A0A096NYJ5_PAPAN Loading...

PDS5 cohesin associated factor A

AlphaFold DB (Q29RF7), UniProt , Accession A0A096NYJ5, Species PAPAN (Papio anubis, Olive baboon), Gene PDS5A, Length 1,337 aa.

						>A0A096NYJ5_PAPAN|A0A096NYJ5|PDS5A
MDFTAQPKPATALCGVVSADGKIAYPPGVKEITDKITTDEMIKRLKMVVKTFMDMDQDSEDEKQQYLPLALHLASEFFLRNPNKDVRLLVACCLADIFRIYAPEAPYTSHDKLKDIFLFITRQLKGLEDTKSPQFNRYFYLLENLAWVKSYNICFELEDCNEIFIQLFRTLFSVINNSHNKKVQMHMLDLMSSIIMEGDGVTQELLDSILINLIPAHKNLNKQSFDLAKVLLKRTVQTIEACIANFFNQVLVLGRSSVSDLSEHVFDLIQELFAIDPHLLLSVMPQLEFKLKSNDGEERLAVVRLLAKLFGSKDSDLATQNRPLWQCFLGRFNDIHVPVRLESVKFASHCLMNHPDLAKDLTEYLKVRSHDPEEAIRHDVIVTIITAAKRDLALVNDQLLGFVRERTLDKRWRVRKEAMMGLAQLYKKYCLHGEAGKEAAEKVSWIKDKLLHIYYQNSIDDKLLVEKIFAQYLVPHNLETEERMKCLYYLYASLDPNAVKALNEMWKCQNMLRSHVRELLDLHKQPTSEANCSAMFGKLMTIAKNLPDPGKAQDFVKKFNQVLGDDEKLRSQLELLISPTCSCKQADICVREIARKLANPKQPTNPFLEMVKFLLERIAPVHIDSEAISALVKLMNKSIEGTADDEEEGVSPDTAIRSGLELLKVLSFTHPTSFHSAETYESLLQCLRMEDDKVAEAAIQIFRNTGHKIETDLPQIRSTLIPILHQKAKRGTPHQAKQAVHCIHAIFTNKEVQLAQIFEPLSRSLNADVPEQLITPLVSLGHISMLAPDQFASPMKSVVANFIVKDLLMNDRSTGEKNGKLWSPDEEVSPEVLAKVQAIKLLVRWLLGMKNNQSKSANSTLRLLSAMLVSEGDLTEQKRISKSDMSRLRLAAGSAIMKLAQEPCYHEIITPEQFQLCALVINDECYQVRQIFAQKLHKALVKLLLPLEYMAIFALCAKDPVKERRAHARQCLLKNISIRREYIKQNPMATEKLLSLLPEYVVPYMIHLLAHDPDFTRSQDVDQLRDIKECLWFMLEVLMTKNENNSHAFMKKMAENIKLTRDAQSPDESKTNEKLYTVCDVALCVINSKSALCNADSPKDPVLPMKFFTQPEKDFCNDKSYISEETRVLLLTGKPKPAGVLGAVNKPLSATGRKPYVRSTGTETGSNINVNSELNPSTGNRSREQSSEAAETGVSENEENPVRIISVTPVKNIDPVKNKEINSDQATQGNISSDRGKKRTVTAAGAENIQQKTDEKVDESGPPAPSKPRRGRRPKSESQGNATKNDDLNKPINKGRKRAAVGQESPGGLEAGNAKAPKLQDLAKKAAPAERQIDLQR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	32.2	Very low	235 Å²	235	152.2 Å²	152.2	100%	1.158	86%	0.855	S	S	*	*				0	123.5	0	-68.2	171.5	178.8	0	0	105.9
2	D	34	Very low	31.8	Very low	142 Å²	142	146.6 Å²	146.6	76%	0.759	84%	0.842	S	S	*	*			trans	5	134.2	167.9	-36.9	-31.5	0	0	0	117.7
3	F	37.6	Very low	31.7	Very low	203 Å²	203	148.1 Å²	148.1	89%	0.89	84%	0.844	S	S	*	*			cis	-127.8	144.3	30.1	-80	-104.8	0	0	0	114.6
4	T	30.7	Very low	31.4	Very low	141 Å²	141	146.8 Å²	146.8	87%	0.865	85%	0.847	S	S	*	*			trans	-109	128.2	164.1	50.2	0	0	0	0	110.1
5	A	34.1	Very low	31.1	Very low	101 Å²	101	141.2 Å²	141.2	84%	0.835	83%	0.833	S	S	*	*			trans	-143.9	103	171.2	0	0	0	0	0	111.3
6	Q	29.8	Very low	31.1	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	83%	0.827	S	S	*	*			trans	-99.6	176.7	156.1	-58.8	-173	-37.1	0	0	108.5
7	P	38.8	Very low	31	Very low	115 Å²	115	140.1 Å²	140.1	75%	0.747	83%	0.83	S	S	*	*				-121.4	172.9	-79.6	34.7	-19.5	0	0	0	111.2
8	K	26.3	Very low	31.1	Very low	198 Å²	198	137.3 Å²	137.3	86%	0.861	82%	0.818	S	S	*	*			trans	-109.1	127.7	157.9	-80	-174.8	175.4	-179.9	0	108.9	A10	K8-A10 PolarHBondContact O-N 3.32Å
9	P	28.4	Very low	31.2	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-69.7	119.4	166.5	29.3	-31.2	0	0	0	108.3	T11	P9-T11 PolarHBondContact O-N 3.41Å
10	A	29.7	Very low	31.5	Very low	100 Å²	100	134.3 Å²	134.3	83%	0.826	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-69.4	118.2	168.1	0	0	0	0	0	108.4	K8 A12	K8-A10 PolarHBondContact O-N 3.32Å; A10-A12 PolarHBondContact O-N 3.32Å
11	T	28	Very low	32.6	Very low	132 Å²	132	131.9 Å²	131.9	81%	0.81	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-61.3	130.7	-179.3	-39.7	0	0	0	0	110.1	P9 L13	P9-T11 PolarHBondContact O-N 3.41Å; T11-L13 PolarHBondContact O-N 3.06Å
12	A	27.5	Very low	34	Very low	85 Å²	85	128.1 Å²	128.1	70%	0.702	79%	0.789	S	S	*	*			trans	-61.4	111.3	-177.9	0	0	0	0	0	111.9	A10 C14	A10-A12 PolarHBondContact O-N 3.32Å; A12-C14 PolarHBondContact O-N 2.91Å
13	L	30.5	Very low	36.4	Very low	166 Å²	166	123.4 Å²	123.4	87%	0.869	76%	0.763	S	S	*	*			trans	-77.9	49	174.4	-86.5	166.6	0	0	0	112.6	T11 G15	T11-L13 PolarHBondContact O-N 3.06Å; L13-G15 PolarHBondContact O-N 2.93Å
14	C	27.9	Very low	38.5	Very low	130 Å²	130	115.2 Å²	115.2	88%	0.878	73%	0.733	S	S	*	*			trans	-72.7	75.2	164.7	-68.5	0	0	0	0	109.6	A12	A12-C14 PolarHBondContact O-N 2.91Å
15	G	27.4	Very low	41.1	Very low	63 Å²	63	110.3 Å²	110.3	65%	0.649	70%	0.699	S	S	*	*			trans	-164.8	10	-166.5	0	0	0	0	0	120.4	L13	L13-G15 PolarHBondContact O-N 2.93Å
16	V	30.3	Very low	43.6	Very low	121 Å²	121	105.6 Å²	105.6	73%	0.733	66%	0.66	S	S	*	*			trans	-130.4	66.6	172.3	-164.3	0	0	0	0	112
17	V	29	Very low	46	Very low	143 Å²	143	102.1 Å²	102.1	87%	0.867	65%	0.653	S	S	*	*			trans	-90.1	90.8	154.2	179.6	0	0	0	0	107	A19	V17-A19 PolarHBondContact O-N 3.16Å; V17-A19 VanDerWaalsContact O-N 3.16Å
18	S	32.6	Very low	47.9	Very low	89 Å²	89	100.1 Å²	100.1	62%	0.622	65%	0.654	S	S	*	*			trans	-61.7	114.4	176.3	-57.5	0	0	0	0	110.1	D20	S18-D20 PolarHBondContact O-N 3.19Å
19	A	33.2	Very low	50.6	Low	108 Å²	108	91.4 Å²	91.4	89%	0.893	62%	0.617	S	S	*	*	S	Bend	trans	-78	43.9	-175.5	0	0	0	0	0	114.3	V17	V17-A19 PolarHBondContact O-N 3.16Å; V17-A19 VanDerWaalsContact O-N 3.16Å
20	D	38	Very low	53.2	Low	107 Å²	107	93 Å²	93	57%	0.572	61%	0.612	S	S	*	*	S	Bend	trans	-153.7	110.9	157.1	-156.7	18.9	0	0	0	108	S18 K22	S18-D20 PolarHBondContact O-N 3.19Å; D20-K22 PolarHBondContact O-N 2.81Å; D20-K22 IonicContact OD1-NZ 3.99Å; D20-K22 IonicContact OD2-NZ 2.79Å; D20-K22 PolarHBondContact OD2-NZ 2.88Å
21	G	54.4	Low	55.8	Low	83 Å²	83	94 Å²	94	86%	0.856	60%	0.6	S	S	*	*			trans	-74.8	35.3	-162.5	0	0	0	0	0	116.6	I23	G21-I23 PolarHBondContact O-N 2.79Å
22	K	66.9	Low	58.6	Low	157 Å²	157	87.7 Å²	87.7	68%	0.683	56%	0.561	S	S	*	*			trans	-88.9	107.1	-177.9	-75.5	171.4	-170.8	128.9	0	111.6	D20 A24	D20-K22 PolarHBondContact O-N 2.81Å; D20-K22 IonicContact OD1-NZ 3.99Å; D20-K22 IonicContact OD2-NZ 2.79Å; D20-K22 PolarHBondContact OD2-NZ 2.88Å; K22-A24 PolarHBondContact O-N 2.68Å
23	I	82.9	Confident	61.2	Low	43 Å²	43	85.3 Å²	85.3	22%	0.221	54%	0.538	C	S	.	.			trans	-60.3	125.6	165.1	-62.9	155.6	0	0	0	108.8	G21 Y25 P68 L69 H72	G21-I23 PolarHBondContact O-N 2.79Å; I23-Y25 HydrophobicContact CB-CD2 4.36Å; I23-Y25 HydrophobicContact CB-CE2 3.66Å; I23-Y25 HydrophobicContact CG2-CD2 4.06Å; I23-Y25 HydrophobicContact CG2-CE1 4.32Å; I23-Y25 HydrophobicContact CG2-CE2 3.51Å; I23-Y25 WeakPolarHBondContact O-CD2 3.5Å; I23-Y25 WeakPolarHBondContact O-CE2 3.46Å; I23-P68 HydrophobicContact CG1-CB 4.4Å; I23-L69 HydrophobicContact CG2-CB 3.7Å; I23-L69 HydrophobicContact CG2-CD1 3.86Å; I23-L69 HydrophobicContact CG2-CG 4.35Å; I23-H72 HydrophobicContact CD1-CB 3.72Å; I23-H72 VanDerWaalsContact CD1-CG 3.49Å; I23-H72 HydrophobicContact CG1-CB 4.39Å
24	A	81.2	Confident	63.5	Low	31 Å²	31	82.7 Å²	82.7	26%	0.256	53%	0.525	S	S	.	.			trans	-74.8	131	171.4	0	0	0	0	0	110.1	K22 Q65	K22-A24 PolarHBondContact O-N 2.68Å; A24-Q65 HydrophobicContact CB-CG 4.08Å; A24-Q65 WeakPolarHBondContact CB-O 3.06Å
25	Y	87.3	Confident	66	Low	37 Å²	37	85.1 Å²	85.1	15%	0.145	52%	0.521	C	S	.	.			trans	-115	146.9	178.2	-73.5	-88.4	0	0	0	110.5	I23 V29 E31 I32 L69 H72	I23-Y25 HydrophobicContact CB-CD2 4.36Å; I23-Y25 HydrophobicContact CB-CE2 3.66Å; I23-Y25 HydrophobicContact CG2-CD2 4.06Å; I23-Y25 HydrophobicContact CG2-CE1 4.32Å; I23-Y25 HydrophobicContact CG2-CE2 3.51Å; I23-Y25 WeakPolarHBondContact O-CD2 3.5Å; I23-Y25 WeakPolarHBondContact O-CE2 3.46Å; Y25-V29 HydrophobicContact CD1-CG1 3.82Å; Y25-V29 HydrophobicContact CG-CG1 4.34Å; Y25-E31 HydrophobicContact CE2-CB 4.05Å; Y25-E31 HydrophobicContact CE2-CG 3.8Å; Y25-I32 HydrophobicContact CD1-CD1 4.42Å; Y25-I32 HydrophobicContact CD1-CG1 4.31Å; Y25-I32 HydrophobicContact CE1-CB 4.04Å; Y25-I32 HydrophobicContact CE1-CD1 3.96Å; Y25-I32 HydrophobicContact CE1-CG1 3.67Å; Y25-I32 PolarHBondContact OH-N 3.35Å; Y25-I32 VanDerWaalsContact OH-N 3.1Å; Y25-L69 HydrophobicContact CD1-CD1 3.97Å; Y25-L69 HydrophobicContact CD1-CD2 4.31Å; Y25-L69 HydrophobicContact CE1-CD1 3.54Å; Y25-H72 PolarHBondContact OH-CD2 2.95Å
26	P	85.5	Confident	68.9	Low	3 Å²	3	83.8 Å²	83.8	2%	0.019	50%	0.498	C	S	.	.			trans	-60.2	157	-178.5	-25	34.1	0	0	0	113.6	G28 V29 V48 T51 Y66 L69	P26-G28 PolarHBondContact O-N 3.25Å; P26-V29 HydrophobicContact CB-CG2 4.07Å; P26-V29 HydrophobicContact CG-CG2 4.4Å; P26-V29 VanDerWaalsContact O-CB 3.28Å; P26-V29 WeakPolarHBondContact O-CB 3.5Å; P26-V29 PolarHBondContact O-N 3.32Å; P26-V48 HydrophobicContact CG-CG2 4.3Å; P26-T51 HydrophobicContact CB-CG2 4.1Å; P26-T51 VanDerWaalsContact CB-OG1 3.28Å; P26-T51 WeakPolarHBondContact CB-OG1 3.46Å; P26-T51 HydrophobicContact CG-CG2 3.88Å; P26-T51 WeakPolarHBondContact CG-OG1 3.31Å; P26-Y66 HydrophobicContact CB-CE1 4.35Å; P26-Y66 HydrophobicContact CG-CE1 3.83Å; P26-L69 HydrophobicContact CG-CD2 4.48Å
27	P	80	Confident	71.6	Confident	114 Å²	114	82.6 Å²	82.6	74%	0.74	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	121.8	180	-30.1	36.4	0	0	0	113.6	M47	P27-M47 WeakPolarHBondContact O-CE 3.06Å
28	G	78.2	Confident	74.5	Confident	74 Å²	74	78.8 Å²	78.8	76%	0.763	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	-6.8	-177	0	0	0	0	0	115.5	P26	P26-G28 PolarHBondContact O-N 3.25Å
29	V	83.1	Confident	77.2	Confident	14 Å²	14	80.6 Å²	80.6	9%	0.085	47%	0.471	C	S	.	.			trans	-89.9	127.8	173.3	-174.7	0	0	0	0	109.8	Y25 P26 I32 R44 M47 V48	Y25-V29 HydrophobicContact CD1-CG1 3.82Å; Y25-V29 HydrophobicContact CG-CG1 4.34Å; P26-V29 HydrophobicContact CB-CG2 4.07Å; P26-V29 HydrophobicContact CG-CG2 4.4Å; P26-V29 VanDerWaalsContact O-CB 3.28Å; P26-V29 WeakPolarHBondContact O-CB 3.5Å; P26-V29 PolarHBondContact O-N 3.32Å; V29-I32 HydrophobicContact CG1-CD1 4.45Å; V29-R44 HydrophobicContact CG1-CB 4.02Å; V29-R44 HydrophobicContact CG1-CG 4.21Å; V29-M47 HydrophobicContact CG2-CB 3.51Å; V29-M47 HydrophobicContact CG2-CE 3.81Å; V29-M47 HydrophobicContact CG2-CG 4.36Å; V29-M47 HydrophobicContact CG2-SD 4.04Å; V29-V48 HydrophobicContact CG1-CG2 3.98Å; V29-V48 HydrophobicContact CG2-CG2 4.34Å
30	K	83.3	Confident	79.9	Confident	153 Å²	153	77.9 Å²	77.9	67%	0.665	44%	0.44	S	S	*	.			trans	-95.7	159.8	168.5	-70.4	-175.3	178.6	-174.8	0	110.3	R44	K30-R44 WeakPolarHBondContact O-CD 3.42Å; K30-R44 PolarHBondContact O-NH1 2.97Å
31	E	84.1	Confident	82.4	Confident	120 Å²	120	73.2 Å²	73.2	56%	0.561	42%	0.415	S	S	*	.			trans	-44.2	138.2	-176.9	-162.7	-171.1	165.2	0	0	114.6	Y25 T33 R44	Y25-E31 HydrophobicContact CE2-CB 4.05Å; Y25-E31 HydrophobicContact CE2-CG 3.8Å; E31-T33 HydrophobicContact CG-CG2 3.94Å; E31-T33 WeakPolarHBondContact OE1-CG2 3.43Å; E31-R44 PolarHBondContact O-NH1 2.84Å
32	I	86.8	Confident	84.2	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.378	C	S	.	.			trans	-108.6	104.1	-176.9	-55.1	176.3	0	0	0	109.1	Y25 V29 I36 M41 R44 L45 V48 H72 F78	Y25-I32 HydrophobicContact CD1-CD1 4.42Å; Y25-I32 HydrophobicContact CD1-CG1 4.31Å; Y25-I32 HydrophobicContact CE1-CB 4.04Å; Y25-I32 HydrophobicContact CE1-CD1 3.96Å; Y25-I32 HydrophobicContact CE1-CG1 3.67Å; Y25-I32 PolarHBondContact OH-N 3.35Å; Y25-I32 VanDerWaalsContact OH-N 3.1Å; V29-I32 HydrophobicContact CG1-CD1 4.45Å; I32-I36 HydrophobicContact CG2-CD1 4.28Å; I32-M41 HydrophobicContact CG2-CG 4Å; I32-R44 HydrophobicContact CD1-CB 3.8Å; I32-R44 HydrophobicContact CG1-CB 3.91Å; I32-L45 HydrophobicContact CD1-CD2 3.98Å; I32-L45 HydrophobicContact CD1-CG 4.22Å; I32-V48 HydrophobicContact CD1-CG2 4.11Å; I32-H72 PolarHBondContact O-NE2 3.47Å; I32-F78 HydrophobicContact CB-CZ 4.31Å; I32-F78 HydrophobicContact CG2-CE1 3.69Å; I32-F78 HydrophobicContact CG2-CZ 3.65Å
33	T	83.4	Confident	85.4	Confident	35 Å²	35	68 Å²	68	22%	0.215	37%	0.369	C	S	.	.			trans	-125.7	177	-175.6	56.9	0	0	0	0	111.9	E31 K35 I36 F77	E31-T33 HydrophobicContact CG-CG2 3.94Å; E31-T33 WeakPolarHBondContact OE1-CG2 3.43Å; T33-K35 PolarHBondContact O-N 2.91Å; T33-I36 WeakPolarHBondContact O-CG1 3.35Å; T33-F77 WeakPolarHBondContact O-CZ 3.4Å
34	D	78.5	Confident	85.9	Confident	112 Å²	112	67.5 Å²	67.5	60%	0.599	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.8	172.5	63.8	-43.5	0	0	0	114.4	F77	D34-F77 HydrophobicContact CB-CD2 4.41Å; D34-F77 HydrophobicContact CB-CE2 3.87Å; D34-F77 HydrophobicContact CB-CZ 4.36Å
35	K	80.8	Confident	86.5	Confident	181 Å²	181	66 Å²	66	79%	0.787	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-1.2	-170.3	-65.4	169.9	-166.4	175.5	0	115	T33	T33-K35 PolarHBondContact O-N 2.91Å
36	I	87.2	Confident	86.7	Confident	34 Å²	34	69 Å²	69	17%	0.174	37%	0.366	C	S	.	.	S	Bend	trans	-97.2	149.7	177.7	62.3	170.1	0	0	0	111.7	I32 T33 M41	I32-I36 HydrophobicContact CG2-CD1 4.28Å; T33-I36 WeakPolarHBondContact O-CG1 3.35Å; I36-M41 HydrophobicContact CD1-CB 3.82Å; I36-M41 HydrophobicContact CD1-CG 4.2Å; I36-M41 HydrophobicContact CG1-CB 4.09Å; I36-M41 HydrophobicContact CG1-CE 4.13Å
37	T	88.3	Confident	87.1	Confident	97 Å²	97	72.4 Å²	72.4	60%	0.595	38%	0.382	S	S	*	.			trans	-64.8	149.3	177.3	58.7	0	0	0	0	111.5	D39 E40 M41	T37-D39 PolarHBondContact O-N 3.26Å; T37-E40 PolarHBondContact O-N 3.32Å; T37-E40 VanDerWaalsContact O-N 3.12Å; T37-M41 WeakPolarHBondContact O-CB 3.41Å; T37-M41 PolarHBondContact O-N 3.4Å
38	T	88.8	Confident	87.7	Confident	63 Å²	63	67 Å²	67	39%	0.387	35%	0.347	S	S	.	.	H	α-helix	trans	-54.7	-37.6	-176.9	-42.3	0	0	0	0	112.9	M41 I42 N83 V86	T38-M41 WeakPolarHBondContact O-CB 3.42Å; T38-M41 PolarHBondContact O-N 3Å; T38-I42 HydrophobicContact CG2-CD1 4.03Å; T38-I42 WeakPolarHBondContact O-CB 3.47Å; T38-I42 WeakPolarHBondContact O-CD1 3.41Å; T38-I42 WeakPolarHBondContact O-CG1 3.37Å; T38-I42 PolarHBondContact O-N 3.22Å; T38-N83 HydrophobicContact CG2-CB 3.85Å; T38-V86 HydrophobicContact CG2-CG2 4.19Å
39	D	88.8	Confident	88.4	Confident	127 Å²	127	63.6 Å²	63.6	68%	0.679	31%	0.312	S	S	*	.	H	α-helix	trans	-69.8	-40.2	179.7	-59.4	-53.4	0	0	0	112.9	T37 I42 K43	T37-D39 PolarHBondContact O-N 3.26Å; D39-I42 PolarHBondContact O-N 3.3Å; D39-K43 VanDerWaalsContact O-CB 3.3Å; D39-K43 WeakPolarHBondContact O-CB 3.24Å; D39-K43 PolarHBondContact O-N 3.48Å
40	E	90.3	Very high	88.9	Confident	50 Å²	50	68.8 Å²	68.8	23%	0.234	33%	0.333	C	S	.	.	H	α-helix	trans	-72.2	-33.5	176	178.9	64.5	-173.9	0	0	110.8	T37 K43 R44	T37-E40 PolarHBondContact O-N 3.32Å; T37-E40 VanDerWaalsContact O-N 3.12Å; E40-K43 PolarHBondContact O-N 2.95Å; E40-K43 IonicContact OE1-NZ 2.83Å; E40-K43 WeakPolarHBondContact OE2-CD 3.41Å; E40-K43 IonicContact OE2-NZ 3.18Å; E40-K43 PolarHBondContact OE2-NZ 3.46Å; E40-R44 WeakPolarHBondContact O-CB 3.49Å; E40-R44 VanDerWaalsContact O-CG 3.28Å; E40-R44 WeakPolarHBondContact O-CG 3.32Å; E40-R44 PolarHBondContact O-N 3.06Å; E40-R44 IonicContact OE1-CZ 3.32Å; E40-R44 IonicContact OE1-NE 2.61Å; E40-R44 PolarHBondContact OE1-NE 3.46Å; E40-R44 IonicContact OE1-NH2 2.72Å; E40-R44 PolarHBondContact OE1-NH2 3.04Å
41	M	91.1	Very high	89.3	Confident	9 Å²	9	63.1 Å²	63.1	4%	0.044	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-49.2	169.6	-168.8	-173.3	-59.8	0	0	111.4	I32 I36 T37 T38 K43 R44 L45 F77 V86	I32-M41 HydrophobicContact CG2-CG 4Å; I36-M41 HydrophobicContact CD1-CB 3.82Å; I36-M41 HydrophobicContact CD1-CG 4.2Å; I36-M41 HydrophobicContact CG1-CB 4.09Å; I36-M41 HydrophobicContact CG1-CE 4.13Å; T37-M41 WeakPolarHBondContact O-CB 3.41Å; T37-M41 PolarHBondContact O-N 3.4Å; T38-M41 WeakPolarHBondContact O-CB 3.42Å; T38-M41 PolarHBondContact O-N 3Å; M41-K43 VanDerWaalsContact C-N 3.31Å; M41-K43 PolarHBondContact O-N 3.01Å; M41-R44 PolarHBondContact O-N 3.23Å; M41-L45 HydrophobicContact CG-CD1 4.04Å; M41-L45 WeakPolarHBondContact O-CB 3.32Å; M41-L45 WeakPolarHBondContact O-CG 3.33Å; M41-L45 PolarHBondContact O-N 3.5Å; M41-F77 HydrophobicContact CE-CE1 4.44Å; M41-F77 HydrophobicContact CE-CE2 4.46Å; M41-F77 HydrophobicContact CE-CZ 3.64Å; M41-F77 HydrophobicContact SD-CZ 4.21Å; M41-V86 HydrophobicContact CG-CG2 4.5Å; M41-V86 HydrophobicContact SD-CG1 4.02Å; M41-V86 HydrophobicContact SD-CG2 3.96Å
42	I	91.7	Very high	89.8	Confident	15 Å²	15	57.5 Å²	57.5	8%	0.077	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-40.8	175.3	-76.3	166.5	0	0	0	111.1	T38 D39 K46 D85 V86 L89	T38-I42 HydrophobicContact CG2-CD1 4.03Å; T38-I42 WeakPolarHBondContact O-CB 3.47Å; T38-I42 WeakPolarHBondContact O-CD1 3.41Å; T38-I42 WeakPolarHBondContact O-CG1 3.37Å; T38-I42 PolarHBondContact O-N 3.22Å; D39-I42 PolarHBondContact O-N 3.3Å; I42-K46 HydrophobicContact CG2-CD 4.01Å; I42-K46 VanDerWaalsContact CG2-CE 3.47Å; I42-K46 WeakPolarHBondContact O-CB 3.47Å; I42-K46 WeakPolarHBondContact O-CD 3.42Å; I42-K46 VanDerWaalsContact O-CG 3.24Å; I42-K46 WeakPolarHBondContact O-CG 3.3Å; I42-K46 PolarHBondContact O-N 3.43Å; I42-D85 HydrophobicContact CD1-CB 3.88Å; I42-D85 HydrophobicContact CG1-CB 4.24Å; I42-V86 HydrophobicContact CD1-CG2 4.27Å; I42-V86 HydrophobicContact CG1-CG2 3.69Å; I42-L89 HydrophobicContact CB-CD1 4.43Å; I42-L89 HydrophobicContact CG2-CD1 4.07Å
43	K	91.9	Very high	90.1	Very high	117 Å²	117	61.3 Å²	61.3	51%	0.509	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-44.7	177.6	177.2	176.5	148.6	-142.5	0	112	D39 E40 M41 K46 M47	D39-K43 VanDerWaalsContact O-CB 3.3Å; D39-K43 WeakPolarHBondContact O-CB 3.24Å; D39-K43 PolarHBondContact O-N 3.48Å; E40-K43 PolarHBondContact O-N 2.95Å; E40-K43 IonicContact OE1-NZ 2.83Å; E40-K43 WeakPolarHBondContact OE2-CD 3.41Å; E40-K43 IonicContact OE2-NZ 3.18Å; E40-K43 PolarHBondContact OE2-NZ 3.46Å; M41-K43 VanDerWaalsContact C-N 3.31Å; M41-K43 PolarHBondContact O-N 3.01Å; K43-K46 PolarHBondContact O-N 3.21Å; K43-M47 PolarHBondContact O-N 3.48Å
44	R	93.2	Very high	90.5	Very high	31 Å²	31	64 Å²	64	12%	0.117	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-47.8	175.2	-71.5	167.1	-172	-166.5	13.6	111.6	V29 K30 E31 I32 E40 M41 K46 M47 V48	V29-R44 HydrophobicContact CG1-CB 4.02Å; V29-R44 HydrophobicContact CG1-CG 4.21Å; K30-R44 WeakPolarHBondContact O-CD 3.42Å; K30-R44 PolarHBondContact O-NH1 2.97Å; E31-R44 PolarHBondContact O-NH1 2.84Å; I32-R44 HydrophobicContact CD1-CB 3.8Å; I32-R44 HydrophobicContact CG1-CB 3.91Å; E40-R44 WeakPolarHBondContact O-CB 3.49Å; E40-R44 VanDerWaalsContact O-CG 3.28Å; E40-R44 WeakPolarHBondContact O-CG 3.32Å; E40-R44 PolarHBondContact O-N 3.06Å; E40-R44 IonicContact OE1-CZ 3.32Å; E40-R44 IonicContact OE1-NE 2.61Å; E40-R44 PolarHBondContact OE1-NE 3.46Å; E40-R44 IonicContact OE1-NH2 2.72Å; E40-R44 PolarHBondContact OE1-NH2 3.04Å; M41-R44 PolarHBondContact O-N 3.23Å; R44-K46 VanDerWaalsContact C-N 3.29Å; R44-K46 PolarHBondContact O-N 3.06Å; R44-M47 WeakPolarHBondContact O-CB 3.2Å; R44-M47 PolarHBondContact O-N 2.91Å; R44-V48 WeakPolarHBondContact O-CG2 3.33Å; R44-V48 PolarHBondContact O-N 3.31Å
45	L	93.3	Very high	91.2	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-35	176.4	-73.4	170.7	0	0	0	112.5	I32 M41 M47 V48 V49 L73 F78 V86 L89 V90	I32-L45 HydrophobicContact CD1-CD2 3.98Å; I32-L45 HydrophobicContact CD1-CG 4.22Å; M41-L45 HydrophobicContact CG-CD1 4.04Å; M41-L45 WeakPolarHBondContact O-CB 3.32Å; M41-L45 WeakPolarHBondContact O-CG 3.33Å; M41-L45 PolarHBondContact O-N 3.5Å; L45-M47 VanDerWaalsContact C-N 3.28Å; L45-M47 PolarHBondContact O-N 3.27Å; L45-V48 PolarHBondContact O-N 3.32Å; L45-V49 WeakPolarHBondContact O-CB 3.48Å; L45-V49 VanDerWaalsContact O-CG2 3.3Å; L45-V49 WeakPolarHBondContact O-CG2 3.46Å; L45-V49 PolarHBondContact O-N 3.07Å; L45-L73 HydrophobicContact CD2-CD2 3.74Å; L45-F78 HydrophobicContact CD2-CE1 4.37Å; L45-V86 HydrophobicContact CD1-CB 4.42Å; L45-V86 HydrophobicContact CD1-CG1 3.82Å; L45-V86 HydrophobicContact CD1-CG2 4.47Å; L45-L89 HydrophobicContact CB-CB 3.92Å; L45-L89 HydrophobicContact CB-CD1 3.84Å; L45-L89 HydrophobicContact CB-CG 4.47Å; L45-V90 HydrophobicContact CD1-CG2 4.24Å; L45-V90 HydrophobicContact CD2-CG2 4.31Å
46	K	92.4	Very high	91.5	Very high	100 Å²	100	55.2 Å²	55.2	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-33	172.8	-80.2	165.1	-178.7	169.9	0	113.3	I42 K43 R44 K50 L89	I42-K46 HydrophobicContact CG2-CD 4.01Å; I42-K46 VanDerWaalsContact CG2-CE 3.47Å; I42-K46 WeakPolarHBondContact O-CB 3.47Å; I42-K46 WeakPolarHBondContact O-CD 3.42Å; I42-K46 VanDerWaalsContact O-CG 3.24Å; I42-K46 WeakPolarHBondContact O-CG 3.3Å; I42-K46 PolarHBondContact O-N 3.43Å; K43-K46 PolarHBondContact O-N 3.21Å; R44-K46 VanDerWaalsContact C-N 3.29Å; R44-K46 PolarHBondContact O-N 3.06Å; K46-K50 PolarHBondContact O-N 2.69Å; K46-L89 HydrophobicContact CG-CD1 3.89Å; K46-L89 HydrophobicContact CG-CD2 3.77Å
47	M	93.1	Very high	91.6	Very high	74 Å²	74	57.2 Å²	57.2	37%	0.365	29%	0.287	S	S	.	.	H	α-helix	trans	-75.3	-43.4	174.1	-65.8	175.4	67.3	0	0	111.1	P27 V29 K43 R44 L45 V49 K50 T51	P27-M47 WeakPolarHBondContact O-CE 3.06Å; V29-M47 HydrophobicContact CG2-CB 3.51Å; V29-M47 HydrophobicContact CG2-CE 3.81Å; V29-M47 HydrophobicContact CG2-CG 4.36Å; V29-M47 HydrophobicContact CG2-SD 4.04Å; K43-M47 PolarHBondContact O-N 3.48Å; R44-M47 WeakPolarHBondContact O-CB 3.2Å; R44-M47 PolarHBondContact O-N 2.91Å; L45-M47 VanDerWaalsContact C-N 3.28Å; L45-M47 PolarHBondContact O-N 3.27Å; M47-V49 PolarHBondContact O-N 2.95Å; M47-K50 WeakPolarHBondContact O-CB 3.33Å; M47-K50 PolarHBondContact O-N 2.89Å; M47-T51 PolarHBondContact O-N 3.41Å; M47-T51 PolarHBondContact O-OG1 3.13Å
48	V	93.7	Very high	91.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-41.9	176.8	177	0	0	0	0	112	P26 V29 I32 R44 L45 K50 T51 F52 L69 L73	P26-V48 HydrophobicContact CG-CG2 4.3Å; V29-V48 HydrophobicContact CG1-CG2 3.98Å; V29-V48 HydrophobicContact CG2-CG2 4.34Å; I32-V48 HydrophobicContact CD1-CG2 4.11Å; R44-V48 WeakPolarHBondContact O-CG2 3.33Å; R44-V48 PolarHBondContact O-N 3.31Å; L45-V48 PolarHBondContact O-N 3.32Å; V48-K50 VanDerWaalsContact C-N 3.29Å; V48-K50 PolarHBondContact O-N 2.79Å; V48-T51 PolarHBondContact O-N 2.87Å; V48-F52 HydrophobicContact CG1-CD2 3.63Å; V48-F52 HydrophobicContact CG1-CE2 3.47Å; V48-F52 VanDerWaalsContact CG1-CE2 3.47Å; V48-F52 WeakPolarHBondContact O-CD2 3.34Å; V48-F52 PolarHBondContact O-N 3.43Å; V48-L69 HydrophobicContact CG1-CD2 3.91Å; V48-L69 HydrophobicContact CG1-CG 4.49Å; V48-L69 HydrophobicContact CG2-CD2 4.33Å; V48-L73 HydrophobicContact CG1-CD1 4Å
49	V	93.4	Very high	91.6	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.024	29%	0.291	C	S	.	.	H	α-helix	trans	-58	-42.1	171.3	169.6	0	0	0	0	110.9	L45 M47 M53 L89 C92 C93	L45-V49 WeakPolarHBondContact O-CB 3.48Å; L45-V49 VanDerWaalsContact O-CG2 3.3Å; L45-V49 WeakPolarHBondContact O-CG2 3.46Å; L45-V49 PolarHBondContact O-N 3.07Å; M47-V49 PolarHBondContact O-N 2.95Å; V49-M53 WeakPolarHBondContact O-CB 3.34Å; V49-M53 PolarHBondContact O-N 3.48Å; V49-L89 HydrophobicContact CG2-CB 3.97Å; V49-L89 HydrophobicContact CG2-CD2 3.92Å; V49-L89 WeakPolarHBondContact CG2-O 3.49Å; V49-C92 HydrophobicContact CG1-CB 4Å; V49-C92 HydrophobicContact CG2-CB 4.07Å; V49-C93 WeakPolarHBondContact CG2-SG 3.36Å
50	K	92.6	Very high	91.4	Very high	122 Å²	122	57.1 Å²	57.1	53%	0.53	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-44.8	177.2	-177.7	177.1	171.5	-177.9	0	111	K46 M47 V48 M53 D54	K46-K50 PolarHBondContact O-N 2.69Å; M47-K50 WeakPolarHBondContact O-CB 3.33Å; M47-K50 PolarHBondContact O-N 2.89Å; V48-K50 VanDerWaalsContact C-N 3.29Å; V48-K50 PolarHBondContact O-N 2.79Å; K50-M53 HydrophobicContact CG-CE 4.49Å; K50-M53 PolarHBondContact O-N 3.3Å; K50-D54 WeakPolarHBondContact CE-OD2 3.03Å; K50-D54 WeakPolarHBondContact CG-OD2 3.44Å; K50-D54 IonicContact NZ-OD2 3.62Å; K50-D54 WeakPolarHBondContact O-CB 3.38Å; K50-D54 VanDerWaalsContact O-CG 3.3Å; K50-D54 PolarHBondContact O-N 3.4Å
51	T	92.8	Very high	91.1	Very high	34 Å²	34	61.4 Å²	61.4	21%	0.209	31%	0.305	C	S	.	.	H	α-helix	trans	-59.8	-50.5	178.7	-55.2	0	0	0	0	111.6	P26 M47 V48 M53 D54 M55 Y66	P26-T51 HydrophobicContact CB-CG2 4.1Å; P26-T51 VanDerWaalsContact CB-OG1 3.28Å; P26-T51 WeakPolarHBondContact CB-OG1 3.46Å; P26-T51 HydrophobicContact CG-CG2 3.88Å; P26-T51 WeakPolarHBondContact CG-OG1 3.31Å; M47-T51 PolarHBondContact O-N 3.41Å; M47-T51 PolarHBondContact O-OG1 3.13Å; V48-T51 PolarHBondContact O-N 2.87Å; T51-M53 VanDerWaalsContact C-N 3.33Å; T51-M53 PolarHBondContact O-N 3.09Å; T51-D54 PolarHBondContact O-N 2.92Å; T51-M55 HydrophobicContact CG2-CG 4.46Å; T51-M55 HydrophobicContact CG2-SD 4.08Å; T51-M55 VanDerWaalsContact O-CG 3.25Å; T51-M55 WeakPolarHBondContact O-CG 3.37Å; T51-M55 PolarHBondContact O-N 3.12Å; T51-M55 VanDerWaalsContact O-N 3.07Å; T51-Y66 HydrophobicContact CG2-CE2 4.04Å
52	F	94	Very high	90.9	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.009	32%	0.319	C	S	.	.	H	α-helix	trans	-67.9	-28.9	177.7	-70.4	-55.7	0	0	0	113.4	V48 M55 L69 L73 C93 D96 I97 R99 I100	V48-F52 HydrophobicContact CG1-CD2 3.63Å; V48-F52 HydrophobicContact CG1-CE2 3.47Å; V48-F52 VanDerWaalsContact CG1-CE2 3.47Å; V48-F52 WeakPolarHBondContact O-CD2 3.34Å; V48-F52 PolarHBondContact O-N 3.43Å; F52-M55 HydrophobicContact CD1-SD 3.75Å; F52-M55 HydrophobicContact CE1-SD 4.16Å; F52-L69 HydrophobicContact CE2-CD2 4.13Å; F52-L69 HydrophobicContact CE2-CG 4.21Å; F52-L69 HydrophobicContact CZ-CB 4.46Å; F52-L69 HydrophobicContact CZ-CD2 4.13Å; F52-L69 HydrophobicContact CZ-CG 4.15Å; F52-L73 HydrophobicContact CD2-CD1 4.39Å; F52-L73 HydrophobicContact CE2-CD1 3.65Å; F52-C93 HydrophobicContact CD2-CB 4.1Å; F52-D96 HydrophobicContact CB-CB 3.79Å; F52-I97 HydrophobicContact CD1-CG1 4.28Å; F52-I97 HydrophobicContact CE1-CG1 4.21Å; F52-I97 HydrophobicContact CE2-CD1 4.19Å; F52-I97 HydrophobicContact CE2-CG1 4.46Å; F52-I97 HydrophobicContact CG-CG1 4.44Å; F52-I97 HydrophobicContact CZ-CD1 4.28Å; F52-I97 HydrophobicContact CZ-CG1 4.3Å; F52-R99 PolarHBondContact O-NH2 3.07Å; F52-I100 HydrophobicContact CB-CD1 4.19Å; F52-I100 HydrophobicContact CD1-CD1 3.73Å; F52-I100 HydrophobicContact CG-CD1 4.43Å; F52-I100 WeakPolarHBondContact O-CD1 3.42Å
53	M	93	Very high	90.8	Very high	81 Å²	81	65 Å²	65	40%	0.399	32%	0.321	S	S	.	.	H	α-helix	trans	-69.2	-36.3	173.2	-178.6	-172.3	79.5	0	0	112.5	V49 K50 T51 R99 Y140	V49-M53 WeakPolarHBondContact O-CB 3.34Å; V49-M53 PolarHBondContact O-N 3.48Å; K50-M53 HydrophobicContact CG-CE 4.49Å; K50-M53 PolarHBondContact O-N 3.3Å; T51-M53 VanDerWaalsContact C-N 3.33Å; T51-M53 PolarHBondContact O-N 3.09Å; M53-R99 PolarHBondContact O-NH2 3.43Å; M53-Y140 HydrophobicContact CG-CE2 4.3Å; M53-Y140 HydrophobicContact SD-CE2 4.38Å
54	D	92.3	Very high	90.6	Very high	91 Å²	91	66.1 Å²	66.1	49%	0.487	33%	0.328	S	S	.	.	H	α-helix	trans	-87.3	-9.3	-177.7	-67.5	-3.1	0	0	0	113.2	K50 T51	K50-D54 WeakPolarHBondContact CE-OD2 3.03Å; K50-D54 WeakPolarHBondContact CG-OD2 3.44Å; K50-D54 IonicContact NZ-OD2 3.62Å; K50-D54 WeakPolarHBondContact O-CB 3.38Å; K50-D54 VanDerWaalsContact O-CG 3.3Å; K50-D54 PolarHBondContact O-N 3.4Å; T51-D54 PolarHBondContact O-N 2.92Å
55	M	92.2	Very high	90.4	Very high	4 Å²	4	69.3 Å²	69.3	2%	0.02	34%	0.344	C	S	.	.			trans	-79.9	142.7	177.9	-82	170.9	69.4	0	0	112.9	T51 F52 E62 Y66 R99 I100	T51-M55 HydrophobicContact CG2-CG 4.46Å; T51-M55 HydrophobicContact CG2-SD 4.08Å; T51-M55 VanDerWaalsContact O-CG 3.25Å; T51-M55 WeakPolarHBondContact O-CG 3.37Å; T51-M55 PolarHBondContact O-N 3.12Å; T51-M55 VanDerWaalsContact O-N 3.07Å; F52-M55 HydrophobicContact CD1-SD 3.75Å; F52-M55 HydrophobicContact CE1-SD 4.16Å; M55-E62 HydrophobicContact CE-CB 3.76Å; M55-Y66 HydrophobicContact CE-CD2 3.96Å; M55-Y66 HydrophobicContact SD-CD2 3.7Å; M55-Y66 HydrophobicContact SD-CE2 4.19Å; M55-R99 VanDerWaalsContact O-CZ 3.28Å; M55-R99 PolarHBondContact O-NH1 3.06Å; M55-R99 PolarHBondContact O-NH2 3.15Å; M55-I100 HydrophobicContact CB-CD1 3.75Å; M55-I100 HydrophobicContact CB-CG1 4.11Å; M55-I100 HydrophobicContact CE-CD1 4.16Å; M55-I100 HydrophobicContact CE-CG2 4.29Å; M55-I100 HydrophobicContact SD-CD1 4.26Å
56	D	88.1	Confident	90.4	Very high	104 Å²	104	69.8 Å²	69.8	56%	0.556	35%	0.346	S	S	*	.			trans	-100.8	162.1	175.8	-80.5	-41.4	0	0	0	113.3	D58 S59	D56-D58 VanDerWaalsContact C-N 3.27Å; D56-D58 PolarHBondContact O-N 3.29Å; D56-S59 PolarHBondContact O-N 2.94Å
57	Q	88.4	Confident	90.3	Very high	77 Å²	77	68 Å²	68	36%	0.36	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-29.3	179.1	-74.4	173.9	-27.9	0	0	112.9	K63 R99	Q57-K63 VanDerWaalsContact O-CD 3.32Å; Q57-K63 WeakPolarHBondContact O-CD 3.21Å; Q57-K63 PolarHBondContact O-NZ 3.12Å; Q57-R99 VanDerWaalsContact CG-O 3.3Å; Q57-R99 WeakPolarHBondContact CG-O 3.31Å; Q57-R99 PolarHBondContact NE2-O 3.22Å
58	D	87.1	Confident	90.2	Very high	149 Å²	149	67.1 Å²	67.1	80%	0.797	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-8.8	-176.9	-59.8	-40.9	0	0	0	113.5	D56 E60	D56-D58 VanDerWaalsContact C-N 3.27Å; D56-D58 PolarHBondContact O-N 3.29Å; D58-E60 VanDerWaalsContact C-N 3.28Å; D58-E60 PolarHBondContact O-N 3.36Å
59	S	89.1	Confident	90.1	Very high	36 Å²	36	67.1 Å²	67.1	25%	0.252	34%	0.341	S	S	.	.			trans	-76.1	64.9	-178.2	-69.8	0	0	0	0	113	D56 D61 E62 K63	D56-S59 PolarHBondContact O-N 2.94Å; S59-D61 VanDerWaalsContact C-N 3.32Å; S59-D61 PolarHBondContact O-N 3.29Å; S59-E62 WeakPolarHBondContact CB-OE2 3.24Å; S59-E62 PolarHBondContact O-N 2.92Å; S59-E62 VanDerWaalsContact O-N 3.13Å; S59-E62 PolarHBondContact OG-OE2 3.27Å; S59-E62 VanDerWaalsContact OG-OE2 3.1Å; S59-K63 VanDerWaalsContact O-CG 3.32Å; S59-K63 WeakPolarHBondContact O-CG 3.17Å; S59-K63 PolarHBondContact O-N 3.36Å
60	E	85.1	Confident	90	Very high	100 Å²	100	67 Å²	67	47%	0.467	34%	0.34	S	S	.	.	H	α-helix	trans	-54.3	-40.3	-177.2	-73.3	-57.6	148.1	0	0	114.5	D58 K63 Q64	D58-E60 VanDerWaalsContact C-N 3.28Å; D58-E60 PolarHBondContact O-N 3.36Å; E60-K63 WeakPolarHBondContact O-CB 3.44Å; E60-K63 PolarHBondContact O-N 3.49Å; E60-K63 IonicContact OE1-NZ 3.72Å; E60-K63 PolarHBondContact OE1-NZ 2.7Å; E60-K63 IonicContact OE2-NZ 3.97Å; E60-Q64 WeakPolarHBondContact O-CG 3.33Å; E60-Q64 PolarHBondContact O-N 3.03Å
61	D	85.2	Confident	90	Very high	140 Å²	140	65.2 Å²	65.2	75%	0.749	34%	0.336	S	S	*	.	H	α-helix	trans	-63.1	-44.3	177.5	-68.7	-37.4	0	0	0	111.7	S59 Q65	S59-D61 VanDerWaalsContact C-N 3.32Å; S59-D61 PolarHBondContact O-N 3.29Å; D61-Q65 VanDerWaalsContact O-CB 3.31Å; D61-Q65 WeakPolarHBondContact O-CB 3.46Å; D61-Q65 PolarHBondContact O-N 2.72Å
62	E	86.8	Confident	90	Very high	73 Å²	73	65.8 Å²	65.8	34%	0.341	34%	0.336	S	S	.	.	H	α-helix	trans	-71.7	-33.5	178.2	-57.3	-171.1	118.8	0	0	111.7	M55 S59 Q65 Y66	M55-E62 HydrophobicContact CE-CB 3.76Å; S59-E62 WeakPolarHBondContact CB-OE2 3.24Å; S59-E62 PolarHBondContact O-N 2.92Å; S59-E62 VanDerWaalsContact O-N 3.13Å; S59-E62 PolarHBondContact OG-OE2 3.27Å; S59-E62 VanDerWaalsContact OG-OE2 3.1Å; E62-Q65 PolarHBondContact O-N 3.05Å; E62-Y66 HydrophobicContact CB-CD2 4.31Å; E62-Y66 HydrophobicContact CB-CE2 4.4Å; E62-Y66 WeakPolarHBondContact O-CD2 3.36Å; E62-Y66 PolarHBondContact O-N 3.01Å
63	K	89.8	Confident	89.9	Confident	26 Å²	26	65.7 Å²	65.7	11%	0.113	34%	0.335	C	S	.	.	H	α-helix	trans	-59.3	-56.3	172.4	-74.7	161.6	69.7	-177.8	0	109.8	Q57 S59 E60 Q65 Y66 L67 I100 Y101	Q57-K63 VanDerWaalsContact O-CD 3.32Å; Q57-K63 WeakPolarHBondContact O-CD 3.21Å; Q57-K63 PolarHBondContact O-NZ 3.12Å; S59-K63 VanDerWaalsContact O-CG 3.32Å; S59-K63 WeakPolarHBondContact O-CG 3.17Å; S59-K63 PolarHBondContact O-N 3.36Å; E60-K63 WeakPolarHBondContact O-CB 3.44Å; E60-K63 PolarHBondContact O-N 3.49Å; E60-K63 IonicContact OE1-NZ 3.72Å; E60-K63 PolarHBondContact OE1-NZ 2.7Å; E60-K63 IonicContact OE2-NZ 3.97Å; K63-Q65 VanDerWaalsContact C-N 3.29Å; K63-Q65 PolarHBondContact O-N 3.48Å; K63-Y66 PolarHBondContact O-N 3Å; K63-L67 WeakPolarHBondContact O-CB 3.19Å; K63-L67 PolarHBondContact O-N 3.1Å; K63-I100 HydrophobicContact CD-CG2 3.88Å; K63-I100 HydrophobicContact CG-CG2 3.5Å; K63-I100 VanDerWaalsContact CG-CG2 3.5Å; K63-Y101 PolarHBondContact O-OH 3.47Å
64	Q	87.4	Confident	89.9	Confident	140 Å²	140	62 Å²	62	65%	0.654	32%	0.318	S	S	*	.	H	α-helix	trans	-60.2	-38.1	177.5	-67.7	-176.2	31.3	0	0	112.4	E60	E60-Q64 WeakPolarHBondContact O-CG 3.33Å; E60-Q64 PolarHBondContact O-N 3.03Å
65	Q	89.4	Confident	89.9	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-62.3	-46.2	176.4	-174.8	177.3	13.5	0	0	112.9	A24 D61 E62 K63	A24-Q65 HydrophobicContact CB-CG 4.08Å; A24-Q65 WeakPolarHBondContact CB-O 3.06Å; D61-Q65 VanDerWaalsContact O-CB 3.31Å; D61-Q65 WeakPolarHBondContact O-CB 3.46Å; D61-Q65 PolarHBondContact O-N 2.72Å; E62-Q65 PolarHBondContact O-N 3.05Å; K63-Q65 VanDerWaalsContact C-N 3.29Å; K63-Q65 PolarHBondContact O-N 3.48Å
66	Y	91.9	Very high	89.8	Confident	9 Å²	9	63.4 Å²	63.4	4%	0.035	33%	0.326	C	S	.	.	H	α-helix	trans	-95.7	-2.3	-174.2	-63.8	-61.9	0	0	0	114.9	P26 T51 M55 E62 K63 P68 L69 A70	P26-Y66 HydrophobicContact CB-CE1 4.35Å; P26-Y66 HydrophobicContact CG-CE1 3.83Å; T51-Y66 HydrophobicContact CG2-CE2 4.04Å; M55-Y66 HydrophobicContact CE-CD2 3.96Å; M55-Y66 HydrophobicContact SD-CD2 3.7Å; M55-Y66 HydrophobicContact SD-CE2 4.19Å; E62-Y66 HydrophobicContact CB-CD2 4.31Å; E62-Y66 HydrophobicContact CB-CE2 4.4Å; E62-Y66 WeakPolarHBondContact O-CD2 3.36Å; E62-Y66 PolarHBondContact O-N 3.01Å; K63-Y66 PolarHBondContact O-N 3Å; Y66-P68 VanDerWaalsContact C-CD 3.49Å; Y66-P68 VanDerWaalsContact C-N 3.35Å; Y66-L69 HydrophobicContact CD1-CD2 4.26Å; Y66-L69 WeakPolarHBondContact O-CA 3.47Å; Y66-L69 WeakPolarHBondContact O-CB 3.35Å; Y66-L69 PolarHBondContact O-N 2.94Å; Y66-A70 PolarHBondContact O-N 3.39Å
67	L	90.8	Very high	89.9	Confident	62 Å²	62	61.6 Å²	61.6	33%	0.325	31%	0.313	S	S	.	.	H	α-helix	trans	-50.3	-44	174.7	178	59.5	0	0	0	113.6	K63 L69 A70 L71 Y101 P106	K63-L67 WeakPolarHBondContact O-CB 3.19Å; K63-L67 PolarHBondContact O-N 3.1Å; L67-L69 VanDerWaalsContact C-N 3.27Å; L67-L69 PolarHBondContact O-N 3.39Å; L67-A70 WeakPolarHBondContact O-CB 3.5Å; L67-A70 PolarHBondContact O-N 3.16Å; L67-L71 HydrophobicContact CD1-CD1 4.39Å; L67-L71 HydrophobicContact CD1-CG 4.27Å; L67-L71 HydrophobicContact CG-CD1 4.44Å; L67-L71 WeakPolarHBondContact O-CG 3.38Å; L67-L71 PolarHBondContact O-N 3.03Å; L67-Y101 WeakPolarHBondContact CA-OH 3.36Å; L67-Y101 WeakPolarHBondContact CB-OH 3.24Å; L67-Y101 HydrophobicContact CD1-CE1 3.96Å; L67-Y101 PolarHBondContact N-OH 3.4Å; L67-P106 HydrophobicContact CD1-CB 3.54Å
68	P	90.7	Very high	90.2	Very high	56 Å²	56	58 Å²	58	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-62.2	-31.9	175.2	-23.6	35.5	0	0	0	113.7	I23 Y66 H72	I23-P68 HydrophobicContact CG1-CB 4.4Å; Y66-P68 VanDerWaalsContact C-CD 3.49Å; Y66-P68 VanDerWaalsContact C-N 3.35Å; P68-H72 WeakPolarHBondContact O-CB 3.18Å; P68-H72 PolarHBondContact O-N 3.42Å
69	L	92.2	Very high	90.5	Very high	1 Å²	1	51 Å²	51	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-75.1	-38.6	176.3	179.8	58.8	0	0	0	111.4	I23 Y25 P26 V48 F52 Y66 L67 L71 H72 L73	I23-L69 HydrophobicContact CG2-CB 3.7Å; I23-L69 HydrophobicContact CG2-CD1 3.86Å; I23-L69 HydrophobicContact CG2-CG 4.35Å; Y25-L69 HydrophobicContact CD1-CD1 3.97Å; Y25-L69 HydrophobicContact CD1-CD2 4.31Å; Y25-L69 HydrophobicContact CE1-CD1 3.54Å; P26-L69 HydrophobicContact CG-CD2 4.48Å; V48-L69 HydrophobicContact CG1-CD2 3.91Å; V48-L69 HydrophobicContact CG1-CG 4.49Å; V48-L69 HydrophobicContact CG2-CD2 4.33Å; F52-L69 HydrophobicContact CE2-CD2 4.13Å; F52-L69 HydrophobicContact CE2-CG 4.21Å; F52-L69 HydrophobicContact CZ-CB 4.46Å; F52-L69 HydrophobicContact CZ-CD2 4.13Å; F52-L69 HydrophobicContact CZ-CG 4.15Å; Y66-L69 HydrophobicContact CD1-CD2 4.26Å; Y66-L69 WeakPolarHBondContact O-CA 3.47Å; Y66-L69 WeakPolarHBondContact O-CB 3.35Å; Y66-L69 PolarHBondContact O-N 2.94Å; L67-L69 VanDerWaalsContact C-N 3.27Å; L67-L69 PolarHBondContact O-N 3.39Å; L69-L71 VanDerWaalsContact C-N 3.32Å; L69-L71 PolarHBondContact O-N 2.9Å; L69-H72 PolarHBondContact O-N 2.93Å; L69-L73 HydrophobicContact CD1-CD1 4.35Å; L69-L73 HydrophobicContact CD1-CG 4.27Å; L69-L73 HydrophobicContact CG-CD1 4.21Å; L69-L73 WeakPolarHBondContact O-CG 3.29Å; L69-L73 PolarHBondContact O-N 3.5Å
70	A	92.2	Very high	90.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-41.7	174.2	0	0	0	0	0	111.7	Y66 L67 I97 Y107	Y66-A70 PolarHBondContact O-N 3.39Å; L67-A70 WeakPolarHBondContact O-CB 3.5Å; L67-A70 PolarHBondContact O-N 3.16Å; A70-I97 HydrophobicContact CB-CD1 3.66Å; A70-I97 HydrophobicContact CB-CG1 3.89Å; A70-I97 HydrophobicContact CB-CG2 3.99Å; A70-Y107 WeakPolarHBondContact O-CE1 3.27Å; A70-Y107 PolarHBondContact O-OH 3.09Å
71	L	91.9	Very high	91	Very high	86 Å²	86	53.5 Å²	53.5	45%	0.45	26%	0.26	S	S	.	.	H	α-helix	trans	-66	-45.3	173	-66.6	175.2	0	0	0	112.3	L67 L69 L73 A74 P106 Y107	L67-L71 HydrophobicContact CD1-CD1 4.39Å; L67-L71 HydrophobicContact CD1-CG 4.27Å; L67-L71 HydrophobicContact CG-CD1 4.44Å; L67-L71 WeakPolarHBondContact O-CG 3.38Å; L67-L71 PolarHBondContact O-N 3.03Å; L69-L71 VanDerWaalsContact C-N 3.32Å; L69-L71 PolarHBondContact O-N 2.9Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 2.73Å; L71-A74 PolarHBondContact O-N 3.03Å; L71-P106 WeakPolarHBondContact CD2-O 3.19Å; L71-Y107 HydrophobicContact CD2-CD1 4Å; L71-Y107 HydrophobicContact CD2-CE1 4.13Å
72	H	91.4	Very high	91.3	Very high	45 Å²	45	52.5 Å²	52.5	21%	0.208	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-39.1	179	-176.3	50.4	0	0	0	113.2	I23 Y25 I32 P68 L69 A74 S75 F78	I23-H72 HydrophobicContact CD1-CB 3.72Å; I23-H72 VanDerWaalsContact CD1-CG 3.49Å; I23-H72 HydrophobicContact CG1-CB 4.39Å; Y25-H72 PolarHBondContact OH-CD2 2.95Å; I32-H72 PolarHBondContact O-NE2 3.47Å; P68-H72 WeakPolarHBondContact O-CB 3.18Å; P68-H72 PolarHBondContact O-N 3.42Å; L69-H72 PolarHBondContact O-N 2.93Å; H72-A74 PolarHBondContact O-N 3.25Å; H72-S75 VanDerWaalsContact O-CB 3.23Å; H72-S75 WeakPolarHBondContact O-CB 3.3Å; H72-S75 PolarHBondContact O-N 3.37Å; H72-S75 PolarHBondContact O-OG 2.65Å; H72-F78 AromaticContact CD2-CE2 3.76Å; H72-F78 AromaticContact NE2-CE2 3.68Å; H72-F78 AromaticContact NE2-CZ 3.91Å; H72-F78 VanDerWaalsContact O-CD2 3.3Å; H72-F78 WeakPolarHBondContact O-CD2 3.34Å; H72-F78 WeakPolarHBondContact O-CE2 3.23Å
73	L	93	Very high	91.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-19.6	179.8	-74.5	169	0	0	0	114.2	L45 V48 F52 L69 L71 S75 F78 C93 I97	L45-L73 HydrophobicContact CD2-CD2 3.74Å; V48-L73 HydrophobicContact CG1-CD1 4Å; F52-L73 HydrophobicContact CD2-CD1 4.39Å; F52-L73 HydrophobicContact CE2-CD1 3.65Å; L69-L73 HydrophobicContact CD1-CD1 4.35Å; L69-L73 HydrophobicContact CD1-CG 4.27Å; L69-L73 HydrophobicContact CG-CD1 4.21Å; L69-L73 WeakPolarHBondContact O-CG 3.29Å; L69-L73 PolarHBondContact O-N 3.5Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 2.73Å; L73-S75 VanDerWaalsContact C-N 3.32Å; L73-F78 HydrophobicContact CD2-CD2 4.34Å; L73-F78 HydrophobicContact CD2-CE1 4.43Å; L73-F78 HydrophobicContact CD2-CE2 4.15Å; L73-F78 HydrophobicContact CD2-CZ 4.19Å; L73-C93 HydrophobicContact CD1-CB 3.81Å; L73-I97 HydrophobicContact CD1-CD1 4.29Å
74	A	92.8	Very high	91.8	Very high	4 Å²	4	56.8 Å²	56.8	3%	0.033	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.2	172.9	0	0	0	0	0	113.9	L71 H72 L79 L94 Y107 K112 I116	L71-A74 PolarHBondContact O-N 3.03Å; H72-A74 PolarHBondContact O-N 3.25Å; A74-L79 VanDerWaalsContact O-CD1 3.29Å; A74-L79 WeakPolarHBondContact O-CD1 3.39Å; A74-L94 HydrophobicContact CB-CD2 4.34Å; A74-Y107 HydrophobicContact CB-CD1 4.11Å; A74-Y107 HydrophobicContact CB-CE1 3.49Å; A74-Y107 VanDerWaalsContact CB-CE1 3.49Å; A74-K112 WeakPolarHBondContact O-CE 3.48Å; A74-K112 PolarHBondContact O-NZ 3.21Å; A74-I116 HydrophobicContact CB-CD1 3.91Å; A74-I116 HydrophobicContact CB-CG1 4.37Å
75	S	92.3	Very high	92	Very high	37 Å²	37	52.4 Å²	52.4	26%	0.259	26%	0.261	S	S	.	.	S	Bend	trans	-65.7	151.4	179.5	65.5	0	0	0	0	112.7	H72 L73 F77 F78 L79	H72-S75 VanDerWaalsContact O-CB 3.23Å; H72-S75 WeakPolarHBondContact O-CB 3.3Å; H72-S75 PolarHBondContact O-N 3.37Å; H72-S75 PolarHBondContact O-OG 2.65Å; L73-S75 VanDerWaalsContact C-N 3.32Å; S75-F77 PolarHBondContact O-N 3.09Å; S75-F77 VanDerWaalsContact O-N 3.09Å; S75-F78 PolarHBondContact O-N 2.97Å; S75-F78 WeakPolarHBondContact OG-CD2 3.39Å; S75-L79 PolarHBondContact O-N 2.69Å
76	E	90.1	Very high	92.3	Very high	88 Å²	88	47.7 Å²	47.7	41%	0.411	24%	0.239	S	C	.	.	H	α-helix	trans	-55.1	-31.7	-178.5	-67.2	-129.1	113.1	0	0	113.4	F78 L79 R80	E76-F78 PolarHBondContact O-N 3.17Å; E76-L79 PolarHBondContact O-N 2.7Å; E76-R80 VanDerWaalsContact CD-NE 3.26Å; E76-R80 WeakPolarHBondContact O-CB 3.36Å; E76-R80 PolarHBondContact O-N 3.32Å; E76-R80 IonicContact OE1-CZ 3.88Å; E76-R80 IonicContact OE1-NE 2.65Å; E76-R80 PolarHBondContact OE1-NE 2.78Å; E76-R80 IonicContact OE1-NH2 3.92Å; E76-R80 PolarHBondContact OE1-NH2 2.78Å; E76-R80 IonicContact OE2-CZ 2.68Å; E76-R80 IonicContact OE2-NE 2.69Å; E76-R80 PolarHBondContact OE2-NE 3.1Å; E76-R80 IonicContact OE2-NH2 2.69Å
77	F	90.3	Very high	92.5	Very high	66 Å²	66	49.7 Å²	49.7	29%	0.289	25%	0.247	S	C	.	.	H	α-helix	trans	-52.5	-36.8	175.4	169.5	-111.9	0	0	0	113.1	T33 D34 M41 S75 N81	T33-F77 WeakPolarHBondContact O-CZ 3.4Å; D34-F77 HydrophobicContact CB-CD2 4.41Å; D34-F77 HydrophobicContact CB-CE2 3.87Å; D34-F77 HydrophobicContact CB-CZ 4.36Å; M41-F77 HydrophobicContact CE-CE1 4.44Å; M41-F77 HydrophobicContact CE-CE2 4.46Å; M41-F77 HydrophobicContact CE-CZ 3.64Å; M41-F77 HydrophobicContact SD-CZ 4.21Å; S75-F77 PolarHBondContact O-N 3.09Å; S75-F77 VanDerWaalsContact O-N 3.09Å; F77-N81 WeakPolarHBondContact O-CB 3.06Å; F77-N81 PolarHBondContact O-ND2 2.98Å
78	F	93.8	Very high	92.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-88.7	-46.5	175.5	-65.8	-64.8	0	0	0	112.1	I32 L45 H72 L73 S75 E76 R80 N81 V90	I32-F78 HydrophobicContact CB-CZ 4.31Å; I32-F78 HydrophobicContact CG2-CE1 3.69Å; I32-F78 HydrophobicContact CG2-CZ 3.65Å; L45-F78 HydrophobicContact CD2-CE1 4.37Å; H72-F78 AromaticContact CD2-CE2 3.76Å; H72-F78 AromaticContact NE2-CE2 3.68Å; H72-F78 AromaticContact NE2-CZ 3.91Å; H72-F78 VanDerWaalsContact O-CD2 3.3Å; H72-F78 WeakPolarHBondContact O-CD2 3.34Å; H72-F78 WeakPolarHBondContact O-CE2 3.23Å; L73-F78 HydrophobicContact CD2-CD2 4.34Å; L73-F78 HydrophobicContact CD2-CE1 4.43Å; L73-F78 HydrophobicContact CD2-CE2 4.15Å; L73-F78 HydrophobicContact CD2-CZ 4.19Å; S75-F78 PolarHBondContact O-N 2.97Å; S75-F78 WeakPolarHBondContact OG-CD2 3.39Å; E76-F78 PolarHBondContact O-N 3.17Å; F78-R80 VanDerWaalsContact C-N 3.33Å; F78-R80 PolarHBondContact O-N 2.72Å; F78-N81 WeakPolarHBondContact O-CB 3.3Å; F78-N81 PolarHBondContact O-N 2.85Å; F78-V90 HydrophobicContact CB-CB 4.46Å; F78-V90 HydrophobicContact CB-CG1 3.9Å; F78-V90 HydrophobicContact CB-CG2 3.77Å; F78-V90 HydrophobicContact CD1-CG2 3.73Å; F78-V90 HydrophobicContact CG-CG2 3.98Å
79	L	93.5	Very high	93	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-33.5	-175.8	-57.7	-174	0	0	0	113.3	A74 S75 E76 V90 L94 D115 I116 F119	A74-L79 VanDerWaalsContact O-CD1 3.29Å; A74-L79 WeakPolarHBondContact O-CD1 3.39Å; S75-L79 PolarHBondContact O-N 2.69Å; E76-L79 PolarHBondContact O-N 2.7Å; L79-V90 HydrophobicContact CD2-CG1 4.44Å; L79-L94 HydrophobicContact CD2-CD1 3.82Å; L79-D115 HydrophobicContact CD1-CB 4.19Å; L79-I116 HydrophobicContact CD1-CG1 4.42Å; L79-F119 HydrophobicContact CB-CD2 4.11Å; L79-F119 HydrophobicContact CB-CE2 4.44Å; L79-F119 HydrophobicContact CB-CG 4.45Å; L79-F119 HydrophobicContact CD2-CB 4.22Å; L79-F119 HydrophobicContact CD2-CD1 3.63Å; L79-F119 HydrophobicContact CD2-CD2 4.04Å; L79-F119 HydrophobicContact CD2-CE1 3.87Å; L79-F119 HydrophobicContact CD2-CE2 4.23Å; L79-F119 HydrophobicContact CD2-CG 3.72Å; L79-F119 HydrophobicContact CD2-CZ 4.15Å; L79-F119 WeakPolarHBondContact O-CD2 3.44Å; L79-F119 WeakPolarHBondContact O-CE2 3.47Å
80	R	92.5	Very high	93.2	Very high	172 Å²	172	44.2 Å²	44.2	65%	0.649	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	6.7	177.8	-55.6	-169	-173.1	-139.7	5.6	113.4	E76 F78	E76-R80 VanDerWaalsContact CD-NE 3.26Å; E76-R80 WeakPolarHBondContact O-CB 3.36Å; E76-R80 PolarHBondContact O-N 3.32Å; E76-R80 IonicContact OE1-CZ 3.88Å; E76-R80 IonicContact OE1-NE 2.65Å; E76-R80 PolarHBondContact OE1-NE 2.78Å; E76-R80 IonicContact OE1-NH2 3.92Å; E76-R80 PolarHBondContact OE1-NH2 2.78Å; E76-R80 IonicContact OE2-CZ 2.68Å; E76-R80 IonicContact OE2-NE 2.69Å; E76-R80 PolarHBondContact OE2-NE 3.1Å; E76-R80 IonicContact OE2-NH2 2.69Å; F78-R80 VanDerWaalsContact C-N 3.33Å; F78-R80 PolarHBondContact O-N 2.72Å
81	N	93.1	Very high	93.4	Very high	16 Å²	16	44.2 Å²	44.2	9%	0.086	22%	0.215	C	C	.	.			trans	-57.8	133.9	-175.2	-164.1	-77.6	0	0	0	111.8	F77 F78 N83 V86 R87	F77-N81 WeakPolarHBondContact O-CB 3.06Å; F77-N81 PolarHBondContact O-ND2 2.98Å; F78-N81 WeakPolarHBondContact O-CB 3.3Å; F78-N81 PolarHBondContact O-N 2.85Å; N81-N83 VanDerWaalsContact C-N 3.32Å; N81-N83 PolarHBondContact O-N 2.61Å; N81-N83 PolarHBondContact OD1-N 2.74Å; N81-V86 HydrophobicContact CB-CG1 3.9Å; N81-R87 HydrophobicContact CB-CG 4.19Å; N81-R87 VanDerWaalsContact O-CD 3.23Å; N81-R87 WeakPolarHBondContact O-CD 3.37Å; N81-R87 WeakPolarHBondContact O-CG 3.43Å; N81-R87 PolarHBondContact O-NH1 3.43Å
82	P	91.9	Very high	93.7	Very high	119 Å²	119	40.1 Å²	40.1	77%	0.773	19%	0.193	S	C	*	.	S	Bend	trans	-67.4	-28.3	-176.5	25.3	-34.5	0	0	0	113.8	R87	P82-R87 VanDerWaalsContact C-NH1 3.27Å; P82-R87 PolarHBondContact O-NH1 2.71Å
83	N	93.4	Very high	93.9	Very high	46 Å²	46	38 Å²	38	25%	0.246	18%	0.183	C	C	.	.			trans	-76.6	132.6	-176	-179.4	-75.3	0	0	0	112.5	T38 N81 D85 V86 R87	T38-N83 HydrophobicContact CG2-CB 3.85Å; N81-N83 VanDerWaalsContact C-N 3.32Å; N81-N83 PolarHBondContact O-N 2.61Å; N81-N83 PolarHBondContact OD1-N 2.74Å; N83-D85 WeakPolarHBondContact OD1-CA 3.28Å; N83-D85 WeakPolarHBondContact OD1-CB 3.35Å; N83-D85 PolarHBondContact OD1-N 3.47Å; N83-V86 HydrophobicContact CB-CB 4.12Å; N83-V86 HydrophobicContact CB-CG2 3.88Å; N83-V86 PolarHBondContact OD1-N 2.84Å; N83-R87 PolarHBondContact O-N 2.83Å; N83-R87 PolarHBondContact O-NH1 3.43Å
84	K	92.8	Very high	94	Very high	143 Å²	143	38 Å²	38	62%	0.622	18%	0.183	S	C	*	.	H	α-helix	trans	-66	-43.5	-178.6	-77.2	-173.3	174.7	-174.9	0	113.3	R87 L88	K84-R87 PolarHBondContact O-N 3.43Å; K84-L88 WeakPolarHBondContact O-CB 3.44Å; K84-L88 PolarHBondContact O-N 2.97Å
85	D	92.7	Very high	94.2	Very high	47 Å²	47	37.8 Å²	37.8	25%	0.251	18%	0.182	S	C	.	.	H	α-helix	trans	-67.8	-39.3	-179.6	-66.1	-81.1	0	0	0	111.9	I42 N83 L88 L89 Q134	I42-D85 HydrophobicContact CD1-CB 3.88Å; I42-D85 HydrophobicContact CG1-CB 4.24Å; N83-D85 WeakPolarHBondContact OD1-CA 3.28Å; N83-D85 WeakPolarHBondContact OD1-CB 3.35Å; N83-D85 PolarHBondContact OD1-N 3.47Å; D85-L88 PolarHBondContact O-N 3.24Å; D85-L89 VanDerWaalsContact O-CG 3.25Å; D85-L89 WeakPolarHBondContact O-CG 3.19Å; D85-L89 PolarHBondContact O-N 3.26Å; D85-Q134 VanDerWaalsContact OD1-CG 3.32Å; D85-Q134 WeakPolarHBondContact OD1-CG 3.47Å; D85-Q134 PolarHBondContact OD1-NE2 3.4Å
86	V	94.6	Very high	94.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-53.7	173.2	173.1	0	0	0	0	110.3	T38 M41 I42 L45 N81 N83 L88 L89 V90	T38-V86 HydrophobicContact CG2-CG2 4.19Å; M41-V86 HydrophobicContact CG-CG2 4.5Å; M41-V86 HydrophobicContact SD-CG1 4.02Å; M41-V86 HydrophobicContact SD-CG2 3.96Å; I42-V86 HydrophobicContact CD1-CG2 4.27Å; I42-V86 HydrophobicContact CG1-CG2 3.69Å; L45-V86 HydrophobicContact CD1-CB 4.42Å; L45-V86 HydrophobicContact CD1-CG1 3.82Å; L45-V86 HydrophobicContact CD1-CG2 4.47Å; N81-V86 HydrophobicContact CB-CG1 3.9Å; N83-V86 HydrophobicContact CB-CB 4.12Å; N83-V86 HydrophobicContact CB-CG2 3.88Å; N83-V86 PolarHBondContact OD1-N 2.84Å; V86-L88 VanDerWaalsContact C-N 3.28Å; V86-L88 PolarHBondContact O-N 3.04Å; V86-L89 PolarHBondContact O-N 3.45Å; V86-V90 HydrophobicContact CG1-CG2 4.39Å; V86-V90 VanDerWaalsContact O-CG2 3.23Å; V86-V90 WeakPolarHBondContact O-CG2 3.46Å; V86-V90 PolarHBondContact O-N 3.35Å
87	R	96.3	Very high	94.5	Very high	51 Å²	51	31.8 Å²	31.8	19%	0.192	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-34.1	178.5	-66.1	-165.3	-52.2	-85.6	2.9	113	N81 P82 N83 K84 A91 F119 Q123	N81-R87 HydrophobicContact CB-CG 4.19Å; N81-R87 VanDerWaalsContact O-CD 3.23Å; N81-R87 WeakPolarHBondContact O-CD 3.37Å; N81-R87 WeakPolarHBondContact O-CG 3.43Å; N81-R87 PolarHBondContact O-NH1 3.43Å; P82-R87 VanDerWaalsContact C-NH1 3.27Å; P82-R87 PolarHBondContact O-NH1 2.71Å; N83-R87 PolarHBondContact O-N 2.83Å; N83-R87 PolarHBondContact O-NH1 3.43Å; K84-R87 PolarHBondContact O-N 3.43Å; R87-A91 WeakPolarHBondContact O-CB 3.31Å; R87-A91 PolarHBondContact O-N 3.44Å; R87-F119 HydrophobicContact CB-CE2 3.81Å; R87-F119 HydrophobicContact CB-CZ 3.95Å; R87-F119 HydrophobicContact CG-CE2 3.86Å; R87-F119 HydrophobicContact CG-CZ 4.38Å; R87-F119 VanDerWaalsContact O-CZ 3.27Å; R87-F119 WeakPolarHBondContact O-CZ 3.49Å; R87-Q123 VanDerWaalsContact C-NE2 3.32Å; R87-Q123 HydrophobicContact CB-CG 4.42Å
88	L	96.5	Very high	94.7	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-67.9	-45.8	176.6	175.7	53.9	0	0	0	111.9	K84 D85 V86 V90 A91 C92 Q134 R137 Y138	K84-L88 WeakPolarHBondContact O-CB 3.44Å; K84-L88 PolarHBondContact O-N 2.97Å; D85-L88 PolarHBondContact O-N 3.24Å; V86-L88 VanDerWaalsContact C-N 3.28Å; V86-L88 PolarHBondContact O-N 3.04Å; L88-V90 VanDerWaalsContact C-N 3.34Å; L88-V90 PolarHBondContact O-N 2.87Å; L88-A91 PolarHBondContact O-N 3.38Å; L88-C92 PolarHBondContact O-N 2.76Å; L88-C92 PolarHBondContact O-SG 3.32Å; L88-Q134 HydrophobicContact CD2-CB 3.75Å; L88-Q134 HydrophobicContact CD2-CG 4.01Å; L88-R137 HydrophobicContact CD1-CB 4.1Å; L88-R137 HydrophobicContact CD2-CB 3.79Å; L88-R137 HydrophobicContact CG-CB 4.04Å; L88-Y138 HydrophobicContact CB-CE1 4.43Å; L88-Y138 HydrophobicContact CD1-CD1 3.54Å; L88-Y138 HydrophobicContact CD1-CE1 3.56Å; L88-Y138 HydrophobicContact CD1-CG 4.06Å; L88-Y138 HydrophobicContact CD2-CD1 4.41Å; L88-Y138 HydrophobicContact CD2-CD2 4.09Å; L88-Y138 HydrophobicContact CD2-CE1 4.04Å; L88-Y138 HydrophobicContact CD2-CE2 3.69Å; L88-Y138 HydrophobicContact CD2-CG 4.43Å; L88-Y138 HydrophobicContact CG-CE1 4.21Å
