 PolarHBondContact O-N 2.88Å; T639-V643 WeakPolarHBondContact O-CG2 3.42Å; T639-V643 PolarHBondContact O-N 2.92Å; T639-W722 VanDerWaalsContact CG2-O 3.32Å; T639-W722 WeakPolarHBondContact CG2-O 3.39Å; T639-Q729 VanDerWaalsContact OG1-CD 3.29Å; T639-Q729 PolarHBondContact OG1-NE2 3.19Å; T639-Q729 PolarHBondContact OG1-OE1 3.21Å
640	R	89.8	Confident	86.9	Confident	36 Å²	36	40.1 Å²	40.1	14%	0.136	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-44.2	173.9	-164.9	-179.4	-55.2	143.7	-0.9	112	S636 L638 V642 V643 R644 E732 G955 L956	S636-R640 VanDerWaalsContact O-CB 3.26Å; S636-R640 WeakPolarHBondContact O-CB 3.41Å; S636-R640 PolarHBondContact O-N 3.34Å; L638-R640 VanDerWaalsContact C-N 3.28Å; L638-R640 PolarHBondContact O-N 3.31Å; R640-V642 PolarHBondContact O-N 2.76Å; R640-V643 PolarHBondContact O-N 2.64Å; R640-R644 WeakPolarHBondContact O-CB 3.34Å; R640-R644 PolarHBondContact O-N 2.98Å; R640-E732 IonicContact CZ-OE1 3.2Å; R640-E732 IonicContact CZ-OE2 3.21Å; R640-E732 IonicContact NE-OE1 3.63Å; R640-E732 IonicContact NE-OE2 2.88Å; R640-E732 PolarHBondContact NE-OE2 3.32Å; R640-E732 IonicContact NH2-OE1 2.57Å; R640-E732 PolarHBondContact NH2-OE1 3.25Å; R640-E732 IonicContact NH2-OE2 3.31Å; R640-E732 PolarHBondContact NH2-OE2 2.84Å; R640-G955 WeakPolarHBondContact CG-O 3.26Å; R640-L956 HydrophobicContact CG-CD2 3.98Å; R640-L956 HydrophobicContact CG-CG 4.25Å
641	S	89.8	Confident	85.8	Confident	14 Å²	14	37.6 Å²	37.6	10%	0.098	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-41.1	175.3	-169.1	0	0	0	0	112	S609 K637 L638 R644 L645	S609-S641 WeakPolarHBondContact CB-OG 3.47Å; S609-S641 PolarHBondContact OG-OG 2.84Å; K637-S641 WeakPolarHBondContact O-CB 3.11Å; K637-S641 PolarHBondContact O-N 3.19Å; L638-S641 WeakPolarHBondContact O-CB 3.38Å; L638-S641 PolarHBondContact O-N 3.31Å; L638-S641 VanDerWaalsContact O-N 3.11Å; S641-R644 PolarHBondContact O-N 3.26Å; S641-L645 WeakPolarHBondContact O-CB 3.38Å; S641-L645 WeakPolarHBondContact O-CG 3.36Å; S641-L645 PolarHBondContact O-N 3.17Å
642	V	90.3	Very high	84.5	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-46.9	176	176.8	0	0	0	0	111.4	L612 L638 T639 R640 R644 L645 S646 W722	L612-V642 HydrophobicContact CB-CG2 3.74Å; L612-V642 HydrophobicContact CD1-CG2 4.01Å; L638-V642 WeakPolarHBondContact O-CG2 2.96Å; L638-V642 PolarHBondContact O-N 3.45Å; T639-V642 PolarHBondContact O-N 2.88Å; R640-V642 PolarHBondContact O-N 2.76Å; V642-R644 VanDerWaalsContact C-N 3.35Å; V642-R644 PolarHBondContact O-N 2.81Å; V642-L645 PolarHBondContact O-N 3.42Å; V642-S646 WeakPolarHBondContact O-CB 3.48Å; V642-S646 PolarHBondContact O-N 3.16Å; V642-W722 HydrophobicContact CG1-CD2 3.76Å; V642-W722 HydrophobicContact CG1-CE3 4.41Å; V642-W722 HydrophobicContact CG1-CG 3.89Å; V642-W722 HydrophobicContact CG1-CZ2 4.09Å
643	V	88.9	Confident	83.1	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-47.2	176.6	170.6	0	0	0	0	110.4	T639 R640 L645 S646 K647 W722 L723 L736 L956	T639-V643 WeakPolarHBondContact O-CG2 3.42Å; T639-V643 PolarHBondContact O-N 2.92Å; R640-V643 PolarHBondContact O-N 2.64Å; V643-L645 PolarHBondContact O-N 2.86Å; V643-S646 PolarHBondContact O-N 3.16Å; V643-S646 PolarHBondContact O-OG 2.71Å; V643-K647 PolarHBondContact O-N 2.96Å; V643-W722 HydrophobicContact CG2-CB 4.29Å; V643-L723 HydrophobicContact CG2-CD1 4.27Å; V643-L723 HydrophobicContact CG2-CD2 4.23Å; V643-L723 HydrophobicContact CG2-CG 4Å; V643-L736 HydrophobicContact CG1-CD1 4.33Å; V643-L736 HydrophobicContact CG1-CD2 3.74Å; V643-L956 HydrophobicContact CG1-CD2 4.19Å
644	R	86.1	Confident	81.3	Confident	83 Å²	83	40.9 Å²	40.9	31%	0.313	21%	0.206	S	C	.	.	H	α-helix	trans	-58.7	-45.7	177.7	-171.7	-178.1	63.5	78.4	-0	112.3	R640 S641 V642 K647 Q648	R640-R644 WeakPolarHBondContact O-CB 3.34Å; R640-R644 PolarHBondContact O-N 2.98Å; S641-R644 PolarHBondContact O-N 3.26Å; V642-R644 VanDerWaalsContact C-N 3.35Å; V642-R644 PolarHBondContact O-N 2.81Å; R644-K647 PolarHBondContact O-N 3.38Å; R644-Q648 VanDerWaalsContact NH1-NE2 3.1Å; R644-Q648 WeakPolarHBondContact O-CG 3.42Å; R644-Q648 PolarHBondContact O-N 2.92Å
645	L	84.8	Confident	79.3	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-42	177.6	-74.9	175.1	0	0	0	112	S609 W610 S641 V642 V643 K647 Q648 R649	S609-L645 WeakPolarHBondContact OG-CD1 3.24Å; W610-L645 HydrophobicContact CB-CD1 4.47Å; W610-L645 HydrophobicContact CE3-CD1 4.37Å; W610-L645 HydrophobicContact CE3-CD2 4.22Å; W610-L645 HydrophobicContact CZ3-CD2 4.43Å; S641-L645 WeakPolarHBondContact O-CB 3.38Å; S641-L645 WeakPolarHBondContact O-CG 3.36Å; S641-L645 PolarHBondContact O-N 3.17Å; V642-L645 PolarHBondContact O-N 3.42Å; V643-L645 PolarHBondContact O-N 2.86Å; L645-K647 VanDerWaalsContact C-N 3.29Å; L645-K647 PolarHBondContact O-N 2.59Å; L645-Q648 PolarHBondContact O-N 3.33Å; L645-R649 WeakPolarHBondContact O-CG 3.38Å; L645-R649 PolarHBondContact O-N 3.13Å
646	S	83.5	Confident	77.1	Confident	21 Å²	21	49.1 Å²	49.1	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-41	177.1	72.9	0	0	0	0	111.5	V642 V643 R649 I650 A719	V642-S646 WeakPolarHBondContact O-CB 3.48Å; V642-S646 PolarHBondContact O-N 3.16Å; V643-S646 PolarHBondContact O-N 3.16Å; V643-S646 PolarHBondContact O-OG 2.71Å; S646-R649 PolarHBondContact O-N 3.37Å; S646-I650 WeakPolarHBondContact O-CB 3.49Å; S646-I650 VanDerWaalsContact O-CD1 3.29Å; S646-I650 WeakPolarHBondContact O-CD1 3.36Å; S646-I650 WeakPolarHBondContact O-CG1 3.16Å; S646-I650 PolarHBondContact O-N 3.31Å; S646-I650 VanDerWaalsContact O-N 3.14Å; S646-A719 WeakPolarHBondContact OG-CB 3.33Å
647	K	79.5	Confident	74.8	Confident	59 Å²	59	55.2 Å²	55.2	26%	0.257	27%	0.272	S	S	.	.	H	α-helix	trans	-62.5	-47.4	175.3	-175.5	177.6	176	176.8	0	112.1	V643 R644 L645 R649 I650 E651 G957	V643-K647 PolarHBondContact O-N 2.96Å; R644-K647 PolarHBondContact O-N 3.38Å; L645-K647 VanDerWaalsContact C-N 3.29Å; L645-K647 PolarHBondContact O-N 2.59Å; K647-R649 PolarHBondContact O-N 2.87Å; K647-I650 WeakPolarHBondContact O-CB 3.44Å; K647-I650 PolarHBondContact O-N 2.89Å; K647-E651 WeakPolarHBondContact CE-OE1 2.91Å; K647-E651 PolarHBondContact O-N 2.91Å; K647-G957 PolarHBondContact NZ-O 3.21Å
648	Q	78.4	Confident	72.3	Confident	76 Å²	76	60.4 Å²	60.4	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-43.3	179.6	-72.7	-179.9	-17.5	0	0	112.3	R644 L645 I650 E651 L652	R644-Q648 VanDerWaalsContact NH1-NE2 3.1Å; R644-Q648 WeakPolarHBondContact O-CG 3.42Å; R644-Q648 PolarHBondContact O-N 2.92Å; L645-Q648 PolarHBondContact O-N 3.33Å; Q648-I650 VanDerWaalsContact C-N 3.31Å; Q648-I650 PolarHBondContact O-N 2.87Å; Q648-E651 PolarHBondContact O-N 3.25Å; Q648-L652 WeakPolarHBondContact O-CD1 3.41Å; Q648-L652 PolarHBondContact O-N 3.47Å; Q648-L652 VanDerWaalsContact O-N 3.08Å
649	R	73.1	Confident	69.6	Low	54 Å²	54	64.5 Å²	64.5	20%	0.204	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-37.9	177.5	-71.2	174.2	-177.8	-147.7	-2.3	112.6	S613 E614 L645 S646 K647 L652 S653	S613-R649 PolarHBondContact OG-NH2 3.21Å; E614-R649 IonicContact OE1-CZ 3.72Å; E614-R649 IonicContact OE1-NH1 2.82Å; E614-R649 PolarHBondContact OE1-NH1 2.86Å; E614-R649 IonicContact OE1-NH2 3.59Å; E614-R649 IonicContact OE2-NH1 2.64Å; L645-R649 WeakPolarHBondContact O-CG 3.38Å; L645-R649 PolarHBondContact O-N 3.13Å; S646-R649 PolarHBondContact O-N 3.37Å; K647-R649 PolarHBondContact O-N 2.87Å; R649-L652 PolarHBondContact O-N 3.06Å; R649-S653 WeakPolarHBondContact O-CB 3.22Å; R649-S653 PolarHBondContact O-N 2.87Å; R649-S653 PolarHBondContact O-OG 2.78Å
650	I	72.5	Confident	66.7	Low	5 Å²	5	69.1 Å²	69.1	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-43.3	176.7	-76.9	166.4	0	0	0	110.9	S646 K647 Q648 S653 S654 L712 Q715 R716	S646-I650 WeakPolarHBondContact O-CB 3.49Å; S646-I650 VanDerWaalsContact O-CD1 3.29Å; S646-I650 WeakPolarHBondContact O-CD1 3.36Å; S646-I650 WeakPolarHBondContact O-CG1 3.16Å; S646-I650 PolarHBondContact O-N 3.31Å; S646-I650 VanDerWaalsContact O-N 3.14Å; K647-I650 WeakPolarHBondContact O-CB 3.44Å; K647-I650 PolarHBondContact O-N 2.89Å; Q648-I650 VanDerWaalsContact C-N 3.31Å; Q648-I650 PolarHBondContact O-N 2.87Å; I650-S653 PolarHBondContact O-N 3.31Å; I650-S654 PolarHBondContact O-N 3.48Å; I650-S654 VanDerWaalsContact O-N 3.12Å; I650-S654 PolarHBondContact O-OG 2.99Å; I650-L712 HydrophobicContact CB-CD1 4.18Å; I650-L712 HydrophobicContact CB-CG 4.48Å; I650-L712 HydrophobicContact CG1-CD1 4.18Å; I650-L712 HydrophobicContact CG2-CD1 3.73Å; I650-L712 HydrophobicContact CG2-CD2 3.76Å; I650-L712 HydrophobicContact CG2-CG 3.54Å; I650-Q715 HydrophobicContact CD1-CB 4Å; I650-R716 HydrophobicContact CD1-CG 3.73Å; I650-R716 HydrophobicContact CG2-CG 4.25Å
651	E	68.2	Low	63.8	Low	69 Å²	69	75.1 Å²	75.1	32%	0.322	39%	0.386	S	S	.	.	H	α-helix	trans	-64	-44.2	176.9	-72	168.5	-171.1	0	0	112.3	K647 Q648 S653 S654 M655	K647-E651 WeakPolarHBondContact CE-OE1 2.91Å; K647-E651 PolarHBondContact O-N 2.91Å; Q648-E651 PolarHBondContact O-N 3.25Å; E651-S653 VanDerWaalsContact C-N 3.31Å; E651-S653 PolarHBondContact O-N 3.46Å; E651-S654 WeakPolarHBondContact O-CB 3.4Å; E651-S654 PolarHBondContact O-N 2.99Å; E651-S654 VanDerWaalsContact O-N 3.14Å; E651-M655 PolarHBondContact O-N 3.24Å
652	L	64.6	Low	60.9	Low	118 Å²	118	80.4 Å²	80.4	62%	0.618	42%	0.418	S	S	*	.	H	α-helix	trans	-59.2	-40.8	174.3	-82.4	149.9	0	0	0	112.4	Q648 R649 S654 M655 N656	Q648-L652 WeakPolarHBondContact O-CD1 3.41Å; Q648-L652 PolarHBondContact O-N 3.47Å; Q648-L652 VanDerWaalsContact O-N 3.08Å; R649-L652 PolarHBondContact O-N 3.06Å; L652-S654 VanDerWaalsContact C-N 3.28Å; L652-S654 PolarHBondContact O-N 3.32Å; L652-M655 PolarHBondContact O-N 3.09Å; L652-N656 PolarHBondContact O-N 3.07Å
653	S	60.9	Low	57.9	Low	61 Å²	61	88.8 Å²	88.8	43%	0.427	46%	0.461	S	S	.	.	H	α-helix	trans	-66	-31.9	177.8	-57	0	0	0	0	112.4	R649 I650 E651	R649-S653 WeakPolarHBondContact O-CB 3.22Å; R649-S653 PolarHBondContact O-N 2.87Å; R649-S653 PolarHBondContact O-OG 2.78Å; I650-S653 PolarHBondContact O-N 3.31Å; E651-S653 VanDerWaalsContact C-N 3.31Å; E651-S653 PolarHBondContact O-N 3.46Å
654	S	55.2	Low	54.9	Low	35 Å²	35	91.8 Å²	91.8	25%	0.245	49%	0.493	C	S	.	.	H	α-helix	trans	-69.9	-37.8	179.3	-49.2	0	0	0	0	112.2	I650 E651 L652 L712	I650-S654 PolarHBondContact O-N 3.48Å; I650-S654 VanDerWaalsContact O-N 3.12Å; I650-S654 PolarHBondContact O-OG 2.99Å; E651-S654 WeakPolarHBondContact O-CB 3.4Å; E651-S654 PolarHBondContact O-N 2.99Å; E651-S654 VanDerWaalsContact O-N 3.14Å; L652-S654 VanDerWaalsContact C-N 3.28Å; L652-S654 PolarHBondContact O-N 3.32Å; S654-L712 VanDerWaalsContact OG-CD2 3.31Å; S654-L712 WeakPolarHBondContact OG-CD2 3.25Å
655	M	46.5	Very low	52.1	Low	144 Å²	144	96.5 Å²	96.5	71%	0.709	52%	0.518	S	S	*	.	H	α-helix	trans	-71.7	-31	-179.9	-75.6	-151.2	160.5	0	0	113.4	E651 L652 Q657 Y658	E651-M655 PolarHBondContact O-N 3.24Å; L652-M655 PolarHBondContact O-N 3.09Å; M655-Q657 VanDerWaalsContact C-N 3.26Å; M655-Q657 PolarHBondContact O-N 3.32Å; M655-Y658 PolarHBondContact O-N 3.02Å
656	N	45.2	Very low	49.3	Very low	115 Å²	115	104.8 Å²	104.8	62%	0.615	56%	0.556	S	S	*	*	H	α-helix	trans	-70	-19.9	-179.3	-75.8	-24	0	0	0	113.7	L652	L652-N656 PolarHBondContact O-N 3.07Å
657	Q	40.4	Very low	46.5	Very low	163 Å²	163	109.1 Å²	109.1	76%	0.762	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-23.7	177.8	-73.5	-176.2	-5	0	0	114	M655	M655-Q657 VanDerWaalsContact C-N 3.26Å; M655-Q657 PolarHBondContact O-N 3.32Å
658	Y	37.5	Very low	44	Very low	196 Å²	196	113.4 Å²	113.4	77%	0.769	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-15.7	179.7	-71.1	-78.2	0	0	0	113.6	M655	M655-Y658 PolarHBondContact O-N 3.02Å
659	S	35.6	Very low	41.4	Very low	85 Å²	85	118.7 Å²	118.7	59%	0.594	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-92.4	-0.3	-172.4	-59.1	0	0	0	0	114.7	N661	S659-N661 PolarHBondContact O-N 3.38Å
660	S	31	Very low	39.1	Very low	99 Å²	99	120.1 Å²	120.1	69%	0.692	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-86.3	5.5	-176.6	-51.7	0	0	0	0	115.4
661	N	28.1	Very low	36.9	Very low	161 Å²	161	129.2 Å²	129.2	86%	0.861	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-113.6	17.6	-177	-85.3	-13.6	0	0	0	116.1	S659	S659-N661 PolarHBondContact O-N 3.38Å
662	T	28	Very low	34.9	Very low	125 Å²	125	134.7 Å²	134.7	77%	0.767	72%	0.724	S	S	*	*			trans	-133.3	101.3	170.5	10.3	0	0	0	0	111.2	G664	T662-G664 PolarHBondContact O-N 3.12Å
663	I	27.8	Very low	33	Very low	178 Å²	178	136.3 Å²	136.3	91%	0.913	73%	0.733	S	S	*	*			trans	-63.1	116.7	166.7	-64.8	169.7	0	0	0	108
664	G	27	Very low	31.3	Very low	66 Å²	66	135.7 Å²	135.7	68%	0.68	74%	0.737	S	S	*	*			trans	-172.8	96.5	172.5	0	0	0	0	0	110	T662 H666	T662-G664 PolarHBondContact O-N 3.12Å; G664-H666 PolarHBondContact O-N 3.45Å
665	H	25.6	Very low	30	Very low	182 Å²	182	139.5 Å²	139.5	84%	0.843	76%	0.762	S	S	*	*			trans	-49.8	118.4	168.7	-82.2	-97.7	0	0	0	110.3
666	H	25.9	Very low	28.9	Very low	188 Å²	188	141 Å²	141	87%	0.87	77%	0.769	S	S	*	*			trans	-164.9	126.7	137.8	-93.9	-61.3	0	0	0	110.8	G664	G664-H666 PolarHBondContact O-N 3.45Å
667	S	25.4	Very low	28	Very low	113 Å²	113	143.2 Å²	143.2	79%	0.79	77%	0.773	S	S	*	*			trans	-70.7	117.6	176.8	57.6	0	0	0	0	111.9
668	I	26.4	Very low	27.6	Very low	149 Å²	149	139.2 Å²	139.2	76%	0.764	76%	0.761	S	S	*	*			trans	-146.7	92.9	155.3	-53.4	180	0	0	0	108.6
669	L	24.8	Very low	27.3	Very low	186 Å²	186	133.1 Å²	133.1	97%	0.974	75%	0.748	S	S	*	*			trans	-116.6	80.1	158.1	-96.5	158.3	0	0	0	106.3
670	S	24.2	Very low	27.5	Very low	85 Å²	85	132.4 Å²	132.4	59%	0.594	74%	0.742	S	S	*	*			trans	-156.1	131.8	161.5	69.6	0	0	0	0	109.2
671	K	26.1	Very low	27.7	Very low	196 Å²	196	130.7 Å²	130.7	85%	0.852	73%	0.731	S	S	*	*	S	Bend	trans	92.8	124.7	164.2	-60.6	-178.7	176.6	-179.9	0	118.1
672	Q	27.2	Very low	28.6	Very low	184 Å²	184	128 Å²	128	86%	0.86	72%	0.716	S	S	*	*			trans	87.2	86.4	159.9	-66.7	178.3	-6.8	0	0	117.1	G674	Q672-G674 PolarHBondContact O-N 3.03Å
673	N	24.9	Very low	29.4	Very low	151 Å²	151	125.4 Å²	125.4	81%	0.807	70%	0.695	S	S	*	*			trans	-51.4	78.1	134.3	-75.3	-16	0	0	0	109.6
674	G	24.4	Very low	30.5	Very low	49 Å²	49	120.1 Å²	120.1	51%	0.505	67%	0.668	S	S	.	*			trans	-125.4	102.3	155.4	0	0	0	0	0	104.1	Q672 M676	Q672-G674 PolarHBondContact O-N 3.03Å; G674-M676 PolarHBondContact O-N 2.97Å
675	C	27.5	Very low	31.9	Very low	115 Å²	115	121 Å²	121	78%	0.777	66%	0.656	S	S	*	*			trans	-62.1	89.1	169.8	-175.4	0	0	0	0	106.8	K677	C675-K677 PolarHBondContact O-N 3.22Å
676	M	23.6	Very low	33.7	Very low	176 Å²	176	118.2 Å²	118.2	87%	0.867	64%	0.642	S	S	*	*			trans	-58	96.7	160.8	-79.2	-85.1	148.1	0	0	104.7	G674 P678	G674-M676 PolarHBondContact O-N 2.97Å; M676-P678 VanDerWaalsContact O-N 3.12Å
677	K	27.2	Very low	35.2	Very low	161 Å²	161	110 Å²	110	70%	0.7	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-46.3	123	165.7	-75.7	-174.4	175.1	-171.8	0	105.1	C675 S679	C675-K677 PolarHBondContact O-N 3.22Å; K677-S679 PolarHBondContact O-N 3.35Å
678	P	30.6	Very low	36.9	Very low	78 Å²	78	106.1 Å²	106.1	51%	0.506	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-53.6	122.4	173.5	21.7	-28.9	0	0	0	105.9	M676 S680	M676-P678 VanDerWaalsContact O-N 3.12Å; P678-S680 PolarHBondContact O-N 3.23Å
679	S	32.9	Very low	38.6	Very low	69 Å²	69	105 Å²	105	48%	0.483	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-54	133	175.5	51.7	0	0	0	0	106.8	K677 S681 N682	K677-S679 PolarHBondContact O-N 3.35Å; S679-S681 PolarHBondContact O-N 2.75Å; S679-S681 PolarHBondContact OG-OG 2.87Å; S679-N682 PolarHBondContact O-N 3.16Å
680	S	38.7	Very low	40.2	Very low	69 Å²	69	98 Å²	98	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-48.7	-19	-177.9	51.5	0	0	0	0	113.7	P678 M684	P678-S680 PolarHBondContact O-N 3.23Å; S680-M684 PolarHBondContact O-N 2.99Å
681	S	36.7	Very low	41.7	Very low	64 Å²	64	94.8 Å²	94.8	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-57.5	-39	170.6	65.6	0	0	0	0	115.1	S679 M684 D685	S679-S681 PolarHBondContact O-N 2.75Å; S679-S681 PolarHBondContact OG-OG 2.87Å; S681-M684 PolarHBondContact O-N 3.34Å; S681-D685 PolarHBondContact O-N 3.4Å; S681-D685 VanDerWaalsContact O-N 3.09Å
682	N	46.7	Very low	43	Very low	103 Å²	103	91.6 Å²	91.6	55%	0.551	49%	0.493	S	S	*	.	H	α-helix	trans	-76.4	-37.4	-172.9	-81.3	-3.7	0	0	0	112.9	S679 M684 F686	S679-N682 PolarHBondContact O-N 3.16Å; N682-M684 VanDerWaalsContact C-N 3.29Å; N682-F686 PolarHBondContact O-N 3.22Å
683	E	44.2	Very low	43.9	Very low	72 Å²	72	89.3 Å²	89.3	34%	0.336	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-38.6	172.8	-70.9	-173.6	157.9	0	0	111.1	F686 F687 S962	E683-F686 PolarHBondContact O-N 3.43Å; E683-F687 PolarHBondContact O-N 3.24Å; E683-S962 PolarHBondContact OE2-OG 3.13Å; E683-S962 VanDerWaalsContact OE2-OG 3.1Å
684	M	51.6	Low	44.8	Very low	67 Å²	67	85.2 Å²	85.2	33%	0.33	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-47.9	178.7	-168.2	-72.4	178	0	0	111.6	S680 S681 N682 F686 F687 T688 L965	S680-M684 PolarHBondContact O-N 2.99Å; S681-M684 PolarHBondContact O-N 3.34Å; N682-M684 VanDerWaalsContact C-N 3.29Å; M684-F686 PolarHBondContact O-N 3.4Å; M684-F687 PolarHBondContact O-N 3.32Å; M684-T688 HydrophobicContact CE-CG2 4.35Å; M684-T688 WeakPolarHBondContact CE-OG1 3.44Å; M684-T688 WeakPolarHBondContact O-CB 3.33Å; M684-T688 PolarHBondContact O-N 3.32Å; M684-T688 PolarHBondContact O-OG1 2.87Å; M684-T688 PolarHBondContact SD-OG1 3.22Å; M684-L965 HydrophobicContact CB-CD2 4.11Å; M684-L965 HydrophobicContact CE-CD2 4.17Å; M684-L965 HydrophobicContact CG-CD2 3.22Å
685	D	55.8	Low	45.6	Very low	83 Å²	83	89.1 Å²	89.1	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-60	-36.3	-179.9	-127.5	40	0	0	0	111.2	S681 K689	S681-D685 PolarHBondContact O-N 3.4Å; S681-D685 VanDerWaalsContact O-N 3.09Å; D685-K689 VanDerWaalsContact O-CB 3.23Å; D685-K689 WeakPolarHBondContact O-CB 3.38Å; D685-K689 VanDerWaalsContact O-CD 3.26Å; D685-K689 WeakPolarHBondContact O-CD 3.43Å; D685-K689 WeakPolarHBondContact O-CG 3.47Å; D685-K689 PolarHBondContact O-N 3.12Å; D685-K689 IonicContact OD2-NZ 2.61Å; D685-K689 PolarHBondContact OD2-NZ 2.82Å
686	F	62.2	Low	45.9	Very low	125 Å²	125	90.2 Å²	90.2	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-69.8	-50.5	175.4	179.5	-104	0	0	0	112.5	N682 E683 M684 T688 K689 L690	N682-F686 PolarHBondContact O-N 3.22Å; E683-F686 PolarHBondContact O-N 3.43Å; M684-F686 PolarHBondContact O-N 3.4Å; F686-T688 VanDerWaalsContact C-N 3.31Å; F686-T688 PolarHBondContact O-N 2.96Å; F686-K689 PolarHBondContact O-N 3.35Å; F686-L690 HydrophobicContact CD1-CD1 3.64Å; F686-L690 HydrophobicContact CE1-CD1 3.25Å; F686-L690 HydrophobicContact CE1-CG 4.44Å; F686-L690 HydrophobicContact CE2-CD1 4.19Å; F686-L690 HydrophobicContact CG-CD1 4.26Å; F686-L690 HydrophobicContact CZ-CD1 3.57Å; F686-L690 HydrophobicContact CZ-CG 4.39Å; F686-L690 PolarHBondContact O-N 3.38Å
687	F	58.7	Low	46.2	Very low	14 Å²	14	86.4 Å²	86.4	6%	0.061	46%	0.463	C	S	.	.	H	α-helix	trans	-62.8	-38.5	-179.7	-162.6	-92.1	0	0	0	111.9	E683 M684 L690 L691 V743 A746 Q966 V969 L970	E683-F687 PolarHBondContact O-N 3.24Å; M684-F687 PolarHBondContact O-N 3.32Å; F687-L690 PolarHBondContact O-N 3.39Å; F687-L691 HydrophobicContact CD1-CD1 4.09Å; F687-L691 HydrophobicContact CE1-CD1 4.03Å; F687-L691 PolarHBondContact O-N 2.86Å; F687-V743 HydrophobicContact CE2-CG2 4.26Å; F687-A746 HydrophobicContact CE1-CB 4.1Å; F687-A746 HydrophobicContact CE2-CB 3.91Å; F687-A746 HydrophobicContact CZ-CB 3.56Å; F687-Q966 HydrophobicContact CD1-CG 4.17Å; F687-Q966 HydrophobicContact CD2-CG 4.01Å; F687-Q966 HydrophobicContact CE1-CB 4.07Å; F687-Q966 HydrophobicContact CE1-CG 4.02Å; F687-Q966 HydrophobicContact CE2-CB 4.39Å; F687-Q966 HydrophobicContact CE2-CG 3.85Å; F687-Q966 HydrophobicContact CG-CG 4.17Å; F687-Q966 HydrophobicContact CZ-CB 3.93Å; F687-Q966 HydrophobicContact CZ-CG 3.85Å; F687-V969 HydrophobicContact CD1-CG1 4.36Å; F687-V969 HydrophobicContact CE1-CB 4.41Å; F687-V969 HydrophobicContact CE1-CG1 4.2Å; F687-L970 HydrophobicContact CE1-CG 4.48Å; F687-L970 HydrophobicContact CZ-CD1 4.44Å; F687-L970 HydrophobicContact CZ-CG 4.28Å
688	T	61.1	Low	46.2	Very low	33 Å²	33	86.8 Å²	86.8	20%	0.202	47%	0.472	C	S	.	.	H	α-helix	trans	-72.1	-36.9	177.7	-51.6	0	0	0	0	111.8	M684 F686 L691 H692	M684-T688 HydrophobicContact CE-CG2 4.35Å; M684-T688 WeakPolarHBondContact CE-OG1 3.44Å; M684-T688 WeakPolarHBondContact O-CB 3.33Å; M684-T688 PolarHBondContact O-N 3.32Å; M684-T688 PolarHBondContact O-OG1 2.87Å; M684-T688 PolarHBondContact SD-OG1 3.22Å; F686-T688 VanDerWaalsContact C-N 3.31Å; F686-T688 PolarHBondContact O-N 2.96Å; T688-L691 PolarHBondContact O-N 3.39Å; T688-H692 PolarHBondContact O-N 3.03Å; T688-H692 VanDerWaalsContact O-N 3.15Å; T688-H692 PolarHBondContact O-ND1 3.14Å
689	K	62.6	Low	46	Very low	124 Å²	124	86.9 Å²	86.9	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-37.6	173	-80.6	168	-166.5	154.8	0	112.6	D685 F686 L691 H692 N693	D685-K689 VanDerWaalsContact O-CB 3.23Å; D685-K689 WeakPolarHBondContact O-CB 3.38Å; D685-K689 VanDerWaalsContact O-CD 3.26Å; D685-K689 WeakPolarHBondContact O-CD 3.43Å; D685-K689 WeakPolarHBondContact O-CG 3.47Å; D685-K689 PolarHBondContact O-N 3.12Å; D685-K689 IonicContact OD2-NZ 2.61Å; D685-K689 PolarHBondContact OD2-NZ 2.82Å; F686-K689 PolarHBondContact O-N 3.35Å; K689-L691 PolarHBondContact O-N 3.19Å; K689-H692 PolarHBondContact O-N 3.06Å; K689-N693 PolarHBondContact O-N 3.21Å; K689-N693 VanDerWaalsContact O-N 3.17Å
690	L	58.5	Low	45.9	Very low	41 Å²	41	91.2 Å²	91.2	22%	0.215	49%	0.493	C	S	.	.	H	α-helix	trans	-58.1	-37.4	176.5	-85.6	155.4	0	0	0	112.2	F686 F687 M747	F686-L690 HydrophobicContact CD1-CD1 3.64Å; F686-L690 HydrophobicContact CE1-CD1 3.25Å; F686-L690 HydrophobicContact CE1-CG 4.44Å; F686-L690 HydrophobicContact CE2-CD1 4.19Å; F686-L690 HydrophobicContact CG-CD1 4.26Å; F686-L690 HydrophobicContact CZ-CD1 3.57Å; F686-L690 HydrophobicContact CZ-CG 4.39Å; F686-L690 PolarHBondContact O-N 3.38Å; F687-L690 PolarHBondContact O-N 3.39Å; L690-M747 HydrophobicContact CD2-CG 3.74Å; L690-M747 HydrophobicContact CD2-SD 3.91Å
691	L	55.4	Low	45.7	Very low	17 Å²	17	92.6 Å²	92.6	9%	0.089	50%	0.502	C	S	.	.	H	α-helix	trans	-79.2	-39.8	179.3	-68.2	159.7	0	0	0	113	F687 T688 K689 N693 A746 V969 T973	F687-L691 HydrophobicContact CD1-CD1 4.09Å; F687-L691 HydrophobicContact CE1-CD1 4.03Å; F687-L691 PolarHBondContact O-N 2.86Å; T688-L691 PolarHBondContact O-N 3.39Å; K689-L691 PolarHBondContact O-N 3.19Å; L691-N693 VanDerWaalsContact C-N 3.34Å; L691-N693 PolarHBondContact O-N 2.99Å; L691-A746 HydrophobicContact CD2-CB 3.89Å; L691-A746 HydrophobicContact CG-CB 4.27Å; L691-V969 HydrophobicContact CD1-CB 4.39Å; L691-V969 HydrophobicContact CD1-CG1 2.99Å; L691-V969 HydrophobicContact CG-CG1 4.47Å; L691-T973 HydrophobicContact CD2-CG2 4.3Å
692	H	52.7	Low	45.7	Very low	128 Å²	128	94.4 Å²	94.4	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-71.9	-25.2	-177.7	-76	81.7	0	0	0	113.7	T688 K689 N694 N695	T688-H692 PolarHBondContact O-N 3.03Å; T688-H692 VanDerWaalsContact O-N 3.15Å; T688-H692 PolarHBondContact O-ND1 3.14Å; K689-H692 PolarHBondContact O-N 3.06Å; H692-N694 PolarHBondContact O-N 3.15Å; H692-N695 PolarHBondContact O-N 3.45Å
693	N	46.1	Very low	45.3	Very low	136 Å²	136	96.5 Å²	96.5	73%	0.727	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.8	-178	-118.2	0.5	0	0	0	113.9	K689 L691	K689-N693 PolarHBondContact O-N 3.21Å; K689-N693 VanDerWaalsContact O-N 3.17Å; L691-N693 VanDerWaalsContact C-N 3.34Å; L691-N693 PolarHBondContact O-N 2.99Å
694	N	44.7	Very low	45	Very low	65 Å²	65	102 Å²	102	35%	0.348	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.2	-177.8	-82.2	-19.7	0	0	0	115.1	H692 H748	H692-N694 PolarHBondContact O-N 3.15Å; N694-H748 PolarHBondContact ND2-CD2 2.82Å
695	N	40	Very low	44.6	Very low	131 Å²	131	106.4 Å²	106.4	70%	0.701	56%	0.557	S	S	*	*	S	Bend	trans	-87.4	-10.4	-179.1	-78.1	-22.7	0	0	0	114.6	H692 S697	H692-N695 PolarHBondContact O-N 3.45Å; N695-S697 PolarHBondContact O-N 2.91Å
696	N	33.8	Very low	44.1	Very low	138 Å²	138	107 Å²	107	74%	0.738	56%	0.559	S	S	*	*			trans	-97.4	84.6	173	-87.7	-19.3	0	0	0	111.1	N698	N696-N698 PolarHBondContact O-N 3.01Å
697	S	29.4	Very low	43.4	Very low	97 Å²	97	103.1 Å²	103.1	68%	0.678	55%	0.553	S	S	*	*			trans	-68.4	74.9	165.7	-70.6	0	0	0	0	110.8	N695	N695-S697 PolarHBondContact O-N 2.91Å
698	N	27.9	Very low	43.3	Very low	168 Å²	168	110.8 Å²	110.8	90%	0.898	59%	0.587	S	S	*	*			trans	-157.3	36.4	166.3	-111.8	-3.4	0	0	0	115.6	N696	N696-N698 PolarHBondContact O-N 3.01Å
699	S	27.6	Very low	43.5	Very low	81 Å²	81	110.6 Å²	110.6	57%	0.566	58%	0.584	S	S	*	*			trans	-138.2	94.3	166	41	0	0	0	0	110.8	S701	S699-S701 PolarHBondContact O-N 3.34Å
700	N	30.4	Very low	43.9	Very low	159 Å²	159	108.1 Å²	108.1	85%	0.85	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	15.9	-175.4	-96.1	-12.9	0	0	0	115.4
701	S	34.6	Very low	44.5	Very low	98 Å²	98	111.4 Å²	111.4	69%	0.685	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	-15.9	-175.2	58.4	0	0	0	0	116	S699	S699-S701 PolarHBondContact O-N 3.34Å
702	N	36.7	Very low	45.2	Very low	103 Å²	103	112.5 Å²	112.5	55%	0.551	60%	0.603	S	S	*	*	S	Bend	trans	-110.2	3.2	-174.4	-73.1	9.5	0	0	0	115.3	H704	N702-H704 PolarHBondContact O-N 2.76Å; N702-H704 VanDerWaalsContact O-N 3.17Å
703	K	37.6	Very low	46.2	Very low	146 Å²	146	107.1 Å²	107.1	64%	0.635	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-11.8	-178.8	-85	-178.1	175.2	175.9	0	115
704	H	37.3	Very low	47.9	Very low	187 Å²	187	105.1 Å²	105.1	87%	0.866	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-9.8	-177.7	-94.6	-55.7	0	0	0	115.6	N702	N702-H704 PolarHBondContact O-N 2.76Å; N702-H704 VanDerWaalsContact O-N 3.17Å
705	E	43.6	Very low	49.5	Very low	161 Å²	161	107 Å²	107	75%	0.752	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-17.9	174.5	-77.9	-173.8	154.2	0	0	113.6	G707	E705-G707 PolarHBondContact O-N 2.82Å
706	I	45.8	Very low	51.3	Low	96 Å²	96	104.3 Å²	104.3	49%	0.492	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.5	93.2	178.1	-57	168.1	0	0	0	108.3
707	G	46.6	Very low	53.7	Low	42 Å²	42	98.1 Å²	98.1	43%	0.433	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	137.2	-0.2	174.3	0	0	0	0	0	116.9	E705	E705-G707 PolarHBondContact O-N 2.82Å
708	K	56.3	Low	56.3	Low	175 Å²	175	96.6 Å²	96.6	76%	0.761	50%	0.501	S	S	*	.	S	Bend	trans	-95.5	126.8	167.3	-74.5	-175.4	179.8	177.8	0	109.6	T710	K708-T710 PolarHBondContact O-N 3.45Å
709	L	65.6	Low	59	Low	29 Å²	29	88.9 Å²	88.9	15%	0.152	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-57.9	123.9	174.1	-122.8	97.4	0	0	0	109.4	D713 K714 I717 A752	L709-D713 HydrophobicContact CD2-CB 3.75Å; L709-D713 HydrophobicContact CG-CB 3.76Å; L709-K714 HydrophobicContact CB-CG 4.27Å; L709-K714 HydrophobicContact CD2-CB 4.26Å; L709-K714 HydrophobicContact CD2-CG 3.53Å; L709-I717 HydrophobicContact CD2-CD1 3.69Å; L709-A752 HydrophobicContact CD1-CB 3.29Å; L709-A752 HydrophobicContact CG-CB 4.41Å