89	L	96.1	Very high	94.7	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-41.9	177.4	-66.1	165.2	0	0	0	111.1	I42 L45 K46 V49 D85 V86 C92 C93	I42-L89 HydrophobicContact CB-CD1 4.43Å; I42-L89 HydrophobicContact CG2-CD1 4.07Å; L45-L89 HydrophobicContact CB-CB 3.92Å; L45-L89 HydrophobicContact CB-CD1 3.84Å; L45-L89 HydrophobicContact CB-CG 4.47Å; K46-L89 HydrophobicContact CG-CD1 3.89Å; K46-L89 HydrophobicContact CG-CD2 3.77Å; V49-L89 HydrophobicContact CG2-CB 3.97Å; V49-L89 HydrophobicContact CG2-CD2 3.92Å; V49-L89 WeakPolarHBondContact CG2-O 3.49Å; D85-L89 VanDerWaalsContact O-CG 3.25Å; D85-L89 WeakPolarHBondContact O-CG 3.19Å; D85-L89 PolarHBondContact O-N 3.26Å; V86-L89 PolarHBondContact O-N 3.45Å; L89-C92 WeakPolarHBondContact O-CB 3.5Å; L89-C92 PolarHBondContact O-N 3.31Å; L89-C93 PolarHBondContact O-N 3.23Å; L89-C93 PolarHBondContact O-SG 3.42Å; L89-C93 VanDerWaalsContact O-SG 3.41Å
90	V	96.5	Very high	94.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-46.4	173.5	170.7	0	0	0	0	111.1	L45 F78 L79 V86 L88 C92 C93 L94 F119	L45-V90 HydrophobicContact CD1-CG2 4.24Å; L45-V90 HydrophobicContact CD2-CG2 4.31Å; F78-V90 HydrophobicContact CB-CB 4.46Å; F78-V90 HydrophobicContact CB-CG1 3.9Å; F78-V90 HydrophobicContact CB-CG2 3.77Å; F78-V90 HydrophobicContact CD1-CG2 3.73Å; F78-V90 HydrophobicContact CG-CG2 3.98Å; L79-V90 HydrophobicContact CD2-CG1 4.44Å; V86-V90 HydrophobicContact CG1-CG2 4.39Å; V86-V90 VanDerWaalsContact O-CG2 3.23Å; V86-V90 WeakPolarHBondContact O-CG2 3.46Å; V86-V90 PolarHBondContact O-N 3.35Å; L88-V90 VanDerWaalsContact C-N 3.34Å; L88-V90 PolarHBondContact O-N 2.87Å; V90-C92 VanDerWaalsContact C-N 3.31Å; V90-C92 PolarHBondContact O-N 3.29Å; V90-C93 WeakPolarHBondContact O-CB 3.32Å; V90-C93 PolarHBondContact O-N 2.9Å; V90-C93 VanDerWaalsContact O-N 3.16Å; V90-L94 HydrophobicContact CG1-CD1 3.87Å; V90-L94 HydrophobicContact CG1-CG 4.28Å; V90-L94 WeakPolarHBondContact O-CG 3.17Å; V90-L94 PolarHBondContact O-N 3.24Å; V90-F119 HydrophobicContact CB-CE1 4.46Å; V90-F119 HydrophobicContact CB-CZ 4.12Å; V90-F119 HydrophobicContact CG1-CE1 3.89Å; V90-F119 HydrophobicContact CG1-CZ 3.82Å
91	A	97	Very high	94.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.6	-37.7	177.8	0	0	0	0	0	112.7	R87 L88 L94 A95 F119 Q123 L141	R87-A91 WeakPolarHBondContact O-CB 3.31Å; R87-A91 PolarHBondContact O-N 3.44Å; L88-A91 PolarHBondContact O-N 3.38Å; A91-L94 PolarHBondContact O-N 3.45Å; A91-A95 PolarHBondContact O-N 3.02Å; A91-A95 VanDerWaalsContact O-N 3.07Å; A91-F119 HydrophobicContact CB-CE1 3.78Å; A91-F119 HydrophobicContact CB-CZ 4.37Å; A91-Q123 HydrophobicContact CB-CB 4.16Å; A91-Q123 HydrophobicContact CB-CG 4.14Å; A91-L141 HydrophobicContact CB-CD1 4.15Å; A91-L141 HydrophobicContact CB-CD2 3.8Å; A91-L141 VanDerWaalsContact O-CD1 3.3Å; A91-L141 WeakPolarHBondContact O-CD1 3.41Å
92	C	96.6	Very high	94.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-49.9	171.4	-64.2	0	0	0	0	111.4	V49 L88 L89 V90 L94 A95 D96	V49-C92 HydrophobicContact CG1-CB 4Å; V49-C92 HydrophobicContact CG2-CB 4.07Å; L88-C92 PolarHBondContact O-N 2.76Å; L88-C92 PolarHBondContact O-SG 3.32Å; L89-C92 WeakPolarHBondContact O-CB 3.5Å; L89-C92 PolarHBondContact O-N 3.31Å; V90-C92 VanDerWaalsContact C-N 3.31Å; V90-C92 PolarHBondContact O-N 3.29Å; C92-L94 VanDerWaalsContact C-N 3.32Å; C92-L94 PolarHBondContact O-N 2.88Å; C92-A95 PolarHBondContact O-N 2.94Å; C92-D96 PolarHBondContact O-N 3.06Å
93	C	95.9	Very high	94	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-56.4	-44.4	175.6	-64.1	0	0	0	0	112.4	V49 F52 L73 L89 V90 A95 D96 I97	V49-C93 WeakPolarHBondContact CG2-SG 3.36Å; F52-C93 HydrophobicContact CD2-CB 4.1Å; L73-C93 HydrophobicContact CD1-CB 3.81Å; L89-C93 PolarHBondContact O-N 3.23Å; L89-C93 PolarHBondContact O-SG 3.42Å; L89-C93 VanDerWaalsContact O-SG 3.41Å; V90-C93 WeakPolarHBondContact O-CB 3.32Å; V90-C93 PolarHBondContact O-N 2.9Å; V90-C93 VanDerWaalsContact O-N 3.16Å; C93-A95 PolarHBondContact O-N 3.16Å; C93-D96 PolarHBondContact O-N 3.47Å; C93-I97 HydrophobicContact CB-CD1 4.42Å; C93-I97 WeakPolarHBondContact O-CB 3.3Å; C93-I97 WeakPolarHBondContact O-CD1 3.25Å; C93-I97 WeakPolarHBondContact O-CG1 3.19Å; C93-I97 PolarHBondContact O-N 3.17Å
94	L	96.1	Very high	93.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.5	-37.2	-178.2	-66.9	172.7	0	0	0	112.1	A74 L79 V90 A91 C92 I97 F98 Y107 I116 F119 I120	A74-L94 HydrophobicContact CB-CD2 4.34Å; L79-L94 HydrophobicContact CD2-CD1 3.82Å; V90-L94 HydrophobicContact CG1-CD1 3.87Å; V90-L94 HydrophobicContact CG1-CG 4.28Å; V90-L94 WeakPolarHBondContact O-CG 3.17Å; V90-L94 PolarHBondContact O-N 3.24Å; A91-L94 PolarHBondContact O-N 3.45Å; C92-L94 VanDerWaalsContact C-N 3.32Å; C92-L94 PolarHBondContact O-N 2.88Å; L94-I97 HydrophobicContact CD2-CD1 4.39Å; L94-I97 PolarHBondContact O-N 3.24Å; L94-F98 WeakPolarHBondContact O-CD2 3.36Å; L94-F98 PolarHBondContact O-N 2.99Å; L94-Y107 HydrophobicContact CD2-CE2 4.34Å; L94-Y107 WeakPolarHBondContact CD2-OH 3.3Å; L94-I116 HydrophobicContact CD1-CG1 4.46Å; L94-I116 HydrophobicContact CD1-CG2 4.18Å; L94-F119 HydrophobicContact CD1-CD1 4Å; L94-F119 HydrophobicContact CD1-CE1 3.85Å; L94-I120 HydrophobicContact CB-CD1 4.4Å
95	A	95.6	Very high	93.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.5	-45.1	172.7	0	0	0	0	0	111.8	A91 C92 C93 I97 F98 R99 L141 N144 L145	A91-A95 PolarHBondContact O-N 3.02Å; A91-A95 VanDerWaalsContact O-N 3.07Å; C92-A95 PolarHBondContact O-N 2.94Å; C93-A95 PolarHBondContact O-N 3.16Å; A95-I97 VanDerWaalsContact C-N 3.33Å; A95-I97 PolarHBondContact O-N 3.4Å; A95-F98 PolarHBondContact O-N 2.8Å; A95-R99 PolarHBondContact O-N 3.4Å; A95-L141 HydrophobicContact CB-CD1 3.78Å; A95-N144 HydrophobicContact CB-CB 4.39Å; A95-N144 PolarHBondContact O-OD1 3.28Å; A95-L145 HydrophobicContact CB-CD2 4.01Å; A95-L145 HydrophobicContact CB-CG 4.16Å
96	D	95	Very high	93	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-31.8	174.4	-81.4	-57.4	0	0	0	113.7	F52 C92 C93 R99 I100 Y140 N144	F52-D96 HydrophobicContact CB-CB 3.79Å; C92-D96 PolarHBondContact O-N 3.06Å; C93-D96 PolarHBondContact O-N 3.47Å; D96-R99 WeakPolarHBondContact O-CA 3.45Å; D96-R99 VanDerWaalsContact O-CB 3.31Å; D96-R99 WeakPolarHBondContact O-CB 3.09Å; D96-R99 PolarHBondContact O-N 3.27Å; D96-R99 VanDerWaalsContact O-N 3.16Å; D96-R99 IonicContact OD1-CZ 3.7Å; D96-R99 IonicContact OD1-NE 3.68Å; D96-R99 PolarHBondContact OD1-NE 3.34Å; D96-R99 IonicContact OD1-NH2 3.11Å; D96-R99 PolarHBondContact OD1-NH2 2.9Å; D96-I100 WeakPolarHBondContact O-CB 3.33Å; D96-I100 VanDerWaalsContact O-CD1 3.32Å; D96-I100 WeakPolarHBondContact O-CD1 3.28Å; D96-I100 WeakPolarHBondContact O-CG1 3.47Å; D96-I100 PolarHBondContact O-N 3.49Å; D96-Y140 VanDerWaalsContact CG-OH 3.28Å; D96-Y140 PolarHBondContact OD1-OH 2.97Å; D96-Y140 PolarHBondContact OD2-OH 2.82Å; D96-N144 PolarHBondContact OD1-ND2 2.85Å
97	I	94.9	Very high	92.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-44.4	172.2	-71.2	157	0	0	0	110	F52 A70 L73 C93 L94 A95 R99 I100 Y101 P106 Y107	F52-I97 HydrophobicContact CD1-CG1 4.28Å; F52-I97 HydrophobicContact CE1-CG1 4.21Å; F52-I97 HydrophobicContact CE2-CD1 4.19Å; F52-I97 HydrophobicContact CE2-CG1 4.46Å; F52-I97 HydrophobicContact CG-CG1 4.44Å; F52-I97 HydrophobicContact CZ-CD1 4.28Å; F52-I97 HydrophobicContact CZ-CG1 4.3Å; A70-I97 HydrophobicContact CB-CD1 3.66Å; A70-I97 HydrophobicContact CB-CG1 3.89Å; A70-I97 HydrophobicContact CB-CG2 3.99Å; L73-I97 HydrophobicContact CD1-CD1 4.29Å; C93-I97 HydrophobicContact CB-CD1 4.42Å; C93-I97 WeakPolarHBondContact O-CB 3.3Å; C93-I97 WeakPolarHBondContact O-CD1 3.25Å; C93-I97 WeakPolarHBondContact O-CG1 3.19Å; C93-I97 PolarHBondContact O-N 3.17Å; L94-I97 HydrophobicContact CD2-CD1 4.39Å; L94-I97 PolarHBondContact O-N 3.24Å; A95-I97 VanDerWaalsContact C-N 3.33Å; A95-I97 PolarHBondContact O-N 3.4Å; I97-R99 VanDerWaalsContact C-N 3.25Å; I97-R99 PolarHBondContact O-N 2.95Å; I97-I100 PolarHBondContact O-N 3.25Å; I97-Y101 HydrophobicContact CG2-CD2 4.07Å; I97-Y101 HydrophobicContact CG2-CE2 4.39Å; I97-Y101 WeakPolarHBondContact O-CB 3.28Å; I97-Y101 VanDerWaalsContact O-CD2 3.3Å; I97-Y101 WeakPolarHBondContact O-CD2 3.25Å; I97-Y101 PolarHBondContact O-N 2.91Å; I97-Y101 VanDerWaalsContact O-N 3.09Å; I97-P106 HydrophobicContact CG2-CG 3.58Å; I97-Y107 HydrophobicContact CG2-CE2 3.94Å
98	F	94.4	Very high	92.1	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-32.6	171.1	-69.8	-57.4	0	0	0	112.6	L94 A95 A102 A105 Y107 L113 I116 F117 I120 I153	L94-F98 WeakPolarHBondContact O-CD2 3.36Å; L94-F98 PolarHBondContact O-N 2.99Å; A95-F98 PolarHBondContact O-N 2.8Å; F98-A102 WeakPolarHBondContact O-CB 3.5Å; F98-A102 PolarHBondContact O-N 3.03Å; F98-A105 HydrophobicContact CD1-CB 3.92Å; F98-A105 HydrophobicContact CE1-CB 3.96Å; F98-Y107 AromaticContact CE1-CD2 3.9Å; F98-Y107 HydrophobicContact CE1-CD2 3.9Å; F98-Y107 HydrophobicContact CE1-CE2 4.26Å; F98-Y107 HydrophobicContact CZ-CD2 4.1Å; F98-Y107 HydrophobicContact CZ-CE2 4.29Å; F98-L113 HydrophobicContact CE1-CD2 3.92Å; F98-L113 HydrophobicContact CZ-CD2 4.09Å; F98-I116 HydrophobicContact CE2-CG2 3.58Å; F98-I116 HydrophobicContact CZ-CG2 3.75Å; F98-F117 HydrophobicContact CD2-CE1 4.33Å; F98-F117 HydrophobicContact CD2-CZ 4.19Å; F98-F117 HydrophobicContact CE1-CE2 4.23Å; F98-F117 AromaticContact CE1-CZ 3.94Å; F98-F117 HydrophobicContact CE1-CZ 3.94Å; F98-F117 AromaticContact CE2-CE1 3.83Å; F98-F117 HydrophobicContact CE2-CE1 3.83Å; F98-F117 HydrophobicContact CE2-CE2 4.21Å; F98-F117 AromaticContact CE2-CZ 3.58Å; F98-F117 HydrophobicContact CE2-CZ 3.58Å; F98-F117 HydrophobicContact CZ-CE1 4.15Å; F98-F117 AromaticContact CZ-CE2 3.69Å; F98-F117 HydrophobicContact CZ-CE2 3.69Å; F98-F117 AromaticContact CZ-CZ 3.43Å; F98-F117 HydrophobicContact CZ-CZ 3.43Å; F98-F117 VanDerWaalsContact CZ-CZ 3.43Å; F98-I120 HydrophobicContact CE2-CD1 4.06Å; F98-I153 HydrophobicContact CD1-CD1 3.49Å; F98-I153 VanDerWaalsContact CD1-CD1 3.49Å; F98-I153 HydrophobicContact CE1-CD1 3.87Å; F98-I153 HydrophobicContact CG-CD1 4.22Å
99	R	94.3	Very high	91.8	Very high	26 Å²	26	30 Å²	30	10%	0.098	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-56.6	173.3	-172.9	177.4	62.1	74.2	5.3	111.7	F52 M53 M55 Q57 A95 D96 I97 Y101 A102 W147 V148	F52-R99 PolarHBondContact O-NH2 3.07Å; M53-R99 PolarHBondContact O-NH2 3.43Å; M55-R99 VanDerWaalsContact O-CZ 3.28Å; M55-R99 PolarHBondContact O-NH1 3.06Å; M55-R99 PolarHBondContact O-NH2 3.15Å; Q57-R99 VanDerWaalsContact CG-O 3.3Å; Q57-R99 WeakPolarHBondContact CG-O 3.31Å; Q57-R99 PolarHBondContact NE2-O 3.22Å; A95-R99 PolarHBondContact O-N 3.4Å; D96-R99 WeakPolarHBondContact O-CA 3.45Å; D96-R99 VanDerWaalsContact O-CB 3.31Å; D96-R99 WeakPolarHBondContact O-CB 3.09Å; D96-R99 PolarHBondContact O-N 3.27Å; D96-R99 VanDerWaalsContact O-N 3.16Å; D96-R99 IonicContact OD1-CZ 3.7Å; D96-R99 IonicContact OD1-NE 3.68Å; D96-R99 PolarHBondContact OD1-NE 3.34Å; D96-R99 IonicContact OD1-NH2 3.11Å; D96-R99 PolarHBondContact OD1-NH2 2.9Å; I97-R99 VanDerWaalsContact C-N 3.25Å; I97-R99 PolarHBondContact O-N 2.95Å; R99-Y101 VanDerWaalsContact C-N 3.32Å; R99-Y101 PolarHBondContact O-N 3.13Å; R99-A102 PolarHBondContact O-N 3.02Å; R99-W147 HydrophobicContact CG-CZ3 4.12Å; R99-V148 HydrophobicContact CB-CG2 3.7Å; R99-V148 HydrophobicContact CG-CG2 3.71Å
100	I	93.6	Very high	91.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.3	-35.3	-172.9	-66.6	156.9	0	0	0	112.2	F52 M55 K63 D96 I97	F52-I100 HydrophobicContact CB-CD1 4.19Å; F52-I100 HydrophobicContact CD1-CD1 3.73Å; F52-I100 HydrophobicContact CG-CD1 4.43Å; F52-I100 WeakPolarHBondContact O-CD1 3.42Å; M55-I100 HydrophobicContact CB-CD1 3.75Å; M55-I100 HydrophobicContact CB-CG1 4.11Å; M55-I100 HydrophobicContact CE-CD1 4.16Å; M55-I100 HydrophobicContact CE-CG2 4.29Å; M55-I100 HydrophobicContact SD-CD1 4.26Å; K63-I100 HydrophobicContact CD-CG2 3.88Å; K63-I100 HydrophobicContact CG-CG2 3.5Å; K63-I100 VanDerWaalsContact CG-CG2 3.5Å; D96-I100 WeakPolarHBondContact O-CB 3.33Å; D96-I100 VanDerWaalsContact O-CD1 3.32Å; D96-I100 WeakPolarHBondContact O-CD1 3.28Å; D96-I100 WeakPolarHBondContact O-CG1 3.47Å; D96-I100 PolarHBondContact O-N 3.49Å; I97-I100 PolarHBondContact O-N 3.25Å
101	Y	91.2	Very high	91.1	Very high	26 Å²	26	40.5 Å²	40.5	10%	0.102	23%	0.229	C	C	.	.	H	α-helix	trans	-96.8	-3.1	-174.5	-73.6	-102.3	0	0	0	114.1	K63 L67 I97 R99 P103 E104 P106	K63-Y101 PolarHBondContact O-OH 3.47Å; L67-Y101 WeakPolarHBondContact CA-OH 3.36Å; L67-Y101 WeakPolarHBondContact CB-OH 3.24Å; L67-Y101 HydrophobicContact CD1-CE1 3.96Å; L67-Y101 PolarHBondContact N-OH 3.4Å; I97-Y101 HydrophobicContact CG2-CD2 4.07Å; I97-Y101 HydrophobicContact CG2-CE2 4.39Å; I97-Y101 WeakPolarHBondContact O-CB 3.28Å; I97-Y101 VanDerWaalsContact O-CD2 3.3Å; I97-Y101 WeakPolarHBondContact O-CD2 3.25Å; I97-Y101 PolarHBondContact O-N 2.91Å; I97-Y101 VanDerWaalsContact O-N 3.09Å; R99-Y101 VanDerWaalsContact C-N 3.32Å; R99-Y101 PolarHBondContact O-N 3.13Å; Y101-P103 CarbonylContact O-C 3.49Å; Y101-E104 CarbonylContact O-C 3.56Å; Y101-E104 VanDerWaalsContact O-C 3.28Å; Y101-E104 PolarHBondContact O-N 3.43Å; Y101-E104 VanDerWaalsContact O-O 3.07Å; Y101-P106 HydrophobicContact CD1-CB 4.09Å; Y101-P106 HydrophobicContact CD1-CG 4.17Å; Y101-P106 HydrophobicContact CD2-CG 4.36Å; Y101-P106 HydrophobicContact CE1-CB 4.2Å; Y101-P106 HydrophobicContact CE1-CG 4.47Å; Y101-P106 HydrophobicContact CG-CG 4.1Å
102	A	86.8	Confident	90.8	Very high	40 Å²	40	42.7 Å²	42.7	33%	0.331	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	133.5	177	0	0	0	0	0	111.2	F98 R99	F98-A102 WeakPolarHBondContact O-CB 3.5Å; F98-A102 PolarHBondContact O-N 3.03Å; R99-A102 PolarHBondContact O-N 3.02Å
103	P	83.3	Confident	90.6	Very high	123 Å²	123	43.3 Å²	43.3	80%	0.799	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	cis	-85.6	-23.3	8	33.4	-35.3	0	0	0	115.8	Y101 A105	Y101-P103 CarbonylContact O-C 3.49Å; P103-A105 PolarHBondContact O-N 3.36Å
104	E	84.6	Confident	90.4	Very high	166 Å²	166	45.3 Å²	45.3	78%	0.776	25%	0.251	S	S	*	.	S	Bend	trans	-90.4	91.4	-173.2	-69.3	-173.3	-173.5	0	0	112.4	Y101	Y101-E104 CarbonylContact O-C 3.56Å; Y101-E104 VanDerWaalsContact O-C 3.28Å; Y101-E104 PolarHBondContact O-N 3.43Å; Y101-E104 VanDerWaalsContact O-O 3.07Å
105	A	86.2	Confident	90.3	Very high	24 Å²	24	47.6 Å²	47.6	20%	0.198	26%	0.263	C	S	.	.			trans	-60.6	141.1	178.4	0	0	0	0	0	112.7	F98 P103 Y107 I153	F98-A105 HydrophobicContact CD1-CB 3.92Å; F98-A105 HydrophobicContact CE1-CB 3.96Å; P103-A105 PolarHBondContact O-N 3.36Å; A105-Y107 PolarHBondContact O-N 3.1Å; A105-I153 HydrophobicContact CB-CD1 4.15Å
106	P	87.4	Confident	90.2	Very high	21 Å²	21	47.6 Å²	47.6	14%	0.136	26%	0.263	C	S	.	.	S	Bend	trans	-74.2	3	-174	31.3	-36.5	0	0	0	114.2	L67 L71 I97 Y101	L67-P106 HydrophobicContact CD1-CB 3.54Å; L71-P106 WeakPolarHBondContact CD2-O 3.19Å; I97-P106 HydrophobicContact CG2-CG 3.58Å; Y101-P106 HydrophobicContact CD1-CB 4.09Å; Y101-P106 HydrophobicContact CD1-CG 4.17Å; Y101-P106 HydrophobicContact CD2-CG 4.36Å; Y101-P106 HydrophobicContact CE1-CB 4.2Å; Y101-P106 HydrophobicContact CE1-CG 4.47Å; Y101-P106 HydrophobicContact CG-CG 4.1Å
107	Y	90.7	Very high	90.3	Very high	9 Å²	9	47.6 Å²	47.6	4%	0.035	26%	0.263	C	S	.	.			trans	-109	94.3	-176	-51.3	-63.3	0	0	0	110.2	A70 L71 A74 L94 I97 F98 A105 S109 L113 I116	A70-Y107 WeakPolarHBondContact O-CE1 3.27Å; A70-Y107 PolarHBondContact O-OH 3.09Å; L71-Y107 HydrophobicContact CD2-CD1 4Å; L71-Y107 HydrophobicContact CD2-CE1 4.13Å; A74-Y107 HydrophobicContact CB-CD1 4.11Å; A74-Y107 HydrophobicContact CB-CE1 3.49Å; A74-Y107 VanDerWaalsContact CB-CE1 3.49Å; L94-Y107 HydrophobicContact CD2-CE2 4.34Å; L94-Y107 WeakPolarHBondContact CD2-OH 3.3Å; I97-Y107 HydrophobicContact CG2-CE2 3.94Å; F98-Y107 AromaticContact CE1-CD2 3.9Å; F98-Y107 HydrophobicContact CE1-CD2 3.9Å; F98-Y107 HydrophobicContact CE1-CE2 4.26Å; F98-Y107 HydrophobicContact CZ-CD2 4.1Å; F98-Y107 HydrophobicContact CZ-CE2 4.29Å; A105-Y107 PolarHBondContact O-N 3.1Å; Y107-S109 VanDerWaalsContact C-N 3.35Å; Y107-S109 PolarHBondContact O-N 3.37Å; Y107-L113 HydrophobicContact CD2-CD2 4.4Å; Y107-L113 WeakPolarHBondContact O-CD1 3.47Å; Y107-L113 WeakPolarHBondContact O-CG 3.33Å; Y107-I116 HydrophobicContact CD1-CD1 4.13Å; Y107-I116 HydrophobicContact CD2-CD1 3.67Å; Y107-I116 HydrophobicContact CE1-CD1 4.29Å; Y107-I116 HydrophobicContact CE2-CD1 3.86Å; Y107-I116 HydrophobicContact CG-CD1 3.82Å
108	T	82.5	Confident	90.2	Very high	138 Å²	138	49 Å²	49	85%	0.847	27%	0.271	S	S	*	.			trans	-82.8	-3.7	-175.1	53.5	0	0	0	0	115.1
109	S	88.9	Confident	90.3	Very high	52 Å²	52	49 Å²	49	36%	0.364	27%	0.271	S	S	.	.			trans	-94.9	123.6	178.4	164.2	0	0	0	0	110.8	Y107 D111 K112 L113	Y107-S109 VanDerWaalsContact C-N 3.35Å; Y107-S109 PolarHBondContact O-N 3.37Å; S109-D111 PolarHBondContact O-N 3Å; S109-K112 WeakPolarHBondContact O-CB 3.35Å; S109-K112 PolarHBondContact O-N 2.89Å; S109-K112 PolarHBondContact OG-N 3.45Å; S109-L113 PolarHBondContact O-N 2.91Å
110	H	89.5	Confident	90.5	Very high	96 Å²	96	47.8 Å²	47.8	44%	0.444	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-45.6	179.2	-73.9	-147.6	0	0	0	111.6	K112 L113 K114 E156 L157	H110-K112 PolarHBondContact O-N 3.38Å; H110-L113 PolarHBondContact O-N 2.87Å; H110-K114 PolarHBondContact O-N 3.33Å; H110-E156 PolarHBondContact CE1-O 3.4Å; H110-L157 HydrophobicContact CB-CD2 3.67Å
111	D	89	Confident	90.6	Very high	127 Å²	127	47.8 Å²	47.8	68%	0.679	27%	0.266	S	S	*	.	H	α-helix	trans	-55.3	-42.1	173	-60.3	-39.4	0	0	0	111.7	S109 K114 D115	S109-D111 PolarHBondContact O-N 3Å; D111-K114 PolarHBondContact O-N 3.47Å; D111-D115 WeakPolarHBondContact O-CB 3.5Å; D111-D115 PolarHBondContact O-N 3.2Å
112	K	90.4	Very high	90.9	Very high	47 Å²	47	52.7 Å²	52.7	20%	0.204	28%	0.284	C	S	.	.	H	α-helix	trans	-69.9	-39.4	-177.7	-155.5	65	-113.9	164.7	0	111.9	A74 S109 H110 D115 I116	A74-K112 WeakPolarHBondContact O-CE 3.48Å; A74-K112 PolarHBondContact O-NZ 3.21Å; S109-K112 WeakPolarHBondContact O-CB 3.35Å; S109-K112 PolarHBondContact O-N 2.89Å; S109-K112 PolarHBondContact OG-N 3.45Å; H110-K112 PolarHBondContact O-N 3.38Å; K112-D115 IonicContact NZ-OD2 3.64Å; K112-D115 PolarHBondContact NZ-OD2 2.69Å; K112-D115 WeakPolarHBondContact O-CB 3.47Å; K112-D115 PolarHBondContact O-N 2.91Å; K112-I116 HydrophobicContact CG-CD1 4.46Å; K112-I116 WeakPolarHBondContact O-CB 3.44Å; K112-I116 WeakPolarHBondContact O-CD1 3.16Å; K112-I116 VanDerWaalsContact O-CG1 3.24Å; K112-I116 WeakPolarHBondContact O-CG1 3.32Å; K112-I116 PolarHBondContact O-N 3.25Å
113	L	92.7	Very high	91.3	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-46.8	171.4	-72.8	169.4	0	0	0	111.1	F98 Y107 S109 H110 D115 I116 F117 I153 L157	F98-L113 HydrophobicContact CE1-CD2 3.92Å; F98-L113 HydrophobicContact CZ-CD2 4.09Å; Y107-L113 HydrophobicContact CD2-CD2 4.4Å; Y107-L113 WeakPolarHBondContact O-CD1 3.47Å; Y107-L113 WeakPolarHBondContact O-CG 3.33Å; S109-L113 PolarHBondContact O-N 2.91Å; H110-L113 PolarHBondContact O-N 2.87Å; L113-D115 PolarHBondContact O-N 2.83Å; L113-I116 PolarHBondContact O-N 3.18Å; L113-I116 VanDerWaalsContact O-N 3.16Å; L113-F117 HydrophobicContact CD2-CE2 4.2Å; L113-F117 VanDerWaalsContact O-CD2 3.24Å; L113-F117 WeakPolarHBondContact O-CD2 3.33Å; L113-F117 PolarHBondContact O-N 3.26Å; L113-I153 HydrophobicContact CD1-CG2 4.19Å; L113-I153 HydrophobicContact CD2-CG2 4.11Å; L113-L157 HydrophobicContact CB-CD1 4.01Å; L113-L157 HydrophobicContact CB-CD2 4.12Å; L113-L157 HydrophobicContact CD1-CD2 4.11Å
114	K	92.2	Very high	92	Very high	41 Å²	41	45.4 Å²	45.4	18%	0.178	23%	0.233	C	C	.	.	H	α-helix	trans	-55.5	-49	174.8	-176	-179.5	-173.8	-176.9	0	111.4	H110 D111 I116 F117 L118 D159 E162 I163	H110-K114 PolarHBondContact O-N 3.33Å; D111-K114 PolarHBondContact O-N 3.47Å; K114-I116 VanDerWaalsContact C-N 3.34Å; K114-I116 PolarHBondContact O-N 2.9Å; K114-F117 PolarHBondContact O-N 2.87Å; K114-L118 HydrophobicContact CD-CD1 4.49Å; K114-L118 HydrophobicContact CG-CD1 3.88Å; K114-L118 HydrophobicContact CG-CG 4.4Å; K114-L118 WeakPolarHBondContact O-CB 3.47Å; K114-L118 WeakPolarHBondContact O-CG 3.38Å; K114-L118 PolarHBondContact O-N 3.45Å; K114-D159 HydrophobicContact CD-CB 3.9Å; K114-D159 WeakPolarHBondContact CE-OD2 3.37Å; K114-D159 IonicContact NZ-OD1 3.65Å; K114-D159 IonicContact NZ-OD2 2.87Å; K114-D159 PolarHBondContact NZ-OD2 3.16Å; K114-E162 WeakPolarHBondContact CE-OE2 3.23Å; K114-E162 IonicContact NZ-OE2 2.73Å; K114-E162 PolarHBondContact NZ-OE2 3.29Å; K114-I163 HydrophobicContact CB-CD1 4.36Å; K114-I163 HydrophobicContact CG-CD1 4.14Å; K114-I163 HydrophobicContact CG-CG1 4.36Å
115	D	92.2	Very high	92.5	Very high	48 Å²	48	42.4 Å²	42.4	26%	0.257	22%	0.217	S	C	.	.	H	α-helix	trans	-53	-48.6	174.9	-116.1	-5.9	0	0	0	112.2	L79 D111 K112 L113 F119	L79-D115 HydrophobicContact CD1-CB 4.19Å; D111-D115 WeakPolarHBondContact O-CB 3.5Å; D111-D115 PolarHBondContact O-N 3.2Å; K112-D115 IonicContact NZ-OD2 3.64Å; K112-D115 PolarHBondContact NZ-OD2 2.69Å; K112-D115 WeakPolarHBondContact O-CB 3.47Å; K112-D115 PolarHBondContact O-N 2.91Å; L113-D115 PolarHBondContact O-N 2.83Å; D115-F119 WeakPolarHBondContact O-CB 3.46Å; D115-F119 PolarHBondContact O-N 3.36Å
116	I	95.1	Very high	92.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-48.8	-178.9	-73.4	160.7	0	0	0	110.9	A74 L79 L94 F98 Y107 K112 L113 K114 F119 I120	A74-I116 HydrophobicContact CB-CD1 3.91Å; A74-I116 HydrophobicContact CB-CG1 4.37Å; L79-I116 HydrophobicContact CD1-CG1 4.42Å; L94-I116 HydrophobicContact CD1-CG1 4.46Å; L94-I116 HydrophobicContact CD1-CG2 4.18Å; F98-I116 HydrophobicContact CE2-CG2 3.58Å; F98-I116 HydrophobicContact CZ-CG2 3.75Å; Y107-I116 HydrophobicContact CD1-CD1 4.13Å; Y107-I116 HydrophobicContact CD2-CD1 3.67Å; Y107-I116 HydrophobicContact CE1-CD1 4.29Å; Y107-I116 HydrophobicContact CE2-CD1 3.86Å; Y107-I116 HydrophobicContact CG-CD1 3.82Å; K112-I116 HydrophobicContact CG-CD1 4.46Å; K112-I116 WeakPolarHBondContact O-CB 3.44Å; K112-I116 WeakPolarHBondContact O-CD1 3.16Å; K112-I116 VanDerWaalsContact O-CG1 3.24Å; K112-I116 WeakPolarHBondContact O-CG1 3.32Å; K112-I116 PolarHBondContact O-N 3.25Å; L113-I116 PolarHBondContact O-N 3.18Å; L113-I116 VanDerWaalsContact O-N 3.16Å; K114-I116 VanDerWaalsContact C-N 3.34Å; K114-I116 PolarHBondContact O-N 2.9Å; I116-F119 WeakPolarHBondContact O-CB 3.32Å; I116-F119 PolarHBondContact O-N 2.84Å; I116-I120 HydrophobicContact CG2-CD1 3.68Å; I116-I120 HydrophobicContact CG2-CG1 4.38Å; I116-I120 VanDerWaalsContact O-CG1 3.3Å; I116-I120 WeakPolarHBondContact O-CG1 3.21Å; I116-I120 PolarHBondContact O-N 2.89Å
117	F	95.4	Very high	93.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-72.3	-34	-177.9	-73.2	-68.6	0	0	0	113.1	F98 L113 K114 F119 I120 T121 S150 Y151 I153 C154 I163	F98-F117 HydrophobicContact CD2-CE1 4.33Å; F98-F117 HydrophobicContact CD2-CZ 4.19Å; F98-F117 HydrophobicContact CE1-CE2 4.23Å; F98-F117 AromaticContact CE1-CZ 3.94Å; F98-F117 HydrophobicContact CE1-CZ 3.94Å; F98-F117 AromaticContact CE2-CE1 3.83Å; F98-F117 HydrophobicContact CE2-CE1 3.83Å; F98-F117 HydrophobicContact CE2-CE2 4.21Å; F98-F117 AromaticContact CE2-CZ 3.58Å; F98-F117 HydrophobicContact CE2-CZ 3.58Å; F98-F117 HydrophobicContact CZ-CE1 4.15Å; F98-F117 AromaticContact CZ-CE2 3.69Å; F98-F117 HydrophobicContact CZ-CE2 3.69Å; F98-F117 AromaticContact CZ-CZ 3.43Å; F98-F117 HydrophobicContact CZ-CZ 3.43Å; F98-F117 VanDerWaalsContact CZ-CZ 3.43Å; L113-F117 HydrophobicContact CD2-CE2 4.2Å; L113-F117 VanDerWaalsContact O-CD2 3.24Å; L113-F117 WeakPolarHBondContact O-CD2 3.33Å; L113-F117 PolarHBondContact O-N 3.26Å; K114-F117 PolarHBondContact O-N 2.87Å; F117-F119 VanDerWaalsContact C-N 3.32Å; F117-I120 HydrophobicContact CD1-CD1 4.34Å; F117-I120 PolarHBondContact O-N 2.7Å; F117-T121 WeakPolarHBondContact O-CB 3.3Å; F117-T121 PolarHBondContact O-N 3.42Å; F117-T121 PolarHBondContact O-OG1 2.99Å; F117-S150 WeakPolarHBondContact CZ-O 3.25Å; F117-Y151 HydrophobicContact CB-CD1 4.49Å; F117-Y151 HydrophobicContact CB-CE1 4Å; F117-Y151 AromaticContact CD1-CD1 3.88Å; F117-Y151 HydrophobicContact CD1-CD1 3.88Å; F117-Y151 HydrophobicContact CD1-CD2 4.04Å; F117-Y151 AromaticContact CD1-CE1 3.77Å; F117-Y151 HydrophobicContact CD1-CE1 3.77Å; F117-Y151 AromaticContact CD1-CE2 3.92Å; F117-Y151 HydrophobicContact CD1-CE2 3.92Å; F117-Y151 HydrophobicContact CD1-CG 4.03Å; F117-Y151 AromaticContact CD1-CZ 3.79Å; F117-Y151 HydrophobicContact CE1-CD2 4.14Å; F117-Y151 HydrophobicContact CE1-CE2 4.34Å; F117-Y151 HydrophobicContact CE1-CG 4.25Å; F117-Y151 HydrophobicContact CG-CD1 4.41Å; F117-Y151 HydrophobicContact CG-CE1 4.26Å; F117-Y151 PolarHBondContact O-OH 3.01Å; F117-I153 HydrophobicContact CE2-CB 4.2Å; F117-I153 HydrophobicContact CE2-CG2 4.26Å; F117-I153 HydrophobicContact CZ-CB 4.16Å; F117-I153 HydrophobicContact CZ-CD1 4.39Å; F117-C154 WeakPolarHBondContact CD2-SG 3.3Å; F117-C154 VanDerWaalsContact CG-SG 3.52Å; F117-I163 HydrophobicContact CB-CD1 4.44Å; F117-I163 HydrophobicContact CB-CG2 3.71Å
118	L	94.9	Very high	93.5	Very high	31 Å²	31	45.9 Å²	45.9	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-68.8	-30	169.7	-68.7	178.3	0	0	0	112.1	K114 R122 I163	K114-L118 HydrophobicContact CD-CD1 4.49Å; K114-L118 HydrophobicContact CG-CD1 3.88Å; K114-L118 HydrophobicContact CG-CG 4.4Å; K114-L118 WeakPolarHBondContact O-CB 3.47Å; K114-L118 WeakPolarHBondContact O-CG 3.38Å; K114-L118 PolarHBondContact O-N 3.45Å; L118-R122 WeakPolarHBondContact O-CG 3.32Å; L118-R122 PolarHBondContact O-N 3.19Å; L118-R122 PolarHBondContact O-NE 3.42Å; L118-I163 HydrophobicContact CD2-CB 4.44Å; L118-I163 HydrophobicContact CD2-CG1 4.17Å; L118-I163 HydrophobicContact CG-CG1 4.28Å
119	F	96.4	Very high	94	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-67.7	-50.7	169.7	166.4	-98.5	0	0	0	112	L79 R87 V90 A91 L94 D115 I116 F117 T121 R122 Q123	L79-F119 HydrophobicContact CB-CD2 4.11Å; L79-F119 HydrophobicContact CB-CE2 4.44Å; L79-F119 HydrophobicContact CB-CG 4.45Å; L79-F119 HydrophobicContact CD2-CB 4.22Å; L79-F119 HydrophobicContact CD2-CD1 3.63Å; L79-F119 HydrophobicContact CD2-CD2 4.04Å; L79-F119 HydrophobicContact CD2-CE1 3.87Å; L79-F119 HydrophobicContact CD2-CE2 4.23Å; L79-F119 HydrophobicContact CD2-CG 3.72Å; L79-F119 HydrophobicContact CD2-CZ 4.15Å; L79-F119 WeakPolarHBondContact O-CD2 3.44Å; L79-F119 WeakPolarHBondContact O-CE2 3.47Å; R87-F119 HydrophobicContact CB-CE2 3.81Å; R87-F119 HydrophobicContact CB-CZ 3.95Å; R87-F119 HydrophobicContact CG-CE2 3.86Å; R87-F119 HydrophobicContact CG-CZ 4.38Å; R87-F119 VanDerWaalsContact O-CZ 3.27Å; R87-F119 WeakPolarHBondContact O-CZ 3.49Å; V90-F119 HydrophobicContact CB-CE1 4.46Å; V90-F119 HydrophobicContact CB-CZ 4.12Å; V90-F119 HydrophobicContact CG1-CE1 3.89Å; V90-F119 HydrophobicContact CG1-CZ 3.82Å; A91-F119 HydrophobicContact CB-CE1 3.78Å; A91-F119 HydrophobicContact CB-CZ 4.37Å; L94-F119 HydrophobicContact CD1-CD1 4Å; L94-F119 HydrophobicContact CD1-CE1 3.85Å; D115-F119 WeakPolarHBondContact O-CB 3.46Å; D115-F119 PolarHBondContact O-N 3.36Å; I116-F119 WeakPolarHBondContact O-CB 3.32Å; I116-F119 PolarHBondContact O-N 2.84Å; F117-F119 VanDerWaalsContact C-N 3.32Å; F119-T121 VanDerWaalsContact C-N 3.31Å; F119-T121 PolarHBondContact O-N 3.39Å; F119-R122 VanDerWaalsContact CA-NH2 3.31Å; F119-R122 WeakPolarHBondContact O-CB 3.36Å; F119-R122 PolarHBondContact O-N 3.31Å; F119-R122 VanDerWaalsContact O-N 3.12Å; F119-Q123 HydrophobicContact CE1-CG 4.42Å; F119-Q123 HydrophobicContact CE2-CG 4.25Å; F119-Q123 HydrophobicContact CZ-CG 4.2Å; F119-Q123 WeakPolarHBondContact O-CG 3.18Å; F119-Q123 PolarHBondContact O-N 2.85Å
120	I	97	Very high	94.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.8	-44.3	177.4	-68	167.9	0	0	0	110.3	L94 F98 I116 F117 R122 Q123 L124 L141 L145 Y151	L94-I120 HydrophobicContact CB-CD1 4.4Å; F98-I120 HydrophobicContact CE2-CD1 4.06Å; I116-I120 HydrophobicContact CG2-CD1 3.68Å; I116-I120 HydrophobicContact CG2-CG1 4.38Å; I116-I120 VanDerWaalsContact O-CG1 3.3Å; I116-I120 WeakPolarHBondContact O-CG1 3.21Å; I116-I120 PolarHBondContact O-N 2.89Å; F117-I120 HydrophobicContact CD1-CD1 4.34Å; F117-I120 PolarHBondContact O-N 2.7Å; I120-R122 PolarHBondContact O-N 3.22Å; I120-Q123 CarbonylContact O-C 3.28Å; I120-Q123 WeakPolarHBondContact O-CA 3.22Å; I120-Q123 PolarHBondContact O-N 3.37Å; I120-L124 PolarHBondContact O-N 3.22Å; I120-L141 HydrophobicContact CG2-CD1 4.44Å; I120-L145 HydrophobicContact CD1-CD2 4.38Å; I120-L145 HydrophobicContact CG2-CD1 3.36Å; I120-L145 HydrophobicContact CG2-CD2 4.12Å; I120-L145 HydrophobicContact CG2-CG 4.38Å; I120-Y151 HydrophobicContact CG2-CE2 4.18Å; I120-Y151 WeakPolarHBondContact CG2-OH 3.27Å
121	T	96.5	Very high	94.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.3	-46.1	174.2	-65.3	0	0	0	0	112	F117 F119 Q123 L124 Y151 Q166 L167	F117-T121 WeakPolarHBondContact O-CB 3.3Å; F117-T121 PolarHBondContact O-N 3.42Å; F117-T121 PolarHBondContact O-OG1 2.99Å; F119-T121 VanDerWaalsContact C-N 3.31Å; F119-T121 PolarHBondContact O-N 3.39Å; T121-Q123 PolarHBondContact O-N 3.34Å; T121-L124 PolarHBondContact O-N 3.31Å; T121-Y151 PolarHBondContact N-OH 3.38Å; T121-Y151 PolarHBondContact OG1-OH 3.03Å; T121-Q166 HydrophobicContact CG2-CB 4.5Å; T121-Q166 HydrophobicContact CG2-CG 3.98Å; T121-L167 HydrophobicContact CG2-CB 4.43Å
122	R	96.4	Very high	94.5	Very high	129 Å²	129	41.7 Å²	41.7	49%	0.487	20%	0.199	S	C	.	.	H	α-helix	trans	-62	-32.1	175.1	-76.7	172.9	-73	158.4	-7.6	112.6	L118 F119 I120	L118-R122 WeakPolarHBondContact O-CG 3.32Å; L118-R122 PolarHBondContact O-N 3.19Å; L118-R122 PolarHBondContact O-NE 3.42Å; F119-R122 VanDerWaalsContact CA-NH2 3.31Å; F119-R122 WeakPolarHBondContact O-CB 3.36Å; F119-R122 PolarHBondContact O-N 3.31Å; F119-R122 VanDerWaalsContact O-N 3.12Å; I120-R122 PolarHBondContact O-N 3.22Å
123	Q	96.4	Very high	94.6	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-78.1	-29.2	177.5	-66.5	-64.6	116.7	0	0	112.7	R87 A91 F119 I120 T121 K125 G126 Y138 L141	R87-Q123 VanDerWaalsContact C-NE2 3.32Å; R87-Q123 HydrophobicContact CB-CG 4.42Å; A91-Q123 HydrophobicContact CB-CB 4.16Å; A91-Q123 HydrophobicContact CB-CG 4.14Å; F119-Q123 HydrophobicContact CE1-CG 4.42Å; F119-Q123 HydrophobicContact CE2-CG 4.25Å; F119-Q123 HydrophobicContact CZ-CG 4.2Å; F119-Q123 WeakPolarHBondContact O-CG 3.18Å; F119-Q123 PolarHBondContact O-N 2.85Å; I120-Q123 CarbonylContact O-C 3.28Å; I120-Q123 WeakPolarHBondContact O-CA 3.22Å; I120-Q123 PolarHBondContact O-N 3.37Å; T121-Q123 PolarHBondContact O-N 3.34Å; Q123-K125 PolarHBondContact O-N 3.11Å; Q123-K125 VanDerWaalsContact O-N 3.13Å; Q123-G126 PolarHBondContact O-N 3.05Å; Q123-Y138 WeakPolarHBondContact O-CD1 3.34Å; Q123-Y138 WeakPolarHBondContact O-CE1 3.38Å; Q123-L141 HydrophobicContact CB-CD2 4.23Å
124	L	97.2	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-18.5	172.5	-71.1	171.7	0	0	0	113.4	I120 T121 G126 L127 L141 L142 L145 L167 T170 L171	I120-L124 PolarHBondContact O-N 3.22Å; T121-L124 PolarHBondContact O-N 3.31Å; L124-G126 PolarHBondContact O-N 2.92Å; L124-G126 VanDerWaalsContact O-N 3.15Å; L124-L127 HydrophobicContact CB-CD1 4.49Å; L124-L127 HydrophobicContact CD2-CD1 4.04Å; L124-L127 WeakPolarHBondContact O-CB 3.37Å; L124-L127 WeakPolarHBondContact O-CG 3.46Å; L124-L127 PolarHBondContact O-N 3.09Å; L124-L127 VanDerWaalsContact O-N 3.15Å; L124-L141 HydrophobicContact CD2-CD2 4.33Å; L124-L141 HydrophobicContact CD2-CG 4.29Å; L124-L142 HydrophobicContact CD2-CB 4.13Å; L124-L142 HydrophobicContact CD2-CD1 4.32Å; L124-L145 HydrophobicContact CD1-CD1 4.41Å; L124-L145 HydrophobicContact CD2-CD1 4.3Å; L124-L167 HydrophobicContact CD1-CD1 3.58Å; L124-T170 HydrophobicContact CB-CG2 4.44Å; L124-L171 HydrophobicContact CD1-CD2 4.46Å
125	K	96	Very high	94.7	Very high	103 Å²	103	46.2 Å²	46.2	45%	0.448	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-57.6	-22.8	168	-77.8	-154.3	170	-151	0	114.3	Q123 L127 E128 T170 V174	Q123-K125 PolarHBondContact O-N 3.11Å; Q123-K125 VanDerWaalsContact O-N 3.13Å; K125-L127 PolarHBondContact O-N 2.99Å; K125-E128 PolarHBondContact O-N 3.05Å; K125-T170 HydrophobicContact CG-CG2 3.66Å; K125-V174 HydrophobicContact CG-CG1 4.42Å
126	G	94.7	Very high	94.8	Very high	18 Å²	18	49.6 Å²	49.6	19%	0.186	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-68	-8.2	176.3	0	0	0	0	0	115.4	Q123 L124 E128 Y138	Q123-G126 PolarHBondContact O-N 3.05Å; L124-G126 PolarHBondContact O-N 2.92Å; L124-G126 VanDerWaalsContact O-N 3.15Å; G126-E128 VanDerWaalsContact C-N 3.3Å; G126-Y138 VanDerWaalsContact O-CD2 3.32Å; G126-Y138 WeakPolarHBondContact O-CD2 3.36Å
127	L	95.7	Very high	94.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-67	-29.3	172.2	-70.1	166.2	0	0	0	112.8	L124 K125 D129 F135 L142 V174 H179 V183 M187	L124-L127 HydrophobicContact CB-CD1 4.49Å; L124-L127 HydrophobicContact CD2-CD1 4.04Å; L124-L127 WeakPolarHBondContact O-CB 3.37Å; L124-L127 WeakPolarHBondContact O-CG 3.46Å; L124-L127 PolarHBondContact O-N 3.09Å; L124-L127 VanDerWaalsContact O-N 3.15Å; K125-L127 PolarHBondContact O-N 2.99Å; L127-D129 VanDerWaalsContact C-N 3.3Å; L127-D129 PolarHBondContact O-N 3.18Å; L127-F135 HydrophobicContact CD2-CE2 4.1Å; L127-F135 WeakPolarHBondContact O-CE2 3.09Å; L127-L142 HydrophobicContact CD1-CB 4.32Å; L127-L142 HydrophobicContact CD1-CD2 3.97Å; L127-L142 HydrophobicContact CD2-CD2 4.48Å; L127-V174 HydrophobicContact CB-CB 4.45Å; L127-V174 HydrophobicContact CB-CG2 4.27Å; L127-H179 PolarHBondContact O-NE2 3.41Å; L127-V183 HydrophobicContact CD2-CG1 4.43Å; L127-M187 HydrophobicContact CD1-CE 3.8Å
128	E	94.8	Very high	94.9	Very high	110 Å²	110	54.7 Å²	54.7	51%	0.514	27%	0.268	S	S	.	.	S	Bend	trans	-55.1	-41.9	-172.9	-167.7	-178.6	168.5	0	0	113.2	K125 G126 T130 V174 N176	K125-E128 PolarHBondContact O-N 3.05Å; G126-E128 VanDerWaalsContact C-N 3.3Å; E128-T130 PolarHBondContact O-N 2.9Å; E128-V174 HydrophobicContact CB-CB 4.13Å; E128-V174 HydrophobicContact CB-CG1 4.11Å; E128-N176 PolarHBondContact O-ND2 3.46Å
129	D	93.5	Very high	95	Very high	87 Å²	87	54.4 Å²	54.4	47%	0.465	27%	0.266	S	S	.	.			trans	-89.6	86.1	176.1	-179	14.1	0	0	0	111.8	L127 K131 S132	L127-D129 VanDerWaalsContact C-N 3.3Å; L127-D129 PolarHBondContact O-N 3.18Å; D129-K131 PolarHBondContact O-N 2.83Å; D129-K131 WeakPolarHBondContact OD1-CA 3.27Å; D129-K131 WeakPolarHBondContact OD1-CB 3.38Å; D129-K131 PolarHBondContact OD1-N 2.92Å; D129-S132 VanDerWaalsContact O-CB 3.25Å; D129-S132 WeakPolarHBondContact O-CB 3.27Å; D129-S132 PolarHBondContact O-N 3.29Å; D129-S132 VanDerWaalsContact O-N 3.09Å; D129-S132 PolarHBondContact OD1-N 2.77Å; D129-S132 WeakPolarHBondContact OD2-CB 3.14Å; D129-S132 PolarHBondContact OD2-N 3.07Å
130	T	92.8	Very high	95	Very high	34 Å²	34	56.9 Å²	56.9	21%	0.209	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	0.8	175.4	80.7	0	0	0	0	114.4	E128 F135 S178	E128-T130 PolarHBondContact O-N 2.9Å; T130-F135 HydrophobicContact CG2-CD2 4.39Å; T130-F135 HydrophobicContact CG2-CE2 3.87Å; T130-F135 HydrophobicContact CG2-CZ 4.21Å; T130-S178 WeakPolarHBondContact OG1-CB 2.79Å
131	K	92.5	Very high	95	Very high	180 Å²	180	56.9 Å²	56.9	78%	0.783	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-8.9	175	-57.2	171.2	-172.7	166	0	112	D129	D129-K131 PolarHBondContact O-N 2.83Å; D129-K131 WeakPolarHBondContact OD1-CA 3.27Å; D129-K131 WeakPolarHBondContact OD1-CB 3.38Å; D129-K131 PolarHBondContact OD1-N 2.92Å
132	S	92.5	Very high	95	Very high	24 Å²	24	56.9 Å²	56.9	17%	0.168	28%	0.276	C	S	.	.	S	Bend	trans	-58.8	134	175.5	-179.1	0	0	0	0	111	D129 Q134 F135	D129-S132 VanDerWaalsContact O-CB 3.25Å; D129-S132 WeakPolarHBondContact O-CB 3.27Å; D129-S132 PolarHBondContact O-N 3.29Å; D129-S132 VanDerWaalsContact O-N 3.09Å; D129-S132 PolarHBondContact OD1-N 2.77Å; D129-S132 WeakPolarHBondContact OD2-CB 3.14Å; D129-S132 PolarHBondContact OD2-N 3.07Å; S132-Q134 PolarHBondContact O-N 3.25Å; S132-Q134 VanDerWaalsContact O-N 3.1Å; S132-Q134 PolarHBondContact OG-N 2.93Å; S132-Q134 PolarHBondContact OG-OE1 2.9Å; S132-Q134 VanDerWaalsContact OG-OE1 3.12Å; S132-F135 VanDerWaalsContact O-CB 3.23Å; S132-F135 WeakPolarHBondContact O-CB 3.46Å; S132-F135 PolarHBondContact O-N 3.28Å
133	P	92.1	Very high	95.1	Very high	119 Å²	119	53.3 Å²	53.3	77%	0.773	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.3	169.6	-25.4	34.8	0	0	0	113.2
134	Q	92.7	Very high	95	Very high	55 Å²	55	53.2 Å²	53.2	26%	0.257	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-10.3	177.4	-70.1	81.1	-5.8	0	0	113.8	D85 L88 S132 N136 R137 Y138	D85-Q134 VanDerWaalsContact OD1-CG 3.32Å; D85-Q134 WeakPolarHBondContact OD1-CG 3.47Å; D85-Q134 PolarHBondContact OD1-NE2 3.4Å; L88-Q134 HydrophobicContact CD2-CB 3.75Å; L88-Q134 HydrophobicContact CD2-CG 4.01Å; S132-Q134 PolarHBondContact O-N 3.25Å; S132-Q134 VanDerWaalsContact O-N 3.1Å; S132-Q134 PolarHBondContact OG-N 2.93Å; S132-Q134 PolarHBondContact OG-OE1 2.9Å; S132-Q134 VanDerWaalsContact OG-OE1 3.12Å; Q134-N136 VanDerWaalsContact C-N 3.28Å; Q134-N136 PolarHBondContact O-N 3.31Å; Q134-N136 VanDerWaalsContact O-N 3.15Å; Q134-R137 WeakPolarHBondContact O-CB 3.16Å; Q134-R137 PolarHBondContact O-N 2.82Å; Q134-Y138 HydrophobicContact CB-CD2 4.17Å; Q134-Y138 HydrophobicContact CB-CE2 3.74Å; Q134-Y138 WeakPolarHBondContact O-CD2 2.74Å; Q134-Y138 PolarHBondContact O-N 3.28Å
135	F	94.6	Very high	95	Very high	21 Å²	21	53.2 Å²	53.2	9%	0.092	26%	0.264	C	S	.	.	H	α-helix	trans	-52	-42.8	-173.7	176.7	-101.9	0	0	0	113.2	L127 T130 S132 R137 Y138 F139 V183	L127-F135 HydrophobicContact CD2-CE2 4.1Å; L127-F135 WeakPolarHBondContact O-CE2 3.09Å; T130-F135 HydrophobicContact CG2-CD2 4.39Å; T130-F135 HydrophobicContact CG2-CE2 3.87Å; T130-F135 HydrophobicContact CG2-CZ 4.21Å; S132-F135 VanDerWaalsContact O-CB 3.23Å; S132-F135 WeakPolarHBondContact O-CB 3.46Å; S132-F135 PolarHBondContact O-N 3.28Å; F135-R137 PolarHBondContact O-N 3.47Å; F135-R137 VanDerWaalsContact O-N 3.15Å; F135-Y138 PolarHBondContact O-N 3.03Å; F135-Y138 VanDerWaalsContact O-N 3.09Å; F135-F139 HydrophobicContact CE1-CB 4.37Å; F135-F139 PolarHBondContact O-N 3.39Å; F135-V183 HydrophobicContact CZ-CG2 4.1Å
136	N	94.1	Very high	95	Very high	119 Å²	119	48.7 Å²	48.7	64%	0.636	25%	0.246	S	C	*	.	H	α-helix	trans	-61.2	-25.5	179.3	-65.7	-46.1	0	0	0	113.6	Q134 Y140	Q134-N136 VanDerWaalsContact C-N 3.28Å; Q134-N136 PolarHBondContact O-N 3.31Å; Q134-N136 VanDerWaalsContact O-N 3.15Å; N136-Y140 WeakPolarHBondContact O-CB 3.47Å; N136-Y140 PolarHBondContact O-N 3.22Å
137	R	95.1	Very high	94.9	Very high	86 Å²	86	56.7 Å²	56.7	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-81.6	-35.6	174.2	-73.9	-176.9	175.6	-80.7	-3.9	112.6	L88 Q134 F135 F139 Y140 L141	L88-R137 HydrophobicContact CD1-CB 4.1Å; L88-R137 HydrophobicContact CD2-CB 3.79Å; L88-R137 HydrophobicContact CG-CB 4.04Å; Q134-R137 WeakPolarHBondContact O-CB 3.16Å; Q134-R137 PolarHBondContact O-N 2.82Å; F135-R137 PolarHBondContact O-N 3.47Å; F135-R137 VanDerWaalsContact O-N 3.15Å; R137-F139 VanDerWaalsContact C-N 3.31Å; R137-Y140 PolarHBondContact O-N 3.1Å; R137-L141 WeakPolarHBondContact O-CB 3.14Å; R137-L141 PolarHBondContact O-N 2.99Å
138	Y	97	Very high	94.8	Very high	21 Å²	21	58.1 Å²	58.1	8%	0.082	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-36.1	169.4	-65.9	-70.7	0	0	0	111.4	L88 Q123 G126 Q134 F135 L142	L88-Y138 HydrophobicContact CB-CE1 4.43Å; L88-Y138 HydrophobicContact CD1-CD1 3.54Å; L88-Y138 HydrophobicContact CD1-CE1 3.56Å; L88-Y138 HydrophobicContact CD1-CG 4.06Å; L88-Y138 HydrophobicContact CD2-CD1 4.41Å; L88-Y138 HydrophobicContact CD2-CD2 4.09Å; L88-Y138 HydrophobicContact CD2-CE1 4.04Å; L88-Y138 HydrophobicContact CD2-CE2 3.69Å; L88-Y138 HydrophobicContact CD2-CG 4.43Å; L88-Y138 HydrophobicContact CG-CE1 4.21Å; Q123-Y138 WeakPolarHBondContact O-CD1 3.34Å; Q123-Y138 WeakPolarHBondContact O-CE1 3.38Å; G126-Y138 VanDerWaalsContact O-CD2 3.32Å; G126-Y138 WeakPolarHBondContact O-CD2 3.36Å; Q134-Y138 HydrophobicContact CB-CD2 4.17Å; Q134-Y138 HydrophobicContact CB-CE2 3.74Å; Q134-Y138 WeakPolarHBondContact O-CD2 2.74Å; Q134-Y138 PolarHBondContact O-N 3.28Å; F135-Y138 PolarHBondContact O-N 3.03Å; F135-Y138 VanDerWaalsContact O-N 3.09Å; Y138-L142 PolarHBondContact O-N 2.98Å; Y138-L142 VanDerWaalsContact O-N 3.1Å
139	F	96.6	Very high	94.8	Very high	25 Å²	25	56.5 Å²	56.5	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-47.7	172.2	178.4	-105.2	0	0	0	112	F135 R137 L141 L142 E143 K182 V183 H186	F135-F139 HydrophobicContact CE1-CB 4.37Å; F135-F139 PolarHBondContact O-N 3.39Å; R137-F139 VanDerWaalsContact C-N 3.31Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-L141 PolarHBondContact O-N 3.1Å; F139-L142 PolarHBondContact O-N 2.95Å; F139-L142 VanDerWaalsContact O-N 3.16Å; F139-E143 HydrophobicContact CE1-CB 4.34Å; F139-E143 WeakPolarHBondContact CE1-OE2 3.22Å; F139-E143 HydrophobicContact CZ-CB 4.28Å; F139-E143 HydrophobicContact CZ-CG 4.43Å; F139-E143 WeakPolarHBondContact O-CB 3.32Å; F139-E143 PolarHBondContact O-N 3.07Å; F139-K182 HydrophobicContact CE2-CB 4.06Å; F139-K182 HydrophobicContact CZ-CB 3.9Å; F139-K182 HydrophobicContact CZ-CD 3.95Å; F139-V183 HydrophobicContact CD2-CB 4.42Å; F139-V183 HydrophobicContact CD2-CG2 3.73Å; F139-V183 HydrophobicContact CE2-CB 4.4Å; F139-V183 HydrophobicContact CE2-CG2 3.89Å; F139-H186 AromaticContact CE2-CD2 3.78Å; F139-H186 AromaticContact CZ-CD2 3.78Å
140	Y	96.2	Very high	94.8	Very high	54 Å²	54	52.5 Å²	52.5	21%	0.212	25%	0.249	C	C	.	.	H	α-helix	trans	-56.4	-44.7	174.1	175.1	-98.8	0	0	0	112.3	M53 D96 N136 R137 L142 E143 N144	M53-Y140 HydrophobicContact CG-CE2 4.3Å; M53-Y140 HydrophobicContact SD-CE2 4.38Å; D96-Y140 VanDerWaalsContact CG-OH 3.28Å; D96-Y140 PolarHBondContact OD1-OH 2.97Å; D96-Y140 PolarHBondContact OD2-OH 2.82Å; N136-Y140 WeakPolarHBondContact O-CB 3.47Å; N136-Y140 PolarHBondContact O-N 3.22Å; R137-Y140 PolarHBondContact O-N 3.1Å; Y140-L142 VanDerWaalsContact C-N 3.34Å; Y140-L142 PolarHBondContact O-N 3.46Å; Y140-E143 PolarHBondContact O-N 3.49Å; Y140-N144 WeakPolarHBondContact O-CB 3.12Å; Y140-N144 PolarHBondContact O-N 3.27Å; Y140-N144 PolarHBondContact OH-ND2 3.36Å
141	L	97.1	Very high	94.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.9	-47.2	175.2	177.8	61.2	0	0	0	111.4	A91 A95 I120 Q123 L124 R137 F139 L145	A91-L141 HydrophobicContact CB-CD1 4.15Å; A91-L141 HydrophobicContact CB-CD2 3.8Å; A91-L141 VanDerWaalsContact O-CD1 3.3Å; A91-L141 WeakPolarHBondContact O-CD1 3.41Å; A95-L141 HydrophobicContact CB-CD1 3.78Å; I120-L141 HydrophobicContact CG2-CD1 4.44Å; Q123-L141 HydrophobicContact CB-CD2 4.23Å; L124-L141 HydrophobicContact CD2-CD2 4.33Å; L124-L141 HydrophobicContact CD2-CG 4.29Å; R137-L141 WeakPolarHBondContact O-CB 3.14Å; R137-L141 PolarHBondContact O-N 2.99Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-L141 PolarHBondContact O-N 3.1Å; L141-L145 HydrophobicContact CD1-CD1 3.72Å; L141-L145 HydrophobicContact CD1-CG 4.22Å; L141-L145 HydrophobicContact CG-CD1 3.81Å; L141-L145 WeakPolarHBondContact O-CB 3.48Å; L141-L145 VanDerWaalsContact O-CD1 3.22Å; L141-L145 WeakPolarHBondContact O-CD1 3.37Å; L141-L145 WeakPolarHBondContact O-CG 3.48Å; L141-L145 PolarHBondContact O-N 3.36Å; L141-L145 VanDerWaalsContact O-N 3.07Å
142	L	97.6	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-45	176.1	177.3	70.5	0	0	0	112.8	L124 L127 Y138 F139 Y140 N144 L145 A146 V183 H186 M187 L190	L124-L142 HydrophobicContact CD2-CB 4.13Å; L124-L142 HydrophobicContact CD2-CD1 4.32Å; L127-L142 HydrophobicContact CD1-CB 4.32Å; L127-L142 HydrophobicContact CD1-CD2 3.97Å; L127-L142 HydrophobicContact CD2-CD2 4.48Å; Y138-L142 PolarHBondContact O-N 2.98Å; Y138-L142 VanDerWaalsContact O-N 3.1Å; F139-L142 PolarHBondContact O-N 2.95Å; F139-L142 VanDerWaalsContact O-N 3.16Å; Y140-L142 VanDerWaalsContact C-N 3.34Å; Y140-L142 PolarHBondContact O-N 3.46Å; L142-N144 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.24Å; L142-L145 PolarHBondContact O-N 2.99Å; L142-A146 WeakPolarHBondContact O-CB 3.46Å; L142-A146 PolarHBondContact O-N 3.3Å; L142-V183 HydrophobicContact CD2-CG1 3.69Å; L142-H186 HydrophobicContact CD2-CB 4.01Å; L142-H186 HydrophobicContact CG-CB 3.83Å; L142-M187 HydrophobicContact CD1-CG 4.26Å; L142-M187 HydrophobicContact CD2-CE 4.45Å; L142-M187 HydrophobicContact CD2-CG 3.86Å; L142-L190 HydrophobicContact CD1-CD2 4.28Å
143	E	97.2	Very high	94.8	Very high	53 Å²	53	45 Å²	45	25%	0.248	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-43.4	-179.5	-171.8	166.8	-129.7	0	0	110.6	F139 Y140 W147 K182 H186	F139-E143 HydrophobicContact CE1-CB 4.34Å; F139-E143 WeakPolarHBondContact CE1-OE2 3.22Å; F139-E143 HydrophobicContact CZ-CB 4.28Å; F139-E143 HydrophobicContact CZ-CG 4.43Å; F139-E143 WeakPolarHBondContact O-CB 3.32Å; F139-E143 PolarHBondContact O-N 3.07Å; Y140-E143 PolarHBondContact O-N 3.49Å; E143-W147 VanDerWaalsContact O-CB 3.27Å; E143-W147 WeakPolarHBondContact O-CB 3.48Å; E143-W147 PolarHBondContact O-N 2.97Å; E143-W147 VanDerWaalsContact O-N 3.09Å; E143-K182 IonicContact OE1-NZ 2.78Å; E143-K182 PolarHBondContact OE1-NZ 3.48Å; E143-H186 IonicContact OE1-NE2 3.84Å; E143-H186 PolarHBondContact OE1-NE2 2.81Å
144	N	95.7	Very high	94.8	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.048	18%	0.178	C	C	.	.	H	α-helix	trans	-65	-55.2	175.9	-171.2	-46.1	0	0	0	111.7	A95 D96 Y140 L142 A146 W147 V148	A95-N144 HydrophobicContact CB-CB 4.39Å; A95-N144 PolarHBondContact O-OD1 3.28Å; D96-N144 PolarHBondContact OD1-ND2 2.85Å; Y140-N144 WeakPolarHBondContact O-CB 3.12Å; Y140-N144 PolarHBondContact O-N 3.27Å; Y140-N144 PolarHBondContact OH-ND2 3.36Å; L142-N144 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.24Å; N144-A146 VanDerWaalsContact C-N 3.27Å; N144-A146 PolarHBondContact O-N 3.22Å; N144-W147 PolarHBondContact O-N 3.41Å; N144-W147 VanDerWaalsContact O-N 3.11Å; N144-V148 WeakPolarHBondContact O-CG2 3.47Å; N144-V148 PolarHBondContact O-N 3.06Å
145	L	96.5	Very high	94.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.6	-36.4	-179.5	-68.4	162.8	0	0	0	113.4	A95 I120 L124 L141 L142 K149 S150 Y151	A95-L145 HydrophobicContact CB-CD2 4.01Å; A95-L145 HydrophobicContact CB-CG 4.16Å; I120-L145 HydrophobicContact CD1-CD2 4.38Å; I120-L145 HydrophobicContact CG2-CD1 3.36Å; I120-L145 HydrophobicContact CG2-CD2 4.12Å; I120-L145 HydrophobicContact CG2-CG 4.38Å; L124-L145 HydrophobicContact CD1-CD1 4.41Å; L124-L145 HydrophobicContact CD2-CD1 4.3Å; L141-L145 HydrophobicContact CD1-CD1 3.72Å; L141-L145 HydrophobicContact CD1-CG 4.22Å; L141-L145 HydrophobicContact CG-CD1 3.81Å; L141-L145 WeakPolarHBondContact O-CB 3.48Å; L141-L145 VanDerWaalsContact O-CD1 3.22Å; L141-L145 WeakPolarHBondContact O-CD1 3.37Å; L141-L145 WeakPolarHBondContact O-CG 3.48Å; L141-L145 PolarHBondContact O-N 3.36Å; L141-L145 VanDerWaalsContact O-N 3.07Å; L142-L145 PolarHBondContact O-N 2.99Å; L145-K149 VanDerWaalsContact O-CA 3.3Å; L145-K149 WeakPolarHBondContact O-CA 3.36Å; L145-K149 PolarHBondContact O-N 3.48Å; L145-S150 PolarHBondContact O-N 2.83Å; L145-Y151 HydrophobicContact CD1-CE2 4.26Å; L145-Y151 HydrophobicContact CD2-CD2 4.48Å; L145-Y151 HydrophobicContact CD2-CE2 4.15Å
146	A	95.5	Very high	94.2	Very high	7 Å²	7	46.3 Å²	46.3	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-74.3	-35.5	178	0	0	0	0	0	112.8	L142 N144 H186 D189 L190	L142-A146 WeakPolarHBondContact O-CB 3.46Å; L142-A146 PolarHBondContact O-N 3.3Å; N144-A146 VanDerWaalsContact C-N 3.27Å; N144-A146 PolarHBondContact O-N 3.22Å; A146-H186 HydrophobicContact CB-CB 3.82Å; A146-H186 VanDerWaalsContact CB-O 3.28Å; A146-H186 WeakPolarHBondContact CB-O 3.29Å; A146-D189 HydrophobicContact CB-CB 4.23Å; A146-L190 HydrophobicContact CB-CB 4.09Å
147	W	93.7	Very high	94	Very high	186 Å²	186	41 Å²	41	71%	0.705	18%	0.181	S	C	*	.	H	α-helix	trans	-74.9	-43.2	178.7	-176.3	75.8	0	0	0	112.4	R99 E143 N144 K149	R99-W147 HydrophobicContact CG-CZ3 4.12Å; E143-W147 VanDerWaalsContact O-CB 3.27Å; E143-W147 WeakPolarHBondContact O-CB 3.48Å; E143-W147 PolarHBondContact O-N 2.97Å; E143-W147 VanDerWaalsContact O-N 3.09Å; N144-W147 PolarHBondContact O-N 3.41Å; N144-W147 VanDerWaalsContact O-N 3.11Å; W147-K149 VanDerWaalsContact C-N 3.3Å
148	V	93.6	Very high	93.4	Very high	31 Å²	31	46 Å²	46	19%	0.188	21%	0.208	C	C	.	.	H	α-helix	trans	-75.4	-20	176.3	-179.5	0	0	0	0	112.1	R99 N144 S150	R99-V148 HydrophobicContact CB-CG2 3.7Å; R99-V148 HydrophobicContact CG-CG2 3.71Å; N144-V148 WeakPolarHBondContact O-CG2 3.47Å; N144-V148 PolarHBondContact O-N 3.06Å; V148-S150 VanDerWaalsContact C-N 3.27Å; V148-S150 WeakPolarHBondContact CG1-OG 3.44Å; V148-S150 PolarHBondContact O-N 3.35Å
149	K	94.1	Very high	92.7	Very high	76 Å²	76	48.9 Å²	48.9	33%	0.33	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	36.7	-169.3	-54.9	169.7	160.6	-170	0	113.1	L145 W147 Y151 N152 S193 E197	L145-K149 VanDerWaalsContact O-CA 3.3Å; L145-K149 WeakPolarHBondContact O-CA 3.36Å; L145-K149 PolarHBondContact O-N 3.48Å; W147-K149 VanDerWaalsContact C-N 3.3Å; K149-Y151 PolarHBondContact O-N 3.3Å; K149-N152 WeakPolarHBondContact O-CB 3.46Å; K149-N152 PolarHBondContact O-N 3.41Å; K149-S193 WeakPolarHBondContact CD-OG 3.44Å; K149-S193 WeakPolarHBondContact CG-OG 3.49Å; K149-E197 IonicContact NZ-OE1 3.72Å; K149-E197 PolarHBondContact NZ-OE1 3.18Å; K149-E197 IonicContact NZ-OE2 3.99Å; K149-E197 PolarHBondContact NZ-OE2 3.2Å
150	S	93.1	Very high	92.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-54.9	-28.8	-167.8	-42.1	0	0	0	0	114.2	F117 L145 V148 N152 I153	F117-S150 WeakPolarHBondContact CZ-O 3.25Å; L145-S150 PolarHBondContact O-N 2.83Å; V148-S150 VanDerWaalsContact C-N 3.27Å; V148-S150 WeakPolarHBondContact CG1-OG 3.44Å; V148-S150 PolarHBondContact O-N 3.35Å; S150-N152 PolarHBondContact O-N 2.63Å; S150-I153 WeakPolarHBondContact O-CB 3.22Å; S150-I153 WeakPolarHBondContact O-CD1 3.3Å; S150-I153 WeakPolarHBondContact O-CG1 3.34Å; S150-I153 PolarHBondContact O-N 3.4Å