710	T	72.2	Confident	61.9	Low	72 Å²	72	85 Å²	85	44%	0.442	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-65.7	155.8	170	66.8	0	0	0	0	109.2	K708 L712 D713 K714	K708-T710 PolarHBondContact O-N 3.45Å; T710-L712 PolarHBondContact O-N 3.4Å; T710-D713 WeakPolarHBondContact CB-OD2 3.17Å; T710-D713 PolarHBondContact N-OD2 2.96Å; T710-D713 VanDerWaalsContact N-OD2 3.16Å; T710-D713 WeakPolarHBondContact O-CB 3.23Å; T710-D713 PolarHBondContact O-N 3.08Å; T710-D713 PolarHBondContact OG1-N 3.14Å; T710-D713 VanDerWaalsContact OG1-N 3.11Å; T710-D713 PolarHBondContact OG1-OD2 3.31Å; T710-K714 PolarHBondContact O-N 2.89Å; T710-K714 VanDerWaalsContact O-N 3.09Å
711	D	70.9	Confident	64.7	Low	110 Å²	110	79.5 Å²	79.5	59%	0.588	40%	0.404	S	S	*	.	H	α-helix	trans	-62.3	-27.9	176	-66.8	-39.5	0	0	0	111.7	K714 Q715	D711-K714 PolarHBondContact O-N 3.42Å; D711-K714 IonicContact OD1-NZ 2.92Å; D711-K714 PolarHBondContact OD1-NZ 3.46Å; D711-Q715 WeakPolarHBondContact O-CG 3.48Å; D711-Q715 PolarHBondContact O-N 2.94Å
712	L	69.8	Low	67.3	Low	41 Å²	41	75.1 Å²	75.1	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-63.5	-43.3	172	-155	78.6	0	0	0	111.9	I650 S654 T710 K714 Q715 R716	I650-L712 HydrophobicContact CB-CD1 4.18Å; I650-L712 HydrophobicContact CB-CG 4.48Å; I650-L712 HydrophobicContact CG1-CD1 4.18Å; I650-L712 HydrophobicContact CG2-CD1 3.73Å; I650-L712 HydrophobicContact CG2-CD2 3.76Å; I650-L712 HydrophobicContact CG2-CG 3.54Å; S654-L712 VanDerWaalsContact OG-CD2 3.31Å; S654-L712 WeakPolarHBondContact OG-CD2 3.25Å; T710-L712 PolarHBondContact O-N 3.4Å; L712-K714 VanDerWaalsContact C-N 3.32Å; L712-K714 PolarHBondContact O-N 3.43Å; L712-Q715 PolarHBondContact O-N 3.27Å; L712-R716 WeakPolarHBondContact O-CG 3.33Å; L712-R716 PolarHBondContact O-N 3.22Å
713	D	73.4	Confident	69.8	Low	15 Å²	15	70.2 Å²	70.2	8%	0.08	35%	0.346	C	S	.	.	H	α-helix	trans	-64.3	-37.8	175.5	-63.9	-39.5	0	0	0	111.4	L709 T710 Q715 R716 I717 F744	L709-D713 HydrophobicContact CD2-CB 3.75Å; L709-D713 HydrophobicContact CG-CB 3.76Å; T710-D713 WeakPolarHBondContact CB-OD2 3.17Å; T710-D713 PolarHBondContact N-OD2 2.96Å; T710-D713 VanDerWaalsContact N-OD2 3.16Å; T710-D713 WeakPolarHBondContact O-CB 3.23Å; T710-D713 PolarHBondContact O-N 3.08Å; T710-D713 PolarHBondContact OG1-N 3.14Å; T710-D713 VanDerWaalsContact OG1-N 3.11Å; T710-D713 PolarHBondContact OG1-OD2 3.31Å; D713-Q715 VanDerWaalsContact C-N 3.34Å; D713-Q715 PolarHBondContact O-N 3.43Å; D713-R716 PolarHBondContact O-N 2.92Å; D713-R716 IonicContact OD1-NH1 3.74Å; D713-I717 WeakPolarHBondContact O-CG1 3.3Å; D713-I717 PolarHBondContact O-N 3.48Å; D713-F744 HydrophobicContact CB-CE1 4.07Å; D713-F744 HydrophobicContact CB-CZ 3.93Å
714	K	81.5	Confident	72.3	Confident	94 Å²	94	64.7 Å²	64.7	41%	0.409	32%	0.322	S	S	.	.	H	α-helix	trans	-63.2	-42.8	176	-64.2	176.6	-165.8	153.9	0	110.9	L709 T710 D711 L712 R716 I717 I718	L709-K714 HydrophobicContact CB-CG 4.27Å; L709-K714 HydrophobicContact CD2-CB 4.26Å; L709-K714 HydrophobicContact CD2-CG 3.53Å; T710-K714 PolarHBondContact O-N 2.89Å; T710-K714 VanDerWaalsContact O-N 3.09Å; D711-K714 PolarHBondContact O-N 3.42Å; D711-K714 IonicContact OD1-NZ 2.92Å; D711-K714 PolarHBondContact OD1-NZ 3.46Å; L712-K714 VanDerWaalsContact C-N 3.32Å; L712-K714 PolarHBondContact O-N 3.43Å; K714-R716 VanDerWaalsContact C-N 3.34Å; K714-R716 PolarHBondContact O-N 3.19Å; K714-I717 PolarHBondContact O-N 3.38Å; K714-I718 WeakPolarHBondContact O-CB 3.31Å; K714-I718 WeakPolarHBondContact O-CD1 3.35Å; K714-I718 VanDerWaalsContact O-CG1 3.23Å; K714-I718 WeakPolarHBondContact O-CG1 3.35Å; K714-I718 PolarHBondContact O-N 2.88Å
715	Q	78.2	Confident	74.7	Confident	105 Å²	105	60.1 Å²	60.1	49%	0.491	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-40.8	177	-72.7	177.3	-4.3	0	0	111.9	I650 D711 L712 D713 I717 I718 A719	I650-Q715 HydrophobicContact CD1-CB 4Å; D711-Q715 WeakPolarHBondContact O-CG 3.48Å; D711-Q715 PolarHBondContact O-N 2.94Å; L712-Q715 PolarHBondContact O-N 3.27Å; D713-Q715 VanDerWaalsContact C-N 3.34Å; D713-Q715 PolarHBondContact O-N 3.43Å; Q715-I717 PolarHBondContact O-N 3.35Å; Q715-I718 PolarHBondContact O-N 3.09Å; Q715-A719 PolarHBondContact O-N 2.94Å
716	R	77.4	Confident	76.8	Confident	74 Å²	74	53.6 Å²	53.6	28%	0.279	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-43.5	174.5	-70.6	-179.8	174.1	154.2	-3.7	112.3	I650 L712 D713 K714 A719 L740	I650-R716 HydrophobicContact CD1-CG 3.73Å; I650-R716 HydrophobicContact CG2-CG 4.25Å; L712-R716 WeakPolarHBondContact O-CG 3.33Å; L712-R716 PolarHBondContact O-N 3.22Å; D713-R716 PolarHBondContact O-N 2.92Å; D713-R716 IonicContact OD1-NH1 3.74Å; K714-R716 VanDerWaalsContact C-N 3.34Å; K714-R716 PolarHBondContact O-N 3.19Å; R716-A719 WeakPolarHBondContact O-CB 3.4Å; R716-A719 PolarHBondContact O-N 3.44Å; R716-L740 HydrophobicContact CB-CD1 4.44Å; R716-L740 HydrophobicContact CB-CD2 3.9Å
717	I	84.6	Confident	78.8	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.041	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-43.4	177	-64.7	179.6	0	0	0	110.6	L709 D713 K714 Q715 A719 M720 L740 F744 Q755 V756 K759	L709-I717 HydrophobicContact CD2-CD1 3.69Å; D713-I717 WeakPolarHBondContact O-CG1 3.3Å; D713-I717 PolarHBondContact O-N 3.48Å; K714-I717 PolarHBondContact O-N 3.38Å; Q715-I717 PolarHBondContact O-N 3.35Å; I717-A719 VanDerWaalsContact C-N 3.25Å; I717-A719 PolarHBondContact O-N 2.83Å; I717-M720 WeakPolarHBondContact O-CB 3.3Å; I717-M720 PolarHBondContact O-N 3.36Å; I717-L740 HydrophobicContact CG1-CD1 4.22Å; I717-F744 HydrophobicContact CD1-CE2 4.28Å; I717-F744 HydrophobicContact CG1-CE2 4.46Å; I717-Q755 HydrophobicContact CD1-CB 4.41Å; I717-V756 HydrophobicContact CD1-CG2 3.89Å; I717-V756 HydrophobicContact CG1-CG2 3.98Å; I717-K759 HydrophobicContact CG2-CB 4.2Å; I717-K759 HydrophobicContact CG2-CG 3.76Å
718	I	84.8	Confident	80.7	Confident	64 Å²	64	55.8 Å²	55.8	33%	0.328	28%	0.275	S	S	.	.	H	α-helix	trans	-66	-27.3	179.2	-68.9	164.6	0	0	0	112.1	R621 K714 Q715 M720 D721	R621-I718 VanDerWaalsContact NH1-CG2 3.28Å; R621-I718 PolarHBondContact NH1-O 2.85Å; K714-I718 WeakPolarHBondContact O-CB 3.31Å; K714-I718 WeakPolarHBondContact O-CD1 3.35Å; K714-I718 VanDerWaalsContact O-CG1 3.23Å; K714-I718 WeakPolarHBondContact O-CG1 3.35Å; K714-I718 PolarHBondContact O-N 2.88Å; Q715-I718 PolarHBondContact O-N 3.09Å; I718-M720 PolarHBondContact O-N 3.29Å; I718-D721 VanDerWaalsContact O-CB 3.31Å; I718-D721 WeakPolarHBondContact O-CB 3.43Å; I718-D721 PolarHBondContact O-N 3.48Å; I718-D721 VanDerWaalsContact O-N 3.15Å
719	A	84.5	Confident	82.4	Confident	7 Å²	7	47.5 Å²	47.5	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-26.9	176.3	0	0	0	0	0	112.6	S646 Q715 R716 I717 D721 W722	S646-A719 WeakPolarHBondContact OG-CB 3.33Å; Q715-A719 PolarHBondContact O-N 2.94Å; R716-A719 WeakPolarHBondContact O-CB 3.4Å; R716-A719 PolarHBondContact O-N 3.44Å; I717-A719 VanDerWaalsContact C-N 3.25Å; I717-A719 PolarHBondContact O-N 2.83Å; A719-D721 PolarHBondContact O-N 2.74Å; A719-W722 PolarHBondContact O-N 3.37Å
720	M	88.1	Confident	83.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-63.2	-28.3	175.3	-61.8	172.7	60.3	0	0	112.5	I717 I718 W722 L723 F724 L736 A737 L740 V756 L760	I717-M720 WeakPolarHBondContact O-CB 3.3Å; I717-M720 PolarHBondContact O-N 3.36Å; I718-M720 PolarHBondContact O-N 3.29Å; M720-W722 PolarHBondContact O-N 3.22Å; M720-W722 VanDerWaalsContact O-N 3.08Å; M720-L723 PolarHBondContact O-N 3.36Å; M720-F724 HydrophobicContact CB-CE1 4.13Å; M720-F724 HydrophobicContact CB-CE2 4.49Å; M720-F724 HydrophobicContact CB-CZ 3.77Å; M720-F724 HydrophobicContact CE-CE1 4.42Å; M720-F724 HydrophobicContact CE-CZ 4.16Å; M720-F724 WeakPolarHBondContact O-CD1 3.43Å; M720-F724 WeakPolarHBondContact O-CE1 3.24Å; M720-L736 HydrophobicContact CB-CD2 4.31Å; M720-L736 HydrophobicContact CG-CD2 3.61Å; M720-L736 HydrophobicContact CG-CG 3.97Å; M720-A737 HydrophobicContact CE-CB 3.53Å; M720-L740 HydrophobicContact CG-CD1 4.34Å; M720-L740 HydrophobicContact SD-CD1 3.67Å; M720-V756 HydrophobicContact CE-CG1 4.22Å; M720-V756 HydrophobicContact SD-CG1 4.1Å; M720-L760 HydrophobicContact CE-CD2 3.6Å; M720-L760 HydrophobicContact CE-CG 4.2Å
721	D	88.7	Confident	84.4	Confident	43 Å²	43	44.2 Å²	44.2	23%	0.23	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-58	-28.4	-177	-65.7	-20.2	0	0	0	111.6	I718 A719 L723 F724 K759	I718-D721 VanDerWaalsContact O-CB 3.31Å; I718-D721 WeakPolarHBondContact O-CB 3.43Å; I718-D721 PolarHBondContact O-N 3.48Å; I718-D721 VanDerWaalsContact O-N 3.15Å; A719-D721 PolarHBondContact O-N 2.74Å; D721-L723 VanDerWaalsContact C-N 3.29Å; D721-L723 PolarHBondContact O-N 2.74Å; D721-F724 HydrophobicContact CB-CD2 4.35Å; D721-F724 WeakPolarHBondContact O-CB 3.47Å; D721-F724 PolarHBondContact O-N 3.13Å; D721-F724 VanDerWaalsContact O-N 3.16Å; D721-F724 VanDerWaalsContact OD1-CE2 3.24Å; D721-F724 WeakPolarHBondContact OD1-CE2 3.3Å; D721-K759 IonicContact OD1-NZ 3.72Å; D721-K759 IonicContact OD2-NZ 3.86Å; D721-K759 PolarHBondContact OD2-NZ 3.41Å
722	W	89.4	Confident	85.3	Confident	6 Å²	6	39.9 Å²	39.9	2%	0.023	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-63.4	-30.6	176.5	-69.4	106.4	0	0	0	113.8	L612 I615 R621 L625 T639 V642 V643 A719 M720 F724	L612-W722 HydrophobicContact CB-CH2 3.73Å; L612-W722 HydrophobicContact CB-CZ2 4.32Å; L612-W722 HydrophobicContact CB-CZ3 4.14Å; L612-W722 HydrophobicContact CD1-CZ3 4.13Å; L612-W722 HydrophobicContact CD2-CH2 4.04Å; L612-W722 HydrophobicContact CD2-CZ3 4.21Å; L612-W722 HydrophobicContact CG-CH2 4.3Å; L612-W722 HydrophobicContact CG-CZ3 4.4Å; L612-W722 WeakPolarHBondContact O-CH2 3.34Å; L612-W722 WeakPolarHBondContact O-CZ2 3.26Å; I615-W722 HydrophobicContact CB-CH2 4.43Å; R621-W722 HydrophobicContact CB-CH2 3.9Å; R621-W722 HydrophobicContact CB-CZ2 4.44Å; R621-W722 HydrophobicContact CB-CZ3 4Å; R621-W722 VanDerWaalsContact CD-CZ2 3.44Å; R621-W722 HydrophobicContact CG-CH2 3.44Å; R621-W722 VanDerWaalsContact CG-CH2 3.44Å; R621-W722 HydrophobicContact CG-CZ2 3.58Å; R621-W722 HydrophobicContact CG-CZ3 4.02Å; R621-W722 VanDerWaalsContact NE-CZ2 3.31Å; L625-W722 HydrophobicContact CD1-CE3 4.07Å; L625-W722 HydrophobicContact CD1-CZ3 4.2Å; L625-W722 HydrophobicContact CD2-CE3 4.15Å; L625-W722 HydrophobicContact CD2-CZ3 4.02Å; L625-W722 HydrophobicContact CG-CE3 4.33Å; L625-W722 HydrophobicContact CG-CZ3 4.05Å; T639-W722 VanDerWaalsContact CG2-O 3.32Å; T639-W722 WeakPolarHBondContact CG2-O 3.39Å; V642-W722 HydrophobicContact CG1-CD2 3.76Å; V642-W722 HydrophobicContact CG1-CE3 4.41Å; V642-W722 HydrophobicContact CG1-CG 3.89Å; V642-W722 HydrophobicContact CG1-CZ2 4.09Å; V643-W722 HydrophobicContact CG2-CB 4.29Å; A719-W722 PolarHBondContact O-N 3.37Å; M720-W722 PolarHBondContact O-N 3.22Å; M720-W722 VanDerWaalsContact O-N 3.08Å; W722-F724 VanDerWaalsContact C-N 3.32Å
723	L	90	Very high	86.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-85.1	-7.7	179.1	-59.8	176.5	0	0	0	112.3	V643 M720 D721 E732 A733 L736 L956	V643-L723 HydrophobicContact CG2-CD1 4.27Å; V643-L723 HydrophobicContact CG2-CD2 4.23Å; V643-L723 HydrophobicContact CG2-CG 4Å; M720-L723 PolarHBondContact O-N 3.36Å; D721-L723 VanDerWaalsContact C-N 3.29Å; D721-L723 PolarHBondContact O-N 2.74Å; L723-E732 HydrophobicContact CD1-CB 4.36Å; L723-A733 HydrophobicContact CB-CB 3.94Å; L723-A733 HydrophobicContact CD1-CB 4.4Å; L723-L736 HydrophobicContact CD1-CB 4.49Å; L723-L736 HydrophobicContact CD1-CD2 4.05Å; L723-L956 HydrophobicContact CD1-CD2 4.24Å
724	F	90.2	Very high	87.3	Confident	30 Å²	30	37.2 Å²	37.2	13%	0.132	18%	0.179	C	C	.	.	S	Bend	trans	-83.3	-18	-177.3	-61	-16	0	0	0	113.7	M720 D721 W722 R730 A733 K759 L760 P761	M720-F724 HydrophobicContact CB-CE1 4.13Å; M720-F724 HydrophobicContact CB-CE2 4.49Å; M720-F724 HydrophobicContact CB-CZ 3.77Å; M720-F724 HydrophobicContact CE-CE1 4.42Å; M720-F724 HydrophobicContact CE-CZ 4.16Å; M720-F724 WeakPolarHBondContact O-CD1 3.43Å; M720-F724 WeakPolarHBondContact O-CE1 3.24Å; D721-F724 HydrophobicContact CB-CD2 4.35Å; D721-F724 WeakPolarHBondContact O-CB 3.47Å; D721-F724 PolarHBondContact O-N 3.13Å; D721-F724 VanDerWaalsContact O-N 3.16Å; D721-F724 VanDerWaalsContact OD1-CE2 3.24Å; D721-F724 WeakPolarHBondContact OD1-CE2 3.3Å; W722-F724 VanDerWaalsContact C-N 3.32Å; F724-R730 PolarHBondContact O-NH2 3.17Å; F724-A733 HydrophobicContact CD1-CB 4.18Å; F724-A733 HydrophobicContact CE1-CB 4.01Å; F724-K759 VanDerWaalsContact CE2-O 3.29Å; F724-K759 WeakPolarHBondContact CE2-O 3.32Å; F724-L760 HydrophobicContact CE1-CD2 3.98Å; F724-L760 HydrophobicContact CZ-CD2 4.14Å; F724-P761 HydrophobicContact CB-CG 4.18Å; F724-P761 HydrophobicContact CD1-CG 4.19Å; F724-P761 HydrophobicContact CD2-CG 3.82Å; F724-P761 HydrophobicContact CE2-CG 4.26Å; F724-P761 HydrophobicContact CG-CG 3.81Å
725	Y	87.2	Confident	87.8	Confident	91 Å²	91	32.9 Å²	32.9	36%	0.357	16%	0.16	S	C	.	.	S	Bend	trans	-67.4	-42.4	-178.6	-175.3	-85.3	0	0	0	111.7	E622 L625 V629 L635 P727	E622-Y725 HydrophobicContact CG-CE2 4.17Å; L625-Y725 HydrophobicContact CB-CD1 4.38Å; L625-Y725 HydrophobicContact CB-CD2 4.12Å; L625-Y725 HydrophobicContact CB-CE1 4.22Å; L625-Y725 HydrophobicContact CB-CE2 3.96Å; L625-Y725 HydrophobicContact CB-CG 4.33Å; L625-Y725 HydrophobicContact CD1-CD1 4.24Å; L625-Y725 HydrophobicContact CD1-CD2 3.72Å; L625-Y725 HydrophobicContact CD1-CE2 4.4Å; L625-Y725 HydrophobicContact CD1-CG 3.62Å; V629-Y725 HydrophobicContact CG2-CE1 4.42Å; L635-Y725 HydrophobicContact CD1-CD1 4.34Å; L635-Y725 HydrophobicContact CD1-CE1 4.5Å; L635-Y725 HydrophobicContact CD2-CD1 3.76Å; L635-Y725 HydrophobicContact CD2-CE1 3.91Å; Y725-P727 WeakPolarHBondContact O-CD 3.28Å
726	N	87	Confident	88.3	Confident	23 Å²	23	28.9 Å²	28.9	12%	0.123	14%	0.142	C	C	.	.	S	Bend	trans	-94.9	116.1	176.3	-171.7	-5.7	0	0	0	111.2	L635 S636 D728 Q729	L635-N726 HydrophobicContact CD2-CB 3.9Å; S636-N726 PolarHBondContact OG-ND2 3.02Å; N726-D728 PolarHBondContact O-N 3.28Å; N726-D728 PolarHBondContact OD1-N 3.46Å; N726-Q729 HydrophobicContact CB-CB 4.49Å; N726-Q729 HydrophobicContact CB-CG 4.12Å; N726-Q729 PolarHBondContact O-N 3.32Å; N726-Q729 VanDerWaalsContact O-N 3.08Å
727	P	88.5	Confident	89.1	Confident	69 Å²	69	25.3 Å²	25.3	45%	0.448	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-58.3	-25.3	175.4	-24.5	35.3	0	0	0	114.5	Y725 Q729 R730 I771	Y725-P727 WeakPolarHBondContact O-CD 3.28Å; P727-Q729 PolarHBondContact O-N 3.1Å; P727-R730 WeakPolarHBondContact O-CG 3.36Å; P727-R730 PolarHBondContact O-N 3.19Å; P727-I771 WeakPolarHBondContact O-CD1 3.38Å
728	D	87.2	Confident	89.5	Confident	116 Å²	116	25 Å²	25	62%	0.62	13%	0.127	S	C	*	.	G	3₁₀ helix	trans	-72.9	-17	179.1	-63.4	-28.9	0	0	0	112.5	N726 R730	N726-D728 PolarHBondContact O-N 3.28Å; N726-D728 PolarHBondContact OD1-N 3.46Å; D728-R730 VanDerWaalsContact C-N 3.33Å
729	Q	90.6	Very high	89.7	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-90.8	10.8	178.3	-63.9	-171.6	-80.2	0	0	113.4	S636 T639 N726 P727 G731 E732 A733	S636-Q729 PolarHBondContact O-NE2 3.44Å; T639-Q729 VanDerWaalsContact OG1-CD 3.29Å; T639-Q729 PolarHBondContact OG1-NE2 3.19Å; T639-Q729 PolarHBondContact OG1-OE1 3.21Å; N726-Q729 HydrophobicContact CB-CB 4.49Å; N726-Q729 HydrophobicContact CB-CG 4.12Å; N726-Q729 PolarHBondContact O-N 3.32Å; N726-Q729 VanDerWaalsContact O-N 3.08Å; P727-Q729 PolarHBondContact O-N 3.1Å; Q729-G731 PolarHBondContact O-N 3.27Å; Q729-E732 HydrophobicContact CB-CB 4.47Å; Q729-E732 PolarHBondContact NE2-OE2 3.1Å; Q729-E732 WeakPolarHBondContact O-CB 3.27Å; Q729-E732 PolarHBondContact O-N 3.33Å; Q729-A733 PolarHBondContact O-N 2.84Å
730	R	91	Very high	90	Very high	31 Å²	31	23.1 Å²	23.1	12%	0.117	12%	0.118	C	C	.	.	H	α-helix	trans	-58.8	-34.6	179.9	-68.6	-79.1	175.6	-140.3	-10.7	112.8	F724 P727 D728 L734 T764 H767 I771	F724-R730 PolarHBondContact O-NH2 3.17Å; P727-R730 WeakPolarHBondContact O-CG 3.36Å; P727-R730 PolarHBondContact O-N 3.19Å; D728-R730 VanDerWaalsContact C-N 3.33Å; R730-L734 WeakPolarHBondContact O-CB 3.42Å; R730-L734 PolarHBondContact O-N 3.45Å; R730-T764 HydrophobicContact CB-CG2 4.24Å; R730-H767 HydrophobicContact CB-CB 4.24Å; R730-H767 HydrophobicContact CG-CB 4.02Å; R730-I771 HydrophobicContact CB-CD1 4.03Å
731	G	90.4	Very high	90.2	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-65.4	-42.2	173	0	0	0	0	0	113.1	Q729 L734 C735	Q729-G731 PolarHBondContact O-N 3.27Å; G731-L734 WeakPolarHBondContact O-CB 3.5Å; G731-L734 PolarHBondContact O-N 3.02Å; G731-C735 PolarHBondContact O-N 3.3Å
732	E	89.8	Confident	90.3	Very high	18 Å²	18	21.1 Å²	21.1	8%	0.084	11%	0.107	C	C	.	.	H	α-helix	trans	-65.9	-42.4	176.4	-64	-177.5	-148.6	0	0	111.5	R640 L723 Q729 L734 C735 L736 W780 L952 L956	R640-E732 IonicContact CZ-OE1 3.2Å; R640-E732 IonicContact CZ-OE2 3.21Å; R640-E732 IonicContact NE-OE1 3.63Å; R640-E732 IonicContact NE-OE2 2.88Å; R640-E732 PolarHBondContact NE-OE2 3.32Å; R640-E732 IonicContact NH2-OE1 2.57Å; R640-E732 PolarHBondContact NH2-OE1 3.25Å; R640-E732 IonicContact NH2-OE2 3.31Å; R640-E732 PolarHBondContact NH2-OE2 2.84Å; L723-E732 HydrophobicContact CD1-CB 4.36Å; Q729-E732 HydrophobicContact CB-CB 4.47Å; Q729-E732 PolarHBondContact NE2-OE2 3.1Å; Q729-E732 WeakPolarHBondContact O-CB 3.27Å; Q729-E732 PolarHBondContact O-N 3.33Å; E732-L734 VanDerWaalsContact C-N 3.27Å; E732-L734 PolarHBondContact O-N 2.94Å; E732-C735 WeakPolarHBondContact O-CB 3.49Å; E732-C735 PolarHBondContact O-N 3.01Å; E732-L736 PolarHBondContact O-N 3Å; E732-W780 HydrophobicContact CG-CH2 4.4Å; E732-L952 HydrophobicContact CG-CD1 4.07Å; E732-L956 HydrophobicContact CB-CD1 4.16Å
733	A	91.9	Very high	90.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.9	-38.5	174.9	0	0	0	0	0	112	L723 F724 Q729 L736 A737	L723-A733 HydrophobicContact CB-CB 3.94Å; L723-A733 HydrophobicContact CD1-CB 4.4Å; F724-A733 HydrophobicContact CD1-CB 4.18Å; F724-A733 HydrophobicContact CE1-CB 4.01Å; Q729-A733 PolarHBondContact O-N 2.84Å; A733-L736 PolarHBondContact O-N 2.99Å; A733-A737 WeakPolarHBondContact O-CB 3.44Å; A733-A737 PolarHBondContact O-N 3.11Å
734	L	92.5	Very high	90.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.2	-40.4	176.3	-157.6	69.4	0	0	0	111.8	R730 G731 E732 A737 N738 L760 T764 L765 A768 T784 I785 H788	R730-L734 WeakPolarHBondContact O-CB 3.42Å; R730-L734 PolarHBondContact O-N 3.45Å; G731-L734 WeakPolarHBondContact O-CB 3.5Å; G731-L734 PolarHBondContact O-N 3.02Å; E732-L734 VanDerWaalsContact C-N 3.27Å; E732-L734 PolarHBondContact O-N 2.94Å; L734-A737 WeakPolarHBondContact O-CB 3.38Å; L734-A737 PolarHBondContact O-N 3.41Å; L734-N738 VanDerWaalsContact O-CG 3.23Å; L734-N738 PolarHBondContact O-N 3.39Å; L734-N738 PolarHBondContact O-OD1 3.48Å; L734-L760 HydrophobicContact CD1-CD1 4.33Å; L734-T764 HydrophobicContact CD1-CG2 4.36Å; L734-L765 HydrophobicContact CD2-CD1 4.01Å; L734-A768 HydrophobicContact CD2-CB 4.2Å; L734-T784 HydrophobicContact CB-CG2 4Å; L734-T784 HydrophobicContact CD2-CG2 4.19Å; L734-T784 HydrophobicContact CG-CG2 4.18Å; L734-I785 HydrophobicContact CD2-CG1 4.11Å; L734-H788 HydrophobicContact CD1-CB 4.12Å; L734-H788 VanDerWaalsContact CD1-CG 3.49Å; L734-H788 WeakPolarHBondContact CD1-ND1 3.38Å; L734-H788 HydrophobicContact CD2-CB 3.88Å; L734-H788 HydrophobicContact CG-CB 3.93Å
735	C	91.1	Very high	90.1	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.02	11%	0.111	C	C	.	.	H	α-helix	trans	-59.1	-48.3	174.9	-172.5	0	0	0	0	111.1	G731 E732 A737 N738 S739 T784 L956	G731-C735 PolarHBondContact O-N 3.3Å; E732-C735 WeakPolarHBondContact O-CB 3.49Å; E732-C735 PolarHBondContact O-N 3.01Å; C735-A737 PolarHBondContact O-N 2.8Å; C735-N738 PolarHBondContact O-N 2.88Å; C735-S739 PolarHBondContact O-N 3.43Å; C735-T784 HydrophobicContact CB-CG2 3.88Å; C735-L956 HydrophobicContact CB-CD1 4.43Å
736	L	90.1	Very high	90.1	Very high	21 Å²	21	17 Å²	17	11%	0.11	9%	0.094	C	C	.	.	H	α-helix	trans	-63.3	-39.9	176.1	-172.5	63.4	0	0	0	112.1	V643 M720 L723 E732 A733 N738 S739 L740	V643-L736 HydrophobicContact CG1-CD1 4.33Å; V643-L736 HydrophobicContact CG1-CD2 3.74Å; M720-L736 HydrophobicContact CB-CD2 4.31Å; M720-L736 HydrophobicContact CG-CD2 3.61Å; M720-L736 HydrophobicContact CG-CG 3.97Å; L723-L736 HydrophobicContact CD1-CB 4.49Å; L723-L736 HydrophobicContact CD1-CD2 4.05Å; E732-L736 PolarHBondContact O-N 3Å; A733-L736 PolarHBondContact O-N 2.99Å; L736-N738 PolarHBondContact O-N 3.47Å; L736-S739 WeakPolarHBondContact O-CB 3.35Å; L736-S739 PolarHBondContact O-N 3.41Å; L736-S739 PolarHBondContact O-OG 2.81Å; L736-L740 PolarHBondContact O-N 3.39Å
737	A	93.1	Very high	89.9	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58.8	-47	174.1	0	0	0	0	0	111.5	M720 A733 L734 C735 S739 L740 L741 V756 L760	M720-A737 HydrophobicContact CE-CB 3.53Å; A733-A737 WeakPolarHBondContact O-CB 3.44Å; A733-A737 PolarHBondContact O-N 3.11Å; L734-A737 WeakPolarHBondContact O-CB 3.38Å; L734-A737 PolarHBondContact O-N 3.41Å; C735-A737 PolarHBondContact O-N 2.8Å; A737-S739 VanDerWaalsContact C-N 3.28Å; A737-S739 PolarHBondContact O-N 3.4Å; A737-L740 PolarHBondContact O-N 3.17Å; A737-L740 VanDerWaalsContact O-N 3.13Å; A737-L741 VanDerWaalsContact O-CG 3.28Å; A737-L741 WeakPolarHBondContact O-CG 3.38Å; A737-L741 PolarHBondContact O-N 3.25Å; A737-V756 HydrophobicContact CB-CG1 4.06Å; A737-L760 HydrophobicContact CB-CD1 3.98Å; A737-L760 HydrophobicContact CB-CD2 4.17Å; A737-L760 HydrophobicContact CB-CG 4.43Å
738	N	93.4	Very high	89.6	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.3	-39.2	178.9	-68.6	-8.5	0	0	0	111.5	L734 C735 L736 L740 L741 R742 T784 E787 H788 L791	L734-N738 VanDerWaalsContact O-CG 3.23Å; L734-N738 PolarHBondContact O-N 3.39Å; L734-N738 PolarHBondContact O-OD1 3.48Å; C735-N738 PolarHBondContact O-N 2.88Å; L736-N738 PolarHBondContact O-N 3.47Å; N738-L740 VanDerWaalsContact C-N 3.33Å; N738-L740 PolarHBondContact O-N 3.35Å; N738-L741 PolarHBondContact O-N 3.05Å; N738-R742 WeakPolarHBondContact O-CG 3.3Å; N738-R742 PolarHBondContact O-N 2.81Å; N738-T784 PolarHBondContact ND2-O 3.1Å; N738-E787 HydrophobicContact CB-CG 4.21Å; N738-H788 PolarHBondContact ND2-N 2.79Å; N738-H788 WeakPolarHBondContact OD1-CA 3.21Å; N738-H788 WeakPolarHBondContact OD1-CB 3.36Å; N738-H788 PolarHBondContact OD1-ND1 3.18Å; N738-L791 HydrophobicContact CB-CD1 4.01Å
739	S	89.7	Confident	89.6	Confident	17 Å²	17	12.2 Å²	12.2	12%	0.119	6%	0.064	C	C	.	.	H	α-helix	trans	-56.3	-45.3	174.1	81.9	0	0	0	0	113	C735 L736 A737 R742 V743 E958	C735-S739 PolarHBondContact O-N 3.43Å; L736-S739 WeakPolarHBondContact O-CB 3.35Å; L736-S739 PolarHBondContact O-N 3.41Å; L736-S739 PolarHBondContact O-OG 2.81Å; A737-S739 VanDerWaalsContact C-N 3.28Å; A737-S739 PolarHBondContact O-N 3.4Å; S739-R742 VanDerWaalsContact CA-NH2 3.31Å; S739-V743 WeakPolarHBondContact O-CG2 3.45Å; S739-V743 PolarHBondContact O-N 3.39Å; S739-E958 WeakPolarHBondContact CB-OE1 3.36Å
740	L	89.1	Confident	89.4	Confident	16 Å²	16	14.4 Å²	14.4	8%	0.084	7%	0.073	C	C	.	.	H	α-helix	trans	-71.9	-39.4	179.3	-63.9	179.3	0	0	0	111.4	R716 I717 M720 L736 A737 N738 R742 V743 F744 V756	R716-L740 HydrophobicContact CB-CD1 4.44Å; R716-L740 HydrophobicContact CB-CD2 3.9Å; I717-L740 HydrophobicContact CG1-CD1 4.22Å; M720-L740 HydrophobicContact CG-CD1 4.34Å; M720-L740 HydrophobicContact SD-CD1 3.67Å; L736-L740 PolarHBondContact O-N 3.39Å; A737-L740 PolarHBondContact O-N 3.17Å; A737-L740 VanDerWaalsContact O-N 3.13Å; N738-L740 VanDerWaalsContact C-N 3.33Å; N738-L740 PolarHBondContact O-N 3.35Å; L740-R742 PolarHBondContact O-N 2.91Å; L740-V743 PolarHBondContact O-N 3.07Å; L740-F744 HydrophobicContact CB-CD2 4.23Å; L740-F744 HydrophobicContact CB-CE2 3.98Å; L740-F744 WeakPolarHBondContact O-CD2 3.34Å; L740-F744 WeakPolarHBondContact O-CG 3.49Å; L740-F744 PolarHBondContact O-N 3.2Å; L740-V756 HydrophobicContact CB-CG1 4.49Å; L740-V756 HydrophobicContact CB-CG2 4.06Å; L740-V756 HydrophobicContact CD1-CG2 4.36Å
741	L	92.6	Very high	89	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.4	-44.7	176	-71	174.1	0	0	0	111.4	A737 N738 V743 F744 I745 A753 V756 L757 L791 L795	A737-L741 VanDerWaalsContact O-CG 3.28Å; A737-L741 WeakPolarHBondContact O-CG 3.38Å; A737-L741 PolarHBondContact O-N 3.25Å; N738-L741 PolarHBondContact O-N 3.05Å; L741-V743 VanDerWaalsContact C-N 3.31Å; L741-V743 PolarHBondContact O-N 2.99Å; L741-F744 PolarHBondContact O-N 3.2Å; L741-I745 VanDerWaalsContact O-CB 3.28Å; L741-I745 WeakPolarHBondContact O-CB 3.37Å; L741-I745 WeakPolarHBondContact O-CD1 3.16Å; L741-I745 VanDerWaalsContact O-CG1 3.25Å; L741-I745 WeakPolarHBondContact O-CG1 3.46Å; L741-I745 PolarHBondContact O-N 2.9Å; L741-A753 HydrophobicContact CD2-CB 3.76Å; L741-V756 HydrophobicContact CD2-CB 4.17Å; L741-V756 HydrophobicContact CD2-CG1 4.31Å; L741-V756 HydrophobicContact CG-CG1 4.26Å; L741-L757 HydrophobicContact CD1-CD2 3.96Å; L741-L757 HydrophobicContact CD2-CD2 4.37Å; L741-L757 HydrophobicContact CD2-CG 4.22Å; L741-L791 HydrophobicContact CB-CD1 3.9Å; L741-L791 HydrophobicContact CD1-CB 4.29Å; L741-L791 HydrophobicContact CD1-CD1 4.33Å; L741-L795 HydrophobicContact CD2-CD1 4.07Å
742	R	91.5	Very high	88.7	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-55.1	-47.4	175.7	-74.8	-171.6	-64.8	-92.2	4.1	111.4	N738 S739 L740 A746 E787 L791 E958 L970	N738-R742 WeakPolarHBondContact O-CG 3.3Å; N738-R742 PolarHBondContact O-N 2.81Å; S739-R742 VanDerWaalsContact CA-NH2 3.31Å; L740-R742 PolarHBondContact O-N 2.91Å; R742-A746 WeakPolarHBondContact O-CB 3.36Å; R742-A746 PolarHBondContact O-N 3.44Å; R742-A746 VanDerWaalsContact O-N 3.07Å; R742-E787 WeakPolarHBondContact CD-OE1 3.17Å; R742-E787 IonicContact CZ-OE1 2.89Å; R742-E787 IonicContact NE-OE1 3.51Å; R742-E787 IonicContact NH1-OE1 3.69Å; R742-E787 PolarHBondContact NH1-OE1 3.45Å; R742-E787 IonicContact NH1-OE2 3.71Å; R742-E787 PolarHBondContact NH1-OE2 2.8Å; R742-L791 HydrophobicContact CG-CD1 4.23Å; R742-L791 HydrophobicContact CG-CD2 4.45Å; R742-E958 IonicContact CZ-OE1 2.8Å; R742-E958 IonicContact CZ-OE2 3.57Å; R742-E958 IonicContact NH2-OE1 3.45Å; R742-E958 PolarHBondContact NH2-OE1 3.49Å; R742-E958 IonicContact NH2-OE2 3.69Å; R742-E958 PolarHBondContact NH2-OE2 3.49Å; R742-L970 HydrophobicContact CB-CD1 3.74Å; R742-L970 HydrophobicContact CG-CD1 3.72Å