151	Y	94.4	Very high	92.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-68.4	-14.1	177.2	-81.6	-100.8	0	0	0	114.5	F117 I120 T121 L145 K149 I153 C154 I163 L167 L190 I194	F117-Y151 HydrophobicContact CB-CD1 4.49Å; F117-Y151 HydrophobicContact CB-CE1 4Å; F117-Y151 AromaticContact CD1-CD1 3.88Å; F117-Y151 HydrophobicContact CD1-CD1 3.88Å; F117-Y151 HydrophobicContact CD1-CD2 4.04Å; F117-Y151 AromaticContact CD1-CE1 3.77Å; F117-Y151 HydrophobicContact CD1-CE1 3.77Å; F117-Y151 AromaticContact CD1-CE2 3.92Å; F117-Y151 HydrophobicContact CD1-CE2 3.92Å; F117-Y151 HydrophobicContact CD1-CG 4.03Å; F117-Y151 AromaticContact CD1-CZ 3.79Å; F117-Y151 HydrophobicContact CE1-CD2 4.14Å; F117-Y151 HydrophobicContact CE1-CE2 4.34Å; F117-Y151 HydrophobicContact CE1-CG 4.25Å; F117-Y151 HydrophobicContact CG-CD1 4.41Å; F117-Y151 HydrophobicContact CG-CE1 4.26Å; F117-Y151 PolarHBondContact O-OH 3.01Å; I120-Y151 HydrophobicContact CG2-CE2 4.18Å; I120-Y151 WeakPolarHBondContact CG2-OH 3.27Å; T121-Y151 PolarHBondContact N-OH 3.38Å; T121-Y151 PolarHBondContact OG1-OH 3.03Å; L145-Y151 HydrophobicContact CD1-CE2 4.26Å; L145-Y151 HydrophobicContact CD2-CD2 4.48Å; L145-Y151 HydrophobicContact CD2-CE2 4.15Å; K149-Y151 PolarHBondContact O-N 3.3Å; Y151-I153 PolarHBondContact O-N 3.29Å; Y151-C154 WeakPolarHBondContact O-CB 3.48Å; Y151-C154 PolarHBondContact O-N 2.93Å; Y151-C154 PolarHBondContact O-SG 3.39Å; Y151-I163 HydrophobicContact CD1-CG2 4.09Å; Y151-I163 HydrophobicContact CE1-CG2 3.85Å; Y151-L167 HydrophobicContact CD1-CD2 3.8Å; Y151-L167 HydrophobicContact CD2-CD2 4.46Å; Y151-L167 HydrophobicContact CE1-CB 4.45Å; Y151-L167 HydrophobicContact CE1-CD1 4.3Å; Y151-L167 HydrophobicContact CE1-CD2 3.87Å; Y151-L167 HydrophobicContact CE1-CG 4.44Å; Y151-L167 HydrophobicContact CG-CD2 4.1Å; Y151-L190 HydrophobicContact CD2-CD1 3.8Å; Y151-L190 HydrophobicContact CD2-CD2 4.37Å; Y151-L190 HydrophobicContact CE2-CD2 4.48Å; Y151-L190 HydrophobicContact CG-CD1 4.23Å; Y151-I194 HydrophobicContact CG-CD1 4.49Å
152	N	92.3	Very high	91.8	Very high	35 Å²	35	53 Å²	53	19%	0.187	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-62.3	-25.8	171.2	-71.1	21.2	0	0	0	111.5	K149 S150 C154 F155 S193 E197	K149-N152 WeakPolarHBondContact O-CB 3.46Å; K149-N152 PolarHBondContact O-N 3.41Å; S150-N152 PolarHBondContact O-N 2.63Å; N152-C154 PolarHBondContact O-N 2.93Å; N152-C154 VanDerWaalsContact O-N 3.15Å; N152-F155 HydrophobicContact CB-CD2 4.06Å; N152-F155 HydrophobicContact CB-CE2 3.73Å; N152-F155 WeakPolarHBondContact O-CB 3.33Å; N152-F155 WeakPolarHBondContact O-CD2 3.28Å; N152-F155 WeakPolarHBondContact O-CG 3.36Å; N152-F155 PolarHBondContact O-N 3.43Å; N152-S193 PolarHBondContact ND2-OG 3.17Å; N152-S193 PolarHBondContact OD1-OG 3.45Å; N152-E197 PolarHBondContact ND2-OE2 2.87Å
153	I	90.8	Very high	91.7	Very high	47 Å²	47	53 Å²	53	24%	0.241	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-59	-25.4	173.3	-60.9	166.9	0	0	0	111	F98 A105 L113 F117 S150 Y151 F155	F98-I153 HydrophobicContact CD1-CD1 3.49Å; F98-I153 VanDerWaalsContact CD1-CD1 3.49Å; F98-I153 HydrophobicContact CE1-CD1 3.87Å; F98-I153 HydrophobicContact CG-CD1 4.22Å; A105-I153 HydrophobicContact CB-CD1 4.15Å; L113-I153 HydrophobicContact CD1-CG2 4.19Å; L113-I153 HydrophobicContact CD2-CG2 4.11Å; F117-I153 HydrophobicContact CE2-CB 4.2Å; F117-I153 HydrophobicContact CE2-CG2 4.26Å; F117-I153 HydrophobicContact CZ-CB 4.16Å; F117-I153 HydrophobicContact CZ-CD1 4.39Å; S150-I153 WeakPolarHBondContact O-CB 3.22Å; S150-I153 WeakPolarHBondContact O-CD1 3.3Å; S150-I153 WeakPolarHBondContact O-CG1 3.34Å; S150-I153 PolarHBondContact O-N 3.4Å; Y151-I153 PolarHBondContact O-N 3.29Å; I153-F155 PolarHBondContact O-N 3.19Å
154	C	92	Very high	91.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-68	-15.5	177	-60.8	0	0	0	0	114.1	F117 Y151 N152 E156 L157 C160 I163 F164	F117-C154 WeakPolarHBondContact CD2-SG 3.3Å; F117-C154 VanDerWaalsContact CG-SG 3.52Å; Y151-C154 WeakPolarHBondContact O-CB 3.48Å; Y151-C154 PolarHBondContact O-N 2.93Å; Y151-C154 PolarHBondContact O-SG 3.39Å; N152-C154 PolarHBondContact O-N 2.93Å; N152-C154 VanDerWaalsContact O-N 3.15Å; C154-E156 PolarHBondContact O-N 3.01Å; C154-L157 HydrophobicContact CB-CD1 4.23Å; C154-L157 WeakPolarHBondContact O-CB 3.38Å; C154-L157 PolarHBondContact O-N 2.78Å; C154-C160 WeakPolarHBondContact O-CB 3.17Å; C154-I163 HydrophobicContact CB-CD1 4.29Å; C154-F164 HydrophobicContact CB-CE1 3.66Å; C154-F164 HydrophobicContact CB-CZ 3.64Å
155	F	90.7	Very high	91.6	Very high	56 Å²	56	51.2 Å²	51.2	25%	0.246	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-62.1	-27.4	-176.4	-64.2	-43	0	0	0	113.3	N152 I153 L157 F164 E197 G198	N152-F155 HydrophobicContact CB-CD2 4.06Å; N152-F155 HydrophobicContact CB-CE2 3.73Å; N152-F155 WeakPolarHBondContact O-CB 3.33Å; N152-F155 WeakPolarHBondContact O-CD2 3.28Å; N152-F155 WeakPolarHBondContact O-CG 3.36Å; N152-F155 PolarHBondContact O-N 3.43Å; I153-F155 PolarHBondContact O-N 3.19Å; F155-L157 VanDerWaalsContact C-N 3.29Å; F155-L157 PolarHBondContact O-N 3.21Å; F155-F164 AromaticContact CD1-CE2 3.75Å; F155-F164 HydrophobicContact CD1-CE2 3.75Å; F155-F164 AromaticContact CD1-CZ 3.54Å; F155-F164 HydrophobicContact CD1-CZ 3.54Å; F155-F164 AromaticContact CE1-CE2 3.8Å; F155-F164 HydrophobicContact CE1-CE2 3.8Å; F155-F164 AromaticContact CE1-CZ 3.55Å; F155-F164 HydrophobicContact CE1-CZ 3.55Å; F155-E197 HydrophobicContact CE2-CB 4.19Å; F155-E197 WeakPolarHBondContact CE2-O 3.47Å; F155-E197 HydrophobicContact CZ-CB 4.47Å; F155-G198 VanDerWaalsContact CE1-CA 3.45Å; F155-G198 VanDerWaalsContact CZ-CA 3.43Å
156	E	84.7	Confident	91.6	Very high	165 Å²	165	54.9 Å²	54.9	77%	0.771	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-82.8	-0.7	177.6	-58.4	-174.1	166.3	0	0	113.6	H110 C154	H110-E156 PolarHBondContact CE1-O 3.4Å; C154-E156 PolarHBondContact O-N 3.01Å
157	L	89.5	Confident	91.7	Very high	9 Å²	9	54.5 Å²	54.5	5%	0.047	26%	0.256	C	S	.	.	S	Bend	trans	-94.2	133.2	179.9	-52.8	179.5	0	0	0	111.3	H110 L113 C154 F155 D159 C160 I163	H110-L157 HydrophobicContact CB-CD2 3.67Å; L113-L157 HydrophobicContact CB-CD1 4.01Å; L113-L157 HydrophobicContact CB-CD2 4.12Å; L113-L157 HydrophobicContact CD1-CD2 4.11Å; C154-L157 HydrophobicContact CB-CD1 4.23Å; C154-L157 WeakPolarHBondContact O-CB 3.38Å; C154-L157 PolarHBondContact O-N 2.78Å; F155-L157 VanDerWaalsContact C-N 3.29Å; F155-L157 PolarHBondContact O-N 3.21Å; L157-D159 PolarHBondContact O-N 3.25Å; L157-C160 VanDerWaalsContact O-CB 3.24Å; L157-C160 WeakPolarHBondContact O-CB 3.46Å; L157-C160 PolarHBondContact O-N 3.02Å; L157-I163 HydrophobicContact CD1-CD1 3.75Å
158	E	83.7	Confident	91.8	Very high	190 Å²	190	45.7 Å²	45.7	89%	0.888	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-37.7	177.5	-60.7	-172.3	150	0	0	112.4	C160	E158-C160 VanDerWaalsContact C-N 3.34Å; E158-C160 PolarHBondContact O-N 2.98Å
159	D	81.7	Confident	92	Very high	81 Å²	81	49.6 Å²	49.6	43%	0.433	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	18.2	179.6	-70.6	-44.2	0	0	0	114.5	K114 L157 N161 E162	K114-D159 HydrophobicContact CD-CB 3.9Å; K114-D159 WeakPolarHBondContact CE-OD2 3.37Å; K114-D159 IonicContact NZ-OD1 3.65Å; K114-D159 IonicContact NZ-OD2 2.87Å; K114-D159 PolarHBondContact NZ-OD2 3.16Å; L157-D159 PolarHBondContact O-N 3.25Å; D159-N161 PolarHBondContact O-N 3.38Å; D159-E162 PolarHBondContact O-N 3.26Å
160	C	89.5	Confident	92.1	Very high	20 Å²	20	46.1 Å²	46.1	14%	0.135	22%	0.219	C	C	.	.	H	α-helix	trans	-50.4	-37.8	-175.2	66.9	0	0	0	0	113.7	C154 L157 E158 E162 I163 F164	C154-C160 WeakPolarHBondContact O-CB 3.17Å; L157-C160 VanDerWaalsContact O-CB 3.24Å; L157-C160 WeakPolarHBondContact O-CB 3.46Å; L157-C160 PolarHBondContact O-N 3.02Å; E158-C160 VanDerWaalsContact C-N 3.34Å; E158-C160 PolarHBondContact O-N 2.98Å; C160-E162 PolarHBondContact O-N 3.02Å; C160-I163 WeakPolarHBondContact O-CB 3.35Å; C160-I163 PolarHBondContact O-N 3.49Å; C160-F164 HydrophobicContact CB-CD2 4.33Å; C160-F164 HydrophobicContact CB-CE2 3.75Å; C160-F164 HydrophobicContact CB-CZ 4.24Å; C160-F164 WeakPolarHBondContact O-CD2 3.44Å; C160-F164 VanDerWaalsContact O-CG 3.27Å; C160-F164 WeakPolarHBondContact O-CG 3.49Å; C160-F164 PolarHBondContact O-N 2.92Å
161	N	90	Very high	92.3	Very high	50 Å²	50	46 Å²	46	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-63.2	-39.1	179.6	-78	-77.9	0	0	0	113.2	D159 I163 F164 I165 T202	D159-N161 PolarHBondContact O-N 3.38Å; N161-I163 VanDerWaalsContact C-N 3.28Å; N161-I163 PolarHBondContact O-N 3Å; N161-F164 PolarHBondContact O-N 3.29Å; N161-I165 HydrophobicContact CB-CD1 4.36Å; N161-I165 VanDerWaalsContact O-CB 3.3Å; N161-I165 WeakPolarHBondContact O-CB 3.42Å; N161-I165 VanDerWaalsContact O-CD1 3.32Å; N161-I165 WeakPolarHBondContact O-CD1 3.2Å; N161-I165 WeakPolarHBondContact O-CG1 3.49Å; N161-I165 PolarHBondContact O-N 2.86Å; N161-T202 WeakPolarHBondContact OD1-CB 3.42Å; N161-T202 WeakPolarHBondContact OD1-CG2 3.45Å; N161-T202 PolarHBondContact OD1-OG1 3.27Å
162	E	92.6	Very high	92.4	Very high	96 Å²	96	46.5 Å²	46.5	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-60	-44.2	177	-169.3	-165.9	160.9	0	0	110.2	K114 D159 C160 Q166	K114-E162 WeakPolarHBondContact CE-OE2 3.23Å; K114-E162 IonicContact NZ-OE2 2.73Å; K114-E162 PolarHBondContact NZ-OE2 3.29Å; D159-E162 PolarHBondContact O-N 3.26Å; C160-E162 PolarHBondContact O-N 3.02Å; E162-Q166 WeakPolarHBondContact O-CB 3.48Å; E162-Q166 PolarHBondContact O-N 2.94Å
163	I	94.5	Very high	92.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-49.2	178.9	-51.3	173.6	0	0	0	110.3	K114 F117 L118 Y151 C154 L157 C160 N161 Q166 L167	K114-I163 HydrophobicContact CB-CD1 4.36Å; K114-I163 HydrophobicContact CG-CD1 4.14Å; K114-I163 HydrophobicContact CG-CG1 4.36Å; F117-I163 HydrophobicContact CB-CD1 4.44Å; F117-I163 HydrophobicContact CB-CG2 3.71Å; L118-I163 HydrophobicContact CD2-CB 4.44Å; L118-I163 HydrophobicContact CD2-CG1 4.17Å; L118-I163 HydrophobicContact CG-CG1 4.28Å; Y151-I163 HydrophobicContact CD1-CG2 4.09Å; Y151-I163 HydrophobicContact CE1-CG2 3.85Å; C154-I163 HydrophobicContact CB-CD1 4.29Å; L157-I163 HydrophobicContact CD1-CD1 3.75Å; C160-I163 WeakPolarHBondContact O-CB 3.35Å; C160-I163 PolarHBondContact O-N 3.49Å; N161-I163 VanDerWaalsContact C-N 3.28Å; N161-I163 PolarHBondContact O-N 3Å; I163-Q166 PolarHBondContact O-N 3.41Å; I163-L167 WeakPolarHBondContact O-CB 3.46Å; I163-L167 PolarHBondContact O-N 3.33Å
164	F	95.7	Very high	92.8	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.035	22%	0.219	C	C	.	.	H	α-helix	trans	-66.5	-44	-178.5	-59.7	-36	0	0	0	112.7	C154 F155 C160 N161 Q166 L167 F168 I194 L205	C154-F164 HydrophobicContact CB-CE1 3.66Å; C154-F164 HydrophobicContact CB-CZ 3.64Å; F155-F164 AromaticContact CD1-CE2 3.75Å; F155-F164 HydrophobicContact CD1-CE2 3.75Å; F155-F164 AromaticContact CD1-CZ 3.54Å; F155-F164 HydrophobicContact CD1-CZ 3.54Å; F155-F164 AromaticContact CE1-CE2 3.8Å; F155-F164 HydrophobicContact CE1-CE2 3.8Å; F155-F164 AromaticContact CE1-CZ 3.55Å; F155-F164 HydrophobicContact CE1-CZ 3.55Å; C160-F164 HydrophobicContact CB-CD2 4.33Å; C160-F164 HydrophobicContact CB-CE2 3.75Å; C160-F164 HydrophobicContact CB-CZ 4.24Å; C160-F164 WeakPolarHBondContact O-CD2 3.44Å; C160-F164 VanDerWaalsContact O-CG 3.27Å; C160-F164 WeakPolarHBondContact O-CG 3.49Å; C160-F164 PolarHBondContact O-N 2.92Å; N161-F164 PolarHBondContact O-N 3.29Å; F164-Q166 VanDerWaalsContact C-N 3.34Å; F164-Q166 PolarHBondContact O-N 3.44Å; F164-L167 PolarHBondContact O-N 3.32Å; F164-F168 WeakPolarHBondContact O-CB 3.47Å; F164-F168 VanDerWaalsContact O-CD2 3.22Å; F164-F168 WeakPolarHBondContact O-CD2 3.46Å; F164-F168 PolarHBondContact O-N 3.24Å; F164-I194 HydrophobicContact CB-CG2 4.23Å; F164-I194 HydrophobicContact CD1-CD1 3.87Å; F164-I194 HydrophobicContact CD1-CG1 4.15Å; F164-I194 HydrophobicContact CD1-CG2 3.7Å; F164-I194 HydrophobicContact CD2-CG2 3.96Å; F164-I194 HydrophobicContact CE1-CD1 4.14Å; F164-I194 HydrophobicContact CE1-CG1 4.03Å; F164-I194 HydrophobicContact CE1-CG2 3.96Å; F164-I194 HydrophobicContact CE2-CG2 4.21Å; F164-I194 HydrophobicContact CG-CG2 3.71Å; F164-I194 HydrophobicContact CZ-CG2 4.21Å; F164-L205 HydrophobicContact CB-CD1 4.13Å; F164-L205 HydrophobicContact CB-CD2 4Å
165	I	95.4	Very high	93	Very high	16 Å²	16	45.3 Å²	45.3	8%	0.082	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-44.5	177	-68.4	161.8	0	0	0	110.1	N161 F168 R169 E204 L205	N161-I165 HydrophobicContact CB-CD1 4.36Å; N161-I165 VanDerWaalsContact O-CB 3.3Å; N161-I165 WeakPolarHBondContact O-CB 3.42Å; N161-I165 VanDerWaalsContact O-CD1 3.32Å; N161-I165 WeakPolarHBondContact O-CD1 3.2Å; N161-I165 WeakPolarHBondContact O-CG1 3.49Å; N161-I165 PolarHBondContact O-N 2.86Å; I165-F168 PolarHBondContact O-N 2.99Å; I165-R169 HydrophobicContact CG2-CG 4.4Å; I165-R169 VanDerWaalsContact CG2-NH1 3.27Å; I165-R169 WeakPolarHBondContact O-CB 3.45Å; I165-R169 VanDerWaalsContact O-CG 3.29Å; I165-R169 WeakPolarHBondContact O-CG 3.27Å; I165-R169 PolarHBondContact O-N 3.38Å; I165-E204 HydrophobicContact CD1-CB 3.58Å; I165-E204 HydrophobicContact CG1-CB 4.25Å; I165-L205 HydrophobicContact CG1-CB 3.86Å; I165-L205 HydrophobicContact CG1-CD1 4.14Å
166	Q	96	Very high	93.1	Very high	77 Å²	77	44.3 Å²	44.3	36%	0.36	22%	0.216	S	C	.	.	H	α-helix	trans	-69.9	-32.9	179.5	-172.8	55.2	29.9	0	0	112.5	T121 E162 I163 F164 T170	T121-Q166 HydrophobicContact CG2-CB 4.5Å; T121-Q166 HydrophobicContact CG2-CG 3.98Å; E162-Q166 WeakPolarHBondContact O-CB 3.48Å; E162-Q166 PolarHBondContact O-N 2.94Å; I163-Q166 PolarHBondContact O-N 3.41Å; F164-Q166 VanDerWaalsContact C-N 3.34Å; F164-Q166 PolarHBondContact O-N 3.44Å; Q166-T170 VanDerWaalsContact O-CB 3.22Å; Q166-T170 WeakPolarHBondContact O-CB 3.36Å; Q166-T170 PolarHBondContact O-N 3.5Å; Q166-T170 PolarHBondContact O-OG1 2.95Å
167	L	96.9	Very high	93.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-51.4	170.8	176.2	67.8	0	0	0	110.9	T121 L124 Y151 I163 F164 T170 L171 L190 I194	T121-L167 HydrophobicContact CG2-CB 4.43Å; L124-L167 HydrophobicContact CD1-CD1 3.58Å; Y151-L167 HydrophobicContact CD1-CD2 3.8Å; Y151-L167 HydrophobicContact CD2-CD2 4.46Å; Y151-L167 HydrophobicContact CE1-CB 4.45Å; Y151-L167 HydrophobicContact CE1-CD1 4.3Å; Y151-L167 HydrophobicContact CE1-CD2 3.87Å; Y151-L167 HydrophobicContact CE1-CG 4.44Å; Y151-L167 HydrophobicContact CG-CD2 4.1Å; I163-L167 WeakPolarHBondContact O-CB 3.46Å; I163-L167 PolarHBondContact O-N 3.33Å; F164-L167 PolarHBondContact O-N 3.32Å; L167-T170 CarbonylContact O-C 3.49Å; L167-T170 WeakPolarHBondContact O-CA 3.33Å; L167-T170 WeakPolarHBondContact O-CB 3.23Å; L167-T170 PolarHBondContact O-N 3.35Å; L167-T170 VanDerWaalsContact O-N 3.1Å; L167-L171 HydrophobicContact CD1-CD1 4.01Å; L167-L171 HydrophobicContact CD1-CD2 4.5Å; L167-L171 HydrophobicContact CD1-CG 4.06Å; L167-L171 HydrophobicContact CG-CD1 4.08Å; L167-L171 HydrophobicContact CG-CG 4.38Å; L167-L171 WeakPolarHBondContact O-CG 3.46Å; L167-L171 PolarHBondContact O-N 3.14Å; L167-L190 HydrophobicContact CD1-CD2 4.36Å; L167-L190 HydrophobicContact CD2-CD2 4.17Å; L167-L190 HydrophobicContact CD2-CG 4.28Å; L167-I194 HydrophobicContact CD2-CD1 3.5Å
168	F	97.5	Very high	93.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-48.3	-177.5	-86.2	-128.4	0	0	0	111.6	F164 I165 T170 L171 F172 M191 I194 I195 L205 S208 I209 L231	F164-F168 WeakPolarHBondContact O-CB 3.47Å; F164-F168 VanDerWaalsContact O-CD2 3.22Å; F164-F168 WeakPolarHBondContact O-CD2 3.46Å; F164-F168 PolarHBondContact O-N 3.24Å; I165-F168 PolarHBondContact O-N 2.99Å; F168-T170 PolarHBondContact O-N 3.37Å; F168-L171 PolarHBondContact O-N 2.8Å; F168-F172 HydrophobicContact CD1-CE2 4.24Å; F168-F172 VanDerWaalsContact O-CD2 3.26Å; F168-F172 WeakPolarHBondContact O-CD2 3.5Å; F168-F172 PolarHBondContact O-N 2.9Å; F168-M191 HydrophobicContact CB-CE 4.23Å; F168-M191 HydrophobicContact CD1-CE 3.44Å; F168-M191 VanDerWaalsContact CD1-CE 3.44Å; F168-M191 HydrophobicContact CD2-CE 4.21Å; F168-M191 HydrophobicContact CD2-CG 4.3Å; F168-M191 HydrophobicContact CE1-CB 4.2Å; F168-M191 HydrophobicContact CE1-CE 3.73Å; F168-M191 HydrophobicContact CE1-CG 4.38Å; F168-M191 HydrophobicContact CE2-CB 4.08Å; F168-M191 HydrophobicContact CE2-CE 4.47Å; F168-M191 HydrophobicContact CE2-CG 3.94Å; F168-M191 HydrophobicContact CG-CE 3.7Å; F168-M191 HydrophobicContact CZ-CB 3.7Å; F168-M191 HydrophobicContact CZ-CE 4.24Å; F168-M191 HydrophobicContact CZ-CG 3.98Å; F168-I194 HydrophobicContact CE2-CB 4.3Å; F168-I194 HydrophobicContact CE2-CD1 4.03Å; F168-I194 HydrophobicContact CE2-CG2 4.18Å; F168-I194 HydrophobicContact CZ-CG2 4.49Å; F168-I195 HydrophobicContact CE1-CD1 3.95Å; F168-I195 HydrophobicContact CE1-CG1 4.36Å; F168-I195 HydrophobicContact CZ-CD1 4.05Å; F168-I195 HydrophobicContact CZ-CG1 4.09Å; F168-L205 HydrophobicContact CB-CD1 4.01Å; F168-L205 HydrophobicContact CD1-CD1 3.75Å; F168-L205 HydrophobicContact CD2-CD1 3.88Å; F168-L205 HydrophobicContact CE1-CD1 4.16Å; F168-L205 HydrophobicContact CE2-CD1 4.27Å; F168-L205 HydrophobicContact CG-CD1 3.6Å; F168-L205 HydrophobicContact CZ-CD1 4.4Å; F168-S208 WeakPolarHBondContact CB-OG 3.17Å; F168-I209 HydrophobicContact CD1-CD1 4.2Å; F168-I209 HydrophobicContact CD1-CG1 3.79Å; F168-I209 HydrophobicContact CE1-CD1 3.85Å; F168-I209 HydrophobicContact CE1-CG1 3.92Å; F168-L231 HydrophobicContact CE1-CD2 4Å
169	R	96.6	Very high	94.2	Very high	114 Å²	114	37.1 Å²	37.1	43%	0.43	19%	0.194	S	C	.	.	H	α-helix	trans	-56	-38.5	172.1	-71.9	176.1	177.8	153	7.2	111.4	I165 S173 E204	I165-R169 HydrophobicContact CG2-CG 4.4Å; I165-R169 VanDerWaalsContact CG2-NH1 3.27Å; I165-R169 WeakPolarHBondContact O-CB 3.45Å; I165-R169 VanDerWaalsContact O-CG 3.29Å; I165-R169 WeakPolarHBondContact O-CG 3.27Å; I165-R169 PolarHBondContact O-N 3.38Å; R169-S173 VanDerWaalsContact O-CB 3.28Å; R169-S173 WeakPolarHBondContact O-CB 3.43Å; R169-S173 PolarHBondContact O-N 3.39Å; R169-S173 VanDerWaalsContact O-N 3.12Å; R169-S173 PolarHBondContact O-OG 2.93Å; R169-E204 IonicContact CZ-OE2 3.65Å; R169-E204 IonicContact NH1-OE2 3.05Å; R169-E204 PolarHBondContact NH1-OE2 2.92Å; R169-E204 IonicContact NH2-OE2 2.61Å; R169-E204 PolarHBondContact NH2-OE2 3.33Å
170	T	96.9	Very high	94.7	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-65.8	-52.3	175.4	-64.4	0	0	0	0	111.8	L124 K125 Q166 L167 F168 F172 S173 V174	L124-T170 HydrophobicContact CB-CG2 4.44Å; K125-T170 HydrophobicContact CG-CG2 3.66Å; Q166-T170 VanDerWaalsContact O-CB 3.22Å; Q166-T170 WeakPolarHBondContact O-CB 3.36Å; Q166-T170 PolarHBondContact O-N 3.5Å; Q166-T170 PolarHBondContact O-OG1 2.95Å; L167-T170 CarbonylContact O-C 3.49Å; L167-T170 WeakPolarHBondContact O-CA 3.33Å; L167-T170 WeakPolarHBondContact O-CB 3.23Å; L167-T170 PolarHBondContact O-N 3.35Å; L167-T170 VanDerWaalsContact O-N 3.1Å; F168-T170 PolarHBondContact O-N 3.37Å; T170-F172 PolarHBondContact O-N 2.99Å; T170-S173 PolarHBondContact O-N 2.78Å; T170-S173 PolarHBondContact O-OG 3.43Å; T170-V174 HydrophobicContact CG2-CG1 4.44Å; T170-V174 PolarHBondContact O-N 3.01Å
171	L	97.4	Very high	94.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-42.1	-177.7	-65.7	-178.1	0	0	0	112.3	L124 L167 F168 S173 V174 I175 M187 L190 M191	L124-L171 HydrophobicContact CD1-CD2 4.46Å; L167-L171 HydrophobicContact CD1-CD1 4.01Å; L167-L171 HydrophobicContact CD1-CD2 4.5Å; L167-L171 HydrophobicContact CD1-CG 4.06Å; L167-L171 HydrophobicContact CG-CD1 4.08Å; L167-L171 HydrophobicContact CG-CG 4.38Å; L167-L171 WeakPolarHBondContact O-CG 3.46Å; L167-L171 PolarHBondContact O-N 3.14Å; F168-L171 PolarHBondContact O-N 2.8Å; L171-S173 VanDerWaalsContact C-N 3.29Å; L171-S173 PolarHBondContact O-N 3.27Å; L171-V174 WeakPolarHBondContact O-CG2 3.33Å; L171-I175 WeakPolarHBondContact O-CG2 3.26Å; L171-I175 PolarHBondContact O-N 3.36Å; L171-M187 HydrophobicContact CD2-CE 4.28Å; L171-M187 HydrophobicContact CD2-CG 4.13Å; L171-L190 HydrophobicContact CD1-CD2 4.45Å; L171-M191 HydrophobicContact CB-CE 4.44Å; L171-M191 HydrophobicContact CB-SD 4.03Å; L171-M191 HydrophobicContact CD1-CG 3.58Å; L171-M191 HydrophobicContact CD1-SD 3.65Å
172	F	96.9	Very high	95.1	Very high	10 Å²	10	47.4 Å²	47.4	4%	0.044	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-25.8	173.4	-73.4	-56.5	0	0	0	113.6	F168 T170 M191 S208 I209 S224 L227 A228 L231	F168-F172 HydrophobicContact CD1-CE2 4.24Å; F168-F172 VanDerWaalsContact O-CD2 3.26Å; F168-F172 WeakPolarHBondContact O-CD2 3.5Å; F168-F172 PolarHBondContact O-N 2.9Å; T170-F172 PolarHBondContact O-N 2.99Å; F172-M191 HydrophobicContact CD2-CE 4.01Å; F172-M191 HydrophobicContact CE1-CE 4.2Å; F172-M191 HydrophobicContact CE2-CE 3.46Å; F172-M191 VanDerWaalsContact CE2-CE 3.46Å; F172-M191 HydrophobicContact CZ-CE 3.57Å; F172-S208 WeakPolarHBondContact CD2-O 3.38Å; F172-S208 VanDerWaalsContact CE2-O 3.23Å; F172-S208 WeakPolarHBondContact CE2-O 3.44Å; F172-I209 HydrophobicContact CE2-CB 4.33Å; F172-I209 HydrophobicContact CE2-CG1 4.09Å; F172-I209 HydrophobicContact CZ-CB 4.43Å; F172-I209 HydrophobicContact CZ-CG1 4.39Å; F172-I209 HydrophobicContact CZ-CG2 4.24Å; F172-S224 PolarHBondContact O-OG 3.09Å; F172-L227 HydrophobicContact CD1-CD2 3.93Å; F172-L227 HydrophobicContact CE1-CB 4.24Å; F172-L227 HydrophobicContact CE1-CD2 3.95Å; F172-L227 HydrophobicContact CE1-CG 4.2Å; F172-A228 HydrophobicContact CE1-CB 3.72Å; F172-A228 HydrophobicContact CZ-CB 3.96Å; F172-L231 HydrophobicContact CZ-CD2 4.24Å
173	S	95.2	Very high	95.2	Very high	57 Å²	57	42.8 Å²	42.8	40%	0.399	21%	0.212	S	C	.	.	H	α-helix	trans	-79	-37.3	176.2	73.8	0	0	0	0	113.8	R169 T170 L171	R169-S173 VanDerWaalsContact O-CB 3.28Å; R169-S173 WeakPolarHBondContact O-CB 3.43Å; R169-S173 PolarHBondContact O-N 3.39Å; R169-S173 VanDerWaalsContact O-N 3.12Å; R169-S173 PolarHBondContact O-OG 2.93Å; T170-S173 PolarHBondContact O-N 2.78Å; T170-S173 PolarHBondContact O-OG 3.43Å; L171-S173 VanDerWaalsContact C-N 3.29Å; L171-S173 PolarHBondContact O-N 3.27Å
174	V	95.4	Very high	95.2	Very high	1 Å²	1	45 Å²	45	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-79.6	-26.7	-177.6	-60.2	0	0	0	0	113.1	K125 L127 E128 T170 L171 N176 H179 M187	K125-V174 HydrophobicContact CG-CG1 4.42Å; L127-V174 HydrophobicContact CB-CB 4.45Å; L127-V174 HydrophobicContact CB-CG2 4.27Å; E128-V174 HydrophobicContact CB-CB 4.13Å; E128-V174 HydrophobicContact CB-CG1 4.11Å; T170-V174 HydrophobicContact CG2-CG1 4.44Å; T170-V174 PolarHBondContact O-N 3.01Å; L171-V174 WeakPolarHBondContact O-CG2 3.33Å; V174-N176 PolarHBondContact O-N 2.67Å; V174-N176 PolarHBondContact O-ND2 3.23Å; V174-H179 PolarHBondContact O-CE1 3Å; V174-H179 VanDerWaalsContact O-CE1 3.26Å; V174-M187 HydrophobicContact CG2-CE 3.6Å
175	I	95.6	Very high	95.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.			trans	-67.9	119.1	-170.6	-171.7	57.6	0	0	0	111.4	L171 H179 Q184 M187 N221 Q223 L227	L171-I175 WeakPolarHBondContact O-CG2 3.26Å; L171-I175 PolarHBondContact O-N 3.36Å; I175-H179 HydrophobicContact CD1-CB 3.92Å; I175-Q184 HydrophobicContact CD1-CG 3.8Å; I175-M187 HydrophobicContact CB-SD 4.2Å; I175-M187 HydrophobicContact CD1-CE 4.47Å; I175-M187 HydrophobicContact CD1-SD 3.96Å; I175-M187 HydrophobicContact CG1-SD 4.35Å; I175-N221 PolarHBondContact O-ND2 3.41Å; I175-Q223 HydrophobicContact CG1-CB 4.13Å; I175-L227 HydrophobicContact CB-CD2 4.35Å; I175-L227 HydrophobicContact CG1-CD2 4.45Å; I175-L227 HydrophobicContact CG2-CD2 4.02Å
176	N	93.9	Very high	95.3	Very high	35 Å²	35	49.2 Å²	49.2	19%	0.187	24%	0.243	C	C	.	.			trans	-142.2	169.4	-175.5	72	54.4	0	0	0	111.7	E128 V174 S178 H179	E128-N176 PolarHBondContact O-ND2 3.46Å; V174-N176 PolarHBondContact O-N 2.67Å; V174-N176 PolarHBondContact O-ND2 3.23Å; N176-S178 PolarHBondContact O-N 2.88Å; N176-S178 VanDerWaalsContact O-N 3.07Å; N176-S178 WeakPolarHBondContact OD1-CB 3.27Å; N176-S178 PolarHBondContact OD1-N 3.33Å; N176-H179 PolarHBondContact N-ND1 3.39Å; N176-H179 PolarHBondContact ND2-CE1 2.91Å; N176-H179 WeakPolarHBondContact O-CB 3.41Å; N176-H179 PolarHBondContact O-N 3.4Å; N176-H179 PolarHBondContact O-ND1 3.3Å; N176-H179 PolarHBondContact OD1-ND1 3.02Å
177	N	92.2	Very high	95.4	Very high	131 Å²	131	45.5 Å²	45.5	70%	0.701	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.2	-171.2	66.9	-3	0	0	0	116	Q223	N177-Q223 HydrophobicContact CB-CG 4.38Å
178	S	92.6	Very high	95.4	Very high	65 Å²	65	45.7 Å²	45.7	46%	0.455	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-8.3	178.1	-56.5	0	0	0	0	112.6	T130 N176	T130-S178 WeakPolarHBondContact OG1-CB 2.79Å; N176-S178 PolarHBondContact O-N 2.88Å; N176-S178 VanDerWaalsContact O-N 3.07Å; N176-S178 WeakPolarHBondContact OD1-CB 3.27Å; N176-S178 PolarHBondContact OD1-N 3.33Å
179	H	95.1	Very high	95.3	Very high	16 Å²	16	47.7 Å²	47.7	7%	0.074	24%	0.237	C	C	.	.			trans	-74.5	144.3	175.9	-68.3	93.3	0	0	0	112.6	L127 V174 I175 N176 V183	L127-H179 PolarHBondContact O-NE2 3.41Å; V174-H179 PolarHBondContact O-CE1 3Å; V174-H179 VanDerWaalsContact O-CE1 3.26Å; I175-H179 HydrophobicContact CD1-CB 3.92Å; N176-H179 PolarHBondContact N-ND1 3.39Å; N176-H179 PolarHBondContact ND2-CE1 2.91Å; N176-H179 WeakPolarHBondContact O-CB 3.41Å; N176-H179 PolarHBondContact O-N 3.4Å; N176-H179 PolarHBondContact O-ND1 3.3Å; N176-H179 PolarHBondContact OD1-ND1 3.02Å; H179-V183 HydrophobicContact CB-CB 4.3Å; H179-V183 HydrophobicContact CB-CG2 4.47Å
180	N	93.2	Very high	95.3	Very high	81 Å²	81	42.2 Å²	42.2	43%	0.433	22%	0.217	S	C	.	.			trans	-87.6	167.7	171.9	73.7	55.7	0	0	0	111.6	K182 V183 Q184	N180-K182 VanDerWaalsContact C-N 3.29Å; N180-K182 PolarHBondContact O-N 3.12Å; N180-K182 WeakPolarHBondContact OD1-CA 3.44Å; N180-K182 VanDerWaalsContact OD1-CB 3.28Å; N180-K182 WeakPolarHBondContact OD1-CB 3.4Å; N180-K182 PolarHBondContact OD1-N 2.97Å; N180-V183 PolarHBondContact O-N 3.26Å; N180-V183 VanDerWaalsContact O-N 3.17Å; N180-V183 PolarHBondContact OD1-N 3.27Å; N180-Q184 PolarHBondContact O-N 3.31Å
181	K	92.8	Very high	95.3	Very high	173 Å²	173	42.1 Å²	42.1	75%	0.752	22%	0.216	S	C	*	.	H	α-helix	trans	-61.8	-26.1	-178.1	-70	-170.7	176.8	-174.2	0	114.9	M185	K181-M185 WeakPolarHBondContact O-CB 3.35Å; K181-M185 PolarHBondContact O-N 2.86Å
182	K	94.5	Very high	95.2	Very high	113 Å²	113	42.2 Å²	42.2	49%	0.491	22%	0.217	S	C	.	.	H	α-helix	trans	-65.6	-46.3	174.1	-78.7	-167.9	153.2	-147.2	0	110.6	F139 E143 N180 Q184 M185 H186	F139-K182 HydrophobicContact CE2-CB 4.06Å; F139-K182 HydrophobicContact CZ-CB 3.9Å; F139-K182 HydrophobicContact CZ-CD 3.95Å; E143-K182 IonicContact OE1-NZ 2.78Å; E143-K182 PolarHBondContact OE1-NZ 3.48Å; N180-K182 VanDerWaalsContact C-N 3.29Å; N180-K182 PolarHBondContact O-N 3.12Å; N180-K182 WeakPolarHBondContact OD1-CA 3.44Å; N180-K182 VanDerWaalsContact OD1-CB 3.28Å; N180-K182 WeakPolarHBondContact OD1-CB 3.4Å; N180-K182 PolarHBondContact OD1-N 2.97Å; K182-Q184 VanDerWaalsContact C-N 3.31Å; K182-Q184 PolarHBondContact O-N 3.44Å; K182-M185 PolarHBondContact O-N 3.42Å; K182-H186 PolarHBondContact O-CD2 2.75Å; K182-H186 PolarHBondContact O-N 2.9Å
183	V	95	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-48.6	179.3	-166.4	0	0	0	0	110.2	L127 F135 F139 L142 H179 N180 M185 H186 M187	L127-V183 HydrophobicContact CD2-CG1 4.43Å; F135-V183 HydrophobicContact CZ-CG2 4.1Å; F139-V183 HydrophobicContact CD2-CB 4.42Å; F139-V183 HydrophobicContact CD2-CG2 3.73Å; F139-V183 HydrophobicContact CE2-CB 4.4Å; F139-V183 HydrophobicContact CE2-CG2 3.89Å; L142-V183 HydrophobicContact CD2-CG1 3.69Å; H179-V183 HydrophobicContact CB-CB 4.3Å; H179-V183 HydrophobicContact CB-CG2 4.47Å; N180-V183 PolarHBondContact O-N 3.26Å; N180-V183 VanDerWaalsContact O-N 3.17Å; N180-V183 PolarHBondContact OD1-N 3.27Å; V183-M185 VanDerWaalsContact C-N 3.28Å; V183-M185 PolarHBondContact O-N 3.44Å; V183-H186 PolarHBondContact O-N 3.41Å; V183-M187 HydrophobicContact CG1-CE 3.84Å; V183-M187 HydrophobicContact CG1-SD 4.48Å; V183-M187 VanDerWaalsContact O-CG 3.32Å; V183-M187 WeakPolarHBondContact O-CG 3.26Å; V183-M187 PolarHBondContact O-N 2.6Å
184	Q	94.7	Very high	95.2	Very high	46 Å²	46	39.6 Å²	39.6	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-56.8	-41.9	175.1	-71.9	171.7	-16.2	0	0	111.9	I175 N180 K182 L188	I175-Q184 HydrophobicContact CD1-CG 3.8Å; N180-Q184 PolarHBondContact O-N 3.31Å; K182-Q184 VanDerWaalsContact C-N 3.31Å; K182-Q184 PolarHBondContact O-N 3.44Å; Q184-L188 WeakPolarHBondContact O-CB 3.33Å; Q184-L188 WeakPolarHBondContact O-CD1 3.41Å; Q184-L188 VanDerWaalsContact O-CG 3.22Å; Q184-L188 WeakPolarHBondContact O-CG 3.19Å; Q184-L188 PolarHBondContact O-N 3.45Å
185	M	95.8	Very high	95.2	Very high	82 Å²	82	39.6 Å²	39.6	40%	0.404	20%	0.199	S	C	.	.	H	α-helix	trans	-70.5	-42.6	-179.4	-155	56.7	45.9	0	0	112.9	K181 K182 V183 M187 L188 D189	K181-M185 WeakPolarHBondContact O-CB 3.35Å; K181-M185 PolarHBondContact O-N 2.86Å; K182-M185 PolarHBondContact O-N 3.42Å; V183-M185 VanDerWaalsContact C-N 3.28Å; V183-M185 PolarHBondContact O-N 3.44Å; M185-M187 VanDerWaalsContact C-N 3.33Å; M185-M187 PolarHBondContact O-N 3.04Å; M185-L188 HydrophobicContact CE-CD1 3.91Å; M185-L188 CarbonylContact O-C 3.37Å; M185-L188 WeakPolarHBondContact O-CA 3.23Å; M185-L188 WeakPolarHBondContact O-CB 3.48Å; M185-L188 PolarHBondContact O-N 2.63Å; M185-L188 HydrophobicContact SD-CB 4.39Å; M185-L188 HydrophobicContact SD-CD1 4.03Å; M185-D189 PolarHBondContact O-N 3.07Å; M185-D189 VanDerWaalsContact O-OD2 3.07Å
186	H	97.4	Very high	95.1	Very high	30 Å²	30	44 Å²	44	14%	0.139	22%	0.221	C	C	.	.	H	α-helix	trans	-67.5	-32.8	176.6	-61.9	-58.1	0	0	0	112.6	F139 L142 E143 A146 K182 V183 D189 L190	F139-H186 AromaticContact CE2-CD2 3.78Å; F139-H186 AromaticContact CZ-CD2 3.78Å; L142-H186 HydrophobicContact CD2-CB 4.01Å; L142-H186 HydrophobicContact CG-CB 3.83Å; E143-H186 IonicContact OE1-NE2 3.84Å; E143-H186 PolarHBondContact OE1-NE2 2.81Å; A146-H186 HydrophobicContact CB-CB 3.82Å; A146-H186 VanDerWaalsContact CB-O 3.28Å; A146-H186 WeakPolarHBondContact CB-O 3.29Å; K182-H186 PolarHBondContact O-CD2 2.75Å; K182-H186 PolarHBondContact O-N 2.9Å; V183-H186 PolarHBondContact O-N 3.41Å; H186-D189 IonicContact ND1-OD2 3.63Å; H186-L190 WeakPolarHBondContact O-CB 3.38Å; H186-L190 PolarHBondContact O-N 2.57Å; H186-L190 VanDerWaalsContact O-N 3.1Å
187	M	97.4	Very high	95	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-47.4	166.9	-69.2	178.4	174.4	0	0	111.1	L127 L142 L171 V174 I175 V183 M185 M191 L227	L127-M187 HydrophobicContact CD1-CE 3.8Å; L142-M187 HydrophobicContact CD1-CG 4.26Å; L142-M187 HydrophobicContact CD2-CE 4.45Å; L142-M187 HydrophobicContact CD2-CG 3.86Å; L171-M187 HydrophobicContact CD2-CE 4.28Å; L171-M187 HydrophobicContact CD2-CG 4.13Å; V174-M187 HydrophobicContact CG2-CE 3.6Å; I175-M187 HydrophobicContact CB-SD 4.2Å; I175-M187 HydrophobicContact CD1-CE 4.47Å; I175-M187 HydrophobicContact CD1-SD 3.96Å; I175-M187 HydrophobicContact CG1-SD 4.35Å; V183-M187 HydrophobicContact CG1-CE 3.84Å; V183-M187 HydrophobicContact CG1-SD 4.48Å; V183-M187 VanDerWaalsContact O-CG 3.32Å; V183-M187 WeakPolarHBondContact O-CG 3.26Å; V183-M187 PolarHBondContact O-N 2.6Å; M185-M187 VanDerWaalsContact C-N 3.33Å; M185-M187 PolarHBondContact O-N 3.04Å; M187-M191 WeakPolarHBondContact O-CB 3.34Å; M187-M191 WeakPolarHBondContact O-CG 3.32Å; M187-M191 PolarHBondContact O-N 3.26Å; M187-L227 HydrophobicContact CB-CD1 4.26Å; M187-L227 HydrophobicContact SD-CD2 4.33Å
188	L	96.5	Very high	94.8	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-40.8	178.2	-72.4	163	0	0	0	112.9	Q184 M185 S192 L227 V230 L231	Q184-L188 WeakPolarHBondContact O-CB 3.33Å; Q184-L188 WeakPolarHBondContact O-CD1 3.41Å; Q184-L188 VanDerWaalsContact O-CG 3.22Å; Q184-L188 WeakPolarHBondContact O-CG 3.19Å; Q184-L188 PolarHBondContact O-N 3.45Å; M185-L188 HydrophobicContact CE-CD1 3.91Å; M185-L188 CarbonylContact O-C 3.37Å; M185-L188 WeakPolarHBondContact O-CA 3.23Å; M185-L188 WeakPolarHBondContact O-CB 3.48Å; M185-L188 PolarHBondContact O-N 2.63Å; M185-L188 HydrophobicContact SD-CB 4.39Å; M185-L188 HydrophobicContact SD-CD1 4.03Å; L188-S192 WeakPolarHBondContact O-CB 3.38Å; L188-S192 PolarHBondContact O-N 3Å; L188-S192 PolarHBondContact O-OG 3.02Å; L188-L227 HydrophobicContact CD1-CD1 4.25Å; L188-L227 HydrophobicContact CD2-CD1 3.89Å; L188-L227 HydrophobicContact CD2-CG 4.37Å; L188-L227 HydrophobicContact CG-CD1 3.69Å; L188-V230 HydrophobicContact CD1-CB 3.92Å; L188-V230 HydrophobicContact CD1-CG1 3.48Å; L188-V230 VanDerWaalsContact CD1-CG1 3.48Å; L188-V230 HydrophobicContact CD2-CB 3.97Å; L188-V230 HydrophobicContact CD2-CG1 4.02Å; L188-V230 HydrophobicContact CG-CG1 4.38Å; L188-L231 HydrophobicContact CD2-CB 3.82Å; L188-L231 HydrophobicContact CD2-CD1 4.39Å
189	D	96.5	Very high	94.4	Very high	41 Å²	41	46.5 Å²	46.5	22%	0.219	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-51	178	-68.7	-40.4	0	0	0	110.2	A146 M185 H186 S192 S193 R234	A146-D189 HydrophobicContact CB-CB 4.23Å; M185-D189 PolarHBondContact O-N 3.07Å; M185-D189 VanDerWaalsContact O-OD2 3.07Å; H186-D189 IonicContact ND1-OD2 3.63Å; D189-S192 PolarHBondContact O-N 2.76Å; D189-S193 PolarHBondContact O-N 2.7Å; D189-R234 IonicContact OD1-CZ 2.7Å; D189-R234 IonicContact OD1-NH1 3.44Å; D189-R234 PolarHBondContact OD1-NH1 3.29Å; D189-R234 IonicContact OD1-NH2 3.42Å; D189-R234 PolarHBondContact OD1-NH2 3.1Å
190	L	96.3	Very high	93.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-47.6	178.3	-179.4	59.2	0	0	0	112.4	L142 A146 Y151 L167 L171 H186 S193 I194	L142-L190 HydrophobicContact CD1-CD2 4.28Å; A146-L190 HydrophobicContact CB-CB 4.09Å; Y151-L190 HydrophobicContact CD2-CD1 3.8Å; Y151-L190 HydrophobicContact CD2-CD2 4.37Å; Y151-L190 HydrophobicContact CE2-CD2 4.48Å; Y151-L190 HydrophobicContact CG-CD1 4.23Å; L167-L190 HydrophobicContact CD1-CD2 4.36Å; L167-L190 HydrophobicContact CD2-CD2 4.17Å; L167-L190 HydrophobicContact CD2-CG 4.28Å; L171-L190 HydrophobicContact CD1-CD2 4.45Å; H186-L190 WeakPolarHBondContact O-CB 3.38Å; H186-L190 PolarHBondContact O-N 2.57Å; H186-L190 VanDerWaalsContact O-N 3.1Å; L190-S193 PolarHBondContact O-N 2.86Å; L190-I194 PolarHBondContact O-N 2.9Å
191	M	97.1	Very high	93.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-69.5	-32.9	179.3	-65.8	169.4	88.4	0	0	112.5	F168 L171 F172 M187 I195 L227 L231	F168-M191 HydrophobicContact CB-CE 4.23Å; F168-M191 HydrophobicContact CD1-CE 3.44Å; F168-M191 VanDerWaalsContact CD1-CE 3.44Å; F168-M191 HydrophobicContact CD2-CE 4.21Å; F168-M191 HydrophobicContact CD2-CG 4.3Å; F168-M191 HydrophobicContact CE1-CB 4.2Å; F168-M191 HydrophobicContact CE1-CE 3.73Å; F168-M191 HydrophobicContact CE1-CG 4.38Å; F168-M191 HydrophobicContact CE2-CB 4.08Å; F168-M191 HydrophobicContact CE2-CE 4.47Å; F168-M191 HydrophobicContact CE2-CG 3.94Å; F168-M191 HydrophobicContact CG-CE 3.7Å; F168-M191 HydrophobicContact CZ-CB 3.7Å; F168-M191 HydrophobicContact CZ-CE 4.24Å; F168-M191 HydrophobicContact CZ-CG 3.98Å; L171-M191 HydrophobicContact CB-CE 4.44Å; L171-M191 HydrophobicContact CB-SD 4.03Å; L171-M191 HydrophobicContact CD1-CG 3.58Å; L171-M191 HydrophobicContact CD1-SD 3.65Å; F172-M191 HydrophobicContact CD2-CE 4.01Å; F172-M191 HydrophobicContact CE1-CE 4.2Å; F172-M191 HydrophobicContact CE2-CE 3.46Å; F172-M191 VanDerWaalsContact CE2-CE 3.46Å; F172-M191 HydrophobicContact CZ-CE 3.57Å; M187-M191 WeakPolarHBondContact O-CB 3.34Å; M187-M191 WeakPolarHBondContact O-CG 3.32Å; M187-M191 PolarHBondContact O-N 3.26Å; M191-I195 WeakPolarHBondContact O-CG1 3.46Å; M191-I195 PolarHBondContact O-N 3.06Å; M191-L227 HydrophobicContact SD-CD2 4.31Å; M191-L231 HydrophobicContact CB-CD1 3.67Å; M191-L231 HydrophobicContact CB-CD2 4.03Å; M191-L231 HydrophobicContact CE-CD2 3.84Å; M191-L231 HydrophobicContact SD-CD2 4.42Å
192	S	96	Very high	93.6	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-70.7	-39.5	176.5	-57.9	0	0	0	0	111.4	L188 D189 I194 I195 M196 R234	L188-S192 WeakPolarHBondContact O-CB 3.38Å; L188-S192 PolarHBondContact O-N 3Å; L188-S192 PolarHBondContact O-OG 3.02Å; D189-S192 PolarHBondContact O-N 2.76Å; S192-I194 VanDerWaalsContact C-N 3.34Å; S192-I194 PolarHBondContact O-N 2.73Å; S192-I195 PolarHBondContact O-N 3.35Å; S192-M196 VanDerWaalsContact O-CB 3.28Å; S192-M196 WeakPolarHBondContact O-CB 3.3Å; S192-M196 VanDerWaalsContact O-CG 3.27Å; S192-M196 WeakPolarHBondContact O-CG 3.36Å; S192-M196 PolarHBondContact O-N 2.79Å; S192-R234 VanDerWaalsContact OG-CD 3.3Å; S192-R234 WeakPolarHBondContact OG-CD 3.47Å
193	S	95.3	Very high	93.5	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-53.9	-51.4	175.3	-165	0	0	0	0	110.9	K149 N152 D189 L190 I195 M196 E197	K149-S193 WeakPolarHBondContact CD-OG 3.44Å; K149-S193 WeakPolarHBondContact CG-OG 3.49Å; N152-S193 PolarHBondContact ND2-OG 3.17Å; N152-S193 PolarHBondContact OD1-OG 3.45Å; D189-S193 PolarHBondContact O-N 2.7Å; L190-S193 PolarHBondContact O-N 2.86Å; S193-I195 VanDerWaalsContact C-N 3.32Å; S193-I195 PolarHBondContact O-N 3.18Å; S193-M196 PolarHBondContact O-N 2.99Å; S193-E197 WeakPolarHBondContact O-CB 3.25Å; S193-E197 PolarHBondContact O-N 3.09Å; S193-E197 PolarHBondContact OG-OE2 3.29Å
194	I	95.6	Very high	93.5	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.036	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-38.1	-178.8	-66.1	163.2	0	0	0	112.3	Y151 F164 L167 F168 L190 S192	Y151-I194 HydrophobicContact CG-CD1 4.49Å; F164-I194 HydrophobicContact CB-CG2 4.23Å; F164-I194 HydrophobicContact CD1-CD1 3.87Å; F164-I194 HydrophobicContact CD1-CG1 4.15Å; F164-I194 HydrophobicContact CD1-CG2 3.7Å; F164-I194 HydrophobicContact CD2-CG2 3.96Å; F164-I194 HydrophobicContact CE1-CD1 4.14Å; F164-I194 HydrophobicContact CE1-CG1 4.03Å; F164-I194 HydrophobicContact CE1-CG2 3.96Å; F164-I194 HydrophobicContact CE2-CG2 4.21Å; F164-I194 HydrophobicContact CG-CG2 3.71Å; F164-I194 HydrophobicContact CZ-CG2 4.21Å; L167-I194 HydrophobicContact CD2-CD1 3.5Å; F168-I194 HydrophobicContact CE2-CB 4.3Å; F168-I194 HydrophobicContact CE2-CD1 4.03Å; F168-I194 HydrophobicContact CE2-CG2 4.18Å; F168-I194 HydrophobicContact CZ-CG2 4.49Å; L190-I194 PolarHBondContact O-N 2.9Å; S192-I194 VanDerWaalsContact C-N 3.34Å; S192-I194 PolarHBondContact O-N 2.73Å
195	I	95.3	Very high	93.5	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-77.9	-35.2	178.5	-65.6	163.6	0	0	0	112.4	F168 M191 S192 S193 V201 I209 L231 T235 T238 I239	F168-I195 HydrophobicContact CE1-CD1 3.95Å; F168-I195 HydrophobicContact CE1-CG1 4.36Å; F168-I195 HydrophobicContact CZ-CD1 4.05Å; F168-I195 HydrophobicContact CZ-CG1 4.09Å; M191-I195 WeakPolarHBondContact O-CG1 3.46Å; M191-I195 PolarHBondContact O-N 3.06Å; S192-I195 PolarHBondContact O-N 3.35Å; S193-I195 VanDerWaalsContact C-N 3.32Å; S193-I195 PolarHBondContact O-N 3.18Å; I195-V201 HydrophobicContact CG1-CG2 4.41Å; I195-V201 HydrophobicContact CG2-CG2 4.13Å; I195-I209 HydrophobicContact CD1-CD1 3.93Å; I195-L231 HydrophobicContact CD1-CD1 4.04Å; I195-L231 HydrophobicContact CD1-CD2 4Å; I195-L231 HydrophobicContact CD1-CG 4.01Å; I195-T235 HydrophobicContact CB-CG2 3.94Å; I195-T235 HydrophobicContact CD1-CG2 4.03Å; I195-T235 HydrophobicContact CG2-CG2 3.89Å; I195-T238 WeakPolarHBondContact O-CG2 3.22Å; I195-I239 HydrophobicContact CD1-CD1 4.21Å; I195-I239 HydrophobicContact CG2-CB 4.34Å; I195-I239 HydrophobicContact CG2-CD1 4.38Å
196	M	93.9	Very high	93.5	Very high	94 Å²	94	35.7 Å²	35.7	46%	0.463	20%	0.2	S	C	.	.	H	α-helix	trans	-89.1	-22.7	-171.4	-69	178.6	64.2	0	0	113.9	S192 S193 T235	S192-M196 VanDerWaalsContact O-CB 3.28Å; S192-M196 WeakPolarHBondContact O-CB 3.3Å; S192-M196 VanDerWaalsContact O-CG 3.27Å; S192-M196 WeakPolarHBondContact O-CG 3.36Å; S192-M196 PolarHBondContact O-N 2.79Å; S193-M196 PolarHBondContact O-N 2.99Å; M196-T235 HydrophobicContact CG-CG2 4.01Å; M196-T235 HydrophobicContact SD-CG2 4.28Å
197	E	92.1	Very high	93.4	Very high	89 Å²	89	35.4 Å²	35.4	42%	0.416	20%	0.2	S	C	.	.	H	α-helix	trans	-118.1	0.8	-171.1	-67.8	159.6	-144.7	0	0	113.6	K149 N152 F155 S193	K149-E197 IonicContact NZ-OE1 3.72Å; K149-E197 PolarHBondContact NZ-OE1 3.18Å; K149-E197 IonicContact NZ-OE2 3.99Å; K149-E197 PolarHBondContact NZ-OE2 3.2Å; N152-E197 PolarHBondContact ND2-OE2 2.87Å; F155-E197 HydrophobicContact CE2-CB 4.19Å; F155-E197 WeakPolarHBondContact CE2-O 3.47Å; F155-E197 HydrophobicContact CZ-CB 4.47Å; S193-E197 WeakPolarHBondContact O-CB 3.25Å; S193-E197 PolarHBondContact O-N 3.09Å; S193-E197 PolarHBondContact OG-OE2 3.29Å
198	G	87.8	Confident	93.3	Very high	17 Å²	17	35.9 Å²	35.9	18%	0.175	20%	0.203	C	C	.	.	S	Bend	trans	-101.4	156.5	174.1	0	0	0	0	0	113.5	F155 G200	F155-G198 VanDerWaalsContact CE1-CA 3.45Å; F155-G198 VanDerWaalsContact CZ-CA 3.43Å; G198-G200 PolarHBondContact O-N 3.04Å; G198-G200 VanDerWaalsContact O-N 3.12Å
199	D	83	Confident	93.3	Very high	177 Å²	177	35.7 Å²	35.7	95%	0.947	20%	0.202	S	C	*	.	S	Bend	trans	-64.2	-15.8	-174.4	-67.3	-49.1	0	0	0	115.3
200	G	81.5	Confident	93.3	Very high	54 Å²	54	33.7 Å²	33.7	56%	0.557	19%	0.191	S	C	*	.			trans	174.7	164.8	175.5	0	0	0	0	0	114.5	G198	G198-G200 PolarHBondContact O-N 3.04Å; G198-G200 VanDerWaalsContact O-N 3.12Å
201	V	90.8	Very high	93.3	Very high	22 Å²	22	36.6 Å²	36.6	13%	0.133	21%	0.206	C	C	.	.			trans	-108.3	119.4	176.8	-177.6	0	0	0	0	109.2	I195 L205 L206 C242	I195-V201 HydrophobicContact CG1-CG2 4.41Å; I195-V201 HydrophobicContact CG2-CG2 4.13Å; V201-L205 HydrophobicContact CG1-CB 4.06Å; V201-L205 HydrophobicContact CG1-CD2 4.12Å; V201-L205 HydrophobicContact CG1-CG 4.03Å; V201-L206 HydrophobicContact CG1-CB 4.08Å; V201-C242 HydrophobicContact CB-CB 4.49Å
202	T	92.5	Very high	93.3	Very high	55 Å²	55	37.3 Å²	37.3	34%	0.337	21%	0.21	S	C	.	.			trans	-72	157.3	174.8	47.9	0	0	0	0	112.3	N161 E204 L205 L206	N161-T202 WeakPolarHBondContact OD1-CB 3.42Å; N161-T202 WeakPolarHBondContact OD1-CG2 3.45Å; N161-T202 PolarHBondContact OD1-OG1 3.27Å; T202-E204 PolarHBondContact O-N 2.72Å; T202-L205 PolarHBondContact O-N 3.22Å; T202-L205 VanDerWaalsContact O-N 3.09Å; T202-L206 PolarHBondContact O-N 2.69Å
203	Q	93.8	Very high	93.3	Very high	41 Å²	41	37.2 Å²	37.2	19%	0.192	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-41.9	-177.2	-171.4	67.2	57.3	0	0	112.4	L205 L206 D207 F246 V258	Q203-L205 VanDerWaalsContact C-N 3.3Å; Q203-L205 PolarHBondContact O-N 3.39Å; Q203-L206 PolarHBondContact O-N 2.96Å; Q203-D207 PolarHBondContact NE2-OD1 2.99Å; Q203-D207 WeakPolarHBondContact O-CB 3.5Å; Q203-D207 PolarHBondContact O-N 2.9Å; Q203-F246 VanDerWaalsContact NE2-CD2 3.3Å; Q203-V258 HydrophobicContact CG-CG1 4.09Å; Q203-V258 WeakPolarHBondContact CG-O 3.28Å
204	E	93.6	Very high	93.2	Very high	106 Å²	106	37.2 Å²	37.2	50%	0.495	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-34.9	175.3	-85.2	-157.5	-133.7	0	0	113.2	I165 R169 T202 S208	I165-E204 HydrophobicContact CD1-CB 3.58Å; I165-E204 HydrophobicContact CG1-CB 4.25Å; R169-E204 IonicContact CZ-OE2 3.65Å; R169-E204 IonicContact NH1-OE2 3.05Å; R169-E204 PolarHBondContact NH1-OE2 2.92Å; R169-E204 IonicContact NH2-OE2 2.61Å; R169-E204 PolarHBondContact NH2-OE2 3.33Å; T202-E204 PolarHBondContact O-N 2.72Å; E204-S208 PolarHBondContact O-N 3.21Å
205	L	94.8	Very high	92.8	Very high	3 Å²	3	39 Å²	39	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-70.9	-42	176.5	-175.4	58.3	0	0	0	110.7	F164 I165 F168 V201 T202 Q203 S208	F164-L205 HydrophobicContact CB-CD1 4.13Å; F164-L205 HydrophobicContact CB-CD2 4Å; I165-L205 HydrophobicContact CG1-CB 3.86Å; I165-L205 HydrophobicContact CG1-CD1 4.14Å; F168-L205 HydrophobicContact CB-CD1 4.01Å; F168-L205 HydrophobicContact CD1-CD1 3.75Å; F168-L205 HydrophobicContact CD2-CD1 3.88Å; F168-L205 HydrophobicContact CE1-CD1 4.16Å; F168-L205 HydrophobicContact CE2-CD1 4.27Å; F168-L205 HydrophobicContact CG-CD1 3.6Å; F168-L205 HydrophobicContact CZ-CD1 4.4Å; V201-L205 HydrophobicContact CG1-CB 4.06Å; V201-L205 HydrophobicContact CG1-CD2 4.12Å; V201-L205 HydrophobicContact CG1-CG 4.03Å; T202-L205 PolarHBondContact O-N 3.22Å; T202-L205 VanDerWaalsContact O-N 3.09Å; Q203-L205 VanDerWaalsContact C-N 3.3Å; Q203-L205 PolarHBondContact O-N 3.39Å; L205-S208 WeakPolarHBondContact O-CB 3.41Å; L205-S208 PolarHBondContact O-N 2.97Å; L205-S208 PolarHBondContact O-OG 3.4Å
206	L	95.7	Very high	92.5	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-44.9	172.9	-179.5	60.4	0	0	0	111.6	V201 T202 Q203 S208 I209 L210 I239 C242 I243 F246	V201-L206 HydrophobicContact CG1-CB 4.08Å; T202-L206 PolarHBondContact O-N 2.69Å; Q203-L206 PolarHBondContact O-N 2.96Å; L206-S208 VanDerWaalsContact C-N 3.29Å; L206-S208 PolarHBondContact O-N 3.34Å; L206-I209 WeakPolarHBondContact O-CA 3.43Å; L206-I209 WeakPolarHBondContact O-CB 3.36Å; L206-I209 PolarHBondContact O-N 3.07Å; L206-L210 HydrophobicContact CD1-CD1 3.97Å; L206-L210 HydrophobicContact CD1-CD2 4.48Å; L206-L210 HydrophobicContact CD1-CG 3.96Å; L206-L210 HydrophobicContact CD2-CD1 4.18Å; L206-L210 HydrophobicContact CG-CD1 3.76Å; L206-L210 HydrophobicContact CG-CG 4.1Å; L206-L210 PolarHBondContact O-N 3.2Å; L206-I239 HydrophobicContact CD1-CD1 3.98Å; L206-I239 HydrophobicContact CD1-CG1 4.02Å; L206-C242 HydrophobicContact CD2-CB 4.25Å; L206-I243 HydrophobicContact CD1-CG1 3.92Å; L206-I243 HydrophobicContact CD2-CG1 4.41Å; L206-F246 HydrophobicContact CD2-CB 4.1Å
207	D	96	Very high	92.3	Very high	25 Å²	25	41.7 Å²	41.7	13%	0.134	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-36.5	178.8	-73	-0.3	0	0	0	111.6	Q203 I209 L210 I211 S259 L261	Q203-D207 PolarHBondContact NE2-OD1 2.99Å; Q203-D207 WeakPolarHBondContact O-CB 3.5Å; Q203-D207 PolarHBondContact O-N 2.9Å; D207-I209 PolarHBondContact O-N 2.96Å; D207-I209 VanDerWaalsContact O-N 3.14Å; D207-L210 PolarHBondContact O-N 2.96Å; D207-I211 VanDerWaalsContact O-CB 3.31Å; D207-I211 WeakPolarHBondContact O-CB 3.28Å; D207-I211 VanDerWaalsContact O-CG2 3.28Å; D207-I211 WeakPolarHBondContact O-CG2 3.43Å; D207-I211 PolarHBondContact O-N 3.22Å; D207-S259 PolarHBondContact OD1-OG 2.9Å; D207-S259 VanDerWaalsContact OD2-CB 3.26Å; D207-S259 WeakPolarHBondContact OD2-CB 3.47Å; D207-S259 PolarHBondContact OD2-OG 3.47Å; D207-L261 HydrophobicContact CB-CD1 3.8Å; D207-L261 HydrophobicContact CB-CG 4.3Å
208	S	95.2	Very high	92.2	Very high	9 Å²	9	40 Å²	40	6%	0.063	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-22.8	173.5	85.1	0	0	0	0	113.6	F168 F172 E204 L205 L206 N212	F168-S208 WeakPolarHBondContact CB-OG 3.17Å; F172-S208 WeakPolarHBondContact CD2-O 3.38Å; F172-S208 VanDerWaalsContact CE2-O 3.23Å; F172-S208 WeakPolarHBondContact CE2-O 3.44Å; E204-S208 PolarHBondContact O-N 3.21Å; L205-S208 WeakPolarHBondContact O-CB 3.41Å; L205-S208 PolarHBondContact O-N 2.97Å; L205-S208 PolarHBondContact O-OG 3.4Å; L206-S208 VanDerWaalsContact C-N 3.29Å; L206-S208 PolarHBondContact O-N 3.34Å; S208-N212 PolarHBondContact O-ND2 3.32Å
209	I	96.9	Very high	92.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-89	-53.2	172.7	-53.5	163.3	0	0	0	110.1	F168 F172 I195 L206 D207 I211 N212 A228 L231 L232 I239	F168-I209 HydrophobicContact CD1-CD1 4.2Å; F168-I209 HydrophobicContact CD1-CG1 3.79Å; F168-I209 HydrophobicContact CE1-CD1 3.85Å; F168-I209 HydrophobicContact CE1-CG1 3.92Å; F172-I209 HydrophobicContact CE2-CB 4.33Å; F172-I209 HydrophobicContact CE2-CG1 4.09Å; F172-I209 HydrophobicContact CZ-CB 4.43Å; F172-I209 HydrophobicContact CZ-CG1 4.39Å; F172-I209 HydrophobicContact CZ-CG2 4.24Å; I195-I209 HydrophobicContact CD1-CD1 3.93Å; L206-I209 WeakPolarHBondContact O-CA 3.43Å; L206-I209 WeakPolarHBondContact O-CB 3.36Å; L206-I209 PolarHBondContact O-N 3.07Å; D207-I209 PolarHBondContact O-N 2.96Å; D207-I209 VanDerWaalsContact O-N 3.14Å; I209-I211 VanDerWaalsContact C-N 3.35Å; I209-I211 PolarHBondContact O-N 3.47Å; I209-N212 WeakPolarHBondContact O-CB 3.37Å; I209-N212 PolarHBondContact O-N 3.03Å; I209-N212 PolarHBondContact O-ND2 3.09Å; I209-A228 HydrophobicContact CG2-CB 4.25Å; I209-L231 HydrophobicContact CD1-CD2 4.33Å; I209-L231 HydrophobicContact CG1-CD2 4.3Å; I209-L231 HydrophobicContact CG2-CD2 4.39Å; I209-L232 HydrophobicContact CG2-CD1 4.21Å; I209-L232 HydrophobicContact CG2-CD2 4.1Å; I209-L232 HydrophobicContact CG2-CG 3.96Å; I209-I239 HydrophobicContact CD1-CD1 3.79Å
210	L	96.7	Very high	92.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.3	-29.6	-171.5	-67.4	-176	0	0	0	113.6	L206 D207 N212 L213 L232 F246 L261 L268 L272	L206-L210 HydrophobicContact CD1-CD1 3.97Å; L206-L210 HydrophobicContact CD1-CD2 4.48Å; L206-L210 HydrophobicContact CD1-CG 3.96Å; L206-L210 HydrophobicContact CD2-CD1 4.18Å; L206-L210 HydrophobicContact CG-CD1 3.76Å; L206-L210 HydrophobicContact CG-CG 4.1Å; L206-L210 PolarHBondContact O-N 3.2Å; D207-L210 PolarHBondContact O-N 2.96Å; L210-N212 PolarHBondContact O-N 2.96Å; L210-N212 VanDerWaalsContact O-N 3.11Å; L210-L213 HydrophobicContact CD2-CD2 4.31Å; L210-L213 WeakPolarHBondContact O-CB 3.4Å; L210-L213 PolarHBondContact O-N 3.04Å; L210-L232 HydrophobicContact CD2-CD1 4.48Å; L210-L232 HydrophobicContact CD2-CD2 4.42Å; L210-F246 HydrophobicContact CD1-CD1 4.19Å; L210-F246 HydrophobicContact CD1-CE1 4.27Å; L210-L261 HydrophobicContact CB-CD1 3.7Å; L210-L268 HydrophobicContact CB-CD2 4.3Å; L210-L268 WeakPolarHBondContact O-CD2 3.4Å; L210-L272 HydrophobicContact CD2-CD1 4.49Å; L210-L272 HydrophobicContact CD2-CD2 4.15Å
211	I	96	Very high	92.7	Very high	60 Å²	60	44.5 Å²	44.5	31%	0.308	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-55.5	-32	177.7	-166.9	167.8	0	0	0	112.6	D207 I209 L213 I214 H217 L261	D207-I211 VanDerWaalsContact O-CB 3.31Å; D207-I211 WeakPolarHBondContact O-CB 3.28Å; D207-I211 VanDerWaalsContact O-CG2 3.28Å; D207-I211 WeakPolarHBondContact O-CG2 3.43Å; D207-I211 PolarHBondContact O-N 3.22Å; I209-I211 VanDerWaalsContact C-N 3.35Å; I209-I211 PolarHBondContact O-N 3.47Å; I211-L213 PolarHBondContact O-N 3.3Å; I211-I214 HydrophobicContact CG1-CD1 4.43Å; I211-I214 PolarHBondContact O-N 2.93Å; I211-H217 VanDerWaalsContact CG1-CE1 3.47Å; I211-H217 WeakPolarHBondContact CG1-CE1 3.19Å; I211-H217 WeakPolarHBondContact O-CB 3.19Å; I211-H217 PolarHBondContact O-ND1 3.27Å; I211-L261 HydrophobicContact CB-CD1 4.41Å; I211-L261 HydrophobicContact CB-CD2 4.03Å; I211-L261 HydrophobicContact CD1-CD2 4.35Å; I211-L261 HydrophobicContact CG1-CD2 4.04Å