743	V	86.3	Confident	88.8	Confident	35 Å²	35	19.5 Å²	19.5	21%	0.212	10%	0.096	C	C	.	.	H	α-helix	trans	-66.4	-48.4	179.4	176.7	0	0	0	0	111.4	F687 S739 L740 L741 I745 A746 M747	F687-V743 HydrophobicContact CE2-CG2 4.26Å; S739-V743 WeakPolarHBondContact O-CG2 3.45Å; S739-V743 PolarHBondContact O-N 3.39Å; L740-V743 PolarHBondContact O-N 3.07Å; L741-V743 VanDerWaalsContact C-N 3.31Å; L741-V743 PolarHBondContact O-N 2.99Å; V743-I745 PolarHBondContact O-N 3.38Å; V743-A746 PolarHBondContact O-N 3.07Å; V743-M747 HydrophobicContact CG1-CE 4.06Å; V743-M747 HydrophobicContact CG1-SD 4.46Å; V743-M747 WeakPolarHBondContact O-CG 3.26Å; V743-M747 PolarHBondContact O-N 3.47Å
744	F	88.7	Confident	88.7	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	11%	0.114	C	C	.	.	H	α-helix	trans	-67.7	-34	-178.2	-68.3	-46.5	0	0	0	113.5	D713 I717 L740 L741 M747 H748 S749 A752 A753 V756	D713-F744 HydrophobicContact CB-CE1 4.07Å; D713-F744 HydrophobicContact CB-CZ 3.93Å; I717-F744 HydrophobicContact CD1-CE2 4.28Å; I717-F744 HydrophobicContact CG1-CE2 4.46Å; L740-F744 HydrophobicContact CB-CD2 4.23Å; L740-F744 HydrophobicContact CB-CE2 3.98Å; L740-F744 WeakPolarHBondContact O-CD2 3.34Å; L740-F744 WeakPolarHBondContact O-CG 3.49Å; L740-F744 PolarHBondContact O-N 3.2Å; L741-F744 PolarHBondContact O-N 3.2Å; F744-M747 HydrophobicContact CD1-CE 3.46Å; F744-M747 VanDerWaalsContact CD1-CE 3.46Å; F744-M747 HydrophobicContact CE1-CE 3.82Å; F744-M747 PolarHBondContact O-N 3.06Å; F744-H748 PolarHBondContact O-N 3.38Å; F744-S749 PolarHBondContact O-N 3.46Å; F744-A752 HydrophobicContact CB-CB 4.24Å; F744-A752 HydrophobicContact CD1-CB 3.58Å; F744-A752 HydrophobicContact CD2-CB 4.03Å; F744-A752 HydrophobicContact CE1-CB 3.9Å; F744-A752 HydrophobicContact CE2-CB 4.29Å; F744-A752 HydrophobicContact CG-CB 3.69Å; F744-A752 HydrophobicContact CZ-CB 4.25Å; F744-A753 HydrophobicContact CB-CB 4.06Å; F744-V756 HydrophobicContact CD2-CG2 3.79Å; F744-V756 HydrophobicContact CE2-CG2 3.58Å
745	I	90.8	Very high	88.5	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-66.1	-45.8	173.3	-72.5	164.7	0	0	0	110.2	L741 V743 M747 H748 L791 Y794 L795 L970	L741-I745 VanDerWaalsContact O-CB 3.28Å; L741-I745 WeakPolarHBondContact O-CB 3.37Å; L741-I745 WeakPolarHBondContact O-CD1 3.16Å; L741-I745 VanDerWaalsContact O-CG1 3.25Å; L741-I745 WeakPolarHBondContact O-CG1 3.46Å; L741-I745 PolarHBondContact O-N 2.9Å; V743-I745 PolarHBondContact O-N 3.38Å; I745-M747 PolarHBondContact O-N 2.8Å; I745-H748 PolarHBondContact O-N 3.32Å; I745-L791 HydrophobicContact CD1-CB 4.28Å; I745-L791 HydrophobicContact CD1-CD2 3.77Å; I745-Y794 HydrophobicContact CD1-CD1 4.11Å; I745-Y794 HydrophobicContact CG1-CD1 4.32Å; I745-Y794 HydrophobicContact CG1-CE1 4.41Å; I745-Y794 HydrophobicContact CG2-CD1 4Å; I745-Y794 HydrophobicContact CG2-CE1 3.54Å; I745-L795 HydrophobicContact CD1-CD2 4.3Å; I745-L795 HydrophobicContact CD1-CG 4.28Å; I745-L795 HydrophobicContact CG1-CD2 4.01Å; I745-L970 HydrophobicContact CB-CD2 4.47Å; I745-L970 HydrophobicContact CG2-CD2 3.87Å
746	A	87.3	Confident	88.5	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-59.7	-31.6	175.8	0	0	0	0	0	112.6	F687 L691 R742 V743 H748 L970	F687-A746 HydrophobicContact CE1-CB 4.1Å; F687-A746 HydrophobicContact CE2-CB 3.91Å; F687-A746 HydrophobicContact CZ-CB 3.56Å; L691-A746 HydrophobicContact CD2-CB 3.89Å; L691-A746 HydrophobicContact CG-CB 4.27Å; R742-A746 WeakPolarHBondContact O-CB 3.36Å; R742-A746 PolarHBondContact O-N 3.44Å; R742-A746 VanDerWaalsContact O-N 3.07Å; V743-A746 PolarHBondContact O-N 3.07Å; A746-H748 VanDerWaalsContact C-N 3.3Å; A746-H748 PolarHBondContact O-N 3.5Å; A746-L970 HydrophobicContact CB-CD2 3.97Å
747	M	81.6	Confident	88.7	Confident	46 Å²	46	28.9 Å²	28.9	23%	0.227	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-1	175.2	-65.3	-163.2	-57.7	0	0	114.5	L690 V743 F744 I745 S749	L690-M747 HydrophobicContact CD2-CG 3.74Å; L690-M747 HydrophobicContact CD2-SD 3.91Å; V743-M747 HydrophobicContact CG1-CE 4.06Å; V743-M747 HydrophobicContact CG1-SD 4.46Å; V743-M747 WeakPolarHBondContact O-CG 3.26Å; V743-M747 PolarHBondContact O-N 3.47Å; F744-M747 HydrophobicContact CD1-CE 3.46Å; F744-M747 VanDerWaalsContact CD1-CE 3.46Å; F744-M747 HydrophobicContact CE1-CE 3.82Å; F744-M747 PolarHBondContact O-N 3.06Å; I745-M747 PolarHBondContact O-N 2.8Å; M747-S749 PolarHBondContact O-N 3.31Å; M747-S749 VanDerWaalsContact O-N 3.15Å
748	H	83.7	Confident	88.6	Confident	48 Å²	48	33.4 Å²	33.4	22%	0.222	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	27.5	-169.4	-58.5	-100.5	0	0	0	113.9	N694 F744 I745 A746 F750 E977	N694-H748 PolarHBondContact ND2-CD2 2.82Å; F744-H748 PolarHBondContact O-N 3.38Å; I745-H748 PolarHBondContact O-N 3.32Å; A746-H748 VanDerWaalsContact C-N 3.3Å; A746-H748 PolarHBondContact O-N 3.5Å; H748-F750 HydrophobicContact CB-CE2 4.23Å; H748-F750 HydrophobicContact CB-CZ 4.14Å; H748-F750 AromaticContact ND1-CZ 3.88Å; H748-F750 PolarHBondContact O-N 2.89Å; H748-E977 IonicContact CE1-OE1 3.83Å; H748-E977 IonicContact CE1-OE2 3.88Å; H748-E977 PolarHBondContact CE1-OE2 2.69Å
749	S	85.9	Confident	88.4	Confident	14 Å²	14	37.6 Å²	37.6	10%	0.098	19%	0.19	C	C	.	.			trans	-92.9	66.3	178.1	-167.2	0	0	0	0	110.2	F744 M747 K751 A752 A753	F744-S749 PolarHBondContact O-N 3.46Å; M747-S749 PolarHBondContact O-N 3.31Å; M747-S749 VanDerWaalsContact O-N 3.15Å; S749-K751 VanDerWaalsContact C-N 3.27Å; S749-K751 PolarHBondContact O-N 3.31Å; S749-A752 VanDerWaalsContact O-CB 3.29Å; S749-A752 WeakPolarHBondContact O-CB 3.25Å; S749-A752 PolarHBondContact O-N 3.26Å; S749-A752 WeakPolarHBondContact OG-CB 3.42Å; S749-A753 PolarHBondContact O-N 3.48Å
750	F	87	Confident	88.5	Confident	48 Å²	48	37.8 Å²	37.8	21%	0.211	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-32.4	-172.9	-54	-58.5	0	0	0	113.4	H748 A752 A753 Q754 Y794 L795	H748-F750 HydrophobicContact CB-CE2 4.23Å; H748-F750 HydrophobicContact CB-CZ 4.14Å; H748-F750 AromaticContact ND1-CZ 3.88Å; H748-F750 PolarHBondContact O-N 2.89Å; F750-A752 VanDerWaalsContact C-N 3.29Å; F750-A752 PolarHBondContact O-N 3.37Å; F750-A753 WeakPolarHBondContact O-CB 3.16Å; F750-A753 PolarHBondContact O-N 2.85Å; F750-Q754 WeakPolarHBondContact O-CG 3.27Å; F750-Q754 PolarHBondContact O-N 2.71Å; F750-Y794 HydrophobicContact CE1-CE1 4.03Å; F750-L795 HydrophobicContact CD1-CD2 3.79Å
751	K	82.6	Confident	88.6	Confident	155 Å²	155	38.9 Å²	38.9	67%	0.674	20%	0.198	S	C	*	.	H	α-helix	trans	-63.2	-34.9	173.6	-68.2	-176.1	179.3	179.2	0	112.5	S749 Q755	S749-K751 VanDerWaalsContact C-N 3.27Å; S749-K751 PolarHBondContact O-N 3.31Å; K751-Q755 WeakPolarHBondContact O-CG 3.46Å; K751-Q755 PolarHBondContact O-N 3.06Å; K751-Q755 VanDerWaalsContact O-N 3.08Å
752	A	84.8	Confident	88.4	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-68.4	-43.5	175.1	0	0	0	0	0	111.1	L709 F744 S749 F750 Q754 Q755 V756	L709-A752 HydrophobicContact CD1-CB 3.29Å; L709-A752 HydrophobicContact CG-CB 4.41Å; F744-A752 HydrophobicContact CB-CB 4.24Å; F744-A752 HydrophobicContact CD1-CB 3.58Å; F744-A752 HydrophobicContact CD2-CB 4.03Å; F744-A752 HydrophobicContact CE1-CB 3.9Å; F744-A752 HydrophobicContact CE2-CB 4.29Å; F744-A752 HydrophobicContact CG-CB 3.69Å; F744-A752 HydrophobicContact CZ-CB 4.25Å; S749-A752 VanDerWaalsContact O-CB 3.29Å; S749-A752 WeakPolarHBondContact O-CB 3.25Å; S749-A752 PolarHBondContact O-N 3.26Å; S749-A752 WeakPolarHBondContact OG-CB 3.42Å; F750-A752 VanDerWaalsContact C-N 3.29Å; F750-A752 PolarHBondContact O-N 3.37Å; A752-Q754 VanDerWaalsContact C-N 3.33Å; A752-Q754 PolarHBondContact O-N 2.84Å; A752-Q755 WeakPolarHBondContact O-CB 3.46Å; A752-Q755 PolarHBondContact O-N 3.49Å; A752-Q755 VanDerWaalsContact O-N 3.08Å; A752-V756 PolarHBondContact O-N 3.25Å; A752-V756 VanDerWaalsContact O-N 3.1Å
753	A	90.8	Very high	88.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-42.9	174.9	0	0	0	0	0	111.8	L741 F744 S749 F750 Q755 V756 L757 L795	L741-A753 HydrophobicContact CD2-CB 3.76Å; F744-A753 HydrophobicContact CB-CB 4.06Å; S749-A753 PolarHBondContact O-N 3.48Å; F750-A753 WeakPolarHBondContact O-CB 3.16Å; F750-A753 PolarHBondContact O-N 2.85Å; A753-Q755 VanDerWaalsContact C-N 3.29Å; A753-Q755 PolarHBondContact O-N 2.86Å; A753-V756 WeakPolarHBondContact O-CB 3.4Å; A753-V756 PolarHBondContact O-N 3.27Å; A753-L757 PolarHBondContact O-N 2.6Å; A753-L757 VanDerWaalsContact O-N 3.12Å; A753-L795 HydrophobicContact CB-CD1 3.85Å; A753-L795 HydrophobicContact CB-CD2 3.93Å
754	Q	90.2	Very high	88.6	Confident	78 Å²	78	46.3 Å²	46.3	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-36	173.1	-74.9	176.5	-15.1	0	0	112.4	F750 A752 L757 S758 D799	F750-Q754 WeakPolarHBondContact O-CG 3.27Å; F750-Q754 PolarHBondContact O-N 2.71Å; A752-Q754 VanDerWaalsContact C-N 3.33Å; A752-Q754 PolarHBondContact O-N 2.84Å; Q754-L757 PolarHBondContact O-N 3.36Å; Q754-S758 WeakPolarHBondContact O-CB 3.25Å; Q754-S758 PolarHBondContact O-N 3.03Å; Q754-S758 PolarHBondContact O-OG 3.43Å; Q754-D799 PolarHBondContact NE2-OD1 3.19Å; Q754-D799 PolarHBondContact NE2-OD2 3.32Å
755	Q	88.2	Confident	88.8	Confident	97 Å²	97	48.5 Å²	48.5	45%	0.453	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-40.4	174.6	-75.7	-175.5	9.5	0	0	112.4	I717 K751 A752 A753 L757 S758 K759	I717-Q755 HydrophobicContact CD1-CB 4.41Å; K751-Q755 WeakPolarHBondContact O-CG 3.46Å; K751-Q755 PolarHBondContact O-N 3.06Å; K751-Q755 VanDerWaalsContact O-N 3.08Å; A752-Q755 WeakPolarHBondContact O-CB 3.46Å; A752-Q755 PolarHBondContact O-N 3.49Å; A752-Q755 VanDerWaalsContact O-N 3.08Å; A753-Q755 VanDerWaalsContact C-N 3.29Å; A753-Q755 PolarHBondContact O-N 2.86Å; Q755-L757 VanDerWaalsContact C-N 3.34Å; Q755-L757 PolarHBondContact O-N 3.46Å; Q755-S758 WeakPolarHBondContact CA-OG 3.23Å; Q755-S758 PolarHBondContact O-N 3.04Å; Q755-S758 PolarHBondContact O-OG 2.87Å; Q755-K759 WeakPolarHBondContact O-CB 3.43Å; Q755-K759 PolarHBondContact O-N 2.9Å
756	V	91.7	Very high	88.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.9	-47.9	173.2	177.7	0	0	0	0	110.6	I717 M720 A737 L740 L741 F744 A752 A753 K759 L760	I717-V756 HydrophobicContact CD1-CG2 3.89Å; I717-V756 HydrophobicContact CG1-CG2 3.98Å; M720-V756 HydrophobicContact CE-CG1 4.22Å; M720-V756 HydrophobicContact SD-CG1 4.1Å; A737-V756 HydrophobicContact CB-CG1 4.06Å; L740-V756 HydrophobicContact CB-CG1 4.49Å; L740-V756 HydrophobicContact CB-CG2 4.06Å; L740-V756 HydrophobicContact CD1-CG2 4.36Å; L741-V756 HydrophobicContact CD2-CB 4.17Å; L741-V756 HydrophobicContact CD2-CG1 4.31Å; L741-V756 HydrophobicContact CG-CG1 4.26Å; F744-V756 HydrophobicContact CD2-CG2 3.79Å; F744-V756 HydrophobicContact CE2-CG2 3.58Å; A752-V756 PolarHBondContact O-N 3.25Å; A752-V756 VanDerWaalsContact O-N 3.1Å; A753-V756 WeakPolarHBondContact O-CB 3.4Å; A753-V756 PolarHBondContact O-N 3.27Å; V756-K759 WeakPolarHBondContact O-CB 3.29Å; V756-K759 PolarHBondContact O-N 3.32Å; V756-L760 PolarHBondContact O-N 3.16Å
757	L	92.9	Very high	89.1	Confident	46 Å²	46	58 Å²	58	24%	0.241	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-43.5	178.5	-66.8	178.9	0	0	0	112.2	L741 A753 Q754 Q755 K759 L760 L795	L741-L757 HydrophobicContact CD1-CD2 3.96Å; L741-L757 HydrophobicContact CD2-CD2 4.37Å; L741-L757 HydrophobicContact CD2-CG 4.22Å; A753-L757 PolarHBondContact O-N 2.6Å; A753-L757 VanDerWaalsContact O-N 3.12Å; Q754-L757 PolarHBondContact O-N 3.36Å; Q755-L757 VanDerWaalsContact C-N 3.34Å; Q755-L757 PolarHBondContact O-N 3.46Å; L757-K759 PolarHBondContact O-N 3.45Å; L757-L760 HydrophobicContact CD2-CD1 4.44Å; L757-L760 PolarHBondContact O-N 2.9Å; L757-L795 HydrophobicContact CD1-CD1 3.78Å
758	S	90.8	Very high	89.6	Confident	94 Å²	94	55.8 Å²	55.8	66%	0.657	29%	0.294	S	S	*	.	H	α-helix	trans	-64.8	-22.1	178.3	74	0	0	0	0	113.5	Q754 Q755	Q754-S758 WeakPolarHBondContact O-CB 3.25Å; Q754-S758 PolarHBondContact O-N 3.03Å; Q754-S758 PolarHBondContact O-OG 3.43Å; Q755-S758 WeakPolarHBondContact CA-OG 3.23Å; Q755-S758 PolarHBondContact O-N 3.04Å; Q755-S758 PolarHBondContact O-OG 2.87Å
759	K	89.8	Confident	90	Very high	89 Å²	89	56.6 Å²	56.6	39%	0.387	30%	0.297	S	S	.	.	H	α-helix	trans	-83	-24.2	179	-92.6	-74.5	-168.3	165.7	0	113.3	I717 D721 F724 Q755 V756 L757 P761	I717-K759 HydrophobicContact CG2-CB 4.2Å; I717-K759 HydrophobicContact CG2-CG 3.76Å; D721-K759 IonicContact OD1-NZ 3.72Å; D721-K759 IonicContact OD2-NZ 3.86Å; D721-K759 PolarHBondContact OD2-NZ 3.41Å; F724-K759 VanDerWaalsContact CE2-O 3.29Å; F724-K759 WeakPolarHBondContact CE2-O 3.32Å; Q755-K759 WeakPolarHBondContact O-CB 3.43Å; Q755-K759 PolarHBondContact O-N 2.9Å; V756-K759 WeakPolarHBondContact O-CB 3.29Å; V756-K759 PolarHBondContact O-N 3.32Å; L757-K759 PolarHBondContact O-N 3.45Å; K759-P761 WeakPolarHBondContact O-CD 3.46Å
760	L	92.1	Very high	90.3	Very high	20 Å²	20	59 Å²	59	11%	0.105	31%	0.308	C	S	.	.	S	Bend	trans	-66.2	131	175.9	-73.2	171.7	0	0	0	110.1	M720 F724 L734 A737 V756 L757 T764	M720-L760 HydrophobicContact CE-CD2 3.6Å; M720-L760 HydrophobicContact CE-CG 4.2Å; F724-L760 HydrophobicContact CE1-CD2 3.98Å; F724-L760 HydrophobicContact CZ-CD2 4.14Å; L734-L760 HydrophobicContact CD1-CD1 4.33Å; A737-L760 HydrophobicContact CB-CD1 3.98Å; A737-L760 HydrophobicContact CB-CD2 4.17Å; A737-L760 HydrophobicContact CB-CG 4.43Å; V756-L760 PolarHBondContact O-N 3.16Å; L757-L760 HydrophobicContact CD2-CD1 4.44Å; L757-L760 PolarHBondContact O-N 2.9Å; L760-T764 HydrophobicContact CD2-CG2 4.32Å
761	P	91.1	Very high	90.3	Very high	40 Å²	40	57.8 Å²	57.8	26%	0.26	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-58.4	143.2	175	-32	42.4	0	0	0	112	F724 K759 G763 T764	F724-P761 HydrophobicContact CB-CG 4.18Å; F724-P761 HydrophobicContact CD1-CG 4.19Å; F724-P761 HydrophobicContact CD2-CG 3.82Å; F724-P761 HydrophobicContact CE2-CG 4.26Å; F724-P761 HydrophobicContact CG-CG 3.81Å; K759-P761 WeakPolarHBondContact O-CD 3.46Å; P761-G763 PolarHBondContact O-N 3.26Å; P761-T764 WeakPolarHBondContact O-CB 3.44Å; P761-T764 PolarHBondContact O-N 3.48Å; P761-T764 PolarHBondContact O-OG1 2.68Å
762	V	88.8	Confident	90.7	Very high	153 Å²	153	50.9 Å²	50.9	93%	0.927	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	132.2	-177.4	-175.4	0	0	0	0	109.8
763	G	89.8	Confident	90.9	Very high	33 Å²	33	57.6 Å²	57.6	34%	0.34	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	12.2	-178.1	0	0	0	0	0	115	P761 L765 E766 H767	P761-G763 PolarHBondContact O-N 3.26Å; G763-L765 VanDerWaalsContact C-N 3.31Å; G763-L765 PolarHBondContact O-N 2.9Å; G763-E766 PolarHBondContact O-N 3.42Å; G763-H767 PolarHBondContact O-N 3.16Å; G763-H767 PolarHBondContact O-ND1 2.94Å
764	T	92.2	Very high	90.8	Very high	4 Å²	4	65.2 Å²	65.2	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-56.8	-43	175.7	-67.1	0	0	0	0	112.3	R730 L734 L760 P761 H767 A768	R730-T764 HydrophobicContact CB-CG2 4.24Å; L734-T764 HydrophobicContact CD1-CG2 4.36Å; L760-T764 HydrophobicContact CD2-CG2 4.32Å; P761-T764 WeakPolarHBondContact O-CB 3.44Å; P761-T764 PolarHBondContact O-N 3.48Å; P761-T764 PolarHBondContact O-OG1 2.68Å; T764-H767 PolarHBondContact O-N 2.65Å; T764-A768 WeakPolarHBondContact O-CB 3.45Å; T764-A768 PolarHBondContact O-N 2.63Å
765	L	92.6	Very high	90.5	Very high	48 Å²	48	63.7 Å²	63.7	25%	0.251	33%	0.333	S	S	.	.	H	α-helix	trans	-61.6	-44.6	176.8	-178.2	62.9	0	0	0	112	L734 G763 A768 K769 I785 E789	L734-L765 HydrophobicContact CD2-CD1 4.01Å; G763-L765 VanDerWaalsContact C-N 3.31Å; G763-L765 PolarHBondContact O-N 2.9Å; L765-A768 WeakPolarHBondContact O-CB 3.48Å; L765-A768 PolarHBondContact O-N 3.12Å; L765-K769 WeakPolarHBondContact O-CG 3.27Å; L765-K769 PolarHBondContact O-N 2.9Å; L765-I785 HydrophobicContact CD1-CG2 3.98Å; L765-E789 HydrophobicContact CD2-CG 4.29Å
766	E	93.3	Very high	90.5	Very high	113 Å²	113	66.3 Å²	66.3	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-65.5	-42	179.7	-161.4	64	-165.2	0	0	111.3	G763 A768 K769 I770	G763-E766 PolarHBondContact O-N 3.42Å; E766-A768 VanDerWaalsContact C-N 3.34Å; E766-A768 PolarHBondContact O-N 3.19Å; E766-K769 WeakPolarHBondContact O-CB 3.39Å; E766-K769 PolarHBondContact O-N 2.85Å; E766-I770 WeakPolarHBondContact O-CG1 3.43Å; E766-I770 PolarHBondContact O-N 3.07Å
767	H	91.8	Very high	90.2	Very high	90 Å²	90	68.7 Å²	68.7	42%	0.417	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-39.9	173.8	-77.1	80.2	0	0	0	112	R730 G763 T764 K769 I770 I771	R730-H767 HydrophobicContact CB-CB 4.24Å; R730-H767 HydrophobicContact CG-CB 4.02Å; G763-H767 PolarHBondContact O-N 3.16Å; G763-H767 PolarHBondContact O-ND1 2.94Å; T764-H767 PolarHBondContact O-N 2.65Å; H767-K769 VanDerWaalsContact C-N 3.3Å; H767-K769 PolarHBondContact O-N 3.29Å; H767-I770 PolarHBondContact O-N 3.32Å; H767-I771 WeakPolarHBondContact O-CD1 3.41Å; H767-I771 VanDerWaalsContact O-CG1 3.25Å; H767-I771 WeakPolarHBondContact O-CG1 3.5Å; H767-I771 PolarHBondContact O-N 2.97Å
768	A	91.3	Very high	89.9	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-39.3	175.1	0	0	0	0	0	111.6	L734 T764 L765 E766 I771 C772 L781 I785	L734-A768 HydrophobicContact CD2-CB 4.2Å; T764-A768 WeakPolarHBondContact O-CB 3.45Å; T764-A768 PolarHBondContact O-N 2.63Å; L765-A768 WeakPolarHBondContact O-CB 3.48Å; L765-A768 PolarHBondContact O-N 3.12Å; E766-A768 VanDerWaalsContact C-N 3.34Å; E766-A768 PolarHBondContact O-N 3.19Å; A768-I771 PolarHBondContact O-N 3.01Å; A768-C772 VanDerWaalsContact O-CB 3.31Å; A768-C772 WeakPolarHBondContact O-CB 3.44Å; A768-C772 PolarHBondContact O-N 2.96Å; A768-L781 HydrophobicContact CB-CD1 4.5Å; A768-I785 HydrophobicContact CB-CD1 4.28Å; A768-I785 HydrophobicContact CB-CG1 4.21Å
769	K	92.2	Very high	89.7	Confident	64 Å²	64	66 Å²	66	28%	0.278	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-46.4	173	-71.2	175.4	179.3	-176.6	0	111.8	L765 E766 H767 I771 C772 E773 I785 E789	L765-K769 WeakPolarHBondContact O-CG 3.27Å; L765-K769 PolarHBondContact O-N 2.9Å; E766-K769 WeakPolarHBondContact O-CB 3.39Å; E766-K769 PolarHBondContact O-N 2.85Å; H767-K769 VanDerWaalsContact C-N 3.3Å; H767-K769 PolarHBondContact O-N 3.29Å; K769-I771 VanDerWaalsContact C-N 3.31Å; K769-I771 PolarHBondContact O-N 2.87Å; K769-C772 VanDerWaalsContact O-CB 3.29Å; K769-C772 WeakPolarHBondContact O-CB 3.48Å; K769-C772 PolarHBondContact O-N 3.27Å; K769-C772 VanDerWaalsContact O-N 3.11Å; K769-E773 WeakPolarHBondContact O-CG 3.25Å; K769-E773 PolarHBondContact O-N 2.87Å; K769-I785 HydrophobicContact CG-CD1 4.05Å; K769-I785 HydrophobicContact CG-CG2 4.14Å; K769-E789 VanDerWaalsContact CE-OE1 3.24Å; K769-E789 WeakPolarHBondContact CE-OE1 3.44Å; K769-E789 IonicContact NZ-OE1 2.77Å; K769-E789 PolarHBondContact NZ-OE1 3.27Å
770	I	91.3	Very high	89.7	Confident	65 Å²	65	63.3 Å²	63.3	33%	0.333	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-42.6	175.8	-66.3	164.4	0	0	0	111.2	E766 H767 C772 E773 K774	E766-I770 WeakPolarHBondContact O-CG1 3.43Å; E766-I770 PolarHBondContact O-N 3.07Å; H767-I770 PolarHBondContact O-N 3.32Å; I770-C772 VanDerWaalsContact C-N 3.34Å; I770-E773 PolarHBondContact O-N 3.13Å; I770-K774 HydrophobicContact CG2-CD 4.17Å; I770-K774 WeakPolarHBondContact O-CB 3.46Å; I770-K774 VanDerWaalsContact O-CG 3.28Å; I770-K774 WeakPolarHBondContact O-CG 3.43Å; I770-K774 PolarHBondContact O-N 3.38Å
771	I	88.7	Confident	89.6	Confident	23 Å²	23	62.4 Å²	62.4	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-41.2	176.5	-67.8	162.1	0	0	0	110.5	P727 R730 H767 A768 K769 E773 K774 L775 L781	P727-I771 WeakPolarHBondContact O-CD1 3.38Å; R730-I771 HydrophobicContact CB-CD1 4.03Å; H767-I771 WeakPolarHBondContact O-CD1 3.41Å; H767-I771 VanDerWaalsContact O-CG1 3.25Å; H767-I771 WeakPolarHBondContact O-CG1 3.5Å; H767-I771 PolarHBondContact O-N 2.97Å; A768-I771 PolarHBondContact O-N 3.01Å; K769-I771 VanDerWaalsContact C-N 3.31Å; K769-I771 PolarHBondContact O-N 2.87Å; I771-E773 VanDerWaalsContact C-N 3.34Å; I771-E773 PolarHBondContact O-N 3.21Å; I771-K774 PolarHBondContact O-N 3.37Å; I771-L775 HydrophobicContact CG2-CD1 3.68Å; I771-L775 HydrophobicContact CG2-CG 4.31Å; I771-L775 WeakPolarHBondContact O-CB 3.25Å; I771-L775 WeakPolarHBondContact O-CG 3.45Å; I771-L775 PolarHBondContact O-N 3.48Å; I771-L781 HydrophobicContact CB-CD2 4.4Å; I771-L781 HydrophobicContact CG2-CD2 3.92Å
772	C	89.8	Confident	89.6	Confident	10 Å²	10	62.3 Å²	62.3	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-45.4	177.1	-165.6	0	0	0	0	111.4	A768 K769 I770 L775 S777 L781 V782 I785	A768-C772 VanDerWaalsContact O-CB 3.31Å; A768-C772 WeakPolarHBondContact O-CB 3.44Å; A768-C772 PolarHBondContact O-N 2.96Å; K769-C772 VanDerWaalsContact O-CB 3.29Å; K769-C772 WeakPolarHBondContact O-CB 3.48Å; K769-C772 PolarHBondContact O-N 3.27Å; K769-C772 VanDerWaalsContact O-N 3.11Å; I770-C772 VanDerWaalsContact C-N 3.34Å; C772-L775 PolarHBondContact O-N 2.63Å; C772-S777 VanDerWaalsContact O-CA 3.28Å; C772-S777 WeakPolarHBondContact O-CA 3.35Å; C772-S777 PolarHBondContact O-N 2.83Å; C772-L781 HydrophobicContact CB-CD2 3.67Å; C772-L781 HydrophobicContact CB-CG 3.87Å; C772-V782 VanDerWaalsContact SG-CG2 3.56Å; C772-I785 HydrophobicContact CB-CD1 3.84Å
773	E	89.9	Confident	89.8	Confident	143 Å²	143	55.5 Å²	55.5	67%	0.668	29%	0.286	S	S	*	.	H	α-helix	trans	-64.9	-42.2	175.8	-70.1	175.7	179.6	0	0	112.2	K769 I770 I771 L775 D776	K769-E773 WeakPolarHBondContact O-CG 3.25Å; K769-E773 PolarHBondContact O-N 2.87Å; I770-E773 PolarHBondContact O-N 3.13Å; I771-E773 VanDerWaalsContact C-N 3.34Å; I771-E773 PolarHBondContact O-N 3.21Å; E773-L775 PolarHBondContact O-N 3.21Å; E773-D776 PolarHBondContact O-N 3.35Å
774	K	88.1	Confident	90	Very high	160 Å²	160	54 Å²	54	70%	0.696	27%	0.271	S	S	*	.	H	α-helix	trans	-63.7	-28.3	177.7	-76.6	175.7	179.3	-179.1	0	113.8	I770 I771	I770-K774 HydrophobicContact CG2-CD 4.17Å; I770-K774 WeakPolarHBondContact O-CB 3.46Å; I770-K774 VanDerWaalsContact O-CG 3.28Å; I770-K774 WeakPolarHBondContact O-CG 3.43Å; I770-K774 PolarHBondContact O-N 3.38Å; I771-K774 PolarHBondContact O-N 3.37Å
775	L	84.8	Confident	90.1	Very high	45 Å²	45	54.4 Å²	54.4	24%	0.236	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	18.4	-177.4	-69.5	177.6	0	0	0	113.4	I771 C772 E773 S777 P778 L945	I771-L775 HydrophobicContact CG2-CD1 3.68Å; I771-L775 HydrophobicContact CG2-CG 4.31Å; I771-L775 WeakPolarHBondContact O-CB 3.25Å; I771-L775 WeakPolarHBondContact O-CG 3.45Å; I771-L775 PolarHBondContact O-N 3.48Å; C772-L775 PolarHBondContact O-N 2.63Å; E773-L775 PolarHBondContact O-N 3.21Å; L775-S777 VanDerWaalsContact C-N 3.27Å; L775-S777 PolarHBondContact O-N 3.21Å; L775-P778 HydrophobicContact CB-CG 4.01Å; L775-P778 HydrophobicContact CD1-CG 4.48Å; L775-L945 HydrophobicContact CD2-CB 3.45Å; L775-L945 VanDerWaalsContact CD2-CB 3.45Å; L775-L945 HydrophobicContact CD2-CD1 3.77Å; L775-L945 HydrophobicContact CD2-CG 4.11Å
776	D	87	Confident	90.1	Very high	152 Å²	152	53.4 Å²	53.4	81%	0.813	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	37.4	-176.6	-63.8	-37.9	0	0	0	113.7	E773	E773-D776 PolarHBondContact O-N 3.35Å
777	S	85.9	Confident	90.2	Very high	51 Å²	51	48.2 Å²	48.2	36%	0.357	24%	0.241	S	C	.	.			trans	56.4	65.8	173.4	-59.8	0	0	0	0	115	C772 L775 D779 Q888	C772-S777 VanDerWaalsContact O-CA 3.28Å; C772-S777 WeakPolarHBondContact O-CA 3.35Å; C772-S777 PolarHBondContact O-N 2.83Å; L775-S777 VanDerWaalsContact C-N 3.27Å; L775-S777 PolarHBondContact O-N 3.21Å; S777-D779 PolarHBondContact O-N 3.42Å; S777-Q888 PolarHBondContact O-NE2 3.46Å
778	P	87	Confident	90.4	Very high	32 Å²	32	44.6 Å²	44.6	21%	0.208	22%	0.224	C	C	.	.			trans	-67.4	135.7	-180	27.2	-30.9	0	0	0	111.1	L775 W780 L781 V782	L775-P778 HydrophobicContact CB-CG 4.01Å; L775-P778 HydrophobicContact CD1-CG 4.48Å; P778-W780 PolarHBondContact O-N 2.68Å; P778-W780 VanDerWaalsContact O-N 3.08Å; P778-L781 HydrophobicContact CG-CB 3.9Å; P778-L781 HydrophobicContact CG-CD2 4.41Å; P778-L781 PolarHBondContact O-N 3.01Å; P778-V782 PolarHBondContact O-N 2.79Å
779	D	87	Confident	90.6	Very high	50 Å²	50	47.6 Å²	47.6	27%	0.267	24%	0.238	S	C	.	.	H	α-helix	trans	-47	-44.3	-174.6	-81.1	-12.1	0	0	0	114.3	S777 L781 N783 Q888	S777-D779 PolarHBondContact O-N 3.42Å; D779-L781 VanDerWaalsContact C-N 3.3Å; D779-L781 PolarHBondContact O-N 2.89Å; D779-N783 VanDerWaalsContact O-CB 3.29Å; D779-N783 WeakPolarHBondContact O-CB 3.42Å; D779-N783 VanDerWaalsContact O-CG 3.31Å; D779-N783 PolarHBondContact O-N 3.34Å; D779-N783 PolarHBondContact O-ND2 2.93Å; D779-Q888 WeakPolarHBondContact OD1-CG 3.08Å; D779-Q888 PolarHBondContact OD1-NE2 3.1Å
780	W	88.3	Confident	90.8	Very high	34 Å²	34	44.5 Å²	44.5	13%	0.129	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-38.5	-177	75.6	-93.6	0	0	0	111.3	E732 P778 T784 L952 F953	E732-W780 HydrophobicContact CG-CH2 4.4Å; P778-W780 PolarHBondContact O-N 2.68Å; P778-W780 VanDerWaalsContact O-N 3.08Å; W780-T784 VanDerWaalsContact O-CB 3.3Å; W780-T784 WeakPolarHBondContact O-CB 3.48Å; W780-T784 PolarHBondContact O-N 2.85Å; W780-T784 PolarHBondContact O-OG1 3.36Å; W780-L952 HydrophobicContact CD2-CD2 3.36Å; W780-L952 VanDerWaalsContact CE2-CD2 3.45Å; W780-L952 HydrophobicContact CE3-CD2 3.5Å; W780-L952 HydrophobicContact CG-CD2 3.99Å; W780-L952 HydrophobicContact CH2-CD2 3.79Å; W780-L952 HydrophobicContact CZ2-CD2 3.67Å; W780-L952 HydrophobicContact CZ3-CD2 3.71Å; W780-F953 HydrophobicContact CB-CE2 4.05Å; W780-F953 HydrophobicContact CB-CZ 4.4Å
781	L	90.2	Very high	91	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-79.3	-40.6	-176.3	-174.4	51.9	0	0	0	110.8	A768 I771 C772 P778 D779 N783 T784 I785	A768-L781 HydrophobicContact CB-CD1 4.5Å; I771-L781 HydrophobicContact CB-CD2 4.4Å; I771-L781 HydrophobicContact CG2-CD2 3.92Å; C772-L781 HydrophobicContact CB-CD2 3.67Å; C772-L781 HydrophobicContact CB-CG 3.87Å; P778-L781 HydrophobicContact CG-CB 3.9Å; P778-L781 HydrophobicContact CG-CD2 4.41Å; P778-L781 PolarHBondContact O-N 3.01Å; D779-L781 VanDerWaalsContact C-N 3.3Å; D779-L781 PolarHBondContact O-N 2.89Å; L781-N783 VanDerWaalsContact C-N 3.3Å; L781-N783 PolarHBondContact O-N 2.81Å; L781-T784 PolarHBondContact O-N 3.14Å; L781-I785 HydrophobicContact CD1-CD1 4.17Å; L781-I785 HydrophobicContact CD1-CG1 4.26Å; L781-I785 HydrophobicContact CG-CD1 4.04Å; L781-I785 WeakPolarHBondContact O-CB 3.42Å; L781-I785 VanDerWaalsContact O-CG1 3.29Å; L781-I785 WeakPolarHBondContact O-CG1 3.49Å; L781-I785 PolarHBondContact O-N 2.89Å
782	V	92.1	Very high	91.3	Very high	39 Å²	39	41.6 Å²	41.6	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-54.8	-49.3	171.9	174.6	0	0	0	0	110.1	C772 P778 I785 R786 I886	C772-V782 VanDerWaalsContact SG-CG2 3.56Å; P778-V782 PolarHBondContact O-N 2.79Å; V782-I785 PolarHBondContact O-N 2.99Å; V782-R786 WeakPolarHBondContact O-CB 3.45Å; V782-R786 PolarHBondContact O-N 3.23Å; V782-I886 HydrophobicContact CG1-CD1 4.31Å
783	N	92.2	Very high	91.5	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-70.3	-33.4	-179.9	-72.8	-40.5	0	0	0	112.8	D779 L781 E787 D885 I886	D779-N783 VanDerWaalsContact O-CB 3.29Å; D779-N783 WeakPolarHBondContact O-CB 3.42Å; D779-N783 VanDerWaalsContact O-CG 3.31Å; D779-N783 PolarHBondContact O-N 3.34Å; D779-N783 PolarHBondContact O-ND2 2.93Å; L781-N783 VanDerWaalsContact C-N 3.3Å; L781-N783 PolarHBondContact O-N 2.81Å; N783-E787 WeakPolarHBondContact O-CB 3.49Å; N783-E787 PolarHBondContact O-N 3.41Å; N783-D885 HydrophobicContact CB-CB 4.44Å; N783-D885 WeakPolarHBondContact OD1-CA 3.34Å; N783-I886 PolarHBondContact ND2-O 3.49Å; N783-I886 PolarHBondContact OD1-N 2.77Å
784	T	93.3	Very high	91.8	Very high	1 Å²	1	36 Å²	36	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-43.7	174	-61.4	0	0	0	0	111.9	L734 C735 N738 W780 L781 E787 H788	L734-T784 HydrophobicContact CB-CG2 4Å; L734-T784 HydrophobicContact CD2-CG2 4.19Å; L734-T784 HydrophobicContact CG-CG2 4.18Å; C735-T784 HydrophobicContact CB-CG2 3.88Å; N738-T784 PolarHBondContact ND2-O 3.1Å; W780-T784 VanDerWaalsContact O-CB 3.3Å; W780-T784 WeakPolarHBondContact O-CB 3.48Å; W780-T784 PolarHBondContact O-N 2.85Å; W780-T784 PolarHBondContact O-OG1 3.36Å; L781-T784 PolarHBondContact O-N 3.14Å; T784-E787 PolarHBondContact O-N 2.85Å; T784-H788 WeakPolarHBondContact O-CB 3.45Å; T784-H788 PolarHBondContact O-N 3.21Å
785	I	94.4	Very high	92.1	Very high	14 Å²	14	28.6 Å²	28.6	7%	0.072	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-50.2	176.8	-70.6	165.9	0	0	0	109.8	L734 L765 A768 K769 C772 L781 V782 E787 H788 E789	L734-I785 HydrophobicContact CD2-CG1 4.11Å; L765-I785 HydrophobicContact CD1-CG2 3.98Å; A768-I785 HydrophobicContact CB-CD1 4.28Å; A768-I785 HydrophobicContact CB-CG1 4.21Å; K769-I785 HydrophobicContact CG-CD1 4.05Å; K769-I785 HydrophobicContact CG-CG2 4.14Å; C772-I785 HydrophobicContact CB-CD1 3.84Å; L781-I785 HydrophobicContact CD1-CD1 4.17Å; L781-I785 HydrophobicContact CD1-CG1 4.26Å; L781-I785 HydrophobicContact CG-CD1 4.04Å; L781-I785 WeakPolarHBondContact O-CB 3.42Å; L781-I785 VanDerWaalsContact O-CG1 3.29Å; L781-I785 WeakPolarHBondContact O-CG1 3.49Å; L781-I785 PolarHBondContact O-N 2.89Å; V782-I785 PolarHBondContact O-N 2.99Å; I785-E787 VanDerWaalsContact C-N 3.3Å; I785-E787 PolarHBondContact O-N 3.42Å; I785-H788 WeakPolarHBondContact O-CB 3.35Å; I785-H788 PolarHBondContact O-N 3.21Å; I785-H788 VanDerWaalsContact O-N 3.13Å; I785-E789 WeakPolarHBondContact O-CG 3.23Å; I785-E789 PolarHBondContact O-N 3.22Å
786	R	94.2	Very high	92.5	Very high	27 Å²	27	30.7 Å²	30.7	10%	0.102	16%	0.162	C	C	.	.	H	α-helix	trans	-58	-44.3	178.1	-179.8	180	176.6	81	3.7	111.8	V782 H788 E789 C790 P878 G881 V884	V782-R786 WeakPolarHBondContact O-CB 3.45Å; V782-R786 PolarHBondContact O-N 3.23Å; R786-H788 VanDerWaalsContact C-N 3.34Å; R786-E789 PolarHBondContact O-N 2.83Å; R786-C790 PolarHBondContact O-N 3.21Å; R786-C790 PolarHBondContact O-SG 3.13Å; R786-P878 PolarHBondContact NH2-O 3.41Å; R786-G881 PolarHBondContact NH2-O 3.1Å; R786-V884 PolarHBondContact NE-O 2.87Å
787	E	94.7	Very high	92.9	Very high	3 Å²	3	23.4 Å²	23.4	1%	0.014	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-43.1	176.9	173.9	167.7	-152.8	0	0	111.8	N738 R742 N783 T784 I785 E789 C790 L791 L883 R963	N738-E787 HydrophobicContact CB-CG 4.21Å; R742-E787 WeakPolarHBondContact CD-OE1 3.17Å; R742-E787 IonicContact CZ-OE1 2.89Å; R742-E787 IonicContact NE-OE1 3.51Å; R742-E787 IonicContact NH1-OE1 3.69Å; R742-E787 PolarHBondContact NH1-OE1 3.45Å; R742-E787 IonicContact NH1-OE2 3.71Å; R742-E787 PolarHBondContact NH1-OE2 2.8Å; N783-E787 WeakPolarHBondContact O-CB 3.49Å; N783-E787 PolarHBondContact O-N 3.41Å; T784-E787 PolarHBondContact O-N 2.85Å; I785-E787 VanDerWaalsContact C-N 3.3Å; I785-E787 PolarHBondContact O-N 3.42Å; E787-E789 VanDerWaalsContact C-N 3.33Å; E787-E789 PolarHBondContact O-N 2.64Å; E787-C790 WeakPolarHBondContact O-CB 3.42Å; E787-C790 PolarHBondContact O-N 2.8Å; E787-L791 HydrophobicContact CG-CD1 3.78Å; E787-L791 HydrophobicContact CG-CG 4.24Å; E787-L791 WeakPolarHBondContact O-CG 3.28Å; E787-L791 PolarHBondContact O-N 3.22Å; E787-L883 HydrophobicContact CG-CD1 3.95Å; E787-R963 IonicContact OE2-CZ 3.45Å; E787-R963 VanDerWaalsContact OE2-CZ 3.24Å; E787-R963 IonicContact OE2-NE 2.73Å; E787-R963 PolarHBondContact OE2-NE 3.29Å; E787-R963 IonicContact OE2-NH2 3.46Å; E787-R963 PolarHBondContact OE2-NH2 3.16Å
788	H	96	Very high	93.2	Very high	14 Å²	14	23 Å²	23	7%	0.065	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-43.8	178.4	-171.6	73.6	0	0	0	112	L734 N738 T784 I785 R786 C790 L791 T792	L734-H788 HydrophobicContact CD1-CB 4.12Å; L734-H788 VanDerWaalsContact CD1-CG 3.49Å; L734-H788 WeakPolarHBondContact CD1-ND1 3.38Å; L734-H788 HydrophobicContact CD2-CB 3.88Å; L734-H788 HydrophobicContact CG-CB 3.93Å; N738-H788 PolarHBondContact ND2-N 2.79Å; N738-H788 WeakPolarHBondContact OD1-CA 3.21Å; N738-H788 WeakPolarHBondContact OD1-CB 3.36Å; N738-H788 PolarHBondContact OD1-ND1 3.18Å; T784-H788 WeakPolarHBondContact O-CB 3.45Å; T784-H788 PolarHBondContact O-N 3.21Å; I785-H788 WeakPolarHBondContact O-CB 3.35Å; I785-H788 PolarHBondContact O-N 3.21Å; I785-H788 VanDerWaalsContact O-N 3.13Å; R786-H788 VanDerWaalsContact C-N 3.34Å; H788-C790 VanDerWaalsContact C-N 3.34Å; H788-L791 PolarHBondContact O-N 2.99Å; H788-T792 WeakPolarHBondContact O-CB 3.46Å; H788-T792 PolarHBondContact O-N 3.2Å; H788-T792 PolarHBondContact O-OG1 3.2Å
789	E	95.3	Very high	93.4	Very high	63 Å²	63	24.3 Å²	24.3	29%	0.294	12%	0.119	S	C	.	.	H	α-helix	trans	-61.6	-42.4	175	-69.1	176	156.5	0	0	111.1	L765 K769 I785 R786 E787 T792 L793	L765-E789 HydrophobicContact CD2-CG 4.29Å; K769-E789 VanDerWaalsContact CE-OE1 3.24Å; K769-E789 WeakPolarHBondContact CE-OE1 3.44Å; K769-E789 IonicContact NZ-OE1 2.77Å; K769-E789 PolarHBondContact NZ-OE1 3.27Å; I785-E789 WeakPolarHBondContact O-CG 3.23Å; I785-E789 PolarHBondContact O-N 3.22Å; R786-E789 PolarHBondContact O-N 2.83Å; E787-E789 VanDerWaalsContact C-N 3.33Å; E787-E789 PolarHBondContact O-N 2.64Å; E789-T792 PolarHBondContact O-N 3.04Å; E789-L793 VanDerWaalsContact O-CB 3.25Å; E789-L793 WeakPolarHBondContact O-CB 3.41Å; E789-L793 PolarHBondContact O-N 2.57Å
790	C	95.6	Very high	93.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.3	-49	175.9	-69.9	0	0	0	0	112.3	R786 E787 H788 Y794 Y877 W882 L883	R786-C790 PolarHBondContact O-N 3.21Å; R786-C790 PolarHBondContact O-SG 3.13Å; E787-C790 WeakPolarHBondContact O-CB 3.42Å; E787-C790 PolarHBondContact O-N 2.8Å; H788-C790 VanDerWaalsContact C-N 3.34Å; C790-Y794 PolarHBondContact O-N 3.22Å; C790-Y794 VanDerWaalsContact O-N 3.12Å; C790-Y877 VanDerWaalsContact SG-CE1 3.55Å; C790-Y877 VanDerWaalsContact SG-CZ 3.53Å; C790-W882 HydrophobicContact CB-CG 4.48Å; C790-W882 PolarHBondContact O-NE1 3.45Å; C790-L883 HydrophobicContact CB-CD1 4.05Å; C790-L883 PolarHBondContact SG-N 2.84Å
791	L	95.9	Very high	94	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.9	-38.7	-177.7	-64.8	170.6	0	0	0	111.4	N738 L741 R742 I745 E787 H788 Y794 L795 L883	N738-L791 HydrophobicContact CB-CD1 4.01Å; L741-L791 HydrophobicContact CB-CD1 3.9Å; L741-L791 HydrophobicContact CD1-CB 4.29Å; L741-L791 HydrophobicContact CD1-CD1 4.33Å; R742-L791 HydrophobicContact CG-CD1 4.23Å; R742-L791 HydrophobicContact CG-CD2 4.45Å; I745-L791 HydrophobicContact CD1-CB 4.28Å; I745-L791 HydrophobicContact CD1-CD2 3.77Å; E787-L791 HydrophobicContact CG-CD1 3.78Å; E787-L791 HydrophobicContact CG-CG 4.24Å; E787-L791 WeakPolarHBondContact O-CG 3.28Å; E787-L791 PolarHBondContact O-N 3.22Å; H788-L791 PolarHBondContact O-N 2.99Å; L791-Y794 PolarHBondContact O-N 3Å; L791-L795 WeakPolarHBondContact O-CG 3.47Å; L791-L795 PolarHBondContact O-N 3.5Å; L791-L883 HydrophobicContact CD2-CD1 3.94Å; L791-L883 HydrophobicContact CG-CD1 4.16Å
792	T	95	Very high	94	Very high	26 Å²	26	24.4 Å²	24.4	16%	0.16	13%	0.13	C	C	.	.	H	α-helix	trans	-66.6	-45.6	176.7	-54.1	0	0	0	0	111.1	H788 E789 Y794 L795 E796	H788-T792 WeakPolarHBondContact O-CB 3.46Å; H788-T792 PolarHBondContact O-N 3.2Å; H788-T792 PolarHBondContact O-OG1 3.2Å; E789-T792 PolarHBondContact O-N 3.04Å; T792-Y794 PolarHBondContact O-N 3.39Å; T792-L795 PolarHBondContact O-N 3.24Å; T792-L795 VanDerWaalsContact O-N 3.15Å; T792-E796 HydrophobicContact CG2-CG 4.47Å; T792-E796 WeakPolarHBondContact O-CG 3.42Å; T792-E796 PolarHBondContact O-N 3.49Å
793	L	95	Very high	93.9	Very high	35 Å²	35	26.9 Å²	26.9	18%	0.183	14%	0.142	C	C	.	.	H	α-helix	trans	-56.5	-40.5	175.4	179.1	62.4	0	0	0	111.8	E789 E796 S797 A873 L874 Y877	E789-L793 VanDerWaalsContact O-CB 3.25Å; E789-L793 WeakPolarHBondContact O-CB 3.41Å; E789-L793 PolarHBondContact O-N 2.57Å; L793-E796 PolarHBondContact O-N 3.29Å; L793-S797 WeakPolarHBondContact O-CB 3.39Å; L793-S797 PolarHBondContact O-N 2.89Å; L793-A873 HydrophobicContact CD1-CB 4.22Å; L793-A873 HydrophobicContact CD2-CB 4.2Å; L793-L874 HydrophobicContact CB-CD2 4.29Å; L793-L874 HydrophobicContact CD2-CD2 3.88Å; L793-L874 HydrophobicContact CD2-CG 4.43Å; L793-L874 HydrophobicContact CG-CD2 3.76Å; L793-L874 HydrophobicContact CG-CG 4.31Å; L793-Y877 HydrophobicContact CD2-CD2 3.73Å; L793-Y877 HydrophobicContact CD2-CE2 3.84Å
794	Y	95.6	Very high	94	Very high	1 Å²	1	26.7 Å²	26.7	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-46.1	177.4	175.4	-101.4	0	0	0	112.5	I745 F750 C790 L791 T792 S797 R798 L874 W882 C974	I745-Y794 HydrophobicContact CD1-CD1 4.11Å; I745-Y794 HydrophobicContact CG1-CD1 4.32Å; I745-Y794 HydrophobicContact CG1-CE1 4.41Å; I745-Y794 HydrophobicContact CG2-CD1 4Å; I745-Y794 HydrophobicContact CG2-CE1 3.54Å; F750-Y794 HydrophobicContact CE1-CE1 4.03Å; C790-Y794 PolarHBondContact O-N 3.22Å; C790-Y794 VanDerWaalsContact O-N 3.12Å; L791-Y794 PolarHBondContact O-N 3Å; T792-Y794 PolarHBondContact O-N 3.39Å; Y794-S797 PolarHBondContact O-N 3.39Å; Y794-S797 PolarHBondContact O-OG 3.13Å; Y794-R798 HydrophobicContact CE1-CG 4.13Å; Y794-R798 HydrophobicContact CE2-CG 4.24Å; Y794-R798 WeakPolarHBondContact O-CG 3.47Å; Y794-R798 PolarHBondContact O-N 3.4Å; Y794-R798 VanDerWaalsContact OH-CZ 3.3Å; Y794-R798 PolarHBondContact OH-NE 3.12Å; Y794-R798 VanDerWaalsContact OH-NE 3.13Å; Y794-R798 PolarHBondContact OH-NH2 3.43Å; Y794-L874 HydrophobicContact CD2-CD1 3.86Å; Y794-W882 HydrophobicContact CD2-CZ2 4.43Å; Y794-W882 HydrophobicContact CG-CZ2 4.17Å; Y794-C974 HydrophobicContact CD2-CB 4.07Å; Y794-C974 HydrophobicContact CE2-CB 3.56Å
795	L	94.4	Very high	93.9	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-62.4	-44.2	176.9	-67.1	169.9	0	0	0	111.6	L741 I745 F750 A753 L757 L791 T792 S797 R798 D799	L741-L795 HydrophobicContact CD2-CD1 4.07Å; I745-L795 HydrophobicContact CD1-CD2 4.3Å; I745-L795 HydrophobicContact CD1-CG 4.28Å; I745-L795 HydrophobicContact CG1-CD2 4.01Å; F750-L795 HydrophobicContact CD1-CD2 3.79Å; A753-L795 HydrophobicContact CB-CD1 3.85Å; A753-L795 HydrophobicContact CB-CD2 3.93Å; L757-L795 HydrophobicContact CD1-CD1 3.78Å; L791-L795 WeakPolarHBondContact O-CG 3.47Å; L791-L795 PolarHBondContact O-N 3.5Å; T792-L795 PolarHBondContact O-N 3.24Å; T792-L795 VanDerWaalsContact O-N 3.15Å; L795-S797 VanDerWaalsContact C-N 3.32Å; L795-S797 PolarHBondContact O-N 3.46Å; L795-R798 WeakPolarHBondContact O-CB 3.42Å; L795-R798 PolarHBondContact O-N 3.4Å; L795-D799 PolarHBondContact O-N 3.43Å
796	E	93.9	Very high	93.6	Very high	88 Å²	88	35.6 Å²	35.6	41%	0.411	18%	0.179	S	C	.	.	H	α-helix	trans	-62.8	-37.6	176.6	-71.1	-177	-164.1	0	0	113	T792 L793 R798 A800 K870	T792-E796 HydrophobicContact CG2-CG 4.47Å; T792-E796 WeakPolarHBondContact O-CG 3.42Å; T792-E796 PolarHBondContact O-N 3.49Å; L793-E796 PolarHBondContact O-N 3.29Å; E796-R798 VanDerWaalsContact C-N 3.33Å; E796-A800 WeakPolarHBondContact O-CB 3.17Å; E796-A800 PolarHBondContact O-N 2.89Å; E796-K870 IonicContact OE2-NZ 2.98Å
797	S	94	Very high	93.2	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-36.3	176.5	79	0	0	0	0	111.8	L793 Y794 L795 F801 L874	L793-S797 WeakPolarHBondContact O-CB 3.39Å; L793-S797 PolarHBondContact O-N 2.89Å; Y794-S797 PolarHBondContact O-N 3.39Å; Y794-S797 PolarHBondContact O-OG 3.13Å; L795-S797 VanDerWaalsContact C-N 3.32Å; L795-S797 PolarHBondContact O-N 3.46Å; S797-F801 PolarHBondContact O-N 3.36Å; S797-L874 VanDerWaalsContact OG-CD1 3.26Å; S797-L874 WeakPolarHBondContact OG-CD1 3.23Å
798	R	93.5	Very high	92.9	Very high	41 Å²	41	38.2 Å²	38.2	16%	0.155	19%	0.193	C	C	.	.	H	α-helix	trans	-68	-44.6	176	-79.7	-72.8	-173.4	151.4	0.8	111.8	Y794 L795 E796 F801 A802 E977	Y794-R798 HydrophobicContact CE1-CG 4.13Å; Y794-R798 HydrophobicContact CE2-CG 4.24Å; Y794-R798 WeakPolarHBondContact O-CG 3.47Å; Y794-R798 PolarHBondContact O-N 3.4Å; Y794-R798 VanDerWaalsContact OH-CZ 3.3Å; Y794-R798 PolarHBondContact OH-NE 3.12Å; Y794-R798 VanDerWaalsContact OH-NE 3.13Å; Y794-R798 PolarHBondContact OH-NH2 3.43Å; L795-R798 WeakPolarHBondContact O-CB 3.42Å; L795-R798 PolarHBondContact O-N 3.4Å; E796-R798 VanDerWaalsContact C-N 3.33Å; R798-F801 PolarHBondContact O-N 3.28Å; R798-A802 WeakPolarHBondContact O-CB 3.36Å; R798-A802 PolarHBondContact O-N 2.88Å; R798-E977 IonicContact CZ-OE2 3.84Å; R798-E977 IonicContact NH2-OE2 3.51Å; R798-E977 PolarHBondContact NH2-OE2 2.69Å
799	D	91.2	Very high	92.3	Very high	60 Å²	60	42 Å²	42	32%	0.321	21%	0.21	S	C	.	.	H	α-helix	trans	-62.8	-44.4	176.5	-72.3	-21	0	0	0	110.4	Q754 L795 F801 A802 D803	Q754-D799 PolarHBondContact NE2-OD1 3.19Å; Q754-D799 PolarHBondContact NE2-OD2 3.32Å; L795-D799 PolarHBondContact O-N 3.43Å; D799-F801 PolarHBondContact O-N 3.39Å; D799-A802 PolarHBondContact O-N 3.12Å; D799-A802 VanDerWaalsContact O-N 3.12Å; D799-D803 PolarHBondContact O-N 3.35Å
800	A	92.7	Very high	91.9	Very high	18 Å²	18	43.4 Å²	43.4	15%	0.149	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-40.2	176.4	0	0	0	0	0	113.3	E796 W804 K870	E796-A800 WeakPolarHBondContact O-CB 3.17Å; E796-A800 PolarHBondContact O-N 2.89Å; A800-W804 VanDerWaalsContact O-CB 3.3Å; A800-W804 WeakPolarHBondContact O-CB 3.44Å; A800-W804 PolarHBondContact O-N 2.84Å; A800-K870 HydrophobicContact CB-CD 3.77Å
801	F	93.9	Very high	91.2	Very high	20 Å²	20	48.1 Å²	48.1	9%	0.088	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-41	172.5	179.5	-86.5	0	0	0	111.8	S797 R798 D799 W804 Y805 L871 L981 L985	S797-F801 PolarHBondContact O-N 3.36Å; R798-F801 PolarHBondContact O-N 3.28Å; D799-F801 PolarHBondContact O-N 3.39Å; F801-W804 AromaticContact CD2-CE3 3.92Å; F801-W804 HydrophobicContact CD2-CE3 3.92Å; F801-W804 HydrophobicContact CD2-CZ3 4.11Å; F801-W804 AromaticContact CE2-CE3 3.8Å; F801-W804 HydrophobicContact CE2-CE3 3.8Å; F801-W804 AromaticContact CE2-CZ3 3.51Å; F801-W804 HydrophobicContact CE2-CZ3 3.51Å; F801-W804 HydrophobicContact CG-CE3 4.46Å; F801-W804 HydrophobicContact CZ-CE3 4.21Å; F801-W804 AromaticContact CZ-CZ3 3.76Å; F801-W804 HydrophobicContact CZ-CZ3 3.76Å; F801-W804 PolarHBondContact O-N 3.25Å; F801-Y805 HydrophobicContact CE1-CD2 4.26Å; F801-Y805 HydrophobicContact CE1-CG 4.39Å; F801-Y805 HydrophobicContact CZ-CD2 4.26Å; F801-Y805 WeakPolarHBondContact O-CB 3.44Å; F801-Y805 PolarHBondContact O-N 2.95Å; F801-L871 HydrophobicContact CB-CD1 4.31Å; F801-L871 HydrophobicContact CD2-CD1 3.99Å; F801-L981 HydrophobicContact CD1-CD2 4.08Å; F801-L981 HydrophobicContact CD2-CB 4.08Å; F801-L981 HydrophobicContact CD2-CD2 4.44Å; F801-L981 HydrophobicContact CE1-CD2 3.68Å; F801-L981 HydrophobicContact CE2-CB 3.99Å; F801-L981 HydrophobicContact CE2-CD2 4.03Å; F801-L981 WeakPolarHBondContact CE2-O 3.45Å; F801-L981 HydrophobicContact CG-CD2 4.46Å; F801-L981 HydrophobicContact CZ-CB 4.47Å; F801-L981 HydrophobicContact CZ-CD2 3.64Å; F801-L985 HydrophobicContact CD2-CB 4.41Å; F801-L985 HydrophobicContact CD2-CD1 3.86Å; F801-L985 HydrophobicContact CE2-CB 4.04Å; F801-L985 HydrophobicContact CE2-CD1 4.27Å
802	A	91.6	Very high	90.7	Very high	48 Å²	48	56.2 Å²	56.2	40%	0.397	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-44.6	179.9	0	0	0	0	0	111.8	R798 D799 Y805 Q806	R798-A802 WeakPolarHBondContact O-CB 3.36Å; R798-A802 PolarHBondContact O-N 2.88Å; D799-A802 PolarHBondContact O-N 3.12Å; D799-A802 VanDerWaalsContact O-N 3.12Å; A802-Y805 PolarHBondContact O-N 3.09Å; A802-Q806 WeakPolarHBondContact O-CB 3.35Å; A802-Q806 PolarHBondContact O-N 2.82Å
803	D	89.7	Confident	90.2	Very high	92 Å²	92	55.6 Å²	55.6	49%	0.492	28%	0.276	S	S	.	.	H	α-helix	trans	-60.6	-49.5	175.5	-74	-16.9	0	0	0	110.9	D799 Y805 Q806 Q807	D799-D803 PolarHBondContact O-N 3.35Å; D803-Y805 PolarHBondContact O-N 2.84Å; D803-Q806 PolarHBondContact O-N 3.21Å; D803-Q807 WeakPolarHBondContact O-CB 3.4Å; D803-Q807 VanDerWaalsContact O-CG 3.26Å; D803-Q807 WeakPolarHBondContact O-CG 3.26Å; D803-Q807 PolarHBondContact O-N 3.41Å
804	W	93.4	Very high	89.7	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-48.9	174.3	166.9	85.1	0	0	0	111.5	A800 F801 Q806 Q807 V808 T864 A867 L985 T988	A800-W804 VanDerWaalsContact O-CB 3.3Å; A800-W804 WeakPolarHBondContact O-CB 3.44Å; A800-W804 PolarHBondContact O-N 2.84Å; F801-W804 AromaticContact CD2-CE3 3.92Å; F801-W804 HydrophobicContact CD2-CE3 3.92Å; F801-W804 HydrophobicContact CD2-CZ3 4.11Å; F801-W804 AromaticContact CE2-CE3 3.8Å; F801-W804 HydrophobicContact CE2-CE3 3.8Å; F801-W804 AromaticContact CE2-CZ3 3.51Å; F801-W804 HydrophobicContact CE2-CZ3 3.51Å; F801-W804 HydrophobicContact CG-CE3 4.46Å; F801-W804 HydrophobicContact CZ-CE3 4.21Å; F801-W804 AromaticContact CZ-CZ3 3.76Å; F801-W804 HydrophobicContact CZ-CZ3 3.76Å; F801-W804 PolarHBondContact O-N 3.25Å; W804-Q806 VanDerWaalsContact C-N 3.29Å; W804-Q806 PolarHBondContact O-N 2.86Å; W804-Q807 PolarHBondContact O-N 2.89Å; W804-V808 HydrophobicContact CD2-CG2 4.23Å; W804-V808 HydrophobicContact CG-CG2 4.32Å; W804-V808 HydrophobicContact CZ2-CG2 4.07Å; W804-V808 WeakPolarHBondContact O-CG2 3.39Å; W804-V808 PolarHBondContact O-N 3.07Å; W804-T864 PolarHBondContact NE1-OG1 3.02Å; W804-A867 HydrophobicContact CB-CB 3.86Å; W804-A867 HydrophobicContact CG-CB 4.14Å; W804-L985 HydrophobicContact CD2-CD1 3.78Å; W804-L985 HydrophobicContact CD2-CG 4.14Å; W804-L985 HydrophobicContact CE3-CD1 3.84Å; W804-L985 HydrophobicContact CE3-CG 4.24Å; W804-L985 HydrophobicContact CG-CD1 4.27Å; W804-L985 VanDerWaalsContact CH2-CA 3.47Å; W804-L985 HydrophobicContact CH2-CB 3.99Å; W804-L985 HydrophobicContact CH2-CG 4.04Å; W804-L985 HydrophobicContact CZ2-CB 4.27Å; W804-L985 HydrophobicContact CZ2-CD1 4.42Å; W804-L985 HydrophobicContact CZ2-CG 3.85Å; W804-L985 HydrophobicContact CZ3-CB 4.12Å; W804-L985 HydrophobicContact CZ3-CD1 4.22Å; W804-L985 HydrophobicContact CZ3-CG 4.19Å; W804-T988 HydrophobicContact CH2-CG2 4.15Å; W804-T988 HydrophobicContact CZ2-CG2 4.34Å
805	Y	91	Very high	89	Confident	79 Å²	79	64.4 Å²	64.4	31%	0.31	32%	0.324	S	S	.	.	H	α-helix	trans	-59.8	-42.8	-177.9	-174.3	-96.7	0	0	0	111	F801 A802 D803 H809 R984	F801-Y805 HydrophobicContact CE1-CD2 4.26Å; F801-Y805 HydrophobicContact CE1-CG 4.39Å; F801-Y805 HydrophobicContact CZ-CD2 4.26Å; F801-Y805 WeakPolarHBondContact O-CB 3.44Å; F801-Y805 PolarHBondContact O-N 2.95Å; A802-Y805 PolarHBondContact O-N 3.09Å; D803-Y805 PolarHBondContact O-N 2.84Å; Y805-H809 AromaticContact CD2-CE1 3.56Å; Y805-H809 AromaticContact CD2-ND1 3.93Å; Y805-H809 AromaticContact CE2-CE1 3.16Å; Y805-H809 WeakPolarHBondContact CE2-CE1 3.28Å; Y805-H809 AromaticContact CE2-ND1 3.83Å; Y805-H809 AromaticContact CE2-NE2 3.79Å; Y805-H809 AromaticContact CZ-CE1 3.48Å; Y805-H809 VanDerWaalsContact CZ-CE1 3.48Å; Y805-H809 AromaticContact CZ-ND1 3.92Å; Y805-H809 AromaticContact CZ-NE2 3.8Å; Y805-H809 PolarHBondContact O-N 3.38Å; Y805-H809 PolarHBondContact O-ND1 3.34Å; Y805-R984 PolarHBondContact OH-NH2 2.58Å
806	Q	89.3	Confident	88.1	Confident	124 Å²	124	66 Å²	66	58%	0.579	34%	0.335	S	S	*	.	H	α-helix	trans	-64.8	-47.1	176.1	-175.5	175.3	-7.5	0	0	111.8	A802 D803 W804 H809 T810	A802-Q806 WeakPolarHBondContact O-CB 3.35Å; A802-Q806 PolarHBondContact O-N 2.82Å; D803-Q806 PolarHBondContact O-N 3.21Å; W804-Q806 VanDerWaalsContact C-N 3.29Å; W804-Q806 PolarHBondContact O-N 2.86Å; Q806-H809 PolarHBondContact O-N 3.33Å; Q806-T810 HydrophobicContact CG-CG2 4.15Å; Q806-T810 WeakPolarHBondContact O-CB 3.3Å; Q806-T810 VanDerWaalsContact O-CG2 3.28Å; Q806-T810 WeakPolarHBondContact O-CG2 3.48Å; Q806-T810 PolarHBondContact O-N 3.41Å; Q806-T810 PolarHBondContact O-OG1 2.84Å
807	Q	86.3	Confident	87.1	Confident	78 Å²	78	66.5 Å²	66.5	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-45.1	-178.7	-72.8	172.5	0.9	0	0	112.1	D803 W804 H809 T810 N811 D863	D803-Q807 WeakPolarHBondContact O-CB 3.4Å; D803-Q807 VanDerWaalsContact O-CG 3.26Å; D803-Q807 WeakPolarHBondContact O-CG 3.26Å; D803-Q807 PolarHBondContact O-N 3.41Å; W804-Q807 PolarHBondContact O-N 2.89Å; Q807-H809 VanDerWaalsContact C-N 3.34Å; Q807-H809 PolarHBondContact O-N 3.41Å; Q807-T810 PolarHBondContact O-OG1 2.87Å; Q807-N811 VanDerWaalsContact O-CB 3.3Å; Q807-N811 WeakPolarHBondContact O-CB 3.47Å; Q807-N811 PolarHBondContact O-N 2.76Å; Q807-N811 PolarHBondContact O-ND2 3.17Å; Q807-D863 PolarHBondContact OE1-OD2 3.48Å
808	V	87	Confident	85.7	Confident	6 Å²	6	69.1 Å²	69.1	4%	0.036	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-40.4	-179.2	171.3	0	0	0	0	111.9	W804 W856 T860 T988	W804-V808 HydrophobicContact CD2-CG2 4.23Å; W804-V808 HydrophobicContact CG-CG2 4.32Å; W804-V808 HydrophobicContact CZ2-CG2 4.07Å; W804-V808 WeakPolarHBondContact O-CG2 3.39Å; W804-V808 PolarHBondContact O-N 3.07Å; V808-W856 HydrophobicContact CG1-CZ2 3.99Å; V808-W856 PolarHBondContact O-NE1 3.29Å; V808-T860 HydrophobicContact CG1-CG2 4.37Å; V808-T860 HydrophobicContact CG2-CG2 3.68Å; V808-T988 HydrophobicContact CG1-CG2 4.03Å
809	H	84.4	Confident	84.3	Confident	94 Å²	94	69.3 Å²	69.3	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-82	-35	-177.3	-68.3	76.8	0	0	0	113.1	Y805 Q806 Q807	Y805-H809 AromaticContact CD2-CE1 3.56Å; Y805-H809 AromaticContact CD2-ND1 3.93Å; Y805-H809 AromaticContact CE2-CE1 3.16Å; Y805-H809 WeakPolarHBondContact CE2-CE1 3.28Å; Y805-H809 AromaticContact CE2-ND1 3.83Å; Y805-H809 AromaticContact CE2-NE2 3.79Å; Y805-H809 AromaticContact CZ-CE1 3.48Å; Y805-H809 VanDerWaalsContact CZ-CE1 3.48Å; Y805-H809 AromaticContact CZ-ND1 3.92Å; Y805-H809 AromaticContact CZ-NE2 3.8Å; Y805-H809 PolarHBondContact O-N 3.38Å; Y805-H809 PolarHBondContact O-ND1 3.34Å; Q806-H809 PolarHBondContact O-N 3.33Å; Q807-H809 VanDerWaalsContact C-N 3.34Å; Q807-H809 PolarHBondContact O-N 3.41Å
810	T	85.7	Confident	82.8	Confident	92 Å²	92	70.1 Å²	70.1	56%	0.564	38%	0.378	S	S	*	.	H	α-helix	trans	-76.4	-37.1	-179.3	52.4	0	0	0	0	112.9	Q806 Q807	Q806-T810 HydrophobicContact CG-CG2 4.15Å; Q806-T810 WeakPolarHBondContact O-CB 3.3Å; Q806-T810 VanDerWaalsContact O-CG2 3.28Å; Q806-T810 WeakPolarHBondContact O-CG2 3.48Å; Q806-T810 PolarHBondContact O-N 3.41Å; Q806-T810 PolarHBondContact O-OG1 2.84Å; Q807-T810 PolarHBondContact O-OG1 2.87Å
811	N	82.3	Confident	80.8	Confident	99 Å²	99	75.4 Å²	75.4	53%	0.529	40%	0.403	S	S	.	.	S	Bend	trans	-90.5	-1.2	-174.5	-65.9	-36.5	0	0	0	114.2	Q807 P813	Q807-N811 VanDerWaalsContact O-CB 3.3Å; Q807-N811 WeakPolarHBondContact O-CB 3.47Å; Q807-N811 PolarHBondContact O-N 2.76Å; Q807-N811 PolarHBondContact O-ND2 3.17Å; N811-P813 VanDerWaalsContact O-CD 3.27Å; N811-P813 WeakPolarHBondContact O-CD 3.41Å
812	R	84.9	Confident	78.5	Confident	170 Å²	170	81.7 Å²	81.7	64%	0.642	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-61.4	119.6	-176.1	-171.8	174.2	-179	-178	1.6	111.4	V814 W856	R812-V814 PolarHBondContact O-N 3.11Å; R812-W856 HydrophobicContact CB-CZ2 3.97Å; R812-W856 HydrophobicContact CG-CH2 4.09Å; R812-W856 HydrophobicContact CG-CZ2 3.84Å
813	P	84.4	Confident	76.2	Confident	14 Å²	14	85 Å²	85	9%	0.091	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-64.1	124.1	-179.5	-25.6	37.4	0	0	0	111.8	N811 Y849 R852 W856	N811-P813 VanDerWaalsContact O-CD 3.27Å; N811-P813 WeakPolarHBondContact O-CD 3.41Å; P813-Y849 HydrophobicContact CB-CD2 4.31Å; P813-Y849 HydrophobicContact CB-CE2 4.05Å; P813-R852 HydrophobicContact CB-CG 4.28Å; P813-R852 HydrophobicContact CG-CB 4.4Å; P813-R852 HydrophobicContact CG-CG 3.87Å; P813-W856 VanDerWaalsContact CD-CG 3.44Å; P813-W856 HydrophobicContact CG-CB 3.8Å; P813-W856 HydrophobicContact CG-CG 4.12Å
814	V	83.7	Confident	74.3	Confident	129 Å²	129	88.1 Å²	88.1	78%	0.782	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-82.6	134.5	176.7	-177	0	0	0	0	109.3	R812	R812-V814 PolarHBondContact O-N 3.11Å
815	Q	82.3	Confident	72.1	Confident	91 Å²	91	94.9 Å²	94.9	43%	0.425	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-62.7	127.1	176.7	-170.8	176.3	24.4	0	0	109.9	S817 L819 T820 Y849	Q815-S817 PolarHBondContact O-N 2.9Å; Q815-L819 HydrophobicContact CG-CB 4.16Å; Q815-T820 HydrophobicContact CG-CG2 4.32Å; Q815-T820 VanDerWaalsContact OE1-CG2 3.27Å; Q815-Y849 HydrophobicContact CB-CE2 4.26Å; Q815-Y849 HydrophobicContact CG-CE1 4.4Å
816	P	75.6	Confident	70.1	Confident	38 Å²	38	95.7 Å²	95.7	25%	0.247	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-59.7	138.1	177.6	-20.9	29.9	0	0	0	111.1	S818 L819 Y849	P816-S818 PolarHBondContact O-N 2.95Å; P816-L819 HydrophobicContact CB-CD1 4.06Å; P816-L819 HydrophobicContact CG-CD1 3.97Å; P816-L819 WeakPolarHBondContact O-CB 3.48Å; P816-L819 PolarHBondContact O-N 3.25Å; P816-Y849 HydrophobicContact CG-CG 4.43Å
817	S	71.7	Confident	68.1	Low	99 Å²	99	98 Å²	98	69%	0.692	53%	0.525	S	S	*	.	H	α-helix	trans	-61.3	-17.6	-179.7	41.9	0	0	0	0	113.9	Q815 L819 T820	Q815-S817 PolarHBondContact O-N 2.9Å; S817-L819 PolarHBondContact O-N 2.71Å; S817-T820 WeakPolarHBondContact CA-OG1 3.44Å; S817-T820 PolarHBondContact O-OG1 3.44Å
818	S	65.3	Low	66.4	Low	55 Å²	55	103.1 Å²	103.1	39%	0.385	55%	0.548	S	S	.	.	H	α-helix	trans	-64.8	-20.9	171.2	53.6	0	0	0	0	113.7	P816	P816-S818 PolarHBondContact O-N 2.95Å
819	L	64	Low	64.6	Low	45 Å²	45	106.6 Å²	106.6	24%	0.236	57%	0.569	C	S	.	*	H	α-helix	trans	-100.9	-16.8	-177.7	-81.7	123.7	0	0	0	114.7	Q815 P816 S817 K846	Q815-L819 HydrophobicContact CG-CB 4.16Å; P816-L819 HydrophobicContact CB-CD1 4.06Å; P816-L819 HydrophobicContact CG-CD1 3.97Å; P816-L819 WeakPolarHBondContact O-CB 3.48Å; P816-L819 PolarHBondContact O-N 3.25Å; S817-L819 PolarHBondContact O-N 2.71Å; L819-K846 HydrophobicContact CD1-CB 4.1Å; L819-K846 HydrophobicContact CD2-CB 3.85Å; L819-K846 HydrophobicContact CD2-CD 3.82Å; L819-K846 HydrophobicContact CD2-CG 3.63Å
820	T	58.8	Low	63	Low	78 Å²	78	104.3 Å²	104.3	48%	0.479	56%	0.562	S	S	.	*	H	α-helix	trans	-92.1	-12.7	-176.9	37.5	0	0	0	0	114.3	Q815 S817 N822	Q815-T820 HydrophobicContact CG-CG2 4.32Å; Q815-T820 VanDerWaalsContact OE1-CG2 3.27Å; S817-T820 WeakPolarHBondContact CA-OG1 3.44Å; S817-T820 PolarHBondContact O-OG1 3.44Å; T820-N822 VanDerWaalsContact C-N 3.28Å; T820-N822 PolarHBondContact O-N 2.88Å
821	N	52.1	Low	61.3	Low	128 Å²	128	111 Å²	111	68%	0.684	58%	0.579	S	S	*	*			trans	-74.7	79.6	178.2	-100.8	-14	0	0	0	111.9	N823	N821-N823 PolarHBondContact O-N 2.96Å