212	N	96.2	Very high	92.9	Very high	15 Å²	15	49.7 Å²	49.7	8%	0.08	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-69.4	-16.6	179.3	-55.2	-81.3	0	0	0	113.7	S208 I209 L210 S224 A228	S208-N212 PolarHBondContact O-ND2 3.32Å; I209-N212 WeakPolarHBondContact O-CB 3.37Å; I209-N212 PolarHBondContact O-N 3.03Å; I209-N212 PolarHBondContact O-ND2 3.09Å; L210-N212 PolarHBondContact O-N 2.96Å; L210-N212 VanDerWaalsContact O-N 3.11Å; N212-S224 VanDerWaalsContact OD1-CB 3.24Å; N212-S224 WeakPolarHBondContact OD1-CB 3.38Å; N212-A228 HydrophobicContact CB-CB 3.93Å
213	L	95.9	Very high	93	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-84.5	-24.7	178.9	-79.7	59.6	0	0	0	112.2	L210 I211 F225 A228 L232 L268 E271 L272 I275	L210-L213 HydrophobicContact CD2-CD2 4.31Å; L210-L213 WeakPolarHBondContact O-CB 3.4Å; L210-L213 PolarHBondContact O-N 3.04Å; I211-L213 PolarHBondContact O-N 3.3Å; L213-F225 HydrophobicContact CG-CE2 4.47Å; L213-A228 HydrophobicContact CD1-CB 3.79Å; L213-L232 HydrophobicContact CD1-CD1 3.87Å; L213-L232 HydrophobicContact CD2-CD1 3.8Å; L213-L232 HydrophobicContact CG-CD1 4.46Å; L213-L268 HydrophobicContact CB-CD2 3.88Å; L213-E271 HydrophobicContact CB-CB 4.26Å; L213-E271 HydrophobicContact CD2-CB 4.3Å; L213-E271 HydrophobicContact CG-CB 4.42Å; L213-L272 HydrophobicContact CD2-CD2 3.75Å; L213-L272 HydrophobicContact CD2-CG 3.96Å; L213-I275 HydrophobicContact CD2-CD1 3.67Å; L213-I275 HydrophobicContact CG-CD1 4.09Å
214	I	93.5	Very high	93	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	25%	0.249	C	C	.	.	S	Bend	trans	-59.7	134.6	-177.3	-66.4	169.2	0	0	0	109.9	I211 A216 H217 K218 L261 H264 L268	I211-I214 HydrophobicContact CG1-CD1 4.43Å; I211-I214 PolarHBondContact O-N 2.93Å; I214-A216 HydrophobicContact CG2-CB 4.34Å; I214-A216 PolarHBondContact O-N 3.43Å; I214-H217 PolarHBondContact O-N 2.61Å; I214-K218 WeakPolarHBondContact O-CB 3.48Å; I214-K218 PolarHBondContact O-N 2.74Å; I214-L261 HydrophobicContact CD1-CD2 3.73Å; I214-H264 HydrophobicContact CD1-CB 4.05Å; I214-H264 VanDerWaalsContact CD1-CD2 3.47Å; I214-H264 WeakPolarHBondContact CD1-CD2 3.48Å; I214-H264 HydrophobicContact CG1-CB 4.03Å; I214-L268 HydrophobicContact CG1-CD2 4.02Å
215	P	87.5	Confident	93.1	Very high	46 Å²	46	43 Å²	43	30%	0.299	23%	0.228	S	C	.	.	H	α-helix	trans	-50.2	-36.5	-175.5	-31.6	36.1	0	0	0	115.2	N219 D267	P215-N219 WeakPolarHBondContact O-CB 3.49Å; P215-N219 PolarHBondContact O-N 3.06Å; P215-N219 PolarHBondContact O-ND2 3.02Å; P215-D267 HydrophobicContact CG-CB 4.36Å
216	A	89.7	Confident	93.1	Very high	69 Å²	69	45.4 Å²	45.4	57%	0.57	24%	0.241	S	C	*	.	H	α-helix	trans	-61.9	-50.5	176	0	0	0	0	0	112.7	I214 L220	I214-A216 HydrophobicContact CG2-CB 4.34Å; I214-A216 PolarHBondContact O-N 3.43Å; A216-L220 PolarHBondContact O-N 3.02Å
217	H	90.3	Very high	93.2	Very high	81 Å²	81	45.6 Å²	45.6	38%	0.375	24%	0.242	S	C	.	.	H	α-helix	trans	-71.2	-40.9	179.3	-68.6	105.3	0	0	0	112.2	I211 I214 N219 L220 N221	I211-H217 VanDerWaalsContact CG1-CE1 3.47Å; I211-H217 WeakPolarHBondContact CG1-CE1 3.19Å; I211-H217 WeakPolarHBondContact O-CB 3.19Å; I211-H217 PolarHBondContact O-ND1 3.27Å; I214-H217 PolarHBondContact O-N 2.61Å; H217-N219 VanDerWaalsContact C-N 3.27Å; H217-N219 PolarHBondContact O-N 2.84Å; H217-L220 PolarHBondContact O-N 3.48Å; H217-N221 PolarHBondContact O-N 2.91Å
218	K	89.2	Confident	93.2	Very high	53 Å²	53	44.4 Å²	44.4	23%	0.23	24%	0.236	C	C	.	.	H	α-helix	trans	-56.8	-37.8	175.2	176.6	175.8	179.6	173.8	0	112.9	I214 F225 E271	I214-K218 WeakPolarHBondContact O-CB 3.48Å; I214-K218 PolarHBondContact O-N 2.74Å; K218-F225 HydrophobicContact CB-CB 4.45Å; K218-F225 HydrophobicContact CB-CD2 4.11Å; K218-F225 HydrophobicContact CB-CG 4.39Å; K218-F225 HydrophobicContact CD-CD2 3.66Å; K218-F225 HydrophobicContact CD-CE1 4.48Å; K218-F225 HydrophobicContact CD-CE2 3.57Å; K218-F225 HydrophobicContact CD-CG 4.17Å; K218-F225 HydrophobicContact CD-CZ 4.01Å; K218-F225 VanDerWaalsContact CE-CZ 3.5Å; K218-F225 HydrophobicContact CG-CB 4.22Å; K218-F225 HydrophobicContact CG-CD1 4.31Å; K218-F225 HydrophobicContact CG-CD2 3.69Å; K218-F225 HydrophobicContact CG-CE2 4.13Å; K218-F225 HydrophobicContact CG-CG 3.8Å; K218-E271 IonicContact NZ-OE1 3.06Å; K218-E271 PolarHBondContact NZ-OE1 3.38Å; K218-E271 IonicContact NZ-OE2 3.23Å; K218-E271 PolarHBondContact NZ-OE2 2.9Å
219	N	86.9	Confident	93.3	Very high	140 Å²	140	47.1 Å²	47.1	75%	0.749	25%	0.246	S	C	*	.	H	α-helix	trans	-76.2	-26.8	174.9	-73.2	-28.6	0	0	0	113.1	P215 H217	P215-N219 WeakPolarHBondContact O-CB 3.49Å; P215-N219 PolarHBondContact O-N 3.06Å; P215-N219 PolarHBondContact O-ND2 3.02Å; H217-N219 VanDerWaalsContact C-N 3.27Å; H217-N219 PolarHBondContact O-N 2.84Å
220	L	88.1	Confident	93.3	Very high	152 Å²	152	50.3 Å²	50.3	80%	0.796	27%	0.266	S	S	*	.	H	α-helix	trans	-82.2	-51.1	-179.2	-166.4	75.8	0	0	0	112.5	A216 H217	A216-L220 PolarHBondContact O-N 3.02Å; H217-L220 PolarHBondContact O-N 3.48Å
221	N	88.4	Confident	93.3	Very high	52 Å²	52	50.3 Å²	50.3	28%	0.278	27%	0.266	S	S	.	.			trans	-130.8	91.4	172.6	-168.4	-7.9	0	0	0	111.8	I175 H217 Q223 S224 F225	I175-N221 PolarHBondContact O-ND2 3.41Å; H217-N221 PolarHBondContact O-N 2.91Å; N221-Q223 PolarHBondContact O-N 3.42Å; N221-Q223 VanDerWaalsContact O-N 3.16Å; N221-Q223 WeakPolarHBondContact OD1-CB 3.42Å; N221-Q223 PolarHBondContact OD1-N 2.98Å; N221-S224 VanDerWaalsContact CG-OG 3.24Å; N221-S224 PolarHBondContact ND2-OG 3.29Å; N221-S224 PolarHBondContact O-N 3.46Å; N221-S224 PolarHBondContact OD1-N 3.16Å; N221-F225 PolarHBondContact O-N 3.1Å
222	K	93.3	Very high	93.4	Very high	131 Å²	131	47.5 Å²	47.5	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-57.3	-26.9	173.6	177.9	170.4	177.4	177.6	0	113.4	F225 D226	K222-F225 WeakPolarHBondContact O-CB 3.42Å; K222-F225 PolarHBondContact O-N 2.95Å; K222-D226 VanDerWaalsContact CE-OD2 3.29Å; K222-D226 WeakPolarHBondContact CE-OD2 3.33Å; K222-D226 WeakPolarHBondContact O-CB 3.25Å; K222-D226 VanDerWaalsContact O-CG 3.26Å; K222-D226 PolarHBondContact O-N 2.73Å
223	Q	94.4	Very high	93.3	Very high	40 Å²	40	51.6 Å²	51.6	19%	0.187	27%	0.269	C	S	.	.	H	α-helix	trans	-76.4	-31.7	-178.2	-57.7	-61.9	-98.6	0	0	112.6	I175 N177 N221 D226 L227	I175-Q223 HydrophobicContact CG1-CB 4.13Å; N177-Q223 HydrophobicContact CB-CG 4.38Å; N221-Q223 PolarHBondContact O-N 3.42Å; N221-Q223 VanDerWaalsContact O-N 3.16Å; N221-Q223 WeakPolarHBondContact OD1-CB 3.42Å; N221-Q223 PolarHBondContact OD1-N 2.98Å; Q223-D226 PolarHBondContact NE2-OD2 3.11Å; Q223-L227 VanDerWaalsContact O-CB 3.28Å; Q223-L227 WeakPolarHBondContact O-CB 3.49Å; Q223-L227 PolarHBondContact O-N 2.94Å
224	S	95.8	Very high	93.3	Very high	7 Å²	7	56.8 Å²	56.8	5%	0.049	29%	0.288	C	S	.	.	H	α-helix	trans	-67.7	-38.7	169.3	-42.3	0	0	0	0	111.1	F172 N212 N221 L227 A228	F172-S224 PolarHBondContact O-OG 3.09Å; N212-S224 VanDerWaalsContact OD1-CB 3.24Å; N212-S224 WeakPolarHBondContact OD1-CB 3.38Å; N221-S224 VanDerWaalsContact CG-OG 3.24Å; N221-S224 PolarHBondContact ND2-OG 3.29Å; N221-S224 PolarHBondContact O-N 3.46Å; N221-S224 PolarHBondContact OD1-N 3.16Å; S224-L227 PolarHBondContact O-N 3Å; S224-A228 WeakPolarHBondContact O-CB 3.24Å; S224-A228 PolarHBondContact O-N 2.96Å
225	F	95.7	Very high	93.4	Very high	13 Å²	13	56.7 Å²	56.7	6%	0.057	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-51.2	170.5	171.1	-94.2	0	0	0	112.6	L213 K218 N221 K222 L227 A228 K229 E271	L213-F225 HydrophobicContact CG-CE2 4.47Å; K218-F225 HydrophobicContact CB-CB 4.45Å; K218-F225 HydrophobicContact CB-CD2 4.11Å; K218-F225 HydrophobicContact CB-CG 4.39Å; K218-F225 HydrophobicContact CD-CD2 3.66Å; K218-F225 HydrophobicContact CD-CE1 4.48Å; K218-F225 HydrophobicContact CD-CE2 3.57Å; K218-F225 HydrophobicContact CD-CG 4.17Å; K218-F225 HydrophobicContact CD-CZ 4.01Å; K218-F225 VanDerWaalsContact CE-CZ 3.5Å; K218-F225 HydrophobicContact CG-CB 4.22Å; K218-F225 HydrophobicContact CG-CD1 4.31Å; K218-F225 HydrophobicContact CG-CD2 3.69Å; K218-F225 HydrophobicContact CG-CE2 4.13Å; K218-F225 HydrophobicContact CG-CG 3.8Å; N221-F225 PolarHBondContact O-N 3.1Å; K222-F225 WeakPolarHBondContact O-CB 3.42Å; K222-F225 PolarHBondContact O-N 2.95Å; F225-L227 VanDerWaalsContact C-N 3.27Å; F225-L227 PolarHBondContact O-N 2.78Å; F225-A228 PolarHBondContact O-N 3.5Å; F225-K229 HydrophobicContact CE1-CD 4.32Å; F225-K229 HydrophobicContact CZ-CD 4.37Å; F225-K229 VanDerWaalsContact O-CB 3.31Å; F225-K229 WeakPolarHBondContact O-CB 3.41Å; F225-K229 PolarHBondContact O-N 3.38Å; F225-E271 WeakPolarHBondContact CE2-OE2 3.28Å; F225-E271 WeakPolarHBondContact CZ-OE2 3.44Å
226	D	94.8	Very high	93.7	Very high	55 Å²	55	55.9 Å²	55.9	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-61.9	-36.4	-179.8	-72.1	-27.1	0	0	0	110.7	K222 Q223 V230	K222-D226 VanDerWaalsContact CE-OD2 3.29Å; K222-D226 WeakPolarHBondContact CE-OD2 3.33Å; K222-D226 WeakPolarHBondContact O-CB 3.25Å; K222-D226 VanDerWaalsContact O-CG 3.26Å; K222-D226 PolarHBondContact O-N 2.73Å; Q223-D226 PolarHBondContact NE2-OD2 3.11Å; D226-V230 WeakPolarHBondContact O-CG2 3.3Å; D226-V230 PolarHBondContact O-N 3.27Å
227	L	96.6	Very high	93.8	Very high	6 Å²	6	61.7 Å²	61.7	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-50.8	173.7	-169.4	73.1	0	0	0	111.8	F172 I175 M187 L188 M191 Q223 S224 F225 K229 V230 L231	F172-L227 HydrophobicContact CD1-CD2 3.93Å; F172-L227 HydrophobicContact CE1-CB 4.24Å; F172-L227 HydrophobicContact CE1-CD2 3.95Å; F172-L227 HydrophobicContact CE1-CG 4.2Å; I175-L227 HydrophobicContact CB-CD2 4.35Å; I175-L227 HydrophobicContact CG1-CD2 4.45Å; I175-L227 HydrophobicContact CG2-CD2 4.02Å; M187-L227 HydrophobicContact CB-CD1 4.26Å; M187-L227 HydrophobicContact SD-CD2 4.33Å; L188-L227 HydrophobicContact CD1-CD1 4.25Å; L188-L227 HydrophobicContact CD2-CD1 3.89Å; L188-L227 HydrophobicContact CD2-CG 4.37Å; L188-L227 HydrophobicContact CG-CD1 3.69Å; M191-L227 HydrophobicContact SD-CD2 4.31Å; Q223-L227 VanDerWaalsContact O-CB 3.28Å; Q223-L227 WeakPolarHBondContact O-CB 3.49Å; Q223-L227 PolarHBondContact O-N 2.94Å; S224-L227 PolarHBondContact O-N 3Å; F225-L227 VanDerWaalsContact C-N 3.27Å; F225-L227 PolarHBondContact O-N 2.78Å; L227-K229 VanDerWaalsContact C-N 3.29Å; L227-K229 PolarHBondContact O-N 2.92Å; L227-V230 PolarHBondContact O-N 2.87Å; L227-L231 PolarHBondContact O-N 3.14Å
228	A	97.2	Very high	93.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-39.3	179.1	0	0	0	0	0	111.7	F172 I209 N212 L213 S224 F225 V230 L231 L232	F172-A228 HydrophobicContact CE1-CB 3.72Å; F172-A228 HydrophobicContact CZ-CB 3.96Å; I209-A228 HydrophobicContact CG2-CB 4.25Å; N212-A228 HydrophobicContact CB-CB 3.93Å; L213-A228 HydrophobicContact CD1-CB 3.79Å; S224-A228 WeakPolarHBondContact O-CB 3.24Å; S224-A228 PolarHBondContact O-N 2.96Å; F225-A228 PolarHBondContact O-N 3.5Å; A228-V230 PolarHBondContact O-N 3.33Å; A228-L231 PolarHBondContact O-N 2.92Å; A228-L232 WeakPolarHBondContact O-CB 3.44Å; A228-L232 WeakPolarHBondContact O-CD1 3.49Å; A228-L232 WeakPolarHBondContact O-CG 3.26Å; A228-L232 PolarHBondContact O-N 3.45Å
229	K	96.2	Very high	94.1	Very high	65 Å²	65	57.9 Å²	57.9	28%	0.283	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-44.6	174.8	168.8	154.8	-167.9	146.9	0	112.8	F225 L227 K233 A274 I275	F225-K229 HydrophobicContact CE1-CD 4.32Å; F225-K229 HydrophobicContact CZ-CD 4.37Å; F225-K229 VanDerWaalsContact O-CB 3.31Å; F225-K229 WeakPolarHBondContact O-CB 3.41Å; F225-K229 PolarHBondContact O-N 3.38Å; L227-K229 VanDerWaalsContact C-N 3.29Å; L227-K229 PolarHBondContact O-N 2.92Å; K229-K233 WeakPolarHBondContact O-CB 3.24Å; K229-K233 PolarHBondContact O-N 2.94Å; K229-A274 PolarHBondContact NZ-O 3.3Å; K229-I275 HydrophobicContact CB-CD1 4.27Å; K229-I275 HydrophobicContact CB-CG1 4.25Å; K229-I275 HydrophobicContact CD-CG1 3.9Å; K229-I275 HydrophobicContact CG-CD1 4.45Å; K229-I275 HydrophobicContact CG-CG1 3.88Å; K229-I275 HydrophobicContact CG-CG2 4.17Å; K229-I275 WeakPolarHBondContact O-CG2 3.4Å
230	V	96.5	Very high	94.5	Very high	68 Å²	68	52.6 Å²	52.6	41%	0.412	26%	0.255	S	S	.	.	H	α-helix	trans	-73.6	-35.9	178.7	-179.5	0	0	0	0	111.1	L188 D226 L227 A228 K233 R234	L188-V230 HydrophobicContact CD1-CB 3.92Å; L188-V230 HydrophobicContact CD1-CG1 3.48Å; L188-V230 VanDerWaalsContact CD1-CG1 3.48Å; L188-V230 HydrophobicContact CD2-CB 3.97Å; L188-V230 HydrophobicContact CD2-CG1 4.02Å; L188-V230 HydrophobicContact CG-CG1 4.38Å; D226-V230 WeakPolarHBondContact O-CG2 3.3Å; D226-V230 PolarHBondContact O-N 3.27Å; L227-V230 PolarHBondContact O-N 2.87Å; A228-V230 PolarHBondContact O-N 3.33Å; V230-K233 PolarHBondContact O-N 3.23Å; V230-R234 WeakPolarHBondContact O-CB 3.5Å; V230-R234 PolarHBondContact O-N 3.05Å
231	L	97.4	Very high	94.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-57.4	176	-175	62.4	0	0	0	111.4	F168 F172 L188 M191 I195 I209 L227 A228 K233 R234 T235	F168-L231 HydrophobicContact CE1-CD2 4Å; F172-L231 HydrophobicContact CZ-CD2 4.24Å; L188-L231 HydrophobicContact CD2-CB 3.82Å; L188-L231 HydrophobicContact CD2-CD1 4.39Å; M191-L231 HydrophobicContact CB-CD1 3.67Å; M191-L231 HydrophobicContact CB-CD2 4.03Å; M191-L231 HydrophobicContact CE-CD2 3.84Å; M191-L231 HydrophobicContact SD-CD2 4.42Å; I195-L231 HydrophobicContact CD1-CD1 4.04Å; I195-L231 HydrophobicContact CD1-CD2 4Å; I195-L231 HydrophobicContact CD1-CG 4.01Å; I209-L231 HydrophobicContact CD1-CD2 4.33Å; I209-L231 HydrophobicContact CG1-CD2 4.3Å; I209-L231 HydrophobicContact CG2-CD2 4.39Å; L227-L231 PolarHBondContact O-N 3.14Å; A228-L231 PolarHBondContact O-N 2.92Å; L231-K233 PolarHBondContact O-N 2.84Å; L231-R234 PolarHBondContact O-N 2.72Å; L231-T235 HydrophobicContact CD1-CG2 4.12Å; L231-T235 PolarHBondContact O-N 3.03Å; L231-T235 PolarHBondContact O-OG1 2.93Å; L231-T235 VanDerWaalsContact O-OG1 3.1Å
232	L	97.4	Very high	95	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-54.8	-39.4	178.8	-73.7	162.7	0	0	0	112.3	I209 L210 L213 A228 V236 I239 I243 L272 I275 L279	I209-L232 HydrophobicContact CG2-CD1 4.21Å; I209-L232 HydrophobicContact CG2-CD2 4.1Å; I209-L232 HydrophobicContact CG2-CG 3.96Å; L210-L232 HydrophobicContact CD2-CD1 4.48Å; L210-L232 HydrophobicContact CD2-CD2 4.42Å; L213-L232 HydrophobicContact CD1-CD1 3.87Å; L213-L232 HydrophobicContact CD2-CD1 3.8Å; L213-L232 HydrophobicContact CG-CD1 4.46Å; A228-L232 WeakPolarHBondContact O-CB 3.44Å; A228-L232 WeakPolarHBondContact O-CD1 3.49Å; A228-L232 WeakPolarHBondContact O-CG 3.26Å; A228-L232 PolarHBondContact O-N 3.45Å; L232-V236 PolarHBondContact O-N 3.15Å; L232-I239 HydrophobicContact CD2-CD1 4.02Å; L232-I239 HydrophobicContact CD2-CG2 4.27Å; L232-I243 HydrophobicContact CD2-CD1 3.96Å; L232-L272 HydrophobicContact CD1-CD2 3.98Å; L232-L272 HydrophobicContact CD2-CD2 4.45Å; L232-I275 HydrophobicContact CB-CG2 4.27Å; L232-I275 HydrophobicContact CD1-CD1 4.06Å; L232-L279 HydrophobicContact CB-CD1 4.09Å; L232-L279 HydrophobicContact CB-CD2 4.44Å; L232-L279 HydrophobicContact CD2-CD2 4.48Å
233	K	95.5	Very high	95.1	Very high	101 Å²	101	41 Å²	41	44%	0.439	21%	0.21	S	C	.	.	H	α-helix	trans	-71.6	-29.1	178	-165	172.7	-169.9	68.3	0	113.1	K229 V230 L231 I275 D276	K229-K233 WeakPolarHBondContact O-CB 3.24Å; K229-K233 PolarHBondContact O-N 2.94Å; V230-K233 PolarHBondContact O-N 3.23Å; L231-K233 PolarHBondContact O-N 2.84Å; K233-I275 HydrophobicContact CB-CG2 4.13Å; K233-I275 PolarHBondContact NZ-O 3.03Å; K233-D276 IonicContact NZ-OD2 2.69Å; K233-D276 PolarHBondContact NZ-OD2 2.89Å
234	R	95	Very high	95.2	Very high	109 Å²	109	39.5 Å²	39.5	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-80.2	-32.9	177.8	-177.8	166.2	173.7	178.2	-4.2	112.5	D189 S192 V230 L231	D189-R234 IonicContact OD1-CZ 2.7Å; D189-R234 IonicContact OD1-NH1 3.44Å; D189-R234 PolarHBondContact OD1-NH1 3.29Å; D189-R234 IonicContact OD1-NH2 3.42Å; D189-R234 PolarHBondContact OD1-NH2 3.1Å; S192-R234 VanDerWaalsContact OG-CD 3.3Å; S192-R234 WeakPolarHBondContact OG-CD 3.47Å; V230-R234 WeakPolarHBondContact O-CB 3.5Å; V230-R234 PolarHBondContact O-N 3.05Å; L231-R234 PolarHBondContact O-N 2.72Å
235	T	95.8	Very high	95.1	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	22%	0.224	C	C	.	.	S	Bend	trans	-100.9	11.1	-176.3	62.9	0	0	0	0	114	I195 M196 L231 Q237 T238 I239	I195-T235 HydrophobicContact CB-CG2 3.94Å; I195-T235 HydrophobicContact CD1-CG2 4.03Å; I195-T235 HydrophobicContact CG2-CG2 3.89Å; M196-T235 HydrophobicContact CG-CG2 4.01Å; M196-T235 HydrophobicContact SD-CG2 4.28Å; L231-T235 HydrophobicContact CD1-CG2 4.12Å; L231-T235 PolarHBondContact O-N 3.03Å; L231-T235 PolarHBondContact O-OG1 2.93Å; L231-T235 VanDerWaalsContact O-OG1 3.1Å; T235-Q237 VanDerWaalsContact C-N 3.26Å; T235-Q237 PolarHBondContact O-N 3.15Å; T235-T238 PolarHBondContact O-N 3.13Å; T235-I239 WeakPolarHBondContact O-CG2 3.49Å; T235-I239 PolarHBondContact O-N 3.29Å
236	V	94.5	Very high	95.1	Very high	29 Å²	29	42.5 Å²	42.5	18%	0.176	22%	0.221	C	C	.	.	H	α-helix	trans	-48.8	-39.1	-170	65	0	0	0	0	114.6	L232 T238 E240 H278 L279	L232-V236 PolarHBondContact O-N 3.15Å; V236-T238 VanDerWaalsContact C-N 3.31Å; V236-T238 PolarHBondContact O-N 2.98Å; V236-E240 WeakPolarHBondContact O-CB 3.49Å; V236-E240 PolarHBondContact O-N 3.01Å; V236-H278 HydrophobicContact CG2-CB 3.78Å; V236-L279 HydrophobicContact CB-CD2 4.27Å; V236-L279 HydrophobicContact CG2-CD2 3.85Å; V236-L279 HydrophobicContact CG2-CG 3.97Å
237	Q	90.2	Very high	95.1	Very high	191 Å²	191	39.9 Å²	39.9	89%	0.893	21%	0.207	S	C	*	.	H	α-helix	trans	-69.5	-24.4	-178.4	-69	-171.5	-23.3	0	0	114.1	T235	T235-Q237 VanDerWaalsContact C-N 3.26Å; T235-Q237 PolarHBondContact O-N 3.15Å
238	T	92.2	Very high	95	Very high	55 Å²	55	42.1 Å²	42.1	34%	0.337	22%	0.22	S	C	.	.	H	α-helix	trans	-99.5	-38.8	179	-37.9	0	0	0	0	111.5	I195 T235 V236	I195-T238 WeakPolarHBondContact O-CG2 3.22Å; T235-T238 PolarHBondContact O-N 3.13Å; V236-T238 VanDerWaalsContact C-N 3.31Å; V236-T238 PolarHBondContact O-N 2.98Å
239	I	95	Very high	94.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-83.1	-16.8	-172.4	-157.1	156.1	0	0	0	114.2	I195 L206 I209 L232 T235 A241 C242 I243 L279	I195-I239 HydrophobicContact CD1-CD1 4.21Å; I195-I239 HydrophobicContact CG2-CB 4.34Å; I195-I239 HydrophobicContact CG2-CD1 4.38Å; L206-I239 HydrophobicContact CD1-CD1 3.98Å; L206-I239 HydrophobicContact CD1-CG1 4.02Å; I209-I239 HydrophobicContact CD1-CD1 3.79Å; L232-I239 HydrophobicContact CD2-CD1 4.02Å; L232-I239 HydrophobicContact CD2-CG2 4.27Å; T235-I239 WeakPolarHBondContact O-CG2 3.49Å; T235-I239 PolarHBondContact O-N 3.29Å; I239-A241 PolarHBondContact O-N 2.93Å; I239-C242 PolarHBondContact O-N 2.92Å; I239-I243 HydrophobicContact CG1-CD1 4.12Å; I239-I243 HydrophobicContact CG1-CG1 4.3Å; I239-I243 HydrophobicContact CG2-CD1 4.09Å; I239-I243 WeakPolarHBondContact O-CG1 3.26Å; I239-I243 PolarHBondContact O-N 3.12Å; I239-L279 HydrophobicContact CG2-CD2 3.79Å
240	E	94.9	Very high	94.7	Very high	29 Å²	29	41.4 Å²	41.4	14%	0.136	22%	0.218	C	C	.	.	H	α-helix	trans	-56.5	-46.4	176.7	-170.3	-79.4	165.1	0	0	112	V236 C242 I243 A244 H278 S282	V236-E240 WeakPolarHBondContact O-CB 3.49Å; V236-E240 PolarHBondContact O-N 3.01Å; E240-C242 VanDerWaalsContact C-N 3.31Å; E240-C242 PolarHBondContact O-N 2.88Å; E240-I243 PolarHBondContact O-N 2.79Å; E240-A244 VanDerWaalsContact O-CB 3.27Å; E240-A244 WeakPolarHBondContact O-CB 3.22Å; E240-A244 PolarHBondContact O-N 3.04Å; E240-H278 WeakPolarHBondContact CG-O 3.23Å; E240-S282 WeakPolarHBondContact OE1-CB 3.48Å; E240-S282 PolarHBondContact OE1-N 2.88Å; E240-S282 PolarHBondContact OE1-OG 3.28Å; E240-S282 PolarHBondContact OE2-OG 3.36Å
241	A	92.7	Very high	94.4	Very high	62 Å²	62	38.7 Å²	38.7	51%	0.512	20%	0.201	S	C	.	.	H	α-helix	trans	-63.4	-36.8	-178.8	0	0	0	0	0	112.4	I239 N245	I239-A241 PolarHBondContact O-N 2.93Å; A241-N245 WeakPolarHBondContact O-CB 3.18Å; A241-N245 PolarHBondContact O-N 2.74Å
242	C	94.3	Very high	94	Very high	28 Å²	28	41 Å²	41	19%	0.189	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-44.5	176.3	-57	0	0	0	0	111.3	V201 L206 I239 E240 N245 F246	V201-C242 HydrophobicContact CB-CB 4.49Å; L206-C242 HydrophobicContact CD2-CB 4.25Å; I239-C242 PolarHBondContact O-N 2.92Å; E240-C242 VanDerWaalsContact C-N 3.31Å; E240-C242 PolarHBondContact O-N 2.88Å; C242-N245 PolarHBondContact O-N 3.45Å; C242-F246 PolarHBondContact O-N 3.31Å
243	I	96	Very high	93.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-42.1	175.3	-69.5	168.9	0	0	0	110.9	L206 L232 I239 E240 F246 F247 L272 L279	L206-I243 HydrophobicContact CD1-CG1 3.92Å; L206-I243 HydrophobicContact CD2-CG1 4.41Å; L232-I243 HydrophobicContact CD2-CD1 3.96Å; I239-I243 HydrophobicContact CG1-CD1 4.12Å; I239-I243 HydrophobicContact CG1-CG1 4.3Å; I239-I243 HydrophobicContact CG2-CD1 4.09Å; I239-I243 WeakPolarHBondContact O-CG1 3.26Å; I239-I243 PolarHBondContact O-N 3.12Å; E240-I243 PolarHBondContact O-N 2.79Å; I243-F246 PolarHBondContact O-N 3.39Å; I243-F247 HydrophobicContact CG2-CD2 3.64Å; I243-F247 HydrophobicContact CG2-CE2 3.45Å; I243-F247 VanDerWaalsContact CG2-CE2 3.45Å; I243-F247 VanDerWaalsContact O-CD2 3.23Å; I243-F247 WeakPolarHBondContact O-CD2 3.11Å; I243-F247 PolarHBondContact O-N 3.47Å; I243-L272 HydrophobicContact CD1-CD2 4.29Å; I243-L272 HydrophobicContact CG2-CD1 4.05Å; I243-L279 HydrophobicContact CD1-CD2 3.85Å; I243-L279 WeakPolarHBondContact CG2-O 3.36Å
244	A	94.5	Very high	93.3	Very high	10 Å²	10	43.4 Å²	43.4	8%	0.083	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-40.8	177.7	0	0	0	0	0	112.6	E240 N248 V283 Q286	E240-A244 VanDerWaalsContact O-CB 3.27Å; E240-A244 WeakPolarHBondContact O-CB 3.22Å; E240-A244 PolarHBondContact O-N 3.04Å; A244-N248 VanDerWaalsContact O-CB 3.25Å; A244-N248 WeakPolarHBondContact O-CB 3.45Å; A244-N248 PolarHBondContact O-N 2.77Å; A244-V283 HydrophobicContact CB-CG2 4.45Å; A244-Q286 PolarHBondContact O-NE2 2.87Å
245	N	94	Very high	93	Very high	82 Å²	82	44.8 Å²	44.8	44%	0.439	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-47.5	173.3	178.8	38.6	0	0	0	111.5	A241 C242 F247 N248 Q249	A241-N245 WeakPolarHBondContact O-CB 3.18Å; A241-N245 PolarHBondContact O-N 2.74Å; C242-N245 PolarHBondContact O-N 3.45Å; N245-F247 PolarHBondContact O-N 3.25Å; N245-N248 WeakPolarHBondContact O-CB 3.45Å; N245-N248 PolarHBondContact O-N 3.4Å; N245-N248 VanDerWaalsContact O-N 3.1Å; N245-Q249 WeakPolarHBondContact O-CG 3.42Å; N245-Q249 PolarHBondContact O-N 3.04Å; N245-Q249 PolarHBondContact OD1-NE2 3.18Å; N245-Q249 VanDerWaalsContact OD1-NE2 3.12Å
246	F	96	Very high	92.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-52.6	-53.7	175.7	162.7	-114.3	0	0	0	111.6	Q203 L206 L210 C242 I243 N248 Q249 V250 L261 V265 L268	Q203-F246 VanDerWaalsContact NE2-CD2 3.3Å; L206-F246 HydrophobicContact CD2-CB 4.1Å; L210-F246 HydrophobicContact CD1-CD1 4.19Å; L210-F246 HydrophobicContact CD1-CE1 4.27Å; C242-F246 PolarHBondContact O-N 3.31Å; I243-F246 PolarHBondContact O-N 3.39Å; F246-N248 VanDerWaalsContact C-N 3.3Å; F246-N248 PolarHBondContact O-N 3.28Å; F246-Q249 PolarHBondContact O-N 3.28Å; F246-V250 HydrophobicContact CD2-CG2 4.14Å; F246-V250 HydrophobicContact CE2-CG2 3.73Å; F246-V250 HydrophobicContact CZ-CG2 4.35Å; F246-V250 PolarHBondContact O-N 3.06Å; F246-V250 VanDerWaalsContact O-N 3.14Å; F246-L261 HydrophobicContact CZ-CB 4.47Å; F246-V265 HydrophobicContact CE1-CG1 4.22Å; F246-V265 HydrophobicContact CZ-CG1 3.94Å; F246-L268 HydrophobicContact CE1-CD1 4.12Å; F246-L268 HydrophobicContact CZ-CD1 4.34Å
247	F	95.7	Very high	92.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-33.4	177.8	-72.9	-57.7	0	0	0	112.8	I243 N245 V250 L251 V265 L268 I269 L272 L280 V283 Q286	I243-F247 HydrophobicContact CG2-CD2 3.64Å; I243-F247 HydrophobicContact CG2-CE2 3.45Å; I243-F247 VanDerWaalsContact CG2-CE2 3.45Å; I243-F247 VanDerWaalsContact O-CD2 3.23Å; I243-F247 WeakPolarHBondContact O-CD2 3.11Å; I243-F247 PolarHBondContact O-N 3.47Å; N245-F247 PolarHBondContact O-N 3.25Å; F247-V250 PolarHBondContact O-N 3.01Å; F247-L251 HydrophobicContact CB-CD1 4.16Å; F247-L251 HydrophobicContact CD1-CD1 4.33Å; F247-L251 WeakPolarHBondContact O-CA 3.13Å; F247-L251 WeakPolarHBondContact O-CB 3.48Å; F247-L251 WeakPolarHBondContact O-CG 3.21Å; F247-L251 PolarHBondContact O-N 3.3Å; F247-V265 HydrophobicContact CD1-CB 4.14Å; F247-V265 HydrophobicContact CD1-CG1 3.95Å; F247-V265 HydrophobicContact CE1-CB 3.85Å; F247-V265 HydrophobicContact CE1-CG1 3.86Å; F247-L268 HydrophobicContact CE1-CB 4.45Å; F247-L268 HydrophobicContact CZ-CB 4.07Å; F247-I269 HydrophobicContact CD1-CD1 4.05Å; F247-I269 HydrophobicContact CD1-CG1 4.17Å; F247-I269 HydrophobicContact CE1-CD1 3.86Å; F247-I269 HydrophobicContact CE1-CG1 3.56Å; F247-I269 HydrophobicContact CE2-CG1 3.95Å; F247-I269 HydrophobicContact CZ-CD1 4.24Å; F247-I269 HydrophobicContact CZ-CG1 3.44Å; F247-I269 VanDerWaalsContact CZ-CG1 3.44Å; F247-L272 HydrophobicContact CE2-CD1 3.67Å; F247-L272 HydrophobicContact CZ-CD1 3.84Å; F247-L280 HydrophobicContact CD2-CD2 4.46Å; F247-L280 HydrophobicContact CE2-CD2 3.94Å; F247-V283 HydrophobicContact CB-CG1 4.03Å; F247-V283 HydrophobicContact CB-CG2 4.25Å; F247-V283 HydrophobicContact CD2-CB 4.49Å; F247-V283 HydrophobicContact CD2-CG1 3.96Å; F247-V283 HydrophobicContact CD2-CG2 3.67Å; F247-V283 HydrophobicContact CE2-CG2 4.49Å; F247-V283 HydrophobicContact CG-CG1 4.07Å; F247-V283 HydrophobicContact CG-CG2 4.35Å; F247-Q286 PolarHBondContact O-OE1 3.31Å
248	N	94.2	Very high	92.3	Very high	54 Å²	54	45.7 Å²	45.7	29%	0.289	28%	0.278	S	S	.	.	I	π-helix	trans	-66.2	-40.4	175.5	-177.6	71.8	0	0	0	112.2	A244 N245 F246 V252 L253 Q286	A244-N248 VanDerWaalsContact O-CB 3.25Å; A244-N248 WeakPolarHBondContact O-CB 3.45Å; A244-N248 PolarHBondContact O-N 2.77Å; N245-N248 WeakPolarHBondContact O-CB 3.45Å; N245-N248 PolarHBondContact O-N 3.4Å; N245-N248 VanDerWaalsContact O-N 3.1Å; F246-N248 VanDerWaalsContact C-N 3.3Å; F246-N248 PolarHBondContact O-N 3.28Å; N248-V252 WeakPolarHBondContact O-CB 3.35Å; N248-V252 PolarHBondContact O-N 2.88Å; N248-V252 VanDerWaalsContact O-N 3.13Å; N248-V252 WeakPolarHBondContact OD1-CB 3.22Å; N248-V252 WeakPolarHBondContact OD1-CG2 3.48Å; N248-L253 PolarHBondContact O-N 3.06Å; N248-Q286 VanDerWaalsContact N-OE1 3.14Å
249	Q	93.9	Very high	92.3	Very high	33 Å²	33	43.5 Å²	43.5	15%	0.154	26%	0.264	C	S	.	.	I	π-helix	trans	-62.4	-46.2	174.6	-61.1	-60.9	-39.5	0	0	111.5	N245 F246 L253 G254 R255 V258	N245-Q249 WeakPolarHBondContact O-CG 3.42Å; N245-Q249 PolarHBondContact O-N 3.04Å; N245-Q249 PolarHBondContact OD1-NE2 3.18Å; N245-Q249 VanDerWaalsContact OD1-NE2 3.12Å; F246-Q249 PolarHBondContact O-N 3.28Å; Q249-L253 CarbonylContact O-C 3.54Å; Q249-L253 WeakPolarHBondContact O-CB 3.38Å; Q249-G254 PolarHBondContact O-N 2.78Å; Q249-R255 WeakPolarHBondContact O-CB 3.42Å; Q249-R255 PolarHBondContact O-N 3.34Å; Q249-V258 HydrophobicContact CB-CB 4.48Å; Q249-V258 HydrophobicContact CB-CG1 4.37Å; Q249-V258 HydrophobicContact CB-CG2 4.11Å; Q249-V258 HydrophobicContact CG-CG1 4.45Å; Q249-V258 HydrophobicContact CG-CG2 4.43Å
250	V	93	Very high	92.1	Very high	17 Å²	17	50.7 Å²	50.7	10%	0.103	30%	0.303	C	S	.	.	I	π-helix	trans	-78.6	-52.4	-175.4	-176.8	0	0	0	0	112.2	F246 F247 G254 V265	F246-V250 HydrophobicContact CD2-CG2 4.14Å; F246-V250 HydrophobicContact CE2-CG2 3.73Å; F246-V250 HydrophobicContact CZ-CG2 4.35Å; F246-V250 PolarHBondContact O-N 3.06Å; F246-V250 VanDerWaalsContact O-N 3.14Å; F247-V250 PolarHBondContact O-N 3.01Å; V250-G254 VanDerWaalsContact O-CA 3.27Å; V250-G254 WeakPolarHBondContact O-CA 3.44Å; V250-G254 PolarHBondContact O-N 3.05Å; V250-V265 HydrophobicContact CB-CG1 4.15Å; V250-V265 HydrophobicContact CG1-CG1 3.77Å
251	L	90.2	Very high	92	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.058	30%	0.299	C	S	.	.	I	π-helix	trans	-75.2	-54.2	-175.8	-59.3	177.4	0	0	0	112	F247 V265 F266 I269 L287 K290	F247-L251 HydrophobicContact CB-CD1 4.16Å; F247-L251 HydrophobicContact CD1-CD1 4.33Å; F247-L251 WeakPolarHBondContact O-CA 3.13Å; F247-L251 WeakPolarHBondContact O-CB 3.48Å; F247-L251 WeakPolarHBondContact O-CG 3.21Å; F247-L251 PolarHBondContact O-N 3.3Å; L251-V265 HydrophobicContact CD2-CB 4.38Å; L251-V265 HydrophobicContact CD2-CG2 3.91Å; L251-F266 HydrophobicContact CD2-CE1 4.04Å; L251-I269 HydrophobicContact CD1-CD1 4.15Å; L251-L287 HydrophobicContact CD1-CD2 4.26Å; L251-K290 WeakPolarHBondContact O-CE 3.3Å; L251-K290 PolarHBondContact O-NZ 3.43Å
252	V	89.5	Confident	91.9	Very high	49 Å²	49	47.9 Å²	47.9	30%	0.297	28%	0.282	S	S	.	.	I	π-helix	trans	-82.5	-42.2	-170.1	-174	0	0	0	0	111.2	N248 Q286 F289	N248-V252 WeakPolarHBondContact O-CB 3.35Å; N248-V252 PolarHBondContact O-N 2.88Å; N248-V252 VanDerWaalsContact O-N 3.13Å; N248-V252 WeakPolarHBondContact OD1-CB 3.22Å; N248-V252 WeakPolarHBondContact OD1-CG2 3.48Å; V252-Q286 HydrophobicContact CG2-CB 3.93Å; V252-Q286 HydrophobicContact CG2-CG 4.01Å; V252-F289 HydrophobicContact CG1-CD1 4.5Å; V252-F289 HydrophobicContact CG1-CE1 4.27Å
253	L	90.7	Very high	91.7	Very high	93 Å²	93	54.2 Å²	54.2	49%	0.487	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-5.3	-177.9	-55.2	179	0	0	0	114.4	N248 Q249 R255	N248-L253 PolarHBondContact O-N 3.06Å; Q249-L253 CarbonylContact O-C 3.54Å; Q249-L253 WeakPolarHBondContact O-CB 3.38Å; L253-R255 VanDerWaalsContact C-N 3.26Å; L253-R255 HydrophobicContact CB-CG 4.25Å; L253-R255 PolarHBondContact O-N 2.81Å
254	G	87	Confident	91.6	Very high	57 Å²	57	56.8 Å²	56.8	59%	0.588	32%	0.321	S	S	*	.			trans	69.7	15.4	176	0	0	0	0	0	115.3	Q249 V250 S256	Q249-G254 PolarHBondContact O-N 2.78Å; V250-G254 VanDerWaalsContact O-CA 3.27Å; V250-G254 WeakPolarHBondContact O-CA 3.44Å; V250-G254 PolarHBondContact O-N 3.05Å; G254-S256 PolarHBondContact O-N 2.79Å
255	R	89.7	Confident	91.5	Very high	138 Å²	138	56.7 Å²	56.7	52%	0.521	32%	0.319	S	S	.	.			trans	-89.3	77.9	-173	-65.7	172.5	165.6	-174.6	-8.5	111.6	Q249 L253 S257 V258	Q249-R255 WeakPolarHBondContact O-CB 3.42Å; Q249-R255 PolarHBondContact O-N 3.34Å; L253-R255 VanDerWaalsContact C-N 3.26Å; L253-R255 HydrophobicContact CB-CG 4.25Å; L253-R255 PolarHBondContact O-N 2.81Å; R255-S257 VanDerWaalsContact C-N 3.25Å; R255-S257 PolarHBondContact O-N 3.01Å; R255-V258 HydrophobicContact CB-CG2 3.87Å; R255-V258 PolarHBondContact O-N 2.99Å
256	S	87	Confident	91.5	Very high	72 Å²	72	56 Å²	56	50%	0.503	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-59	-35.6	173.8	51.5	0	0	0	0	113	G254 V258 S259 S262	G254-S256 PolarHBondContact O-N 2.79Å; S256-V258 PolarHBondContact O-N 3.16Å; S256-S259 PolarHBondContact O-N 3.46Å; S256-S262 WeakPolarHBondContact CB-OG 3.41Å; S256-S262 WeakPolarHBondContact O-CB 3.47Å; S256-S262 PolarHBondContact O-OG 3.49Å
257	S	89.2	Confident	91.3	Very high	118 Å²	118	58.7 Å²	58.7	83%	0.825	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-65.9	9.3	-179.8	72.9	0	0	0	0	115.9	R255	R255-S257 VanDerWaalsContact C-N 3.25Å; R255-S257 PolarHBondContact O-N 3.01Å
258	V	88.5	Confident	91.3	Very high	52 Å²	52	58.7 Å²	58.7	32%	0.315	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-84.9	-23.6	172.8	170.9	0	0	0	0	111.2	Q203 Q249 R255 S256	Q203-V258 HydrophobicContact CG-CG1 4.09Å; Q203-V258 WeakPolarHBondContact CG-O 3.28Å; Q249-V258 HydrophobicContact CB-CB 4.48Å; Q249-V258 HydrophobicContact CB-CG1 4.37Å; Q249-V258 HydrophobicContact CB-CG2 4.11Å; Q249-V258 HydrophobicContact CG-CG1 4.45Å; Q249-V258 HydrophobicContact CG-CG2 4.43Å; R255-V258 HydrophobicContact CB-CG2 3.87Å; R255-V258 PolarHBondContact O-N 2.99Å; S256-V258 PolarHBondContact O-N 3.16Å
259	S	92	Very high	91.3	Very high	8 Å²	8	56.1 Å²	56.1	6%	0.056	31%	0.313	C	S	.	.			trans	-162.9	141.7	-179.2	174.4	0	0	0	0	111.6	D207 S256 L261 S262	D207-S259 PolarHBondContact OD1-OG 2.9Å; D207-S259 VanDerWaalsContact OD2-CB 3.26Å; D207-S259 WeakPolarHBondContact OD2-CB 3.47Å; D207-S259 PolarHBondContact OD2-OG 3.47Å; S256-S259 PolarHBondContact O-N 3.46Å; S259-L261 PolarHBondContact O-N 3.5Å; S259-L261 WeakPolarHBondContact OG-CB 3.31Å; S259-L261 WeakPolarHBondContact OG-CG 3.28Å; S259-L261 PolarHBondContact OG-N 2.82Å; S259-S262 WeakPolarHBondContact O-CB 3.07Å; S259-S262 PolarHBondContact O-N 2.62Å; S259-S262 VanDerWaalsContact O-N 3.09Å; S259-S262 PolarHBondContact O-OG 2.86Å
260	D	90.5	Very high	91.3	Very high	152 Å²	152	57.6 Å²	57.6	81%	0.813	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-60.2	-21.9	169.3	-64.5	-25.7	0	0	0	112.1	S262	D260-S262 PolarHBondContact O-N 3.46Å
261	L	93.4	Very high	91.3	Very high	11 Å²	11	58.3 Å²	58.3	6%	0.058	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-77.4	-1.1	178	-44.6	-173.5	0	0	0	113	D207 L210 I211 I214 F246 S259 E263 H264 L268	D207-L261 HydrophobicContact CB-CD1 3.8Å; D207-L261 HydrophobicContact CB-CG 4.3Å; L210-L261 HydrophobicContact CB-CD1 3.7Å; I211-L261 HydrophobicContact CB-CD1 4.41Å; I211-L261 HydrophobicContact CB-CD2 4.03Å; I211-L261 HydrophobicContact CD1-CD2 4.35Å; I211-L261 HydrophobicContact CG1-CD2 4.04Å; I214-L261 HydrophobicContact CD1-CD2 3.73Å; F246-L261 HydrophobicContact CZ-CB 4.47Å; S259-L261 PolarHBondContact O-N 3.5Å; S259-L261 WeakPolarHBondContact OG-CB 3.31Å; S259-L261 WeakPolarHBondContact OG-CG 3.28Å; S259-L261 PolarHBondContact OG-N 2.82Å; L261-E263 VanDerWaalsContact C-N 3.3Å; L261-E263 PolarHBondContact O-N 2.98Å; L261-H264 PolarHBondContact O-N 3.33Å; L261-L268 HydrophobicContact CB-CD1 4.18Å
262	S	91.1	Very high	91.5	Very high	21 Å²	21	57.8 Å²	57.8	15%	0.147	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-64	-26.4	-174.8	57.2	0	0	0	0	114.6	S256 S259 D260 H264	S256-S262 WeakPolarHBondContact CB-OG 3.41Å; S256-S262 WeakPolarHBondContact O-CB 3.47Å; S256-S262 PolarHBondContact O-OG 3.49Å; S259-S262 WeakPolarHBondContact O-CB 3.07Å; S259-S262 PolarHBondContact O-N 2.62Å; S259-S262 VanDerWaalsContact O-N 3.09Å; S259-S262 PolarHBondContact O-OG 2.86Å; D260-S262 PolarHBondContact O-N 3.46Å; S262-H264 VanDerWaalsContact C-N 3.27Å; S262-H264 PolarHBondContact O-N 3Å
263	E	90	Very high	91.7	Very high	160 Å²	160	56.5 Å²	56.5	75%	0.748	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-73	-19.6	172.8	67.5	177.8	157.4	0	0	113.3	L261	L261-E263 VanDerWaalsContact C-N 3.3Å; L261-E263 PolarHBondContact O-N 2.98Å
264	H	92.8	Very high	91.7	Very high	54 Å²	54	55 Å²	55	25%	0.25	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-98.5	8	-175.6	-67.6	-59.9	0	0	0	114.5	I214 L261 S262 F266 D267 L268	I214-H264 HydrophobicContact CD1-CB 4.05Å; I214-H264 VanDerWaalsContact CD1-CD2 3.47Å; I214-H264 WeakPolarHBondContact CD1-CD2 3.48Å; I214-H264 HydrophobicContact CG1-CB 4.03Å; L261-H264 PolarHBondContact O-N 3.33Å; S262-H264 VanDerWaalsContact C-N 3.27Å; S262-H264 PolarHBondContact O-N 3Å; H264-F266 VanDerWaalsContact C-N 3.27Å; H264-F266 PolarHBondContact O-N 2.96Å; H264-F266 VanDerWaalsContact O-N 3.09Å; H264-D267 PolarHBondContact O-N 3.29Å; H264-L268 HydrophobicContact CB-CD1 4.47Å; H264-L268 HydrophobicContact CB-CG 4.4Å; H264-L268 WeakPolarHBondContact O-CG 3.45Å; H264-L268 PolarHBondContact O-N 3.33Å
265	V	93.7	Very high	92	Very high	9 Å²	9	52.6 Å²	52.6	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-51.9	-38.3	-172.7	-74	0	0	0	0	114.6	F246 F247 V250 L251 I269	F246-V265 HydrophobicContact CE1-CG1 4.22Å; F246-V265 HydrophobicContact CZ-CG1 3.94Å; F247-V265 HydrophobicContact CD1-CB 4.14Å; F247-V265 HydrophobicContact CD1-CG1 3.95Å; F247-V265 HydrophobicContact CE1-CB 3.85Å; F247-V265 HydrophobicContact CE1-CG1 3.86Å; V250-V265 HydrophobicContact CB-CG1 4.15Å; V250-V265 HydrophobicContact CG1-CG1 3.77Å; L251-V265 HydrophobicContact CD2-CB 4.38Å; L251-V265 HydrophobicContact CD2-CG2 3.91Å; V265-I269 WeakPolarHBondContact O-CD1 3.43Å; V265-I269 VanDerWaalsContact O-CG1 3.22Å; V265-I269 WeakPolarHBondContact O-CG1 3.32Å; V265-I269 PolarHBondContact O-N 3.47Å
266	F	92.8	Very high	92	Very high	68 Å²	68	47.4 Å²	47.4	30%	0.298	27%	0.267	S	S	.	.	H	α-helix	trans	-74.8	-32.3	-179.7	-58	-45.1	0	0	0	113.5	L251 H264 Q270 A301 V302 L305	L251-F266 HydrophobicContact CD2-CE1 4.04Å; H264-F266 VanDerWaalsContact C-N 3.27Å; H264-F266 PolarHBondContact O-N 2.96Å; H264-F266 VanDerWaalsContact O-N 3.09Å; F266-Q270 PolarHBondContact O-N 3.13Å; F266-Q270 VanDerWaalsContact O-N 3.16Å; F266-A301 HydrophobicContact CD2-CB 4.39Å; F266-A301 HydrophobicContact CE2-CB 3.66Å; F266-A301 HydrophobicContact CZ-CB 4Å; F266-V302 HydrophobicContact CE1-CG2 4.13Å; F266-V302 HydrophobicContact CZ-CG2 4.32Å; F266-L305 HydrophobicContact CB-CD2 4.39Å; F266-L305 HydrophobicContact CD1-CD2 3.75Å; F266-L305 HydrophobicContact CG-CD2 4.45Å; F266-L305 WeakPolarHBondContact O-CD1 3.48Å
267	D	91.8	Very high	92.2	Very high	56 Å²	56	46.2 Å²	46.2	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-72	-40.5	172.9	-68.9	-32.7	0	0	0	110.5	P215 H264 Q270 E271	P215-D267 HydrophobicContact CG-CB 4.36Å; H264-D267 PolarHBondContact O-N 3.29Å; D267-Q270 PolarHBondContact O-N 2.96Å; D267-E271 PolarHBondContact O-N 3.26Å
268	L	95.4	Very high	92.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-46.1	174.1	-70.4	174.6	0	0	0	111.6	L210 L213 I214 F246 F247 L261 H264 Q270 E271 L272	L210-L268 HydrophobicContact CB-CD2 4.3Å; L210-L268 WeakPolarHBondContact O-CD2 3.4Å; L213-L268 HydrophobicContact CB-CD2 3.88Å; I214-L268 HydrophobicContact CG1-CD2 4.02Å; F246-L268 HydrophobicContact CE1-CD1 4.12Å; F246-L268 HydrophobicContact CZ-CD1 4.34Å; F247-L268 HydrophobicContact CE1-CB 4.45Å; F247-L268 HydrophobicContact CZ-CB 4.07Å; L261-L268 HydrophobicContact CB-CD1 4.18Å; H264-L268 HydrophobicContact CB-CD1 4.47Å; H264-L268 HydrophobicContact CB-CG 4.4Å; H264-L268 WeakPolarHBondContact O-CG 3.45Å; H264-L268 PolarHBondContact O-N 3.33Å; L268-Q270 VanDerWaalsContact C-N 3.32Å; L268-Q270 PolarHBondContact O-N 3.49Å; L268-E271 PolarHBondContact O-N 3.18Å; L268-L272 VanDerWaalsContact O-CB 3.29Å; L268-L272 WeakPolarHBondContact O-CB 3.35Å; L268-L272 WeakPolarHBondContact O-CD1 3.43Å; L268-L272 WeakPolarHBondContact O-CG 3.46Å; L268-L272 PolarHBondContact O-N 2.99Å
269	I	95.5	Very high	92.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-40.6	175.7	-68.2	164.3	0	0	0	111.1	F247 L251 V265 F273 L280 V283 L287 L305 L309	F247-I269 HydrophobicContact CD1-CD1 4.05Å; F247-I269 HydrophobicContact CD1-CG1 4.17Å; F247-I269 HydrophobicContact CE1-CD1 3.86Å; F247-I269 HydrophobicContact CE1-CG1 3.56Å; F247-I269 HydrophobicContact CE2-CG1 3.95Å; F247-I269 HydrophobicContact CZ-CD1 4.24Å; F247-I269 HydrophobicContact CZ-CG1 3.44Å; F247-I269 VanDerWaalsContact CZ-CG1 3.44Å; L251-I269 HydrophobicContact CD1-CD1 4.15Å; V265-I269 WeakPolarHBondContact O-CD1 3.43Å; V265-I269 VanDerWaalsContact O-CG1 3.22Å; V265-I269 WeakPolarHBondContact O-CG1 3.32Å; V265-I269 PolarHBondContact O-N 3.47Å; I269-F273 WeakPolarHBondContact O-CB 3.43Å; I269-F273 PolarHBondContact O-N 3.03Å; I269-L280 HydrophobicContact CG1-CD2 4.19Å; I269-L280 HydrophobicContact CG2-CD1 3.9Å; I269-L280 HydrophobicContact CG2-CD2 4.27Å; I269-L280 WeakPolarHBondContact O-CD1 3.35Å; I269-V283 HydrophobicContact CD1-CG1 4.28Å; I269-L287 HydrophobicContact CD1-CD2 4.26Å; I269-L287 HydrophobicContact CG2-CD1 4.4Å; I269-L305 HydrophobicContact CB-CD2 4.12Å; I269-L305 HydrophobicContact CD1-CD2 4.12Å; I269-L305 HydrophobicContact CG2-CD1 4.28Å; I269-L305 HydrophobicContact CG2-CD2 3.86Å; I269-L309 HydrophobicContact CG2-CD1 4.18Å
270	Q	93	Very high	92.6	Very high	64 Å²	64	43.2 Å²	43.2	30%	0.299	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-43.4	177.6	-171.2	-171	-37.2	0	0	112.2	F266 D267 L268 A274 L305 K308 L309	F266-Q270 PolarHBondContact O-N 3.13Å; F266-Q270 VanDerWaalsContact O-N 3.16Å; D267-Q270 PolarHBondContact O-N 2.96Å; L268-Q270 VanDerWaalsContact C-N 3.32Å; L268-Q270 PolarHBondContact O-N 3.49Å; Q270-A274 PolarHBondContact O-N 3.39Å; Q270-L305 HydrophobicContact CB-CD1 4.25Å; Q270-K308 HydrophobicContact CG-CD 4.47Å; Q270-L309 HydrophobicContact CG-CD2 4.5Å
271	E	93.3	Very high	92.5	Very high	31 Å²	31	41.4 Å²	41.4	15%	0.145	22%	0.215	C	C	.	.	H	α-helix	trans	-72.5	-42	178.7	-70.4	-70.2	157.6	0	0	112.2	L213 K218 F225 D267 L268 F273 A274 I275	L213-E271 HydrophobicContact CB-CB 4.26Å; L213-E271 HydrophobicContact CD2-CB 4.3Å; L213-E271 HydrophobicContact CG-CB 4.42Å; K218-E271 IonicContact NZ-OE1 3.06Å; K218-E271 PolarHBondContact NZ-OE1 3.38Å; K218-E271 IonicContact NZ-OE2 3.23Å; K218-E271 PolarHBondContact NZ-OE2 2.9Å; F225-E271 WeakPolarHBondContact CE2-OE2 3.28Å; F225-E271 WeakPolarHBondContact CZ-OE2 3.44Å; D267-E271 PolarHBondContact O-N 3.26Å; L268-E271 PolarHBondContact O-N 3.18Å; E271-F273 PolarHBondContact O-N 3.37Å; E271-A274 CarbonylContact O-C 3.55Å; E271-A274 WeakPolarHBondContact O-CA 3.44Å; E271-A274 PolarHBondContact O-N 3.04Å; E271-A274 VanDerWaalsContact O-N 3.07Å; E271-I275 VanDerWaalsContact O-CG1 3.3Å; E271-I275 WeakPolarHBondContact O-CG1 3.45Å; E271-I275 PolarHBondContact O-N 3.17Å; E271-I275 VanDerWaalsContact O-N 3.13Å
272	L	95.3	Very high	92.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-44	176.3	-73.1	167.4	0	0	0	111.7	L210 L213 L232 I243 F247 L268 A274 I275 D276 L279 L280	L210-L272 HydrophobicContact CD2-CD1 4.49Å; L210-L272 HydrophobicContact CD2-CD2 4.15Å; L213-L272 HydrophobicContact CD2-CD2 3.75Å; L213-L272 HydrophobicContact CD2-CG 3.96Å; L232-L272 HydrophobicContact CD1-CD2 3.98Å; L232-L272 HydrophobicContact CD2-CD2 4.45Å; I243-L272 HydrophobicContact CD1-CD2 4.29Å; I243-L272 HydrophobicContact CG2-CD1 4.05Å; F247-L272 HydrophobicContact CE2-CD1 3.67Å; F247-L272 HydrophobicContact CZ-CD1 3.84Å; L268-L272 VanDerWaalsContact O-CB 3.29Å; L268-L272 WeakPolarHBondContact O-CB 3.35Å; L268-L272 WeakPolarHBondContact O-CD1 3.43Å; L268-L272 WeakPolarHBondContact O-CG 3.46Å; L268-L272 PolarHBondContact O-N 2.99Å; L272-A274 PolarHBondContact O-N 3.36Å; L272-I275 WeakPolarHBondContact O-CB 3.38Å; L272-I275 PolarHBondContact O-N 3.06Å; L272-D276 PolarHBondContact O-N 3.1Å; L272-L279 HydrophobicContact CD2-CB 4.4Å; L272-L279 HydrophobicContact CD2-CD1 3.95Å; L272-L280 HydrophobicContact CB-CD1 4.13Å; L272-L280 HydrophobicContact CB-CD2 4.12Å; L272-L280 HydrophobicContact CB-CG 4.14Å; L272-L280 HydrophobicContact CD1-CD2 4.1Å
273	F	93.2	Very high	92.6	Very high	23 Å²	23	42.6 Å²	42.6	10%	0.101	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-35	174.9	-171.7	-101.5	0	0	0	112.3	I269 E271 I275 P277 L280 M284 L309 L317	I269-F273 WeakPolarHBondContact O-CB 3.43Å; I269-F273 PolarHBondContact O-N 3.03Å; E271-F273 PolarHBondContact O-N 3.37Å; F273-I275 VanDerWaalsContact C-N 3.29Å; F273-I275 PolarHBondContact O-N 3.36Å; F273-P277 HydrophobicContact CD2-CB 4.04Å; F273-P277 HydrophobicContact CD2-CG 4.15Å; F273-P277 HydrophobicContact CE2-CB 3.82Å; F273-P277 HydrophobicContact CE2-CG 3.89Å; F273-P277 HydrophobicContact CZ-CG 4.28Å; F273-L280 HydrophobicContact CB-CD1 3.66Å; F273-L280 HydrophobicContact CD2-CD1 4.21Å; F273-L280 HydrophobicContact CG-CD1 4.45Å; F273-M284 HydrophobicContact CD2-CE 3.68Å; F273-M284 HydrophobicContact CE2-CE 3.87Å; F273-L309 HydrophobicContact CB-CD2 3.98Å; F273-L309 HydrophobicContact CD1-CD2 3.85Å; F273-L309 HydrophobicContact CG-CD2 3.97Å; F273-L317 HydrophobicContact CE2-CB 4.36Å; F273-L317 HydrophobicContact CE2-CD1 4.21Å; F273-L317 HydrophobicContact CE2-CD2 4.2Å; F273-L317 HydrophobicContact CE2-CG 4.49Å; F273-L317 HydrophobicContact CZ-CB 4.01Å; F273-L317 HydrophobicContact CZ-CD2 4.3Å
274	A	91.1	Very high	92.8	Very high	60 Å²	60	35.4 Å²	35.4	50%	0.496	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-0	175.6	0	0	0	0	0	114.3	K229 Q270 E271 L272	K229-A274 PolarHBondContact NZ-O 3.3Å; Q270-A274 PolarHBondContact O-N 3.39Å; E271-A274 CarbonylContact O-C 3.55Å; E271-A274 WeakPolarHBondContact O-CA 3.44Å; E271-A274 PolarHBondContact O-N 3.04Å; E271-A274 VanDerWaalsContact O-N 3.07Å; L272-A274 PolarHBondContact O-N 3.36Å
275	I	92.4	Very high	92.8	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.041	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-57	173	-66.7	165.6	0	0	0	109.6	L213 K229 L232 K233 E271 L272 F273 L279	L213-I275 HydrophobicContact CD2-CD1 3.67Å; L213-I275 HydrophobicContact CG-CD1 4.09Å; K229-I275 HydrophobicContact CB-CD1 4.27Å; K229-I275 HydrophobicContact CB-CG1 4.25Å; K229-I275 HydrophobicContact CD-CG1 3.9Å; K229-I275 HydrophobicContact CG-CD1 4.45Å; K229-I275 HydrophobicContact CG-CG1 3.88Å; K229-I275 HydrophobicContact CG-CG2 4.17Å; K229-I275 WeakPolarHBondContact O-CG2 3.4Å; L232-I275 HydrophobicContact CB-CG2 4.27Å; L232-I275 HydrophobicContact CD1-CD1 4.06Å; K233-I275 HydrophobicContact CB-CG2 4.13Å; K233-I275 PolarHBondContact NZ-O 3.03Å; E271-I275 VanDerWaalsContact O-CG1 3.3Å; E271-I275 WeakPolarHBondContact O-CG1 3.45Å; E271-I275 PolarHBondContact O-N 3.17Å; E271-I275 VanDerWaalsContact O-N 3.13Å; L272-I275 WeakPolarHBondContact O-CB 3.38Å; L272-I275 PolarHBondContact O-N 3.06Å; F273-I275 VanDerWaalsContact C-N 3.29Å; F273-I275 PolarHBondContact O-N 3.36Å; I275-L279 HydrophobicContact CB-CD1 4.09Å; I275-L279 HydrophobicContact CG2-CD1 3.78Å
276	D	91	Very high	92.8	Very high	29 Å²	29	36.8 Å²	36.8	16%	0.155	20%	0.204	C	C	.	.			trans	-159.9	123	169	-155.5	-61.5	0	0	0	110.5	K233 L272 H278 L279	K233-D276 IonicContact NZ-OD2 2.69Å; K233-D276 PolarHBondContact NZ-OD2 2.89Å; L272-D276 PolarHBondContact O-N 3.1Å; D276-H278 PolarHBondContact O-N 2.87Å; D276-H278 VanDerWaalsContact O-N 3.09Å; D276-H278 WeakPolarHBondContact OD1-CB 3.22Å; D276-H278 IonicContact OD1-CG 3.51Å; D276-H278 PolarHBondContact OD1-N 3.11Å; D276-H278 IonicContact OD1-ND1 2.74Å; D276-H278 PolarHBondContact OD1-ND1 3.07Å; D276-L279 HydrophobicContact CB-CD1 4.1Å; D276-L279 HydrophobicContact CB-CG 4.26Å; D276-L279 WeakPolarHBondContact O-CB 3.32Å; D276-L279 PolarHBondContact O-N 3.38Å
277	P	89.9	Confident	92.9	Very high	46 Å²	46	33.6 Å²	33.6	30%	0.299	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-55.3	-24.4	175.7	-29.5	37.5	0	0	0	115	F273 L279 L280	F273-P277 HydrophobicContact CD2-CB 4.04Å; F273-P277 HydrophobicContact CD2-CG 4.15Å; F273-P277 HydrophobicContact CE2-CB 3.82Å; F273-P277 HydrophobicContact CE2-CG 3.89Å; F273-P277 HydrophobicContact CZ-CG 4.28Å; P277-L279 PolarHBondContact O-N 3.25Å; P277-L280 PolarHBondContact O-N 3.43Å
278	H	90.6	Very high	93	Very high	115 Å²	115	33 Å²	33	53%	0.532	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-64.2	-25.7	175.8	-76.4	84.7	0	0	0	113.3	V236 E240 D276 L280 L281	V236-H278 HydrophobicContact CG2-CB 3.78Å; E240-H278 WeakPolarHBondContact CG-O 3.23Å; D276-H278 PolarHBondContact O-N 2.87Å; D276-H278 VanDerWaalsContact O-N 3.09Å; D276-H278 WeakPolarHBondContact OD1-CB 3.22Å; D276-H278 IonicContact OD1-CG 3.51Å; D276-H278 PolarHBondContact OD1-N 3.11Å; D276-H278 IonicContact OD1-ND1 2.74Å; D276-H278 PolarHBondContact OD1-ND1 3.07Å; H278-L280 PolarHBondContact O-N 3.45Å; H278-L281 PolarHBondContact O-N 3.32Å
279	L	94.6	Very high	92.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-62.2	-7.9	175.7	-67.8	163.6	0	0	0	113.6	L232 V236 I239 I243 L272 I275 D276 P277	L232-L279 HydrophobicContact CB-CD1 4.09Å; L232-L279 HydrophobicContact CB-CD2 4.44Å; L232-L279 HydrophobicContact CD2-CD2 4.48Å; V236-L279 HydrophobicContact CB-CD2 4.27Å; V236-L279 HydrophobicContact CG2-CD2 3.85Å; V236-L279 HydrophobicContact CG2-CG 3.97Å; I239-L279 HydrophobicContact CG2-CD2 3.79Å; I243-L279 HydrophobicContact CD1-CD2 3.85Å; I243-L279 WeakPolarHBondContact CG2-O 3.36Å; L272-L279 HydrophobicContact CD2-CB 4.4Å; L272-L279 HydrophobicContact CD2-CD1 3.95Å; I275-L279 HydrophobicContact CB-CD1 4.09Å; I275-L279 HydrophobicContact CG2-CD1 3.78Å; D276-L279 HydrophobicContact CB-CD1 4.1Å; D276-L279 HydrophobicContact CB-CG 4.26Å; D276-L279 WeakPolarHBondContact O-CB 3.32Å; D276-L279 PolarHBondContact O-N 3.38Å; P277-L279 PolarHBondContact O-N 3.25Å
280	L	94	Very high	92.8	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-127.1	11.9	-175.4	-62.5	170.1	0	0	0	112.6	F247 I269 L272 F273 P277 H278 S282 V283 M284	F247-L280 HydrophobicContact CD2-CD2 4.46Å; F247-L280 HydrophobicContact CE2-CD2 3.94Å; I269-L280 HydrophobicContact CG1-CD2 4.19Å; I269-L280 HydrophobicContact CG2-CD1 3.9Å; I269-L280 HydrophobicContact CG2-CD2 4.27Å; I269-L280 WeakPolarHBondContact O-CD1 3.35Å; L272-L280 HydrophobicContact CB-CD1 4.13Å; L272-L280 HydrophobicContact CB-CD2 4.12Å; L272-L280 HydrophobicContact CB-CG 4.14Å; L272-L280 HydrophobicContact CD1-CD2 4.1Å; F273-L280 HydrophobicContact CB-CD1 3.66Å; F273-L280 HydrophobicContact CD2-CD1 4.21Å; F273-L280 HydrophobicContact CG-CD1 4.45Å; P277-L280 PolarHBondContact O-N 3.43Å; H278-L280 PolarHBondContact O-N 3.45Å; L280-S282 VanDerWaalsContact C-N 3.34Å; L280-S282 PolarHBondContact O-N 3.35Å; L280-V283 HydrophobicContact CB-CB 4.19Å; L280-V283 HydrophobicContact CD2-CB 4.06Å; L280-V283 HydrophobicContact CD2-CG1 4.21Å; L280-V283 HydrophobicContact CD2-CG2 4.01Å; L280-V283 WeakPolarHBondContact O-CA 3.32Å; L280-V283 WeakPolarHBondContact O-CB 3.43Å; L280-V283 PolarHBondContact O-N 3.03Å; L280-M284 HydrophobicContact CB-CE 4.01Å; L280-M284 HydrophobicContact CD1-CE 4.21Å; L280-M284 WeakPolarHBondContact O-CG 3.29Å; L280-M284 PolarHBondContact O-N 2.84Å
281	L	88	Confident	93	Very high	113 Å²	113	36.6 Å²	36.6	59%	0.592	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-49.9	-174.1	-170.5	74	0	0	0	111.7	H278 V283 P285	H278-L281 PolarHBondContact O-N 3.32Å; L281-V283 VanDerWaalsContact C-N 3.3Å; L281-V283 PolarHBondContact O-N 2.97Å; L281-P285 WeakPolarHBondContact O-CD 3.27Å