822	N	45.8	Very low	60.1	Low	153 Å²	153	108.1 Å²	108.1	82%	0.818	57%	0.573	S	S	*	*			trans	-73.5	42.5	163.7	-94.5	-9.5	0	0	0	112.4	T820	T820-N822 VanDerWaalsContact C-N 3.28Å; T820-N822 PolarHBondContact O-N 2.88Å
823	N	42.9	Very low	58.6	Low	117 Å²	117	106 Å²	106	63%	0.626	58%	0.58	S	S	*	*	S	Bend	trans	-130.1	94.9	-178.9	-79.6	-26.7	0	0	0	110.9	N821 N825	N821-N823 PolarHBondContact O-N 2.96Å; N823-N825 PolarHBondContact O-N 3.43Å
824	N	49	Very low	57	Low	158 Å²	158	115.9 Å²	115.9	85%	0.845	62%	0.616	S	S	*	*	S	Bend	trans	35.8	5.6	137.3	-65.9	-17.7	0	0	0	122.7
825	N	48.7	Very low	56.1	Low	145 Å²	145	110.2 Å²	110.2	78%	0.775	58%	0.583	S	S	*	*			trans	-113.9	8.2	-176.1	-81.8	-17.2	0	0	0	113.9	N823	N823-N825 PolarHBondContact O-N 3.43Å
826	L	48.4	Very low	55.5	Low	97 Å²	97	111.4 Å²	111.4	51%	0.508	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.3	19.3	173.2	-143.2	81.2	0	0	0	113.4
827	M	47.8	Very low	55.5	Low	173 Å²	173	112.4 Å²	112.4	85%	0.852	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-17.5	169.4	-86.1	-161.4	89.2	0	0	113.6
828	H	49.4	Very low	55.5	Low	184 Å²	184	112.5 Å²	112.5	85%	0.852	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	2.8	-168.3	-136.1	-66.9	0	0	0	116.6
829	T	50.5	Low	55.9	Low	79 Å²	79	115.6 Å²	115.6	49%	0.485	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.8	19.3	176.3	55.7	0	0	0	0	113.7	Y831	T829-Y831 PolarHBondContact O-N 3.26Å
830	T	49.5	Very low	56.7	Low	47 Å²	47	118 Å²	118	29%	0.288	61%	0.609	S	S	.	*			trans	-78.1	-10.3	-170.6	-59.4	0	0	0	0	114.9	R839	T830-R839 PolarHBondContact OG1-NH2 3.29Å
831	Y	49.6	Very low	57.7	Low	232 Å²	232	116.8 Å²	116.8	91%	0.91	61%	0.607	S	S	*	*	S	Bend	trans	-120.8	78.2	-179	-65.2	-78.3	0	0	0	111.7	T829	T829-Y831 PolarHBondContact O-N 3.26Å
832	G	56.9	Low	59	Low	39 Å²	39	112.8 Å²	112.8	40%	0.402	59%	0.585	S	S	.	*	S	Bend	trans	177.6	155.8	170.3	0	0	0	0	0	112.3	R834 G835	G832-R834 PolarHBondContact O-N 2.77Å; G832-G835 PolarHBondContact O-N 3.34Å
833	P	55	Low	60.6	Low	124 Å²	124	111.8 Å²	111.8	81%	0.805	58%	0.575	S	S	*	*	H	α-helix	trans	-58.4	-23.4	-176.5	18.6	-29.4	0	0	0	114.1	A837	P833-A837 PolarHBondContact O-N 3.09Å
834	R	50.5	Low	62.6	Low	223 Å²	223	112.9 Å²	112.9	84%	0.842	58%	0.577	S	S	*	*	H	α-helix	trans	-69.5	-29.5	171.9	-73.1	-173.6	175.4	-173.3	-1.4	113.7	G832 Q838	G832-R834 PolarHBondContact O-N 2.77Å; R834-Q838 WeakPolarHBondContact O-CB 3.43Å; R834-Q838 PolarHBondContact O-N 2.7Å; R834-Q838 VanDerWaalsContact O-N 3.11Å
835	G	64.4	Low	64.2	Low	9 Å²	9	106.6 Å²	106.6	9%	0.093	55%	0.545	C	S	.	.	H	α-helix	trans	-74.4	-34.5	180	0	0	0	0	0	113.6	G832 R839	G832-G835 PolarHBondContact O-N 3.34Å; G835-R839 WeakPolarHBondContact O-CG 3.25Å; G835-R839 PolarHBondContact O-N 2.75Å; G835-R839 VanDerWaalsContact O-N 3.11Å
836	L	69.1	Low	66	Low	116 Å²	116	105 Å²	105	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-68.4	-45.8	173.4	-175.5	68.9	0	0	0	111.1	Q838 R839 L840	L836-Q838 VanDerWaalsContact C-N 3.3Å; L836-Q838 PolarHBondContact O-N 2.8Å; L836-R839 PolarHBondContact O-N 3.4Å; L836-L840 HydrophobicContact CD1-CD1 4.46Å; L836-L840 HydrophobicContact CD2-CD1 4.48Å; L836-L840 HydrophobicContact CG-CD1 3.95Å; L836-L840 PolarHBondContact O-N 2.87Å
837	A	76.3	Confident	67.9	Low	59 Å²	59	108 Å²	108	49%	0.488	54%	0.541	S	S	.	.	H	α-helix	trans	-59.9	-40.3	177.1	0	0	0	0	0	112.1	P833 L840 A841	P833-A837 PolarHBondContact O-N 3.09Å; A837-L840 PolarHBondContact O-N 2.7Å; A837-A841 WeakPolarHBondContact O-CB 3.25Å; A837-A841 PolarHBondContact O-N 2.73Å
838	Q	72.1	Confident	69.8	Low	102 Å²	102	106.1 Å²	106.1	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-68.5	-37	177	-168.4	172	9.4	0	0	112.5	R834 L836 A841 I842	R834-Q838 WeakPolarHBondContact O-CB 3.43Å; R834-Q838 PolarHBondContact O-N 2.7Å; R834-Q838 VanDerWaalsContact O-N 3.11Å; L836-Q838 VanDerWaalsContact C-N 3.3Å; L836-Q838 PolarHBondContact O-N 2.8Å; Q838-A841 PolarHBondContact O-N 2.92Å; Q838-I842 HydrophobicContact CG-CD1 4.33Å; Q838-I842 WeakPolarHBondContact O-CG1 3.49Å; Q838-I842 PolarHBondContact O-N 3.27Å
839	R	72.7	Confident	71.6	Confident	120 Å²	120	99.6 Å²	99.6	45%	0.453	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-44.6	173.4	-75.1	178.3	-177.7	-178.8	-0.4	112.3	T830 G835 L836 A841 I842 E843	T830-R839 PolarHBondContact OG1-NH2 3.29Å; G835-R839 WeakPolarHBondContact O-CG 3.25Å; G835-R839 PolarHBondContact O-N 2.75Å; G835-R839 VanDerWaalsContact O-N 3.11Å; L836-R839 PolarHBondContact O-N 3.4Å; R839-A841 VanDerWaalsContact C-N 3.33Å; R839-A841 PolarHBondContact O-N 3.25Å; R839-I842 PolarHBondContact O-N 3.12Å; R839-E843 WeakPolarHBondContact O-CB 3.25Å; R839-E843 PolarHBondContact O-N 3.35Å
840	L	80.2	Confident	73.6	Confident	94 Å²	94	99.7 Å²	99.7	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-43.6	174.4	-82.5	158.1	0	0	0	111.2	L836 A837 I842 E843 E844	L836-L840 HydrophobicContact CD1-CD1 4.46Å; L836-L840 HydrophobicContact CD2-CD1 4.48Å; L836-L840 HydrophobicContact CG-CD1 3.95Å; L836-L840 PolarHBondContact O-N 2.87Å; A837-L840 PolarHBondContact O-N 2.7Å; L840-I842 PolarHBondContact O-N 3.41Å; L840-E843 PolarHBondContact O-N 3.45Å; L840-E844 VanDerWaalsContact O-CB 3.24Å; L840-E844 WeakPolarHBondContact O-CB 3.38Å; L840-E844 PolarHBondContact O-N 2.88Å
841	A	80.2	Confident	75.5	Confident	53 Å²	53	99.6 Å²	99.6	44%	0.438	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-37.4	175.7	0	0	0	0	0	112.6	A837 Q838 R839 S845	A837-A841 WeakPolarHBondContact O-CB 3.25Å; A837-A841 PolarHBondContact O-N 2.73Å; Q838-A841 PolarHBondContact O-N 2.92Å; R839-A841 VanDerWaalsContact C-N 3.33Å; R839-A841 PolarHBondContact O-N 3.25Å; A841-S845 WeakPolarHBondContact O-CB 3.09Å; A841-S845 PolarHBondContact O-N 3Å; A841-S845 PolarHBondContact O-OG 3.32Å
842	I	79.2	Confident	77.4	Confident	44 Å²	44	96 Å²	96	23%	0.226	48%	0.483	C	S	.	.	H	α-helix	trans	-65.4	-45.5	173.6	-68.8	165	0	0	0	110.3	Q838 R839 L840 S845 K846	Q838-I842 HydrophobicContact CG-CD1 4.33Å; Q838-I842 WeakPolarHBondContact O-CG1 3.49Å; Q838-I842 PolarHBondContact O-N 3.27Å; R839-I842 PolarHBondContact O-N 3.12Å; L840-I842 PolarHBondContact O-N 3.41Å; I842-S845 WeakPolarHBondContact CA-OG 3.11Å; I842-S845 PolarHBondContact O-N 3.26Å; I842-S845 PolarHBondContact O-OG 3.18Å; I842-K846 WeakPolarHBondContact O-CB 3.45Å; I842-K846 PolarHBondContact O-N 3.02Å
843	E	80.6	Confident	78.9	Confident	133 Å²	133	95.2 Å²	95.2	62%	0.621	47%	0.47	S	S	*	.	H	α-helix	trans	-64.9	-42.9	179	-169.9	174.8	-175	0	0	112.1	R839 L840 K846 K847	R839-E843 WeakPolarHBondContact O-CB 3.25Å; R839-E843 PolarHBondContact O-N 3.35Å; L840-E843 PolarHBondContact O-N 3.45Å; E843-K846 WeakPolarHBondContact O-CB 3.23Å; E843-K846 PolarHBondContact O-N 2.91Å; E843-K847 WeakPolarHBondContact O-CB 3.14Å; E843-K847 PolarHBondContact O-N 3.46Å
844	E	84	Confident	80.5	Confident	139 Å²	139	96.1 Å²	96.1	65%	0.65	46%	0.464	S	S	*	.	H	α-helix	trans	-64.3	-44.9	174.3	-173	168.4	-155.2	0	0	110.9	L840 K846 K847 E848	L840-E844 VanDerWaalsContact O-CB 3.24Å; L840-E844 WeakPolarHBondContact O-CB 3.38Å; L840-E844 PolarHBondContact O-N 2.88Å; E844-K846 VanDerWaalsContact C-N 3.28Å; E844-K846 PolarHBondContact O-N 3.28Å; E844-K847 PolarHBondContact O-N 3.45Å; E844-K847 VanDerWaalsContact O-N 3.14Å; E844-E848 WeakPolarHBondContact O-CB 3.32Å; E844-E848 PolarHBondContact O-N 2.66Å
845	S	83.9	Confident	82.3	Confident	27 Å²	27	93.5 Å²	93.5	19%	0.189	45%	0.453	C	S	.	.	H	α-helix	trans	-62.7	-34.5	174.8	74.1	0	0	0	0	112.6	A841 I842 Y849	A841-S845 WeakPolarHBondContact O-CB 3.09Å; A841-S845 PolarHBondContact O-N 3Å; A841-S845 PolarHBondContact O-OG 3.32Å; I842-S845 WeakPolarHBondContact CA-OG 3.11Å; I842-S845 PolarHBondContact O-N 3.26Å; I842-S845 PolarHBondContact O-OG 3.18Å; S845-Y849 WeakPolarHBondContact O-CB 3.19Å; S845-Y849 PolarHBondContact O-N 3Å
846	K	85.5	Confident	83.5	Confident	111 Å²	111	94.8 Å²	94.8	48%	0.483	46%	0.456	S	S	.	.	H	α-helix	trans	-66.1	-45.7	173.5	-174.8	-178.7	180	-177.9	0	110.5	L819 I842 E843 E844 Y849 L850	L819-K846 HydrophobicContact CD1-CB 4.1Å; L819-K846 HydrophobicContact CD2-CB 3.85Å; L819-K846 HydrophobicContact CD2-CD 3.82Å; L819-K846 HydrophobicContact CD2-CG 3.63Å; I842-K846 WeakPolarHBondContact O-CB 3.45Å; I842-K846 PolarHBondContact O-N 3.02Å; E843-K846 WeakPolarHBondContact O-CB 3.23Å; E843-K846 PolarHBondContact O-N 2.91Å; E844-K846 VanDerWaalsContact C-N 3.28Å; E844-K846 PolarHBondContact O-N 3.28Å; K846-Y849 PolarHBondContact O-N 3.09Å; K846-L850 HydrophobicContact CG-CD1 4.19Å; K846-L850 WeakPolarHBondContact O-CB 3.36Å; K846-L850 VanDerWaalsContact O-CG 3.27Å; K846-L850 WeakPolarHBondContact O-CG 3.41Å; K846-L850 PolarHBondContact O-N 2.92Å
847	K	88.1	Confident	84.4	Confident	161 Å²	161	96.9 Å²	96.9	70%	0.7	46%	0.455	S	S	*	.	H	α-helix	trans	-64.5	-44	179	-175.7	177.9	176.9	-178.1	0	111.6	E843 E844 L850 A851	E843-K847 WeakPolarHBondContact O-CB 3.14Å; E843-K847 PolarHBondContact O-N 3.46Å; E844-K847 PolarHBondContact O-N 3.45Å; E844-K847 VanDerWaalsContact O-N 3.14Å; K847-L850 PolarHBondContact O-N 3.01Å; K847-A851 WeakPolarHBondContact O-CB 3.2Å; K847-A851 PolarHBondContact O-N 3.04Å
848	E	87.7	Confident	84.9	Confident	133 Å²	133	98.5 Å²	98.5	62%	0.621	45%	0.453	S	S	*	.	H	α-helix	trans	-64.2	-43.7	176.5	-170.7	-178.7	-178.8	0	0	111.4	E844 L850 A851 R852	E844-E848 WeakPolarHBondContact O-CB 3.32Å; E844-E848 PolarHBondContact O-N 2.66Å; E848-L850 PolarHBondContact O-N 3.09Å; E848-A851 PolarHBondContact O-N 2.9Å; E848-R852 WeakPolarHBondContact O-CB 3.45Å; E848-R852 PolarHBondContact O-N 2.91Å
849	Y	88.7	Confident	85.7	Confident	47 Å²	47	97.2 Å²	97.2	18%	0.184	45%	0.449	C	S	.	.	H	α-helix	trans	-58	-48.4	173.6	168.9	-106.4	0	0	0	111.8	P813 Q815 P816 S845 K846 R852 L853	P813-Y849 HydrophobicContact CB-CD2 4.31Å; P813-Y849 HydrophobicContact CB-CE2 4.05Å; Q815-Y849 HydrophobicContact CB-CE2 4.26Å; Q815-Y849 HydrophobicContact CG-CE1 4.4Å; P816-Y849 HydrophobicContact CG-CG 4.43Å; S845-Y849 WeakPolarHBondContact O-CB 3.19Å; S845-Y849 PolarHBondContact O-N 3Å; K846-Y849 PolarHBondContact O-N 3.09Å; Y849-R852 PolarHBondContact O-N 3.18Å; Y849-L853 HydrophobicContact CE1-CD2 4.33Å; Y849-L853 VanDerWaalsContact O-CB 3.31Å; Y849-L853 WeakPolarHBondContact O-CB 3.41Å; Y849-L853 PolarHBondContact O-N 2.6Å
850	L	90.7	Very high	86.4	Confident	80 Å²	80	91.9 Å²	91.9	42%	0.419	43%	0.43	S	S	.	.	H	α-helix	trans	-63.2	-43.2	178.6	-71.9	173.6	0	0	0	111.9	K846 K847 E848 R852 L853 E854	K846-L850 HydrophobicContact CG-CD1 4.19Å; K846-L850 WeakPolarHBondContact O-CB 3.36Å; K846-L850 VanDerWaalsContact O-CG 3.27Å; K846-L850 WeakPolarHBondContact O-CG 3.41Å; K846-L850 PolarHBondContact O-N 2.92Å; K847-L850 PolarHBondContact O-N 3.01Å; E848-L850 PolarHBondContact O-N 3.09Å; L850-R852 VanDerWaalsContact C-N 3.34Å; L850-R852 PolarHBondContact O-N 3.45Å; L850-L853 WeakPolarHBondContact O-CB 3.4Å; L850-L853 PolarHBondContact O-N 3.49Å; L850-E854 PolarHBondContact O-N 3.2Å
851	A	89.7	Confident	86.8	Confident	45 Å²	45	93 Å²	93	37%	0.372	43%	0.427	S	S	.	.	H	α-helix	trans	-63.2	-39.9	176.8	0	0	0	0	0	112.1	K847 E848 R855	K847-A851 WeakPolarHBondContact O-CB 3.2Å; K847-A851 PolarHBondContact O-N 3.04Å; E848-A851 PolarHBondContact O-N 2.9Å; A851-R855 PolarHBondContact O-N 3.38Å
852	R	89.6	Confident	87.2	Confident	157 Å²	157	94.3 Å²	94.3	59%	0.592	43%	0.427	S	S	*	.	H	α-helix	trans	-68.6	-36.5	175.1	-166.1	175.1	-178.2	155.4	0.1	111.7	P813 E848 Y849 L850 W856	P813-R852 HydrophobicContact CB-CG 4.28Å; P813-R852 HydrophobicContact CG-CB 4.4Å; P813-R852 HydrophobicContact CG-CG 3.87Å; E848-R852 WeakPolarHBondContact O-CB 3.45Å; E848-R852 PolarHBondContact O-N 2.91Å; Y849-R852 PolarHBondContact O-N 3.18Å; L850-R852 VanDerWaalsContact C-N 3.34Å; L850-R852 PolarHBondContact O-N 3.45Å; R852-W856 VanDerWaalsContact O-CB 3.29Å; R852-W856 WeakPolarHBondContact O-CB 3.43Å; R852-W856 PolarHBondContact O-N 2.89Å
853	L	88	Confident	87.7	Confident	23 Å²	23	95 Å²	95	12%	0.12	43%	0.431	C	S	.	.	H	α-helix	trans	-65.2	-43.3	175.1	-172.9	68.8	0	0	0	111.6	Y849 L850 W856 R857	Y849-L853 HydrophobicContact CE1-CD2 4.33Å; Y849-L853 VanDerWaalsContact O-CB 3.31Å; Y849-L853 WeakPolarHBondContact O-CB 3.41Å; Y849-L853 PolarHBondContact O-N 2.6Å; L850-L853 WeakPolarHBondContact O-CB 3.4Å; L850-L853 PolarHBondContact O-N 3.49Å; L853-W856 HydrophobicContact CD1-CE3 4.01Å; L853-W856 HydrophobicContact CD1-CZ3 4.35Å; L853-W856 PolarHBondContact O-N 3.06Å; L853-R857 WeakPolarHBondContact O-CB 3.32Å; L853-R857 VanDerWaalsContact O-CG 3.31Å; L853-R857 WeakPolarHBondContact O-CG 3.13Å; L853-R857 PolarHBondContact O-N 3.37Å
854	E	88.4	Confident	88.3	Confident	143 Å²	143	88.7 Å²	88.7	67%	0.668	40%	0.402	S	S	*	.	H	α-helix	trans	-62.8	-45.8	174.8	-77.9	-179.7	173.6	0	0	111.8	L850 R857 H858	L850-E854 PolarHBondContact O-N 3.2Å; E854-R857 PolarHBondContact O-N 3.43Å; E854-H858 PolarHBondContact O-N 2.9Å
855	R	89	Confident	88.6	Confident	167 Å²	167	85.8 Å²	85.8	63%	0.63	39%	0.388	S	S	*	.	H	α-helix	trans	-61.3	-47.4	176.7	-165.4	179.9	-67.5	134.6	-0.9	111.4	A851 R857 H858 D859	A851-R855 PolarHBondContact O-N 3.38Å; R855-R857 VanDerWaalsContact C-N 3.33Å; R855-R857 PolarHBondContact O-N 2.94Å; R855-H858 WeakPolarHBondContact O-CB 3.46Å; R855-H858 PolarHBondContact O-N 3.44Å; R855-H858 VanDerWaalsContact O-N 3.13Å; R855-D859 VanDerWaalsContact O-CG 3.26Å; R855-D859 PolarHBondContact O-N 3.44Å
856	W	90.2	Very high	89	Confident	37 Å²	37	87.1 Å²	87.1	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-59.8	-40.5	175.7	172.1	80.6	0	0	0	112.7	V808 R812 P813 R852 L853 H858 T860	V808-W856 HydrophobicContact CG1-CZ2 3.99Å; V808-W856 PolarHBondContact O-NE1 3.29Å; R812-W856 HydrophobicContact CB-CZ2 3.97Å; R812-W856 HydrophobicContact CG-CH2 4.09Å; R812-W856 HydrophobicContact CG-CZ2 3.84Å; P813-W856 VanDerWaalsContact CD-CG 3.44Å; P813-W856 HydrophobicContact CG-CB 3.8Å; P813-W856 HydrophobicContact CG-CG 4.12Å; R852-W856 VanDerWaalsContact O-CB 3.29Å; R852-W856 WeakPolarHBondContact O-CB 3.43Å; R852-W856 PolarHBondContact O-N 2.89Å; L853-W856 HydrophobicContact CD1-CE3 4.01Å; L853-W856 HydrophobicContact CD1-CZ3 4.35Å; L853-W856 PolarHBondContact O-N 3.06Å; W856-H858 VanDerWaalsContact C-N 3.33Å; W856-T860 PolarHBondContact NE1-OG1 2.84Å; W856-T860 WeakPolarHBondContact O-CB 3.46Å; W856-T860 PolarHBondContact O-N 3.47Å; W856-T860 PolarHBondContact O-OG1 2.96Å
857	R	86.7	Confident	89.4	Confident	159 Å²	159	82 Å²	82	60%	0.6	38%	0.379	S	S	*	.	H	α-helix	trans	-62.8	-40.7	175.1	-76.9	-178.8	-166.9	-138.9	5.7	111.7	L853 E854 R855 R861	L853-R857 WeakPolarHBondContact O-CB 3.32Å; L853-R857 VanDerWaalsContact O-CG 3.31Å; L853-R857 WeakPolarHBondContact O-CG 3.13Å; L853-R857 PolarHBondContact O-N 3.37Å; E854-R857 PolarHBondContact O-N 3.43Å; R855-R857 VanDerWaalsContact C-N 3.33Å; R855-R857 PolarHBondContact O-N 2.94Å; R857-R861 WeakPolarHBondContact O-CB 3.47Å; R857-R861 PolarHBondContact O-N 3.06Å
858	H	88.4	Confident	89.7	Confident	93 Å²	93	74.5 Å²	74.5	43%	0.431	35%	0.347	S	S	.	.	H	α-helix	trans	-65	-51.1	177.7	-177.8	72.3	0	0	0	111.8	E854 R855 W856 T860 R861 L862	E854-H858 PolarHBondContact O-N 2.9Å; R855-H858 WeakPolarHBondContact O-CB 3.46Å; R855-H858 PolarHBondContact O-N 3.44Å; R855-H858 VanDerWaalsContact O-N 3.13Å; W856-H858 VanDerWaalsContact C-N 3.33Å; H858-T860 PolarHBondContact O-N 2.82Å; H858-R861 WeakPolarHBondContact O-CB 3.49Å; H858-R861 PolarHBondContact O-N 2.98Å; H858-R861 VanDerWaalsContact O-N 3.1Å; H858-L862 PolarHBondContact O-N 3.27Å; H858-L862 VanDerWaalsContact O-N 3.12Å
859	D	88.6	Confident	90	Very high	75 Å²	75	75 Å²	75	40%	0.401	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-47.4	179	-61	-18.6	0	0	0	110.2	R855 R861 L862 D863	R855-D859 VanDerWaalsContact O-CG 3.26Å; R855-D859 PolarHBondContact O-N 3.44Å; D859-R861 PolarHBondContact O-N 2.93Å; D859-L862 PolarHBondContact O-N 3.26Å; D859-D863 PolarHBondContact O-N 3.2Å
860	T	88	Confident	90.2	Very high	8 Å²	8	76.7 Å²	76.7	5%	0.049	36%	0.357	C	S	.	.	H	α-helix	trans	-54.7	-41.5	174.8	-63	0	0	0	0	111.1	V808 W856 H858 D863 T864	V808-T860 HydrophobicContact CG1-CG2 4.37Å; V808-T860 HydrophobicContact CG2-CG2 3.68Å; W856-T860 PolarHBondContact NE1-OG1 2.84Å; W856-T860 WeakPolarHBondContact O-CB 3.46Å; W856-T860 PolarHBondContact O-N 3.47Å; W856-T860 PolarHBondContact O-OG1 2.96Å; H858-T860 PolarHBondContact O-N 2.82Å; T860-D863 PolarHBondContact O-N 3.25Å; T860-T864 WeakPolarHBondContact O-CB 3.34Å; T860-T864 PolarHBondContact O-N 2.95Å; T860-T864 PolarHBondContact O-OG1 3.42Å
861	R	87.5	Confident	90.3	Very high	117 Å²	117	72.9 Å²	72.9	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-42.7	179.2	-168.9	-178.9	70.7	166.9	5.4	111.7	R857 H858 D859 T864 E865 L991	R857-R861 WeakPolarHBondContact O-CB 3.47Å; R857-R861 PolarHBondContact O-N 3.06Å; H858-R861 WeakPolarHBondContact O-CB 3.49Å; H858-R861 PolarHBondContact O-N 2.98Å; H858-R861 VanDerWaalsContact O-N 3.1Å; D859-R861 PolarHBondContact O-N 2.93Å; R861-T864 WeakPolarHBondContact O-CB 3.36Å; R861-T864 PolarHBondContact O-N 3.28Å; R861-E865 WeakPolarHBondContact O-CG 3.33Å; R861-E865 PolarHBondContact O-N 3.43Å; R861-L991 HydrophobicContact CG-CD1 4.45Å; R861-L991 HydrophobicContact CG-CD2 4.48Å
862	L	89.3	Confident	90.5	Very high	81 Å²	81	72.9 Å²	72.9	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-46.7	177.1	-66.9	175	0	0	0	111.4	H858 D859 T864 E865 A866	H858-L862 PolarHBondContact O-N 3.27Å; H858-L862 VanDerWaalsContact O-N 3.12Å; D859-L862 PolarHBondContact O-N 3.26Å; L862-T864 VanDerWaalsContact C-N 3.26Å; L862-T864 PolarHBondContact O-N 3.25Å; L862-E865 PolarHBondContact O-N 3.41Å; L862-E865 VanDerWaalsContact O-N 3.14Å; L862-A866 PolarHBondContact O-N 3.43Å
863	D	90.1	Very high	90.7	Very high	60 Å²	60	66.9 Å²	66.9	32%	0.321	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-36.5	178	-61.9	-27.2	0	0	0	111.1	Q807 D859 T860 A866 A867	Q807-D863 PolarHBondContact OE1-OD2 3.48Å; D859-D863 PolarHBondContact O-N 3.2Å; T860-D863 PolarHBondContact O-N 3.25Å; D863-A866 PolarHBondContact O-N 3.21Å; D863-A867 WeakPolarHBondContact O-CB 3.47Å; D863-A867 PolarHBondContact O-N 3.08Å
864	T	92.4	Very high	91	Very high	0 Å²	0	66 Å²	66	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-43.4	174.4	-61	0	0	0	0	110.7	W804 T860 R861 L862 A868 L985 Y986 A989 L991	W804-T864 PolarHBondContact NE1-OG1 3.02Å; T860-T864 WeakPolarHBondContact O-CB 3.34Å; T860-T864 PolarHBondContact O-N 2.95Å; T860-T864 PolarHBondContact O-OG1 3.42Å; R861-T864 WeakPolarHBondContact O-CB 3.36Å; R861-T864 PolarHBondContact O-N 3.28Å; L862-T864 VanDerWaalsContact C-N 3.26Å; L862-T864 PolarHBondContact O-N 3.25Å; T864-A868 WeakPolarHBondContact O-CB 3.19Å; T864-A868 PolarHBondContact O-N 2.96Å; T864-L985 HydrophobicContact CG2-CD2 3.23Å; T864-L985 HydrophobicContact CG2-CG 3.89Å; T864-Y986 HydrophobicContact CG2-CD1 4.25Å; T864-A989 HydrophobicContact CG2-CB 3.6Å; T864-A989 WeakPolarHBondContact OG1-CB 3.19Å; T864-L991 HydrophobicContact CG2-CD1 3.9Å
865	E	91.2	Very high	91.2	Very high	78 Å²	78	59.4 Å²	59.4	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-43.1	178.1	-73.3	-178.3	155.3	0	0	111.8	R861 L862 A868 E869 K994	R861-E865 WeakPolarHBondContact O-CG 3.33Å; R861-E865 PolarHBondContact O-N 3.43Å; L862-E865 PolarHBondContact O-N 3.41Å; L862-E865 VanDerWaalsContact O-N 3.14Å; E865-A868 PolarHBondContact O-N 3.35Å; E865-E869 WeakPolarHBondContact O-CB 3.43Å; E865-E869 PolarHBondContact O-N 2.99Å; E865-K994 IonicContact OE1-NZ 2.87Å; E865-K994 PolarHBondContact OE1-NZ 3.16Å
866	A	92.1	Very high	91.3	Very high	55 Å²	55	54.2 Å²	54.2	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-42.7	176.7	0	0	0	0	0	112.8	L862 D863	L862-A866 PolarHBondContact O-N 3.43Å; D863-A866 PolarHBondContact O-N 3.21Å
867	A	93.1	Very high	91.4	Very high	4 Å²	4	53.7 Å²	53.7	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-70.7	-38.3	176.5	0	0	0	0	0	112.2	W804 D863 K870 L871 L985	W804-A867 HydrophobicContact CB-CB 3.86Å; W804-A867 HydrophobicContact CG-CB 4.14Å; D863-A867 WeakPolarHBondContact O-CB 3.47Å; D863-A867 PolarHBondContact O-N 3.08Å; A867-K870 PolarHBondContact O-N 3.18Å; A867-L871 WeakPolarHBondContact O-CG 3.28Å; A867-L871 PolarHBondContact O-N 3.48Å; A867-L985 HydrophobicContact CB-CD1 3.73Å
868	A	93.3	Very high	91.5	Very high	2 Å²	2	50.3 Å²	50.3	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-39.6	175.1	0	0	0	0	0	112.1	T864 E865 K870 L871 L872 L985 Y986	T864-A868 WeakPolarHBondContact O-CB 3.19Å; T864-A868 PolarHBondContact O-N 2.96Å; E865-A868 PolarHBondContact O-N 3.35Å; A868-K870 VanDerWaalsContact C-N 3.33Å; A868-K870 PolarHBondContact O-N 3.31Å; A868-L871 PolarHBondContact O-N 2.89Å; A868-L872 VanDerWaalsContact O-CB 3.26Å; A868-L872 WeakPolarHBondContact O-CB 3.27Å; A868-L872 VanDerWaalsContact O-CG 3.27Å; A868-L872 WeakPolarHBondContact O-CG 3.46Å; A868-L872 PolarHBondContact O-N 3.5Å; A868-L985 HydrophobicContact CB-CD2 3.83Å; A868-Y986 HydrophobicContact CB-CE1 3.75Å
869	E	94.3	Very high	91.2	Very high	143 Å²	143	52 Å²	52	67%	0.668	27%	0.271	S	S	*	.	H	α-helix	trans	-55.3	-47.9	178.1	-175.3	-179.1	175.8	0	0	111.3	E865 L872 A873	E865-E869 WeakPolarHBondContact O-CB 3.43Å; E865-E869 PolarHBondContact O-N 2.99Å; E869-L872 PolarHBondContact O-N 3.25Å; E869-A873 WeakPolarHBondContact O-CB 3.31Å; E869-A873 PolarHBondContact O-N 3.03Å
870	K	92.8	Very high	91.2	Very high	83 Å²	83	50 Å²	50	36%	0.361	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-38.5	178.1	-67	-162.1	-179.7	-165.6	0	113.5	E796 A800 A867 A868	E796-K870 IonicContact OE2-NZ 2.98Å; A800-K870 HydrophobicContact CB-CD 3.77Å; A867-K870 PolarHBondContact O-N 3.18Å; A868-K870 VanDerWaalsContact C-N 3.33Å; A868-K870 PolarHBondContact O-N 3.31Å
871	L	93.9	Very high	91.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-70.4	-39.7	177.3	-67.5	165.3	0	0	0	111.5	F801 A867 A868 A873 L874 T978 I982 L985	F801-L871 HydrophobicContact CB-CD1 4.31Å; F801-L871 HydrophobicContact CD2-CD1 3.99Å; A867-L871 WeakPolarHBondContact O-CG 3.28Å; A867-L871 PolarHBondContact O-N 3.48Å; A868-L871 PolarHBondContact O-N 2.89Å; L871-A873 VanDerWaalsContact C-N 3.31Å; L871-A873 PolarHBondContact O-N 2.78Å; L871-L874 WeakPolarHBondContact O-CB 3.41Å; L871-L874 PolarHBondContact O-N 3.13Å; L871-T978 HydrophobicContact CB-CG2 4.05Å; L871-T978 HydrophobicContact CD2-CG2 3.83Å; L871-I982 HydrophobicContact CB-CD1 3.79Å; L871-I982 HydrophobicContact CB-CG1 3.52Å; L871-I982 HydrophobicContact CD1-CG1 3.88Å; L871-I982 HydrophobicContact CG-CG1 4.29Å; L871-L985 HydrophobicContact CD1-CD1 4.13Å
872	L	94.2	Very high	91.6	Very high	45 Å²	45	44.8 Å²	44.8	24%	0.236	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-34.4	176.6	-76.5	170.6	0	0	0	111.6	A868 E869 L874 L875 T876 I982 L998 L1001	A868-L872 VanDerWaalsContact O-CB 3.26Å; A868-L872 WeakPolarHBondContact O-CB 3.27Å; A868-L872 VanDerWaalsContact O-CG 3.27Å; A868-L872 WeakPolarHBondContact O-CG 3.46Å; A868-L872 PolarHBondContact O-N 3.5Å; E869-L872 PolarHBondContact O-N 3.25Å; L872-L874 PolarHBondContact O-N 3.07Å; L872-L874 VanDerWaalsContact O-N 3.13Å; L872-L875 HydrophobicContact CD2-CD1 4.33Å; L872-L875 WeakPolarHBondContact O-CA 3.27Å; L872-L875 WeakPolarHBondContact O-CB 3.45Å; L872-L875 PolarHBondContact O-N 3.4Å; L872-T876 PolarHBondContact O-N 2.97Å; L872-T876 PolarHBondContact O-OG1 3.41Å; L872-T876 VanDerWaalsContact O-OG1 3.05Å; L872-I982 HydrophobicContact CD2-CD1 4.06Å; L872-I982 HydrophobicContact CG-CD1 4.3Å; L872-L998 HydrophobicContact CD2-CD1 4.11Å; L872-L1001 HydrophobicContact CD2-CD2 3.98Å
873	A	94.1	Very high	91.7	Very high	32 Å²	32	41 Å²	41	26%	0.264	23%	0.226	S	C	.	.	H	α-helix	trans	-57.4	-26.4	176.2	0	0	0	0	0	113.5	L793 E869 L871 Y877	L793-A873 HydrophobicContact CD1-CB 4.22Å; L793-A873 HydrophobicContact CD2-CB 4.2Å; E869-A873 WeakPolarHBondContact O-CB 3.31Å; E869-A873 PolarHBondContact O-N 3.03Å; L871-A873 VanDerWaalsContact C-N 3.31Å; L871-A873 PolarHBondContact O-N 2.78Å; A873-Y877 PolarHBondContact O-N 2.91Å
874	L	93.7	Very high	91.8	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-70.7	-37.8	171.4	-65.5	168.5	0	0	0	112.2	L793 Y794 S797 L871 L872 W882 T978	L793-L874 HydrophobicContact CB-CD2 4.29Å; L793-L874 HydrophobicContact CD2-CD2 3.88Å; L793-L874 HydrophobicContact CD2-CG 4.43Å; L793-L874 HydrophobicContact CG-CD2 3.76Å; L793-L874 HydrophobicContact CG-CG 4.31Å; Y794-L874 HydrophobicContact CD2-CD1 3.86Å; S797-L874 VanDerWaalsContact OG-CD1 3.26Å; S797-L874 WeakPolarHBondContact OG-CD1 3.23Å; L871-L874 WeakPolarHBondContact O-CB 3.41Å; L871-L874 PolarHBondContact O-N 3.13Å; L872-L874 PolarHBondContact O-N 3.07Å; L872-L874 VanDerWaalsContact O-N 3.13Å; L874-W882 HydrophobicContact CD2-CD2 4.39Å; L874-W882 HydrophobicContact CD2-CG 4.23Å; L874-W882 HydrophobicContact CD2-CZ2 4.49Å; L874-W882 WeakPolarHBondContact O-CB 3.42Å; L874-T978 HydrophobicContact CD1-CG2 3.76Å
875	L	92.1	Very high	91.7	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-77.7	-34.2	-178.1	-55.7	-172.1	0	0	0	112	L872 I975 V979 I982 L998 L1001 Y1007 L1009	L872-L875 HydrophobicContact CD2-CD1 4.33Å; L872-L875 WeakPolarHBondContact O-CA 3.27Å; L872-L875 WeakPolarHBondContact O-CB 3.45Å; L872-L875 PolarHBondContact O-N 3.4Å; L875-I975 HydrophobicContact CD2-CG2 3.77Å; L875-V979 HydrophobicContact CD1-CG2 3.82Å; L875-V979 HydrophobicContact CD2-CG2 3.89Å; L875-I982 HydrophobicContact CD1-CD1 3.63Å; L875-I982 HydrophobicContact CG-CD1 4.34Å; L875-L998 HydrophobicContact CD1-CD1 3.81Å; L875-L1001 HydrophobicContact CB-CD2 4.03Å; L875-L1001 HydrophobicContact CD1-CD2 4.21Å; L875-Y1007 WeakPolarHBondContact O-CD1 3.43Å; L875-L1009 HydrophobicContact CB-CD1 3.93Å; L875-L1009 HydrophobicContact CD2-CD1 4.29Å
876	T	91.5	Very high	91.5	Very high	59 Å²	59	39.9 Å²	39.9	36%	0.362	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	19.6	-179.9	58.9	0	0	0	0	112.9	L872 L1001	L872-T876 PolarHBondContact O-N 2.97Å; L872-T876 PolarHBondContact O-OG1 3.41Å; L872-T876 VanDerWaalsContact O-OG1 3.05Å; T876-L1001 HydrophobicContact CG2-CD1 4Å; T876-L1001 HydrophobicContact CG2-CD2 4.02Å
877	Y	92	Very high	90.6	Very high	26 Å²	26	43 Å²	43	10%	0.102	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-59.6	136.7	-178.4	-158.7	-94.6	0	0	0	110.7	C790 L793 A873 W882	C790-Y877 VanDerWaalsContact SG-CE1 3.55Å; C790-Y877 VanDerWaalsContact SG-CZ 3.53Å; L793-Y877 HydrophobicContact CD2-CD2 3.73Å; L793-Y877 HydrophobicContact CD2-CE2 3.84Å; A873-Y877 PolarHBondContact O-N 2.91Å; Y877-W882 HydrophobicContact CG-CB 4.27Å
878	P	88.6	Confident	89	Confident	88 Å²	88	47.3 Å²	47.3	57%	0.571	25%	0.248	S	C	*	.	S	Bend	trans	-54.2	147.9	-174.2	-27.6	34.1	0	0	0	113.6	R786 G881	R786-P878 PolarHBondContact NH2-O 3.41Å; P878-G881 PolarHBondContact O-N 3.48Å
879	H	81.7	Confident	86.9	Confident	127 Å²	127	54.8 Å²	54.8	59%	0.588	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	135	177.7	-172.7	81.3	0	0	0	111.8
880	P	89.2	Confident	84.5	Confident	35 Å²	35	52.6 Å²	52.6	23%	0.227	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	cis	-84.7	16.3	9	33.3	-36	0	0	0	116.2	V884 D885	P880-V884 HydrophobicContact CB-CB 4.24Å; P880-V884 HydrophobicContact CB-CG1 3.81Å; P880-V884 HydrophobicContact CG-CB 3.94Å; P880-V884 HydrophobicContact CG-CG1 3.7Å; P880-D885 WeakPolarHBondContact CG-O 3.09Å
881	G	89.2	Confident	82.2	Confident	11 Å²	11	54 Å²	54	11%	0.113	28%	0.28	C	S	.	.			trans	103.4	176.9	178.4	0	0	0	0	0	113.6	R786 P878 L883	R786-G881 PolarHBondContact NH2-O 3.1Å; P878-G881 PolarHBondContact O-N 3.48Å; G881-L883 PolarHBondContact O-N 3.29Å
882	W	94.1	Very high	79.8	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.015	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	131	-175.8	-174.9	81.8	0	0	0	111.8	C790 Y794 L874 Y877 V884 R971 C974 I975	C790-W882 HydrophobicContact CB-CG 4.48Å; C790-W882 PolarHBondContact O-NE1 3.45Å; Y794-W882 HydrophobicContact CD2-CZ2 4.43Å; Y794-W882 HydrophobicContact CG-CZ2 4.17Å; L874-W882 HydrophobicContact CD2-CD2 4.39Å; L874-W882 HydrophobicContact CD2-CG 4.23Å; L874-W882 HydrophobicContact CD2-CZ2 4.49Å; L874-W882 WeakPolarHBondContact O-CB 3.42Å; Y877-W882 HydrophobicContact CG-CB 4.27Å; W882-V884 VanDerWaalsContact C-N 3.33Å; W882-V884 PolarHBondContact O-N 3.28Å; W882-R971 HydrophobicContact CE3-CB 4.43Å; W882-R971 HydrophobicContact CE3-CG 4.34Å; W882-R971 HydrophobicContact CZ3-CB 4.41Å; W882-R971 WeakPolarHBondContact O-CD 3.42Å; W882-R971 PolarHBondContact O-NE 2.99Å; W882-C974 HydrophobicContact CH2-CB 3.94Å; W882-C974 HydrophobicContact CZ3-CB 4.01Å; W882-I975 HydrophobicContact CB-CD1 4.41Å; W882-I975 HydrophobicContact CE3-CD1 4.13Å; W882-I975 HydrophobicContact CE3-CG1 4.04Å
883	L	93	Very high	77.3	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.01	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	42.4	179.4	-152.1	69.4	0	0	0	113.5	E787 C790 L791 G881 M967 L970	E787-L883 HydrophobicContact CG-CD1 3.95Å; C790-L883 HydrophobicContact CB-CD1 4.05Å; C790-L883 PolarHBondContact SG-N 2.84Å; L791-L883 HydrophobicContact CD2-CD1 3.94Å; L791-L883 HydrophobicContact CG-CD1 4.16Å; G881-L883 PolarHBondContact O-N 3.29Å; L883-M967 HydrophobicContact CD1-CE 4.44Å; L883-M967 HydrophobicContact CD1-CG 4.26Å; L883-M967 HydrophobicContact CD2-CB 4.01Å; L883-M967 HydrophobicContact CD2-CG 4.17Å; L883-M967 WeakPolarHBondContact CD2-O 3.42Å; L883-M967 HydrophobicContact CG-CB 3.92Å; L883-M967 HydrophobicContact CG-CE 4.06Å; L883-M967 HydrophobicContact CG-CG 3.88Å; L883-M967 WeakPolarHBondContact O-CE 3.48Å; L883-L970 HydrophobicContact CD2-CB 3.68Å; L883-L970 HydrophobicContact CD2-CD1 4.31Å
884	V	91.2	Very high	74.9	Confident	40 Å²	40	68 Å²	68	24%	0.242	34%	0.339	C	S	.	.			trans	-126	131.5	173.8	-174.2	0	0	0	0	109.5	R786 P880 W882	R786-V884 PolarHBondContact NE-O 2.87Å; P880-V884 HydrophobicContact CB-CB 4.24Å; P880-V884 HydrophobicContact CB-CG1 3.81Å; P880-V884 HydrophobicContact CG-CB 3.94Å; P880-V884 HydrophobicContact CG-CG1 3.7Å; W882-V884 VanDerWaalsContact C-N 3.33Å; W882-V884 PolarHBondContact O-N 3.28Å
885	D	90.1	Very high	72.5	Confident	32 Å²	32	74.4 Å²	74.4	17%	0.171	37%	0.369	C	S	.	.			trans	-70.3	150	178	-73.5	-15	0	0	0	111.6	N783 P880 R963	N783-D885 HydrophobicContact CB-CB 4.44Å; N783-D885 WeakPolarHBondContact OD1-CA 3.34Å; P880-D885 WeakPolarHBondContact CG-O 3.09Å; D885-R963 IonicContact OD1-CZ 2.61Å; D885-R963 IonicContact OD1-NH1 2.85Å; D885-R963 PolarHBondContact OD1-NH1 3.39Å; D885-R963 IonicContact OD1-NH2 3.72Å; D885-R963 PolarHBondContact OD1-NH2 3.2Å; D885-R963 IonicContact OD2-CZ 3.56Å; D885-R963 IonicContact OD2-NH1 3.24Å; D885-R963 PolarHBondContact OD2-NH1 3.47Å; D885-R963 IonicContact OD2-NH2 3.71Å
886	I	87.2	Confident	70.3	Confident	42 Å²	42	80.8 Å²	80.8	22%	0.215	40%	0.398	C	S	.	.			trans	-88.4	120.7	173.4	-57.7	173	0	0	0	108.3	V782 N783	V782-I886 HydrophobicContact CG1-CD1 4.31Å; N783-I886 PolarHBondContact ND2-O 3.49Å; N783-I886 PolarHBondContact OD1-N 2.77Å
887	E	74.1	Confident	68.1	Low	120 Å²	120	85.3 Å²	85.3	56%	0.561	42%	0.415	S	S	*	.			trans	-91.5	111.8	170.5	-66.6	-179.4	170.1	0	0	109.4	Q889 Q890	E887-Q889 PolarHBondContact O-N 2.94Å; E887-Q890 PolarHBondContact O-N 3.4Å; E887-Q890 VanDerWaalsContact O-N 3.12Å
888	Q	59.2	Low	65.9	Low	95 Å²	95	91 Å²	91	44%	0.444	45%	0.447	S	S	.	.	H	α-helix	trans	-56.7	-21.5	-177.4	-82.2	-172	9.5	0	0	114.2	S777 D779 Q890 Q891	S777-Q888 PolarHBondContact O-NE2 3.46Å; D779-Q888 WeakPolarHBondContact OD1-CG 3.08Å; D779-Q888 PolarHBondContact OD1-NE2 3.1Å; Q888-Q890 PolarHBondContact O-N 3.01Å; Q888-Q891 PolarHBondContact O-N 2.98Å
889	Q	49.5	Very low	63.7	Low	158 Å²	158	93.8 Å²	93.8	74%	0.738	46%	0.457	S	S	*	.	H	α-helix	trans	-64.1	-23.8	178.3	-68.9	-174.2	3.1	0	0	113.7	E887	E887-Q889 PolarHBondContact O-N 2.94Å
890	Q	43.8	Very low	61.5	Low	97 Å²	97	93.6 Å²	93.6	45%	0.453	46%	0.458	S	S	.	.	H	α-helix	trans	-83.5	-27	-179.5	-70.9	-176.6	19.1	0	0	113.7	E887 Q888 Q893 Q894	E887-Q890 PolarHBondContact O-N 3.4Å; E887-Q890 VanDerWaalsContact O-N 3.12Å; Q888-Q890 PolarHBondContact O-N 3.01Å; Q890-Q893 PolarHBondContact O-N 3.49Å; Q890-Q894 PolarHBondContact O-N 3.46Å
891	Q	44.2	Very low	59.2	Low	112 Å²	112	97.8 Å²	97.8	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-72.5	-34.5	179.8	-79.1	-176.1	3.4	0	0	112.9	Q888 Q893 Q894 Q895	Q888-Q891 PolarHBondContact O-N 2.98Å; Q891-Q893 VanDerWaalsContact C-N 3.33Å; Q891-Q893 PolarHBondContact O-N 2.96Å; Q891-Q894 PolarHBondContact O-N 3.24Å; Q891-Q895 PolarHBondContact O-N 2.99Å
892	Q	43.5	Very low	57	Low	136 Å²	136	102.2 Å²	102.2	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-67.8	-32.6	173.5	-73.1	-175.7	10.7	0	0	112.4	Q896	Q892-Q896 WeakPolarHBondContact O-CB 3.44Å; Q892-Q896 WeakPolarHBondContact O-CG 3.49Å; Q892-Q896 PolarHBondContact O-N 3.27Å; Q892-Q896 VanDerWaalsContact O-N 3.11Å
893	Q	41.3	Very low	54.7	Low	125 Å²	125	109 Å²	109	58%	0.584	54%	0.542	S	S	*	.	H	α-helix	trans	-74.2	-36.1	175.1	-71.2	-176.6	15.3	0	0	112.7	Q890 Q891 Q896 Q897	Q890-Q893 PolarHBondContact O-N 3.49Å; Q891-Q893 VanDerWaalsContact C-N 3.33Å; Q891-Q893 PolarHBondContact O-N 2.96Å; Q893-Q896 PolarHBondContact O-N 3.09Å; Q893-Q897 PolarHBondContact O-N 3.35Å; Q893-Q897 VanDerWaalsContact O-N 3.11Å
894	Q	43.4	Very low	52.3	Low	110 Å²	110	114 Å²	114	51%	0.514	57%	0.569	S	S	.	*	H	α-helix	trans	-70.4	-36.6	174.4	-86.5	-179.1	6.6	0	0	112.9	Q890 Q891 Q897 L898	Q890-Q894 PolarHBondContact O-N 3.46Å; Q891-Q894 PolarHBondContact O-N 3.24Å; Q894-Q897 PolarHBondContact O-N 3.37Å; Q894-L898 PolarHBondContact O-N 2.82Å
895	Q	43.4	Very low	49.8	Very low	140 Å²	140	123.2 Å²	123.2	65%	0.654	60%	0.599	S	S	*	*	H	α-helix	trans	-70.9	-30.4	173.5	-87.4	176.4	2.9	0	0	113.2	Q891	Q891-Q895 PolarHBondContact O-N 2.99Å
896	Q	46.5	Very low	47.1	Very low	137 Å²	137	129.5 Å²	129.5	64%	0.64	63%	0.632	S	S	*	*	H	α-helix	trans	-72	-29	172	-77	177	14.9	0	0	112.9	Q892 Q893	Q892-Q896 WeakPolarHBondContact O-CB 3.44Å; Q892-Q896 WeakPolarHBondContact O-CG 3.49Å; Q892-Q896 PolarHBondContact O-N 3.27Å; Q892-Q896 VanDerWaalsContact O-N 3.11Å; Q893-Q896 PolarHBondContact O-N 3.09Å
897	Q	45	Very low	44.4	Very low	154 Å²	154	133.4 Å²	133.4	72%	0.72	66%	0.658	S	S	*	*	H	α-helix	trans	-75	-22.6	174.9	-79.9	-179.5	8.6	0	0	114.2	Q893 Q894	Q893-Q897 PolarHBondContact O-N 3.35Å; Q893-Q897 VanDerWaalsContact O-N 3.11Å; Q894-Q897 PolarHBondContact O-N 3.37Å
898	L	46.6	Very low	42.2	Very low	145 Å²	145	133.3 Å²	133.3	76%	0.759	67%	0.67	S	S	*	*	H	α-helix	trans	-82.1	-12.9	177.1	-81.2	156.9	0	0	0	113.8	Q894	Q894-L898 PolarHBondContact O-N 2.82Å
899	N	42.7	Very low	40.6	Very low	148 Å²	148	135.2 Å²	135.2	79%	0.791	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	14.7	-179.4	-84.2	-14.9	0	0	0	114.6
900	M	35.2	Very low	39.6	Very low	123 Å²	123	134 Å²	134	61%	0.606	69%	0.692	S	S	*	*	S	Bend	trans	-103.2	129.8	177.8	-71.2	-70.1	-77.1	0	0	111.6
901	D	39.7	Very low	39	Very low	123 Å²	123	138.8 Å²	138.8	66%	0.658	71%	0.711	S	S	*	*			trans	-55.7	146.7	-179.9	-122.3	-27.7	0	0	0	111.8	N903	D901-N903 PolarHBondContact O-N 3.46Å
902	P	44.1	Very low	38.2	Very low	103 Å²	103	139.6 Å²	139.6	67%	0.669	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-6	-176.1	-19.6	31.4	0	0	0	115.6
903	N	45.8	Very low	37.3	Very low	147 Å²	147	140.4 Å²	140.4	79%	0.786	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-7.5	-173.1	-83.1	-23.5	0	0	0	115.7	D901	D901-N903 PolarHBondContact O-N 3.46Å
904	D	43	Very low	36.7	Very low	108 Å²	108	143.6 Å²	143.6	58%	0.578	75%	0.747	S	S	*	*			trans	-92.8	7.4	179.6	-83	-20.5	0	0	0	114.6	L906	D904-L906 PolarHBondContact O-N 2.79Å; D904-L906 VanDerWaalsContact O-N 3.1Å
905	R	37.9	Very low	35.8	Very low	232 Å²	232	145.6 Å²	145.6	88%	0.875	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	9.8	-178.2	-76.2	-168.7	-172.8	-144.8	1.3	116
906	L	34.1	Very low	35	Very low	165 Å²	165	148.2 Å²	148.2	86%	0.864	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	9.1	-173.4	-96.2	142.3	0	0	0	116.5	D904	D904-L906 PolarHBondContact O-N 2.79Å; D904-L906 VanDerWaalsContact O-N 3.1Å
907	T	29.9	Very low	33.9	Very low	123 Å²	123	146.7 Å²	146.7	76%	0.755	78%	0.778	S	S	*	*	S	Bend	trans	-139	66.3	176.4	53.2	0	0	0	0	113.8
908	S	27.3	Very low	32.9	Very low	119 Å²	119	146.6 Å²	146.6	83%	0.832	78%	0.779	S	S	*	*			trans	-164.8	62	154	65.1	0	0	0	0	112.4
909	T	27	Very low	31.9	Very low	134 Å²	134	147.7 Å²	147.7	82%	0.822	79%	0.786	S	S	*	*			trans	-108.4	95.2	158.5	50.2	0	0	0	0	108.1
910	T	26.8	Very low	31	Very low	133 Å²	133	149.5 Å²	149.5	82%	0.816	79%	0.787	S	S	*	*			trans	174.7	134.4	145.7	26	0	0	0	0	110
911	K	30.9	Very low	30.7	Very low	197 Å²	197	152.9 Å²	152.9	86%	0.857	80%	0.801	S	S	*	*			trans	99.8	123	171.8	-58.4	170.8	-177.9	-178.3	0	113.6
912	T	28.7	Very low	29.9	Very low	130 Å²	130	154.9 Å²	154.9	80%	0.798	81%	0.806	S	S	*	*			cis	-179.5	130.3	-12	13.2	0	0	0	0	103.1	H914	T912-H914 PolarHBondContact O-N 3.4Å
913	N	23.9	Very low	28.9	Very low	153 Å²	153	156.2 Å²	156.2	82%	0.818	81%	0.808	S	S	*	*			trans	-55.4	130	168.5	-72.1	-30.1	0	0	0	111.4
914	H	28.6	Very low	28.1	Very low	191 Å²	191	159.1 Å²	159.1	88%	0.884	81%	0.813	S	S	*	*			trans	-142.4	115.5	144.8	-94.2	-17.9	0	0	0	111.7	T912	T912-H914 PolarHBondContact O-N 3.4Å
915	N	24.1	Very low	27.1	Very low	153 Å²	153	161.4 Å²	161.4	82%	0.818	83%	0.825	S	S	*	*			trans	-55.9	134.5	163.5	-65.4	-29.6	0	0	0	109.9
916	H	28.3	Very low	26.5	Very low	195 Å²	195	157.8 Å²	157.8	90%	0.903	82%	0.819	S	S	*	*			trans	-115.4	100.7	154.7	-105.9	-38.9	0	0	0	110.6
917	S	23.6	Very low	26	Very low	104 Å²	104	156 Å²	156	73%	0.727	81%	0.811	S	S	*	*			trans	-69	142.8	157.4	-178.1	0	0	0	0	109.6
918	M	23.3	Very low	26	Very low	153 Å²	153	159.3 Å²	159.3	75%	0.754	82%	0.817	S	S	*	*			trans	-37.1	138	161.7	-79.1	-106.7	-162.8	0	0	113.3
919	N	26	Very low	25.7	Very low	168 Å²	168	162 Å²	162	90%	0.898	82%	0.817	S	S	*	*			trans	-157	129	137.9	-104.2	-17.1	0	0	0	111.6
920	F	23.7	Very low	25.7	Very low	185 Å²	185	163 Å²	163	81%	0.811	82%	0.816	S	S	*	*			trans	-60.8	136.2	163.9	-88.6	-102.3	0	0	0	110.7
921	H	27.4	Very low	25.7	Very low	195 Å²	195	164.9 Å²	164.9	90%	0.903	82%	0.815	S	S	*	*			trans	-163.6	157.2	130.3	-107.2	-17.9	0	0	0	114
922	H	23.2	Very low	25.3	Very low	164 Å²	164	166 Å²	166	76%	0.759	82%	0.815	S	S	*	*			trans	-78.7	164.5	-164.2	-133	24.9	0	0	0	113.9
923	D	23	Very low	25.2	Very low	131 Å²	131	167.6 Å²	167.6	70%	0.701	82%	0.819	S	S	*	*			trans	68.3	112	155.5	-64.3	-25.6	0	0	0	120.3
924	K	28.9	Very low	25.2	Very low	208 Å²	208	169.2 Å²	169.2	90%	0.904	82%	0.822	S	S	*	*				-166.8	127.8	109.9	-104.2	171.2	-175.6	-178.4	0	113.6
925	L	22.9	Very low	25.1	Very low	157 Å²	157	163.6 Å²	163.6	82%	0.822	82%	0.816	S	S	*	*			trans	-59	142.6	157.1	-71.9	143.8	0	0	0	111.3
926	M	25.9	Very low	25.1	Very low	155 Å²	155	165.4 Å²	165.4	76%	0.764	82%	0.819	S	S	*	*				164.3	118.2	121.5	-86.4	-71.6	174.3	0	0	110.5
927	D	23.5	Very low	24.9	Very low	129 Å²	129	162 Å²	162	69%	0.69	81%	0.813	S	S	*	*			trans	50	108	135.3	-55.8	-9.1	0	0	0	120.4
928	H	28.6	Very low	25	Very low	191 Å²	191	165.2 Å²	165.2	88%	0.884	82%	0.816	S	S	*	*			trans	-140.4	103.6	134.2	-101.3	-53.1	0	0	0	110.4
929	E	21.4	Very low	25	Very low	176 Å²	176	166.5 Å²	166.5	82%	0.822	82%	0.82	S	S	*	*			trans	-61.3	146.7	152.9	-64.4	174.3	147.5	0	0	109.9
930	I	28	Very low	24.9	Very low	156 Å²	156	168 Å²	168	80%	0.8	82%	0.818	S	S	*	*			trans	164.7	136.4	150.7	-85.2	151	0	0	0	104.9
931	E	25.4	Very low	24.9	Very low	172 Å²	172	168 Å²	168	80%	0.804	82%	0.82	S	S	*	*			cis	-176.9	140.3	-15.7	-165.8	168.1	-158.8	0	0	102.3
932	Y	22.6	Very low	24.7	Very low	219 Å²	219	163.9 Å²	163.9	86%	0.859	81%	0.813	S	S	*	*			trans	-61.2	134.6	174.6	-88.9	-105.2	0	0	0	110
933	N	27.5	Very low	24.7	Very low	165 Å²	165	160.3 Å²	160.3	88%	0.882	82%	0.82	S	S	*	*			trans	-148	116	152.4	-117.6	-16.7	0	0	0	111.5
934	E	23.6	Very low	24.9	Very low	186 Å²	186	159 Å²	159	87%	0.869	82%	0.817	S	S	*	*			trans	-66.7	144.4	166.1	-65.5	173.8	152.9	0	0	109.9
935	G	27.4	Very low	25	Very low	73 Å²	73	154.6 Å²	154.6	75%	0.753	80%	0.803	S	S	*	*			trans	-172.4	90	176.1	0	0	0	0	0	110.7
936	E	22.3	Very low	25.4	Very low	191 Å²	191	154.9 Å²	154.9	89%	0.893	80%	0.804	S	S	*	*			trans	-46.5	139.6	163.9	-66	174.4	135.5	0	0	111.2
937	T	25.2	Very low	26.1	Very low	125 Å²	125	150.3 Å²	150.3	77%	0.767	79%	0.785	S	S	*	*			trans	-173.2	124.8	135.6	25.2	0	0	0	0	112.5
938	H	25.6	Very low	26.8	Very low	171 Å²	171	149.8 Å²	149.8	79%	0.792	78%	0.782	S	S	*	*			trans	69	98.9	145.2	-73.2	-65.5	0	0	0	121.4	K940	H938-K940 PolarHBondContact O-N 3.03Å
939	E	22.9	Very low	27.4	Very low	180 Å²	180	146.2 Å²	146.2	84%	0.841	76%	0.764	S	S	*	*			trans	-31.8	114	140.9	-70.8	176.5	131.2	0	0	113.4
940	K	24.9	Very low	28.3	Very low	198 Å²	198	145.8 Å²	145.8	86%	0.861	76%	0.762	S	S	*	*			trans	-134.3	109.4	145.1	-80.1	-170.9	178.4	174.4	0	109.1	H938 C942	H938-K940 PolarHBondContact O-N 3.03Å; K940-C942 PolarHBondContact O-N 3.27Å
941	H	23.4	Very low	29.3	Very low	186 Å²	186	143.4 Å²	143.4	86%	0.861	75%	0.751	S	S	*	*	S	Bend	trans	-49.1	101.7	161.7	-76.3	-9.3	0	0	0	111.2
942	C	22	Very low	30.5	Very low	109 Å²	109	135.5 Å²	135.5	74%	0.736	71%	0.714	S	S	*	*			trans	177.6	79.5	141.6	-148.8	0	0	0	0	108.3	K940 T944	K940-C942 PolarHBondContact O-N 3.27Å; C942-T944 PolarHBondContact O-N 3.35Å
943	G	24.4	Very low	32	Very low	89 Å²	89	126 Å²	126	92%	0.918	68%	0.677	S	S	*	*			trans	-87.3	76.2	-177.2	0	0	0	0	0	112.4	L945	G943-L945 PolarHBondContact O-N 3.28Å
944	T	25.9	Very low	33.1	Very low	102 Å²	102	123.4 Å²	123.4	63%	0.626	66%	0.663	S	S	*	*			trans	-70.7	116.9	173.2	-51.9	0	0	0	0	110.7	C942 L946	C942-T944 PolarHBondContact O-N 3.35Å; T944-L946 PolarHBondContact O-N 2.83Å
945	L	32.7	Very low	34.4	Very low	117 Å²	117	115.3 Å²	115.3	61%	0.613	63%	0.63	S	S	*	*			trans	11.7	64.2	146.4	-69.7	151.7	0	0	0	118.6	L775 G943	L775-L945 HydrophobicContact CD2-CB 3.45Å; L775-L945 VanDerWaalsContact CD2-CB 3.45Å; L775-L945 HydrophobicContact CD2-CD1 3.77Å; L775-L945 HydrophobicContact CD2-CG 4.11Å; G943-L945 PolarHBondContact O-N 3.28Å
946	L	30.3	Very low	36	Very low	163 Å²	163	112.1 Å²	112.1	85%	0.853	60%	0.595	S	S	*	*			trans	-110.8	80.1	156.8	-81.2	166.4	0	0	0	108.2	T944 N948	T944-L946 PolarHBondContact O-N 2.83Å; L946-N948 PolarHBondContact O-N 3.22Å
947	V	41	Very low	37.4	Very low	59 Å²	59	104.6 Å²	104.6	36%	0.358	57%	0.569	S	S	.	*			trans	-78.4	111.2	170.5	-177.3	0	0	0	0	107.3	L952	V947-L952 HydrophobicContact CG1-CB 3.91Å; V947-L952 HydrophobicContact CG1-CD1 4.24Å
948	N	38.3	Very low	39.3	Very low	117 Å²	117	99.5 Å²	99.5	63%	0.626	54%	0.536	S	S	*	.			trans	-57.3	139.9	173.1	-81.6	-28	0	0	0	110.3	L946 E950 D951	L946-N948 PolarHBondContact O-N 3.22Å; N948-E950 PolarHBondContact O-N 3.31Å; N948-D951 PolarHBondContact O-N 3.44Å; N948-D951 VanDerWaalsContact O-N 3.15Å
949	K	41.5	Very low	41.5	Very low	116 Å²	116	94.7 Å²	94.7	50%	0.504	52%	0.516	S	S	.	.	H	α-helix	trans	-52.5	-32.1	-176.4	-163.9	175.5	-178	174.9	0	112.6	F953	K949-F953 HydrophobicContact CG-CD2 4.47Å; K949-F953 HydrophobicContact CG-CE2 4.4Å; K949-F953 VanDerWaalsContact O-CD2 3.31Å; K949-F953 WeakPolarHBondContact O-CD2 3.21Å
950	E	39.4	Very low	44	Very low	167 Å²	167	88.9 Å²	88.9	78%	0.78	50%	0.496	S	S	*	.	H	α-helix	trans	-76.3	-37.9	-177.3	-66.2	-178.6	164.2	0	0	113.1	N948 L952 D954	N948-E950 PolarHBondContact O-N 3.31Å; E950-L952 PolarHBondContact O-N 3.09Å; E950-D954 PolarHBondContact O-N 2.94Å
951	D	48.2	Very low	46.6	Very low	107 Å²	107	83.5 Å²	83.5	57%	0.572	48%	0.48	S	S	*	.	H	α-helix	trans	-71.8	-30.8	-177.6	-72.5	-30.2	0	0	0	113.3	N948 G955	N948-D951 PolarHBondContact O-N 3.44Å; N948-D951 VanDerWaalsContact O-N 3.15Å; D951-G955 PolarHBondContact O-N 3.38Å
952	L	52.5	Low	49.3	Very low	5 Å²	5	75.3 Å²	75.3	3%	0.026	44%	0.443	C	S	.	.	H	α-helix	trans	-72.9	-43.9	-177	-170.4	68.9	0	0	0	112.1	E732 W780 V947 E950 G955 L956	E732-L952 HydrophobicContact CG-CD1 4.07Å; W780-L952 HydrophobicContact CD2-CD2 3.36Å; W780-L952 VanDerWaalsContact CE2-CD2 3.45Å; W780-L952 HydrophobicContact CE3-CD2 3.5Å; W780-L952 HydrophobicContact CG-CD2 3.99Å; W780-L952 HydrophobicContact CH2-CD2 3.79Å; W780-L952 HydrophobicContact CZ2-CD2 3.67Å; W780-L952 HydrophobicContact CZ3-CD2 3.71Å; V947-L952 HydrophobicContact CG1-CB 3.91Å; V947-L952 HydrophobicContact CG1-CD1 4.24Å; E950-L952 PolarHBondContact O-N 3.09Å; L952-G955 PolarHBondContact O-N 3.32Å; L952-L956 PolarHBondContact O-N 3.07Å; L952-L956 VanDerWaalsContact O-N 3.14Å
953	F	52.4	Low	52.5	Low	20 Å²	20	70.8 Å²	70.8	9%	0.088	41%	0.411	C	S	.	.	H	α-helix	trans	-74.2	-36.9	-178.3	-81.7	-66.9	0	0	0	111.9	W780 K949 G955 G957 E958	W780-F953 HydrophobicContact CB-CE2 4.05Å; W780-F953 HydrophobicContact CB-CZ 4.4Å; K949-F953 HydrophobicContact CG-CD2 4.47Å; K949-F953 HydrophobicContact CG-CE2 4.4Å; K949-F953 VanDerWaalsContact O-CD2 3.31Å; K949-F953 WeakPolarHBondContact O-CD2 3.21Å; F953-G955 VanDerWaalsContact C-N 3.26Å; F953-G955 PolarHBondContact O-N 2.81Å; F953-G957 PolarHBondContact O-N 3.06Å; F953-G957 VanDerWaalsContact O-N 3.12Å; F953-E958 WeakPolarHBondContact CB-O 3.39Å; F953-E958 HydrophobicContact CD1-CB 4.39Å; F953-E958 PolarHBondContact O-N 3.31Å
954	D	50.9	Low	55.5	Low	110 Å²	110	70.6 Å²	70.6	59%	0.588	39%	0.386	S	S	*	.	H	α-helix	trans	-64.6	-33.4	168.4	-99.3	-1.1	0	0	0	111.5	E950 G957	E950-D954 PolarHBondContact O-N 2.94Å; D954-G957 PolarHBondContact O-N 3.08Å
955	G	51.7	Low	58.4	Low	16 Å²	16	69.1 Å²	69.1	17%	0.165	37%	0.374	C	S	.	.	H	α-helix	trans	-67.2	-39.1	179	0	0	0	0	0	114.9	R640 D951 L952 F953 G957	R640-G955 WeakPolarHBondContact CG-O 3.26Å; D951-G955 PolarHBondContact O-N 3.38Å; L952-G955 PolarHBondContact O-N 3.32Å; F953-G955 VanDerWaalsContact C-N 3.26Å; F953-G955 PolarHBondContact O-N 2.81Å; G955-G957 VanDerWaalsContact C-N 3.34Å
956	L	59.7	Low	61.1	Low	7 Å²	7	65 Å²	65	4%	0.037	35%	0.352	C	S	.	.	H	α-helix	trans	-90	-0.6	175	-67.8	168.8	0	0	0	113	R640 V643 L723 E732 C735 L952	R640-L956 HydrophobicContact CG-CD2 3.98Å; R640-L956 HydrophobicContact CG-CG 4.25Å; V643-L956 HydrophobicContact CG1-CD2 4.19Å; L723-L956 HydrophobicContact CD1-CD2 4.24Å; E732-L956 HydrophobicContact CB-CD1 4.16Å; C735-L956 HydrophobicContact CB-CD1 4.43Å; L952-L956 PolarHBondContact O-N 3.07Å; L952-L956 VanDerWaalsContact O-N 3.14Å
957	G	53.5	Low	64.1	Low	32 Å²	32	57.5 Å²	57.5	33%	0.33	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	26.7	177.9	0	0	0	0	0	113.8	K647 F953 D954 G955	K647-G957 PolarHBondContact NZ-O 3.21Å; F953-G957 PolarHBondContact O-N 3.06Å; F953-G957 VanDerWaalsContact O-N 3.12Å; D954-G957 PolarHBondContact O-N 3.08Å; G955-G957 VanDerWaalsContact C-N 3.34Å
958	E	64.4	Low	66.4	Low	19 Å²	19	58.5 Å²	58.5	9%	0.089	32%	0.316	C	S	.	.			trans	-112.3	110.6	-177.9	-172.7	158.3	-106.7	0	0	111	S739 R742 F953 S960 R963	S739-E958 WeakPolarHBondContact CB-OE1 3.36Å; R742-E958 IonicContact CZ-OE1 2.8Å; R742-E958 IonicContact CZ-OE2 3.57Å; R742-E958 IonicContact NH2-OE1 3.45Å; R742-E958 PolarHBondContact NH2-OE1 3.49Å; R742-E958 IonicContact NH2-OE2 3.69Å; R742-E958 PolarHBondContact NH2-OE2 3.49Å; F953-E958 WeakPolarHBondContact CB-O 3.39Å; F953-E958 HydrophobicContact CD1-CB 4.39Å; F953-E958 PolarHBondContact O-N 3.31Å; E958-S960 PolarHBondContact O-N 2.87Å; E958-R963 HydrophobicContact CG-CB 4.49Å
959	N	72.3	Confident	68.8	Low	69 Å²	69	54.1 Å²	54.1	37%	0.369	29%	0.293	S	S	.	.			trans	-71.1	120.8	178.2	179.7	-4.4	0	0	0	110.2	T961 S962 R963	N959-T961 PolarHBondContact ND2-OG1 3.01Å; N959-T961 PolarHBondContact O-N 3.01Å; N959-T961 VanDerWaalsContact O-N 3.14Å; N959-T961 PolarHBondContact OD1-N 3.46Å; N959-T961 PolarHBondContact OD1-OG1 3.39Å; N959-S962 WeakPolarHBondContact O-CA 3.4Å; N959-S962 WeakPolarHBondContact O-CB 3.35Å; N959-S962 PolarHBondContact O-N 3.23Å; N959-R963 PolarHBondContact O-N 2.96Å
960	S	74.7	Confident	71.2	Confident	59 Å²	59	48.6 Å²	48.6	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-45.4	-43.3	175.6	164.5	0	0	0	0	112.9	E958 R963 Q964	E958-S960 PolarHBondContact O-N 2.87Å; S960-R963 PolarHBondContact O-N 3.35Å; S960-Q964 PolarHBondContact O-N 2.85Å
961	T	78.7	Confident	73.8	Confident	85 Å²	85	42.8 Å²	42.8	52%	0.521	24%	0.24	S	C	.	.	H	α-helix	trans	-68.8	-41.2	179.4	56.9	0	0	0	0	112.7	N959 Q964 L965	N959-T961 PolarHBondContact ND2-OG1 3.01Å; N959-T961 PolarHBondContact O-N 3.01Å; N959-T961 VanDerWaalsContact O-N 3.14Å; N959-T961 PolarHBondContact OD1-N 3.46Å; N959-T961 PolarHBondContact OD1-OG1 3.39Å; T961-Q964 PolarHBondContact O-N 3.39Å; T961-L965 WeakPolarHBondContact O-CB 3.48Å; T961-L965 PolarHBondContact O-N 2.9Å; T961-L965 VanDerWaalsContact O-N 3.11Å
962	S	80.9	Confident	75.7	Confident	14 Å²	14	42.3 Å²	42.3	10%	0.098	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-43	174.1	-63.2	0	0	0	0	110.9	E683 N959 L965 Q966	E683-S962 PolarHBondContact OE2-OG 3.13Å; E683-S962 VanDerWaalsContact OE2-OG 3.1Å; N959-S962 WeakPolarHBondContact O-CA 3.4Å; N959-S962 WeakPolarHBondContact O-CB 3.35Å; N959-S962 PolarHBondContact O-N 3.23Å; S962-L965 PolarHBondContact O-N 3.42Å; S962-Q966 VanDerWaalsContact O-CG 3.25Å; S962-Q966 WeakPolarHBondContact O-CG 3.36Å; S962-Q966 PolarHBondContact O-N 2.94Å
963	R	89.2	Confident	77.5	Confident	13 Å²	13	43.7 Å²	43.7	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-51.2	176.8	172.4	177.3	170.3	-82.9	-1.6	111.5	E787 D885 E958 N959 S960 L965 Q966 M967	E787-R963 IonicContact OE2-CZ 3.45Å; E787-R963 VanDerWaalsContact OE2-CZ 3.24Å; E787-R963 IonicContact OE2-NE 2.73Å; E787-R963 PolarHBondContact OE2-NE 3.29Å; E787-R963 IonicContact OE2-NH2 3.46Å; E787-R963 PolarHBondContact OE2-NH2 3.16Å; D885-R963 IonicContact OD1-CZ 2.61Å; D885-R963 IonicContact OD1-NH1 2.85Å; D885-R963 PolarHBondContact OD1-NH1 3.39Å; D885-R963 IonicContact OD1-NH2 3.72Å; D885-R963 PolarHBondContact OD1-NH2 3.2Å; D885-R963 IonicContact OD2-CZ 3.56Å; D885-R963 IonicContact OD2-NH1 3.24Å; D885-R963 PolarHBondContact OD2-NH1 3.47Å; D885-R963 IonicContact OD2-NH2 3.71Å; E958-R963 HydrophobicContact CG-CB 4.49Å; N959-R963 PolarHBondContact O-N 2.96Å; S960-R963 PolarHBondContact O-N 3.35Å; R963-L965 VanDerWaalsContact C-N 3.28Å; R963-L965 PolarHBondContact O-N 3.19Å; R963-Q966 WeakPolarHBondContact O-CB 3.26Å; R963-Q966 PolarHBondContact O-N 2.9Å; R963-M967 HydrophobicContact CG-SD 4.02Å; R963-M967 PolarHBondContact NH2-SD 3.21Å; R963-M967 VanDerWaalsContact NH2-SD 3.43Å; R963-M967 WeakPolarHBondContact O-CG 3.37Å; R963-M967 PolarHBondContact O-N 3.36Å
964	Q	88.4	Confident	79.4	Confident	86 Å²	86	43 Å²	43	40%	0.402	24%	0.24	S	C	.	.	H	α-helix	trans	-65	-35.1	-176.6	-165.5	156.4	16.5	0	0	112.1	S960 T961 M967 N968	S960-Q964 PolarHBondContact O-N 2.85Å; T961-Q964 PolarHBondContact O-N 3.39Å; Q964-M967 PolarHBondContact O-N 3.25Å; Q964-N968 VanDerWaalsContact O-CG 3.28Å; Q964-N968 PolarHBondContact O-N 2.91Å; Q964-N968 PolarHBondContact O-ND2 3.47Å
965	L	86.2	Confident	81.4	Confident	71 Å²	71	37.9 Å²	37.9	37%	0.372	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-46.1	173.4	-167.2	69.7	0	0	0	112.2	M684 T961 S962 R963 M967 N968 V969	M684-L965 HydrophobicContact CB-CD2 4.11Å; M684-L965 HydrophobicContact CE-CD2 4.17Å; M684-L965 HydrophobicContact CG-CD2 3.22Å; T961-L965 WeakPolarHBondContact O-CB 3.48Å; T961-L965 PolarHBondContact O-N 2.9Å; T961-L965 VanDerWaalsContact O-N 3.11Å; S962-L965 PolarHBondContact O-N 3.42Å; R963-L965 VanDerWaalsContact C-N 3.28Å; R963-L965 PolarHBondContact O-N 3.19Å; L965-M967 VanDerWaalsContact C-N 3.27Å; L965-M967 PolarHBondContact O-N 3.16Å; L965-N968 PolarHBondContact O-N 3.43Å; L965-V969 WeakPolarHBondContact O-CB 3.48Å; L965-V969 VanDerWaalsContact O-CG2 3.27Å; L965-V969 WeakPolarHBondContact O-CG2 3.46Å; L965-V969 PolarHBondContact O-N 3.09Å
966	Q	89.2	Confident	83.3	Confident	31 Å²	31	37.2 Å²	37.2	15%	0.145	21%	0.205	C	C	.	.	H	α-helix	trans	-56.5	-43.5	175.4	-71.8	169.5	8.8	0	0	111.2	F687 S962 R963 V969 L970	F687-Q966 HydrophobicContact CD1-CG 4.17Å; F687-Q966 HydrophobicContact CD2-CG 4.01Å; F687-Q966 HydrophobicContact CE1-CB 4.07Å; F687-Q966 HydrophobicContact CE1-CG 4.02Å; F687-Q966 HydrophobicContact CE2-CB 4.39Å; F687-Q966 HydrophobicContact CE2-CG 3.85Å; F687-Q966 HydrophobicContact CG-CG 4.17Å; F687-Q966 HydrophobicContact CZ-CB 3.93Å; F687-Q966 HydrophobicContact CZ-CG 3.85Å; S962-Q966 VanDerWaalsContact O-CG 3.25Å; S962-Q966 WeakPolarHBondContact O-CG 3.36Å; S962-Q966 PolarHBondContact O-N 2.94Å; R963-Q966 WeakPolarHBondContact O-CB 3.26Å; R963-Q966 PolarHBondContact O-N 2.9Å; Q966-V969 PolarHBondContact O-N 3.06Å; Q966-L970 WeakPolarHBondContact O-CB 3.38Å; Q966-L970 VanDerWaalsContact O-CG 3.29Å; Q966-L970 WeakPolarHBondContact O-CG 3.47Å; Q966-L970 PolarHBondContact O-N 3.09Å
967	M	92.2	Very high	84.8	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-47.4	176.3	-73.1	172.9	54.6	0	0	112.2	L883 R963 Q964 L965 V969 L970 R971	L883-M967 HydrophobicContact CD1-CE 4.44Å; L883-M967 HydrophobicContact CD1-CG 4.26Å; L883-M967 HydrophobicContact CD2-CB 4.01Å; L883-M967 HydrophobicContact CD2-CG 4.17Å; L883-M967 WeakPolarHBondContact CD2-O 3.42Å; L883-M967 HydrophobicContact CG-CB 3.92Å; L883-M967 HydrophobicContact CG-CE 4.06Å; L883-M967 HydrophobicContact CG-CG 3.88Å; L883-M967 WeakPolarHBondContact O-CE 3.48Å; R963-M967 HydrophobicContact CG-SD 4.02Å; R963-M967 PolarHBondContact NH2-SD 3.21Å; R963-M967 VanDerWaalsContact NH2-SD 3.43Å; R963-M967 WeakPolarHBondContact O-CG 3.37Å; R963-M967 PolarHBondContact O-N 3.36Å; Q964-M967 PolarHBondContact O-N 3.25Å; L965-M967 VanDerWaalsContact C-N 3.27Å; L965-M967 PolarHBondContact O-N 3.16Å; M967-V969 VanDerWaalsContact C-N 3.3Å; M967-V969 PolarHBondContact O-N 2.95Å; M967-L970 PolarHBondContact O-N 2.96Å; M967-R971 VanDerWaalsContact O-CB 3.28Å; M967-R971 WeakPolarHBondContact O-CB 3.49Å; M967-R971 PolarHBondContact O-N 2.76Å