282	S	92.5	Very high	93	Very high	57 Å²	57	40.5 Å²	40.5	40%	0.399	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.7	177.3	-48.5	0	0	0	0	113.9	E240 L280 Q286	E240-S282 WeakPolarHBondContact OE1-CB 3.48Å; E240-S282 PolarHBondContact OE1-N 2.88Å; E240-S282 PolarHBondContact OE1-OG 3.28Å; E240-S282 PolarHBondContact OE2-OG 3.36Å; L280-S282 VanDerWaalsContact C-N 3.34Å; L280-S282 PolarHBondContact O-N 3.35Å; S282-Q286 PolarHBondContact O-NE2 3.09Å
283	V	94.6	Very high	93	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-32.3	177.9	-172.8	0	0	0	0	111.3	A244 F247 I269 L280 L281 Q286 L287	A244-V283 HydrophobicContact CB-CG2 4.45Å; F247-V283 HydrophobicContact CB-CG1 4.03Å; F247-V283 HydrophobicContact CB-CG2 4.25Å; F247-V283 HydrophobicContact CD2-CB 4.49Å; F247-V283 HydrophobicContact CD2-CG1 3.96Å; F247-V283 HydrophobicContact CD2-CG2 3.67Å; F247-V283 HydrophobicContact CE2-CG2 4.49Å; F247-V283 HydrophobicContact CG-CG1 4.07Å; F247-V283 HydrophobicContact CG-CG2 4.35Å; I269-V283 HydrophobicContact CD1-CG1 4.28Å; L280-V283 HydrophobicContact CB-CB 4.19Å; L280-V283 HydrophobicContact CD2-CB 4.06Å; L280-V283 HydrophobicContact CD2-CG1 4.21Å; L280-V283 HydrophobicContact CD2-CG2 4.01Å; L280-V283 WeakPolarHBondContact O-CA 3.32Å; L280-V283 WeakPolarHBondContact O-CB 3.43Å; L280-V283 PolarHBondContact O-N 3.03Å; L281-V283 VanDerWaalsContact C-N 3.3Å; L281-V283 PolarHBondContact O-N 2.97Å; V283-Q286 WeakPolarHBondContact O-CA 3.36Å; V283-Q286 VanDerWaalsContact O-CB 3.25Å; V283-Q286 WeakPolarHBondContact O-CB 3.21Å; V283-Q286 PolarHBondContact O-N 3.48Å; V283-L287 PolarHBondContact O-N 2.9Å
284	M	93.6	Very high	93	Very high	9 Å²	9	48.4 Å²	48.4	4%	0.044	26%	0.262	C	S	.	.	H	α-helix	trans	-54.9	-40.2	177.9	-65.7	-62.3	175.4	0	0	114	F273 L280 Q286 L287 E288 L309 L317 N321 L324	F273-M284 HydrophobicContact CD2-CE 3.68Å; F273-M284 HydrophobicContact CE2-CE 3.87Å; L280-M284 HydrophobicContact CB-CE 4.01Å; L280-M284 HydrophobicContact CD1-CE 4.21Å; L280-M284 WeakPolarHBondContact O-CG 3.29Å; L280-M284 PolarHBondContact O-N 2.84Å; M284-Q286 VanDerWaalsContact C-N 3.29Å; M284-Q286 PolarHBondContact O-N 2.82Å; M284-L287 PolarHBondContact O-N 3.15Å; M284-L287 HydrophobicContact SD-CD1 4.29Å; M284-E288 PolarHBondContact O-N 2.89Å; M284-E288 VanDerWaalsContact O-N 3.09Å; M284-L309 HydrophobicContact CE-CD1 4.5Å; M284-L317 HydrophobicContact CE-CD1 3.83Å; M284-L317 HydrophobicContact CE-CD2 4.14Å; M284-L317 HydrophobicContact CG-CD1 4.5Å; M284-L317 HydrophobicContact SD-CD1 4.01Å; M284-L317 HydrophobicContact SD-CD2 4.25Å; M284-N321 WeakPolarHBondContact CB-ND2 3.41Å; M284-L324 HydrophobicContact CB-CD2 4.11Å; M284-L324 HydrophobicContact CG-CD2 4.4Å; M284-L324 HydrophobicContact SD-CD2 3.73Å
285	P	92.5	Very high	93.2	Very high	75 Å²	75	49.4 Å²	49.4	49%	0.487	26%	0.259	S	S	.	.	H	α-helix	trans	-64.7	-29.3	173.1	-22.2	34.9	0	0	0	113.7	L281 E288 F289	L281-P285 WeakPolarHBondContact O-CD 3.27Å; P285-E288 PolarHBondContact O-N 2.95Å; P285-F289 PolarHBondContact O-N 3.15Å
286	Q	93.7	Very high	93.3	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.084	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-35.9	177.4	-48.4	178	23.8	0	0	110.8	A244 F247 N248 V252 S282 V283 M284 F289 K290	A244-Q286 PolarHBondContact O-NE2 2.87Å; F247-Q286 PolarHBondContact O-OE1 3.31Å; N248-Q286 VanDerWaalsContact N-OE1 3.14Å; V252-Q286 HydrophobicContact CG2-CB 3.93Å; V252-Q286 HydrophobicContact CG2-CG 4.01Å; S282-Q286 PolarHBondContact O-NE2 3.09Å; V283-Q286 WeakPolarHBondContact O-CA 3.36Å; V283-Q286 VanDerWaalsContact O-CB 3.25Å; V283-Q286 WeakPolarHBondContact O-CB 3.21Å; V283-Q286 PolarHBondContact O-N 3.48Å; M284-Q286 VanDerWaalsContact C-N 3.29Å; M284-Q286 PolarHBondContact O-N 2.82Å; Q286-F289 WeakPolarHBondContact O-CB 3.36Å; Q286-F289 PolarHBondContact O-N 2.93Å; Q286-K290 PolarHBondContact O-N 3.46Å
287	L	94.6	Very high	93.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.5	-38.9	171	-60.9	179.6	0	0	0	111.7	L251 I269 V283 M284 F289 K290 L291 V302 L305 L306 L324	L251-L287 HydrophobicContact CD1-CD2 4.26Å; I269-L287 HydrophobicContact CD1-CD2 4.26Å; I269-L287 HydrophobicContact CG2-CD1 4.4Å; V283-L287 PolarHBondContact O-N 2.9Å; M284-L287 PolarHBondContact O-N 3.15Å; M284-L287 HydrophobicContact SD-CD1 4.29Å; L287-F289 VanDerWaalsContact C-N 3.29Å; L287-F289 PolarHBondContact O-N 3.02Å; L287-K290 PolarHBondContact O-N 3.36Å; L287-L291 WeakPolarHBondContact O-CG 3.34Å; L287-L291 PolarHBondContact O-N 3.22Å; L287-V302 HydrophobicContact CB-CG1 4.28Å; L287-V302 HydrophobicContact CD2-CG1 4.24Å; L287-L305 HydrophobicContact CD1-CD2 4.22Å; L287-L305 HydrophobicContact CD2-CD2 4.12Å; L287-L306 HydrophobicContact CD1-CD2 4.04Å; L287-L324 HydrophobicContact CB-CD1 4.38Å
288	E	94.6	Very high	93.7	Very high	43 Å²	43	53.9 Å²	53.9	20%	0.201	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-36.3	173.3	-156.7	-162.2	117.9	0	0	112.1	M284 P285 K292 L324 C327	M284-E288 PolarHBondContact O-N 2.89Å; M284-E288 VanDerWaalsContact O-N 3.09Å; P285-E288 PolarHBondContact O-N 2.95Å; E288-K292 WeakPolarHBondContact O-CE 3.46Å; E288-K292 WeakPolarHBondContact O-CG 3.41Å; E288-K292 WeakPolarHBondContact OE1-CE 3.44Å; E288-K292 IonicContact OE1-NZ 2.7Å; E288-K292 PolarHBondContact OE1-NZ 3.34Å; E288-L324 HydrophobicContact CB-CD1 3.82Å; E288-L324 HydrophobicContact CG-CD1 4.18Å; E288-C327 HydrophobicContact CG-CB 3.68Å
289	F	93.4	Very high	93.9	Very high	115 Å²	115	49 Å²	49	50%	0.504	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-47.5	171.6	175.2	-103.1	0	0	0	111.8	V252 P285 Q286 L287 L291 K292 S293	V252-F289 HydrophobicContact CG1-CD1 4.5Å; V252-F289 HydrophobicContact CG1-CE1 4.27Å; P285-F289 PolarHBondContact O-N 3.15Å; Q286-F289 WeakPolarHBondContact O-CB 3.36Å; Q286-F289 PolarHBondContact O-N 2.93Å; L287-F289 VanDerWaalsContact C-N 3.29Å; L287-F289 PolarHBondContact O-N 3.02Å; F289-L291 VanDerWaalsContact C-N 3.33Å; F289-L291 PolarHBondContact O-N 3.42Å; F289-K292 WeakPolarHBondContact O-CA 3.28Å; F289-K292 WeakPolarHBondContact O-CB 3.41Å; F289-K292 PolarHBondContact O-N 2.92Å; F289-S293 PolarHBondContact O-N 2.9Å
290	K	93.4	Very high	94.1	Very high	26 Å²	26	49.1 Å²	49.1	11%	0.113	26%	0.256	C	S	.	.	H	α-helix	trans	-66.2	-28.5	178.2	-78.8	-72.6	-179.9	-179.1	0	114.2	L251 Q286 L287 K292 S293 E298 V302	L251-K290 WeakPolarHBondContact O-CE 3.3Å; L251-K290 PolarHBondContact O-NZ 3.43Å; Q286-K290 PolarHBondContact O-N 3.46Å; L287-K290 PolarHBondContact O-N 3.36Å; K290-K292 PolarHBondContact O-N 2.94Å; K290-K292 VanDerWaalsContact O-N 3.11Å; K290-S293 VanDerWaalsContact O-CB 3.24Å; K290-S293 WeakPolarHBondContact O-CB 3.29Å; K290-S293 PolarHBondContact O-N 3.16Å; K290-E298 WeakPolarHBondContact CD-OE2 3.28Å; K290-E298 IonicContact NZ-OE1 2.71Å; K290-E298 PolarHBondContact NZ-OE1 3.12Å; K290-E298 IonicContact NZ-OE2 3.96Å; K290-E298 PolarHBondContact NZ-OE2 3.3Å; K290-V302 HydrophobicContact CB-CG2 3.68Å; K290-V302 HydrophobicContact CG-CG2 4.49Å
291	L	95.9	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-17.7	168	-77.1	-173.7	0	0	0	113.9	L287 F289 R299 V302 V303 L306 L324 C327 F328 R331	L287-L291 WeakPolarHBondContact O-CG 3.34Å; L287-L291 PolarHBondContact O-N 3.22Å; F289-L291 VanDerWaalsContact C-N 3.33Å; F289-L291 PolarHBondContact O-N 3.42Å; L291-R299 VanDerWaalsContact O-CD 3.26Å; L291-R299 WeakPolarHBondContact O-CD 3.31Å; L291-V302 HydrophobicContact CD2-CB 4.32Å; L291-V302 HydrophobicContact CD2-CG1 3.78Å; L291-V302 HydrophobicContact CG-CG1 3.98Å; L291-V303 HydrophobicContact CD2-CG2 3.65Å; L291-L306 HydrophobicContact CD1-CD1 3.64Å; L291-L306 HydrophobicContact CD2-CD1 3.96Å; L291-L306 HydrophobicContact CG-CD1 3.86Å; L291-L324 HydrophobicContact CD1-CD1 4.16Å; L291-C327 HydrophobicContact CD1-CB 4.15Å; L291-F328 HydrophobicContact CD1-CB 4Å; L291-R331 HydrophobicContact CD2-CG 3.91Å; L291-R331 PolarHBondContact O-NH1 2.91Å
292	K	94.8	Very high	94.5	Very high	113 Å²	113	45.1 Å²	45.1	49%	0.491	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	6.3	177.6	-55	163.7	-166.8	170.6	0	112.3	E288 F289 K290 C327	E288-K292 WeakPolarHBondContact O-CE 3.46Å; E288-K292 WeakPolarHBondContact O-CG 3.41Å; E288-K292 WeakPolarHBondContact OE1-CE 3.44Å; E288-K292 IonicContact OE1-NZ 2.7Å; E288-K292 PolarHBondContact OE1-NZ 3.34Å; F289-K292 WeakPolarHBondContact O-CA 3.28Å; F289-K292 WeakPolarHBondContact O-CB 3.41Å; F289-K292 PolarHBondContact O-N 2.92Å; K290-K292 PolarHBondContact O-N 2.94Å; K290-K292 VanDerWaalsContact O-N 3.11Å; K292-C327 VanDerWaalsContact CE-SG 3.59Å
293	S	94.2	Very high	94.8	Very high	27 Å²	27	42.4 Å²	42.4	19%	0.189	22%	0.219	C	C	.	.			trans	-59.9	147.1	174.7	-174.8	0	0	0	0	111.3	F289 K290 D295 E298 R299	F289-S293 PolarHBondContact O-N 2.9Å; K290-S293 VanDerWaalsContact O-CB 3.24Å; K290-S293 WeakPolarHBondContact O-CB 3.29Å; K290-S293 PolarHBondContact O-N 3.16Å; S293-D295 VanDerWaalsContact C-N 3.33Å; S293-D295 PolarHBondContact OG-N 2.96Å; S293-E298 VanDerWaalsContact CB-OE2 3.26Å; S293-E298 WeakPolarHBondContact CB-OE2 3.33Å; S293-E298 PolarHBondContact OG-OE2 3.18Å; S293-R299 WeakPolarHBondContact O-CD 3.42Å; S293-R299 WeakPolarHBondContact O-CG 3.49Å; S293-R299 PolarHBondContact O-NH1 3.35Å
294	N	93.7	Very high	94.9	Very high	161 Å²	161	47.9 Å²	47.9	86%	0.861	24%	0.24	S	C	*	.	S	Bend	trans	-72.3	-27.5	176.8	-70	-39.1	0	0	0	112.2	R299	N294-R299 PolarHBondContact O-NH1 3.01Å
295	D	94.7	Very high	95	Very high	82 Å²	82	47.7 Å²	47.7	44%	0.439	24%	0.239	S	C	.	.			trans	-72.2	131.2	177.9	178.5	25.6	0	0	0	112.2	S293 E297 E298 R299	S293-D295 VanDerWaalsContact C-N 3.33Å; S293-D295 PolarHBondContact OG-N 2.96Å; D295-E297 PolarHBondContact OD1-N 3.29Å; D295-E298 HydrophobicContact CB-CB 4.13Å; D295-E298 HydrophobicContact CB-CG 4.09Å; D295-E298 WeakPolarHBondContact OD2-CG 3.3Å; D295-E298 PolarHBondContact OD2-N 2.98Å; D295-R299 VanDerWaalsContact C-NH1 3.31Å; D295-R299 WeakPolarHBondContact O-CG 3.45Å; D295-R299 PolarHBondContact O-N 3.11Å; D295-R299 PolarHBondContact O-NH1 3.42Å
296	G	95	Very high	95.1	Very high	13 Å²	13	44.1 Å²	44.1	13%	0.134	22%	0.216	C	C	.	.	H	α-helix	trans	-72	-25.2	178.3	0	0	0	0	0	114	L300 H336	G296-L300 WeakPolarHBondContact O-CB 3.48Å; G296-L300 PolarHBondContact O-N 2.86Å; G296-H336 PolarHBondContact O-ND1 3.24Å; G296-H336 VanDerWaalsContact O-ND1 3.1Å
297	E	95.6	Very high	95.3	Very high	97 Å²	97	44 Å²	44	45%	0.453	22%	0.218	S	C	.	.	H	α-helix	trans	-85.2	-40.9	177.1	-71.5	-58.4	132.5	0	0	112.2	D295 R299 L300 A301 H336	D295-E297 PolarHBondContact OD1-N 3.29Å; E297-R299 VanDerWaalsContact C-N 3.33Å; E297-R299 PolarHBondContact O-N 3.12Å; E297-L300 WeakPolarHBondContact O-CB 3.43Å; E297-L300 PolarHBondContact O-N 3.11Å; E297-L300 VanDerWaalsContact O-N 3.11Å; E297-A301 PolarHBondContact O-N 3.18Å; E297-H336 IonicContact OE1-CE1 3.72Å; E297-H336 PolarHBondContact OE1-CE1 3.1Å
298	E	92.7	Very high	95.2	Very high	67 Å²	67	48.9 Å²	48.9	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-53.8	-48.7	167.4	-74.5	-156.3	142.3	0	0	112	K290 S293 D295 L300 A301 V302	K290-E298 WeakPolarHBondContact CD-OE2 3.28Å; K290-E298 IonicContact NZ-OE1 2.71Å; K290-E298 PolarHBondContact NZ-OE1 3.12Å; K290-E298 IonicContact NZ-OE2 3.96Å; K290-E298 PolarHBondContact NZ-OE2 3.3Å; S293-E298 VanDerWaalsContact CB-OE2 3.26Å; S293-E298 WeakPolarHBondContact CB-OE2 3.33Å; S293-E298 PolarHBondContact OG-OE2 3.18Å; D295-E298 HydrophobicContact CB-CB 4.13Å; D295-E298 HydrophobicContact CB-CG 4.09Å; D295-E298 WeakPolarHBondContact OD2-CG 3.3Å; D295-E298 PolarHBondContact OD2-N 2.98Å; E298-L300 VanDerWaalsContact C-N 3.29Å; E298-L300 PolarHBondContact O-N 2.73Å; E298-A301 PolarHBondContact O-N 3.3Å; E298-V302 WeakPolarHBondContact O-CG2 3.45Å; E298-V302 PolarHBondContact O-N 3.4Å
299	R	96.7	Very high	95.2	Very high	13 Å²	13	47 Å²	47	5%	0.049	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-38.2	176.6	-71.7	-161.8	-50.1	-73.7	-1.1	111.9	L291 S293 N294 D295 E297 V303 D334 V339	L291-R299 VanDerWaalsContact O-CD 3.26Å; L291-R299 WeakPolarHBondContact O-CD 3.31Å; S293-R299 WeakPolarHBondContact O-CD 3.42Å; S293-R299 WeakPolarHBondContact O-CG 3.49Å; S293-R299 PolarHBondContact O-NH1 3.35Å; N294-R299 PolarHBondContact O-NH1 3.01Å; D295-R299 VanDerWaalsContact C-NH1 3.31Å; D295-R299 WeakPolarHBondContact O-CG 3.45Å; D295-R299 PolarHBondContact O-N 3.11Å; D295-R299 PolarHBondContact O-NH1 3.42Å; E297-R299 VanDerWaalsContact C-N 3.33Å; E297-R299 PolarHBondContact O-N 3.12Å; R299-V303 WeakPolarHBondContact O-CB 3.12Å; R299-V303 VanDerWaalsContact O-CG2 3.28Å; R299-V303 WeakPolarHBondContact O-CG2 3.45Å; R299-V303 PolarHBondContact O-N 3.02Å; R299-D334 WeakPolarHBondContact CD-OD2 3.24Å; R299-D334 IonicContact CZ-OD1 2.75Å; R299-D334 IonicContact CZ-OD2 3.21Å; R299-D334 IonicContact NE-OD1 3.29Å; R299-D334 PolarHBondContact NE-OD1 2.78Å; R299-D334 IonicContact NE-OD2 2.63Å; R299-D334 PolarHBondContact NE-OD2 2.9Å; R299-D334 IonicContact NH2-OD1 3.04Å; R299-D334 PolarHBondContact NH2-OD1 2.71Å; R299-D334 IonicContact NH2-OD2 2.81Å; R299-V339 HydrophobicContact CB-CG2 4.4Å
300	L	97.5	Very high	95.3	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-41.8	177.6	-177.7	60.2	0	0	0	112.3	G296 E297 E298 V303 R304 P338 V339 E342	G296-L300 WeakPolarHBondContact O-CB 3.48Å; G296-L300 PolarHBondContact O-N 2.86Å; E297-L300 WeakPolarHBondContact O-CB 3.43Å; E297-L300 PolarHBondContact O-N 3.11Å; E297-L300 VanDerWaalsContact O-N 3.11Å; E298-L300 VanDerWaalsContact C-N 3.29Å; E298-L300 PolarHBondContact O-N 2.73Å; L300-V303 PolarHBondContact O-N 3.3Å; L300-R304 WeakPolarHBondContact O-CB 3.32Å; L300-R304 WeakPolarHBondContact O-CG 3.32Å; L300-R304 PolarHBondContact O-N 3.1Å; L300-P338 HydrophobicContact CD1-CB 4.03Å; L300-P338 HydrophobicContact CD2-CB 3.7Å; L300-P338 HydrophobicContact CG-CB 4.49Å; L300-V339 HydrophobicContact CB-CG2 3.92Å; L300-V339 HydrophobicContact CD1-CG2 4.19Å; L300-E342 HydrophobicContact CD1-CB 4.15Å
301	A	95	Very high	95.2	Very high	27 Å²	27	40.9 Å²	40.9	22%	0.223	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-45.8	177.1	0	0	0	0	0	111.7	F266 E297 E298 R304 L305	F266-A301 HydrophobicContact CD2-CB 4.39Å; F266-A301 HydrophobicContact CE2-CB 3.66Å; F266-A301 HydrophobicContact CZ-CB 4Å; E297-A301 PolarHBondContact O-N 3.18Å; E298-A301 PolarHBondContact O-N 3.3Å; A301-R304 PolarHBondContact O-N 3.33Å; A301-L305 PolarHBondContact O-N 3.28Å
302	V	96.2	Very high	95	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-68.7	-35.3	177.1	177.7	0	0	0	0	112.1	F266 L287 K290 L291 E298 L305 L306	F266-V302 HydrophobicContact CE1-CG2 4.13Å; F266-V302 HydrophobicContact CZ-CG2 4.32Å; L287-V302 HydrophobicContact CB-CG1 4.28Å; L287-V302 HydrophobicContact CD2-CG1 4.24Å; K290-V302 HydrophobicContact CB-CG2 3.68Å; K290-V302 HydrophobicContact CG-CG2 4.49Å; L291-V302 HydrophobicContact CD2-CB 4.32Å; L291-V302 HydrophobicContact CD2-CG1 3.78Å; L291-V302 HydrophobicContact CG-CG1 3.98Å; E298-V302 WeakPolarHBondContact O-CG2 3.45Å; E298-V302 PolarHBondContact O-N 3.4Å; V302-L305 PolarHBondContact O-N 3.09Å; V302-L306 HydrophobicContact CG1-CD1 3.78Å; V302-L306 HydrophobicContact CG1-CG 4.24Å; V302-L306 WeakPolarHBondContact O-CB 3.48Å; V302-L306 WeakPolarHBondContact O-CG 3.33Å; V302-L306 PolarHBondContact O-N 3.11Å
303	V	97.5	Very high	94.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.5	-41	172.1	164.6	0	0	0	0	111.9	L291 R299 L300 L305 L306 A307 F328 R331 V339 E342	L291-V303 HydrophobicContact CD2-CG2 3.65Å; R299-V303 WeakPolarHBondContact O-CB 3.12Å; R299-V303 VanDerWaalsContact O-CG2 3.28Å; R299-V303 WeakPolarHBondContact O-CG2 3.45Å; R299-V303 PolarHBondContact O-N 3.02Å; L300-V303 PolarHBondContact O-N 3.3Å; V303-L305 VanDerWaalsContact C-N 3.34Å; V303-L305 PolarHBondContact O-N 3.35Å; V303-L306 PolarHBondContact O-N 2.78Å; V303-A307 WeakPolarHBondContact O-CB 3.47Å; V303-A307 PolarHBondContact O-N 2.62Å; V303-F328 HydrophobicContact CB-CE2 4.41Å; V303-F328 HydrophobicContact CG1-CE2 4.06Å; V303-F328 HydrophobicContact CG2-CD2 4.42Å; V303-F328 HydrophobicContact CG2-CE2 4.35Å; V303-R331 HydrophobicContact CG2-CB 3.91Å; V303-R331 HydrophobicContact CG2-CG 3.65Å; V303-V339 HydrophobicContact CG2-CG1 4.01Å; V303-E342 HydrophobicContact CG1-CB 4.23Å; V303-E342 HydrophobicContact CG1-CG 4.45Å
304	R	96.9	Very high	94.4	Very high	116 Å²	116	51.2 Å²	51.2	44%	0.438	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-40.9	173.2	-77.2	173	176.1	148.8	2.2	112.3	L300 A301 K308 E342	L300-R304 WeakPolarHBondContact O-CB 3.32Å; L300-R304 WeakPolarHBondContact O-CG 3.32Å; L300-R304 PolarHBondContact O-N 3.1Å; A301-R304 PolarHBondContact O-N 3.33Å; R304-K308 WeakPolarHBondContact O-CG 3.4Å; R304-K308 PolarHBondContact O-N 2.92Å; R304-E342 HydrophobicContact CG-CG 3.79Å
305	L	95.5	Very high	94.3	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-64.4	-55.8	175.2	173.9	60	0	0	0	111.1	F266 I269 Q270 L287 A301 V302 V303 A307 K308 L309	F266-L305 HydrophobicContact CB-CD2 4.39Å; F266-L305 HydrophobicContact CD1-CD2 3.75Å; F266-L305 HydrophobicContact CG-CD2 4.45Å; F266-L305 WeakPolarHBondContact O-CD1 3.48Å; I269-L305 HydrophobicContact CB-CD2 4.12Å; I269-L305 HydrophobicContact CD1-CD2 4.12Å; I269-L305 HydrophobicContact CG2-CD1 4.28Å; I269-L305 HydrophobicContact CG2-CD2 3.86Å; Q270-L305 HydrophobicContact CB-CD1 4.25Å; L287-L305 HydrophobicContact CD1-CD2 4.22Å; L287-L305 HydrophobicContact CD2-CD2 4.12Å; A301-L305 PolarHBondContact O-N 3.28Å; V302-L305 PolarHBondContact O-N 3.09Å; V303-L305 VanDerWaalsContact C-N 3.34Å; V303-L305 PolarHBondContact O-N 3.35Å; L305-A307 VanDerWaalsContact C-N 3.27Å; L305-A307 PolarHBondContact O-N 2.83Å; L305-K308 WeakPolarHBondContact O-CB 3.33Å; L305-K308 PolarHBondContact O-N 3.34Å; L305-L309 HydrophobicContact CD1-CD1 4.32Å; L305-L309 HydrophobicContact CD1-CD2 4.26Å; L305-L309 HydrophobicContact CD1-CG 4.17Å; L305-L309 HydrophobicContact CG-CD1 4.31Å; L305-L309 HydrophobicContact CG-CG 4.43Å; L305-L309 PolarHBondContact O-N 2.73Å; L305-L309 VanDerWaalsContact O-N 3.08Å
306	L	96.4	Very high	94.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-32.4	-177.3	-70.4	172.8	0	0	0	112.4	L287 L291 V302 V303 K308 L309 F310 L324 F328	L287-L306 HydrophobicContact CD1-CD2 4.04Å; L291-L306 HydrophobicContact CD1-CD1 3.64Å; L291-L306 HydrophobicContact CD2-CD1 3.96Å; L291-L306 HydrophobicContact CG-CD1 3.86Å; V302-L306 HydrophobicContact CG1-CD1 3.78Å; V302-L306 HydrophobicContact CG1-CG 4.24Å; V302-L306 WeakPolarHBondContact O-CB 3.48Å; V302-L306 WeakPolarHBondContact O-CG 3.33Å; V302-L306 PolarHBondContact O-N 3.11Å; V303-L306 PolarHBondContact O-N 2.78Å; L306-K308 VanDerWaalsContact C-N 3.29Å; L306-K308 PolarHBondContact O-N 2.87Å; L306-L309 HydrophobicContact CD2-CD1 4.34Å; L306-L309 PolarHBondContact O-N 3.46Å; L306-L309 VanDerWaalsContact O-N 3.16Å; L306-F310 HydrophobicContact CB-CD2 4.02Å; L306-F310 HydrophobicContact CB-CE2 4.06Å; L306-F310 HydrophobicContact CD2-CE2 4.07Å; L306-F310 HydrophobicContact CG-CE2 4.48Å; L306-F310 WeakPolarHBondContact O-CB 3.47Å; L306-F310 VanDerWaalsContact O-CD2 3.27Å; L306-F310 WeakPolarHBondContact O-CD2 3.23Å; L306-F310 PolarHBondContact O-N 3.14Å; L306-L324 HydrophobicContact CD1-CD1 3.97Å; L306-L324 HydrophobicContact CD2-CD1 4.34Å; L306-L324 HydrophobicContact CD2-CD2 3.92Å; L306-L324 HydrophobicContact CD2-CG 4.34Å; L306-F328 HydrophobicContact CB-CD2 3.55Å; L306-F328 HydrophobicContact CB-CE2 3.63Å; L306-F328 HydrophobicContact CB-CG 4.41Å; L306-F328 HydrophobicContact CD1-CD2 3.95Å; L306-F328 HydrophobicContact CG-CD2 4.42Å
307	A	96.2	Very high	94	Very high	15 Å²	15	43.7 Å²	43.7	12%	0.124	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-38.6	171.2	0	0	0	0	0	112.7	V303 L305 G311 F328 F346	V303-A307 WeakPolarHBondContact O-CB 3.47Å; V303-A307 PolarHBondContact O-N 2.62Å; L305-A307 VanDerWaalsContact C-N 3.27Å; L305-A307 PolarHBondContact O-N 2.83Å; A307-G311 WeakPolarHBondContact O-CA 3.32Å; A307-G311 PolarHBondContact O-N 3.45Å; A307-F328 HydrophobicContact CB-CZ 4.26Å; A307-F346 HydrophobicContact CB-CB 3.86Å; A307-F346 HydrophobicContact CB-CD2 3.93Å; A307-F346 HydrophobicContact CB-CG 4.18Å; A307-F346 WeakPolarHBondContact O-CD2 3.32Å
308	K	93.9	Very high	93.9	Very high	102 Å²	102	39.3 Å²	39.3	44%	0.443	20%	0.201	S	C	.	.	H	α-helix	trans	-69.9	-42.3	172.8	-60.2	173.7	-176.2	173.5	0	111.6	Q270 R304 L305 L306 S312	Q270-K308 HydrophobicContact CG-CD 4.47Å; R304-K308 WeakPolarHBondContact O-CG 3.4Å; R304-K308 PolarHBondContact O-N 2.92Å; L305-K308 WeakPolarHBondContact O-CB 3.33Å; L305-K308 PolarHBondContact O-N 3.34Å; L306-K308 VanDerWaalsContact C-N 3.29Å; L306-K308 PolarHBondContact O-N 2.87Å; K308-S312 WeakPolarHBondContact O-CB 3.43Å; K308-S312 PolarHBondContact O-N 2.86Å; K308-S312 VanDerWaalsContact O-N 3.1Å
309	L	94.5	Very high	93.9	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-45.8	-176.6	-57.2	-169.7	0	0	0	112.4	I269 Q270 F273 M284 L305 L306 S315 L317	I269-L309 HydrophobicContact CG2-CD1 4.18Å; Q270-L309 HydrophobicContact CG-CD2 4.5Å; F273-L309 HydrophobicContact CB-CD2 3.98Å; F273-L309 HydrophobicContact CD1-CD2 3.85Å; F273-L309 HydrophobicContact CG-CD2 3.97Å; M284-L309 HydrophobicContact CE-CD1 4.5Å; L305-L309 HydrophobicContact CD1-CD1 4.32Å; L305-L309 HydrophobicContact CD1-CD2 4.26Å; L305-L309 HydrophobicContact CD1-CG 4.17Å; L305-L309 HydrophobicContact CG-CD1 4.31Å; L305-L309 HydrophobicContact CG-CG 4.43Å; L305-L309 PolarHBondContact O-N 2.73Å; L305-L309 VanDerWaalsContact O-N 3.08Å; L306-L309 HydrophobicContact CD2-CD1 4.34Å; L306-L309 PolarHBondContact O-N 3.46Å; L306-L309 VanDerWaalsContact O-N 3.16Å; L309-S315 WeakPolarHBondContact O-CB 3.32Å; L309-S315 PolarHBondContact O-OG 3.16Å; L309-L317 HydrophobicContact CB-CD2 3.93Å; L309-L317 HydrophobicContact CD1-CD2 4.44Å
310	F	95.3	Very high	93.6	Very high	3 Å²	3	45.5 Å²	45.5	1%	0.013	24%	0.237	C	C	.	.	H	α-helix	trans	-75.5	-21.8	175.2	-70.5	-62.2	0	0	0	113.5	L306 L317 A318 L324 W325 F328 F346 H354	L306-F310 HydrophobicContact CB-CD2 4.02Å; L306-F310 HydrophobicContact CB-CE2 4.06Å; L306-F310 HydrophobicContact CD2-CE2 4.07Å; L306-F310 HydrophobicContact CG-CE2 4.48Å; L306-F310 WeakPolarHBondContact O-CB 3.47Å; L306-F310 VanDerWaalsContact O-CD2 3.27Å; L306-F310 WeakPolarHBondContact O-CD2 3.23Å; L306-F310 PolarHBondContact O-N 3.14Å; F310-L317 HydrophobicContact CD1-CB 3.92Å; F310-L317 HydrophobicContact CD1-CD2 4.08Å; F310-L317 HydrophobicContact CD1-CG 4.02Å; F310-L317 HydrophobicContact CE1-CB 3.87Å; F310-L317 HydrophobicContact CE1-CD2 3.83Å; F310-L317 HydrophobicContact CE1-CG 3.54Å; F310-L317 HydrophobicContact CZ-CD2 4.08Å; F310-L317 HydrophobicContact CZ-CG 4.11Å; F310-A318 HydrophobicContact CD1-CB 4.06Å; F310-A318 HydrophobicContact CE1-CB 4.17Å; F310-L324 HydrophobicContact CE2-CG 4.45Å; F310-L324 HydrophobicContact CZ-CD2 4.3Å; F310-L324 HydrophobicContact CZ-CG 4.03Å; F310-W325 HydrophobicContact CB-CE3 4.4Å; F310-W325 HydrophobicContact CB-CZ3 4.02Å; F310-W325 HydrophobicContact CD1-CD2 4.48Å; F310-W325 AromaticContact CD1-CE3 3.64Å; F310-W325 HydrophobicContact CD1-CE3 3.64Å; F310-W325 HydrophobicContact CD1-CZ3 4.1Å; F310-W325 AromaticContact CD2-CE3 3.88Å; F310-W325 HydrophobicContact CD2-CE3 3.88Å; F310-W325 HydrophobicContact CD2-CZ3 4.11Å; F310-W325 HydrophobicContact CE1-CB 3.93Å; F310-W325 HydrophobicContact CE1-CD2 4.32Å; F310-W325 AromaticContact CE1-CE3 3.73Å; F310-W325 HydrophobicContact CE1-CE3 3.73Å; F310-W325 HydrophobicContact CE1-CG 4.45Å; F310-W325 AromaticContact CE2-CE3 3.97Å; F310-W325 HydrophobicContact CE2-CE3 3.97Å; F310-W325 AromaticContact CG-CE3 3.74Å; F310-W325 HydrophobicContact CG-CE3 3.74Å; F310-W325 AromaticContact CG-CZ3 3.85Å; F310-W325 HydrophobicContact CG-CZ3 3.85Å; F310-W325 HydrophobicContact CZ-CB 3.95Å; F310-W325 AromaticContact CZ-CE3 3.9Å; F310-W325 HydrophobicContact CZ-CE3 3.9Å; F310-F328 AromaticContact CD2-CD1 3.81Å; F310-F328 HydrophobicContact CD2-CD1 3.81Å; F310-F328 HydrophobicContact CD2-CD2 4.4Å; F310-F328 HydrophobicContact CD2-CE1 4.06Å; F310-F328 AromaticContact CD2-CG 3.99Å; F310-F328 HydrophobicContact CD2-CG 3.99Å; F310-F328 HydrophobicContact CD2-CZ 4.47Å; F310-F328 HydrophobicContact CE2-CB 3.85Å; F310-F328 AromaticContact CE2-CD1 3.97Å; F310-F328 HydrophobicContact CE2-CD1 3.97Å; F310-F328 HydrophobicContact CE2-CD2 4.35Å; F310-F328 AromaticContact CE2-CG 3.8Å; F310-F328 HydrophobicContact CE2-CG 3.8Å; F310-F346 HydrophobicContact CB-CE2 3.65Å; F310-F346 HydrophobicContact CB-CZ 3.83Å; F310-H354 PolarHBondContact O-CD2 2.68Å; F310-H354 PolarHBondContact O-NE2 3.32Å
311	G	92	Very high	93.4	Very high	9 Å²	9	47 Å²	47	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-95.2	-5.8	-177.6	0	0	0	0	0	114.7	A307 N353	A307-G311 WeakPolarHBondContact O-CA 3.32Å; A307-G311 PolarHBondContact O-N 3.45Å; G311-N353 PolarHBondContact O-ND2 2.74Å
312	S	90.4	Very high	93.3	Very high	60 Å²	60	50.4 Å²	50.4	42%	0.42	25%	0.252	S	S	.	.	S	Bend	trans	-72	127.6	176.3	-177	0	0	0	0	110.3	K308 D314 S315 H354	K308-S312 WeakPolarHBondContact O-CB 3.43Å; K308-S312 PolarHBondContact O-N 2.86Å; K308-S312 VanDerWaalsContact O-N 3.1Å; S312-D314 PolarHBondContact O-N 2.76Å; S312-S315 WeakPolarHBondContact O-CB 3.16Å; S312-S315 PolarHBondContact O-N 3.04Å; S312-H354 PolarHBondContact O-CE1 2.95Å; S312-H354 PolarHBondContact O-NE2 3.18Å; S312-H354 VanDerWaalsContact O-NE2 3.13Å
313	K	88.8	Confident	93.3	Very high	149 Å²	149	54.1 Å²	54.1	65%	0.648	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-37.2	-169.1	-170	-167.5	172.8	-165.2	0	114.8	S315 H354	K313-S315 VanDerWaalsContact C-N 3.32Å; K313-H354 PolarHBondContact O-CE1 3.25Å
314	D	88.1	Confident	93.3	Very high	149 Å²	149	54.1 Å²	54.1	80%	0.797	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	16.6	-175.9	-47.1	-40.7	0	0	0	112.2	S312	S312-D314 PolarHBondContact O-N 2.76Å
315	S	91.2	Very high	93.2	Very high	15 Å²	15	48.6 Å²	48.6	11%	0.105	26%	0.255	C	S	.	.			trans	-87.2	135.3	-179	-167.6	0	0	0	0	112.9	L309 S312 K313 L317 H354	L309-S315 WeakPolarHBondContact O-CB 3.32Å; L309-S315 PolarHBondContact O-OG 3.16Å; S312-S315 WeakPolarHBondContact O-CB 3.16Å; S312-S315 PolarHBondContact O-N 3.04Å; K313-S315 VanDerWaalsContact C-N 3.32Å; S315-L317 PolarHBondContact OG-N 3.39Å; S315-H354 PolarHBondContact O-CE1 2.83Å
316	D	91	Very high	93.3	Very high	76 Å²	76	52.2 Å²	52.2	41%	0.406	27%	0.272	S	S	.	.			trans	-119.8	15.9	175.3	-177.3	47.8	0	0	0	111.2	A318 T319 Q320	D316-A318 PolarHBondContact O-N 2.98Å; D316-A318 VanDerWaalsContact O-N 3.16Å; D316-T319 WeakPolarHBondContact O-CB 3.47Å; D316-T319 PolarHBondContact O-N 3.46Å; D316-T319 WeakPolarHBondContact OD1-CB 3.46Å; D316-T319 PolarHBondContact OD1-OG1 2.86Å; D316-Q320 WeakPolarHBondContact O-CG 3.02Å; D316-Q320 PolarHBondContact O-N 2.66Å; D316-Q320 WeakPolarHBondContact OD2-CG 3.02Å; D316-Q320 PolarHBondContact OD2-NE2 3.08Å
317	L	92.8	Very high	93.3	Very high	6 Å²	6	53.1 Å²	53.1	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-29.4	-175.4	-174.8	59.7	0	0	0	113.1	F273 M284 L309 F310 S315 T319 N321	F273-L317 HydrophobicContact CE2-CB 4.36Å; F273-L317 HydrophobicContact CE2-CD1 4.21Å; F273-L317 HydrophobicContact CE2-CD2 4.2Å; F273-L317 HydrophobicContact CE2-CG 4.49Å; F273-L317 HydrophobicContact CZ-CB 4.01Å; F273-L317 HydrophobicContact CZ-CD2 4.3Å; M284-L317 HydrophobicContact CE-CD1 3.83Å; M284-L317 HydrophobicContact CE-CD2 4.14Å; M284-L317 HydrophobicContact CG-CD1 4.5Å; M284-L317 HydrophobicContact SD-CD1 4.01Å; M284-L317 HydrophobicContact SD-CD2 4.25Å; L309-L317 HydrophobicContact CB-CD2 3.93Å; L309-L317 HydrophobicContact CD1-CD2 4.44Å; F310-L317 HydrophobicContact CD1-CB 3.92Å; F310-L317 HydrophobicContact CD1-CD2 4.08Å; F310-L317 HydrophobicContact CD1-CG 4.02Å; F310-L317 HydrophobicContact CE1-CB 3.87Å; F310-L317 HydrophobicContact CE1-CD2 3.83Å; F310-L317 HydrophobicContact CE1-CG 3.54Å; F310-L317 HydrophobicContact CZ-CD2 4.08Å; F310-L317 HydrophobicContact CZ-CG 4.11Å; S315-L317 PolarHBondContact OG-N 3.39Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-T319 PolarHBondContact O-N 3.29Å; L317-N321 HydrophobicContact CD1-CB 4.11Å; L317-N321 PolarHBondContact O-N 2.84Å
318	A	93.4	Very high	93.4	Very high	6 Å²	6	52.4 Å²	52.4	5%	0.05	27%	0.272	C	S	.	.	H	α-helix	trans	-71.1	-22.9	177.7	0	0	0	0	0	113.6	F310 D316 R322 W325 L357	F310-A318 HydrophobicContact CD1-CB 4.06Å; F310-A318 HydrophobicContact CE1-CB 4.17Å; D316-A318 PolarHBondContact O-N 2.98Å; D316-A318 VanDerWaalsContact O-N 3.16Å; A318-R322 WeakPolarHBondContact O-CD 3.46Å; A318-W325 HydrophobicContact CB-CB 4.35Å; A318-W325 HydrophobicContact CB-CD2 3.8Å; A318-W325 HydrophobicContact CB-CE3 4.24Å; A318-W325 HydrophobicContact CB-CG 3.85Å; A318-L357 HydrophobicContact CB-CD1 3.66Å; A318-L357 HydrophobicContact CB-CD2 4.03Å
319	T	91.8	Very high	93.6	Very high	93 Å²	93	47.6 Å²	47.6	57%	0.571	25%	0.251	S	S	*	.	H	α-helix	trans	-86.5	-48.6	172.3	-41.5	0	0	0	0	109.9	D316 L317	D316-T319 WeakPolarHBondContact O-CB 3.47Å; D316-T319 PolarHBondContact O-N 3.46Å; D316-T319 WeakPolarHBondContact OD1-CB 3.46Å; D316-T319 PolarHBondContact OD1-OG1 2.86Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-T319 PolarHBondContact O-N 3.29Å
320	Q	91	Very high	93.7	Very high	117 Å²	117	48.5 Å²	48.5	55%	0.547	26%	0.262	S	S	.	.	H	α-helix	trans	-69.2	-36.3	-174.5	-65.9	172.3	15.4	0	0	113.1	D316	D316-Q320 WeakPolarHBondContact O-CG 3.02Å; D316-Q320 PolarHBondContact O-N 2.66Å; D316-Q320 WeakPolarHBondContact OD2-CG 3.02Å; D316-Q320 PolarHBondContact OD2-NE2 3.08Å
321	N	93	Very high	93.8	Very high	32 Å²	32	50.8 Å²	50.8	17%	0.171	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	73	176.3	-164.3	-29.1	0	0	0	111.2	M284 L317 P323 L324 W325	M284-N321 WeakPolarHBondContact CB-ND2 3.41Å; L317-N321 HydrophobicContact CD1-CB 4.11Å; L317-N321 PolarHBondContact O-N 2.84Å; N321-P323 WeakPolarHBondContact OD1-CD 3.37Å; N321-L324 HydrophobicContact CB-CB 4.18Å; N321-L324 VanDerWaalsContact CG-CB 3.47Å; N321-L324 PolarHBondContact O-N 2.83Å; N321-L324 VanDerWaalsContact OD1-CB 3.25Å; N321-L324 WeakPolarHBondContact OD1-CB 3.42Å; N321-L324 PolarHBondContact OD1-N 3.34Å; N321-W325 PolarHBondContact O-N 3.43Å; N321-W325 VanDerWaalsContact O-N 3.07Å
322	R	94.2	Very high	94.1	Very high	99 Å²	99	50.4 Å²	50.4	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-57.3	-37.5	176.1	-159.9	72.6	-179.2	166.8	4.5	113.6	A318 W325 Q326 D360	A318-R322 WeakPolarHBondContact O-CD 3.46Å; R322-W325 PolarHBondContact O-N 3.07Å; R322-Q326 WeakPolarHBondContact O-CG 3.39Å; R322-Q326 PolarHBondContact O-N 3Å; R322-D360 IonicContact CZ-OD2 3.77Å; R322-D360 IonicContact NH1-OD2 2.69Å; R322-D360 PolarHBondContact NH1-OD2 3.19Å; R322-D360 VanDerWaalsContact NH2-CG 3.25Å; R322-D360 IonicContact NH2-OD1 2.72Å; R322-D360 PolarHBondContact NH2-OD1 3.05Å; R322-D360 IonicContact NH2-OD2 3.16Å; R322-D360 PolarHBondContact NH2-OD2 3.23Å
323	P	95.9	Very high	94.4	Very high	80 Å²	80	51.6 Å²	51.6	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-58.6	-50.4	173.5	-27.3	36.3	0	0	0	113.9	N321 W325 Q326 C327	N321-P323 WeakPolarHBondContact OD1-CD 3.37Å; P323-W325 VanDerWaalsContact C-N 3.31Å; P323-W325 PolarHBondContact O-N 3.21Å; P323-Q326 PolarHBondContact O-N 3.22Å; P323-C327 PolarHBondContact O-N 2.9Å
324	L	96.1	Very high	94.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.4	-41.6	176.9	178.7	63.3	0	0	0	111.4	M284 L287 E288 L291 L306 F310 N321 C327 F328	M284-L324 HydrophobicContact CB-CD2 4.11Å; M284-L324 HydrophobicContact CG-CD2 4.4Å; M284-L324 HydrophobicContact SD-CD2 3.73Å; L287-L324 HydrophobicContact CB-CD1 4.38Å; E288-L324 HydrophobicContact CB-CD1 3.82Å; E288-L324 HydrophobicContact CG-CD1 4.18Å; L291-L324 HydrophobicContact CD1-CD1 4.16Å; L306-L324 HydrophobicContact CD1-CD1 3.97Å; L306-L324 HydrophobicContact CD2-CD1 4.34Å; L306-L324 HydrophobicContact CD2-CD2 3.92Å; L306-L324 HydrophobicContact CD2-CG 4.34Å; F310-L324 HydrophobicContact CE2-CG 4.45Å; F310-L324 HydrophobicContact CZ-CD2 4.3Å; F310-L324 HydrophobicContact CZ-CG 4.03Å; N321-L324 HydrophobicContact CB-CB 4.18Å; N321-L324 VanDerWaalsContact CG-CB 3.47Å; N321-L324 PolarHBondContact O-N 2.83Å; N321-L324 VanDerWaalsContact OD1-CB 3.25Å; N321-L324 WeakPolarHBondContact OD1-CB 3.42Å; N321-L324 PolarHBondContact OD1-N 3.34Å; L324-C327 PolarHBondContact O-N 3.32Å; L324-F328 VanDerWaalsContact O-CB 3.29Å; L324-F328 WeakPolarHBondContact O-CB 3.44Å; L324-F328 PolarHBondContact O-N 3.46Å
325	W	96.7	Very high	95.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-45.5	175.6	175.2	-122.4	0	0	0	112.6	F310 A318 N321 R322 P323 F328 L329 F346 L357 D360 L361	F310-W325 HydrophobicContact CB-CE3 4.4Å; F310-W325 HydrophobicContact CB-CZ3 4.02Å; F310-W325 HydrophobicContact CD1-CD2 4.48Å; F310-W325 AromaticContact CD1-CE3 3.64Å; F310-W325 HydrophobicContact CD1-CE3 3.64Å; F310-W325 HydrophobicContact CD1-CZ3 4.1Å; F310-W325 AromaticContact CD2-CE3 3.88Å; F310-W325 HydrophobicContact CD2-CE3 3.88Å; F310-W325 HydrophobicContact CD2-CZ3 4.11Å; F310-W325 HydrophobicContact CE1-CB 3.93Å; F310-W325 HydrophobicContact CE1-CD2 4.32Å; F310-W325 AromaticContact CE1-CE3 3.73Å; F310-W325 HydrophobicContact CE1-CE3 3.73Å; F310-W325 HydrophobicContact CE1-CG 4.45Å; F310-W325 AromaticContact CE2-CE3 3.97Å; F310-W325 HydrophobicContact CE2-CE3 3.97Å; F310-W325 AromaticContact CG-CE3 3.74Å; F310-W325 HydrophobicContact CG-CE3 3.74Å; F310-W325 AromaticContact CG-CZ3 3.85Å; F310-W325 HydrophobicContact CG-CZ3 3.85Å; F310-W325 HydrophobicContact CZ-CB 3.95Å; F310-W325 AromaticContact CZ-CE3 3.9Å; F310-W325 HydrophobicContact CZ-CE3 3.9Å; A318-W325 HydrophobicContact CB-CB 4.35Å; A318-W325 HydrophobicContact CB-CD2 3.8Å; A318-W325 HydrophobicContact CB-CE3 4.24Å; A318-W325 HydrophobicContact CB-CG 3.85Å; N321-W325 PolarHBondContact O-N 3.43Å; N321-W325 VanDerWaalsContact O-N 3.07Å; R322-W325 PolarHBondContact O-N 3.07Å; P323-W325 VanDerWaalsContact C-N 3.31Å; P323-W325 PolarHBondContact O-N 3.21Å; W325-F328 AromaticContact CE3-CD1 3.89Å; W325-F328 HydrophobicContact CE3-CD1 3.89Å; W325-F328 AromaticContact CZ3-CD1 3.76Å; W325-F328 HydrophobicContact CZ3-CD1 3.76Å; W325-F328 AromaticContact CZ3-CE1 3.97Å; W325-F328 HydrophobicContact CZ3-CE1 3.97Å; W325-F328 PolarHBondContact O-N 2.79Å; W325-L329 HydrophobicContact CD2-CD1 4.16Å; W325-L329 HydrophobicContact CD2-CG 4.12Å; W325-L329 HydrophobicContact CE3-CG 4.39Å; W325-L329 HydrophobicContact CG-CD1 4.45Å; W325-L329 HydrophobicContact CH2-CD2 3.87Å; W325-L329 HydrophobicContact CH2-CG 4.33Å; W325-L329 HydrophobicContact CZ2-CD1 3.92Å; W325-L329 HydrophobicContact CZ2-CD2 3.82Å; W325-L329 HydrophobicContact CZ2-CG 4.03Å; W325-L329 HydrophobicContact CZ3-CD2 4.31Å; W325-L329 HydrophobicContact CZ3-CG 4.49Å; W325-L329 WeakPolarHBondContact O-CG 3.48Å; W325-L329 PolarHBondContact O-N 3.14Å; W325-F346 AromaticContact CH2-CE1 3.71Å; W325-F346 HydrophobicContact CH2-CE1 3.71Å; W325-F346 AromaticContact CH2-CZ 3.66Å; W325-F346 HydrophobicContact CH2-CZ 3.66Å; W325-F346 AromaticContact CZ3-CE1 3.78Å; W325-F346 HydrophobicContact CZ3-CE1 3.78Å; W325-F346 AromaticContact CZ3-CZ 3.55Å; W325-F346 HydrophobicContact CZ3-CZ 3.55Å; W325-L357 HydrophobicContact CH2-CD1 4.19Å; W325-L357 HydrophobicContact CZ2-CB 4.26Å; W325-L357 HydrophobicContact CZ2-CD1 3.98Å; W325-L357 HydrophobicContact CZ2-CD2 4.39Å; W325-L357 HydrophobicContact CZ2-CG 4.45Å; W325-D360 HydrophobicContact CZ2-CB 4.26Å; W325-D360 PolarHBondContact NE1-OD2 3.3Å; W325-L361 HydrophobicContact CH2-CD2 4.4Å
326	Q	96.4	Very high	95.6	Very high	81 Å²	81	46.7 Å²	46.7	38%	0.379	24%	0.244	S	C	.	.	H	α-helix	trans	-67.1	-37.6	176.3	-66.8	-61	-55.5	0	0	112.3	R322 P323 F328 L329 G330	R322-Q326 WeakPolarHBondContact O-CG 3.39Å; R322-Q326 PolarHBondContact O-N 3Å; P323-Q326 PolarHBondContact O-N 3.22Å; Q326-F328 VanDerWaalsContact C-N 3.33Å; Q326-F328 PolarHBondContact O-N 2.73Å; Q326-L329 PolarHBondContact O-N 3.02Å; Q326-G330 PolarHBondContact O-N 3.36Å
327	C	96.9	Very high	95.9	Very high	20 Å²	20	45.4 Å²	45.4	14%	0.135	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-37.8	174.7	-169.4	0	0	0	0	112.2	E288 L291 K292 P323 L324 G330	E288-C327 HydrophobicContact CG-CB 3.68Å; L291-C327 HydrophobicContact CD1-CB 4.15Å; K292-C327 VanDerWaalsContact CE-SG 3.59Å; P323-C327 PolarHBondContact O-N 2.9Å; L324-C327 PolarHBondContact O-N 3.32Å; C327-G330 PolarHBondContact O-N 3.34Å
328	F	97.8	Very high	96.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-47.1	174.3	175.5	-98.3	0	0	0	112	L291 V303 L306 A307 F310 L324 W325 Q326 G330 R331 F346	L291-F328 HydrophobicContact CD1-CB 4Å; V303-F328 HydrophobicContact CB-CE2 4.41Å; V303-F328 HydrophobicContact CG1-CE2 4.06Å; V303-F328 HydrophobicContact CG2-CD2 4.42Å; V303-F328 HydrophobicContact CG2-CE2 4.35Å; L306-F328 HydrophobicContact CB-CD2 3.55Å; L306-F328 HydrophobicContact CB-CE2 3.63Å; L306-F328 HydrophobicContact CB-CG 4.41Å; L306-F328 HydrophobicContact CD1-CD2 3.95Å; L306-F328 HydrophobicContact CG-CD2 4.42Å; A307-F328 HydrophobicContact CB-CZ 4.26Å; F310-F328 AromaticContact CD2-CD1 3.81Å; F310-F328 HydrophobicContact CD2-CD1 3.81Å; F310-F328 HydrophobicContact CD2-CD2 4.4Å; F310-F328 HydrophobicContact CD2-CE1 4.06Å; F310-F328 AromaticContact CD2-CG 3.99Å; F310-F328 HydrophobicContact CD2-CG 3.99Å; F310-F328 HydrophobicContact CD2-CZ 4.47Å; F310-F328 HydrophobicContact CE2-CB 3.85Å; F310-F328 AromaticContact CE2-CD1 3.97Å; F310-F328 HydrophobicContact CE2-CD1 3.97Å; F310-F328 HydrophobicContact CE2-CD2 4.35Å; F310-F328 AromaticContact CE2-CG 3.8Å; F310-F328 HydrophobicContact CE2-CG 3.8Å; L324-F328 VanDerWaalsContact O-CB 3.29Å; L324-F328 WeakPolarHBondContact O-CB 3.44Å; L324-F328 PolarHBondContact O-N 3.46Å; W325-F328 AromaticContact CE3-CD1 3.89Å; W325-F328 HydrophobicContact CE3-CD1 3.89Å; W325-F328 AromaticContact CZ3-CD1 3.76Å; W325-F328 HydrophobicContact CZ3-CD1 3.76Å; W325-F328 AromaticContact CZ3-CE1 3.97Å; W325-F328 HydrophobicContact CZ3-CE1 3.97Å; W325-F328 PolarHBondContact O-N 2.79Å; Q326-F328 VanDerWaalsContact C-N 3.33Å; Q326-F328 PolarHBondContact O-N 2.73Å; F328-G330 PolarHBondContact O-N 3.47Å; F328-R331 WeakPolarHBondContact O-CB 3.38Å; F328-R331 WeakPolarHBondContact O-CG 3.23Å; F328-R331 PolarHBondContact O-N 3.16Å; F328-F346 AromaticContact CE1-CD1 3.61Å; F328-F346 HydrophobicContact CE1-CD1 3.61Å; F328-F346 HydrophobicContact CE1-CD2 4.4Å; F328-F346 AromaticContact CE1-CE1 3.57Å; F328-F346 HydrophobicContact CE1-CE1 3.57Å; F328-F346 HydrophobicContact CE1-CE2 4.35Å; F328-F346 HydrophobicContact CE1-CG 4.04Å; F328-F346 AromaticContact CE1-CZ 3.95Å; F328-F346 HydrophobicContact CE1-CZ 3.95Å; F328-F346 HydrophobicContact CZ-CB 4.47Å; F328-F346 AromaticContact CZ-CD1 3.93Å; F328-F346 HydrophobicContact CZ-CD1 3.93Å; F328-F346 HydrophobicContact CZ-CD2 4.28Å; F328-F346 HydrophobicContact CZ-CE1 4.29Å; F328-F346 AromaticContact CZ-CG 3.92Å; F328-F346 HydrophobicContact CZ-CG 3.92Å
329	L	97.4	Very high	96.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-34.3	172.7	-73.4	177.1	0	0	0	112.3	W325 Q326 R331 F332 D360 L361 Y364	W325-L329 HydrophobicContact CD2-CD1 4.16Å; W325-L329 HydrophobicContact CD2-CG 4.12Å; W325-L329 HydrophobicContact CE3-CG 4.39Å; W325-L329 HydrophobicContact CG-CD1 4.45Å; W325-L329 HydrophobicContact CH2-CD2 3.87Å; W325-L329 HydrophobicContact CH2-CG 4.33Å; W325-L329 HydrophobicContact CZ2-CD1 3.92Å; W325-L329 HydrophobicContact CZ2-CD2 3.82Å; W325-L329 HydrophobicContact CZ2-CG 4.03Å; W325-L329 HydrophobicContact CZ3-CD2 4.31Å; W325-L329 HydrophobicContact CZ3-CG 4.49Å; W325-L329 WeakPolarHBondContact O-CG 3.48Å; W325-L329 PolarHBondContact O-N 3.14Å; Q326-L329 PolarHBondContact O-N 3.02Å; L329-R331 PolarHBondContact O-N 3.01Å; L329-R331 VanDerWaalsContact O-N 3.11Å; L329-F332 HydrophobicContact CD2-CD2 4.34Å; L329-F332 HydrophobicContact CD2-CE2 3.95Å; L329-F332 WeakPolarHBondContact O-CB 3.38Å; L329-F332 WeakPolarHBondContact O-CD2 3.29Å; L329-F332 PolarHBondContact O-N 2.64Å; L329-F332 VanDerWaalsContact O-N 3.1Å; L329-D360 HydrophobicContact CD1-CB 3.98Å; L329-L361 HydrophobicContact CD2-CD2 3.78Å; L329-Y364 HydrophobicContact CB-CD2 4.47Å; L329-Y364 HydrophobicContact CB-CE2 3.8Å; L329-Y364 HydrophobicContact CD1-CE2 4.12Å; L329-Y364 HydrophobicContact CD2-CD2 4.35Å; L329-Y364 HydrophobicContact CD2-CE2 4.34Å; L329-Y364 HydrophobicContact CG-CE2 4.32Å; L329-Y364 WeakPolarHBondContact O-CE1 3.27Å
330	G	97	Very high	96.7	Very high	23 Å²	23	44 Å²	44	24%	0.237	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-54.6	-26.8	170.8	0	0	0	0	0	114.5	Q326 C327 F328 F332 N333	Q326-G330 PolarHBondContact O-N 3.36Å; C327-G330 PolarHBondContact O-N 3.34Å; F328-G330 PolarHBondContact O-N 3.47Å; G330-F332 VanDerWaalsContact C-N 3.27Å; G330-F332 PolarHBondContact O-N 3.25Å; G330-N333 PolarHBondContact O-N 2.9Å
331	R	97.7	Very high	97	Very high	52 Å²	52	40.2 Å²	40.2	20%	0.196	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-71.8	-15.2	178.8	-58.4	-59.9	100.9	-168.4	12	114.2	L291 V303 F328 L329 N333 D334 V339	L291-R331 HydrophobicContact CD2-CG 3.91Å; L291-R331 PolarHBondContact O-NH1 2.91Å; V303-R331 HydrophobicContact CG2-CB 3.91Å; V303-R331 HydrophobicContact CG2-CG 3.65Å; F328-R331 WeakPolarHBondContact O-CB 3.38Å; F328-R331 WeakPolarHBondContact O-CG 3.23Å; F328-R331 PolarHBondContact O-N 3.16Å; L329-R331 PolarHBondContact O-N 3.01Å; L329-R331 VanDerWaalsContact O-N 3.11Å; R331-N333 PolarHBondContact O-N 3.35Å; R331-N333 VanDerWaalsContact O-N 3.14Å; R331-D334 IonicContact CZ-OD2 3.66Å; R331-D334 IonicContact NE-OD2 3.9Å; R331-D334 IonicContact NH1-OD2 2.63Å; R331-D334 PolarHBondContact NH1-OD2 3.19Å; R331-D334 VanDerWaalsContact O-CB 3.3Å; R331-D334 WeakPolarHBondContact O-CB 3.18Å; R331-D334 PolarHBondContact O-N 3.2Å; R331-V339 HydrophobicContact CB-CG1 3.97Å
332	F	98.1	Very high	97.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-59.1	-22.8	165.7	-78.4	-104.9	0	0	0	111.9	L329 G330 R340 S343 F346 A347 L361 Y364 L365 R368	L329-F332 HydrophobicContact CD2-CD2 4.34Å; L329-F332 HydrophobicContact CD2-CE2 3.95Å; L329-F332 WeakPolarHBondContact O-CB 3.38Å; L329-F332 WeakPolarHBondContact O-CD2 3.29Å; L329-F332 PolarHBondContact O-N 2.64Å; L329-F332 VanDerWaalsContact O-N 3.1Å; G330-F332 VanDerWaalsContact C-N 3.27Å; G330-F332 PolarHBondContact O-N 3.25Å; F332-R340 WeakPolarHBondContact O-CG 3.44Å; F332-S343 VanDerWaalsContact CE1-O 3.29Å; F332-S343 WeakPolarHBondContact CE1-O 3.32Å; F332-S343 WeakPolarHBondContact CZ-O 3.48Å; F332-F346 HydrophobicContact CE2-CD1 4.37Å; F332-F346 HydrophobicContact CZ-CD1 4.2Å; F332-A347 HydrophobicContact CE1-CB 4.23Å; F332-A347 HydrophobicContact CZ-CB 4.11Å; F332-L361 HydrophobicContact CE2-CD2 4.3Å; F332-L361 HydrophobicContact CZ-CD2 3.92Å; F332-Y364 HydrophobicContact CB-CD1 3.67Å; F332-Y364 HydrophobicContact CB-CG 4.02Å; F332-Y364 HydrophobicContact CG-CD1 4.29Å; F332-Y364 HydrophobicContact CG-CG 4.17Å; F332-L365 HydrophobicContact CE1-CD2 4.31Å; F332-R368 HydrophobicContact CD1-CG 4.24Å; F332-R368 VanDerWaalsContact O-CD 3.27Å; F332-R368 WeakPolarHBondContact O-CD 3.45Å; F332-R368 PolarHBondContact O-NE 3.02Å; F332-R368 PolarHBondContact O-NH1 3.08Å
333	N	97.6	Very high	97.4	Very high	85 Å²	85	35.9 Å²	35.9	46%	0.455	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-104.1	16	175.3	-66.2	-48.7	0	0	0	113.5	G330 R331 R368	G330-N333 PolarHBondContact O-N 2.9Å; R331-N333 PolarHBondContact O-N 3.35Å; R331-N333 VanDerWaalsContact O-N 3.14Å; N333-R368 PolarHBondContact OD1-NH1 3.26Å
334	D	98.1	Very high	97.5	Very high	6 Å²	6	32 Å²	32	3%	0.032	17%	0.168	C	C	.	.			trans	-61.3	147.6	179.6	-157.7	-71.7	0	0	0	112	R299 R331 H336 V339 R340	R299-D334 WeakPolarHBondContact CD-OD2 3.24Å; R299-D334 IonicContact CZ-OD1 2.75Å; R299-D334 IonicContact CZ-OD2 3.21Å; R299-D334 IonicContact NE-OD1 3.29Å; R299-D334 PolarHBondContact NE-OD1 2.78Å; R299-D334 IonicContact NE-OD2 2.63Å; R299-D334 PolarHBondContact NE-OD2 2.9Å; R299-D334 IonicContact NH2-OD1 3.04Å; R299-D334 PolarHBondContact NH2-OD1 2.71Å; R299-D334 IonicContact NH2-OD2 2.81Å; R331-D334 IonicContact CZ-OD2 3.66Å; R331-D334 IonicContact NE-OD2 3.9Å; R331-D334 IonicContact NH1-OD2 2.63Å; R331-D334 PolarHBondContact NH1-OD2 3.19Å; R331-D334 VanDerWaalsContact O-CB 3.3Å; R331-D334 WeakPolarHBondContact O-CB 3.18Å; R331-D334 PolarHBondContact O-N 3.2Å; D334-H336 PolarHBondContact O-N 3.04Å; D334-H336 WeakPolarHBondContact OD1-CB 3.37Å; D334-H336 PolarHBondContact OD1-N 3.26Å; D334-V339 HydrophobicContact CB-CB 3.97Å; D334-V339 HydrophobicContact CB-CG1 3.61Å; D334-R340 HydrophobicContact CB-CG 4.38Å; D334-R340 WeakPolarHBondContact O-CD 3.47Å; D334-R340 VanDerWaalsContact O-CG 3.29Å; D334-R340 WeakPolarHBondContact O-CG 3.25Å; D334-R340 PolarHBondContact O-NE 2.89Å
335	I	96.9	Very high	97.5	Very high	147 Å²	147	36 Å²	36	75%	0.754	19%	0.185	S	C	*	.	S	Bend	trans	-61.2	-36.2	174.1	56.7	176.8	0	0	0	111.5	V337 R340	I335-V337 PolarHBondContact O-N 3.3Å; I335-R340 PolarHBondContact O-NH2 2.95Å
336	H	97.8	Very high	97.4	Very high	57 Å²	57	36.2 Å²	36.2	26%	0.264	19%	0.187	S	C	.	.	S	Bend	trans	-77.8	119.5	-171.5	-162.7	-147.4	0	0	0	111.8	G296 E297 D334 V339 R340	G296-H336 PolarHBondContact O-ND1 3.24Å; G296-H336 VanDerWaalsContact O-ND1 3.1Å; E297-H336 IonicContact OE1-CE1 3.72Å; E297-H336 PolarHBondContact OE1-CE1 3.1Å; D334-H336 PolarHBondContact O-N 3.04Å; D334-H336 WeakPolarHBondContact OD1-CB 3.37Å; D334-H336 PolarHBondContact OD1-N 3.26Å; H336-V339 HydrophobicContact CB-CB 4.29Å; H336-V339 HydrophobicContact CB-CG2 3.87Å; H336-V339 WeakPolarHBondContact O-CB 3.36Å; H336-V339 PolarHBondContact O-N 3.09Å; H336-V339 VanDerWaalsContact O-N 3.09Å; H336-R340 PolarHBondContact O-N 3.23Å
337	V	98.2	Very high	97.4	Very high	49 Å²	49	32.3 Å²	32.3	30%	0.297	17%	0.168	S	C	.	.	H	α-helix	trans	-56.7	-44.8	-175.2	176.1	0	0	0	0	113.1	I335 V339 R340 L341 E373 I376	I335-V337 PolarHBondContact O-N 3.3Å; V337-V339 VanDerWaalsContact C-N 3.3Å; V337-V339 PolarHBondContact O-N 3.09Å; V337-R340 PolarHBondContact O-N 3.31Å; V337-L341 WeakPolarHBondContact O-CB 3.37Å; V337-L341 PolarHBondContact O-N 3.46Å; V337-E373 HydrophobicContact CG1-CG 4.01Å; V337-E373 HydrophobicContact CG2-CG 3.84Å; V337-I376 HydrophobicContact CG1-CD1 4.13Å
338	P	98.2	Very high	97.2	Very high	45 Å²	45	32 Å²	32	29%	0.292	17%	0.166	S	C	.	.	H	α-helix	trans	-58.7	-36.8	175.4	-26.7	37.3	0	0	0	113.9	L300 L341 E342	L300-P338 HydrophobicContact CD1-CB 4.03Å; L300-P338 HydrophobicContact CD2-CB 3.7Å; L300-P338 HydrophobicContact CG-CB 4.49Å; P338-L341 PolarHBondContact O-N 2.76Å; P338-E342 WeakPolarHBondContact O-CB 3.43Å; P338-E342 PolarHBondContact O-N 3.23Å
339	V	98.4	Very high	96.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.4	-44.2	179.7	178	0	0	0	0	110.7	R299 L300 V303 R331 D334 H336 V337 S343	R299-V339 HydrophobicContact CB-CG2 4.4Å; L300-V339 HydrophobicContact CB-CG2 3.92Å; L300-V339 HydrophobicContact CD1-CG2 4.19Å; V303-V339 HydrophobicContact CG2-CG1 4.01Å; R331-V339 HydrophobicContact CB-CG1 3.97Å; D334-V339 HydrophobicContact CB-CB 3.97Å; D334-V339 HydrophobicContact CB-CG1 3.61Å; H336-V339 HydrophobicContact CB-CB 4.29Å; H336-V339 HydrophobicContact CB-CG2 3.87Å; H336-V339 WeakPolarHBondContact O-CB 3.36Å; H336-V339 PolarHBondContact O-N 3.09Å; H336-V339 VanDerWaalsContact O-N 3.09Å; V337-V339 VanDerWaalsContact C-N 3.3Å; V337-V339 PolarHBondContact O-N 3.09Å; V339-S343 WeakPolarHBondContact O-CB 3.44Å; V339-S343 PolarHBondContact O-N 2.92Å; V339-S343 PolarHBondContact O-OG 3.03Å
340	R	98.1	Very high	96.8	Very high	31 Å²	31	37 Å²	37	12%	0.117	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-41.4	173.9	-72.4	-171.6	-91.7	135.5	0.5	112.4	F332 D334 I335 H336 V337 S343 V344 D371 I376	F332-R340 WeakPolarHBondContact O-CG 3.44Å; D334-R340 HydrophobicContact CB-CG 4.38Å; D334-R340 WeakPolarHBondContact O-CD 3.47Å; D334-R340 VanDerWaalsContact O-CG 3.29Å; D334-R340 WeakPolarHBondContact O-CG 3.25Å; D334-R340 PolarHBondContact O-NE 2.89Å; I335-R340 PolarHBondContact O-NH2 2.95Å; H336-R340 PolarHBondContact O-N 3.23Å; V337-R340 PolarHBondContact O-N 3.31Å; R340-S343 WeakPolarHBondContact O-CB 3.44Å; R340-S343 PolarHBondContact O-N 3.36Å; R340-V344 WeakPolarHBondContact O-CG2 3.18Å; R340-V344 PolarHBondContact O-N 3.07Å; R340-D371 IonicContact CZ-OD2 3.2Å; R340-D371 IonicContact NH1-OD1 3.63Å; R340-D371 PolarHBondContact NH1-OD1 3.34Å; R340-D371 IonicContact NH1-OD2 2.77Å; R340-D371 PolarHBondContact NH1-OD2 2.97Å; R340-I376 HydrophobicContact CB-CD1 3.6Å
341	L	97.4	Very high	96.7	Very high	37 Å²	37	36 Å²	36	19%	0.194	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-43.6	179	-167.2	72.8	0	0	0	111.4	V337 P338 V344 K345 A375 I376 D379	V337-L341 WeakPolarHBondContact O-CB 3.37Å; V337-L341 PolarHBondContact O-N 3.46Å; P338-L341 PolarHBondContact O-N 2.76Å; L341-V344 PolarHBondContact O-N 2.9Å; L341-K345 WeakPolarHBondContact O-CG 3.48Å; L341-K345 PolarHBondContact O-N 3.25Å; L341-K345 VanDerWaalsContact O-N 3.08Å; L341-A375 HydrophobicContact CD1-CB 4.31Å; L341-I376 HydrophobicContact CB-CG1 4.49Å; L341-I376 HydrophobicContact CD1-CG1 4.04Å; L341-D379 HydrophobicContact CD1-CB 4.13Å
342	E	97.7	Very high	96.5	Very high	40 Å²	40	34.8 Å²	34.8	19%	0.187	18%	0.176	C	C	.	.	H	α-helix	trans	-67	-38	176.9	-155.1	70.2	-176.4	0	0	112.1	L300 V303 R304 P338 V344 K345 F346	L300-E342 HydrophobicContact CD1-CB 4.15Å; V303-E342 HydrophobicContact CG1-CB 4.23Å; V303-E342 HydrophobicContact CG1-CG 4.45Å; R304-E342 HydrophobicContact CG-CG 3.79Å; P338-E342 WeakPolarHBondContact O-CB 3.43Å; P338-E342 PolarHBondContact O-N 3.23Å; E342-V344 VanDerWaalsContact C-N 3.31Å; E342-V344 PolarHBondContact O-N 3Å; E342-K345 PolarHBondContact O-N 3Å; E342-K345 IonicContact OE2-NZ 2.74Å; E342-K345 PolarHBondContact OE2-NZ 2.83Å; E342-F346 PolarHBondContact O-N 3.48Å