968	N	90.2	Very high	86.7	Confident	80 Å²	80	38 Å²	38	43%	0.428	20%	0.201	S	C	.	.	H	α-helix	trans	-59.9	-42.4	178.5	-74.1	-23.2	0	0	0	112.1	Q964 L965 R971 E972	Q964-N968 VanDerWaalsContact O-CG 3.28Å; Q964-N968 PolarHBondContact O-N 2.91Å; Q964-N968 PolarHBondContact O-ND2 3.47Å; L965-N968 PolarHBondContact O-N 3.43Å; N968-R971 WeakPolarHBondContact O-CB 3.32Å; N968-R971 PolarHBondContact O-N 2.94Å; N968-E972 PolarHBondContact O-N 3.36Å
969	V	88.7	Confident	88.1	Confident	24 Å²	24	37.1 Å²	37.1	15%	0.145	20%	0.196	C	C	.	.	H	α-helix	trans	-67.7	-42.8	179.4	173	0	0	0	0	111.4	F687 L691 L965 Q966 M967 R971 E972 T973	F687-V969 HydrophobicContact CD1-CG1 4.36Å; F687-V969 HydrophobicContact CE1-CB 4.41Å; F687-V969 HydrophobicContact CE1-CG1 4.2Å; L691-V969 HydrophobicContact CD1-CB 4.39Å; L691-V969 HydrophobicContact CD1-CG1 2.99Å; L691-V969 HydrophobicContact CG-CG1 4.47Å; L965-V969 WeakPolarHBondContact O-CB 3.48Å; L965-V969 VanDerWaalsContact O-CG2 3.27Å; L965-V969 WeakPolarHBondContact O-CG2 3.46Å; L965-V969 PolarHBondContact O-N 3.09Å; Q966-V969 PolarHBondContact O-N 3.06Å; M967-V969 VanDerWaalsContact C-N 3.3Å; M967-V969 PolarHBondContact O-N 2.95Å; V969-R971 VanDerWaalsContact C-N 3.31Å; V969-R971 PolarHBondContact O-N 3.23Å; V969-E972 PolarHBondContact O-N 2.82Å; V969-T973 WeakPolarHBondContact O-CG2 3.46Å; V969-T973 PolarHBondContact O-N 3.2Å; V969-T973 PolarHBondContact O-OG1 3.32Å
970	L	92.7	Very high	89.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-38.5	173.3	-75.5	175	0	0	0	111.6	F687 R742 I745 A746 L883 Q966 M967 T973 C974	F687-L970 HydrophobicContact CE1-CG 4.48Å; F687-L970 HydrophobicContact CZ-CD1 4.44Å; F687-L970 HydrophobicContact CZ-CG 4.28Å; R742-L970 HydrophobicContact CB-CD1 3.74Å; R742-L970 HydrophobicContact CG-CD1 3.72Å; I745-L970 HydrophobicContact CB-CD2 4.47Å; I745-L970 HydrophobicContact CG2-CD2 3.87Å; A746-L970 HydrophobicContact CB-CD2 3.97Å; L883-L970 HydrophobicContact CD2-CB 3.68Å; L883-L970 HydrophobicContact CD2-CD1 4.31Å; Q966-L970 WeakPolarHBondContact O-CB 3.38Å; Q966-L970 VanDerWaalsContact O-CG 3.29Å; Q966-L970 WeakPolarHBondContact O-CG 3.47Å; Q966-L970 PolarHBondContact O-N 3.09Å; M967-L970 PolarHBondContact O-N 2.96Å; L970-T973 WeakPolarHBondContact CA-OG1 3.48Å; L970-T973 PolarHBondContact O-OG1 3.27Å; L970-C974 WeakPolarHBondContact O-CA 3.4Å; L970-C974 WeakPolarHBondContact O-CB 3.19Å; L970-C974 PolarHBondContact O-N 2.82Å; L970-C974 PolarHBondContact O-SG 3.23Å
971	R	92.6	Very high	90	Very high	46 Å²	46	34.3 Å²	34.3	17%	0.174	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-48.1	175.5	-172.3	176.6	178.7	-114.1	-5.2	111.9	W882 M967 N968 V969 I975 L1012	W882-R971 HydrophobicContact CE3-CB 4.43Å; W882-R971 HydrophobicContact CE3-CG 4.34Å; W882-R971 HydrophobicContact CZ3-CB 4.41Å; W882-R971 WeakPolarHBondContact O-CD 3.42Å; W882-R971 PolarHBondContact O-NE 2.99Å; M967-R971 VanDerWaalsContact O-CB 3.28Å; M967-R971 WeakPolarHBondContact O-CB 3.49Å; M967-R971 PolarHBondContact O-N 2.76Å; N968-R971 WeakPolarHBondContact O-CB 3.32Å; N968-R971 PolarHBondContact O-N 2.94Å; V969-R971 VanDerWaalsContact C-N 3.31Å; V969-R971 PolarHBondContact O-N 3.23Å; R971-I975 HydrophobicContact CG-CD1 3.64Å; R971-I975 HydrophobicContact CG-CG1 4.45Å; R971-I975 WeakPolarHBondContact O-CB 3.28Å; R971-I975 WeakPolarHBondContact O-CG1 3.49Å; R971-I975 PolarHBondContact O-N 3.06Å; R971-L1012 HydrophobicContact CG-CD1 4.03Å; R971-L1012 HydrophobicContact CG-CD2 4.29Å
972	E	89.2	Confident	90.7	Very high	96 Å²	96	30.2 Å²	30.2	45%	0.449	15%	0.15	S	C	.	.	H	α-helix	trans	-62.3	-46.9	178.3	-165.8	-178.6	163.1	0	0	111.9	N968 V969 T976 L1012	N968-E972 PolarHBondContact O-N 3.36Å; V969-E972 PolarHBondContact O-N 2.82Å; E972-T976 WeakPolarHBondContact O-CB 3.42Å; E972-T976 WeakPolarHBondContact O-CG2 3.28Å; E972-T976 PolarHBondContact O-N 2.92Å; E972-T976 PolarHBondContact O-OG1 3.4Å; E972-L1012 WeakPolarHBondContact CG-O 3.38Å
973	T	89.5	Confident	91.3	Very high	34 Å²	34	29.7 Å²	29.7	21%	0.209	15%	0.146	C	C	.	.	H	α-helix	trans	-74.2	-50.9	-176.8	50.8	0	0	0	0	112.9	L691 V969 L970 T976 E977	L691-T973 HydrophobicContact CD2-CG2 4.3Å; V969-T973 WeakPolarHBondContact O-CG2 3.46Å; V969-T973 PolarHBondContact O-N 3.2Å; V969-T973 PolarHBondContact O-OG1 3.32Å; L970-T973 WeakPolarHBondContact CA-OG1 3.48Å; L970-T973 PolarHBondContact O-OG1 3.27Å; T973-T976 PolarHBondContact O-OG1 2.89Å; T973-E977 WeakPolarHBondContact O-CB 3.32Å; T973-E977 VanDerWaalsContact O-CG 3.31Å; T973-E977 WeakPolarHBondContact O-CG 3.25Å; T973-E977 PolarHBondContact O-N 3.32Å
974	C	92.8	Very high	91.4	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.034	17%	0.165	C	C	.	.	H	α-helix	trans	-70.3	-38.7	-173.9	-63.9	0	0	0	0	112.4	Y794 W882 L970 T978	Y794-C974 HydrophobicContact CD2-CB 4.07Å; Y794-C974 HydrophobicContact CE2-CB 3.56Å; W882-C974 HydrophobicContact CH2-CB 3.94Å; W882-C974 HydrophobicContact CZ3-CB 4.01Å; L970-C974 WeakPolarHBondContact O-CA 3.4Å; L970-C974 WeakPolarHBondContact O-CB 3.19Å; L970-C974 PolarHBondContact O-N 2.82Å; L970-C974 PolarHBondContact O-SG 3.23Å; C974-T978 VanDerWaalsContact O-CB 3.27Å; C974-T978 WeakPolarHBondContact O-CB 3.49Å; C974-T978 PolarHBondContact O-N 3.07Å; C974-T978 PolarHBondContact O-OG1 3.21Å
975	I	92.9	Very high	91.5	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.015	15%	0.146	C	C	.	.	H	α-helix	trans	-67.7	-45.9	178.8	-69.6	-177.1	0	0	0	110.5	L875 W882 R971 E977 T978 V979 L1009 L1012	L875-I975 HydrophobicContact CD2-CG2 3.77Å; W882-I975 HydrophobicContact CB-CD1 4.41Å; W882-I975 HydrophobicContact CE3-CD1 4.13Å; W882-I975 HydrophobicContact CE3-CG1 4.04Å; R971-I975 HydrophobicContact CG-CD1 3.64Å; R971-I975 HydrophobicContact CG-CG1 4.45Å; R971-I975 WeakPolarHBondContact O-CB 3.28Å; R971-I975 WeakPolarHBondContact O-CG1 3.49Å; R971-I975 PolarHBondContact O-N 3.06Å; I975-E977 VanDerWaalsContact C-N 3.35Å; I975-E977 PolarHBondContact O-N 3.47Å; I975-T978 PolarHBondContact O-N 2.97Å; I975-V979 WeakPolarHBondContact O-CG2 3.38Å; I975-V979 PolarHBondContact O-N 3.12Å; I975-L1009 HydrophobicContact CD1-CD2 4.3Å; I975-L1009 HydrophobicContact CG2-CD2 4.09Å; I975-L1012 HydrophobicContact CB-CD1 4.09Å; I975-L1012 HydrophobicContact CD1-CD1 3.58Å; I975-L1012 HydrophobicContact CG1-CD1 4.37Å; I975-L1012 HydrophobicContact CG2-CD1 3.95Å
976	T	91.2	Very high	91.8	Very high	2 Å²	2	28 Å²	28	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-61.9	-44.2	178.8	53.7	0	0	0	0	111.1	E972 T973 T978 V979 F980 L1012 F1013	E972-T976 WeakPolarHBondContact O-CB 3.42Å; E972-T976 WeakPolarHBondContact O-CG2 3.28Å; E972-T976 PolarHBondContact O-N 2.92Å; E972-T976 PolarHBondContact O-OG1 3.4Å; T973-T976 PolarHBondContact O-OG1 2.89Å; T976-T978 PolarHBondContact O-N 2.68Å; T976-V979 PolarHBondContact O-N 3.17Å; T976-F980 WeakPolarHBondContact O-CD2 3.5Å; T976-F980 PolarHBondContact O-N 2.84Å; T976-L1012 WeakPolarHBondContact CG2-O 3.47Å; T976-F1013 HydrophobicContact CG2-CD1 3.89Å; T976-F1013 HydrophobicContact CG2-CD2 4.05Å; T976-F1013 HydrophobicContact CG2-CE1 3.92Å; T976-F1013 HydrophobicContact CG2-CE2 4.08Å; T976-F1013 HydrophobicContact CG2-CG 3.95Å; T976-F1013 HydrophobicContact CG2-CZ 4Å
977	E	91.1	Very high	91.9	Very high	55 Å²	55	28.7 Å²	28.7	26%	0.257	13%	0.134	S	C	.	.	H	α-helix	trans	-60.6	-44	173.9	-74.4	-177.8	-163.6	0	0	112.7	H748 R798 T973 I975 V979 F980 L981	H748-E977 IonicContact CE1-OE1 3.83Å; H748-E977 IonicContact CE1-OE2 3.88Å; H748-E977 PolarHBondContact CE1-OE2 2.69Å; R798-E977 IonicContact CZ-OE2 3.84Å; R798-E977 IonicContact NH2-OE2 3.51Å; R798-E977 PolarHBondContact NH2-OE2 2.69Å; T973-E977 WeakPolarHBondContact O-CB 3.32Å; T973-E977 VanDerWaalsContact O-CG 3.31Å; T973-E977 WeakPolarHBondContact O-CG 3.25Å; T973-E977 PolarHBondContact O-N 3.32Å; I975-E977 VanDerWaalsContact C-N 3.35Å; I975-E977 PolarHBondContact O-N 3.47Å; E977-V979 VanDerWaalsContact C-N 3.31Å; E977-V979 PolarHBondContact O-N 3.31Å; E977-F980 PolarHBondContact O-N 3.1Å; E977-F980 VanDerWaalsContact O-N 3.16Å; E977-L981 WeakPolarHBondContact O-CG 3.38Å; E977-L981 PolarHBondContact O-N 3.35Å
978	T	93.5	Very high	91.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-59.8	-41.9	178.9	-60.8	0	0	0	0	111.4	L871 L874 C974 I975 T976 F980 L981 I982	L871-T978 HydrophobicContact CB-CG2 4.05Å; L871-T978 HydrophobicContact CD2-CG2 3.83Å; L874-T978 HydrophobicContact CD1-CG2 3.76Å; C974-T978 VanDerWaalsContact O-CB 3.27Å; C974-T978 WeakPolarHBondContact O-CB 3.49Å; C974-T978 PolarHBondContact O-N 3.07Å; C974-T978 PolarHBondContact O-OG1 3.21Å; I975-T978 PolarHBondContact O-N 2.97Å; T976-T978 PolarHBondContact O-N 2.68Å; T978-F980 PolarHBondContact O-N 2.95Å; T978-L981 WeakPolarHBondContact O-CB 3.32Å; T978-L981 PolarHBondContact O-N 3.37Å; T978-I982 HydrophobicContact CG2-CD1 4.22Å; T978-I982 WeakPolarHBondContact O-CG1 3.13Å; T978-I982 PolarHBondContact O-N 3.42Å
979	V	93.9	Very high	91.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.4	-46.5	175.2	166	0	0	0	0	111.3	L875 I975 T976 E977 L981 I982 V983 L998 I1002 F1013 L1021	L875-V979 HydrophobicContact CD1-CG2 3.82Å; L875-V979 HydrophobicContact CD2-CG2 3.89Å; I975-V979 WeakPolarHBondContact O-CG2 3.38Å; I975-V979 PolarHBondContact O-N 3.12Å; T976-V979 PolarHBondContact O-N 3.17Å; E977-V979 VanDerWaalsContact C-N 3.31Å; E977-V979 PolarHBondContact O-N 3.31Å; V979-L981 VanDerWaalsContact C-N 3.29Å; V979-L981 PolarHBondContact O-N 3.22Å; V979-I982 PolarHBondContact O-N 2.94Å; V979-V983 WeakPolarHBondContact O-CG2 3.38Å; V979-V983 PolarHBondContact O-N 3.41Å; V979-L998 HydrophobicContact CG1-CD2 4.31Å; V979-I1002 HydrophobicContact CB-CD1 4.49Å; V979-I1002 HydrophobicContact CG1-CD1 3.51Å; V979-I1002 HydrophobicContact CG2-CD1 4.13Å; V979-I1002 HydrophobicContact CG2-CG1 4.34Å; V979-F1013 HydrophobicContact CB-CZ 3.91Å; V979-F1013 HydrophobicContact CG1-CE1 4.37Å; V979-F1013 HydrophobicContact CG1-CZ 3.92Å; V979-F1013 HydrophobicContact CG2-CZ 3.91Å; V979-L1021 HydrophobicContact CG1-CD1 3.81Å; V979-L1021 HydrophobicContact CG1-CD2 4.4Å
980	F	93.8	Very high	91.3	Very high	44 Å²	44	29.4 Å²	29.4	19%	0.193	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-31.9	177.2	-73.5	-68.4	0	0	0	112.6	T976 E977 T978 R984 F1013 Q1017 N1020 L1021 H1024	T976-F980 WeakPolarHBondContact O-CD2 3.5Å; T976-F980 PolarHBondContact O-N 2.84Å; E977-F980 PolarHBondContact O-N 3.1Å; E977-F980 VanDerWaalsContact O-N 3.16Å; T978-F980 PolarHBondContact O-N 2.95Å; F980-R984 WeakPolarHBondContact O-CB 3.4Å; F980-R984 PolarHBondContact O-N 3.34Å; F980-F1013 HydrophobicContact CE2-CE1 4.3Å; F980-Q1017 HydrophobicContact CE2-CB 4.43Å; F980-N1020 HydrophobicContact CE1-CB 4.37Å; F980-N1020 HydrophobicContact CZ-CB 4.27Å; F980-L1021 HydrophobicContact CE1-CB 4.2Å; F980-L1021 HydrophobicContact CZ-CB 4.21Å; F980-H1024 AromaticContact CE1-CD2 4Å
981	L	93.1	Very high	91.1	Very high	25 Å²	25	31.1 Å²	31.1	13%	0.131	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-43.8	171.7	-67.3	175.9	0	0	0	111.5	F801 E977 T978 V979 R984 L985	F801-L981 HydrophobicContact CD1-CD2 4.08Å; F801-L981 HydrophobicContact CD2-CB 4.08Å; F801-L981 HydrophobicContact CD2-CD2 4.44Å; F801-L981 HydrophobicContact CE1-CD2 3.68Å; F801-L981 HydrophobicContact CE2-CB 3.99Å; F801-L981 HydrophobicContact CE2-CD2 4.03Å; F801-L981 WeakPolarHBondContact CE2-O 3.45Å; F801-L981 HydrophobicContact CG-CD2 4.46Å; F801-L981 HydrophobicContact CZ-CB 4.47Å; F801-L981 HydrophobicContact CZ-CD2 3.64Å; E977-L981 WeakPolarHBondContact O-CG 3.38Å; E977-L981 PolarHBondContact O-N 3.35Å; T978-L981 WeakPolarHBondContact O-CB 3.32Å; T978-L981 PolarHBondContact O-N 3.37Å; V979-L981 VanDerWaalsContact C-N 3.29Å; V979-L981 PolarHBondContact O-N 3.22Å; L981-R984 PolarHBondContact O-N 3.26Å; L981-L985 WeakPolarHBondContact O-CB 3.44Å; L981-L985 PolarHBondContact O-N 3.46Å
982	I	93.6	Very high	90.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-45.3	176.5	-63.5	165.9	0	0	0	110.8	L871 L872 L875 T978 V979 R984 L985 Y986 L998	L871-I982 HydrophobicContact CB-CD1 3.79Å; L871-I982 HydrophobicContact CB-CG1 3.52Å; L871-I982 HydrophobicContact CD1-CG1 3.88Å; L871-I982 HydrophobicContact CG-CG1 4.29Å; L872-I982 HydrophobicContact CD2-CD1 4.06Å; L872-I982 HydrophobicContact CG-CD1 4.3Å; L875-I982 HydrophobicContact CD1-CD1 3.63Å; L875-I982 HydrophobicContact CG-CD1 4.34Å; T978-I982 HydrophobicContact CG2-CD1 4.22Å; T978-I982 WeakPolarHBondContact O-CG1 3.13Å; T978-I982 PolarHBondContact O-N 3.42Å; V979-I982 PolarHBondContact O-N 2.94Å; I982-R984 VanDerWaalsContact C-N 3.33Å; I982-R984 PolarHBondContact O-N 3.22Å; I982-L985 WeakPolarHBondContact O-CB 3.48Å; I982-L985 PolarHBondContact O-N 3.31Å; I982-L985 VanDerWaalsContact O-N 3.16Å; I982-Y986 HydrophobicContact CG2-CD2 3.61Å; I982-Y986 HydrophobicContact CG2-CE2 3.26Å; I982-Y986 HydrophobicContact CG2-CG 4.42Å; I982-Y986 PolarHBondContact O-N 3.46Å; I982-L998 HydrophobicContact CB-CD2 4.05Å; I982-L998 HydrophobicContact CD1-CD1 4.39Å; I982-L998 HydrophobicContact CG2-CD1 4.34Å; I982-L998 HydrophobicContact CG2-CD2 3.72Å
983	V	92.9	Very high	90.9	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-56.8	-49.1	176.2	169.8	0	0	0	0	110.4	V979 L985 Y986 Q987 L998 L1021 H1024	V979-V983 WeakPolarHBondContact O-CG2 3.38Å; V979-V983 PolarHBondContact O-N 3.41Å; V983-L985 VanDerWaalsContact C-N 3.29Å; V983-L985 PolarHBondContact O-N 3.35Å; V983-Y986 PolarHBondContact O-N 3.49Å; V983-Q987 HydrophobicContact CG1-CG 4.33Å; V983-Q987 WeakPolarHBondContact O-CB 3.44Å; V983-Q987 VanDerWaalsContact O-CG 3.29Å; V983-Q987 WeakPolarHBondContact O-CG 3.24Å; V983-Q987 PolarHBondContact O-N 2.66Å; V983-L998 HydrophobicContact CG2-CD2 3.72Å; V983-L1021 HydrophobicContact CG2-CD1 3.89Å; V983-H1024 HydrophobicContact CG1-CB 3.66Å
984	R	91	Very high	90.9	Very high	123 Å²	123	29.5 Å²	29.5	46%	0.464	15%	0.152	S	C	.	.	H	α-helix	trans	-61.5	-39.7	177.8	-174.7	172.7	-175	173.7	0.9	111.9	Y805 F980 L981 I982 T988	Y805-R984 PolarHBondContact OH-NH2 2.58Å; F980-R984 WeakPolarHBondContact O-CB 3.4Å; F980-R984 PolarHBondContact O-N 3.34Å; L981-R984 PolarHBondContact O-N 3.26Å; I982-R984 VanDerWaalsContact C-N 3.33Å; I982-R984 PolarHBondContact O-N 3.22Å; R984-T988 VanDerWaalsContact O-CB 3.31Å; R984-T988 WeakPolarHBondContact O-CB 3.23Å; R984-T988 PolarHBondContact O-N 3.12Å; R984-T988 PolarHBondContact O-OG1 2.88Å
985	L	92	Very high	90.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-50.5	178.7	179.9	143.9	0	0	0	111.4	F801 W804 T864 A867 A868 L871 L981 I982 V983 T988 A989	F801-L985 HydrophobicContact CD2-CB 4.41Å; F801-L985 HydrophobicContact CD2-CD1 3.86Å; F801-L985 HydrophobicContact CE2-CB 4.04Å; F801-L985 HydrophobicContact CE2-CD1 4.27Å; W804-L985 HydrophobicContact CD2-CD1 3.78Å; W804-L985 HydrophobicContact CD2-CG 4.14Å; W804-L985 HydrophobicContact CE3-CD1 3.84Å; W804-L985 HydrophobicContact CE3-CG 4.24Å; W804-L985 HydrophobicContact CG-CD1 4.27Å; W804-L985 VanDerWaalsContact CH2-CA 3.47Å; W804-L985 HydrophobicContact CH2-CB 3.99Å; W804-L985 HydrophobicContact CH2-CG 4.04Å; W804-L985 HydrophobicContact CZ2-CB 4.27Å; W804-L985 HydrophobicContact CZ2-CD1 4.42Å; W804-L985 HydrophobicContact CZ2-CG 3.85Å; W804-L985 HydrophobicContact CZ3-CB 4.12Å; W804-L985 HydrophobicContact CZ3-CD1 4.22Å; W804-L985 HydrophobicContact CZ3-CG 4.19Å; T864-L985 HydrophobicContact CG2-CD2 3.23Å; T864-L985 HydrophobicContact CG2-CG 3.89Å; A867-L985 HydrophobicContact CB-CD1 3.73Å; A868-L985 HydrophobicContact CB-CD2 3.83Å; L871-L985 HydrophobicContact CD1-CD1 4.13Å; L981-L985 WeakPolarHBondContact O-CB 3.44Å; L981-L985 PolarHBondContact O-N 3.46Å; I982-L985 WeakPolarHBondContact O-CB 3.48Å; I982-L985 PolarHBondContact O-N 3.31Å; I982-L985 VanDerWaalsContact O-N 3.16Å; V983-L985 VanDerWaalsContact C-N 3.29Å; V983-L985 PolarHBondContact O-N 3.35Å; L985-T988 PolarHBondContact O-N 3.13Å; L985-A989 WeakPolarHBondContact O-CB 3.47Å; L985-A989 PolarHBondContact O-N 3.06Å; L985-A989 VanDerWaalsContact O-N 3.11Å
986	Y	92.3	Very high	90.5	Very high	11 Å²	11	29.9 Å²	29.9	4%	0.043	15%	0.154	C	C	.	.	H	α-helix	trans	-66	-43.2	177.4	-70.2	-29.1	0	0	0	113.4	T864 A868 I982 V983 T988 A989 G990 L991 K994 C995	T864-Y986 HydrophobicContact CG2-CD1 4.25Å; A868-Y986 HydrophobicContact CB-CE1 3.75Å; I982-Y986 HydrophobicContact CG2-CD2 3.61Å; I982-Y986 HydrophobicContact CG2-CE2 3.26Å; I982-Y986 HydrophobicContact CG2-CG 4.42Å; I982-Y986 PolarHBondContact O-N 3.46Å; V983-Y986 PolarHBondContact O-N 3.49Å; Y986-T988 VanDerWaalsContact C-N 3.34Å; Y986-T988 PolarHBondContact O-N 3.49Å; Y986-A989 PolarHBondContact O-N 3.09Å; Y986-G990 PolarHBondContact O-N 3.04Å; Y986-L991 HydrophobicContact CD1-CB 4.24Å; Y986-L991 HydrophobicContact CD1-CD1 4.2Å; Y986-L991 PolarHBondContact O-N 2.71Å; Y986-K994 HydrophobicContact CD1-CB 4.11Å; Y986-K994 HydrophobicContact CD1-CD 4.23Å; Y986-K994 HydrophobicContact CD2-CB 3.66Å; Y986-K994 HydrophobicContact CE1-CB 4.06Å; Y986-K994 HydrophobicContact CE1-CD 3.66Å; Y986-K994 HydrophobicContact CE1-CG 4.49Å; Y986-K994 HydrophobicContact CE2-CB 3.58Å; Y986-K994 HydrophobicContact CE2-CD 4.47Å; Y986-K994 HydrophobicContact CG-CB 3.93Å; Y986-C995 WeakPolarHBondContact CB-SG 3.43Å
987	Q	89.8	Confident	90.5	Very high	46 Å²	46	34.6 Å²	34.6	22%	0.215	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-41	176.2	-73.6	179.6	-26	0	0	111.9	V983 A989 G990 H1024 S1028	V983-Q987 HydrophobicContact CG1-CG 4.33Å; V983-Q987 WeakPolarHBondContact O-CB 3.44Å; V983-Q987 VanDerWaalsContact O-CG 3.29Å; V983-Q987 WeakPolarHBondContact O-CG 3.24Å; V983-Q987 PolarHBondContact O-N 2.66Å; Q987-A989 VanDerWaalsContact C-N 3.33Å; Q987-A989 PolarHBondContact O-N 3.26Å; Q987-G990 PolarHBondContact O-N 3.35Å; Q987-H1024 PolarHBondContact NE2-O 3.34Å; Q987-H1024 VanDerWaalsContact NE2-O 3.12Å; Q987-S1028 PolarHBondContact NE2-OG 3.1Å
988	T	86.6	Confident	90.4	Very high	60 Å²	60	32.3 Å²	32.3	37%	0.368	17%	0.165	S	C	.	.	H	α-helix	trans	-67.1	-35.5	179.2	-53.9	0	0	0	0	111.8	W804 V808 R984 L985 Y986 G990	W804-T988 HydrophobicContact CH2-CG2 4.15Å; W804-T988 HydrophobicContact CZ2-CG2 4.34Å; V808-T988 HydrophobicContact CG1-CG2 4.03Å; R984-T988 VanDerWaalsContact O-CB 3.31Å; R984-T988 WeakPolarHBondContact O-CB 3.23Å; R984-T988 PolarHBondContact O-N 3.12Å; R984-T988 PolarHBondContact O-OG1 2.88Å; L985-T988 PolarHBondContact O-N 3.13Å; Y986-T988 VanDerWaalsContact C-N 3.34Å; Y986-T988 PolarHBondContact O-N 3.49Å; T988-G990 VanDerWaalsContact C-N 3.3Å
989	A	87	Confident	90.2	Very high	30 Å²	30	33.6 Å²	33.6	25%	0.248	17%	0.174	C	C	.	.	H	α-helix	trans	-81.3	-5.6	176.6	0	0	0	0	0	114	T864 L985 Y986 Q987 L991	T864-A989 HydrophobicContact CG2-CB 3.6Å; T864-A989 WeakPolarHBondContact OG1-CB 3.19Å; L985-A989 WeakPolarHBondContact O-CB 3.47Å; L985-A989 PolarHBondContact O-N 3.06Å; L985-A989 VanDerWaalsContact O-N 3.11Å; Y986-A989 PolarHBondContact O-N 3.09Å; Q987-A989 VanDerWaalsContact C-N 3.33Å; Q987-A989 PolarHBondContact O-N 3.26Å; A989-L991 VanDerWaalsContact C-N 3.32Å; A989-L991 HydrophobicContact CB-CD1 4.24Å; A989-L991 HydrophobicContact CB-CG 4.14Å
990	G	85.3	Confident	90	Very high	35 Å²	35	38.8 Å²	38.8	36%	0.361	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	17.2	-176.2	0	0	0	0	0	114.5	Y986 Q987 T988 H992	Y986-G990 PolarHBondContact O-N 3.04Å; Q987-G990 PolarHBondContact O-N 3.35Å; T988-G990 VanDerWaalsContact C-N 3.3Å; G990-H992 VanDerWaalsContact C-N 3.29Å; G990-H992 PolarHBondContact O-N 3.22Å
991	L	88	Confident	89.8	Confident	36 Å²	36	38.2 Å²	38.2	19%	0.188	20%	0.2	C	C	.	.			trans	-89.5	55.5	-179.5	-62.4	177.2	0	0	0	111.4	R861 T864 Y986 A989 Q993 K994	R861-L991 HydrophobicContact CG-CD1 4.45Å; R861-L991 HydrophobicContact CG-CD2 4.48Å; T864-L991 HydrophobicContact CG2-CD1 3.9Å; Y986-L991 HydrophobicContact CD1-CB 4.24Å; Y986-L991 HydrophobicContact CD1-CD1 4.2Å; Y986-L991 PolarHBondContact O-N 2.71Å; A989-L991 VanDerWaalsContact C-N 3.32Å; A989-L991 HydrophobicContact CB-CD1 4.24Å; A989-L991 HydrophobicContact CB-CG 4.14Å; L991-Q993 VanDerWaalsContact C-N 3.27Å; L991-Q993 PolarHBondContact O-N 3.01Å; L991-K994 HydrophobicContact CB-CG 4.48Å; L991-K994 HydrophobicContact CD1-CD 4.31Å; L991-K994 PolarHBondContact O-N 3.21Å; L991-K994 VanDerWaalsContact O-N 3.08Å
992	H	88.6	Confident	89.6	Confident	16 Å²	16	37.2 Å²	37.2	7%	0.074	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-27.5	-172.3	-69.4	-81.8	0	0	0	114.3	G990 K994 C995 S1028 Y1031 L1032	G990-H992 VanDerWaalsContact C-N 3.29Å; G990-H992 PolarHBondContact O-N 3.22Å; H992-K994 VanDerWaalsContact C-N 3.33Å; H992-K994 PolarHBondContact O-N 2.99Å; H992-C995 WeakPolarHBondContact O-CB 3.45Å; H992-C995 PolarHBondContact O-N 3.11Å; H992-S1028 WeakPolarHBondContact ND1-CA 3.39Å; H992-S1028 WeakPolarHBondContact ND1-CB 3.45Å; H992-S1028 PolarHBondContact ND1-OG 3.16Å; H992-Y1031 HydrophobicContact CB-CD1 4.25Å; H992-Y1031 AromaticContact CD2-CD1 2.97Å; H992-Y1031 WeakPolarHBondContact CD2-CD1 3.16Å; H992-Y1031 AromaticContact CD2-CE1 3.29Å; H992-Y1031 WeakPolarHBondContact CD2-CE1 3.43Å; H992-Y1031 AromaticContact CD2-CG 3.47Å; H992-Y1031 VanDerWaalsContact CD2-CG 3.47Å; H992-Y1031 AromaticContact CE1-CG 3.86Å; H992-Y1031 AromaticContact CG-CD1 3.62Å; H992-Y1031 AromaticContact CG-CG 3.97Å; H992-Y1031 AromaticContact NE2-CD1 3.41Å; H992-Y1031 WeakPolarHBondContact NE2-CD1 3.2Å; H992-Y1031 AromaticContact NE2-CD2 3.71Å; H992-Y1031 AromaticContact NE2-CE1 3.66Å; H992-Y1031 AromaticContact NE2-CE2 3.96Å; H992-Y1031 AromaticContact NE2-CG 3.41Å; H992-Y1031 AromaticContact NE2-CZ 3.92Å; H992-L1032 HydrophobicContact CB-CD1 4.26Å; H992-L1032 HydrophobicContact CB-CD2 3.86Å; H992-L1032 HydrophobicContact CB-CG 3.87Å
993	Q	89.8	Confident	89.3	Confident	70 Å²	70	41.9 Å²	41.9	33%	0.327	22%	0.223	S	C	.	.	H	α-helix	trans	-60.7	-40.7	172.9	-174.5	174.3	11.7	0	0	112.1	L991 C995 I996 E997	L991-Q993 VanDerWaalsContact C-N 3.27Å; L991-Q993 PolarHBondContact O-N 3.01Å; Q993-C995 VanDerWaalsContact C-N 3.25Å; Q993-C995 PolarHBondContact O-N 3.15Å; Q993-I996 WeakPolarHBondContact O-CB 3.41Å; Q993-I996 PolarHBondContact O-N 3.24Å; Q993-E997 PolarHBondContact O-N 3.27Å
994	K	90.1	Very high	89.1	Confident	55 Å²	55	44.7 Å²	44.7	24%	0.239	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-25.3	178	-66.3	-164.2	-179.7	-179.5	0	112.7	E865 Y986 L991 H992 I996 E997 L998	E865-K994 IonicContact OE1-NZ 2.87Å; E865-K994 PolarHBondContact OE1-NZ 3.16Å; Y986-K994 HydrophobicContact CD1-CB 4.11Å; Y986-K994 HydrophobicContact CD1-CD 4.23Å; Y986-K994 HydrophobicContact CD2-CB 3.66Å; Y986-K994 HydrophobicContact CE1-CB 4.06Å; Y986-K994 HydrophobicContact CE1-CD 3.66Å; Y986-K994 HydrophobicContact CE1-CG 4.49Å; Y986-K994 HydrophobicContact CE2-CB 3.58Å; Y986-K994 HydrophobicContact CE2-CD 4.47Å; Y986-K994 HydrophobicContact CG-CB 3.93Å; L991-K994 HydrophobicContact CB-CG 4.48Å; L991-K994 HydrophobicContact CD1-CD 4.31Å; L991-K994 PolarHBondContact O-N 3.21Å; L991-K994 VanDerWaalsContact O-N 3.08Å; H992-K994 VanDerWaalsContact C-N 3.33Å; H992-K994 PolarHBondContact O-N 2.99Å; K994-I996 VanDerWaalsContact C-N 3.3Å; K994-I996 PolarHBondContact O-N 3.09Å; K994-E997 PolarHBondContact O-N 3.35Å; K994-L998 WeakPolarHBondContact O-CB 3.5Å; K994-L998 PolarHBondContact O-N 3.26Å
995	C	89.5	Confident	88.7	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-34.1	171.8	-64.1	0	0	0	0	112.3	Y986 H992 Q993 S999	Y986-C995 WeakPolarHBondContact CB-SG 3.43Å; H992-C995 WeakPolarHBondContact O-CB 3.45Å; H992-C995 PolarHBondContact O-N 3.11Å; Q993-C995 VanDerWaalsContact C-N 3.25Å; Q993-C995 PolarHBondContact O-N 3.15Å; C995-S999 PolarHBondContact O-N 3.19Å
996	I	88.3	Confident	88.3	Confident	16 Å²	16	51.9 Å²	51.9	8%	0.082	28%	0.282	C	S	.	.	H	α-helix	trans	-74.6	-43.3	177.6	-60.3	162.8	0	0	0	109.6	Q993 K994 L998 S999 N1000 I1029 L1032 P1039 L1040	Q993-I996 WeakPolarHBondContact O-CB 3.41Å; Q993-I996 PolarHBondContact O-N 3.24Å; K994-I996 VanDerWaalsContact C-N 3.3Å; K994-I996 PolarHBondContact O-N 3.09Å; I996-L998 VanDerWaalsContact C-N 3.26Å; I996-L998 PolarHBondContact O-N 2.73Å; I996-S999 WeakPolarHBondContact O-CB 3.15Å; I996-S999 PolarHBondContact O-N 3.02Å; I996-S999 PolarHBondContact O-OG 3Å; I996-N1000 PolarHBondContact O-N 3.22Å; I996-I1029 HydrophobicContact CD1-CG1 4.07Å; I996-I1029 HydrophobicContact CG1-CG1 4.22Å; I996-L1032 HydrophobicContact CD1-CD1 3.35Å; I996-P1039 WeakPolarHBondContact CD1-O 3.32Å; I996-L1040 HydrophobicContact CG2-CD2 4.1Å
997	E	89.5	Confident	87.7	Confident	101 Å²	101	54.2 Å²	54.2	47%	0.472	29%	0.291	S	S	.	.	H	α-helix	trans	-58.8	-38.8	174.6	-67.5	174.5	-178	0	0	112	Q993 K994 S999 N1000 L1001	Q993-E997 PolarHBondContact O-N 3.27Å; K994-E997 PolarHBondContact O-N 3.35Å; E997-S999 PolarHBondContact O-N 2.86Å; E997-N1000 WeakPolarHBondContact O-CB 3.27Å; E997-N1000 PolarHBondContact O-N 3.23Å; E997-N1000 VanDerWaalsContact O-N 3.12Å; E997-L1001 PolarHBondContact O-N 2.74Å
998	L	90.5	Very high	87.4	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-34.6	174	-178	65.7	0	0	0	112.4	L872 L875 V979 I982 V983 K994 I996 N1000 L1001 I1002	L872-L998 HydrophobicContact CD2-CD1 4.11Å; L875-L998 HydrophobicContact CD1-CD1 3.81Å; V979-L998 HydrophobicContact CG1-CD2 4.31Å; I982-L998 HydrophobicContact CB-CD2 4.05Å; I982-L998 HydrophobicContact CD1-CD1 4.39Å; I982-L998 HydrophobicContact CG2-CD1 4.34Å; I982-L998 HydrophobicContact CG2-CD2 3.72Å; V983-L998 HydrophobicContact CG2-CD2 3.72Å; K994-L998 WeakPolarHBondContact O-CB 3.5Å; K994-L998 PolarHBondContact O-N 3.26Å; I996-L998 VanDerWaalsContact C-N 3.26Å; I996-L998 PolarHBondContact O-N 2.73Å; L998-N1000 VanDerWaalsContact C-N 3.3Å; L998-N1000 PolarHBondContact O-N 2.98Å; L998-L1001 HydrophobicContact CD1-CD2 4.36Å; L998-L1001 WeakPolarHBondContact O-CB 3.49Å; L998-L1001 PolarHBondContact O-N 3.28Å; L998-I1002 HydrophobicContact CG-CD1 4.08Å; L998-I1002 WeakPolarHBondContact O-CG1 3.41Å; L998-I1002 PolarHBondContact O-N 2.74Å; L998-I1002 VanDerWaalsContact O-N 3.09Å
999	S	89.5	Confident	87.5	Confident	28 Å²	28	49.9 Å²	49.9	20%	0.196	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-34.5	177.5	79.3	0	0	0	0	112.6	C995 I996 E997 I1002 V1003	C995-S999 PolarHBondContact O-N 3.19Å; I996-S999 WeakPolarHBondContact O-CB 3.15Å; I996-S999 PolarHBondContact O-N 3.02Å; I996-S999 PolarHBondContact O-OG 3Å; E997-S999 PolarHBondContact O-N 2.86Å; S999-I1002 PolarHBondContact O-N 3.22Å; S999-V1003 WeakPolarHBondContact O-CG2 3.41Å; S999-V1003 PolarHBondContact O-N 3.07Å