343	S	97.7	Very high	96.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-40.5	173	-55.5	0	0	0	0	111.9	F332 V339 R340 F346 A347	F332-S343 VanDerWaalsContact CE1-O 3.29Å; F332-S343 WeakPolarHBondContact CE1-O 3.32Å; F332-S343 WeakPolarHBondContact CZ-O 3.48Å; V339-S343 WeakPolarHBondContact O-CB 3.44Å; V339-S343 PolarHBondContact O-N 2.92Å; V339-S343 PolarHBondContact O-OG 3.03Å; R340-S343 WeakPolarHBondContact O-CB 3.44Å; R340-S343 PolarHBondContact O-N 3.36Å; S343-F346 WeakPolarHBondContact O-CB 3.47Å; S343-F346 PolarHBondContact O-N 2.95Å; S343-A347 PolarHBondContact O-N 3.04Å
344	V	97.5	Very high	96.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.2	-44.4	175.2	168.8	0	0	0	0	111.8	R340 L341 E342 F346 A347 R368 I376 D379 V380 T383	R340-V344 WeakPolarHBondContact O-CG2 3.18Å; R340-V344 PolarHBondContact O-N 3.07Å; L341-V344 PolarHBondContact O-N 2.9Å; E342-V344 VanDerWaalsContact C-N 3.31Å; E342-V344 PolarHBondContact O-N 3Å; V344-F346 VanDerWaalsContact C-N 3.3Å; V344-F346 PolarHBondContact O-N 3.32Å; V344-A347 WeakPolarHBondContact O-CB 3.48Å; V344-A347 PolarHBondContact O-N 3Å; V344-A347 VanDerWaalsContact O-N 3.11Å; V344-R368 HydrophobicContact CG2-CB 4.1Å; V344-R368 HydrophobicContact CG2-CG 3.93Å; V344-I376 HydrophobicContact CG2-CG2 4.35Å; V344-D379 HydrophobicContact CG1-CB 4.01Å; V344-V380 HydrophobicContact CB-CG2 4.48Å; V344-V380 HydrophobicContact CG1-CB 4.42Å; V344-V380 HydrophobicContact CG1-CG2 3.73Å; V344-V380 HydrophobicContact CG2-CG2 3.82Å; V344-T383 PolarHBondContact O-OG1 2.89Å
345	K	94.9	Very high	95.9	Very high	82 Å²	82	36.8 Å²	36.8	36%	0.357	19%	0.19	S	C	.	.	H	α-helix	trans	-59.1	-41.9	175.1	-64.8	174	-158.1	160.5	0	112.2	L341 E342 A347 S348	L341-K345 WeakPolarHBondContact O-CG 3.48Å; L341-K345 PolarHBondContact O-N 3.25Å; L341-K345 VanDerWaalsContact O-N 3.08Å; E342-K345 PolarHBondContact O-N 3Å; E342-K345 IonicContact OE2-NZ 2.74Å; E342-K345 PolarHBondContact OE2-NZ 2.83Å; K345-A347 VanDerWaalsContact C-N 3.26Å; K345-A347 PolarHBondContact O-N 3.34Å; K345-S348 WeakPolarHBondContact O-CB 3.43Å; K345-S348 PolarHBondContact O-N 3.28Å; K345-S348 VanDerWaalsContact O-N 3.14Å
346	F	96.1	Very high	95.7	Very high	5 Å²	5	34 Å²	34	2%	0.022	18%	0.176	C	C	.	.	H	α-helix	trans	-54.6	-42.5	175	159.6	-98.2	0	0	0	112	A307 F310 W325 F328 F332 E342 S343 V344 S348 H349 C350 L361	A307-F346 HydrophobicContact CB-CB 3.86Å; A307-F346 HydrophobicContact CB-CD2 3.93Å; A307-F346 HydrophobicContact CB-CG 4.18Å; A307-F346 WeakPolarHBondContact O-CD2 3.32Å; F310-F346 HydrophobicContact CB-CE2 3.65Å; F310-F346 HydrophobicContact CB-CZ 3.83Å; W325-F346 AromaticContact CH2-CE1 3.71Å; W325-F346 HydrophobicContact CH2-CE1 3.71Å; W325-F346 AromaticContact CH2-CZ 3.66Å; W325-F346 HydrophobicContact CH2-CZ 3.66Å; W325-F346 AromaticContact CZ3-CE1 3.78Å; W325-F346 HydrophobicContact CZ3-CE1 3.78Å; W325-F346 AromaticContact CZ3-CZ 3.55Å; W325-F346 HydrophobicContact CZ3-CZ 3.55Å; F328-F346 AromaticContact CE1-CD1 3.61Å; F328-F346 HydrophobicContact CE1-CD1 3.61Å; F328-F346 HydrophobicContact CE1-CD2 4.4Å; F328-F346 AromaticContact CE1-CE1 3.57Å; F328-F346 HydrophobicContact CE1-CE1 3.57Å; F328-F346 HydrophobicContact CE1-CE2 4.35Å; F328-F346 HydrophobicContact CE1-CG 4.04Å; F328-F346 AromaticContact CE1-CZ 3.95Å; F328-F346 HydrophobicContact CE1-CZ 3.95Å; F328-F346 HydrophobicContact CZ-CB 4.47Å; F328-F346 AromaticContact CZ-CD1 3.93Å; F328-F346 HydrophobicContact CZ-CD1 3.93Å; F328-F346 HydrophobicContact CZ-CD2 4.28Å; F328-F346 HydrophobicContact CZ-CE1 4.29Å; F328-F346 AromaticContact CZ-CG 3.92Å; F328-F346 HydrophobicContact CZ-CG 3.92Å; F332-F346 HydrophobicContact CE2-CD1 4.37Å; F332-F346 HydrophobicContact CZ-CD1 4.2Å; E342-F346 PolarHBondContact O-N 3.48Å; S343-F346 WeakPolarHBondContact O-CB 3.47Å; S343-F346 PolarHBondContact O-N 2.95Å; V344-F346 VanDerWaalsContact C-N 3.3Å; V344-F346 PolarHBondContact O-N 3.32Å; F346-S348 PolarHBondContact O-N 3.42Å; F346-S348 VanDerWaalsContact O-N 3.16Å; F346-H349 PolarHBondContact O-N 3.11Å; F346-C350 HydrophobicContact CD1-CB 4.41Å; F346-C350 HydrophobicContact CE1-CB 3.73Å; F346-C350 HydrophobicContact CE2-CB 3.88Å; F346-C350 HydrophobicContact CZ-CB 3.44Å; F346-C350 VanDerWaalsContact CZ-CB 3.44Å; F346-C350 PolarHBondContact O-N 3.4Å; F346-L361 HydrophobicContact CE1-CD2 4.15Å
347	A	96.5	Very high	95.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.6	-30.4	-179.2	0	0	0	0	0	112.8	F332 S343 V344 K345 C350 L351 L361 L365 T383	F332-A347 HydrophobicContact CE1-CB 4.23Å; F332-A347 HydrophobicContact CZ-CB 4.11Å; S343-A347 PolarHBondContact O-N 3.04Å; V344-A347 WeakPolarHBondContact O-CB 3.48Å; V344-A347 PolarHBondContact O-N 3Å; V344-A347 VanDerWaalsContact O-N 3.11Å; K345-A347 VanDerWaalsContact C-N 3.26Å; K345-A347 PolarHBondContact O-N 3.34Å; A347-C350 PolarHBondContact O-N 3.35Å; A347-L351 WeakPolarHBondContact O-CB 3.34Å; A347-L351 VanDerWaalsContact O-CG 3.23Å; A347-L351 WeakPolarHBondContact O-CG 3.41Å; A347-L351 PolarHBondContact O-N 2.8Å; A347-L361 HydrophobicContact CB-CD1 4.09Å; A347-L361 HydrophobicContact CB-CD2 4.35Å; A347-L365 HydrophobicContact CB-CD1 4.2Å; A347-L365 HydrophobicContact CB-CD2 4.03Å; A347-L365 HydrophobicContact CB-CG 4.47Å; A347-T383 HydrophobicContact CB-CG2 4.01Å
348	S	91.4	Very high	95.2	Very high	13 Å²	13	29.9 Å²	29.9	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-47.2	174	-170	0	0	0	0	111.9	K345 F346 M352	K345-S348 WeakPolarHBondContact O-CB 3.43Å; K345-S348 PolarHBondContact O-N 3.28Å; K345-S348 VanDerWaalsContact O-N 3.14Å; F346-S348 PolarHBondContact O-N 3.42Å; F346-S348 VanDerWaalsContact O-N 3.16Å; S348-M352 VanDerWaalsContact O-CB 3.3Å; S348-M352 WeakPolarHBondContact O-CB 3.36Å; S348-M352 VanDerWaalsContact O-CE 3.24Å; S348-M352 WeakPolarHBondContact O-CE 3.47Å; S348-M352 WeakPolarHBondContact O-CG 3.49Å; S348-M352 PolarHBondContact O-N 3.44Å
349	H	91.1	Very high	95	Very high	106 Å²	106	34.6 Å²	34.6	49%	0.491	17%	0.172	S	C	.	.	H	α-helix	trans	-67.7	-38.4	175.5	-64.1	-71.8	0	0	0	112.2	F346 M352 N353	F346-H349 PolarHBondContact O-N 3.11Å; H349-M352 PolarHBondContact O-N 2.66Å; H349-N353 VanDerWaalsContact O-CB 3.31Å; H349-N353 WeakPolarHBondContact O-CB 3.49Å; H349-N353 PolarHBondContact O-N 3.15Å
350	C	95.4	Very high	94.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.6	-50.4	179.9	-168.8	0	0	0	0	112.1	F346 A347 M352 N353 H354 L361	F346-C350 HydrophobicContact CD1-CB 4.41Å; F346-C350 HydrophobicContact CE1-CB 3.73Å; F346-C350 HydrophobicContact CE2-CB 3.88Å; F346-C350 HydrophobicContact CZ-CB 3.44Å; F346-C350 VanDerWaalsContact CZ-CB 3.44Å; F346-C350 PolarHBondContact O-N 3.4Å; A347-C350 PolarHBondContact O-N 3.35Å; C350-M352 PolarHBondContact O-N 2.97Å; C350-N353 PolarHBondContact O-N 3.16Å; C350-N353 VanDerWaalsContact O-N 3.11Å; C350-H354 CarbonylContact O-C 3.58Å; C350-H354 WeakPolarHBondContact O-CA 3.29Å; C350-H354 PolarHBondContact O-N 2.96Å; C350-L361 HydrophobicContact CB-CD1 3.86Å
351	L	94.9	Very high	94.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-55.3	-35.3	173.1	-69.6	172.1	0	0	0	112.1	A347 A358 L361 L365 T383 A387 L399	A347-L351 WeakPolarHBondContact O-CB 3.34Å; A347-L351 VanDerWaalsContact O-CG 3.23Å; A347-L351 WeakPolarHBondContact O-CG 3.41Å; A347-L351 PolarHBondContact O-N 2.8Å; L351-A358 HydrophobicContact CD2-CB 3.44Å; L351-A358 VanDerWaalsContact CD2-CB 3.44Å; L351-L361 HydrophobicContact CD2-CD1 4.06Å; L351-L361 HydrophobicContact CG-CD1 4.04Å; L351-L365 HydrophobicContact CD1-CD1 4.39Å; L351-T383 HydrophobicContact CD1-CG2 4.37Å; L351-A387 HydrophobicContact CB-CB 3.96Å; L351-A387 HydrophobicContact CD1-CB 4.11Å; L351-L399 HydrophobicContact CD1-CD1 4.22Å; L351-L399 HydrophobicContact CD2-CD1 4.11Å
352	M	93.7	Very high	94.6	Very high	28 Å²	28	33 Å²	33	14%	0.138	17%	0.166	C	C	.	.	H	α-helix	trans	-77.2	-22.9	179.7	-87.5	-164	-73.9	0	0	115.4	S348 H349 C350 T386 R390 L394	S348-M352 VanDerWaalsContact O-CB 3.3Å; S348-M352 WeakPolarHBondContact O-CB 3.36Å; S348-M352 VanDerWaalsContact O-CE 3.24Å; S348-M352 WeakPolarHBondContact O-CE 3.47Å; S348-M352 WeakPolarHBondContact O-CG 3.49Å; S348-M352 PolarHBondContact O-N 3.44Å; H349-M352 PolarHBondContact O-N 2.66Å; C350-M352 PolarHBondContact O-N 2.97Å; M352-T386 HydrophobicContact CE-CG2 3.97Å; M352-T386 HydrophobicContact SD-CG2 4.38Å; M352-R390 PolarHBondContact O-NH1 3.4Å; M352-R390 VanDerWaalsContact O-NH1 3.09Å; M352-R390 PolarHBondContact O-NH2 3.42Å; M352-L394 HydrophobicContact CG-CD1 4.41Å
353	N	94.5	Very high	94.5	Very high	46 Å²	46	35.8 Å²	35.8	25%	0.246	18%	0.18	C	C	.	.	H	α-helix	trans	-119.4	-26.9	-170.9	-70.1	-9.6	0	0	0	113.3	G311 H349 C350	G311-N353 PolarHBondContact O-ND2 2.74Å; H349-N353 VanDerWaalsContact O-CB 3.31Å; H349-N353 WeakPolarHBondContact O-CB 3.49Å; H349-N353 PolarHBondContact O-N 3.15Å; C350-N353 PolarHBondContact O-N 3.16Å; C350-N353 VanDerWaalsContact O-N 3.11Å
354	H	94.8	Very high	94.4	Very high	14 Å²	14	38.3 Å²	38.3	7%	0.065	19%	0.189	C	C	.	.			trans	-134.5	72.2	-175.7	-48.4	-82.1	0	0	0	110.1	F310 S312 K313 S315 C350 D356 L357	F310-H354 PolarHBondContact O-CD2 2.68Å; F310-H354 PolarHBondContact O-NE2 3.32Å; S312-H354 PolarHBondContact O-CE1 2.95Å; S312-H354 PolarHBondContact O-NE2 3.18Å; S312-H354 VanDerWaalsContact O-NE2 3.13Å; K313-H354 PolarHBondContact O-CE1 3.25Å; S315-H354 PolarHBondContact O-CE1 2.83Å; C350-H354 CarbonylContact O-C 3.58Å; C350-H354 WeakPolarHBondContact O-CA 3.29Å; C350-H354 PolarHBondContact O-N 2.96Å; H354-D356 VanDerWaalsContact C-OD1 3.23Å; H354-D356 WeakPolarHBondContact CA-OD1 3.29Å; H354-D356 PolarHBondContact O-N 3.38Å; H354-D356 VanDerWaalsContact O-N 3.16Å; H354-L357 HydrophobicContact CB-CB 4.22Å; H354-L357 HydrophobicContact CB-CD1 3.74Å; H354-L357 HydrophobicContact CB-CG 3.93Å; H354-L357 WeakPolarHBondContact O-CB 3.44Å; H354-L357 PolarHBondContact O-N 2.9Å
355	P	92.5	Very high	94.5	Very high	72 Å²	72	38.3 Å²	38.3	47%	0.468	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-61.2	-25.9	-175.1	-22.3	34.6	0	0	0	113.2	L357 A358 L394	P355-L357 PolarHBondContact O-N 3.11Å; P355-A358 WeakPolarHBondContact O-CB 3.38Å; P355-A358 PolarHBondContact O-N 3.17Å; P355-A358 VanDerWaalsContact O-N 3.15Å; P355-L394 HydrophobicContact CB-CD2 4.42Å; P355-L394 HydrophobicContact CG-CD2 3.88Å
356	D	92.1	Very high	94.6	Very high	88 Å²	88	38 Å²	38	47%	0.471	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-63.5	-24.7	173.9	63.9	-68.3	0	0	0	113.6	H354 K359	H354-D356 VanDerWaalsContact C-OD1 3.23Å; H354-D356 WeakPolarHBondContact CA-OD1 3.29Å; H354-D356 PolarHBondContact O-N 3.38Å; H354-D356 VanDerWaalsContact O-N 3.16Å; D356-K359 WeakPolarHBondContact O-CD 3.29Å; D356-K359 VanDerWaalsContact O-CE 3.32Å; D356-K359 WeakPolarHBondContact O-CE 3.43Å; D356-K359 PolarHBondContact O-NZ 2.94Å
357	L	93.9	Very high	94.6	Very high	9 Å²	9	41 Å²	41	5%	0.047	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-88.9	-8.3	175.2	-59.4	-177.9	0	0	0	113.2	A318 W325 H354 P355 K359 D360 L361	A318-L357 HydrophobicContact CB-CD1 3.66Å; A318-L357 HydrophobicContact CB-CD2 4.03Å; W325-L357 HydrophobicContact CH2-CD1 4.19Å; W325-L357 HydrophobicContact CZ2-CB 4.26Å; W325-L357 HydrophobicContact CZ2-CD1 3.98Å; W325-L357 HydrophobicContact CZ2-CD2 4.39Å; W325-L357 HydrophobicContact CZ2-CG 4.45Å; H354-L357 HydrophobicContact CB-CB 4.22Å; H354-L357 HydrophobicContact CB-CD1 3.74Å; H354-L357 HydrophobicContact CB-CG 3.93Å; H354-L357 WeakPolarHBondContact O-CB 3.44Å; H354-L357 PolarHBondContact O-N 2.9Å; P355-L357 PolarHBondContact O-N 3.11Å; L357-K359 PolarHBondContact O-N 3.02Å; L357-K359 VanDerWaalsContact O-N 3.11Å; L357-D360 WeakPolarHBondContact O-CB 3.17Å; L357-D360 PolarHBondContact O-N 3.28Å; L357-L361 PolarHBondContact O-N 3.13Å
358	A	93.1	Very high	94.7	Very high	12 Å²	12	41.9 Å²	41.9	10%	0.099	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-32.5	-179.9	0	0	0	0	0	113.3	L351 P355 L361 T362	L351-A358 HydrophobicContact CD2-CB 3.44Å; L351-A358 VanDerWaalsContact CD2-CB 3.44Å; P355-A358 WeakPolarHBondContact O-CB 3.38Å; P355-A358 PolarHBondContact O-N 3.17Å; P355-A358 VanDerWaalsContact O-N 3.15Å; A358-L361 PolarHBondContact O-N 3.1Å; A358-T362 PolarHBondContact O-N 2.84Å; A358-T362 PolarHBondContact O-OG1 3.47Å
359	K	93.1	Very high	95	Very high	143 Å²	143	41.3 Å²	41.3	62%	0.622	21%	0.206	S	C	*	.	H	α-helix	trans	-61.6	-40.5	173.9	70.6	-164.9	-176.8	-123.6	0	112.7	D356 L357 L361 T362	D356-K359 WeakPolarHBondContact O-CD 3.29Å; D356-K359 VanDerWaalsContact O-CE 3.32Å; D356-K359 WeakPolarHBondContact O-CE 3.43Å; D356-K359 PolarHBondContact O-NZ 2.94Å; L357-K359 PolarHBondContact O-N 3.02Å; L357-K359 VanDerWaalsContact O-N 3.11Å; K359-L361 VanDerWaalsContact C-N 3.28Å; K359-L361 PolarHBondContact O-N 3.48Å; K359-T362 PolarHBondContact O-N 3.31Å
360	D	94	Very high	95.3	Very high	27 Å²	27	41.5 Å²	41.5	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-68.4	-30.7	-179.7	-69.3	-9.1	0	0	0	110.9	R322 W325 L329 L357 Y364	R322-D360 IonicContact CZ-OD2 3.77Å; R322-D360 IonicContact NH1-OD2 2.69Å; R322-D360 PolarHBondContact NH1-OD2 3.19Å; R322-D360 VanDerWaalsContact NH2-CG 3.25Å; R322-D360 IonicContact NH2-OD1 2.72Å; R322-D360 PolarHBondContact NH2-OD1 3.05Å; R322-D360 IonicContact NH2-OD2 3.16Å; R322-D360 PolarHBondContact NH2-OD2 3.23Å; W325-D360 HydrophobicContact CZ2-CB 4.26Å; W325-D360 PolarHBondContact NE1-OD2 3.3Å; L329-D360 HydrophobicContact CD1-CB 3.98Å; L357-D360 WeakPolarHBondContact O-CB 3.17Å; L357-D360 PolarHBondContact O-N 3.28Å; D360-Y364 VanDerWaalsContact O-CD2 3.23Å; D360-Y364 WeakPolarHBondContact O-CD2 3.49Å; D360-Y364 WeakPolarHBondContact O-CE2 3.45Å
361	L	96.4	Very high	95.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-81.4	-24.7	-178.4	-61.4	173.5	0	0	0	114.2	W325 L329 F332 F346 A347 C350 L351 L357 A358 K359 E363 Y364 L365	W325-L361 HydrophobicContact CH2-CD2 4.4Å; L329-L361 HydrophobicContact CD2-CD2 3.78Å; F332-L361 HydrophobicContact CE2-CD2 4.3Å; F332-L361 HydrophobicContact CZ-CD2 3.92Å; F346-L361 HydrophobicContact CE1-CD2 4.15Å; A347-L361 HydrophobicContact CB-CD1 4.09Å; A347-L361 HydrophobicContact CB-CD2 4.35Å; C350-L361 HydrophobicContact CB-CD1 3.86Å; L351-L361 HydrophobicContact CD2-CD1 4.06Å; L351-L361 HydrophobicContact CG-CD1 4.04Å; L357-L361 PolarHBondContact O-N 3.13Å; A358-L361 PolarHBondContact O-N 3.1Å; K359-L361 VanDerWaalsContact C-N 3.28Å; K359-L361 PolarHBondContact O-N 3.48Å; L361-E363 PolarHBondContact O-N 3.24Å; L361-Y364 PolarHBondContact O-N 3.11Å; L361-Y364 VanDerWaalsContact O-N 3.14Å; L361-L365 HydrophobicContact CB-CD1 4.27Å; L361-L365 PolarHBondContact O-N 2.64Å
362	T	95.9	Very high	95.6	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.043	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-45.7	-163.8	-65.1	0	0	0	0	112.5	A358 K359 Y364 L365 K366 N396 Q398 L399 F402	A358-T362 PolarHBondContact O-N 2.84Å; A358-T362 PolarHBondContact O-OG1 3.47Å; K359-T362 PolarHBondContact O-N 3.31Å; T362-Y364 PolarHBondContact O-N 3.45Å; T362-L365 PolarHBondContact O-N 3.37Å; T362-K366 WeakPolarHBondContact O-CB 3.46Å; T362-K366 PolarHBondContact O-N 3.42Å; T362-N396 PolarHBondContact OG1-ND2 2.82Å; T362-Q398 HydrophobicContact CG2-CB 3.98Å; T362-L399 HydrophobicContact CG2-CD2 4.39Å; T362-F402 HydrophobicContact CG2-CE2 4.13Å; T362-F402 HydrophobicContact CG2-CZ 4.18Å
363	E	94.2	Very high	95.7	Very high	100 Å²	100	49.5 Å²	49.5	47%	0.467	25%	0.253	S	S	.	.	H	α-helix	trans	-69.1	-29.3	177.2	-72.7	-65.2	127.9	0	0	113.3	L361 K366 V367	L361-E363 PolarHBondContact O-N 3.24Å; E363-K366 WeakPolarHBondContact O-CB 3.14Å; E363-K366 WeakPolarHBondContact OE1-CD 3.46Å; E363-K366 IonicContact OE1-NZ 2.79Å; E363-K366 PolarHBondContact OE1-NZ 3.01Å; E363-K366 VanDerWaalsContact OE2-CD 3.32Å; E363-K366 WeakPolarHBondContact OE2-CD 3.48Å; E363-K366 IonicContact OE2-NZ 3.88Å; E363-K366 PolarHBondContact OE2-NZ 3.38Å; E363-V367 WeakPolarHBondContact O-CG2 3.37Å; E363-V367 PolarHBondContact O-N 2.8Å
364	Y	97.3	Very high	95.9	Very high	52 Å²	52	49.8 Å²	49.8	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-72.1	-43.1	174.3	-64.7	-79.7	0	0	0	111.5	L329 F332 D360 L361 T362 K366 V367 R368	L329-Y364 HydrophobicContact CB-CD2 4.47Å; L329-Y364 HydrophobicContact CB-CE2 3.8Å; L329-Y364 HydrophobicContact CD1-CE2 4.12Å; L329-Y364 HydrophobicContact CD2-CD2 4.35Å; L329-Y364 HydrophobicContact CD2-CE2 4.34Å; L329-Y364 HydrophobicContact CG-CE2 4.32Å; L329-Y364 WeakPolarHBondContact O-CE1 3.27Å; F332-Y364 HydrophobicContact CB-CD1 3.67Å; F332-Y364 HydrophobicContact CB-CG 4.02Å; F332-Y364 HydrophobicContact CG-CD1 4.29Å; F332-Y364 HydrophobicContact CG-CG 4.17Å; D360-Y364 VanDerWaalsContact O-CD2 3.23Å; D360-Y364 WeakPolarHBondContact O-CD2 3.49Å; D360-Y364 WeakPolarHBondContact O-CE2 3.45Å; L361-Y364 PolarHBondContact O-N 3.11Å; L361-Y364 VanDerWaalsContact O-N 3.14Å; T362-Y364 PolarHBondContact O-N 3.45Å; Y364-K366 VanDerWaalsContact C-N 3.32Å; Y364-K366 PolarHBondContact O-N 3.34Å; Y364-V367 PolarHBondContact O-N 3.19Å; Y364-R368 VanDerWaalsContact O-CG 3.29Å; Y364-R368 WeakPolarHBondContact O-CG 3.26Å; Y364-R368 PolarHBondContact O-N 3.3Å
365	L	97.8	Very high	96.1	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-35.2	175.8	-69.5	175	0	0	0	112.2	F332 A347 L351 L361 T362 R368 S369 V380 L399	F332-L365 HydrophobicContact CE1-CD2 4.31Å; A347-L365 HydrophobicContact CB-CD1 4.2Å; A347-L365 HydrophobicContact CB-CD2 4.03Å; A347-L365 HydrophobicContact CB-CG 4.47Å; L351-L365 HydrophobicContact CD1-CD1 4.39Å; L361-L365 HydrophobicContact CB-CD1 4.27Å; L361-L365 PolarHBondContact O-N 2.64Å; T362-L365 PolarHBondContact O-N 3.37Å; L365-R368 PolarHBondContact O-N 3.22Å; L365-S369 WeakPolarHBondContact O-CB 3.47Å; L365-S369 PolarHBondContact O-N 3.26Å; L365-V380 HydrophobicContact CD2-CG1 4.42Å; L365-V380 HydrophobicContact CD2-CG2 4.22Å; L365-L399 HydrophobicContact CB-CD2 4.01Å; L365-L399 HydrophobicContact CD1-CD2 3.64Å; L365-L399 HydrophobicContact CG-CD2 4.49Å
366	K	97.3	Very high	96.3	Very high	77 Å²	77	47.6 Å²	47.6	34%	0.335	24%	0.243	S	C	.	.	H	α-helix	trans	-54.2	-52.4	170.5	-175	-179.2	178.5	-172.8	0	111.8	T362 E363 Y364 S369 H370 F402	T362-K366 WeakPolarHBondContact O-CB 3.46Å; T362-K366 PolarHBondContact O-N 3.42Å; E363-K366 WeakPolarHBondContact O-CB 3.14Å; E363-K366 WeakPolarHBondContact OE1-CD 3.46Å; E363-K366 IonicContact OE1-NZ 2.79Å; E363-K366 PolarHBondContact OE1-NZ 3.01Å; E363-K366 VanDerWaalsContact OE2-CD 3.32Å; E363-K366 WeakPolarHBondContact OE2-CD 3.48Å; E363-K366 IonicContact OE2-NZ 3.88Å; E363-K366 PolarHBondContact OE2-NZ 3.38Å; Y364-K366 VanDerWaalsContact C-N 3.32Å; Y364-K366 PolarHBondContact O-N 3.34Å; K366-S369 PolarHBondContact O-N 3.04Å; K366-S369 PolarHBondContact O-OG 3.16Å; K366-H370 PolarHBondContact O-ND1 2.96Å; K366-F402 HydrophobicContact CB-CD2 4.3Å; K366-F402 HydrophobicContact CB-CE1 3.9Å; K366-F402 HydrophobicContact CB-CE2 3.6Å; K366-F402 HydrophobicContact CB-CZ 3.4Å; K366-F402 VanDerWaalsContact CB-CZ 3.4Å; K366-F402 HydrophobicContact CD-CE1 4.21Å; K366-F402 HydrophobicContact CD-CZ 4.01Å; K366-F402 HydrophobicContact CG-CD1 4.36Å; K366-F402 HydrophobicContact CG-CE1 3.64Å; K366-F402 HydrophobicContact CG-CE2 4.29Å; K366-F402 HydrophobicContact CG-CZ 3.62Å
367	V	97.4	Very high	96.6	Very high	68 Å²	68	44.5 Å²	44.5	41%	0.412	23%	0.225	S	C	.	.	H	α-helix	trans	-66.8	-41.3	177.8	-178.9	0	0	0	0	111.2	E363 Y364 S369 H370 D371	E363-V367 WeakPolarHBondContact O-CG2 3.37Å; E363-V367 PolarHBondContact O-N 2.8Å; Y364-V367 PolarHBondContact O-N 3.19Å; V367-S369 VanDerWaalsContact C-N 3.3Å; V367-S369 PolarHBondContact O-N 3.29Å; V367-H370 CarbonylContact O-C 3.5Å; V367-H370 WeakPolarHBondContact O-CA 3.46Å; V367-H370 PolarHBondContact O-N 3.02Å; V367-D371 PolarHBondContact O-N 2.89Å
368	R	98	Very high	96.8	Very high	18 Å²	18	45.1 Å²	45.1	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-66.7	-26.9	177.2	-63.7	-70.5	76	67.7	-12.9	113.6	F332 N333 V344 Y364 L365 H370 D371 I376 R377 V380	F332-R368 HydrophobicContact CD1-CG 4.24Å; F332-R368 VanDerWaalsContact O-CD 3.27Å; F332-R368 WeakPolarHBondContact O-CD 3.45Å; F332-R368 PolarHBondContact O-NE 3.02Å; F332-R368 PolarHBondContact O-NH1 3.08Å; N333-R368 PolarHBondContact OD1-NH1 3.26Å; V344-R368 HydrophobicContact CG2-CB 4.1Å; V344-R368 HydrophobicContact CG2-CG 3.93Å; Y364-R368 VanDerWaalsContact O-CG 3.29Å; Y364-R368 WeakPolarHBondContact O-CG 3.26Å; Y364-R368 PolarHBondContact O-N 3.3Å; L365-R368 PolarHBondContact O-N 3.22Å; R368-H370 PolarHBondContact O-N 3.42Å; R368-D371 IonicContact CZ-OD2 2.73Å; R368-D371 IonicContact NE-OD2 3.56Å; R368-D371 PolarHBondContact NE-OD2 3.38Å; R368-D371 IonicContact NH2-OD2 3.61Å; R368-D371 PolarHBondContact NH2-OD2 3.26Å; R368-D371 VanDerWaalsContact O-CB 3.26Å; R368-D371 WeakPolarHBondContact O-CB 3.34Å; R368-D371 PolarHBondContact O-N 3.34Å; R368-I376 HydrophobicContact CB-CG2 3.99Å; R368-I376 HydrophobicContact CG-CG2 4.4Å; R368-R377 WeakPolarHBondContact O-CG 3.4Å; R368-V380 HydrophobicContact CB-CG2 3.51Å
369	S	97.5	Very high	97.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.1	171.1	77.1	0	0	0	0	113.3	L365 K366 V367 R377 R406	L365-S369 WeakPolarHBondContact O-CB 3.47Å; L365-S369 PolarHBondContact O-N 3.26Å; K366-S369 PolarHBondContact O-N 3.04Å; K366-S369 PolarHBondContact O-OG 3.16Å; V367-S369 VanDerWaalsContact C-N 3.3Å; V367-S369 PolarHBondContact O-N 3.29Å; S369-R377 VanDerWaalsContact O-CD 3.31Å; S369-R377 WeakPolarHBondContact O-CD 3.31Å; S369-R377 WeakPolarHBondContact O-CG 3.2Å; S369-R406 WeakPolarHBondContact O-CD 3.42Å; S369-R406 PolarHBondContact O-NE 3.11Å; S369-R406 PolarHBondContact O-NH1 3.06Å
370	H	97.5	Very high	97.3	Very high	110 Å²	110	39.5 Å²	39.5	51%	0.509	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	9.5	176	-74.9	84.9	0	0	0	113.5	K366 V367 R368 E405 R406	K366-H370 PolarHBondContact O-ND1 2.96Å; V367-H370 CarbonylContact O-C 3.5Å; V367-H370 WeakPolarHBondContact O-CA 3.46Å; V367-H370 PolarHBondContact O-N 3.02Å; R368-H370 PolarHBondContact O-N 3.42Å; H370-E405 IonicContact CE1-OE2 2.64Å; H370-E405 PolarHBondContact CE1-OE2 3.41Å; H370-E405 VanDerWaalsContact CE1-OE2 3.24Å; H370-E405 IonicContact NE2-OE2 2.67Å; H370-R406 PolarHBondContact CE1-NH2 2.96Å; H370-R406 PolarHBondContact NE2-NH2 3.42Å
371	D	98.2	Very high	97.5	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	20%	0.196	C	C	.	.			trans	-59	145.4	-175.8	-160.3	-78.3	0	0	0	112.2	R340 V367 R368 E373 I376 R377	R340-D371 IonicContact CZ-OD2 3.2Å; R340-D371 IonicContact NH1-OD1 3.63Å; R340-D371 PolarHBondContact NH1-OD1 3.34Å; R340-D371 IonicContact NH1-OD2 2.77Å; R340-D371 PolarHBondContact NH1-OD2 2.97Å; V367-D371 PolarHBondContact O-N 2.89Å; R368-D371 IonicContact CZ-OD2 2.73Å; R368-D371 IonicContact NE-OD2 3.56Å; R368-D371 PolarHBondContact NE-OD2 3.38Å; R368-D371 IonicContact NH2-OD2 3.61Å; R368-D371 PolarHBondContact NH2-OD2 3.26Å; R368-D371 VanDerWaalsContact O-CB 3.26Å; R368-D371 WeakPolarHBondContact O-CB 3.34Å; R368-D371 PolarHBondContact O-N 3.34Å; D371-E373 PolarHBondContact O-N 3.14Å; D371-E373 PolarHBondContact OD1-N 2.69Å; D371-I376 HydrophobicContact CB-CB 4.08Å; D371-I376 HydrophobicContact CB-CG2 3.63Å; D371-R377 HydrophobicContact CB-CG 4.21Å; D371-R377 WeakPolarHBondContact O-CD 3.3Å; D371-R377 WeakPolarHBondContact O-CG 3.31Å; D371-R377 PolarHBondContact O-NE 3.36Å
372	P	97.5	Very high	97.6	Very high	110 Å²	110	40.5 Å²	40.5	71%	0.714	21%	0.21	S	C	*	.	S	Bend	trans	-50.3	-41.8	171.2	-29.6	36.4	0	0	0	113	R377	P372-R377 PolarHBondContact O-NH2 3.23Å; P372-R377 VanDerWaalsContact O-NH2 3.14Å
373	E	97.8	Very high	97.6	Very high	83 Å²	83	40.4 Å²	40.4	39%	0.388	21%	0.21	S	C	.	.			trans	-75.3	131.8	-172.7	-63	-52.1	140.2	0	0	113.5	V337 D371 I376 R377	V337-E373 HydrophobicContact CG1-CG 4.01Å; V337-E373 HydrophobicContact CG2-CG 3.84Å; D371-E373 PolarHBondContact O-N 3.14Å; D371-E373 PolarHBondContact OD1-N 2.69Å; E373-I376 HydrophobicContact CB-CB 4.2Å; E373-I376 HydrophobicContact CB-CD1 4.01Å; E373-I376 HydrophobicContact CB-CG1 4.09Å; E373-I376 HydrophobicContact CG-CD1 4.29Å; E373-I376 PolarHBondContact O-N 2.71Å; E373-R377 PolarHBondContact O-N 3.11Å
374	E	97.9	Very high	97.8	Very high	52 Å²	52	35.7 Å²	35.7	24%	0.243	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-38.7	179.4	-169.1	177.3	143	0	0	112.2	I376 R377 H378 R411 R413 V414	E374-I376 VanDerWaalsContact C-N 3.34Å; E374-I376 PolarHBondContact O-N 3.25Å; E374-R377 PolarHBondContact O-N 2.9Å; E374-H378 VanDerWaalsContact O-CB 3.24Å; E374-H378 WeakPolarHBondContact O-CB 3.47Å; E374-H378 PolarHBondContact O-N 3.31Å; E374-R411 HydrophobicContact CG-CB 4.03Å; E374-R411 HydrophobicContact CG-CG 4.01Å; E374-R411 WeakPolarHBondContact OE2-CD 3.43Å; E374-R411 WeakPolarHBondContact OE2-CG 3.32Å; E374-R411 IonicContact OE2-CZ 2.82Å; E374-R411 IonicContact OE2-NE 3.99Å; E374-R411 PolarHBondContact OE2-NE 2.96Å; E374-R413 WeakPolarHBondContact OE1-CB 3.39Å; E374-V414 HydrophobicContact CG-CG2 3.57Å
375	A	97.9	Very high	97.8	Very high	40 Å²	40	33.5 Å²	33.5	33%	0.331	18%	0.179	S	C	.	.	H	α-helix	trans	-63.8	-38.1	178.3	0	0	0	0	0	112.4	L341 D379	L341-A375 HydrophobicContact CD1-CB 4.31Å; A375-D379 WeakPolarHBondContact O-CB 3.23Å; A375-D379 PolarHBondContact O-N 3.14Å
376	I	98.3	Very high	97.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.3	-47.1	178.3	-68.3	175.5	0	0	0	110.3	V337 R340 L341 V344 R368 D371 E373 E374 H378 D379 V380	V337-I376 HydrophobicContact CG1-CD1 4.13Å; R340-I376 HydrophobicContact CB-CD1 3.6Å; L341-I376 HydrophobicContact CB-CG1 4.49Å; L341-I376 HydrophobicContact CD1-CG1 4.04Å; V344-I376 HydrophobicContact CG2-CG2 4.35Å; R368-I376 HydrophobicContact CB-CG2 3.99Å; R368-I376 HydrophobicContact CG-CG2 4.4Å; D371-I376 HydrophobicContact CB-CB 4.08Å; D371-I376 HydrophobicContact CB-CG2 3.63Å; E373-I376 HydrophobicContact CB-CB 4.2Å; E373-I376 HydrophobicContact CB-CD1 4.01Å; E373-I376 HydrophobicContact CB-CG1 4.09Å; E373-I376 HydrophobicContact CG-CD1 4.29Å; E373-I376 PolarHBondContact O-N 2.71Å; E374-I376 VanDerWaalsContact C-N 3.34Å; E374-I376 PolarHBondContact O-N 3.25Å; I376-H378 VanDerWaalsContact C-N 3.28Å; I376-H378 PolarHBondContact O-N 3.38Å; I376-D379 PolarHBondContact O-N 3.09Å; I376-V380 WeakPolarHBondContact O-CG2 3.39Å; I376-V380 PolarHBondContact O-N 3.3Å
377	R	98.4	Very high	97.7	Very high	23 Å²	23	32.7 Å²	32.7	9%	0.087	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-35.2	176.7	-73.7	-174.3	-80.5	104.4	8.1	113.1	R368 S369 D371 P372 E373 E374 I381 D409 V414	R368-R377 WeakPolarHBondContact O-CG 3.4Å; S369-R377 VanDerWaalsContact O-CD 3.31Å; S369-R377 WeakPolarHBondContact O-CD 3.31Å; S369-R377 WeakPolarHBondContact O-CG 3.2Å; D371-R377 HydrophobicContact CB-CG 4.21Å; D371-R377 WeakPolarHBondContact O-CD 3.3Å; D371-R377 WeakPolarHBondContact O-CG 3.31Å; D371-R377 PolarHBondContact O-NE 3.36Å; P372-R377 PolarHBondContact O-NH2 3.23Å; P372-R377 VanDerWaalsContact O-NH2 3.14Å; E373-R377 PolarHBondContact O-N 3.11Å; E374-R377 PolarHBondContact O-N 2.9Å; R377-I381 WeakPolarHBondContact O-CG1 3.16Å; R377-D409 IonicContact CZ-OD1 2.62Å; R377-D409 IonicContact CZ-OD2 3.42Å; R377-D409 IonicContact NH1-OD1 3.47Å; R377-D409 PolarHBondContact NH1-OD1 3.35Å; R377-D409 IonicContact NH1-OD2 2.7Å; R377-D409 PolarHBondContact NH1-OD2 3.5Å; R377-V414 HydrophobicContact CB-CG1 4.24Å
378	H	98.5	Very high	97.6	Very high	22 Å²	22	29.5 Å²	29.5	10%	0.102	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-54.1	172.1	175.9	-83.1	0	0	0	111.5	E374 I376 V380 I381 V382 R413 V414	E374-H378 VanDerWaalsContact O-CB 3.24Å; E374-H378 WeakPolarHBondContact O-CB 3.47Å; E374-H378 PolarHBondContact O-N 3.31Å; I376-H378 VanDerWaalsContact C-N 3.28Å; I376-H378 PolarHBondContact O-N 3.38Å; H378-V380 VanDerWaalsContact C-N 3.27Å; H378-V380 PolarHBondContact O-N 3Å; H378-I381 WeakPolarHBondContact O-CB 3.3Å; H378-I381 PolarHBondContact O-N 3.05Å; H378-V382 PolarHBondContact O-N 2.85Å; H378-V382 VanDerWaalsContact O-N 3.09Å; H378-R413 PolarHBondContact CD2-NE 3.41Å; H378-R413 PolarHBondContact CD2-NH2 2.71Å; H378-R413 PolarHBondContact CE1-NH2 3.23Å; H378-R413 PolarHBondContact ND1-NH2 2.92Å; H378-R413 PolarHBondContact NE2-NE 2.83Å; H378-R413 PolarHBondContact NE2-NH2 3.32Å; H378-V414 HydrophobicContact CB-CG2 4.44Å
379	D	97.6	Very high	97.5	Very high	35 Å²	35	32.8 Å²	32.8	19%	0.187	18%	0.176	C	C	.	.	H	α-helix	trans	-71	-21.5	-173.9	-75.1	16.4	0	0	0	113	L341 V344 A375 I376 T383	L341-D379 HydrophobicContact CD1-CB 4.13Å; V344-D379 HydrophobicContact CG1-CB 4.01Å; A375-D379 WeakPolarHBondContact O-CB 3.23Å; A375-D379 PolarHBondContact O-N 3.14Å; I376-D379 PolarHBondContact O-N 3.09Å; D379-T383 WeakPolarHBondContact O-CB 3.24Å; D379-T383 PolarHBondContact O-N 3.02Å; D379-T383 PolarHBondContact O-OG1 3.02Å
380	V	98.4	Very high	97.4	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-41.4	167.1	169.6	0	0	0	0	111.6	V344 L365 R368 I376 H378 I384	V344-V380 HydrophobicContact CB-CG2 4.48Å; V344-V380 HydrophobicContact CG1-CB 4.42Å; V344-V380 HydrophobicContact CG1-CG2 3.73Å; V344-V380 HydrophobicContact CG2-CG2 3.82Å; L365-V380 HydrophobicContact CD2-CG1 4.42Å; L365-V380 HydrophobicContact CD2-CG2 4.22Å; R368-V380 HydrophobicContact CB-CG2 3.51Å; I376-V380 WeakPolarHBondContact O-CG2 3.39Å; I376-V380 PolarHBondContact O-N 3.3Å; H378-V380 VanDerWaalsContact C-N 3.27Å; H378-V380 PolarHBondContact O-N 3Å; V380-I384 HydrophobicContact CG1-CD1 3.84Å; V380-I384 WeakPolarHBondContact O-CG1 3.35Å; V380-I384 PolarHBondContact O-N 2.89Å; V380-I384 VanDerWaalsContact O-N 3.1Å
381	I	98.4	Very high	97.2	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-52.1	174.4	-61.7	157.4	0	0	0	109.5	R377 H378 T383 I384 I385 V403 R406 V414 E417 A418	R377-I381 WeakPolarHBondContact O-CG1 3.16Å; H378-I381 WeakPolarHBondContact O-CB 3.3Å; H378-I381 PolarHBondContact O-N 3.05Å; I381-T383 PolarHBondContact O-N 3.46Å; I381-I384 PolarHBondContact O-N 3.31Å; I381-I385 HydrophobicContact CG2-CG1 3.89Å; I381-I385 VanDerWaalsContact O-CB 3.31Å; I381-I385 WeakPolarHBondContact O-CB 3.31Å; I381-I385 VanDerWaalsContact O-CG1 3.29Å; I381-I385 WeakPolarHBondContact O-CG1 3.33Å; I381-I385 PolarHBondContact O-N 3.24Å; I381-V403 HydrophobicContact CG2-CG1 4.05Å; I381-V403 HydrophobicContact CG2-CG2 4.43Å; I381-R406 HydrophobicContact CD1-CB 3.78Å; I381-R406 HydrophobicContact CD1-CG 3.91Å; I381-R406 HydrophobicContact CG1-CB 4.08Å; I381-R406 HydrophobicContact CG1-CG 3.92Å; I381-V414 HydrophobicContact CD1-CG1 3.59Å; I381-V414 WeakPolarHBondContact CD1-O 3.24Å; I381-E417 HydrophobicContact CD1-CB 4.43Å; I381-E417 HydrophobicContact CG2-CB 4.43Å; I381-E417 HydrophobicContact CG2-CG 4.11Å; I381-A418 HydrophobicContact CD1-CB 3.99Å; I381-A418 HydrophobicContact CG1-CB 4.48Å; I381-A418 HydrophobicContact CG2-CB 4.47Å
382	V	98	Very high	97	Very high	47 Å²	47	37.9 Å²	37.9	29%	0.285	20%	0.197	S	C	.	.	H	α-helix	trans	-56	-43.7	-179.3	177.8	0	0	0	0	110.4	H378 T386 E417	H378-V382 PolarHBondContact O-N 2.85Å; H378-V382 VanDerWaalsContact O-N 3.09Å; V382-T386 VanDerWaalsContact O-CB 3.23Å; V382-T386 WeakPolarHBondContact O-CB 3.16Å; V382-T386 PolarHBondContact O-N 3.09Å; V382-T386 PolarHBondContact O-OG1 2.89Å; V382-E417 HydrophobicContact CG2-CG 3.98Å
383	T	96.7	Very high	96.9	Very high	6 Å²	6	36.5 Å²	36.5	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-56.1	-54.6	175.5	-70.4	0	0	0	0	112.7	V344 A347 L351 D379 I381 T386 A387	V344-T383 PolarHBondContact O-OG1 2.89Å; A347-T383 HydrophobicContact CB-CG2 4.01Å; L351-T383 HydrophobicContact CD1-CG2 4.37Å; D379-T383 WeakPolarHBondContact O-CB 3.24Å; D379-T383 PolarHBondContact O-N 3.02Å; D379-T383 PolarHBondContact O-OG1 3.02Å; I381-T383 PolarHBondContact O-N 3.46Å; T383-T386 PolarHBondContact O-N 3.25Å; T383-A387 PolarHBondContact O-N 3.17Å; T383-A387 VanDerWaalsContact O-N 3.16Å
384	I	97.7	Very high	96.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-42.6	-177.3	-66.5	166.4	0	0	0	110.6	V380 I381 A387 A388 V395 L399 L400 F402 V403	V380-I384 HydrophobicContact CG1-CD1 3.84Å; V380-I384 WeakPolarHBondContact O-CG1 3.35Å; V380-I384 PolarHBondContact O-N 2.89Å; V380-I384 VanDerWaalsContact O-N 3.1Å; I381-I384 PolarHBondContact O-N 3.31Å; I384-A387 PolarHBondContact O-N 2.72Å; I384-A388 VanDerWaalsContact O-CB 3.24Å; I384-A388 WeakPolarHBondContact O-CB 3.33Å; I384-A388 PolarHBondContact O-N 3.1Å; I384-V395 HydrophobicContact CG2-CG1 4.25Å; I384-L399 HydrophobicContact CD1-CB 4.06Å; I384-L399 HydrophobicContact CD1-CD2 3.95Å; I384-L399 HydrophobicContact CG1-CB 4.18Å; I384-L399 HydrophobicContact CG1-CD2 4.19Å; I384-L399 HydrophobicContact CG2-CB 3.91Å; I384-L400 HydrophobicContact CG2-CD2 4.46Å; I384-F402 HydrophobicContact CD1-CD2 4.47Å; I384-V403 HydrophobicContact CB-CG2 4.02Å; I384-V403 HydrophobicContact CD1-CG2 4.2Å; I384-V403 HydrophobicContact CG2-CG2 3.8Å
385	I	97.5	Very high	96.6	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.036	17%	0.174	C	C	.	.	H	α-helix	trans	-68.3	-37.5	179	-67.5	-60.5	0	0	0	111.8	I381 K389 V403 L425	I381-I385 HydrophobicContact CG2-CG1 3.89Å; I381-I385 VanDerWaalsContact O-CB 3.31Å; I381-I385 WeakPolarHBondContact O-CB 3.31Å; I381-I385 VanDerWaalsContact O-CG1 3.29Å; I381-I385 WeakPolarHBondContact O-CG1 3.33Å; I381-I385 PolarHBondContact O-N 3.24Å; I385-K389 HydrophobicContact CG2-CD 3.65Å; I385-K389 HydrophobicContact CG2-CG 4.12Å; I385-K389 WeakPolarHBondContact O-CB 3.49Å; I385-K389 WeakPolarHBondContact O-CG 3.32Å; I385-K389 PolarHBondContact O-N 2.83Å; I385-V403 HydrophobicContact CD1-CG1 4.2Å; I385-V403 HydrophobicContact CG1-CG1 4.44Å; I385-L425 HydrophobicContact CD1-CD1 3.59Å; I385-L425 HydrophobicContact CD1-CG 4.17Å
386	T	97	Very high	96.4	Very high	60 Å²	60	32.1 Å²	32.1	37%	0.368	17%	0.171	S	C	.	.	H	α-helix	trans	-63.5	-45.8	175.2	-70.8	0	0	0	0	111.5	M352 V382 T383 R390	M352-T386 HydrophobicContact CE-CG2 3.97Å; M352-T386 HydrophobicContact SD-CG2 4.38Å; V382-T386 VanDerWaalsContact O-CB 3.23Å; V382-T386 WeakPolarHBondContact O-CB 3.16Å; V382-T386 PolarHBondContact O-N 3.09Å; V382-T386 PolarHBondContact O-OG1 2.89Å; T383-T386 PolarHBondContact O-N 3.25Å; T386-R390 PolarHBondContact O-N 3.33Å
387	A	96	Very high	96.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-54.1	175.1	0	0	0	0	0	111.1	L351 T383 I384 K389 R390 D391 L394 V395	L351-A387 HydrophobicContact CB-CB 3.96Å; L351-A387 HydrophobicContact CD1-CB 4.11Å; T383-A387 PolarHBondContact O-N 3.17Å; T383-A387 VanDerWaalsContact O-N 3.16Å; I384-A387 PolarHBondContact O-N 2.72Å; A387-K389 VanDerWaalsContact C-N 3.31Å; A387-K389 PolarHBondContact O-N 3.24Å; A387-R390 WeakPolarHBondContact O-CB 3.31Å; A387-R390 PolarHBondContact O-N 2.93Å; A387-D391 PolarHBondContact O-N 3.13Å; A387-D391 VanDerWaalsContact O-N 3.14Å; A387-D391 VanDerWaalsContact O-O 3.12Å; A387-L394 HydrophobicContact CB-CB 4.46Å; A387-V395 HydrophobicContact CB-CG1 3.94Å
388	A	96.1	Very high	96.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-35.7	-179.1	0	0	0	0	0	113.6	I384 R390 D391 L392 V395 L400 L425 Y429	I384-A388 VanDerWaalsContact O-CB 3.24Å; I384-A388 WeakPolarHBondContact O-CB 3.33Å; I384-A388 PolarHBondContact O-N 3.1Å; A388-R390 VanDerWaalsContact C-N 3.33Å; A388-D391 CarbonylContact O-C 3.59Å; A388-L392 PolarHBondContact O-N 3Å; A388-V395 HydrophobicContact CB-CB 4.5Å; A388-V395 HydrophobicContact CB-CG1 4.04Å; A388-V395 HydrophobicContact CB-CG2 3.63Å; A388-L400 HydrophobicContact CB-CD2 4.43Å; A388-L425 HydrophobicContact CB-CD1 3.9Å; A388-L425 HydrophobicContact CB-CD2 3.59Å; A388-L425 HydrophobicContact CB-CG 4.41Å; A388-Y429 VanDerWaalsContact O-CE2 3.25Å; A388-Y429 WeakPolarHBondContact O-CE2 3.35Å; A388-Y429 PolarHBondContact O-OH 3.14Å
389	K	95.6	Very high	96	Very high	88 Å²	88	40.1 Å²	40.1	38%	0.383	21%	0.213	S	C	.	.	H	α-helix	trans	-72	-23.9	176.4	-78.9	178	65.3	-173.9	0	113.5	I385 A387 Q424 L425 K428	I385-K389 HydrophobicContact CG2-CD 3.65Å; I385-K389 HydrophobicContact CG2-CG 4.12Å; I385-K389 WeakPolarHBondContact O-CB 3.49Å; I385-K389 WeakPolarHBondContact O-CG 3.32Å; I385-K389 PolarHBondContact O-N 2.83Å; A387-K389 VanDerWaalsContact C-N 3.31Å; A387-K389 PolarHBondContact O-N 3.24Å; K389-Q424 HydrophobicContact CD-CB 4.17Å; K389-L425 HydrophobicContact CB-CD2 4.42Å; K389-L425 HydrophobicContact CG-CD2 3.67Å; K389-L425 HydrophobicContact CG-CG 4.49Å; K389-K428 PolarHBondContact O-NZ 2.66Å
390	R	94.2	Very high	96	Very high	133 Å²	133	38.7 Å²	38.7	50%	0.502	21%	0.205	S	C	.	.	H	α-helix	trans	-72	-59.3	169.8	173	173.2	152.7	-169.2	-17.2	109.1	M352 T386 A387 A388 L394 K428	M352-R390 PolarHBondContact O-NH1 3.4Å; M352-R390 VanDerWaalsContact O-NH1 3.09Å; M352-R390 PolarHBondContact O-NH2 3.42Å; T386-R390 PolarHBondContact O-N 3.33Å; A387-R390 WeakPolarHBondContact O-CB 3.31Å; A387-R390 PolarHBondContact O-N 2.93Å; A388-R390 VanDerWaalsContact C-N 3.33Å; R390-L394 HydrophobicContact CB-CD1 4.33Å; R390-L394 HydrophobicContact CG-CD1 4.14Å; R390-K428 PolarHBondContact O-NZ 3.34Å
391	D	94.1	Very high	95.9	Very high	70 Å²	70	39 Å²	39	37%	0.374	21%	0.209	S	C	.	.			trans	-151.6	133.5	176.7	171.7	10.4	0	0	0	108.9	A387 A388 A393 L394 Y429	A387-D391 PolarHBondContact O-N 3.13Å; A387-D391 VanDerWaalsContact O-N 3.14Å; A387-D391 VanDerWaalsContact O-O 3.12Å; A388-D391 CarbonylContact O-C 3.59Å; D391-A393 VanDerWaalsContact C-N 3.27Å; D391-A393 PolarHBondContact O-N 3.26Å; D391-A393 PolarHBondContact OD1-N 3.02Å; D391-L394 HydrophobicContact CB-CD1 3.88Å; D391-L394 HydrophobicContact CB-CG 3.92Å; D391-L394 WeakPolarHBondContact O-CB 3.49Å; D391-L394 PolarHBondContact O-N 3.29Å; D391-Y429 WeakPolarHBondContact CA-OH 3.34Å
392	L	94.6	Very high	95.9	Very high	16 Å²	16	39.7 Å²	39.7	8%	0.084	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-67.2	-29	-178	-169	64.5	0	0	0	111.8	A388 L394 V395 L400 Y429 A439 V443	A388-L392 PolarHBondContact O-N 3Å; L392-L394 PolarHBondContact O-N 3.27Å; L392-V395 HydrophobicContact CD1-CG2 4.16Å; L392-V395 VanDerWaalsContact O-CG2 3.3Å; L392-V395 WeakPolarHBondContact O-CG2 3.45Å; L392-V395 PolarHBondContact O-N 2.95Å; L392-L400 HydrophobicContact CD1-CD1 4.13Å; L392-Y429 HydrophobicContact CB-CD2 4.37Å; L392-Y429 HydrophobicContact CB-CE1 4.28Å; L392-Y429 HydrophobicContact CB-CE2 3.94Å; L392-Y429 HydrophobicContact CD1-CD2 4.32Å; L392-Y429 HydrophobicContact CD1-CE2 4.22Å; L392-Y429 HydrophobicContact CD2-CD2 4.39Å; L392-Y429 HydrophobicContact CD2-CG 4.46Å; L392-Y429 PolarHBondContact N-OH 3.23Å; L392-A439 HydrophobicContact CD2-CB 4.03Å; L392-V443 HydrophobicContact CD1-CG1 3.94Å; L392-V443 HydrophobicContact CD2-CG1 4.1Å; L392-V443 HydrophobicContact CD2-CG2 4.29Å
393	A	93.4	Very high	95.9	Very high	82 Å²	82	37.5 Å²	37.5	68%	0.678	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-67.5	-12.4	178.2	0	0	0	0	0	113.9	D391 V395	D391-A393 VanDerWaalsContact C-N 3.27Å; D391-A393 PolarHBondContact O-N 3.26Å; D391-A393 PolarHBondContact OD1-N 3.02Å; A393-V395 VanDerWaalsContact C-N 3.27Å; A393-V395 PolarHBondContact O-N 3.36Å
394	L	94.6	Very high	96	Very high	15 Å²	15	42.7 Å²	42.7	8%	0.079	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-79.7	-6.8	175.8	-55.6	175	0	0	0	113.2	M352 P355 A387 R390 D391 L392	M352-L394 HydrophobicContact CG-CD1 4.41Å; P355-L394 HydrophobicContact CB-CD2 4.42Å; P355-L394 HydrophobicContact CG-CD2 3.88Å; A387-L394 HydrophobicContact CB-CB 4.46Å; R390-L394 HydrophobicContact CB-CD1 4.33Å; R390-L394 HydrophobicContact CG-CD1 4.14Å; D391-L394 HydrophobicContact CB-CD1 3.88Å; D391-L394 HydrophobicContact CB-CG 3.92Å; D391-L394 WeakPolarHBondContact O-CB 3.49Å; D391-L394 PolarHBondContact O-N 3.29Å; L392-L394 PolarHBondContact O-N 3.27Å
395	V	95.1	Very high	96	Very high	16 Å²	16	46.6 Å²	46.6	10%	0.097	24%	0.236	C	C	.	.	S	Bend	trans	-127.1	149.9	176.8	-63.9	0	0	0	0	111.2	I384 A387 A388 L392 A393 L399 L400	I384-V395 HydrophobicContact CG2-CG1 4.25Å; A387-V395 HydrophobicContact CB-CG1 3.94Å; A388-V395 HydrophobicContact CB-CB 4.5Å; A388-V395 HydrophobicContact CB-CG1 4.04Å; A388-V395 HydrophobicContact CB-CG2 3.63Å; L392-V395 HydrophobicContact CD1-CG2 4.16Å; L392-V395 VanDerWaalsContact O-CG2 3.3Å; L392-V395 WeakPolarHBondContact O-CG2 3.45Å; L392-V395 PolarHBondContact O-N 2.95Å; A393-V395 VanDerWaalsContact C-N 3.27Å; A393-V395 PolarHBondContact O-N 3.36Å; V395-L399 HydrophobicContact CB-CB 4.42Å; V395-L399 HydrophobicContact CB-CD1 4.17Å; V395-L399 HydrophobicContact CG1-CD1 4.19Å; V395-L400 HydrophobicContact CG2-CD1 4.18Å; V395-L400 HydrophobicContact CG2-CD2 4.08Å; V395-L400 HydrophobicContact CG2-CG 4.03Å
396	N	93.6	Very high	96	Very high	52 Å²	52	47.4 Å²	47.4	28%	0.278	24%	0.238	S	C	.	.			trans	-102	167	172.8	63.7	50.6	0	0	0	111.2	T362 Q398 L399 L400	T362-N396 PolarHBondContact OG1-ND2 2.82Å; N396-Q398 PolarHBondContact O-N 2.71Å; N396-Q398 VanDerWaalsContact O-N 3.14Å; N396-Q398 WeakPolarHBondContact OD1-CB 3.13Å; N396-Q398 PolarHBondContact OD1-N 2.77Å; N396-Q398 VanDerWaalsContact OD1-N 3.09Å; N396-L399 PolarHBondContact O-N 2.74Å; N396-L399 VanDerWaalsContact O-N 3.11Å; N396-L399 PolarHBondContact OD1-N 3.39Å; N396-L400 PolarHBondContact O-N 2.87Å
397	D	94	Very high	96	Very high	112 Å²	112	44.6 Å²	44.6	60%	0.599	22%	0.221	S	C	*	.	H	α-helix	trans	-61.8	-23.7	-177.3	-55.1	-53.4	0	0	0	113.6	G401	D397-G401 PolarHBondContact O-N 3.09Å
398	Q	96.3	Very high	96.1	Very high	101 Å²	101	49 Å²	49	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-71.2	-44.6	175.6	-53.8	-171.8	8.1	0	0	110.9	T362 N396 L400 G401 F402	T362-Q398 HydrophobicContact CG2-CB 3.98Å; N396-Q398 PolarHBondContact O-N 2.71Å; N396-Q398 VanDerWaalsContact O-N 3.14Å; N396-Q398 WeakPolarHBondContact OD1-CB 3.13Å; N396-Q398 PolarHBondContact OD1-N 2.77Å; N396-Q398 VanDerWaalsContact OD1-N 3.09Å; Q398-L400 PolarHBondContact O-N 3.22Å; Q398-G401 CarbonylContact O-C 3.43Å; Q398-G401 VanDerWaalsContact O-CA 3.31Å; Q398-G401 WeakPolarHBondContact O-CA 3.24Å; Q398-G401 PolarHBondContact O-N 3.42Å; Q398-F402 HydrophobicContact CB-CE1 4.17Å; Q398-F402 HydrophobicContact CB-CE2 4.41Å; Q398-F402 HydrophobicContact CB-CZ 3.75Å; Q398-F402 WeakPolarHBondContact O-CD1 3.37Å; Q398-F402 WeakPolarHBondContact O-CD2 3.04Å; Q398-F402 VanDerWaalsContact O-CE1 3.3Å; Q398-F402 WeakPolarHBondContact O-CE1 3.5Å; Q398-F402 WeakPolarHBondContact O-CG 3.25Å; Q398-F402 PolarHBondContact O-N 2.94Å
399	L	96.8	Very high	96.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.1	-46	175	-65.3	176	0	0	0	111.3	L351 T362 L365 I384 V395 N396 G401 F402 V403	L351-L399 HydrophobicContact CD1-CD1 4.22Å; L351-L399 HydrophobicContact CD2-CD1 4.11Å; T362-L399 HydrophobicContact CG2-CD2 4.39Å; L365-L399 HydrophobicContact CB-CD2 4.01Å; L365-L399 HydrophobicContact CD1-CD2 3.64Å; L365-L399 HydrophobicContact CG-CD2 4.49Å; I384-L399 HydrophobicContact CD1-CB 4.06Å; I384-L399 HydrophobicContact CD1-CD2 3.95Å; I384-L399 HydrophobicContact CG1-CB 4.18Å; I384-L399 HydrophobicContact CG1-CD2 4.19Å; I384-L399 HydrophobicContact CG2-CB 3.91Å; V395-L399 HydrophobicContact CB-CB 4.42Å; V395-L399 HydrophobicContact CB-CD1 4.17Å; V395-L399 HydrophobicContact CG1-CD1 4.19Å; N396-L399 PolarHBondContact O-N 2.74Å; N396-L399 VanDerWaalsContact O-N 3.11Å; N396-L399 PolarHBondContact OD1-N 3.39Å; L399-G401 VanDerWaalsContact C-N 3.29Å; L399-G401 PolarHBondContact O-N 3.42Å; L399-F402 HydrophobicContact CD2-CD2 4.07Å; L399-F402 HydrophobicContact CD2-CE2 3.92Å; L399-F402 PolarHBondContact O-N 3.36Å; L399-V403 PolarHBondContact O-N 3.45Å
400	L	97.2	Very high	96.2	Very high	5 Å²	5	55 Å²	55	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-35.5	173.5	-65.3	176.3	0	0	0	111.9	I384 A388 L392 V395 N396 Q398 F402 V403 R404 L425 V443 W445	I384-L400 HydrophobicContact CG2-CD2 4.46Å; A388-L400 HydrophobicContact CB-CD2 4.43Å; L392-L400 HydrophobicContact CD1-CD1 4.13Å; V395-L400 HydrophobicContact CG2-CD1 4.18Å; V395-L400 HydrophobicContact CG2-CD2 4.08Å; V395-L400 HydrophobicContact CG2-CG 4.03Å; N396-L400 PolarHBondContact O-N 2.87Å; Q398-L400 PolarHBondContact O-N 3.22Å; L400-F402 PolarHBondContact O-N 2.88Å; L400-V403 PolarHBondContact O-N 3.47Å; L400-R404 WeakPolarHBondContact O-CB 3.39Å; L400-R404 PolarHBondContact O-N 3.06Å; L400-L425 HydrophobicContact CD2-CD1 3.84Å; L400-V443 HydrophobicContact CD1-CG1 3.99Å; L400-W445 HydrophobicContact CB-CZ2 4.25Å
401	G	97.5	Very high	96.3	Very high	8 Å²	8	55.4 Å²	55.4	8%	0.082	27%	0.272	C	S	.	.	H	α-helix	trans	-58.4	-39.9	171	0	0	0	0	0	113.8	D397 Q398 L399 R404 E405	D397-G401 PolarHBondContact O-N 3.09Å; Q398-G401 CarbonylContact O-C 3.43Å; Q398-G401 VanDerWaalsContact O-CA 3.31Å; Q398-G401 WeakPolarHBondContact O-CA 3.24Å; Q398-G401 PolarHBondContact O-N 3.42Å; L399-G401 VanDerWaalsContact C-N 3.29Å; L399-G401 PolarHBondContact O-N 3.42Å; G401-R404 VanDerWaalsContact O-CB 3.32Å; G401-R404 WeakPolarHBondContact O-CB 3.2Å; G401-R404 PolarHBondContact O-N 2.85Å; G401-E405 WeakPolarHBondContact O-CG 3.34Å; G401-E405 PolarHBondContact O-N 3.08Å
402	F	97.6	Very high	96.4	Very high	15 Å²	15	56.6 Å²	56.6	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-67.2	-39.9	177.3	-50.2	-28.2	0	0	0	111.3	T362 K366 I384 Q398 L399 L400 E405 R406	T362-F402 HydrophobicContact CG2-CE2 4.13Å; T362-F402 HydrophobicContact CG2-CZ 4.18Å; K366-F402 HydrophobicContact CB-CD2 4.3Å; K366-F402 HydrophobicContact CB-CE1 3.9Å; K366-F402 HydrophobicContact CB-CE2 3.6Å; K366-F402 HydrophobicContact CB-CZ 3.4Å; K366-F402 VanDerWaalsContact CB-CZ 3.4Å; K366-F402 HydrophobicContact CD-CE1 4.21Å; K366-F402 HydrophobicContact CD-CZ 4.01Å; K366-F402 HydrophobicContact CG-CD1 4.36Å; K366-F402 HydrophobicContact CG-CE1 3.64Å; K366-F402 HydrophobicContact CG-CE2 4.29Å; K366-F402 HydrophobicContact CG-CZ 3.62Å; I384-F402 HydrophobicContact CD1-CD2 4.47Å; Q398-F402 HydrophobicContact CB-CE1 4.17Å; Q398-F402 HydrophobicContact CB-CE2 4.41Å; Q398-F402 HydrophobicContact CB-CZ 3.75Å; Q398-F402 WeakPolarHBondContact O-CD1 3.37Å; Q398-F402 WeakPolarHBondContact O-CD2 3.04Å; Q398-F402 VanDerWaalsContact O-CE1 3.3Å; Q398-F402 WeakPolarHBondContact O-CE1 3.5Å; Q398-F402 WeakPolarHBondContact O-CG 3.25Å; Q398-F402 PolarHBondContact O-N 2.94Å; L399-F402 HydrophobicContact CD2-CD2 4.07Å; L399-F402 HydrophobicContact CD2-CE2 3.92Å; L399-F402 PolarHBondContact O-N 3.36Å; L400-F402 PolarHBondContact O-N 2.88Å; F402-E405 PolarHBondContact O-N 2.73Å; F402-R406 WeakPolarHBondContact O-CG 3.35Å; F402-R406 PolarHBondContact O-N 3.13Å
403	V	98.4	Very high	96.5	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-41.9	172.5	-176.6	0	0	0	0	111	I381 I384 I385 L399 L400 E405 R406 T407 A418 L422	I381-V403 HydrophobicContact CG2-CG1 4.05Å; I381-V403 HydrophobicContact CG2-CG2 4.43Å; I384-V403 HydrophobicContact CB-CG2 4.02Å; I384-V403 HydrophobicContact CD1-CG2 4.2Å; I384-V403 HydrophobicContact CG2-CG2 3.8Å; I385-V403 HydrophobicContact CD1-CG1 4.2Å; I385-V403 HydrophobicContact CG1-CG1 4.44Å; L399-V403 PolarHBondContact O-N 3.45Å; L400-V403 PolarHBondContact O-N 3.47Å; V403-E405 VanDerWaalsContact C-N 3.26Å; V403-E405 PolarHBondContact O-N 2.72Å; V403-R406 PolarHBondContact O-N 2.76Å; V403-T407 PolarHBondContact O-N 2.9Å; V403-A418 HydrophobicContact CG1-CB 3.93Å; V403-L422 HydrophobicContact CB-CD2 4.41Å; V403-L422 HydrophobicContact CG1-CD1 4.17Å; V403-L422 HydrophobicContact CG1-CD2 3.98Å; V403-L422 HydrophobicContact CG1-CG 3.83Å
404	R	98.2	Very high	96.8	Very high	115 Å²	115	57.8 Å²	57.8	43%	0.434	26%	0.257	S	S	.	.	H	α-helix	trans	-55.7	-40	174.3	-175.6	-178.7	69.5	177.1	-0.2	112	L400 G401 T407 W445 K449	L400-R404 WeakPolarHBondContact O-CB 3.39Å; L400-R404 PolarHBondContact O-N 3.06Å; G401-R404 VanDerWaalsContact O-CB 3.32Å; G401-R404 WeakPolarHBondContact O-CB 3.2Å; G401-R404 PolarHBondContact O-N 2.85Å; R404-T407 PolarHBondContact O-OG1 2.83Å; R404-W445 HydrophobicContact CB-CH2 3.73Å; R404-W445 HydrophobicContact CB-CZ3 3.84Å; R404-W445 HydrophobicContact CG-CE3 4.22Å; R404-W445 HydrophobicContact CG-CH2 3.95Å; R404-W445 HydrophobicContact CG-CZ3 3.53Å; R404-K449 HydrophobicContact CG-CD 4.29Å; R404-K449 HydrophobicContact CG-CG 4.08Å
405	E	97.5	Very high	96.9	Very high	82 Å²	82	58.5 Å²	58.5	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-69.4	-39.1	173.6	-71.9	169.6	-165.2	0	0	112.6	H370 G401 F402 V403 T407 L408	H370-E405 IonicContact CE1-OE2 2.64Å; H370-E405 PolarHBondContact CE1-OE2 3.41Å; H370-E405 VanDerWaalsContact CE1-OE2 3.24Å; H370-E405 IonicContact NE2-OE2 2.67Å; G401-E405 WeakPolarHBondContact O-CG 3.34Å; G401-E405 PolarHBondContact O-N 3.08Å; F402-E405 PolarHBondContact O-N 2.73Å; V403-E405 VanDerWaalsContact C-N 3.26Å; V403-E405 PolarHBondContact O-N 2.72Å; E405-T407 PolarHBondContact O-N 3.08Å; E405-T407 VanDerWaalsContact O-N 3.13Å; E405-L408 PolarHBondContact O-N 3.35Å
406	R	98.1	Very high	97.1	Very high	25 Å²	25	62.4 Å²	62.4	9%	0.094	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-16.7	177.6	-69.7	-42.7	88.9	-176.9	12	114.1	S369 H370 I381 F402 V403 L408 D409 V414 R415 A418	S369-R406 WeakPolarHBondContact O-CD 3.42Å; S369-R406 PolarHBondContact O-NE 3.11Å; S369-R406 PolarHBondContact O-NH1 3.06Å; H370-R406 PolarHBondContact CE1-NH2 2.96Å; H370-R406 PolarHBondContact NE2-NH2 3.42Å; I381-R406 HydrophobicContact CD1-CB 3.78Å; I381-R406 HydrophobicContact CD1-CG 3.91Å; I381-R406 HydrophobicContact CG1-CB 4.08Å; I381-R406 HydrophobicContact CG1-CG 3.92Å; F402-R406 WeakPolarHBondContact O-CG 3.35Å; F402-R406 PolarHBondContact O-N 3.13Å; V403-R406 PolarHBondContact O-N 2.76Å; R406-L408 PolarHBondContact O-N 3.33Å; R406-L408 VanDerWaalsContact O-N 3.08Å; R406-D409 IonicContact CZ-OD2 3.05Å; R406-D409 IonicContact NH1-OD2 2.79Å; R406-D409 PolarHBondContact NH1-OD2 2.92Å; R406-D409 VanDerWaalsContact O-CB 3.31Å; R406-D409 WeakPolarHBondContact O-CB 3.3Å; R406-D409 PolarHBondContact O-N 3.23Å; R406-V414 HydrophobicContact CB-CG1 4.26Å; R406-V414 HydrophobicContact CG-CG1 4.27Å; R406-R415 WeakPolarHBondContact O-CA 3.13Å; R406-A418 HydrophobicContact CB-CB 3.8Å
407	T	98	Very high	97.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-15.3	167.3	68.1	0	0	0	0	114	V403 R404 E405 R415 A418 M419 L422 K449	V403-T407 PolarHBondContact O-N 2.9Å; R404-T407 PolarHBondContact O-OG1 2.83Å; E405-T407 PolarHBondContact O-N 3.08Å; E405-T407 VanDerWaalsContact O-N 3.13Å; T407-R415 VanDerWaalsContact O-CD 3.28Å; T407-R415 WeakPolarHBondContact O-CD 3.26Å; T407-A418 HydrophobicContact CG2-CB 4.12Å; T407-M419 HydrophobicContact CG2-CG 4.22Å; T407-L422 HydrophobicContact CG2-CD1 3.73Å; T407-K449 WeakPolarHBondContact OG1-CE 3.4Å; T407-K449 PolarHBondContact OG1-NZ 3.45Å
408	L	96.8	Very high	97.5	Very high	92 Å²	92	57.4 Å²	57.4	48%	0.482	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	19.2	175.8	-61	177.6	0	0	0	112.9	E405 R406 I453 Q456	E405-L408 PolarHBondContact O-N 3.35Å; R406-L408 PolarHBondContact O-N 3.33Å; R406-L408 VanDerWaalsContact O-N 3.08Å; L408-I453 HydrophobicContact CD2-CD1 3.72Å; L408-I453 HydrophobicContact CG-CD1 4.49Å; L408-Q456 HydrophobicContact CD2-CG 4.46Å
409	D	97.9	Very high	97.6	Very high	9 Å²	9	52.6 Å²	52.6	5%	0.048	22%	0.223	C	C	.	.			trans	-62.1	149.5	178.2	-164.5	-75.9	0	0	0	112.7	R377 R406 R411 V414 R415	R377-D409 IonicContact CZ-OD1 2.62Å; R377-D409 IonicContact CZ-OD2 3.42Å; R377-D409 IonicContact NH1-OD1 3.47Å; R377-D409 PolarHBondContact NH1-OD1 3.35Å; R377-D409 IonicContact NH1-OD2 2.7Å; R377-D409 PolarHBondContact NH1-OD2 3.5Å; R406-D409 IonicContact CZ-OD2 3.05Å; R406-D409 IonicContact NH1-OD2 2.79Å; R406-D409 PolarHBondContact NH1-OD2 2.92Å; R406-D409 VanDerWaalsContact O-CB 3.31Å; R406-D409 WeakPolarHBondContact O-CB 3.3Å; R406-D409 PolarHBondContact O-N 3.23Å; D409-R411 PolarHBondContact O-N 3.19Å; D409-R411 PolarHBondContact OD1-N 3.17Å; D409-V414 HydrophobicContact CB-CB 4.07Å; D409-V414 HydrophobicContact CB-CG1 3.79Å; D409-R415 HydrophobicContact CB-CG 4Å; D409-R415 WeakPolarHBondContact O-CD 3.34Å; D409-R415 WeakPolarHBondContact O-CG 3.44Å; D409-R415 PolarHBondContact O-NH1 3.11Å
410	K	95.8	Very high	97.7	Very high	205 Å²	205	54.1 Å²	54.1	89%	0.891	23%	0.231	S	C	*	.	S	Bend	trans	-61.4	-28.4	178	-63.9	178.7	-178.7	175.6	0	112.6
411	R	97.2	Very high	97.8	Very high	143 Å²	143	53.9 Å²	53.9	54%	0.54	23%	0.23	S	C	.	.	S	Bend	trans	-99.1	124.8	-176.3	-65.8	-67.4	-152.1	-163.4	-2.2	111.5	E374 D409 R413 V414 R415	E374-R411 HydrophobicContact CG-CB 4.03Å; E374-R411 HydrophobicContact CG-CG 4.01Å; E374-R411 WeakPolarHBondContact OE2-CD 3.43Å; E374-R411 WeakPolarHBondContact OE2-CG 3.32Å; E374-R411 IonicContact OE2-CZ 2.82Å; E374-R411 IonicContact OE2-NE 3.99Å; E374-R411 PolarHBondContact OE2-NE 2.96Å; D409-R411 PolarHBondContact O-N 3.19Å; D409-R411 PolarHBondContact OD1-N 3.17Å; R411-R413 PolarHBondContact O-N 3.31Å; R411-V414 HydrophobicContact CB-CB 4.41Å; R411-V414 HydrophobicContact CB-CG2 4.09Å; R411-V414 PolarHBondContact O-N 2.81Å; R411-V414 VanDerWaalsContact O-N 3.12Å; R411-R415 PolarHBondContact O-N 3.42Å; R411-R415 VanDerWaalsContact O-N 3.1Å
412	W	95.3	Very high	97.8	Very high	94 Å²	94	53.5 Å²	53.5	36%	0.356	23%	0.226	S	C	.	.	H	α-helix	trans	-52.8	-46.9	-179	165.1	-131	0	0	0	113.3	V414 R415 K416 M419 D460 D461 L464	W412-V414 VanDerWaalsContact C-N 3.27Å; W412-V414 PolarHBondContact O-N 3.48Å; W412-R415 PolarHBondContact O-N 3.45Å; W412-K416 HydrophobicContact CD2-CB 4.44Å; W412-K416 HydrophobicContact CE3-CB 4.33Å; W412-K416 HydrophobicContact CH2-CB 4.3Å; W412-K416 HydrophobicContact CZ2-CB 4.37Å; W412-K416 HydrophobicContact CZ2-CD 4.15Å; W412-K416 HydrophobicContact CZ3-CB 4.26Å; W412-K416 WeakPolarHBondContact O-CB 3.3Å; W412-K416 PolarHBondContact O-N 3.03Å; W412-M419 HydrophobicContact CZ3-CE 4.36Å; W412-D460 HydrophobicContact CD2-CB 4.09Å; W412-D460 HydrophobicContact CE3-CB 4.1Å; W412-D460 HydrophobicContact CH2-CB 3.68Å; W412-D460 VanDerWaalsContact CH2-O 3.28Å; W412-D460 WeakPolarHBondContact CH2-O 2.99Å; W412-D460 HydrophobicContact CZ2-CB 3.68Å; W412-D460 HydrophobicContact CZ3-CB 3.91Å; W412-D461 VanDerWaalsContact CZ3-OD1 3.25Å; W412-D461 WeakPolarHBondContact CZ3-OD1 3.21Å; W412-L464 HydrophobicContact CH2-CB 3.87Å; W412-L464 HydrophobicContact CH2-CD2 3.73Å; W412-L464 HydrophobicContact CH2-CG 4.38Å; W412-L464 HydrophobicContact CZ3-CB 4.5Å; W412-L464 HydrophobicContact CZ3-CD2 3.99Å
413	R	97.3	Very high	97.9	Very high	124 Å²	124	52.8 Å²	52.8	47%	0.468	22%	0.223	S	C	.	.	H	α-helix	trans	-55.5	-42.3	178.9	-176.7	-173.4	165.8	-170.6	-7.4	112.2	E374 H378 R411 E417	E374-R413 WeakPolarHBondContact OE1-CB 3.39Å; H378-R413 PolarHBondContact CD2-NE 3.41Å; H378-R413 PolarHBondContact CD2-NH2 2.71Å; H378-R413 PolarHBondContact CE1-NH2 3.23Å; H378-R413 PolarHBondContact ND1-NH2 2.92Å; H378-R413 PolarHBondContact NE2-NE 2.83Å; H378-R413 PolarHBondContact NE2-NH2 3.32Å; R411-R413 PolarHBondContact O-N 3.31Å; R413-E417 PolarHBondContact O-N 3.45Å; R413-E417 VanDerWaalsContact O-N 3.09Å
414	V	98.5	Very high	97.9	Very high	0 Å²	0	55 Å²	55	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70.9	-42.8	-179.6	-178.3	0	0	0	0	111	E374 R377 H378 I381 R406 D409 R411 W412 K416 E417 A418	E374-V414 HydrophobicContact CG-CG2 3.57Å; R377-V414 HydrophobicContact CB-CG1 4.24Å; H378-V414 HydrophobicContact CB-CG2 4.44Å; I381-V414 HydrophobicContact CD1-CG1 3.59Å; I381-V414 WeakPolarHBondContact CD1-O 3.24Å; R406-V414 HydrophobicContact CB-CG1 4.26Å; R406-V414 HydrophobicContact CG-CG1 4.27Å; D409-V414 HydrophobicContact CB-CB 4.07Å; D409-V414 HydrophobicContact CB-CG1 3.79Å; R411-V414 HydrophobicContact CB-CB 4.41Å; R411-V414 HydrophobicContact CB-CG2 4.09Å; R411-V414 PolarHBondContact O-N 2.81Å; R411-V414 VanDerWaalsContact O-N 3.12Å; W412-V414 VanDerWaalsContact C-N 3.27Å; W412-V414 PolarHBondContact O-N 3.48Å; V414-K416 PolarHBondContact O-N 3.21Å; V414-E417 PolarHBondContact O-N 3.27Å; V414-A418 PolarHBondContact O-N 2.95Å; V414-A418 VanDerWaalsContact O-N 3.1Å
415	R	98.1	Very high	97.8	Very high	29 Å²	29	49.6 Å²	49.6	11%	0.109	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-45.2	172.7	-67.2	-158.8	-56.4	-79.6	2.3	112.4	R406 T407 D409 R411 W412 E417 A418 M419 D461	R406-R415 WeakPolarHBondContact O-CA 3.13Å; T407-R415 VanDerWaalsContact O-CD 3.28Å; T407-R415 WeakPolarHBondContact O-CD 3.26Å; D409-R415 HydrophobicContact CB-CG 4Å; D409-R415 WeakPolarHBondContact O-CD 3.34Å; D409-R415 WeakPolarHBondContact O-CG 3.44Å; D409-R415 PolarHBondContact O-NH1 3.11Å; R411-R415 PolarHBondContact O-N 3.42Å; R411-R415 VanDerWaalsContact O-N 3.1Å; W412-R415 PolarHBondContact O-N 3.45Å; R415-E417 PolarHBondContact O-N 2.87Å; R415-A418 PolarHBondContact O-N 3.32Å; R415-M419 HydrophobicContact CB-CE 3.76Å; R415-M419 WeakPolarHBondContact O-CB 3.42Å; R415-M419 WeakPolarHBondContact O-CG 3.39Å; R415-M419 PolarHBondContact O-N 2.8Å; R415-D461 IonicContact CZ-OD1 2.66Å; R415-D461 VanDerWaalsContact CZ-OD1 3.24Å; R415-D461 IonicContact CZ-OD2 2.76Å; R415-D461 VanDerWaalsContact NE-CG 3.34Å; R415-D461 IonicContact NE-OD1 3.93Å; R415-D461 PolarHBondContact NE-OD1 3.32Å; R415-D461 IonicContact NE-OD2 2.71Å; R415-D461 PolarHBondContact NE-OD2 2.93Å; R415-D461 VanDerWaalsContact NE-OD2 3.1Å; R415-D461 IonicContact NH2-OD1 3.86Å; R415-D461 PolarHBondContact NH2-OD1 3.48Å; R415-D461 IonicContact NH2-OD2 2.8Å; R415-D461 PolarHBondContact NH2-OD2 3.14Å
416	K	98.2	Very high	97.8	Very high	98 Å²	98	46.7 Å²	46.7	43%	0.426	20%	0.198	S	C	.	.	H	α-helix	trans	-58.9	-47.1	179.8	175.5	179.3	175.1	-173.6	0	111.3	W412 V414 M419 M420 L464	W412-K416 HydrophobicContact CD2-CB 4.44Å; W412-K416 HydrophobicContact CE3-CB 4.33Å; W412-K416 HydrophobicContact CH2-CB 4.3Å; W412-K416 HydrophobicContact CZ2-CB 4.37Å; W412-K416 HydrophobicContact CZ2-CD 4.15Å; W412-K416 HydrophobicContact CZ3-CB 4.26Å; W412-K416 WeakPolarHBondContact O-CB 3.3Å; W412-K416 PolarHBondContact O-N 3.03Å; V414-K416 PolarHBondContact O-N 3.21Å; K416-M419 PolarHBondContact O-N 3.03Å; K416-M420 HydrophobicContact CG-CG 4.38Å; K416-M420 WeakPolarHBondContact O-CB 3.45Å; K416-M420 VanDerWaalsContact O-CG 3.28Å; K416-M420 WeakPolarHBondContact O-CG 3.29Å; K416-M420 PolarHBondContact O-N 3.28Å; K416-L464 HydrophobicContact CB-CD2 4.01Å; K416-L464 HydrophobicContact CG-CD2 3.88Å
417	E	98.5	Very high	97.7	Very high	60 Å²	60	47.6 Å²	47.6	28%	0.28	20%	0.203	S	C	.	.	H	α-helix	trans	-65.5	-41.6	179.7	-160.7	58.7	-152.5	0	0	111.6	I381 V382 R413 V414 R415 G421	I381-E417 HydrophobicContact CD1-CB 4.43Å; I381-E417 HydrophobicContact CG2-CB 4.43Å; I381-E417 HydrophobicContact CG2-CG 4.11Å; V382-E417 HydrophobicContact CG2-CG 3.98Å; R413-E417 PolarHBondContact O-N 3.45Å; R413-E417 VanDerWaalsContact O-N 3.09Å; V414-E417 PolarHBondContact O-N 3.27Å; R415-E417 PolarHBondContact O-N 2.87Å; E417-G421 PolarHBondContact O-N 3.04Å
418	A	98.7	Very high	97.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-47.5	174.9	0	0	0	0	0	112.5	I381 V403 R406 T407 V414 R415 L422	I381-A418 HydrophobicContact CD1-CB 3.99Å; I381-A418 HydrophobicContact CG1-CB 4.48Å; I381-A418 HydrophobicContact CG2-CB 4.47Å; V403-A418 HydrophobicContact CG1-CB 3.93Å; R406-A418 HydrophobicContact CB-CB 3.8Å; T407-A418 HydrophobicContact CG2-CB 4.12Å; V414-A418 PolarHBondContact O-N 2.95Å; V414-A418 VanDerWaalsContact O-N 3.1Å; R415-A418 PolarHBondContact O-N 3.32Å; A418-L422 VanDerWaalsContact O-CG 3.29Å; A418-L422 WeakPolarHBondContact O-CG 3.23Å; A418-L422 PolarHBondContact O-N 3.29Å
419	M	98.8	Very high	97.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-46.2	178.3	-73.3	-171.8	-108.9	0	0	112.3	T407 W412 R415 K416 A423 L450 I453 L464 V465 I468	T407-M419 HydrophobicContact CG2-CG 4.22Å; W412-M419 HydrophobicContact CZ3-CE 4.36Å; R415-M419 HydrophobicContact CB-CE 3.76Å; R415-M419 WeakPolarHBondContact O-CB 3.42Å; R415-M419 WeakPolarHBondContact O-CG 3.39Å; R415-M419 PolarHBondContact O-N 2.8Å; K416-M419 PolarHBondContact O-N 3.03Å; M419-A423 VanDerWaalsContact O-CB 3.3Å; M419-A423 WeakPolarHBondContact O-CB 3.5Å; M419-A423 PolarHBondContact O-N 3.19Å; M419-L450 HydrophobicContact CB-CD2 4.02Å; M419-L450 HydrophobicContact CG-CD2 4.12Å; M419-I453 HydrophobicContact CE-CG2 3.95Å; M419-I453 HydrophobicContact SD-CB 4.25Å; M419-I453 HydrophobicContact SD-CG1 4.16Å; M419-I453 HydrophobicContact SD-CG2 3.75Å; M419-L464 HydrophobicContact CB-CD2 4.01Å; M419-L464 HydrophobicContact CE-CD2 4.03Å; M419-L464 HydrophobicContact SD-CD2 3.95Å; M419-L464 HydrophobicContact SD-CG 4.49Å; M419-V465 HydrophobicContact SD-CG2 4.48Å; M419-I468 HydrophobicContact CB-CD1 3.71Å
420	M	98.6	Very high	97.4	Very high	31 Å²	31	46.6 Å²	46.6	15%	0.153	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-38.6	178.7	-73.4	-62.8	-57.3	0	0	112.3	K416 Q424 L464 I468 Y472	K416-M420 HydrophobicContact CG-CG 4.38Å; K416-M420 WeakPolarHBondContact O-CB 3.45Å; K416-M420 VanDerWaalsContact O-CG 3.28Å; K416-M420 WeakPolarHBondContact O-CG 3.29Å; K416-M420 PolarHBondContact O-N 3.28Å; M420-Q424 VanDerWaalsContact O-CG 3.23Å; M420-Q424 WeakPolarHBondContact O-CG 3.31Å; M420-Q424 PolarHBondContact O-N 3.16Å; M420-L464 HydrophobicContact CG-CD1 4.17Å; M420-L464 HydrophobicContact SD-CD1 3.72Å; M420-I468 HydrophobicContact SD-CD1 4.12Å; M420-I468 HydrophobicContact SD-CG1 3.91Å; M420-Y472 HydrophobicContact CE-CE2 3.77Å; M420-Y472 WeakPolarHBondContact CE-OH 3.31Å; M420-Y472 HydrophobicContact SD-CE2 4.5Å
421	G	98.3	Very high	97.2	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-63.9	-49.1	176.1	0	0	0	0	0	112.4	E417 A423 Q424 L425	E417-G421 PolarHBondContact O-N 3.04Å; G421-A423 PolarHBondContact O-N 3.31Å; G421-Q424 PolarHBondContact O-N 3.35Å; G421-L425 PolarHBondContact O-N 3.26Å; G421-L425 VanDerWaalsContact O-N 3.07Å
422	L	98.6	Very high	96.9	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62	-41.9	176	-67.2	174.7	0	0	0	111.7	V403 T407 A418 Q424 L425 Y426 W445 I446	V403-L422 HydrophobicContact CB-CD2 4.41Å; V403-L422 HydrophobicContact CG1-CD1 4.17Å; V403-L422 HydrophobicContact CG1-CD2 3.98Å; V403-L422 HydrophobicContact CG1-CG 3.83Å; T407-L422 HydrophobicContact CG2-CD1 3.73Å; A418-L422 VanDerWaalsContact O-CG 3.29Å; A418-L422 WeakPolarHBondContact O-CG 3.23Å; A418-L422 PolarHBondContact O-N 3.29Å; L422-Q424 VanDerWaalsContact C-N 3.3Å; L422-Q424 PolarHBondContact O-N 3.44Å; L422-L425 HydrophobicContact CD2-CD1 4.48Å; L422-L425 PolarHBondContact O-N 2.86Å; L422-L425 VanDerWaalsContact O-N 3.14Å; L422-Y426 PolarHBondContact O-N 3.29Å; L422-W445 HydrophobicContact CD1-CH2 4.26Å; L422-W445 HydrophobicContact CD1-CZ3 4.26Å; L422-W445 HydrophobicContact CD2-CH2 3.83Å; L422-I446 HydrophobicContact CB-CD1 4.2Å; L422-I446 HydrophobicContact CB-CG1 4.45Å; L422-I446 HydrophobicContact CB-CG2 3.89Å; L422-I446 HydrophobicContact CD2-CD1 3.83Å; L422-I446 HydrophobicContact CD2-CG1 4.21Å
423	A	98.5	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-38.5	175.4	0	0	0	0	0	112.8	M419 G421 Y426 K427 L450 I468 Y472	M419-A423 VanDerWaalsContact O-CB 3.3Å; M419-A423 WeakPolarHBondContact O-CB 3.5Å; M419-A423 PolarHBondContact O-N 3.19Å; G421-A423 PolarHBondContact O-N 3.31Å; A423-Y426 PolarHBondContact O-N 3.23Å; A423-K427 PolarHBondContact O-N 3.42Å; A423-K427 VanDerWaalsContact O-N 3.08Å; A423-L450 HydrophobicContact CB-CD1 4.1Å; A423-I468 HydrophobicContact CB-CB 4.46Å; A423-I468 HydrophobicContact CB-CD1 4.15Å; A423-I468 HydrophobicContact CB-CG1 4.05Å; A423-I468 HydrophobicContact CB-CG2 3.7Å; A423-Y472 HydrophobicContact CB-CD1 4.3Å; A423-Y472 HydrophobicContact CB-CD2 4.1Å; A423-Y472 HydrophobicContact CB-CG 3.82Å
424	Q	98	Very high	96.1	Very high	48 Å²	48	34.7 Å²	34.7	22%	0.224	17%	0.172	C	C	.	.	H	α-helix	trans	-67.7	-36.5	174.8	-72.3	166.2	31	0	0	112.6	K389 M420 G421 L422 K428 Y472	K389-Q424 HydrophobicContact CD-CB 4.17Å; M420-Q424 VanDerWaalsContact O-CG 3.23Å; M420-Q424 WeakPolarHBondContact O-CG 3.31Å; M420-Q424 PolarHBondContact O-N 3.16Å; G421-Q424 PolarHBondContact O-N 3.35Å; L422-Q424 VanDerWaalsContact C-N 3.3Å; L422-Q424 PolarHBondContact O-N 3.44Å; Q424-K428 PolarHBondContact O-N 3.21Å; Q424-Y472 HydrophobicContact CG-CD1 4.18Å; Q424-Y472 HydrophobicContact CG-CE1 3.56Å
425	L	97.5	Very high	95.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.9	-44.7	173.7	-66.1	177.6	0	0	0	111.9	I385 A388 K389 L400 G421 L422 K427 K428 Y429 I446	I385-L425 HydrophobicContact CD1-CD1 3.59Å; I385-L425 HydrophobicContact CD1-CG 4.17Å; A388-L425 HydrophobicContact CB-CD1 3.9Å; A388-L425 HydrophobicContact CB-CD2 3.59Å; A388-L425 HydrophobicContact CB-CG 4.41Å; K389-L425 HydrophobicContact CB-CD2 4.42Å; K389-L425 HydrophobicContact CG-CD2 3.67Å; K389-L425 HydrophobicContact CG-CG 4.49Å; L400-L425 HydrophobicContact CD2-CD1 3.84Å; G421-L425 PolarHBondContact O-N 3.26Å; G421-L425 VanDerWaalsContact O-N 3.07Å; L422-L425 HydrophobicContact CD2-CD1 4.48Å; L422-L425 PolarHBondContact O-N 2.86Å; L422-L425 VanDerWaalsContact O-N 3.14Å; L425-K427 PolarHBondContact O-N 2.8Å; L425-K428 PolarHBondContact O-N 2.97Å; L425-Y429 HydrophobicContact CB-CD2 4.47Å; L425-Y429 HydrophobicContact CD2-CD2 4.28Å; L425-Y429 HydrophobicContact CD2-CE2 3.86Å; L425-Y429 WeakPolarHBondContact O-CD2 3.48Å; L425-Y429 PolarHBondContact O-N 2.82Å; L425-I446 HydrophobicContact CB-CD1 4.23Å
426	Y	97.7	Very high	95.3	Very high	21 Å²	21	37.4 Å²	37.4	8%	0.082	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-46.7	176.7	-177.2	-88.6	0	0	0	111.7	L422 A423 K428 C430 L431 I446 K447 L473	L422-Y426 PolarHBondContact O-N 3.29Å; A423-Y426 PolarHBondContact O-N 3.23Å; Y426-K428 VanDerWaalsContact C-N 3.35Å; Y426-K428 PolarHBondContact O-N 3.23Å; Y426-C430 HydrophobicContact CD1-CB 4.35Å; Y426-C430 HydrophobicContact CD2-CB 3.75Å; Y426-C430 WeakPolarHBondContact CD2-SG 3.22Å; Y426-C430 HydrophobicContact CE1-CB 4.2Å; Y426-C430 HydrophobicContact CE2-CB 3.57Å; Y426-C430 HydrophobicContact CG-CB 4.13Å; Y426-C430 WeakPolarHBondContact O-CA 3.25Å; Y426-C430 VanDerWaalsContact O-CB 3.27Å; Y426-C430 WeakPolarHBondContact O-CB 3.48Å; Y426-C430 PolarHBondContact O-N 3.06Å; Y426-L431 PolarHBondContact O-N 2.96Å; Y426-L431 VanDerWaalsContact O-N 3.15Å; Y426-I446 HydrophobicContact CD2-CB 4.26Å; Y426-I446 HydrophobicContact CD2-CG2 4.38Å; Y426-I446 HydrophobicContact CG-CG2 4.45Å; Y426-K447 HydrophobicContact CD2-CB 4.3Å; Y426-K447 HydrophobicContact CE2-CB 3.72Å; Y426-K447 HydrophobicContact CE2-CD 4.18Å; Y426-K447 HydrophobicContact CE2-CG 4.32Å; Y426-L473 HydrophobicContact CD1-CD2 3.46Å; Y426-L473 VanDerWaalsContact CD1-CD2 3.46Å; Y426-L473 HydrophobicContact CE1-CD2 3.73Å; Y426-L473 HydrophobicContact CG-CD2 3.93Å
427	K	96.4	Very high	94.8	Very high	45 Å²	45	39 Å²	39	20%	0.196	21%	0.212	C	C	.	.	I	π-helix	trans	-60.3	-44.1	178.3	-168	175.7	-166.6	162.7	0	112	A423 L425 L431 H432 Q471 Y472	A423-K427 PolarHBondContact O-N 3.42Å; A423-K427 VanDerWaalsContact O-N 3.08Å; L425-K427 PolarHBondContact O-N 2.8Å; K427-L431 HydrophobicContact CG-CD2 4.19Å; K427-L431 WeakPolarHBondContact O-CB 3.3Å; K427-L431 PolarHBondContact O-N 3.13Å; K427-H432 PolarHBondContact O-CD2 3.1Å; K427-H432 PolarHBondContact O-N 3.5Å; K427-H432 VanDerWaalsContact O-N 3.08Å; K427-Q471 PolarHBondContact NZ-O 3.3Å; K427-Y472 HydrophobicContact CB-CD1 4.07Å; K427-Y472 HydrophobicContact CD-CD1 3.98Å
428	K	96.1	Very high	94.4	Very high	43 Å²	43	42.2 Å²	42.2	19%	0.187	23%	0.227	C	C	.	.	I	π-helix	trans	-68.2	-47.5	-178.8	-165.2	-169.2	171.1	-161.6	0	112.7	K389 R390 Q424 L425 Y426 E434	K389-K428 PolarHBondContact O-NZ 2.66Å; R390-K428 PolarHBondContact O-NZ 3.34Å; Q424-K428 PolarHBondContact O-N 3.21Å; L425-K428 PolarHBondContact O-N 2.97Å; Y426-K428 VanDerWaalsContact C-N 3.35Å; Y426-K428 PolarHBondContact O-N 3.23Å; K428-E434 WeakPolarHBondContact CE-OE2 3.15Å; K428-E434 HydrophobicContact CG-CB 4.26Å; K428-E434 VanDerWaalsContact CG-CD 3.4Å; K428-E434 HydrophobicContact CG-CG 4.31Å; K428-E434 WeakPolarHBondContact CG-OE1 3.36Å; K428-E434 VanDerWaalsContact CG-OE2 3.27Å; K428-E434 WeakPolarHBondContact CG-OE2 3.26Å; K428-E434 WeakPolarHBondContact O-CB 3.47Å; K428-E434 PolarHBondContact O-N 3.21Å
429	Y	96.1	Very high	94.1	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.012	23%	0.232	C	C	.	.	I	π-helix	trans	-98.5	-35.2	-169	-63.5	-59.4	0	0	0	114.3	A388 D391 L392 L425 G433 A435 A440	A388-Y429 VanDerWaalsContact O-CE2 3.25Å; A388-Y429 WeakPolarHBondContact O-CE2 3.35Å; A388-Y429 PolarHBondContact O-OH 3.14Å; D391-Y429 WeakPolarHBondContact CA-OH 3.34Å; L392-Y429 HydrophobicContact CB-CD2 4.37Å; L392-Y429 HydrophobicContact CB-CE1 4.28Å; L392-Y429 HydrophobicContact CB-CE2 3.94Å; L392-Y429 HydrophobicContact CD1-CD2 4.32Å; L392-Y429 HydrophobicContact CD1-CE2 4.22Å; L392-Y429 HydrophobicContact CD2-CD2 4.39Å; L392-Y429 HydrophobicContact CD2-CG 4.46Å; L392-Y429 PolarHBondContact N-OH 3.23Å; L425-Y429 HydrophobicContact CB-CD2 4.47Å; L425-Y429 HydrophobicContact CD2-CD2 4.28Å; L425-Y429 HydrophobicContact CD2-CE2 3.86Å; L425-Y429 WeakPolarHBondContact O-CD2 3.48Å; L425-Y429 PolarHBondContact O-N 2.82Å; Y429-G433 WeakPolarHBondContact O-CA 3.37Å; Y429-A435 HydrophobicContact CD1-CB 3.62Å; Y429-A435 HydrophobicContact CE1-CB 3.77Å; Y429-A440 WeakPolarHBondContact O-CB 3.45Å
430	C	93.3	Very high	93.8	Very high	34 Å²	34	43.9 Å²	43.9	23%	0.23	24%	0.24	C	C	.	.	I	π-helix	trans	-88.1	-49.1	177.2	-52.5	0	0	0	0	112	Y426	Y426-C430 HydrophobicContact CD1-CB 4.35Å; Y426-C430 HydrophobicContact CD2-CB 3.75Å; Y426-C430 WeakPolarHBondContact CD2-SG 3.22Å; Y426-C430 HydrophobicContact CE1-CB 4.2Å; Y426-C430 HydrophobicContact CE2-CB 3.57Å; Y426-C430 HydrophobicContact CG-CB 4.13Å; Y426-C430 WeakPolarHBondContact O-CA 3.25Å; Y426-C430 VanDerWaalsContact O-CB 3.27Å; Y426-C430 WeakPolarHBondContact O-CB 3.48Å; Y426-C430 PolarHBondContact O-N 3.06Å
431	L	90.7	Very high	93.4	Very high	60 Å²	60	48.5 Å²	48.5	31%	0.314	26%	0.261	S	S	.	.	I	π-helix	trans	-82	-36.8	-173.1	-170.4	69.3	0	0	0	113.7	Y426 K427 P475 C486	Y426-L431 PolarHBondContact O-N 2.96Å; Y426-L431 VanDerWaalsContact O-N 3.15Å; K427-L431 HydrophobicContact CG-CD2 4.19Å; K427-L431 WeakPolarHBondContact O-CB 3.3Å; K427-L431 PolarHBondContact O-N 3.13Å; L431-P475 HydrophobicContact CD2-CG 3.58Å; L431-C486 VanDerWaalsContact CD1-SG 3.59Å
432	H	91	Very high	93.2	Very high	107 Å²	107	53.3 Å²	53.3	50%	0.495	28%	0.282	S	S	.	.	S	Bend	trans	-95.4	-9.9	176	-56.5	173.8	0	0	0	113.7	K427 E434	K427-H432 PolarHBondContact O-CD2 3.1Å; K427-H432 PolarHBondContact O-N 3.5Å; K427-H432 VanDerWaalsContact O-N 3.08Å; H432-E434 HydrophobicContact CB-CG 3.83Å; H432-E434 IonicContact CE1-OE1 3.96Å; H432-E434 IonicContact CG-OE1 2.59Å; H432-E434 IonicContact ND1-OE1 2.7Å; H432-E434 PolarHBondContact ND1-OE1 3.01Å; H432-E434 PolarHBondContact O-N 3.08Å
433	G	87.8	Confident	93	Very high	36 Å²	36	53.3 Å²	53.3	37%	0.371	28%	0.282	S	S	.	.			trans	64.2	18.2	-179.8	0	0	0	0	0	115.9	Y429 A435 G436	Y429-G433 WeakPolarHBondContact O-CA 3.37Å; G433-A435 PolarHBondContact O-N 3.46Å; G433-G436 PolarHBondContact O-N 3.09Å
434	E	89.7	Confident	92.8	Very high	112 Å²	112	55.6 Å²	55.6	52%	0.523	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-7.9	-166.6	-72.6	176.4	-136.3	0	0	116	K428 H432	K428-E434 WeakPolarHBondContact CE-OE2 3.15Å; K428-E434 HydrophobicContact CG-CB 4.26Å; K428-E434 VanDerWaalsContact CG-CD 3.4Å; K428-E434 HydrophobicContact CG-CG 4.31Å; K428-E434 WeakPolarHBondContact CG-OE1 3.36Å; K428-E434 VanDerWaalsContact CG-OE2 3.27Å; K428-E434 WeakPolarHBondContact CG-OE2 3.26Å; K428-E434 WeakPolarHBondContact O-CB 3.47Å; K428-E434 PolarHBondContact O-N 3.21Å; H432-E434 HydrophobicContact CB-CG 3.83Å; H432-E434 IonicContact CE1-OE1 3.96Å; H432-E434 IonicContact CG-OE1 2.59Å; H432-E434 IonicContact ND1-OE1 2.7Å; H432-E434 PolarHBondContact ND1-OE1 3.01Å; H432-E434 PolarHBondContact O-N 3.08Å
435	A	89.3	Confident	92.7	Very high	47 Å²	47	56.3 Å²	56.3	39%	0.388	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	16.7	173.8	0	0	0	0	0	114	Y429 G433 A439	Y429-A435 HydrophobicContact CD1-CB 3.62Å; Y429-A435 HydrophobicContact CE1-CB 3.77Å; G433-A435 PolarHBondContact O-N 3.46Å; A435-A439 HydrophobicContact CB-CB 3.52Å; A435-A439 WeakPolarHBondContact O-CB 3.36Å
436	G	90.5	Very high	92.8	Very high	39 Å²	39	56.3 Å²	56.3	40%	0.402	30%	0.299	S	S	.	.			trans	78.4	171.8	179.2	0	0	0	0	0	115.3	G433 E438 A439 A440	G433-G436 PolarHBondContact O-N 3.09Å; G436-E438 PolarHBondContact O-N 2.88Å; G436-A439 PolarHBondContact O-N 3.46Å; G436-A440 PolarHBondContact O-N 2.95Å; G436-A440 VanDerWaalsContact O-N 3.16Å
437	K	87.7	Confident	92.7	Very high	132 Å²	132	56.2 Å²	56.2	57%	0.574	30%	0.299	S	S	*	.	H	α-helix	trans	-60.7	-43.8	-171.3	-70.6	-168.2	170.6	-169.5	0	113.7	A439 A440 E441 E647	K437-A439 PolarHBondContact O-N 2.95Å; K437-A440 WeakPolarHBondContact O-CB 3.12Å; K437-A440 PolarHBondContact O-N 2.84Å; K437-E441 WeakPolarHBondContact O-CG 3.09Å; K437-E441 PolarHBondContact O-N 3.44Å; K437-E647 WeakPolarHBondContact CE-O 3.29Å; K437-E647 PolarHBondContact NZ-O 3.09Å
438	E	89.5	Confident	92.8	Very high	128 Å²	128	54.9 Å²	54.9	60%	0.598	29%	0.294	S	S	*	.	H	α-helix	trans	-60.1	-33	178.8	-163	-157.5	142	0	0	112.6	G436 K442	G436-E438 PolarHBondContact O-N 2.88Å; E438-K442 WeakPolarHBondContact O-CG 3.48Å; E438-K442 PolarHBondContact O-N 2.72Å; E438-K442 VanDerWaalsContact OE1-CE 3.31Å; E438-K442 WeakPolarHBondContact OE1-CE 3.42Å; E438-K442 IonicContact OE1-NZ 2.71Å; E438-K442 PolarHBondContact OE1-NZ 3.15Å
439	A	91.4	Very high	92.9	Very high	13 Å²	13	54.8 Å²	54.8	11%	0.107	29%	0.293	C	S	.	.	H	α-helix	trans	-73.2	-42	174.3	0	0	0	0	0	111.6	L392 A435 G436 K437 E441 K442 V443	L392-A439 HydrophobicContact CD2-CB 4.03Å; A435-A439 HydrophobicContact CB-CB 3.52Å; A435-A439 WeakPolarHBondContact O-CB 3.36Å; G436-A439 PolarHBondContact O-N 3.46Å; K437-A439 PolarHBondContact O-N 2.95Å; A439-E441 VanDerWaalsContact C-N 3.35Å; A439-E441 PolarHBondContact O-N 3.11Å; A439-K442 PolarHBondContact O-N 3.04Å; A439-V443 WeakPolarHBondContact O-CG2 3.45Å
440	A	92.7	Very high	93	Very high	21 Å²	21	54.7 Å²	54.7	17%	0.174	29%	0.293	C	S	.	.	H	α-helix	trans	-60.5	-42	174.9	0	0	0	0	0	112.2	Y429 G436 K437 K442 V443 S444	Y429-A440 WeakPolarHBondContact O-CB 3.45Å; G436-A440 PolarHBondContact O-N 2.95Å; G436-A440 VanDerWaalsContact O-N 3.16Å; K437-A440 WeakPolarHBondContact O-CB 3.12Å; K437-A440 PolarHBondContact O-N 2.84Å; A440-K442 PolarHBondContact O-N 2.73Å; A440-V443 CarbonylContact O-C 3.46Å; A440-V443 PolarHBondContact O-N 2.86Å; A440-S444 WeakPolarHBondContact O-CA 3.31Å; A440-S444 PolarHBondContact O-N 2.86Å
441	E	91.6	Very high	93.3	Very high	128 Å²	128	53.1 Å²	53.1	60%	0.598	28%	0.282	S	S	*	.	H	α-helix	trans	-59.3	-44.4	177.1	-75.8	170.2	-163.8	0	0	112.2	K437 A439 V443 S444	K437-E441 WeakPolarHBondContact O-CG 3.09Å; K437-E441 PolarHBondContact O-N 3.44Å; A439-E441 VanDerWaalsContact C-N 3.35Å; A439-E441 PolarHBondContact O-N 3.11Å; E441-V443 PolarHBondContact O-N 3.49Å; E441-S444 VanDerWaalsContact O-CB 3.24Å; E441-S444 WeakPolarHBondContact O-CB 3.01Å; E441-S444 PolarHBondContact O-N 2.93Å; E441-S444 VanDerWaalsContact O-N 3.11Å; E441-S444 PolarHBondContact O-OG 2.87Å
442	K	92.7	Very high	93.6	Very high	102 Å²	102	52.7 Å²	52.7	44%	0.443	28%	0.279	S	S	.	.	H	α-helix	trans	-61.9	-28.5	179.2	-71.5	168.1	-171.5	170.8	0	113.8	E438 A439 A440 W445	E438-K442 WeakPolarHBondContact O-CG 3.48Å; E438-K442 PolarHBondContact O-N 2.72Å; E438-K442 VanDerWaalsContact OE1-CE 3.31Å; E438-K442 WeakPolarHBondContact OE1-CE 3.42Å; E438-K442 IonicContact OE1-NZ 2.71Å; E438-K442 PolarHBondContact OE1-NZ 3.15Å; A439-K442 PolarHBondContact O-N 3.04Å; A440-K442 PolarHBondContact O-N 2.73Å; K442-W445 VanDerWaalsContact O-CD1 3.28Å; K442-W445 PolarHBondContact O-NE1 3.09Å
443	V	95.6	Very high	93.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-107	7.3	175.2	-71.5	0	0	0	0	114.2	L392 L400 A439 A440 E441 W445 I446	L392-V443 HydrophobicContact CD1-CG1 3.94Å; L392-V443 HydrophobicContact CD2-CG1 4.1Å; L392-V443 HydrophobicContact CD2-CG2 4.29Å; L400-V443 HydrophobicContact CD1-CG1 3.99Å; A439-V443 WeakPolarHBondContact O-CG2 3.45Å; A440-V443 CarbonylContact O-C 3.46Å; A440-V443 PolarHBondContact O-N 2.86Å; E441-V443 PolarHBondContact O-N 3.49Å; V443-W445 VanDerWaalsContact C-N 3.25Å; V443-W445 PolarHBondContact O-N 3.1Å; V443-I446 HydrophobicContact CB-CD1 3.8Å; V443-I446 HydrophobicContact CB-CG1 4.37Å; V443-I446 HydrophobicContact CG1-CD1 4.08Å; V443-I446 VanDerWaalsContact O-CB 3.31Å; V443-I446 WeakPolarHBondContact O-CB 3.23Å; V443-I446 VanDerWaalsContact O-CG1 3.29Å; V443-I446 WeakPolarHBondContact O-CG1 3.31Å; V443-I446 PolarHBondContact O-N 3.24Å
444	S	93.8	Very high	94.3	Very high	49 Å²	49	46.2 Å²	46.2	34%	0.343	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-38.2	-178	60.9	0	0	0	0	113.2	A440 E441 I446 K447	A440-S444 WeakPolarHBondContact O-CA 3.31Å; A440-S444 PolarHBondContact O-N 2.86Å; E441-S444 VanDerWaalsContact O-CB 3.24Å; E441-S444 WeakPolarHBondContact O-CB 3.01Å; E441-S444 PolarHBondContact O-N 2.93Å; E441-S444 VanDerWaalsContact O-N 3.11Å; E441-S444 PolarHBondContact O-OG 2.87Å; S444-I446 PolarHBondContact O-N 3.12Å; S444-K447 WeakPolarHBondContact O-CE 3.37Å; S444-K447 WeakPolarHBondContact O-CG 3.34Å; S444-K447 PolarHBondContact O-N 3.28Å
445	W	96.6	Very high	94.5	Very high	62 Å²	62	45.7 Å²	45.7	24%	0.235	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.3	178.3	62.1	-95.6	0	0	0	114.8	L400 R404 L422 K442 V443 K447 D448 K449	L400-W445 HydrophobicContact CB-CZ2 4.25Å; R404-W445 HydrophobicContact CB-CH2 3.73Å; R404-W445 HydrophobicContact CB-CZ3 3.84Å; R404-W445 HydrophobicContact CG-CE3 4.22Å; R404-W445 HydrophobicContact CG-CH2 3.95Å; R404-W445 HydrophobicContact CG-CZ3 3.53Å; L422-W445 HydrophobicContact CD1-CH2 4.26Å; L422-W445 HydrophobicContact CD1-CZ3 4.26Å; L422-W445 HydrophobicContact CD2-CH2 3.83Å; K442-W445 VanDerWaalsContact O-CD1 3.28Å; K442-W445 PolarHBondContact O-NE1 3.09Å; V443-W445 VanDerWaalsContact C-N 3.25Å; V443-W445 PolarHBondContact O-N 3.1Å; W445-K447 VanDerWaalsContact C-N 3.34Å; W445-K447 PolarHBondContact O-N 3.33Å; W445-D448 PolarHBondContact O-N 3.25Å; W445-K449 HydrophobicContact CE3-CB 3.95Å; W445-K449 HydrophobicContact CE3-CG 4.39Å; W445-K449 HydrophobicContact CZ3-CB 4.21Å; W445-K449 HydrophobicContact CZ3-CG 4.21Å; W445-K449 WeakPolarHBondContact O-CB 3.36Å; W445-K449 PolarHBondContact O-N 3.47Å; W445-K449 VanDerWaalsContact O-N 3.1Å
446	I	98.3	Very high	94.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-40.1	-178.7	-70.8	179.5	0	0	0	111.4	L422 L425 Y426 V443 S444 D448 K449 L450	L422-I446 HydrophobicContact CB-CD1 4.2Å; L422-I446 HydrophobicContact CB-CG1 4.45Å; L422-I446 HydrophobicContact CB-CG2 3.89Å; L422-I446 HydrophobicContact CD2-CD1 3.83Å; L422-I446 HydrophobicContact CD2-CG1 4.21Å; L425-I446 HydrophobicContact CB-CD1 4.23Å; Y426-I446 HydrophobicContact CD2-CB 4.26Å; Y426-I446 HydrophobicContact CD2-CG2 4.38Å; Y426-I446 HydrophobicContact CG-CG2 4.45Å; V443-I446 HydrophobicContact CB-CD1 3.8Å; V443-I446 HydrophobicContact CB-CG1 4.37Å; V443-I446 HydrophobicContact CG1-CD1 4.08Å; V443-I446 VanDerWaalsContact O-CB 3.31Å; V443-I446 WeakPolarHBondContact O-CB 3.23Å; V443-I446 VanDerWaalsContact O-CG1 3.29Å; V443-I446 WeakPolarHBondContact O-CG1 3.31Å; V443-I446 PolarHBondContact O-N 3.24Å; S444-I446 PolarHBondContact O-N 3.12Å; I446-D448 VanDerWaalsContact C-N 3.35Å; I446-D448 PolarHBondContact O-N 3.46Å; I446-K449 PolarHBondContact O-N 2.99Å; I446-L450 HydrophobicContact CG2-CD1 3.43Å; I446-L450 VanDerWaalsContact CG2-CD1 3.43Å; I446-L450 HydrophobicContact CG2-CG 4.01Å; I446-L450 WeakPolarHBondContact O-CB 3Å; I446-L450 VanDerWaalsContact O-CG 3.26Å; I446-L450 WeakPolarHBondContact O-CG 3.3Å; I446-L450 PolarHBondContact O-N 3.21Å
447	K	97.1	Very high	94.4	Very high	20 Å²	20	52 Å²	52	9%	0.087	25%	0.249	C	C	.	.	H	α-helix	trans	-57.8	-47.2	-179.4	65.9	-165.7	157.9	54.1	0	111.7	Y426 S444 W445 L451 L490 S493 L494	Y426-K447 HydrophobicContact CD2-CB 4.3Å; Y426-K447 HydrophobicContact CE2-CB 3.72Å; Y426-K447 HydrophobicContact CE2-CD 4.18Å; Y426-K447 HydrophobicContact CE2-CG 4.32Å; S444-K447 WeakPolarHBondContact O-CE 3.37Å; S444-K447 WeakPolarHBondContact O-CG 3.34Å; S444-K447 PolarHBondContact O-N 3.28Å; W445-K447 VanDerWaalsContact C-N 3.34Å; W445-K447 PolarHBondContact O-N 3.33Å; K447-L451 WeakPolarHBondContact O-CG 3.31Å; K447-L451 PolarHBondContact O-N 3.48Å; K447-L490 HydrophobicContact CB-CD1 4Å; K447-L490 HydrophobicContact CD-CD1 3.92Å; K447-L490 HydrophobicContact CG-CD1 4.4Å; K447-S493 PolarHBondContact NZ-O 3.44Å; K447-L494 HydrophobicContact CB-CD2 4.09Å; K447-L494 HydrophobicContact CD-CD2 4.03Å; K447-L494 HydrophobicContact CG-CD2 3.75Å
448	D	98.1	Very high	94.6	Very high	17 Å²	17	47 Å²	47	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-69.7	-47.8	-177	-48.1	-73.9	0	0	0	109.8	W445 I446 L450 L451 H452 L494 D495 A498	W445-D448 PolarHBondContact O-N 3.25Å; I446-D448 VanDerWaalsContact C-N 3.35Å; I446-D448 PolarHBondContact O-N 3.46Å; D448-L450 VanDerWaalsContact C-N 3.31Å; D448-L450 PolarHBondContact O-N 2.96Å; D448-L451 PolarHBondContact O-N 3.18Å; D448-L451 VanDerWaalsContact O-N 3.16Å; D448-H452 PolarHBondContact O-CD2 2.89Å; D448-H452 PolarHBondContact O-N 2.79Å; D448-L494 WeakPolarHBondContact OD1-CA 3.26Å; D448-D495 PolarHBondContact OD1-N 2.88Å; D448-A498 HydrophobicContact CB-CB 4.06Å
449	K	97.9	Very high	94.7	Very high	40 Å²	40	42.5 Å²	42.5	17%	0.174	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-37.8	-179.3	178	60.1	-173	169.3	0	112.8	R404 T407 W445 I446	R404-K449 HydrophobicContact CG-CD 4.29Å; R404-K449 HydrophobicContact CG-CG 4.08Å; T407-K449 WeakPolarHBondContact OG1-CE 3.4Å; T407-K449 PolarHBondContact OG1-NZ 3.45Å; W445-K449 HydrophobicContact CE3-CB 3.95Å; W445-K449 HydrophobicContact CE3-CG 4.39Å; W445-K449 HydrophobicContact CZ3-CB 4.21Å; W445-K449 HydrophobicContact CZ3-CG 4.21Å; W445-K449 WeakPolarHBondContact O-CB 3.36Å; W445-K449 PolarHBondContact O-N 3.47Å; W445-K449 VanDerWaalsContact O-N 3.1Å; I446-K449 PolarHBondContact O-N 2.99Å
450	L	98.5	Very high	94.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-67	-46	175.5	-73.4	169.2	0	0	0	111.1	M419 A423 I446 D448 H452 I453 V465 I468 L473	M419-L450 HydrophobicContact CB-CD2 4.02Å; M419-L450 HydrophobicContact CG-CD2 4.12Å; A423-L450 HydrophobicContact CB-CD1 4.1Å; I446-L450 HydrophobicContact CG2-CD1 3.43Å; I446-L450 VanDerWaalsContact CG2-CD1 3.43Å; I446-L450 HydrophobicContact CG2-CG 4.01Å; I446-L450 WeakPolarHBondContact O-CB 3Å; I446-L450 VanDerWaalsContact O-CG 3.26Å; I446-L450 WeakPolarHBondContact O-CG 3.3Å; I446-L450 PolarHBondContact O-N 3.21Å; D448-L450 VanDerWaalsContact C-N 3.31Å; D448-L450 PolarHBondContact O-N 2.96Å; L450-H452 VanDerWaalsContact C-N 3.34Å; L450-H452 PolarHBondContact O-N 3.31Å; L450-I453 WeakPolarHBondContact O-CB 3.38Å; L450-I453 PolarHBondContact O-N 3.26Å; L450-I453 VanDerWaalsContact O-N 3.14Å; L450-V465 WeakPolarHBondContact O-CG2 3.47Å; L450-I468 HydrophobicContact CD1-CG2 3.98Å; L450-I468 HydrophobicContact CD2-CD1 4.33Å; L450-L473 HydrophobicContact CD1-CD2 4.26Å
451	L	98.4	Very high	94.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-33.6	178	-71.3	170.7	0	0	0	112.6	K447 D448 I453 Y454 V465 F469 L473 L494 A498 A501 L502	K447-L451 WeakPolarHBondContact O-CG 3.31Å; K447-L451 PolarHBondContact O-N 3.48Å; D448-L451 PolarHBondContact O-N 3.18Å; D448-L451 VanDerWaalsContact O-N 3.16Å; L451-I453 PolarHBondContact O-N 2.79Å; L451-I453 VanDerWaalsContact O-N 3.13Å; L451-Y454 VanDerWaalsContact O-CB 3.29Å; L451-Y454 WeakPolarHBondContact O-CB 3.25Å; L451-Y454 PolarHBondContact O-N 3.44Å; L451-V465 HydrophobicContact CD2-CG1 4.09Å; L451-F469 HydrophobicContact CD2-CD2 4.34Å; L451-L473 HydrophobicContact CG-CD1 4.31Å; L451-L494 HydrophobicContact CD1-CD1 3.43Å; L451-L494 VanDerWaalsContact CD1-CD1 3.43Å; L451-L494 HydrophobicContact CD1-CD2 3.65Å; L451-L494 HydrophobicContact CD1-CG 4.19Å; L451-A498 HydrophobicContact CB-CB 3.99Å; L451-A498 HydrophobicContact CD1-CB 4.14Å; L451-A501 HydrophobicContact CB-CB 4.4Å; L451-A501 VanDerWaalsContact O-CB 3.25Å; L451-A501 WeakPolarHBondContact O-CB 3.32Å; L451-L502 HydrophobicContact CD2-CB 4.46Å
452	H	97.6	Very high	95.1	Very high	52 Å²	52	39.8 Å²	39.8	24%	0.241	19%	0.193	C	C	.	.	H	α-helix	trans	-58.3	-24.1	172.7	-65.9	173.4	0	0	0	113.4	D448 L450 Y454 Y455 D495	D448-H452 PolarHBondContact O-CD2 2.89Å; D448-H452 PolarHBondContact O-N 2.79Å; L450-H452 VanDerWaalsContact C-N 3.34Å; L450-H452 PolarHBondContact O-N 3.31Å; H452-Y454 PolarHBondContact O-N 2.79Å; H452-Y455 WeakPolarHBondContact O-CB 3.36Å; H452-Y455 WeakPolarHBondContact O-CD2 3.45Å; H452-Y455 PolarHBondContact O-N 3.03Å; H452-D495 IonicContact CE1-OD1 3.96Å; H452-D495 IonicContact CE1-OD2 2.68Å; H452-D495 PolarHBondContact CE1-OD2 3.22Å; H452-D495 VanDerWaalsContact NE2-CG 3.29Å; H452-D495 IonicContact NE2-OD1 2.66Å; H452-D495 PolarHBondContact NE2-OD1 3.49Å; H452-D495 IonicContact NE2-OD2 2.82Å; H452-D495 PolarHBondContact NE2-OD2 2.78Å
453	I	97.5	Very high	95.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-66.4	-20.3	175.6	-56.5	-56.2	0	0	0	111.7	L408 M419 L450 L451 Y455 Q456 D461 V465	L408-I453 HydrophobicContact CD2-CD1 3.72Å; L408-I453 HydrophobicContact CG-CD1 4.49Å; M419-I453 HydrophobicContact CE-CG2 3.95Å; M419-I453 HydrophobicContact SD-CB 4.25Å; M419-I453 HydrophobicContact SD-CG1 4.16Å; M419-I453 HydrophobicContact SD-CG2 3.75Å; L450-I453 WeakPolarHBondContact O-CB 3.38Å; L450-I453 PolarHBondContact O-N 3.26Å; L450-I453 VanDerWaalsContact O-N 3.14Å; L451-I453 PolarHBondContact O-N 2.79Å; L451-I453 VanDerWaalsContact O-N 3.13Å; I453-Y455 PolarHBondContact O-N 2.95Å; I453-Q456 HydrophobicContact CG2-CG 4.07Å; I453-Q456 WeakPolarHBondContact O-CB 3.31Å; I453-Q456 WeakPolarHBondContact O-CG 3.46Å; I453-Q456 PolarHBondContact O-N 3.15Å; I453-D461 HydrophobicContact CG2-CB 3.87Å; I453-V465 HydrophobicContact CB-CG2 3.8Å; I453-V465 HydrophobicContact CG2-CG2 4.06Å
454	Y	96.8	Very high	95.2	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.02	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-62.8	-15.3	173.6	-149.7	-101.3	0	0	0	113.6	L451 H452 Q456 K462 V465 E466 E504 M505 R617	L451-Y454 VanDerWaalsContact O-CB 3.29Å; L451-Y454 WeakPolarHBondContact O-CB 3.25Å; L451-Y454 PolarHBondContact O-N 3.44Å; H452-Y454 PolarHBondContact O-N 2.79Å; Y454-Q456 VanDerWaalsContact C-N 3.32Å; Y454-K462 HydrophobicContact CD2-CB 3.89Å; Y454-K462 HydrophobicContact CD2-CG 3.91Å; Y454-K462 HydrophobicContact CE2-CB 3.59Å; Y454-K462 HydrophobicContact CE2-CG 3.92Å; Y454-K462 HydrophobicContact CG-CG 4.26Å; Y454-K462 PolarHBondContact O-NZ 3.42Å; Y454-V465 HydrophobicContact CD2-CB 4.14Å; Y454-V465 HydrophobicContact CD2-CG1 4.05Å; Y454-E466 HydrophobicContact CE2-CG 4.02Å; Y454-E466 VanDerWaalsContact CE2-OE1 3.26Å; Y454-E466 WeakPolarHBondContact CE2-OE1 3.21Å; Y454-E466 PolarHBondContact OH-OE1 2.87Å; Y454-E504 HydrophobicContact CE1-CG 4.47Å; Y454-M505 HydrophobicContact CE1-CB 4.09Å; Y454-M505 HydrophobicContact CE2-CB 4.23Å; Y454-M505 HydrophobicContact CE2-CG 3.88Å; Y454-R617 PolarHBondContact OH-NH2 3.11Å
455	Y	93.4	Very high	95.4	Very high	102 Å²	102	34 Å²	34	40%	0.4	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-78.1	-10	171.4	-67.1	-62.6	0	0	0	114.5	H452 I453 N497 K500 A501	H452-Y455 WeakPolarHBondContact O-CB 3.36Å; H452-Y455 WeakPolarHBondContact O-CD2 3.45Å; H452-Y455 PolarHBondContact O-N 3.03Å; I453-Y455 PolarHBondContact O-N 2.95Å; Y455-N497 HydrophobicContact CE2-CB 4.12Å; Y455-N497 PolarHBondContact OH-O 3.23Å; Y455-K500 VanDerWaalsContact OH-CB 3.27Å; Y455-K500 WeakPolarHBondContact OH-CB 3.49Å; Y455-A501 HydrophobicContact CE2-CB 4.02Å
456	Q	91.4	Very high	95.4	Very high	73 Å²	73	31.7 Å²	31.7	34%	0.341	15%	0.154	S	C	.	.	S	Bend	trans	-68.8	154.1	175.8	-61.6	-52.7	-38.3	0	0	111.8	L408 I453 Y454 D461 K462	L408-Q456 HydrophobicContact CD2-CG 4.46Å; I453-Q456 HydrophobicContact CG2-CG 4.07Å; I453-Q456 WeakPolarHBondContact O-CB 3.31Å; I453-Q456 WeakPolarHBondContact O-CG 3.46Å; I453-Q456 PolarHBondContact O-N 3.15Å; Y454-Q456 VanDerWaalsContact C-N 3.32Å; Q456-D461 HydrophobicContact CB-CB 4.31Å; Q456-K462 WeakPolarHBondContact O-CE 3.44Å
457	N	86.4	Confident	95.3	Very high	146 Å²	146	34.9 Å²	34.9	78%	0.781	17%	0.168	S	C	*	.	S	Bend	trans	-82.9	-12.3	179.8	-66.7	-53.9	0	0	0	113.6
458	S	91.5	Very high	95.3	Very high	27 Å²	27	34 Å²	34	19%	0.189	16%	0.164	C	C	.	.			trans	-70.8	132.5	174.5	163.2	0	0	0	0	109.9	D460 D461 K462	S458-D460 PolarHBondContact OG-N 3.47Å; S458-D460 PolarHBondContact OG-OD2 3.47Å; S458-D461 WeakPolarHBondContact CB-OD2 3.28Å; S458-D461 PolarHBondContact OG-N 3.25Å; S458-D461 VanDerWaalsContact OG-N 3.15Å; S458-K462 PolarHBondContact O-N 3.35Å
459	I	91.2	Very high	95.3	Very high	33 Å²	33	33.2 Å²	33.2	17%	0.169	16%	0.16	C	C	.	.	H	α-helix	trans	-69.4	-38.7	173	-173	57.2	0	0	0	110.3	D461 K462 L463	I459-D461 VanDerWaalsContact C-N 3.35Å; I459-D461 PolarHBondContact O-N 3.4Å; I459-K462 WeakPolarHBondContact O-CB 3.19Å; I459-K462 PolarHBondContact O-N 2.92Å; I459-K462 VanDerWaalsContact O-N 3.16Å; I459-L463 HydrophobicContact CD1-CD1 4.27Å; I459-L463 HydrophobicContact CD1-CD2 4.38Å; I459-L463 HydrophobicContact CD1-CG 4.11Å; I459-L463 HydrophobicContact CG1-CD1 3.82Å; I459-L463 HydrophobicContact CG1-CG 4.13Å; I459-L463 VanDerWaalsContact O-CG 3.22Å; I459-L463 WeakPolarHBondContact O-CG 3.28Å; I459-L463 PolarHBondContact O-N 2.93Å
460	D	93.2	Very high	95.2	Very high	53 Å²	53	32 Å²	32	28%	0.283	16%	0.158	S	C	.	.	H	α-helix	trans	-59	-44.7	179.1	-35.8	-95.9	0	0	0	111.6	W412 S458 L463 L464	W412-D460 HydrophobicContact CD2-CB 4.09Å; W412-D460 HydrophobicContact CE3-CB 4.1Å; W412-D460 HydrophobicContact CH2-CB 3.68Å; W412-D460 VanDerWaalsContact CH2-O 3.28Å; W412-D460 WeakPolarHBondContact CH2-O 2.99Å; W412-D460 HydrophobicContact CZ2-CB 3.68Å; W412-D460 HydrophobicContact CZ3-CB 3.91Å; S458-D460 PolarHBondContact OG-N 3.47Å; S458-D460 PolarHBondContact OG-OD2 3.47Å; D460-L463 PolarHBondContact O-N 3.3Å; D460-L464 WeakPolarHBondContact O-CB 3.29Å; D460-L464 PolarHBondContact O-N 3.1Å
461	D	95.7	Very high	95.1	Very high	5 Å²	5	35 Å²	35	3%	0.027	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-48.3	174.4	-70.9	-11.7	0	0	0	111.3	W412 R415 I453 Q456 S458 I459 L464 V465	W412-D461 VanDerWaalsContact CZ3-OD1 3.25Å; W412-D461 WeakPolarHBondContact CZ3-OD1 3.21Å; R415-D461 IonicContact CZ-OD1 2.66Å; R415-D461 VanDerWaalsContact CZ-OD1 3.24Å; R415-D461 IonicContact CZ-OD2 2.76Å; R415-D461 VanDerWaalsContact NE-CG 3.34Å; R415-D461 IonicContact NE-OD1 3.93Å; R415-D461 PolarHBondContact NE-OD1 3.32Å; R415-D461 IonicContact NE-OD2 2.71Å; R415-D461 PolarHBondContact NE-OD2 2.93Å; R415-D461 VanDerWaalsContact NE-OD2 3.1Å; R415-D461 IonicContact NH2-OD1 3.86Å; R415-D461 PolarHBondContact NH2-OD1 3.48Å; R415-D461 IonicContact NH2-OD2 2.8Å; R415-D461 PolarHBondContact NH2-OD2 3.14Å; I453-D461 HydrophobicContact CG2-CB 3.87Å; Q456-D461 HydrophobicContact CB-CB 4.31Å; S458-D461 WeakPolarHBondContact CB-OD2 3.28Å; S458-D461 PolarHBondContact OG-N 3.25Å; S458-D461 VanDerWaalsContact OG-N 3.15Å; I459-D461 VanDerWaalsContact C-N 3.35Å; I459-D461 PolarHBondContact O-N 3.4Å; D461-L464 PolarHBondContact O-N 3.27Å; D461-V465 WeakPolarHBondContact O-CG2 3.25Å; D461-V465 PolarHBondContact O-N 3.39Å
462	K	95.2	Very high	95.1	Very high	47 Å²	47	36.8 Å²	36.8	20%	0.204	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-44.1	178.5	-72.4	174.3	-179	-75.2	0	112.8	Y454 Q456 S458 I459 L464 V465 E466	Y454-K462 HydrophobicContact CD2-CB 3.89Å; Y454-K462 HydrophobicContact CD2-CG 3.91Å; Y454-K462 HydrophobicContact CE2-CB 3.59Å; Y454-K462 HydrophobicContact CE2-CG 3.92Å; Y454-K462 HydrophobicContact CG-CG 4.26Å; Y454-K462 PolarHBondContact O-NZ 3.42Å; Q456-K462 WeakPolarHBondContact O-CE 3.44Å; S458-K462 PolarHBondContact O-N 3.35Å; I459-K462 WeakPolarHBondContact O-CB 3.19Å; I459-K462 PolarHBondContact O-N 2.92Å; I459-K462 VanDerWaalsContact O-N 3.16Å; K462-L464 VanDerWaalsContact C-N 3.31Å; K462-L464 PolarHBondContact O-N 3.28Å; K462-V465 PolarHBondContact O-N 3.02Å; K462-E466 PolarHBondContact O-N 2.61Å
463	L	94.6	Very high	95.1	Very high	16 Å²	16	34.4 Å²	34.4	8%	0.084	17%	0.168	C	C	.	.	H	α-helix	trans	-68.2	-32.9	-179.7	-64.8	176.7	0	0	0	111.9	I459 D460 K467 P547 R617	I459-L463 HydrophobicContact CD1-CD1 4.27Å; I459-L463 HydrophobicContact CD1-CD2 4.38Å; I459-L463 HydrophobicContact CD1-CG 4.11Å; I459-L463 HydrophobicContact CG1-CD1 3.82Å; I459-L463 HydrophobicContact CG1-CG 4.13Å; I459-L463 VanDerWaalsContact O-CG 3.22Å; I459-L463 WeakPolarHBondContact O-CG 3.28Å; I459-L463 PolarHBondContact O-N 2.93Å; D460-L463 PolarHBondContact O-N 3.3Å; L463-K467 WeakPolarHBondContact O-CB 3.41Å; L463-K467 PolarHBondContact O-N 3.24Å; L463-P547 HydrophobicContact CD1-CG 3.57Å; L463-R617 HydrophobicContact CD2-CG 3.91Å
464	L	96.5	Very high	95.1	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.068	17%	0.168	C	C	.	.	H	α-helix	trans	-69.8	-37.2	171.8	-177.1	63.5	0	0	0	112.1	W412 K416 M419 M420 D460 D461 K462 K467 I468	W412-L464 HydrophobicContact CH2-CB 3.87Å; W412-L464 HydrophobicContact CH2-CD2 3.73Å; W412-L464 HydrophobicContact CH2-CG 4.38Å; W412-L464 HydrophobicContact CZ3-CB 4.5Å; W412-L464 HydrophobicContact CZ3-CD2 3.99Å; K416-L464 HydrophobicContact CB-CD2 4.01Å; K416-L464 HydrophobicContact CG-CD2 3.88Å; M419-L464 HydrophobicContact CB-CD2 4.01Å; M419-L464 HydrophobicContact CE-CD2 4.03Å; M419-L464 HydrophobicContact SD-CD2 3.95Å; M419-L464 HydrophobicContact SD-CG 4.49Å; M420-L464 HydrophobicContact CG-CD1 4.17Å; M420-L464 HydrophobicContact SD-CD1 3.72Å; D460-L464 WeakPolarHBondContact O-CB 3.29Å; D460-L464 PolarHBondContact O-N 3.1Å; D461-L464 PolarHBondContact O-N 3.27Å; K462-L464 VanDerWaalsContact C-N 3.31Å; K462-L464 PolarHBondContact O-N 3.28Å; L464-K467 PolarHBondContact O-N 3.37Å; L464-I468 HydrophobicContact CD1-CD1 4.15Å; L464-I468 HydrophobicContact CD1-CG1 4.28Å; L464-I468 HydrophobicContact CD2-CD1 4.43Å; L464-I468 HydrophobicContact CG-CD1 3.82Å; L464-I468 HydrophobicContact CG-CG1 4.36Å; L464-I468 VanDerWaalsContact O-CB 3.24Å; L464-I468 WeakPolarHBondContact O-CB 3.49Å; L464-I468 VanDerWaalsContact O-CG1 3.26Å; L464-I468 WeakPolarHBondContact O-CG1 3.32Å; L464-I468 PolarHBondContact O-N 2.69Å
465	V	98	Very high	95.1	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-63.4	-44.6	171.7	172.7	0	0	0	0	111.4	M419 L450 L451 I453 Y454 D461 K462 K467 I468 F469	M419-V465 HydrophobicContact SD-CG2 4.48Å; L450-V465 WeakPolarHBondContact O-CG2 3.47Å; L451-V465 HydrophobicContact CD2-CG1 4.09Å; I453-V465 HydrophobicContact CB-CG2 3.8Å; I453-V465 HydrophobicContact CG2-CG2 4.06Å; Y454-V465 HydrophobicContact CD2-CB 4.14Å; Y454-V465 HydrophobicContact CD2-CG1 4.05Å; D461-V465 WeakPolarHBondContact O-CG2 3.25Å; D461-V465 PolarHBondContact O-N 3.39Å; K462-V465 PolarHBondContact O-N 3.02Å; V465-K467 VanDerWaalsContact C-N 3.32Å; V465-K467 PolarHBondContact O-N 3.3Å; V465-I468 PolarHBondContact O-N 3Å; V465-F469 WeakPolarHBondContact O-CB 3.38Å; V465-F469 PolarHBondContact O-N 2.67Å
466	E	96.6	Very high	95	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-55.9	-45.6	172.9	-83.6	169.4	-129	0	0	111.5	Y454 K462 A470 M505 Q509 R617	Y454-E466 HydrophobicContact CE2-CG 4.02Å; Y454-E466 VanDerWaalsContact CE2-OE1 3.26Å; Y454-E466 WeakPolarHBondContact CE2-OE1 3.21Å; Y454-E466 PolarHBondContact OH-OE1 2.87Å; K462-E466 PolarHBondContact O-N 2.61Å; E466-A470 WeakPolarHBondContact O-CB 3.47Å; E466-A470 PolarHBondContact O-N 3.01Å; E466-A470 VanDerWaalsContact O-N 3.15Å; E466-M505 HydrophobicContact CB-SD 4.36Å; E466-M505 HydrophobicContact CG-CG 3.41Å; E466-M505 VanDerWaalsContact CG-CG 3.41Å; E466-M505 HydrophobicContact CG-SD 3.52Å; E466-M505 VanDerWaalsContact CG-SD 3.52Å; E466-Q509 PolarHBondContact OE2-NE2 3.49Å; E466-R617 IonicContact OE1-CZ 3.48Å; E466-R617 IonicContact OE1-NE 3.1Å; E466-R617 IonicContact OE1-NH2 3.22Å; E466-R617 PolarHBondContact OE1-NH2 3.45Å; E466-R617 IonicContact OE2-CZ 2.74Å; E466-R617 IonicContact OE2-NE 2.78Å; E466-R617 PolarHBondContact OE2-NE 3.08Å; E466-R617 IonicContact OE2-NH2 3.24Å; E466-R617 PolarHBondContact OE2-NH2 3.19Å
467	K	95.7	Very high	95.1	Very high	66 Å²	66	35.3 Å²	35.3	29%	0.287	18%	0.179	S	C	.	.	H	α-helix	trans	-68	-39.5	177.6	-158.4	-177.2	-161.5	83.7	0	113.1	L463 L464 V465 A470 Q471 E616	L463-K467 WeakPolarHBondContact O-CB 3.41Å; L463-K467 PolarHBondContact O-N 3.24Å; L464-K467 PolarHBondContact O-N 3.37Å; V465-K467 VanDerWaalsContact C-N 3.32Å; V465-K467 PolarHBondContact O-N 3.3Å; K467-A470 PolarHBondContact O-N 2.96Å; K467-Q471 WeakPolarHBondContact O-CB 3.28Å; K467-Q471 WeakPolarHBondContact O-CG 3.39Å; K467-Q471 PolarHBondContact O-N 3.18Å; K467-Q471 VanDerWaalsContact O-N 3.15Å; K467-E616 IonicContact NZ-OE1 3.03Å; K467-E616 PolarHBondContact NZ-OE1 2.8Å; K467-E616 IonicContact NZ-OE2 2.73Å; K467-E616 PolarHBondContact NZ-OE2 2.86Å
468	I	97.9	Very high	95.5	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-45.2	178.4	-82	172.2	0	0	0	110.4	M419 M420 A423 L450 L464 V465 A470 Q471 Y472 L473	M419-I468 HydrophobicContact CB-CD1 3.71Å; M420-I468 HydrophobicContact SD-CD1 4.12Å; M420-I468 HydrophobicContact SD-CG1 3.91Å; A423-I468 HydrophobicContact CB-CB 4.46Å; A423-I468 HydrophobicContact CB-CD1 4.15Å; A423-I468 HydrophobicContact CB-CG1 4.05Å; A423-I468 HydrophobicContact CB-CG2 3.7Å; L450-I468 HydrophobicContact CD1-CG2 3.98Å; L450-I468 HydrophobicContact CD2-CD1 4.33Å; L464-I468 HydrophobicContact CD1-CD1 4.15Å; L464-I468 HydrophobicContact CD1-CG1 4.28Å; L464-I468 HydrophobicContact CD2-CD1 4.43Å; L464-I468 HydrophobicContact CG-CD1 3.82Å; L464-I468 HydrophobicContact CG-CG1 4.36Å; L464-I468 VanDerWaalsContact O-CB 3.24Å; L464-I468 WeakPolarHBondContact O-CB 3.49Å; L464-I468 VanDerWaalsContact O-CG1 3.26Å; L464-I468 WeakPolarHBondContact O-CG1 3.32Å; L464-I468 PolarHBondContact O-N 2.69Å; V465-I468 PolarHBondContact O-N 3Å; I468-A470 VanDerWaalsContact C-N 3.32Å; I468-A470 PolarHBondContact O-N 3.28Å; I468-Q471 PolarHBondContact O-N 2.81Å; I468-Y472 HydrophobicContact CG1-CD2 4.5Å; I468-Y472 WeakPolarHBondContact O-CB 3.28Å; I468-Y472 PolarHBondContact O-N 3.27Å; I468-L473 HydrophobicContact CG2-CD1 4.49Å; I468-L473 HydrophobicContact CG2-CG 4.32Å; I468-L473 PolarHBondContact O-N 2.9Å