1000	N	89	Confident	87.5	Confident	110 Å²	110	51.8 Å²	51.8	59%	0.588	27%	0.272	S	S	*	.	H	α-helix	trans	-65.7	-42.7	174.3	-64.8	-30.8	0	0	0	110.8	I996 E997 L998 I1002 V1003 D1004	I996-N1000 PolarHBondContact O-N 3.22Å; E997-N1000 WeakPolarHBondContact O-CB 3.27Å; E997-N1000 PolarHBondContact O-N 3.23Å; E997-N1000 VanDerWaalsContact O-N 3.12Å; L998-N1000 VanDerWaalsContact C-N 3.3Å; L998-N1000 PolarHBondContact O-N 2.98Å; N1000-I1002 VanDerWaalsContact C-N 3.31Å; N1000-I1002 PolarHBondContact O-N 3.1Å; N1000-V1003 PolarHBondContact O-N 3.47Å; N1000-D1004 PolarHBondContact O-N 2.85Å
1001	L	89.4	Confident	87.6	Confident	31 Å²	31	57.9 Å²	57.9	16%	0.162	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-37.6	177.7	-177.2	65	0	0	0	112.4	L872 L875 T876 E997 L998 D1004 Y1007 L1009	L872-L1001 HydrophobicContact CD2-CD2 3.98Å; L875-L1001 HydrophobicContact CB-CD2 4.03Å; L875-L1001 HydrophobicContact CD1-CD2 4.21Å; T876-L1001 HydrophobicContact CG2-CD1 4Å; T876-L1001 HydrophobicContact CG2-CD2 4.02Å; E997-L1001 PolarHBondContact O-N 2.74Å; L998-L1001 HydrophobicContact CD1-CD2 4.36Å; L998-L1001 WeakPolarHBondContact O-CB 3.49Å; L998-L1001 PolarHBondContact O-N 3.28Å; L1001-D1004 WeakPolarHBondContact O-CB 3.31Å; L1001-D1004 PolarHBondContact O-N 2.66Å; L1001-Y1007 HydrophobicContact CD1-CD2 3.89Å; L1001-Y1007 HydrophobicContact CD1-CE2 3.83Å; L1001-L1009 HydrophobicContact CG-CD1 4.49Å
1002	I	88.6	Confident	87.6	Confident	4 Å²	4	57 Å²	57	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-69.1	-36.9	-179.7	-67	165	0	0	0	111.7	V979 L998 S999 N1000 D1004 F1010 F1013 L1021	V979-I1002 HydrophobicContact CB-CD1 4.49Å; V979-I1002 HydrophobicContact CG1-CD1 3.51Å; V979-I1002 HydrophobicContact CG2-CD1 4.13Å; V979-I1002 HydrophobicContact CG2-CG1 4.34Å; L998-I1002 HydrophobicContact CG-CD1 4.08Å; L998-I1002 WeakPolarHBondContact O-CG1 3.41Å; L998-I1002 PolarHBondContact O-N 2.74Å; L998-I1002 VanDerWaalsContact O-N 3.09Å; S999-I1002 PolarHBondContact O-N 3.22Å; N1000-I1002 VanDerWaalsContact C-N 3.31Å; N1000-I1002 PolarHBondContact O-N 3.1Å; I1002-D1004 VanDerWaalsContact C-N 3.3Å; I1002-F1010 HydrophobicContact CG2-CB 4.33Å; I1002-F1010 WeakPolarHBondContact O-CB 3.44Å; I1002-F1010 PolarHBondContact O-N 3.33Å; I1002-F1013 HydrophobicContact CG2-CD2 4.43Å; I1002-F1013 HydrophobicContact CG2-CE2 4.01Å; I1002-L1021 HydrophobicContact CD1-CD1 4.42Å; I1002-L1021 HydrophobicContact CD1-CD2 3.55Å; I1002-L1021 HydrophobicContact CG2-CD2 4.44Å
1003	V	88	Confident	87.6	Confident	98 Å²	98	57.1 Å²	57.1	59%	0.594	29%	0.285	S	S	*	.	H	α-helix	trans	-81.2	-13.7	-179.7	179.4	0	0	0	0	111.8	S999 N1000 N1005	S999-V1003 WeakPolarHBondContact O-CG2 3.41Å; S999-V1003 PolarHBondContact O-N 3.07Å; N1000-V1003 PolarHBondContact O-N 3.47Å; V1003-N1005 PolarHBondContact O-N 2.96Å
1004	D	87.6	Confident	87.5	Confident	62 Å²	62	56 Å²	56	33%	0.332	28%	0.284	S	S	.	.			trans	-57.1	125.8	-179.6	-160.3	-28.3	0	0	0	111.6	N1000 L1001 I1002 E1006 Y1007 G1008	N1000-D1004 PolarHBondContact O-N 2.85Å; L1001-D1004 WeakPolarHBondContact O-CB 3.31Å; L1001-D1004 PolarHBondContact O-N 2.66Å; I1002-D1004 VanDerWaalsContact C-N 3.3Å; D1004-E1006 PolarHBondContact O-N 3.41Å; D1004-E1006 WeakPolarHBondContact OD1-CB 3.38Å; D1004-E1006 PolarHBondContact OD1-N 3.17Å; D1004-Y1007 HydrophobicContact CB-CD2 4.19Å; D1004-G1008 PolarHBondContact O-N 3.45Å
1005	N	83.5	Confident	87.4	Confident	137 Å²	137	55.8 Å²	55.8	73%	0.733	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-22	180	-74.8	-41.3	0	0	0	112.4	V1003	V1003-N1005 PolarHBondContact O-N 2.96Å
1006	E	83.2	Confident	87.4	Confident	136 Å²	136	60.3 Å²	60.3	64%	0.636	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-45.9	178.2	-174.2	174.9	-174.3	0	0	111.3	D1004	D1004-E1006 PolarHBondContact O-N 3.41Å; D1004-E1006 WeakPolarHBondContact OD1-CB 3.38Å; D1004-E1006 PolarHBondContact OD1-N 3.17Å
1007	Y	81	Confident	87.4	Confident	61 Å²	61	62.1 Å²	62.1	24%	0.239	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-26.7	-179.3	-55	-77	0	0	0	112.7	L875 L1001 D1004 L1009	L875-Y1007 WeakPolarHBondContact O-CD1 3.43Å; L1001-Y1007 HydrophobicContact CD1-CD2 3.89Å; L1001-Y1007 HydrophobicContact CD1-CE2 3.83Å; D1004-Y1007 HydrophobicContact CB-CD2 4.19Å; Y1007-L1009 PolarHBondContact O-N 3.02Å
1008	G	83.6	Confident	87.4	Confident	10 Å²	10	60.4 Å²	60.4	10%	0.103	33%	0.329	C	S	.	.			trans	61.8	27.6	177.2	0	0	0	0	0	114.1	D1004 F1010 K1011	D1004-G1008 PolarHBondContact O-N 3.45Å; G1008-F1010 VanDerWaalsContact C-N 3.29Å; G1008-F1010 PolarHBondContact O-N 2.92Å; G1008-K1011 WeakPolarHBondContact O-CB 3.49Å; G1008-K1011 PolarHBondContact O-N 2.97Å
1009	L	87.7	Confident	87.4	Confident	5 Å²	5	67 Å²	67	3%	0.026	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-62.7	-33.6	-172.3	-60.9	172.7	0	0	0	112.4	L875 I975 L1001 Y1007 K1011 L1012 F1013	L875-L1009 HydrophobicContact CB-CD1 3.93Å; L875-L1009 HydrophobicContact CD2-CD1 4.29Å; I975-L1009 HydrophobicContact CD1-CD2 4.3Å; I975-L1009 HydrophobicContact CG2-CD2 4.09Å; L1001-L1009 HydrophobicContact CG-CD1 4.49Å; Y1007-L1009 PolarHBondContact O-N 3.02Å; L1009-K1011 PolarHBondContact O-N 2.87Å; L1009-L1012 WeakPolarHBondContact O-CB 3.38Å; L1009-L1012 PolarHBondContact O-N 3.46Å; L1009-F1013 WeakPolarHBondContact O-CD2 3.37Å
1010	F	86.5	Confident	87.5	Confident	69 Å²	69	69.2 Å²	69.2	30%	0.303	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-55.4	-24.9	177	67.8	-90.8	0	0	0	113.9	I1002 G1008 L1012 F1013	I1002-F1010 HydrophobicContact CG2-CB 4.33Å; I1002-F1010 WeakPolarHBondContact O-CB 3.44Å; I1002-F1010 PolarHBondContact O-N 3.33Å; G1008-F1010 VanDerWaalsContact C-N 3.29Å; G1008-F1010 PolarHBondContact O-N 2.92Å; F1010-L1012 PolarHBondContact O-N 3.27Å; F1010-F1013 PolarHBondContact O-N 3.47Å
1011	K	87.9	Confident	87.6	Confident	163 Å²	163	64.4 Å²	64.4	71%	0.709	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-71	-16.1	178.2	-61.9	178.8	-177.8	171.6	0	113.3	G1008 L1009	G1008-K1011 WeakPolarHBondContact O-CB 3.49Å; G1008-K1011 PolarHBondContact O-N 2.97Å; L1009-K1011 PolarHBondContact O-N 2.87Å
1012	L	87.8	Confident	87.6	Confident	18 Å²	18	67.8 Å²	67.8	9%	0.094	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-89.3	-7.2	-179.9	-60	173.5	0	0	0	112.9	R971 E972 I975 T976 L1009 F1010	R971-L1012 HydrophobicContact CG-CD1 4.03Å; R971-L1012 HydrophobicContact CG-CD2 4.29Å; E972-L1012 WeakPolarHBondContact CG-O 3.38Å; I975-L1012 HydrophobicContact CB-CD1 4.09Å; I975-L1012 HydrophobicContact CD1-CD1 3.58Å; I975-L1012 HydrophobicContact CG1-CD1 4.37Å; I975-L1012 HydrophobicContact CG2-CD1 3.95Å; T976-L1012 WeakPolarHBondContact CG2-O 3.47Å; L1009-L1012 WeakPolarHBondContact O-CB 3.38Å; L1009-L1012 PolarHBondContact O-N 3.46Å; F1010-L1012 PolarHBondContact O-N 3.27Å
1013	F	89.2	Confident	87.8	Confident	19 Å²	19	72.5 Å²	72.5	8%	0.083	38%	0.383	C	S	.	.	S	Bend	trans	-93.4	132.1	-179.1	-74.8	-102.2	0	0	0	110.8	T976 V979 F980 I1002 L1009 F1010 Q1017 L1018 L1021	T976-F1013 HydrophobicContact CG2-CD1 3.89Å; T976-F1013 HydrophobicContact CG2-CD2 4.05Å; T976-F1013 HydrophobicContact CG2-CE1 3.92Å; T976-F1013 HydrophobicContact CG2-CE2 4.08Å; T976-F1013 HydrophobicContact CG2-CG 3.95Å; T976-F1013 HydrophobicContact CG2-CZ 4Å; V979-F1013 HydrophobicContact CB-CZ 3.91Å; V979-F1013 HydrophobicContact CG1-CE1 4.37Å; V979-F1013 HydrophobicContact CG1-CZ 3.92Å; V979-F1013 HydrophobicContact CG2-CZ 3.91Å; F980-F1013 HydrophobicContact CE2-CE1 4.3Å; I1002-F1013 HydrophobicContact CG2-CD2 4.43Å; I1002-F1013 HydrophobicContact CG2-CE2 4.01Å; L1009-F1013 WeakPolarHBondContact O-CD2 3.37Å; F1010-F1013 PolarHBondContact O-N 3.47Å; F1013-Q1017 HydrophobicContact CD1-CB 3.94Å; F1013-L1018 HydrophobicContact CB-CB 4.35Å; F1013-L1018 HydrophobicContact CB-CD1 3.6Å; F1013-L1018 HydrophobicContact CG-CD1 4.1Å; F1013-L1021 HydrophobicContact CE1-CD2 4.15Å; F1013-L1021 HydrophobicContact CZ-CD2 4.41Å
1014	S	87.8	Confident	87.9	Confident	46 Å²	46	70 Å²	70	32%	0.322	37%	0.365	S	S	.	.			trans	-68.8	154.5	163.7	66.7	0	0	0	0	110.9	P1016 Q1017 L1018	S1014-P1016 VanDerWaalsContact C-N 3.34Å; S1014-Q1017 PolarHBondContact O-N 3Å; S1014-Q1017 WeakPolarHBondContact OG-CG 3.44Å; S1014-Q1017 PolarHBondContact OG-N 3.24Å; S1014-Q1017 PolarHBondContact OG-OE1 2.78Å; S1014-L1018 PolarHBondContact O-N 2.62Å
1015	G	87	Confident	88.1	Confident	51 Å²	51	67.7 Å²	67.7	53%	0.526	35%	0.352	S	S	.	.	H	α-helix	trans	-49	-46.5	177.3	0	0	0	0	0	114.3	L1018 Q1019	G1015-L1018 PolarHBondContact O-N 3.08Å; G1015-Q1019 WeakPolarHBondContact O-CG 3.47Å; G1015-Q1019 PolarHBondContact O-N 3.19Å; G1015-Q1019 VanDerWaalsContact O-N 3.11Å
1016	P	89.1	Confident	88.4	Confident	95 Å²	95	63.9 Å²	63.9	62%	0.617	34%	0.336	S	S	*	.	H	α-helix	trans	-64.4	-39	175.4	-23.7	34.7	0	0	0	114	S1014 L1018 Q1019 N1020	S1014-P1016 VanDerWaalsContact C-N 3.34Å; P1016-L1018 VanDerWaalsContact C-N 3.34Å; P1016-Q1019 PolarHBondContact O-N 3.32Å; P1016-N1020 WeakPolarHBondContact O-CB 3.4Å; P1016-N1020 PolarHBondContact O-N 3.34Å
1017	Q	88.9	Confident	88.7	Confident	54 Å²	54	61.5 Å²	61.5	25%	0.252	33%	0.325	S	S	.	.	H	α-helix	trans	-65.8	-39.8	177.2	-72.7	166.8	-41.8	0	0	111.2	F980 F1013 S1014 Q1019 N1020 L1021	F980-Q1017 HydrophobicContact CE2-CB 4.43Å; F1013-Q1017 HydrophobicContact CD1-CB 3.94Å; S1014-Q1017 PolarHBondContact O-N 3Å; S1014-Q1017 WeakPolarHBondContact OG-CG 3.44Å; S1014-Q1017 PolarHBondContact OG-N 3.24Å; S1014-Q1017 PolarHBondContact OG-OE1 2.78Å; Q1017-Q1019 VanDerWaalsContact C-N 3.34Å; Q1017-Q1019 PolarHBondContact O-N 2.99Å; Q1017-N1020 PolarHBondContact O-N 2.94Å; Q1017-L1021 WeakPolarHBondContact O-CB 3.16Å; Q1017-L1021 PolarHBondContact O-N 3.48Å
1018	L	89.8	Confident	89.2	Confident	65 Å²	65	58.6 Å²	58.6	34%	0.34	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-39.3	177.7	-149.3	110.7	0	0	0	111.4	F1013 S1014 G1015 P1016 L1021 L1022	F1013-L1018 HydrophobicContact CB-CB 4.35Å; F1013-L1018 HydrophobicContact CB-CD1 3.6Å; F1013-L1018 HydrophobicContact CG-CD1 4.1Å; S1014-L1018 PolarHBondContact O-N 2.62Å; G1015-L1018 PolarHBondContact O-N 3.08Å; P1016-L1018 VanDerWaalsContact C-N 3.34Å; L1018-L1021 PolarHBondContact O-N 3.47Å; L1018-L1022 HydrophobicContact CD2-CD1 4.47Å; L1018-L1022 WeakPolarHBondContact O-CG 3.13Å; L1018-L1022 PolarHBondContact O-N 2.83Å
1019	Q	90.6	Very high	89.4	Confident	146 Å²	146	60.5 Å²	60.5	68%	0.682	32%	0.321	S	S	*	.	H	α-helix	trans	-62.2	-42.7	172.2	-74.5	179.4	-3.2	0	0	112.2	G1015 P1016 Q1017 L1022 H1023	G1015-Q1019 WeakPolarHBondContact O-CG 3.47Å; G1015-Q1019 PolarHBondContact O-N 3.19Å; G1015-Q1019 VanDerWaalsContact O-N 3.11Å; P1016-Q1019 PolarHBondContact O-N 3.32Å; Q1017-Q1019 VanDerWaalsContact C-N 3.34Å; Q1017-Q1019 PolarHBondContact O-N 2.99Å; Q1019-L1022 PolarHBondContact O-N 2.9Å; Q1019-H1023 PolarHBondContact O-N 2.94Å
1020	N	91	Very high	89.5	Confident	74 Å²	74	64.9 Å²	64.9	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-66.2	-39	178.1	-167	34.4	0	0	0	112.1	F980 P1016 Q1017 H1023 H1024	F980-N1020 HydrophobicContact CE1-CB 4.37Å; F980-N1020 HydrophobicContact CZ-CB 4.27Å; P1016-N1020 WeakPolarHBondContact O-CB 3.4Å; P1016-N1020 PolarHBondContact O-N 3.34Å; Q1017-N1020 PolarHBondContact O-N 2.94Å; N1020-H1023 WeakPolarHBondContact O-CB 3.17Å; N1020-H1023 PolarHBondContact O-N 3.03Å; N1020-H1024 PolarHBondContact O-CD2 2.82Å; N1020-H1024 PolarHBondContact O-N 2.98Å; N1020-H1024 VanDerWaalsContact O-N 3.1Å
1021	L	90.6	Very high	89.5	Confident	8 Å²	8	66.9 Å²	66.9	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-61.9	-46.2	173.8	178.1	65.6	0	0	0	111.3	V979 F980 V983 I1002 F1013 Q1017 L1018 H1023 H1024 I1025	V979-L1021 HydrophobicContact CG1-CD1 3.81Å; V979-L1021 HydrophobicContact CG1-CD2 4.4Å; F980-L1021 HydrophobicContact CE1-CB 4.2Å; F980-L1021 HydrophobicContact CZ-CB 4.21Å; V983-L1021 HydrophobicContact CG2-CD1 3.89Å; I1002-L1021 HydrophobicContact CD1-CD1 4.42Å; I1002-L1021 HydrophobicContact CD1-CD2 3.55Å; I1002-L1021 HydrophobicContact CG2-CD2 4.44Å; F1013-L1021 HydrophobicContact CE1-CD2 4.15Å; F1013-L1021 HydrophobicContact CZ-CD2 4.41Å; Q1017-L1021 WeakPolarHBondContact O-CB 3.16Å; Q1017-L1021 PolarHBondContact O-N 3.48Å; L1018-L1021 PolarHBondContact O-N 3.47Å; L1021-H1023 PolarHBondContact O-N 3.05Å; L1021-H1024 PolarHBondContact O-N 3.32Å; L1021-I1025 HydrophobicContact CD1-CD1 4.26Å; L1021-I1025 HydrophobicContact CG-CD1 3.91Å; L1021-I1025 WeakPolarHBondContact O-CG1 3.03Å; L1021-I1025 PolarHBondContact O-N 3.17Å
1022	L	90.8	Very high	89.5	Confident	102 Å²	102	59.4 Å²	59.4	53%	0.534	32%	0.316	S	S	.	.	H	α-helix	trans	-60.2	-35.4	175.3	-73.9	170.6	0	0	0	111.9	L1018 Q1019 I1025 S1026	L1018-L1022 HydrophobicContact CD2-CD1 4.47Å; L1018-L1022 WeakPolarHBondContact O-CG 3.13Å; L1018-L1022 PolarHBondContact O-N 2.83Å; Q1019-L1022 PolarHBondContact O-N 2.9Å; L1022-I1025 PolarHBondContact O-N 2.81Å; L1022-S1026 WeakPolarHBondContact O-CB 3.47Å; L1022-S1026 PolarHBondContact O-N 2.91Å
1023	H	92.2	Very high	89.4	Confident	103 Å²	103	62.3 Å²	62.3	48%	0.477	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-50.1	174	-173.8	57.2	0	0	0	111.6	Q1019 N1020 L1021 I1025 S1026 E1027	Q1019-H1023 PolarHBondContact O-N 2.94Å; N1020-H1023 WeakPolarHBondContact O-CB 3.17Å; N1020-H1023 PolarHBondContact O-N 3.03Å; L1021-H1023 PolarHBondContact O-N 3.05Å; H1023-I1025 VanDerWaalsContact C-N 3.32Å; H1023-I1025 PolarHBondContact O-N 2.87Å; H1023-S1026 WeakPolarHBondContact O-CA 3.27Å; H1023-S1026 WeakPolarHBondContact O-CB 3.42Å; H1023-S1026 PolarHBondContact O-N 3.35Å; H1023-S1026 PolarHBondContact O-OG 3.32Å; H1023-E1027 IonicContact NE2-OE1 3.14Å; H1023-E1027 WeakPolarHBondContact O-CG 3.41Å; H1023-E1027 PolarHBondContact O-N 2.74Å
1024	H	91	Very high	89.3	Confident	46 Å²	46	66.6 Å²	66.6	21%	0.213	35%	0.354	C	S	.	.	H	α-helix	trans	-65.5	-32.4	177.5	-71.6	-53.6	0	0	0	114.2	F980 V983 Q987 N1020 L1021 E1027 S1028	F980-H1024 AromaticContact CE1-CD2 4Å; V983-H1024 HydrophobicContact CG1-CB 3.66Å; Q987-H1024 PolarHBondContact NE2-O 3.34Å; Q987-H1024 VanDerWaalsContact NE2-O 3.12Å; N1020-H1024 PolarHBondContact O-CD2 2.82Å; N1020-H1024 PolarHBondContact O-N 2.98Å; N1020-H1024 VanDerWaalsContact O-N 3.1Å; L1021-H1024 PolarHBondContact O-N 3.32Å; H1024-E1027 IonicContact CE1-OE2 2.81Å; H1024-E1027 IonicContact CG-OE2 3.79Å; H1024-E1027 IonicContact ND1-OE2 3.62Å; H1024-E1027 PolarHBondContact ND1-OE2 3.4Å; H1024-S1028 PolarHBondContact O-N 3.3Å; H1024-S1028 VanDerWaalsContact O-N 3.14Å; H1024-S1028 PolarHBondContact O-OG 3.4Å
1025	I	90.4	Very high	89.1	Confident	13 Å²	13	68.5 Å²	68.5	7%	0.067	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-42.8	171.2	-66.2	162.8	0	0	0	109.6	L1021 L1022 H1023 E1027 S1028 I1029	L1021-I1025 HydrophobicContact CD1-CD1 4.26Å; L1021-I1025 HydrophobicContact CG-CD1 3.91Å; L1021-I1025 WeakPolarHBondContact O-CG1 3.03Å; L1021-I1025 PolarHBondContact O-N 3.17Å; L1022-I1025 PolarHBondContact O-N 2.81Å; H1023-I1025 VanDerWaalsContact C-N 3.32Å; H1023-I1025 PolarHBondContact O-N 2.87Å; I1025-E1027 VanDerWaalsContact C-N 3.34Å; I1025-E1027 PolarHBondContact O-N 3.21Å; I1025-S1028 WeakPolarHBondContact O-CA 3.23Å; I1025-S1028 WeakPolarHBondContact O-CB 3.46Å; I1025-S1028 PolarHBondContact O-N 3.37Å; I1025-I1029 HydrophobicContact CG2-CD1 3.97Å; I1025-I1029 HydrophobicContact CG2-CG1 4.43Å; I1025-I1029 WeakPolarHBondContact O-CG1 3.05Å; I1025-I1029 PolarHBondContact O-N 3.02Å
1026	S	90.1	Very high	88.9	Confident	58 Å²	58	74.2 Å²	74.2	41%	0.406	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-38	177.4	76.6	0	0	0	0	112.9	L1022 H1023 S1028 I1029 Q1030	L1022-S1026 WeakPolarHBondContact O-CB 3.47Å; L1022-S1026 PolarHBondContact O-N 2.91Å; H1023-S1026 WeakPolarHBondContact O-CA 3.27Å; H1023-S1026 WeakPolarHBondContact O-CB 3.42Å; H1023-S1026 PolarHBondContact O-N 3.35Å; H1023-S1026 PolarHBondContact O-OG 3.32Å; S1026-S1028 VanDerWaalsContact C-N 3.27Å; S1026-S1028 PolarHBondContact O-N 2.73Å; S1026-I1029 PolarHBondContact O-N 3.36Å; S1026-Q1030 PolarHBondContact O-N 2.93Å
1027	E	90.7	Very high	88.6	Confident	86 Å²	86	72.6 Å²	72.6	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-38.8	172.1	-68.7	179.6	135.7	0	0	111.3	H1023 H1024 I1025 Q1030 Y1031	H1023-E1027 IonicContact NE2-OE1 3.14Å; H1023-E1027 WeakPolarHBondContact O-CG 3.41Å; H1023-E1027 PolarHBondContact O-N 2.74Å; H1024-E1027 IonicContact CE1-OE2 2.81Å; H1024-E1027 IonicContact CG-OE2 3.79Å; H1024-E1027 IonicContact ND1-OE2 3.62Å; H1024-E1027 PolarHBondContact ND1-OE2 3.4Å; I1025-E1027 VanDerWaalsContact C-N 3.34Å; I1025-E1027 PolarHBondContact O-N 3.21Å; E1027-Q1030 PolarHBondContact O-N 3.39Å; E1027-Y1031 PolarHBondContact O-N 3.2Å
1028	S	90.4	Very high	88.4	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-70.1	-38.9	178.1	-55.8	0	0	0	0	112.1	Q987 H992 H1024 I1025 S1026 Y1031 L1032	Q987-S1028 PolarHBondContact NE2-OG 3.1Å; H992-S1028 WeakPolarHBondContact ND1-CA 3.39Å; H992-S1028 WeakPolarHBondContact ND1-CB 3.45Å; H992-S1028 PolarHBondContact ND1-OG 3.16Å; H1024-S1028 PolarHBondContact O-N 3.3Å; H1024-S1028 VanDerWaalsContact O-N 3.14Å; H1024-S1028 PolarHBondContact O-OG 3.4Å; I1025-S1028 WeakPolarHBondContact O-CA 3.23Å; I1025-S1028 WeakPolarHBondContact O-CB 3.46Å; I1025-S1028 PolarHBondContact O-N 3.37Å; S1026-S1028 VanDerWaalsContact C-N 3.27Å; S1026-S1028 PolarHBondContact O-N 2.73Å; S1028-Y1031 PolarHBondContact O-N 3.34Å; S1028-L1032 WeakPolarHBondContact O-CG 3.17Å; S1028-L1032 PolarHBondContact O-N 2.76Å; S1028-L1032 VanDerWaalsContact O-N 3.12Å
1029	I	88.2	Confident	88	Confident	50 Å²	50	72.3 Å²	72.3	26%	0.256	36%	0.362	S	S	.	.	H	α-helix	trans	-62.9	-44.7	173.3	-68.9	168.5	0	0	0	110.5	I996 I1025 S1026 Y1031 L1032 I1033 P1039	I996-I1029 HydrophobicContact CD1-CG1 4.07Å; I996-I1029 HydrophobicContact CG1-CG1 4.22Å; I1025-I1029 HydrophobicContact CG2-CD1 3.97Å; I1025-I1029 HydrophobicContact CG2-CG1 4.43Å; I1025-I1029 WeakPolarHBondContact O-CG1 3.05Å; I1025-I1029 PolarHBondContact O-N 3.02Å; S1026-I1029 PolarHBondContact O-N 3.36Å; I1029-Y1031 VanDerWaalsContact C-N 3.29Å; I1029-Y1031 PolarHBondContact O-N 3.45Å; I1029-L1032 PolarHBondContact O-N 3.18Å; I1029-L1032 VanDerWaalsContact O-N 3.14Å; I1029-I1033 HydrophobicContact CG2-CD1 3.77Å; I1029-I1033 HydrophobicContact CG2-CG1 4.39Å; I1029-I1033 WeakPolarHBondContact O-CG1 3.24Å; I1029-I1033 PolarHBondContact O-N 3.44Å; I1029-P1039 HydrophobicContact CG2-CB 3.84Å
1030	Q	88.8	Confident	87.4	Confident	97 Å²	97	69.9 Å²	69.9	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-60.1	-42.1	177.4	-172.3	61.3	51.8	0	0	111.1	S1026 E1027 L1032 I1033 D1034	S1026-Q1030 PolarHBondContact O-N 2.93Å; E1027-Q1030 PolarHBondContact O-N 3.39Å; Q1030-L1032 VanDerWaalsContact C-N 3.32Å; Q1030-L1032 PolarHBondContact O-N 2.71Å; Q1030-I1033 PolarHBondContact O-N 3.26Å; Q1030-D1034 PolarHBondContact NE2-OD1 2.96Å; Q1030-D1034 WeakPolarHBondContact O-CB 2.88Å; Q1030-D1034 PolarHBondContact O-N 2.95Å
1031	Y	88.2	Confident	86.6	Confident	110 Å²	110	66.6 Å²	66.6	43%	0.431	34%	0.337	S	S	.	.	H	α-helix	trans	-60.9	-38.7	175.6	-173.6	-85.7	0	0	0	112.9	H992 E1027 S1028 I1029 N1035	H992-Y1031 HydrophobicContact CB-CD1 4.25Å; H992-Y1031 AromaticContact CD2-CD1 2.97Å; H992-Y1031 WeakPolarHBondContact CD2-CD1 3.16Å; H992-Y1031 AromaticContact CD2-CE1 3.29Å; H992-Y1031 WeakPolarHBondContact CD2-CE1 3.43Å; H992-Y1031 AromaticContact CD2-CG 3.47Å; H992-Y1031 VanDerWaalsContact CD2-CG 3.47Å; H992-Y1031 AromaticContact CE1-CG 3.86Å; H992-Y1031 AromaticContact CG-CD1 3.62Å; H992-Y1031 AromaticContact CG-CG 3.97Å; H992-Y1031 AromaticContact NE2-CD1 3.41Å; H992-Y1031 WeakPolarHBondContact NE2-CD1 3.2Å; H992-Y1031 AromaticContact NE2-CD2 3.71Å; H992-Y1031 AromaticContact NE2-CE1 3.66Å; H992-Y1031 AromaticContact NE2-CE2 3.96Å; H992-Y1031 AromaticContact NE2-CG 3.41Å; H992-Y1031 AromaticContact NE2-CZ 3.92Å; E1027-Y1031 PolarHBondContact O-N 3.2Å; S1028-Y1031 PolarHBondContact O-N 3.34Å; I1029-Y1031 VanDerWaalsContact C-N 3.29Å; I1029-Y1031 PolarHBondContact O-N 3.45Å; Y1031-N1035 VanDerWaalsContact CD1-ND2 3.31Å; Y1031-N1035 WeakPolarHBondContact CD1-ND2 3.37Å; Y1031-N1035 WeakPolarHBondContact CE1-ND2 3.13Å; Y1031-N1035 PolarHBondContact O-N 3.04Å; Y1031-N1035 PolarHBondContact O-ND2 3.24Å
1032	L	87.1	Confident	86.2	Confident	7 Å²	7	73 Å²	73	4%	0.037	36%	0.362	C	S	.	.	H	α-helix	trans	-68	-43.2	177.4	-65.3	166.2	0	0	0	111.2	H992 I996 S1028 I1029 Q1030 D1034 N1035 Q1037	H992-L1032 HydrophobicContact CB-CD1 4.26Å; H992-L1032 HydrophobicContact CB-CD2 3.86Å; H992-L1032 HydrophobicContact CB-CG 3.87Å; I996-L1032 HydrophobicContact CD1-CD1 3.35Å; S1028-L1032 WeakPolarHBondContact O-CG 3.17Å; S1028-L1032 PolarHBondContact O-N 2.76Å; S1028-L1032 VanDerWaalsContact O-N 3.12Å; I1029-L1032 PolarHBondContact O-N 3.18Å; I1029-L1032 VanDerWaalsContact O-N 3.14Å; Q1030-L1032 VanDerWaalsContact C-N 3.32Å; Q1030-L1032 PolarHBondContact O-N 2.71Å; L1032-D1034 VanDerWaalsContact C-N 3.35Å; L1032-D1034 PolarHBondContact O-N 3.02Å; L1032-N1035 CarbonylContact O-C 3.32Å; L1032-N1035 PolarHBondContact O-N 3.29Å; L1032-N1035 VanDerWaalsContact O-N 3.08Å; L1032-Q1037 HydrophobicContact CB-CB 4.29Å; L1032-Q1037 WeakPolarHBondContact O-CB 3.36Å; L1032-Q1037 PolarHBondContact O-N 3.12Å; L1032-Q1037 VanDerWaalsContact O-N 3.08Å
1033	I	86	Confident	85.4	Confident	78 Å²	78	72.4 Å²	72.4	40%	0.4	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-43.9	176.6	-66.6	168.7	0	0	0	111	I1029 Q1030 N1035 E1036 P1039	I1029-I1033 HydrophobicContact CG2-CD1 3.77Å; I1029-I1033 HydrophobicContact CG2-CG1 4.39Å; I1029-I1033 WeakPolarHBondContact O-CG1 3.24Å; I1029-I1033 PolarHBondContact O-N 3.44Å; Q1030-I1033 PolarHBondContact O-N 3.26Å; I1033-N1035 PolarHBondContact O-N 3.45Å; I1033-N1035 VanDerWaalsContact O-N 3.15Å; I1033-E1036 PolarHBondContact O-N 3.16Å; I1033-E1036 VanDerWaalsContact O-N 3.16Å; I1033-P1039 HydrophobicContact CD1-CG 4.33Å
1034	D	86.6	Confident	84.2	Confident	110 Å²	110	72.3 Å²	72.3	59%	0.588	37%	0.369	S	S	*	.	H	α-helix	trans	-63.4	-18.6	178.1	-69	-11.1	0	0	0	112.5	Q1030 L1032	Q1030-D1034 PolarHBondContact NE2-OD1 2.96Å; Q1030-D1034 WeakPolarHBondContact O-CB 2.88Å; Q1030-D1034 PolarHBondContact O-N 2.95Å; L1032-D1034 VanDerWaalsContact C-N 3.35Å; L1032-D1034 PolarHBondContact O-N 3.02Å
1035	N	83	Confident	82.8	Confident	85 Å²	85	81.5 Å²	81.5	46%	0.455	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	27.3	177.3	-69.4	-61.4	0	0	0	113.6	Y1031 L1032 I1033 Q1037	Y1031-N1035 VanDerWaalsContact CD1-ND2 3.31Å; Y1031-N1035 WeakPolarHBondContact CD1-ND2 3.37Å; Y1031-N1035 WeakPolarHBondContact CE1-ND2 3.13Å; Y1031-N1035 PolarHBondContact O-N 3.04Å; Y1031-N1035 PolarHBondContact O-ND2 3.24Å; L1032-N1035 CarbonylContact O-C 3.32Å; L1032-N1035 PolarHBondContact O-N 3.29Å; L1032-N1035 VanDerWaalsContact O-N 3.08Å; I1033-N1035 PolarHBondContact O-N 3.45Å; I1033-N1035 VanDerWaalsContact O-N 3.15Å; N1035-Q1037 PolarHBondContact O-N 3.38Å
1036	E	82.8	Confident	82.4	Confident	172 Å²	172	84.9 Å²	84.9	80%	0.804	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	25.4	175.9	-55.7	-178.9	171.5	0	0	114.6	I1033	I1033-E1036 PolarHBondContact O-N 3.16Å; I1033-E1036 VanDerWaalsContact O-N 3.16Å
1037	Q	83.3	Confident	82	Confident	61 Å²	61	86.3 Å²	86.3	29%	0.285	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-104.2	158.9	172	-62.6	-178.6	-20.6	0	0	110.9	L1032 N1035 Y1042	L1032-Q1037 HydrophobicContact CB-CB 4.29Å; L1032-Q1037 WeakPolarHBondContact O-CB 3.36Å; L1032-Q1037 PolarHBondContact O-N 3.12Å; L1032-Q1037 VanDerWaalsContact O-N 3.08Å; N1035-Q1037 PolarHBondContact O-N 3.38Å; Q1037-Y1042 CarbonylContact C-O 3.46Å; Q1037-Y1042 WeakPolarHBondContact CA-O 3.25Å
1038	D	85.4	Confident	81.6	Confident	46 Å²	46	86.3 Å²	86.3	25%	0.246	43%	0.431	C	S	.	.			trans	-69.9	169	170.7	83.5	-7.3	0	0	0	110.6	L1040 G1041 Y1042 V1044	D1038-L1040 PolarHBondContact O-N 3.48Å; D1038-L1040 VanDerWaalsContact OD1-C 3.29Å; D1038-L1040 WeakPolarHBondContact OD1-CA 3.17Å; D1038-L1040 WeakPolarHBondContact OD1-CB 3.11Å; D1038-L1040 PolarHBondContact OD1-N 3.05Å; D1038-G1041 PolarHBondContact O-N 3.41Å; D1038-G1041 PolarHBondContact OD1-N 3.3Å; D1038-Y1042 PolarHBondContact N-O 3.2Å; D1038-Y1042 PolarHBondContact OD1-N 3.39Å; D1038-V1044 HydrophobicContact CB-CG2 3.92Å
1039	P	80.6	Confident	81	Confident	67 Å²	67	91.4 Å²	91.4	44%	0.435	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-9.8	178.3	-26.8	36.4	0	0	0	115.4	I996 I1029 I1033	I996-P1039 WeakPolarHBondContact CD1-O 3.32Å; I1029-P1039 HydrophobicContact CG2-CB 3.84Å; I1033-P1039 HydrophobicContact CD1-CG 4.33Å
1040	L	78.4	Confident	80.6	Confident	95 Å²	95	94 Å²	94	50%	0.497	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-2	178.2	-61.4	174.7	0	0	0	112.5	I996 D1038 Y1042	I996-L1040 HydrophobicContact CG2-CD2 4.1Å; D1038-L1040 PolarHBondContact O-N 3.48Å; D1038-L1040 VanDerWaalsContact OD1-C 3.29Å; D1038-L1040 WeakPolarHBondContact OD1-CA 3.17Å; D1038-L1040 WeakPolarHBondContact OD1-CB 3.11Å; D1038-L1040 PolarHBondContact OD1-N 3.05Å; L1040-Y1042 HydrophobicContact CB-CD2 3.72Å; L1040-Y1042 HydrophobicContact CB-CE2 3.78Å; L1040-Y1042 HydrophobicContact CD1-CE2 4.41Å
1041	G	75	Confident	80.1	Confident	5 Å²	5	93.8 Å²	93.8	5%	0.052	47%	0.47	C	S	.	.	S	Bend	trans	89.5	8.1	179.6	0	0	0	0	0	115.1	D1038	D1038-G1041 PolarHBondContact O-N 3.41Å; D1038-G1041 PolarHBondContact OD1-N 3.3Å
1042	Y	80.5	Confident	79.5	Confident	142 Å²	142	92.6 Å²	92.6	56%	0.557	47%	0.473	S	S	*	.			trans	-82.1	143.2	173.7	-60.2	-77.2	0	0	0	110.8	Q1037 D1038 L1040 V1044	Q1037-Y1042 CarbonylContact C-O 3.46Å; Q1037-Y1042 WeakPolarHBondContact CA-O 3.25Å; D1038-Y1042 PolarHBondContact N-O 3.2Å; D1038-Y1042 PolarHBondContact OD1-N 3.39Å; L1040-Y1042 HydrophobicContact CB-CD2 3.72Å; L1040-Y1042 HydrophobicContact CB-CE2 3.78Å; L1040-Y1042 HydrophobicContact CD1-CE2 4.41Å; Y1042-V1044 PolarHBondContact O-N 3.35Å
1043	T	74.7	Confident	78.9	Confident	89 Å²	89	99.2 Å²	99.2	55%	0.546	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-65.2	122.6	176.7	48.5	0	0	0	0	110.4	H1045	T1043-H1045 PolarHBondContact O-N 3.32Å
1044	V	68	Low	78.3	Confident	102 Å²	102	101 Å²	101	62%	0.618	52%	0.515	S	S	*	.			trans	-73.8	109.7	175.4	-170.5	0	0	0	0	107.7	D1038 Y1042	D1038-V1044 HydrophobicContact CB-CG2 3.92Å; Y1042-V1044 PolarHBondContact O-N 3.35Å
1045	H	61.2	Low	77.5	Confident	238 Å²	238	100.2 Å²	100.2	100%	1.102	51%	0.509	S	S	*	.			trans	-78.6	0	179	-78.6	-50	0	0	0	113.4	T1043	T1043-H1045 PolarHBondContact O-N 3.32Å

Retrieved 1,045 of 1,045 residues in 2653.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).