469	F	97.9	Very high	95.6	Very high	1 Å²	1	34 Å²	34	0%	0.004	17%	0.167	C	C	.	.	I	π-helix	trans	-54.9	-50.4	174.2	179.8	-91.6	0	0	0	110.5	L451 V465 Q471 L473 V474 L487 L490 L502 M505 W506 H622	L451-F469 HydrophobicContact CD2-CD2 4.34Å; V465-F469 WeakPolarHBondContact O-CB 3.38Å; V465-F469 PolarHBondContact O-N 2.67Å; F469-Q471 VanDerWaalsContact C-N 3.3Å; F469-Q471 PolarHBondContact O-N 3.42Å; F469-L473 HydrophobicContact CD2-CB 4.2Å; F469-L473 HydrophobicContact CD2-CD1 4.17Å; F469-L473 PolarHBondContact O-N 3.32Å; F469-V474 HydrophobicContact CE1-CB 4.29Å; F469-V474 HydrophobicContact CE1-CG2 4.35Å; F469-V474 HydrophobicContact CE2-CG2 3.89Å; F469-V474 HydrophobicContact CZ-CB 4.16Å; F469-V474 HydrophobicContact CZ-CG2 3.73Å; F469-V474 CarbonylContact O-C 3.58Å; F469-V474 PolarHBondContact O-N 3.47Å; F469-L487 HydrophobicContact CZ-CD1 3.83Å; F469-L490 HydrophobicContact CD2-CD2 4.5Å; F469-L490 HydrophobicContact CE2-CD2 3.89Å; F469-L502 HydrophobicContact CD2-CD1 3.93Å; F469-L502 HydrophobicContact CE1-CD1 4.38Å; F469-L502 HydrophobicContact CE2-CD1 3.53Å; F469-L502 HydrophobicContact CE2-CD2 3.89Å; F469-L502 HydrophobicContact CE2-CG 4.39Å; F469-L502 HydrophobicContact CG-CD1 4.49Å; F469-L502 HydrophobicContact CZ-CD1 3.78Å; F469-L502 HydrophobicContact CZ-CD2 4.36Å; F469-M505 HydrophobicContact CD1-CE 3.83Å; F469-M505 HydrophobicContact CE1-CE 4.19Å; F469-M505 HydrophobicContact CG-CE 4.13Å; F469-W506 HydrophobicContact CD1-CH2 4.28Å; F469-W506 HydrophobicContact CD1-CZ2 4.38Å; F469-W506 AromaticContact CE1-CH2 3.66Å; F469-W506 HydrophobicContact CE1-CH2 3.66Å; F469-W506 AromaticContact CE1-CZ2 3.49Å; F469-W506 HydrophobicContact CE1-CZ2 3.49Å; F469-W506 VanDerWaalsContact CE1-CZ2 3.49Å; F469-W506 HydrophobicContact CZ-CH2 4.45Å; F469-W506 AromaticContact CZ-CZ2 3.84Å; F469-W506 HydrophobicContact CZ-CZ2 3.84Å; F469-H622 AromaticContact CD1-CE1 3.68Å; F469-H622 AromaticContact CE1-CE1 3.61Å; F469-H622 AromaticContact CE1-ND1 3.93Å; F469-H622 AromaticContact CE1-NE2 3.75Å
470	A	96.1	Very high	95.8	Very high	16 Å²	16	32.7 Å²	32.7	13%	0.132	16%	0.16	C	C	.	.	I	π-helix	trans	-69.4	-14.8	-178.2	0	0	0	0	0	116.3	E466 K467 I468 V474 H476 V621	E466-A470 WeakPolarHBondContact O-CB 3.47Å; E466-A470 PolarHBondContact O-N 3.01Å; E466-A470 VanDerWaalsContact O-N 3.15Å; K467-A470 PolarHBondContact O-N 2.96Å; I468-A470 VanDerWaalsContact C-N 3.32Å; I468-A470 PolarHBondContact O-N 3.28Å; A470-V474 CarbonylContact C-O 3.56Å; A470-H476 PolarHBondContact O-N 3.47Å; A470-H476 PolarHBondContact O-ND1 3.04Å; A470-V621 HydrophobicContact CB-CG1 4.2Å
471	Q	96.1	Very high	95.9	Very high	62 Å²	62	36.3 Å²	36.3	29%	0.29	18%	0.176	S	C	.	.	I	π-helix	trans	-119.1	-25.6	-174.1	-67	-173.6	-10.1	0	0	114.3	K427 K467 I468 F469	K427-Q471 PolarHBondContact NZ-O 3.3Å; K467-Q471 WeakPolarHBondContact O-CB 3.28Å; K467-Q471 WeakPolarHBondContact O-CG 3.39Å; K467-Q471 PolarHBondContact O-N 3.18Å; K467-Q471 VanDerWaalsContact O-N 3.15Å; I468-Q471 PolarHBondContact O-N 2.81Å; F469-Q471 VanDerWaalsContact C-N 3.3Å; F469-Q471 PolarHBondContact O-N 3.42Å
472	Y	97.4	Very high	95.9	Very high	40 Å²	40	41.5 Å²	41.5	16%	0.157	20%	0.2	C	C	.	.	I	π-helix	trans	-130.4	-29.6	-169.5	-58.8	-89.8	0	0	0	114.9	M420 A423 Q424 K427 I468	M420-Y472 HydrophobicContact CE-CE2 3.77Å; M420-Y472 WeakPolarHBondContact CE-OH 3.31Å; M420-Y472 HydrophobicContact SD-CE2 4.5Å; A423-Y472 HydrophobicContact CB-CD1 4.3Å; A423-Y472 HydrophobicContact CB-CD2 4.1Å; A423-Y472 HydrophobicContact CB-CG 3.82Å; Q424-Y472 HydrophobicContact CG-CD1 4.18Å; Q424-Y472 HydrophobicContact CG-CE1 3.56Å; K427-Y472 HydrophobicContact CB-CD1 4.07Å; K427-Y472 HydrophobicContact CD-CD1 3.98Å; I468-Y472 HydrophobicContact CG1-CD2 4.5Å; I468-Y472 WeakPolarHBondContact O-CB 3.28Å; I468-Y472 PolarHBondContact O-N 3.27Å
473	L	97.4	Very high	96	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	19%	0.192	C	C	.	.	I	π-helix	trans	-91.8	-50	176.6	-53.2	-177.3	0	0	0	111.3	Y426 L450 L451 I468 F469 C486 L490	Y426-L473 HydrophobicContact CD1-CD2 3.46Å; Y426-L473 VanDerWaalsContact CD1-CD2 3.46Å; Y426-L473 HydrophobicContact CE1-CD2 3.73Å; Y426-L473 HydrophobicContact CG-CD2 3.93Å; L450-L473 HydrophobicContact CD1-CD2 4.26Å; L451-L473 HydrophobicContact CG-CD1 4.31Å; I468-L473 HydrophobicContact CG2-CD1 4.49Å; I468-L473 HydrophobicContact CG2-CG 4.32Å; I468-L473 PolarHBondContact O-N 2.9Å; F469-L473 HydrophobicContact CD2-CB 4.2Å; F469-L473 HydrophobicContact CD2-CD1 4.17Å; F469-L473 PolarHBondContact O-N 3.32Å; L473-C486 PolarHBondContact O-SG 3.02Å; L473-C486 VanDerWaalsContact O-SG 3.32Å; L473-L490 HydrophobicContact CB-CD2 3.97Å
474	V	97.5	Very high	96.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-131	91.3	171.9	-172.3	0	0	0	0	108	F469 A470 H476 R483 C486 L487 L490 H622	F469-V474 HydrophobicContact CE1-CB 4.29Å; F469-V474 HydrophobicContact CE1-CG2 4.35Å; F469-V474 HydrophobicContact CE2-CG2 3.89Å; F469-V474 HydrophobicContact CZ-CB 4.16Å; F469-V474 HydrophobicContact CZ-CG2 3.73Å; F469-V474 CarbonylContact O-C 3.58Å; F469-V474 PolarHBondContact O-N 3.47Å; A470-V474 CarbonylContact C-O 3.56Å; V474-H476 PolarHBondContact O-N 2.87Å; V474-R483 HydrophobicContact CG1-CG 3.97Å; V474-R483 WeakPolarHBondContact CG1-O 3.45Å; V474-C486 HydrophobicContact CG1-CB 4.46Å; V474-L487 HydrophobicContact CG1-CB 4.19Å; V474-L487 HydrophobicContact CG2-CB 4.37Å; V474-L487 HydrophobicContact CG2-CD1 4.11Å; V474-L490 HydrophobicContact CG2-CD2 3.43Å; V474-L490 VanDerWaalsContact CG2-CD2 3.43Å; V474-H622 PolarHBondContact O-NE2 3.48Å
475	P	96.8	Very high	96	Very high	3 Å²	3	41 Å²	41	2%	0.019	20%	0.196	C	C	.	.			trans	-65.1	119.9	-175	-21.1	32.7	0	0	0	112.3	L431 N477 L478	L431-P475 HydrophobicContact CD2-CG 3.58Å; P475-N477 WeakPolarHBondContact CB-OD1 3.34Å; P475-N477 PolarHBondContact O-N 2.94Å; P475-L478 HydrophobicContact CB-CD1 4.32Å; P475-L478 HydrophobicContact CB-CG 4.24Å; P475-L478 HydrophobicContact CG-CD1 4.31Å; P475-L478 PolarHBondContact O-N 3.42Å
476	H	92.8	Very high	96	Very high	87 Å²	87	42 Å²	42	40%	0.403	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.6	-179.1	66.5	-81.9	0	0	0	114.9	A470 V474 V621	A470-H476 PolarHBondContact O-N 3.47Å; A470-H476 PolarHBondContact O-ND1 3.04Å; V474-H476 PolarHBondContact O-N 2.87Å; H476-V621 HydrophobicContact CB-CG1 3.35Å
477	N	92.4	Very high	96	Very high	110 Å²	110	41.3 Å²	41.3	59%	0.588	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	3.8	-177.5	72.4	-88.8	0	0	0	114.2	P475	P475-N477 WeakPolarHBondContact CB-OD1 3.34Å; P475-N477 PolarHBondContact O-N 2.94Å
478	L	94.4	Very high	96	Very high	50 Å²	50	38.2 Å²	38.2	26%	0.262	19%	0.186	S	C	.	.	S	Bend	trans	-78.4	157.5	171.7	-68.5	173.4	0	0	0	111.3	P475 E482 R483 C486	P475-L478 HydrophobicContact CB-CD1 4.32Å; P475-L478 HydrophobicContact CB-CG 4.24Å; P475-L478 HydrophobicContact CG-CD1 4.31Å; P475-L478 PolarHBondContact O-N 3.42Å; L478-E482 HydrophobicContact CB-CB 4.18Å; L478-R483 HydrophobicContact CB-CB 3.92Å; L478-R483 PolarHBondContact O-NH1 3.46Å; L478-C486 HydrophobicContact CD1-CB 4.47Å
479	E	94.8	Very high	96	Very high	94 Å²	94	38.8 Å²	38.8	44%	0.439	19%	0.188	S	C	.	.			trans	-56.8	151.3	169.1	-147.4	-56.5	104.6	0	0	109.9	E481 E482 R483	E479-E481 VanDerWaalsContact C-N 3.33Å; E479-E481 PolarHBondContact O-N 2.63Å; E479-E481 PolarHBondContact OE2-N 3.05Å; E479-E482 HydrophobicContact CB-CB 4.44Å; E479-E482 HydrophobicContact CB-CG 4.2Å; E479-E482 PolarHBondContact N-OE2 3.42Å; E479-E482 PolarHBondContact O-N 3.22Å; E479-R483 WeakPolarHBondContact O-CB 3.33Å; E479-R483 PolarHBondContact O-N 3.35Å
480	T	95.5	Very high	95.9	Very high	6 Å²	6	39 Å²	39	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-53.9	-41.9	179.1	-64.9	0	0	0	0	113.9	R483 M484 E626 A627 A630	T480-R483 VanDerWaalsContact CA-NH1 3.28Å; T480-R483 PolarHBondContact OG1-NH1 3Å; T480-R483 PolarHBondContact OG1-NH2 3.45Å; T480-M484 WeakPolarHBondContact O-CB 3.35Å; T480-M484 VanDerWaalsContact O-CG 3.24Å; T480-M484 WeakPolarHBondContact O-CG 3.49Å; T480-M484 PolarHBondContact O-N 3.19Å; T480-E626 HydrophobicContact CG2-CB 3.91Å; T480-E626 PolarHBondContact OG1-OE2 3.1Å; T480-A627 HydrophobicContact CG2-CB 4.26Å; T480-A630 HydrophobicContact CG2-CB 4.21Å
481	E	95.1	Very high	95.9	Very high	130 Å²	130	38.5 Å²	38.5	61%	0.607	18%	0.184	S	C	*	.	H	α-helix	trans	-67.2	-48	177.6	-64.6	-163.7	168.1	0	0	111.9	E479 R483 M484 K485 A630	E479-E481 VanDerWaalsContact C-N 3.33Å; E479-E481 PolarHBondContact O-N 2.63Å; E479-E481 PolarHBondContact OE2-N 3.05Å; E481-R483 PolarHBondContact O-N 2.96Å; E481-M484 PolarHBondContact O-N 3.45Å; E481-K485 PolarHBondContact O-N 3.28Å; E481-A630 HydrophobicContact CG-CB 4.48Å
482	E	95	Very high	95.9	Very high	114 Å²	114	36.1 Å²	36.1	53%	0.533	18%	0.175	S	C	.	.	H	α-helix	trans	-60.6	-44.8	176.5	-63.2	179.2	147.9	0	0	112.4	L478 E479 M484 K485 C486	L478-E482 HydrophobicContact CB-CB 4.18Å; E479-E482 HydrophobicContact CB-CB 4.44Å; E479-E482 HydrophobicContact CB-CG 4.2Å; E479-E482 PolarHBondContact N-OE2 3.42Å; E479-E482 PolarHBondContact O-N 3.22Å; E482-M484 VanDerWaalsContact C-N 3.27Å; E482-M484 PolarHBondContact O-N 3.47Å; E482-K485 PolarHBondContact O-N 3.07Å; E482-C486 VanDerWaalsContact O-CB 3.27Å; E482-C486 WeakPolarHBondContact O-CB 3.18Å; E482-C486 PolarHBondContact O-N 3.35Å
483	R	96.9	Very high	95.8	Very high	11 Å²	11	36.7 Å²	36.7	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-36.3	179.7	-167.3	173.6	65.7	-103.5	-1.9	110.9	V474 L478 E479 T480 E481 L487	V474-R483 HydrophobicContact CG1-CG 3.97Å; V474-R483 WeakPolarHBondContact CG1-O 3.45Å; L478-R483 HydrophobicContact CB-CB 3.92Å; L478-R483 PolarHBondContact O-NH1 3.46Å; E479-R483 WeakPolarHBondContact O-CB 3.33Å; E479-R483 PolarHBondContact O-N 3.35Å; T480-R483 VanDerWaalsContact CA-NH1 3.28Å; T480-R483 PolarHBondContact OG1-NH1 3Å; T480-R483 PolarHBondContact OG1-NH2 3.45Å; E481-R483 PolarHBondContact O-N 2.96Å; R483-L487 WeakPolarHBondContact O-CB 3.5Å; R483-L487 PolarHBondContact O-N 3.14Å; R483-L487 VanDerWaalsContact O-N 3.09Å
484	M	96.9	Very high	95.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-80.6	-34.9	176.8	-68.5	-55.7	103.8	0	0	112.9	T480 E481 E482 C486 L487 Y488 H622 I623 A627 A630 L631 L634	T480-M484 WeakPolarHBondContact O-CB 3.35Å; T480-M484 VanDerWaalsContact O-CG 3.24Å; T480-M484 WeakPolarHBondContact O-CG 3.49Å; T480-M484 PolarHBondContact O-N 3.19Å; E481-M484 PolarHBondContact O-N 3.45Å; E482-M484 VanDerWaalsContact C-N 3.27Å; E482-M484 PolarHBondContact O-N 3.47Å; M484-C486 VanDerWaalsContact C-N 3.34Å; M484-C486 PolarHBondContact O-N 3.09Å; M484-L487 HydrophobicContact CE-CB 4.44Å; M484-L487 HydrophobicContact CE-CD2 3.96Å; M484-L487 PolarHBondContact O-N 3.18Å; M484-L487 HydrophobicContact SD-CD2 3.84Å; M484-Y488 VanDerWaalsContact O-CB 3.26Å; M484-Y488 WeakPolarHBondContact O-CB 3.36Å; M484-Y488 PolarHBondContact O-N 3.35Å; M484-H622 HydrophobicContact CE-CB 4.36Å; M484-H622 VanDerWaalsContact CE-O 3.25Å; M484-H622 WeakPolarHBondContact CE-O 3.44Å; M484-I623 HydrophobicContact CE-CD1 4.41Å; M484-I623 HydrophobicContact SD-CD1 4.35Å; M484-A627 HydrophobicContact CE-CB 4.14Å; M484-A627 HydrophobicContact CG-CB 4.02Å; M484-A627 WeakPolarHBondContact CG-O 3.29Å; M484-A627 HydrophobicContact SD-CB 3.74Å; M484-A630 HydrophobicContact CB-CB 4.04Å; M484-A630 HydrophobicContact CG-CB 4.03Å; M484-L631 HydrophobicContact CB-CD2 3.9Å; M484-L631 HydrophobicContact CB-CG 3.99Å; M484-L631 HydrophobicContact CG-CD2 4.32Å; M484-L631 HydrophobicContact CG-CG 3.96Å; M484-L631 HydrophobicContact SD-CD1 3.7Å; M484-L631 HydrophobicContact SD-CD2 3.93Å; M484-L631 HydrophobicContact SD-CG 3.56Å; M484-L631 VanDerWaalsContact SD-CG 3.56Å; M484-L634 HydrophobicContact CB-CD1 4.06Å
485	K	96.1	Very high	95.7	Very high	53 Å²	53	39.5 Å²	39.5	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-48.9	169.4	-168.9	-172.2	173	-170.8	0	110.5	E481 E482 L487 Y488 Y489 L634 D644 E648	E481-K485 PolarHBondContact O-N 3.28Å; E482-K485 PolarHBondContact O-N 3.07Å; K485-L487 PolarHBondContact O-N 3Å; K485-Y488 PolarHBondContact O-N 2.71Å; K485-Y489 HydrophobicContact CD-CE2 4.26Å; K485-Y489 HydrophobicContact CG-CD2 3.85Å; K485-Y489 HydrophobicContact CG-CE2 3.6Å; K485-Y489 VanDerWaalsContact O-CD2 3.29Å; K485-Y489 WeakPolarHBondContact O-CD2 3.38Å; K485-Y489 PolarHBondContact O-N 2.76Å; K485-L634 HydrophobicContact CB-CD1 4.19Å; K485-L634 HydrophobicContact CB-CD2 4.3Å; K485-L634 HydrophobicContact CG-CD2 4.24Å; K485-D644 WeakPolarHBondContact CE-OD2 3.3Å; K485-D644 IonicContact NZ-OD2 2.62Å; K485-D644 PolarHBondContact NZ-OD2 2.74Å; K485-E648 WeakPolarHBondContact CE-OE1 3.39Å; K485-E648 IonicContact NZ-OE1 3.95Å; K485-E648 PolarHBondContact NZ-OE1 3.22Å
486	C	96	Very high	95.7	Very high	22 Å²	22	43.5 Å²	43.5	15%	0.149	23%	0.226	C	C	.	.	H	α-helix	trans	-57.9	-44.7	175.1	178	0	0	0	0	112.6	L431 L473 V474 L478 E482 M484 L490	L431-C486 VanDerWaalsContact CD1-SG 3.59Å; L473-C486 PolarHBondContact O-SG 3.02Å; L473-C486 VanDerWaalsContact O-SG 3.32Å; V474-C486 HydrophobicContact CG1-CB 4.46Å; L478-C486 HydrophobicContact CD1-CB 4.47Å; E482-C486 VanDerWaalsContact O-CB 3.27Å; E482-C486 WeakPolarHBondContact O-CB 3.18Å; E482-C486 PolarHBondContact O-N 3.35Å; M484-C486 VanDerWaalsContact C-N 3.34Å; M484-C486 PolarHBondContact O-N 3.09Å; C486-L490 WeakPolarHBondContact O-CB 3.41Å; C486-L490 PolarHBondContact O-N 2.91Å; C486-L490 VanDerWaalsContact O-N 3.12Å
487	L	97.3	Very high	95.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-40.6	176.9	178.9	60.5	0	0	0	112.9	F469 V474 R483 M484 K485 Y491 I623 L631 L662	F469-L487 HydrophobicContact CZ-CD1 3.83Å; V474-L487 HydrophobicContact CG1-CB 4.19Å; V474-L487 HydrophobicContact CG2-CB 4.37Å; V474-L487 HydrophobicContact CG2-CD1 4.11Å; R483-L487 WeakPolarHBondContact O-CB 3.5Å; R483-L487 PolarHBondContact O-N 3.14Å; R483-L487 VanDerWaalsContact O-N 3.09Å; M484-L487 HydrophobicContact CE-CB 4.44Å; M484-L487 HydrophobicContact CE-CD2 3.96Å; M484-L487 PolarHBondContact O-N 3.18Å; M484-L487 HydrophobicContact SD-CD2 3.84Å; K485-L487 PolarHBondContact O-N 3Å; L487-Y491 WeakPolarHBondContact O-CB 3.38Å; L487-Y491 PolarHBondContact O-N 3.49Å; L487-I623 HydrophobicContact CD2-CD1 3.83Å; L487-L631 HydrophobicContact CD2-CD1 4.34Å; L487-L631 HydrophobicContact CD2-CD2 4.5Å; L487-L662 HydrophobicContact CD2-CD2 4.08Å; L487-L662 HydrophobicContact CG-CD2 3.89Å
488	Y	96.9	Very high	96	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-56.8	-176.2	-175.7	-101.6	0	0	0	111.5	M484 K485 Y491 A492 L631 M635 S638 A655 I656	M484-Y488 VanDerWaalsContact O-CB 3.26Å; M484-Y488 WeakPolarHBondContact O-CB 3.36Å; M484-Y488 PolarHBondContact O-N 3.35Å; K485-Y488 PolarHBondContact O-N 2.71Å; Y488-Y491 PolarHBondContact O-N 3.12Å; Y488-A492 PolarHBondContact O-N 2.92Å; Y488-L631 HydrophobicContact CD2-CD2 4.46Å; Y488-M635 HydrophobicContact CE2-CB 4.25Å; Y488-S638 PolarHBondContact OH-OG 3.45Å; Y488-A655 HydrophobicContact CE1-CB 3.82Å; Y488-A655 PolarHBondContact OH-O 3.03Å; Y488-I656 PolarHBondContact OH-N 2.89Å
489	Y	95.9	Very high	96.1	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-72.9	-27.7	179.6	-61.9	-64.5	0	0	0	113.5	K485 S493 D645 E648 V650	K485-Y489 HydrophobicContact CD-CE2 4.26Å; K485-Y489 HydrophobicContact CG-CD2 3.85Å; K485-Y489 HydrophobicContact CG-CE2 3.6Å; K485-Y489 VanDerWaalsContact O-CD2 3.29Å; K485-Y489 WeakPolarHBondContact O-CD2 3.38Å; K485-Y489 PolarHBondContact O-N 2.76Å; Y489-S493 WeakPolarHBondContact O-CB 3.39Å; Y489-S493 PolarHBondContact O-N 3.3Å; Y489-S493 VanDerWaalsContact O-N 3.16Å; Y489-S493 PolarHBondContact O-OG 3.46Å; Y489-D645 HydrophobicContact CE1-CB 4.41Å; Y489-D645 WeakPolarHBondContact CE1-OD1 3.49Å; Y489-D645 PolarHBondContact OH-N 2.9Å; Y489-D645 PolarHBondContact OH-OD1 3.18Å; Y489-E648 HydrophobicContact CD1-CB 3.82Å; Y489-E648 HydrophobicContact CD1-CG 4.34Å; Y489-E648 HydrophobicContact CD2-CB 3.98Å; Y489-E648 HydrophobicContact CD2-CG 3.67Å; Y489-E648 HydrophobicContact CE1-CB 4.06Å; Y489-E648 HydrophobicContact CE1-CG 4.33Å; Y489-E648 HydrophobicContact CE2-CB 4.2Å; Y489-E648 HydrophobicContact CE2-CG 3.64Å; Y489-E648 HydrophobicContact CG-CB 3.77Å; Y489-E648 HydrophobicContact CG-CG 4.02Å; Y489-V650 HydrophobicContact CD1-CB 4.44Å; Y489-V650 HydrophobicContact CD1-CG2 4.24Å
490	L	96.4	Very high	96.2	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-55.2	166.3	176.7	63.8	0	0	0	109.9	K447 F469 L473 V474 C486 A492 S493 L494	K447-L490 HydrophobicContact CB-CD1 4Å; K447-L490 HydrophobicContact CD-CD1 3.92Å; K447-L490 HydrophobicContact CG-CD1 4.4Å; F469-L490 HydrophobicContact CD2-CD2 4.5Å; F469-L490 HydrophobicContact CE2-CD2 3.89Å; L473-L490 HydrophobicContact CB-CD2 3.97Å; V474-L490 HydrophobicContact CG2-CD2 3.43Å; V474-L490 VanDerWaalsContact CG2-CD2 3.43Å; C486-L490 WeakPolarHBondContact O-CB 3.41Å; C486-L490 PolarHBondContact O-N 2.91Å; C486-L490 VanDerWaalsContact O-N 3.12Å; L490-A492 VanDerWaalsContact C-N 3.29Å; L490-A492 PolarHBondContact O-N 2.91Å; L490-S493 PolarHBondContact O-N 3.38Å; L490-S493 VanDerWaalsContact O-N 3.08Å; L490-S493 PolarHBondContact O-OG 3.43Å; L490-L494 HydrophobicContact CD1-CD2 3.91Å; L490-L494 HydrophobicContact CD1-CG 4.4Å; L490-L494 HydrophobicContact CG-CD2 4.43Å; L490-L494 HydrophobicContact CG-CG 4.44Å; L490-L494 WeakPolarHBondContact O-CG 3.39Å; L490-L494 PolarHBondContact O-N 3.1Å; L490-L494 VanDerWaalsContact O-N 3.16Å
491	Y	97.3	Very high	96.2	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-39.4	-176.5	-159.8	-88	0	0	0	112.2	L487 Y488 S493 L494 V499 L502 N503 S658 E661 L662	L487-Y491 WeakPolarHBondContact O-CB 3.38Å; L487-Y491 PolarHBondContact O-N 3.49Å; Y488-Y491 PolarHBondContact O-N 3.12Å; Y491-S493 VanDerWaalsContact C-N 3.28Å; Y491-S493 PolarHBondContact O-N 2.92Å; Y491-L494 PolarHBondContact O-N 3.32Å; Y491-V499 HydrophobicContact CE1-CG1 4.08Å; Y491-V499 HydrophobicContact CE2-CG1 4.35Å; Y491-V499 WeakPolarHBondContact OH-CG1 3.49Å; Y491-L502 HydrophobicContact CD2-CD2 3.78Å; Y491-L502 HydrophobicContact CE2-CD2 4.08Å; Y491-N503 WeakPolarHBondContact CE2-OD1 3.32Å; Y491-N503 VanDerWaalsContact OH-CG 3.3Å; Y491-N503 PolarHBondContact OH-ND2 3.34Å; Y491-N503 PolarHBondContact OH-OD1 2.87Å; Y491-S658 VanDerWaalsContact CD1-O 3.32Å; Y491-S658 WeakPolarHBondContact CD1-O 3.19Å; Y491-S658 WeakPolarHBondContact CE1-O 3.17Å; Y491-E661 HydrophobicContact CE1-CB 4.29Å; Y491-E661 HydrophobicContact CE1-CG 4.38Å; Y491-L662 HydrophobicContact CD1-CB 3.84Å; Y491-L662 HydrophobicContact CD2-CB 4.2Å; Y491-L662 HydrophobicContact CD2-CD1 3.81Å; Y491-L662 HydrophobicContact CD2-CG 4.4Å; Y491-L662 HydrophobicContact CE1-CB 3.84Å; Y491-L662 HydrophobicContact CE2-CB 4.2Å; Y491-L662 HydrophobicContact CE2-CD1 3.82Å; Y491-L662 HydrophobicContact CG-CB 4Å; Y491-L662 HydrophobicContact CG-CD1 4.37Å; Y491-L662 HydrophobicContact CG-CD2 4.41Å; Y491-L662 HydrophobicContact CG-CG 4.49Å
492	A	96	Very high	96.2	Very high	12 Å²	12	29.2 Å²	29.2	10%	0.099	16%	0.157	C	C	.	.	H	α-helix	trans	-70.7	-17.9	177.9	0	0	0	0	0	114.9	Y488 L490 V650 S658	Y488-A492 PolarHBondContact O-N 2.92Å; L490-A492 VanDerWaalsContact C-N 3.29Å; L490-A492 PolarHBondContact O-N 2.91Å; A492-V650 HydrophobicContact CB-CG1 3.94Å; A492-V650 HydrophobicContact CB-CG2 4.5Å; A492-S658 VanDerWaalsContact CA-CB 3.45Å
493	S	94.7	Very high	96.3	Very high	51 Å²	51	25.1 Å²	25.1	36%	0.357	14%	0.139	S	C	.	.	H	α-helix	trans	-102.7	-3	176	62.6	0	0	0	0	114	K447 Y489 L490 Y491	K447-S493 PolarHBondContact NZ-O 3.44Å; Y489-S493 WeakPolarHBondContact O-CB 3.39Å; Y489-S493 PolarHBondContact O-N 3.3Å; Y489-S493 VanDerWaalsContact O-N 3.16Å; Y489-S493 PolarHBondContact O-OG 3.46Å; L490-S493 PolarHBondContact O-N 3.38Å; L490-S493 VanDerWaalsContact O-N 3.08Å; L490-S493 PolarHBondContact O-OG 3.43Å; Y491-S493 VanDerWaalsContact C-N 3.28Å; Y491-S493 PolarHBondContact O-N 2.92Å
494	L	97	Very high	96.1	Very high	16 Å²	16	27.4 Å²	27.4	8%	0.084	15%	0.15	C	C	.	.	S	Bend	trans	-74.8	146.1	179.7	-75.2	-172	0	0	0	113.4	K447 D448 L451 L490 Y491 A498 V499 L502	K447-L494 HydrophobicContact CB-CD2 4.09Å; K447-L494 HydrophobicContact CD-CD2 4.03Å; K447-L494 HydrophobicContact CG-CD2 3.75Å; D448-L494 WeakPolarHBondContact OD1-CA 3.26Å; L451-L494 HydrophobicContact CD1-CD1 3.43Å; L451-L494 VanDerWaalsContact CD1-CD1 3.43Å; L451-L494 HydrophobicContact CD1-CD2 3.65Å; L451-L494 HydrophobicContact CD1-CG 4.19Å; L490-L494 HydrophobicContact CD1-CD2 3.91Å; L490-L494 HydrophobicContact CD1-CG 4.4Å; L490-L494 HydrophobicContact CG-CD2 4.43Å; L490-L494 HydrophobicContact CG-CG 4.44Å; L490-L494 WeakPolarHBondContact O-CG 3.39Å; L490-L494 PolarHBondContact O-N 3.1Å; L490-L494 VanDerWaalsContact O-N 3.16Å; Y491-L494 PolarHBondContact O-N 3.32Å; L494-A498 HydrophobicContact CB-CB 4.13Å; L494-A498 HydrophobicContact CD1-CB 4.28Å; L494-A498 HydrophobicContact CD2-CB 4.03Å; L494-A498 HydrophobicContact CG-CB 4.36Å; L494-V499 HydrophobicContact CB-CG2 3.57Å; L494-V499 HydrophobicContact CD1-CG2 4.36Å; L494-L502 HydrophobicContact CD1-CD2 3.88Å
495	D	96.1	Very high	96	Very high	46 Å²	46	27.5 Å²	27.5	25%	0.246	15%	0.15	C	C	.	.			trans	-69.5	157.8	171.7	92.4	24.5	0	0	0	113	D448 H452 N497 A498 V499	D448-D495 PolarHBondContact OD1-N 2.88Å; H452-D495 IonicContact CE1-OD1 3.96Å; H452-D495 IonicContact CE1-OD2 2.68Å; H452-D495 PolarHBondContact CE1-OD2 3.22Å; H452-D495 VanDerWaalsContact NE2-CG 3.29Å; H452-D495 IonicContact NE2-OD1 2.66Å; H452-D495 PolarHBondContact NE2-OD1 3.49Å; H452-D495 IonicContact NE2-OD2 2.82Å; H452-D495 PolarHBondContact NE2-OD2 2.78Å; D495-N497 PolarHBondContact O-N 2.8Å; D495-N497 WeakPolarHBondContact OD1-CA 3.34Å; D495-N497 WeakPolarHBondContact OD1-CB 3.38Å; D495-N497 PolarHBondContact OD1-N 2.85Å; D495-A498 PolarHBondContact O-N 2.66Å; D495-A498 PolarHBondContact OD1-N 3.31Å; D495-V499 WeakPolarHBondContact O-CG2 3.2Å; D495-V499 PolarHBondContact O-N 3.3Å
496	P	95.7	Very high	95.9	Very high	87 Å²	87	25.3 Å²	25.3	57%	0.565	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-8	-175	-25.7	35.9	0	0	0	116.4	K500	P496-K500 WeakPolarHBondContact O-CD 3.44Å; P496-K500 WeakPolarHBondContact O-CG 3.43Å; P496-K500 PolarHBondContact O-NZ 3.1Å
497	N	95	Very high	95.7	Very high	74 Å²	74	28.3 Å²	28.3	40%	0.396	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-36.9	171.3	-55	-63.9	0	0	0	111.2	Y455 D495 K500 A501	Y455-N497 HydrophobicContact CE2-CB 4.12Å; Y455-N497 PolarHBondContact OH-O 3.23Å; D495-N497 PolarHBondContact O-N 2.8Å; D495-N497 WeakPolarHBondContact OD1-CA 3.34Å; D495-N497 WeakPolarHBondContact OD1-CB 3.38Å; D495-N497 PolarHBondContact OD1-N 2.85Å; N497-K500 PolarHBondContact O-N 3.22Å; N497-A501 WeakPolarHBondContact O-CB 3.48Å; N497-A501 PolarHBondContact O-N 3.09Å
498	A	97.3	Very high	95.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-43.3	172.4	0	0	0	0	0	111.4	D448 L451 L494 D495 K500 A501 L502	D448-A498 HydrophobicContact CB-CB 4.06Å; L451-A498 HydrophobicContact CB-CB 3.99Å; L451-A498 HydrophobicContact CD1-CB 4.14Å; L494-A498 HydrophobicContact CB-CB 4.13Å; L494-A498 HydrophobicContact CD1-CB 4.28Å; L494-A498 HydrophobicContact CD2-CB 4.03Å; L494-A498 HydrophobicContact CG-CB 4.36Å; D495-A498 PolarHBondContact O-N 2.66Å; D495-A498 PolarHBondContact OD1-N 3.31Å; A498-K500 PolarHBondContact O-N 3.04Å; A498-A501 PolarHBondContact O-N 3.44Å; A498-L502 WeakPolarHBondContact O-CB 3.22Å; A498-L502 PolarHBondContact O-N 3.2Å
499	V	97.1	Very high	95.2	Very high	22 Å²	22	30 Å²	30	13%	0.133	16%	0.161	C	C	.	.	H	α-helix	trans	-54.7	-49.4	169	170.5	0	0	0	0	111.1	Y491 L494 D495 A501 L502 N503	Y491-V499 HydrophobicContact CE1-CG1 4.08Å; Y491-V499 HydrophobicContact CE2-CG1 4.35Å; Y491-V499 WeakPolarHBondContact OH-CG1 3.49Å; L494-V499 HydrophobicContact CB-CG2 3.57Å; L494-V499 HydrophobicContact CD1-CG2 4.36Å; D495-V499 WeakPolarHBondContact O-CG2 3.2Å; D495-V499 PolarHBondContact O-N 3.3Å; V499-A501 VanDerWaalsContact C-N 3.34Å; V499-A501 PolarHBondContact O-N 2.93Å; V499-L502 PolarHBondContact O-N 3.19Å; V499-N503 WeakPolarHBondContact O-CB 3.42Å; V499-N503 PolarHBondContact O-N 2.95Å; V499-N503 PolarHBondContact O-ND2 2.95Å; V499-N503 PolarHBondContact O-OD1 3.39Å
500	K	95	Very high	95	Very high	79 Å²	79	31.6 Å²	31.6	34%	0.343	17%	0.17	S	C	.	.	H	α-helix	trans	-67.2	-32.6	-178.5	-73.9	175.9	-177.3	69.5	0	112.7	Y455 P496 N497 A498 E504 E1198	Y455-K500 VanDerWaalsContact OH-CB 3.27Å; Y455-K500 WeakPolarHBondContact OH-CB 3.49Å; P496-K500 WeakPolarHBondContact O-CD 3.44Å; P496-K500 WeakPolarHBondContact O-CG 3.43Å; P496-K500 PolarHBondContact O-NZ 3.1Å; N497-K500 PolarHBondContact O-N 3.22Å; A498-K500 PolarHBondContact O-N 3.04Å; K500-E504 PolarHBondContact O-N 3.47Å; K500-E504 VanDerWaalsContact O-N 3.09Å; K500-E1198 IonicContact NZ-OE1 3.51Å
501	A	96	Very high	94.8	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-46.6	172.6	0	0	0	0	0	111.8	L451 Y455 N497 A498 V499 N503 E504 M505	L451-A501 HydrophobicContact CB-CB 4.4Å; L451-A501 VanDerWaalsContact O-CB 3.25Å; L451-A501 WeakPolarHBondContact O-CB 3.32Å; Y455-A501 HydrophobicContact CE2-CB 4.02Å; N497-A501 WeakPolarHBondContact O-CB 3.48Å; N497-A501 PolarHBondContact O-N 3.09Å; A498-A501 PolarHBondContact O-N 3.44Å; V499-A501 VanDerWaalsContact C-N 3.34Å; V499-A501 PolarHBondContact O-N 2.93Å; A501-N503 VanDerWaalsContact C-N 3.35Å; A501-N503 PolarHBondContact O-N 3.23Å; A501-E504 PolarHBondContact O-N 3.15Å; A501-M505 PolarHBondContact O-N 2.75Å
502	L	96.6	Very high	94.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-39.3	176.5	-177.6	55.7	0	0	0	112.1	L451 F469 Y491 L494 A498 V499 M505 W506	L451-L502 HydrophobicContact CD2-CB 4.46Å; F469-L502 HydrophobicContact CD2-CD1 3.93Å; F469-L502 HydrophobicContact CE1-CD1 4.38Å; F469-L502 HydrophobicContact CE2-CD1 3.53Å; F469-L502 HydrophobicContact CE2-CD2 3.89Å; F469-L502 HydrophobicContact CE2-CG 4.39Å; F469-L502 HydrophobicContact CG-CD1 4.49Å; F469-L502 HydrophobicContact CZ-CD1 3.78Å; F469-L502 HydrophobicContact CZ-CD2 4.36Å; Y491-L502 HydrophobicContact CD2-CD2 3.78Å; Y491-L502 HydrophobicContact CE2-CD2 4.08Å; L494-L502 HydrophobicContact CD1-CD2 3.88Å; A498-L502 WeakPolarHBondContact O-CB 3.22Å; A498-L502 PolarHBondContact O-N 3.2Å; V499-L502 PolarHBondContact O-N 3.19Å; L502-M505 HydrophobicContact CD1-CE 3.57Å; L502-M505 HydrophobicContact CD1-SD 4.27Å; L502-M505 WeakPolarHBondContact O-CB 3.4Å; L502-M505 PolarHBondContact O-N 3.45Å; L502-W506 HydrophobicContact CD1-CZ2 4.22Å; L502-W506 PolarHBondContact O-N 3.14Å
503	N	95.2	Very high	94.5	Very high	29 Å²	29	35.3 Å²	35.3	16%	0.155	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-38.2	175.4	-64.7	-12	0	0	0	112.3	Y491 V499 A501 K507 V665	Y491-N503 WeakPolarHBondContact CE2-OD1 3.32Å; Y491-N503 VanDerWaalsContact OH-CG 3.3Å; Y491-N503 PolarHBondContact OH-ND2 3.34Å; Y491-N503 PolarHBondContact OH-OD1 2.87Å; V499-N503 WeakPolarHBondContact O-CB 3.42Å; V499-N503 PolarHBondContact O-N 2.95Å; V499-N503 PolarHBondContact O-ND2 2.95Å; V499-N503 PolarHBondContact O-OD1 3.39Å; A501-N503 VanDerWaalsContact C-N 3.35Å; A501-N503 PolarHBondContact O-N 3.23Å; N503-K507 WeakPolarHBondContact O-CB 3.09Å; N503-K507 PolarHBondContact O-N 2.81Å; N503-V665 HydrophobicContact CB-CG1 4.05Å; N503-V665 HydrophobicContact CB-CG2 4.33Å; N503-V665 WeakPolarHBondContact ND2-CG2 3.45Å
504	E	93.5	Very high	94.5	Very high	59 Å²	59	35 Å²	35	28%	0.276	18%	0.184	S	C	.	.	H	α-helix	trans	-69.8	-33.5	174.1	-171.1	61.9	-155.3	0	0	111.9	Y454 K500 A501 K507 C508	Y454-E504 HydrophobicContact CE1-CG 4.47Å; K500-E504 PolarHBondContact O-N 3.47Å; K500-E504 VanDerWaalsContact O-N 3.09Å; A501-E504 PolarHBondContact O-N 3.15Å; E504-K507 PolarHBondContact O-N 3.2Å; E504-K507 IonicContact OE1-NZ 2.66Å; E504-K507 PolarHBondContact OE1-NZ 2.81Å; E504-K507 IonicContact OE2-NZ 3.78Å; E504-K507 PolarHBondContact OE2-NZ 3.45Å; E504-C508 WeakPolarHBondContact O-CB 3.37Å; E504-C508 PolarHBondContact O-N 3.13Å; E504-C508 PolarHBondContact O-SG 3.42Å
505	M	95	Very high	94.3	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-52.4	175	-169.4	-173.3	86.4	0	0	111.8	Y454 E466 F469 A501 L502 K507 C508 Q509	Y454-M505 HydrophobicContact CE1-CB 4.09Å; Y454-M505 HydrophobicContact CE2-CB 4.23Å; Y454-M505 HydrophobicContact CE2-CG 3.88Å; E466-M505 HydrophobicContact CB-SD 4.36Å; E466-M505 HydrophobicContact CG-CG 3.41Å; E466-M505 VanDerWaalsContact CG-CG 3.41Å; E466-M505 HydrophobicContact CG-SD 3.52Å; E466-M505 VanDerWaalsContact CG-SD 3.52Å; F469-M505 HydrophobicContact CD1-CE 3.83Å; F469-M505 HydrophobicContact CE1-CE 4.19Å; F469-M505 HydrophobicContact CG-CE 4.13Å; A501-M505 PolarHBondContact O-N 2.75Å; L502-M505 HydrophobicContact CD1-CE 3.57Å; L502-M505 HydrophobicContact CD1-SD 4.27Å; L502-M505 WeakPolarHBondContact O-CB 3.4Å; L502-M505 PolarHBondContact O-N 3.45Å; M505-K507 VanDerWaalsContact C-N 3.29Å; M505-K507 PolarHBondContact O-N 3.31Å; M505-C508 PolarHBondContact O-N 3.24Å; M505-Q509 PolarHBondContact O-N 3.11Å
506	W	93.4	Very high	94.3	Very high	6 Å²	6	33.8 Å²	33.8	2%	0.023	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-36.7	176.5	-62.2	133.2	0	0	0	112.8	F469 L502 Q509 N510 H622 T669	F469-W506 HydrophobicContact CD1-CH2 4.28Å; F469-W506 HydrophobicContact CD1-CZ2 4.38Å; F469-W506 AromaticContact CE1-CH2 3.66Å; F469-W506 HydrophobicContact CE1-CH2 3.66Å; F469-W506 AromaticContact CE1-CZ2 3.49Å; F469-W506 HydrophobicContact CE1-CZ2 3.49Å; F469-W506 VanDerWaalsContact CE1-CZ2 3.49Å; F469-W506 HydrophobicContact CZ-CH2 4.45Å; F469-W506 AromaticContact CZ-CZ2 3.84Å; F469-W506 HydrophobicContact CZ-CZ2 3.84Å; L502-W506 HydrophobicContact CD1-CZ2 4.22Å; L502-W506 PolarHBondContact O-N 3.14Å; W506-Q509 VanDerWaalsContact CE3-OE1 3.31Å; W506-Q509 VanDerWaalsContact CZ3-OE1 3.3Å; W506-Q509 PolarHBondContact O-N 2.73Å; W506-N510 WeakPolarHBondContact O-CB 3.3Å; W506-N510 PolarHBondContact O-N 2.97Å; W506-H622 HydrophobicContact CH2-CB 4.19Å; W506-H622 AromaticContact CH2-ND1 3.58Å; W506-T669 HydrophobicContact CB-CG2 4.1Å
507	K	91.6	Very high	94.3	Very high	85 Å²	85	33 Å²	33	37%	0.37	16%	0.162	S	C	.	.	H	α-helix	trans	-66.4	-40.5	175.1	168.2	167	159.3	-82.7	0	112.5	N503 E504 M505 N510 M511	N503-K507 WeakPolarHBondContact O-CB 3.09Å; N503-K507 PolarHBondContact O-N 2.81Å; E504-K507 PolarHBondContact O-N 3.2Å; E504-K507 IonicContact OE1-NZ 2.66Å; E504-K507 PolarHBondContact OE1-NZ 2.81Å; E504-K507 IonicContact OE2-NZ 3.78Å; E504-K507 PolarHBondContact OE2-NZ 3.45Å; M505-K507 VanDerWaalsContact C-N 3.29Å; M505-K507 PolarHBondContact O-N 3.31Å; K507-N510 PolarHBondContact O-N 2.73Å; K507-M511 WeakPolarHBondContact O-CB 3.46Å; K507-M511 PolarHBondContact O-N 3.43Å
508	C	92.3	Very high	94.2	Very high	22 Å²	22	32 Å²	32	15%	0.149	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-44.3	173.8	-80.7	0	0	0	0	112	E504 M505 M511 L512	E504-C508 WeakPolarHBondContact O-CB 3.37Å; E504-C508 PolarHBondContact O-N 3.13Å; E504-C508 PolarHBondContact O-SG 3.42Å; M505-C508 PolarHBondContact O-N 3.24Å; C508-M511 PolarHBondContact O-N 3.17Å; C508-L512 PolarHBondContact O-N 3.36Å
509	Q	92	Very high	94.1	Very high	16 Å²	16	32.3 Å²	32.3	8%	0.075	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-43.3	176.1	-70.1	-176.9	-10.4	0	0	111.7	E466 M505 W506 M511 L512 R513 R617	E466-Q509 PolarHBondContact OE2-NE2 3.49Å; M505-Q509 PolarHBondContact O-N 3.11Å; W506-Q509 VanDerWaalsContact CE3-OE1 3.31Å; W506-Q509 VanDerWaalsContact CZ3-OE1 3.3Å; W506-Q509 PolarHBondContact O-N 2.73Å; Q509-M511 PolarHBondContact O-N 2.98Å; Q509-L512 PolarHBondContact O-N 3.42Å; Q509-R513 WeakPolarHBondContact O-CG 3.39Å; Q509-R513 PolarHBondContact O-N 3.15Å; Q509-R617 WeakPolarHBondContact CG-O 3.39Å
510	N	91.5	Very high	94	Very high	44 Å²	44	31.3 Å²	31.3	24%	0.235	15%	0.151	C	C	.	.	H	α-helix	trans	-63.5	-39.4	176.9	-164.8	39.1	0	0	0	113	W506 K507 R513 S514 T669	W506-N510 WeakPolarHBondContact O-CB 3.3Å; W506-N510 PolarHBondContact O-N 2.97Å; K507-N510 PolarHBondContact O-N 2.73Å; N510-R513 PolarHBondContact O-N 2.75Å; N510-R513 PolarHBondContact OD1-NE 2.95Å; N510-R513 PolarHBondContact OD1-NH2 3.04Å; N510-S514 PolarHBondContact O-N 3.31Å; N510-T669 HydrophobicContact CB-CG2 4.24Å; N510-T669 PolarHBondContact ND2-O 3.16Å; N510-T669 PolarHBondContact OD1-O 3.35Å
511	M	92.2	Very high	93.9	Very high	85 Å²	85	30.6 Å²	30.6	42%	0.419	15%	0.15	S	C	.	.	H	α-helix	trans	-60.3	-44.6	173.1	-173.8	-171.3	-55.7	0	0	111.5	K507 C508 Q509 S514 H515	K507-M511 WeakPolarHBondContact O-CB 3.46Å; K507-M511 PolarHBondContact O-N 3.43Å; C508-M511 PolarHBondContact O-N 3.17Å; Q509-M511 PolarHBondContact O-N 2.98Å; M511-S514 WeakPolarHBondContact O-CB 3.4Å; M511-S514 PolarHBondContact O-N 3.18Å; M511-H515 PolarHBondContact O-CD2 3.43Å; M511-H515 PolarHBondContact O-N 3.06Å
512	L	93.9	Very high	93.8	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-42.1	177.8	-171.9	59.8	0	0	0	111.9	C508 Q509 S514 H515 V516 I542 N545 L614 R617 I618	C508-L512 PolarHBondContact O-N 3.36Å; Q509-L512 PolarHBondContact O-N 3.42Å; L512-S514 VanDerWaalsContact C-N 3.27Å; L512-S514 PolarHBondContact O-N 2.86Å; L512-H515 PolarHBondContact O-N 3Å; L512-H515 VanDerWaalsContact O-N 3.16Å; L512-V516 WeakPolarHBondContact O-CG2 3.16Å; L512-V516 PolarHBondContact O-N 3.29Å; L512-I542 HydrophobicContact CD1-CG1 4.36Å; L512-I542 HydrophobicContact CD1-CG2 4.36Å; L512-N545 HydrophobicContact CD1-CB 3.94Å; L512-N545 HydrophobicContact CD2-CB 4.4Å; L512-L614 HydrophobicContact CD1-CD1 4.29Å; L512-L614 HydrophobicContact CD2-CD1 4.05Å; L512-L614 HydrophobicContact CG-CD1 4.28Å; L512-R617 HydrophobicContact CD2-CB 3.83Å; L512-I618 HydrophobicContact CB-CG2 4.39Å; L512-I618 HydrophobicContact CD2-CG2 3.93Å; L512-I618 HydrophobicContact CG-CG2 3.78Å
513	R	94	Very high	93.5	Very high	16 Å²	16	32.9 Å²	32.9	6%	0.06	16%	0.161	C	C	.	.	H	α-helix	trans	-56.6	-40	171.7	-69.6	-174.4	-57.5	-130.6	14.2	112.1	Q509 N510 R517 I618 T669 H670	Q509-R513 WeakPolarHBondContact O-CG 3.39Å; Q509-R513 PolarHBondContact O-N 3.15Å; N510-R513 PolarHBondContact O-N 2.75Å; N510-R513 PolarHBondContact OD1-NE 2.95Å; N510-R513 PolarHBondContact OD1-NH2 3.04Å; R513-R517 WeakPolarHBondContact O-CB 3.45Å; R513-R517 PolarHBondContact O-N 3.23Å; R513-I618 VanDerWaalsContact CD-O 3.29Å; R513-I618 WeakPolarHBondContact CD-O 3.4Å; R513-I618 HydrophobicContact CG-CB 4Å; R513-I618 HydrophobicContact CG-CG2 4.32Å; R513-I618 WeakPolarHBondContact CG-O 3.47Å; R513-T669 PolarHBondContact NH2-O 3Å; R513-H670 PolarHBondContact NH1-NE2 2.95Å; R513-H670 PolarHBondContact NH2-CD2 3.06Å; R513-H670 PolarHBondContact NH2-NE2 3.2Å
514	S	93.5	Very high	93.3	Very high	43 Å²	43	36.8 Å²	36.8	30%	0.301	18%	0.177	S	C	.	.	H	α-helix	trans	-61.7	-48.4	174.7	-160	0	0	0	0	111.5	N510 M511 L512 V516 R517 E518	N510-S514 PolarHBondContact O-N 3.31Å; M511-S514 WeakPolarHBondContact O-CB 3.4Å; M511-S514 PolarHBondContact O-N 3.18Å; L512-S514 VanDerWaalsContact C-N 3.27Å; L512-S514 PolarHBondContact O-N 2.86Å; S514-V516 VanDerWaalsContact C-N 3.35Å; S514-V516 PolarHBondContact O-N 3.46Å; S514-R517 WeakPolarHBondContact O-CB 3.49Å; S514-R517 PolarHBondContact O-N 3.02Å; S514-R517 VanDerWaalsContact O-N 3.08Å; S514-E518 VanDerWaalsContact CB-OE1 3.31Å; S514-E518 WeakPolarHBondContact CB-OE1 3.4Å; S514-E518 WeakPolarHBondContact O-CB 3.35Å; S514-E518 WeakPolarHBondContact O-CG 3.12Å; S514-E518 PolarHBondContact O-N 3.35Å; S514-E518 PolarHBondContact OG-OE1 3.23Å
515	H	94.2	Very high	93.1	Very high	35 Å²	35	39 Å²	39	16%	0.162	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-32.7	179.7	-63.1	-29.1	0	0	0	114	M511 L512 E518 L519 I542	M511-H515 PolarHBondContact O-CD2 3.43Å; M511-H515 PolarHBondContact O-N 3.06Å; L512-H515 PolarHBondContact O-N 3Å; L512-H515 VanDerWaalsContact O-N 3.16Å; H515-E518 IonicContact CE1-OE2 2.94Å; H515-E518 IonicContact CG-OE2 3.65Å; H515-E518 IonicContact ND1-OE1 3.62Å; H515-E518 IonicContact ND1-OE2 3.77Å; H515-E518 PolarHBondContact ND1-OE2 2.9Å; H515-L519 WeakPolarHBondContact O-CB 3.33Å; H515-L519 PolarHBondContact O-N 2.94Å; H515-L519 VanDerWaalsContact O-N 3.11Å; H515-I542 HydrophobicContact CB-CG1 4.11Å
516	V	95.5	Very high	92.7	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-69.5	-37.8	170.8	-177.9	0	0	0	0	111.1	L512 S514 L519 L520 I542 L573 I577 L614 I618	L512-V516 WeakPolarHBondContact O-CG2 3.16Å; L512-V516 PolarHBondContact O-N 3.29Å; S514-V516 VanDerWaalsContact C-N 3.35Å; S514-V516 PolarHBondContact O-N 3.46Å; V516-L519 WeakPolarHBondContact O-CB 3.44Å; V516-L519 PolarHBondContact O-N 2.76Å; V516-L520 HydrophobicContact CG1-CD1 4.27Å; V516-L520 WeakPolarHBondContact O-CG 3.24Å; V516-L520 PolarHBondContact O-N 3.21Å; V516-I542 HydrophobicContact CG2-CD1 4.17Å; V516-L573 HydrophobicContact CG1-CD1 4.48Å; V516-L573 HydrophobicContact CG1-CD2 4Å; V516-L573 HydrophobicContact CG1-CG 4.21Å; V516-I577 HydrophobicContact CB-CD1 4.33Å; V516-I577 HydrophobicContact CG1-CD1 4.04Å; V516-I577 HydrophobicContact CG1-CG2 4.29Å; V516-L614 HydrophobicContact CG2-CD1 4.24Å; V516-I618 HydrophobicContact CG1-CD1 4.37Å; V516-I618 HydrophobicContact CG2-CD1 4.35Å; V516-I618 HydrophobicContact CG2-CG2 4.18Å
517	R	95.1	Very high	92.3	Very high	71 Å²	71	50.1 Å²	50.1	27%	0.268	26%	0.258	S	S	.	.	H	α-helix	trans	-64.2	-48.4	175	-163.4	179	-58.7	108.1	2.1	111.9	R513 S514 L519 L520 D521 I577	R513-R517 WeakPolarHBondContact O-CB 3.45Å; R513-R517 PolarHBondContact O-N 3.23Å; S514-R517 WeakPolarHBondContact O-CB 3.49Å; S514-R517 PolarHBondContact O-N 3.02Å; S514-R517 VanDerWaalsContact O-N 3.08Å; R517-L519 PolarHBondContact O-N 3.12Å; R517-L520 PolarHBondContact O-N 2.92Å; R517-D521 PolarHBondContact O-N 2.62Å; R517-I577 VanDerWaalsContact CA-CD1 3.47Å; R517-I577 HydrophobicContact CB-CD1 3.7Å; R517-I577 HydrophobicContact CG-CD1 4.15Å; R517-I577 PolarHBondContact NH2-O 2.92Å
518	E	94.2	Very high	92.2	Very high	52 Å²	52	48.9 Å²	48.9	24%	0.243	26%	0.26	C	S	.	.	H	α-helix	trans	-55.8	-34.7	174.3	-67.6	151.4	-145.5	0	0	112.2	S514 H515 L522 K538	S514-E518 VanDerWaalsContact CB-OE1 3.31Å; S514-E518 WeakPolarHBondContact CB-OE1 3.4Å; S514-E518 WeakPolarHBondContact O-CB 3.35Å; S514-E518 WeakPolarHBondContact O-CG 3.12Å; S514-E518 PolarHBondContact O-N 3.35Å; S514-E518 PolarHBondContact OG-OE1 3.23Å; H515-E518 IonicContact CE1-OE2 2.94Å; H515-E518 IonicContact CG-OE2 3.65Å; H515-E518 IonicContact ND1-OE1 3.62Å; H515-E518 IonicContact ND1-OE2 3.77Å; H515-E518 PolarHBondContact ND1-OE2 2.9Å; E518-L522 WeakPolarHBondContact O-CD1 3.34Å; E518-L522 VanDerWaalsContact O-CG 3.28Å; E518-L522 WeakPolarHBondContact O-CG 3.38Å; E518-L522 PolarHBondContact O-N 3.46Å; E518-K538 HydrophobicContact CB-CD 4.18Å; E518-K538 WeakPolarHBondContact OE2-CE 3.26Å; E518-K538 IonicContact OE2-NZ 2.8Å; E518-K538 PolarHBondContact OE2-NZ 3.49Å
519	L	94.6	Very high	91.8	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-71.1	-39.9	174.1	-179.1	66.9	0	0	0	112.5	H515 V516 R517 L522 H523 M535 K538 L539 I542	H515-L519 WeakPolarHBondContact O-CB 3.33Å; H515-L519 PolarHBondContact O-N 2.94Å; H515-L519 VanDerWaalsContact O-N 3.11Å; V516-L519 WeakPolarHBondContact O-CB 3.44Å; V516-L519 PolarHBondContact O-N 2.76Å; R517-L519 PolarHBondContact O-N 3.12Å; L519-L522 PolarHBondContact O-N 3.39Å; L519-H523 PolarHBondContact O-CD2 2.66Å; L519-H523 PolarHBondContact O-N 3.05Å; L519-M535 HydrophobicContact CD1-CB 4.27Å; L519-M535 HydrophobicContact CD1-CE 4.16Å; L519-M535 HydrophobicContact CD1-CG 4.4Å; L519-K538 HydrophobicContact CB-CB 4.42Å; L519-K538 HydrophobicContact CD1-CB 4.21Å; L519-L539 HydrophobicContact CD1-CD2 3.93Å; L519-L539 HydrophobicContact CD1-CG 4.27Å; L519-L539 HydrophobicContact CD2-CD2 3.61Å; L519-L539 HydrophobicContact CG-CD2 4.44Å; L519-I542 HydrophobicContact CB-CD1 4.38Å; L519-I542 HydrophobicContact CD2-CD1 3.86Å
520	L	94.2	Very high	91.5	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-72.3	-31.6	178.3	-66.8	173.5	0	0	0	112.5	V516 R517 L522 H523 K524 L563 R570 L573 E574 I577	V516-L520 HydrophobicContact CG1-CD1 4.27Å; V516-L520 WeakPolarHBondContact O-CG 3.24Å; V516-L520 PolarHBondContact O-N 3.21Å; R517-L520 PolarHBondContact O-N 2.92Å; L520-L522 VanDerWaalsContact C-N 3.3Å; L520-L522 PolarHBondContact O-N 2.87Å; L520-H523 WeakPolarHBondContact O-CB 3.29Å; L520-H523 PolarHBondContact O-N 3.16Å; L520-K524 PolarHBondContact O-N 3.11Å; L520-L563 HydrophobicContact CD2-CD1 4.39Å; L520-L563 HydrophobicContact CD2-CD2 4.22Å; L520-R570 HydrophobicContact CD2-CG 3.69Å; L520-L573 HydrophobicContact CD1-CB 4.22Å; L520-L573 HydrophobicContact CD1-CD2 4.08Å; L520-L573 HydrophobicContact CD1-CG 3.91Å; L520-L573 HydrophobicContact CD2-CD2 4.3Å; L520-E574 HydrophobicContact CB-CG 4.25Å; L520-E574 HydrophobicContact CD1-CG 3.63Å; L520-E574 HydrophobicContact CG-CG 4.41Å; L520-I577 HydrophobicContact CD1-CD1 3.67Å
521	D	93.5	Very high	91.4	Very high	63 Å²	63	57.2 Å²	57.2	34%	0.337	31%	0.309	S	S	.	.	H	α-helix	trans	-73.5	-22.5	173.9	-63.8	-32.5	0	0	0	112.5	R517 K524 Q525	R517-D521 PolarHBondContact O-N 2.62Å; D521-K524 PolarHBondContact O-N 3.25Å; D521-K524 IonicContact OD1-NZ 3.15Å; D521-K524 PolarHBondContact OD1-NZ 3.41Å; D521-Q525 PolarHBondContact O-NE2 3.44Å
522	L	93.4	Very high	91.2	Very high	18 Å²	18	56.2 Å²	56.2	9%	0.094	31%	0.31	C	S	.	.	H	α-helix	trans	-73.8	-32.7	167.1	-71.2	166.9	0	0	0	112.4	E518 L519 L520 K524 Q525 N531 A534 M535 K538	E518-L522 WeakPolarHBondContact O-CD1 3.34Å; E518-L522 VanDerWaalsContact O-CG 3.28Å; E518-L522 WeakPolarHBondContact O-CG 3.38Å; E518-L522 PolarHBondContact O-N 3.46Å; L519-L522 PolarHBondContact O-N 3.39Å; L520-L522 VanDerWaalsContact C-N 3.3Å; L520-L522 PolarHBondContact O-N 2.87Å; L522-K524 PolarHBondContact O-N 3.21Å; L522-Q525 PolarHBondContact O-N 3.49Å; L522-Q525 VanDerWaalsContact O-N 3.14Å; L522-N531 WeakPolarHBondContact CB-OD1 3.34Å; L522-N531 WeakPolarHBondContact CD2-OD1 3.47Å; L522-N531 PolarHBondContact O-ND2 3.14Å; L522-N531 VanDerWaalsContact O-ND2 3.15Å; L522-A534 HydrophobicContact CD1-CB 4.05Å; L522-A534 HydrophobicContact CD2-CB 4.07Å; L522-M535 HydrophobicContact CB-CG 3.69Å; L522-M535 HydrophobicContact CB-SD 4.5Å; L522-M535 HydrophobicContact CD1-CG 3.93Å; L522-M535 HydrophobicContact CG-CG 4.36Å; L522-K538 HydrophobicContact CD1-CG 4.04Å
523	H	91	Very high	90.8	Very high	31 Å²	31	59.8 Å²	59.8	14%	0.144	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.4	169.7	-88.3	-82.1	0	0	0	114	L519 L520 M535 N560 G564 R570	L519-H523 PolarHBondContact O-CD2 2.66Å; L519-H523 PolarHBondContact O-N 3.05Å; L520-H523 WeakPolarHBondContact O-CB 3.29Å; L520-H523 PolarHBondContact O-N 3.16Å; H523-M535 WeakPolarHBondContact CD2-CE 3.31Å; H523-M535 VanDerWaalsContact NE2-CE 3.28Å; H523-M535 WeakPolarHBondContact NE2-CE 3.23Å; H523-N560 PolarHBondContact CE1-O 3.27Å; H523-N560 PolarHBondContact NE2-OD1 3.39Å; H523-G564 PolarHBondContact CE1-N 2.93Å; H523-R570 PolarHBondContact O-NH1 3.22Å
524	K	89.9	Confident	90.6	Very high	111 Å²	111	61.1 Å²	61.1	48%	0.483	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-10.1	174.1	-62.9	168.2	-165.4	164.9	0	112.9	L520 D521 L522 E574	L520-K524 PolarHBondContact O-N 3.11Å; D521-K524 PolarHBondContact O-N 3.25Å; D521-K524 IonicContact OD1-NZ 3.15Å; D521-K524 PolarHBondContact OD1-NZ 3.41Å; L522-K524 PolarHBondContact O-N 3.21Å; K524-E574 VanDerWaalsContact CE-CD 3.41Å; K524-E574 WeakPolarHBondContact CE-OE1 3.4Å; K524-E574 WeakPolarHBondContact CE-OE2 3.25Å; K524-E574 VanDerWaalsContact NZ-CD 3.35Å; K524-E574 IonicContact NZ-OE1 2.73Å; K524-E574 IonicContact NZ-OE2 2.73Å; K524-E574 PolarHBondContact NZ-OE2 3.16Å
525	Q	89.5	Confident	90.4	Very high	106 Å²	106	60.2 Å²	60.2	50%	0.495	34%	0.341	S	S	.	.	S	Bend	trans	-92.8	150.1	177.4	-70.2	173	48.1	0	0	110.6	D521 L522 N531	D521-Q525 PolarHBondContact O-NE2 3.44Å; L522-Q525 PolarHBondContact O-N 3.49Å; L522-Q525 VanDerWaalsContact O-N 3.14Å; Q525-N531 PolarHBondContact O-ND2 3.18Å
526	P	87	Confident	90.1	Very high	110 Å²	110	63.7 Å²	63.7	71%	0.714	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-60.5	144.9	176.4	25.3	-34.2	0	0	0	111.8	S528 N531	P526-S528 PolarHBondContact O-N 2.92Å; P526-N531 PolarHBondContact O-ND2 3.43Å
527	T	86.2	Confident	89.8	Confident	132 Å²	132	65.1 Å²	65.1	81%	0.81	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-64.2	122.3	178.9	-48.1	0	0	0	0	110.4
528	S	88.6	Confident	89.6	Confident	58 Å²	58	64.7 Å²	64.7	41%	0.406	37%	0.371	S	S	.	.			trans	-149.3	159.8	177.2	59	0	0	0	0	109.2	P526 A530 N531 C532	P526-S528 PolarHBondContact O-N 2.92Å; S528-A530 PolarHBondContact O-N 3.13Å; S528-N531 PolarHBondContact O-N 3.46Å; S528-N531 VanDerWaalsContact OG-CB 3.3Å; S528-N531 WeakPolarHBondContact OG-CB 3.45Å; S528-N531 PolarHBondContact OG-N 2.87Å; S528-C532 PolarHBondContact O-N 3.01Å; S528-C532 PolarHBondContact O-SG 2.88Å; S528-C532 VanDerWaalsContact O-SG 3.34Å
529	E	84	Confident	89.4	Confident	170 Å²	170	62.6 Å²	62.6	79%	0.794	36%	0.361	S	S	*	.	H	α-helix	trans	-59	-36.2	-179.3	-172	171.6	-157	0	0	112.6	S533	E529-S533 WeakPolarHBondContact O-CB 3.46Å; E529-S533 PolarHBondContact O-N 3.05Å; E529-S533 PolarHBondContact O-OG 2.73Å
530	A	86.3	Confident	89.1	Confident	78 Å²	78	64.1 Å²	64.1	65%	0.645	37%	0.369	S	S	*	.	H	α-helix	trans	-65.5	-44.8	172.4	0	0	0	0	0	112.4	S528 S533 A534	S528-A530 PolarHBondContact O-N 3.13Å; A530-S533 PolarHBondContact O-N 3.27Å; A530-A534 WeakPolarHBondContact O-CB 3.14Å; A530-A534 PolarHBondContact O-N 2.88Å
531	N	88.8	Confident	89	Confident	9 Å²	9	66.3 Å²	66.3	5%	0.048	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-49.3	175.7	-173.2	1.5	0	0	0	110.8	L522 Q525 P526 S528 S533 A534 M535	L522-N531 WeakPolarHBondContact CB-OD1 3.34Å; L522-N531 WeakPolarHBondContact CD2-OD1 3.47Å; L522-N531 PolarHBondContact O-ND2 3.14Å; L522-N531 VanDerWaalsContact O-ND2 3.15Å; Q525-N531 PolarHBondContact O-ND2 3.18Å; P526-N531 PolarHBondContact O-ND2 3.43Å; S528-N531 PolarHBondContact O-N 3.46Å; S528-N531 VanDerWaalsContact OG-CB 3.3Å; S528-N531 WeakPolarHBondContact OG-CB 3.45Å; S528-N531 PolarHBondContact OG-N 2.87Å; N531-S533 VanDerWaalsContact C-N 3.28Å; N531-S533 PolarHBondContact O-N 2.94Å; N531-A534 WeakPolarHBondContact O-CB 3.26Å; N531-A534 PolarHBondContact O-N 3.43Å; N531-A534 VanDerWaalsContact O-N 3.08Å; N531-M535 WeakPolarHBondContact O-CG 3.5Å; N531-M535 PolarHBondContact O-N 3.3Å; N531-M535 WeakPolarHBondContact OD1-CG 3.35Å
532	C	87.5	Confident	89	Confident	65 Å²	65	63.4 Å²	63.4	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-55.3	-41.6	176.4	-68.5	0	0	0	0	112.6	S528 F536	S528-C532 PolarHBondContact O-N 3.01Å; S528-C532 PolarHBondContact O-SG 2.88Å; S528-C532 VanDerWaalsContact O-SG 3.34Å; C532-F536 WeakPolarHBondContact O-CB 3.44Å; C532-F536 PolarHBondContact O-N 2.8Å
533	S	86.9	Confident	88.9	Confident	77 Å²	77	62.5 Å²	62.5	54%	0.538	36%	0.362	S	S	.	.	H	α-helix	trans	-67.6	-42.5	176.1	-60.5	0	0	0	0	112.3	E529 A530 N531 F536 G537	E529-S533 WeakPolarHBondContact O-CB 3.46Å; E529-S533 PolarHBondContact O-N 3.05Å; E529-S533 PolarHBondContact O-OG 2.73Å; A530-S533 PolarHBondContact O-N 3.27Å; N531-S533 VanDerWaalsContact C-N 3.28Å; N531-S533 PolarHBondContact O-N 2.94Å; S533-F536 PolarHBondContact O-N 3.01Å; S533-G537 PolarHBondContact O-N 3.06Å
534	A	88.3	Confident	88.9	Confident	43 Å²	43	65.9 Å²	65.9	36%	0.355	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-45.1	175.7	0	0	0	0	0	111.9	L522 A530 N531 G537 K538	L522-A534 HydrophobicContact CD1-CB 4.05Å; L522-A534 HydrophobicContact CD2-CB 4.07Å; A530-A534 WeakPolarHBondContact O-CB 3.14Å; A530-A534 PolarHBondContact O-N 2.88Å; N531-A534 WeakPolarHBondContact O-CB 3.26Å; N531-A534 PolarHBondContact O-N 3.43Å; N531-A534 VanDerWaalsContact O-N 3.08Å; A534-G537 PolarHBondContact O-N 3.1Å; A534-K538 WeakPolarHBondContact O-CG 3.38Å; A534-K538 PolarHBondContact O-N 3.45Å
535	M	89.8	Confident	89	Confident	24 Å²	24	62.3 Å²	62.3	12%	0.118	36%	0.363	C	S	.	.	H	α-helix	trans	-57.3	-50.5	174	-69.1	-176.6	93.8	0	0	110.5	L519 L522 H523 N531 G537 K538 L539	L519-M535 HydrophobicContact CD1-CB 4.27Å; L519-M535 HydrophobicContact CD1-CE 4.16Å; L519-M535 HydrophobicContact CD1-CG 4.4Å; L522-M535 HydrophobicContact CB-CG 3.69Å; L522-M535 HydrophobicContact CB-SD 4.5Å; L522-M535 HydrophobicContact CD1-CG 3.93Å; L522-M535 HydrophobicContact CG-CG 4.36Å; H523-M535 WeakPolarHBondContact CD2-CE 3.31Å; H523-M535 VanDerWaalsContact NE2-CE 3.28Å; H523-M535 WeakPolarHBondContact NE2-CE 3.23Å; N531-M535 WeakPolarHBondContact O-CG 3.5Å; N531-M535 PolarHBondContact O-N 3.3Å; N531-M535 WeakPolarHBondContact OD1-CG 3.35Å; M535-G537 VanDerWaalsContact C-N 3.3Å; M535-G537 PolarHBondContact O-N 3.42Å; M535-K538 WeakPolarHBondContact O-CA 3.37Å; M535-K538 PolarHBondContact O-N 3.41Å; M535-L539 WeakPolarHBondContact O-CG 3.39Å; M535-L539 PolarHBondContact O-N 2.93Å
536	F	88.7	Confident	89.1	Confident	108 Å²	108	57.3 Å²	57.3	47%	0.474	34%	0.339	S	S	.	.	H	α-helix	trans	-56.9	-42.7	178.5	-172.1	-99.7	0	0	0	112.2	C532 S533 K538 L539 M540	C532-F536 WeakPolarHBondContact O-CB 3.44Å; C532-F536 PolarHBondContact O-N 2.8Å; S533-F536 PolarHBondContact O-N 3.01Å; F536-K538 VanDerWaalsContact C-N 3.35Å; F536-K538 PolarHBondContact O-N 2.95Å; F536-L539 PolarHBondContact O-N 2.92Å; F536-M540 HydrophobicContact CD1-CG 4.11Å; F536-M540 HydrophobicContact CD2-CE 4.32Å; F536-M540 HydrophobicContact CE1-CE 4.24Å; F536-M540 HydrophobicContact CE1-CG 3.79Å; F536-M540 HydrophobicContact CE1-SD 4.05Å; F536-M540 HydrophobicContact CE2-CE 3.68Å; F536-M540 HydrophobicContact CE2-SD 4.5Å; F536-M540 HydrophobicContact CZ-CE 3.63Å; F536-M540 HydrophobicContact CZ-CG 4.15Å; F536-M540 HydrophobicContact CZ-SD 3.85Å; F536-M540 WeakPolarHBondContact O-CG 3.45Å; F536-M540 PolarHBondContact O-N 3.28Å
537	G	87.8	Confident	89.2	Confident	33 Å²	33	52.8 Å²	52.8	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-57.8	-42.1	172.9	0	0	0	0	0	113.5	S533 A534 M535 T541	S533-G537 PolarHBondContact O-N 3.06Å; A534-G537 PolarHBondContact O-N 3.1Å; M535-G537 VanDerWaalsContact C-N 3.3Å; M535-G537 PolarHBondContact O-N 3.42Å; G537-T541 PolarHBondContact O-N 3.47Å; G537-T541 VanDerWaalsContact O-N 3.09Å; G537-T541 PolarHBondContact O-OG1 2.87Å
538	K	90.8	Very high	89.3	Confident	63 Å²	63	49.7 Å²	49.7	27%	0.274	29%	0.289	S	S	.	.	H	α-helix	trans	-67.1	-41.4	175	-62.4	-61.7	174.3	-178.3	0	112.4	E518 L519 L522 A534 M535 F536 M540 T541 I542	E518-K538 HydrophobicContact CB-CD 4.18Å; E518-K538 WeakPolarHBondContact OE2-CE 3.26Å; E518-K538 IonicContact OE2-NZ 2.8Å; E518-K538 PolarHBondContact OE2-NZ 3.49Å; L519-K538 HydrophobicContact CB-CB 4.42Å; L519-K538 HydrophobicContact CD1-CB 4.21Å; L522-K538 HydrophobicContact CD1-CG 4.04Å; A534-K538 WeakPolarHBondContact O-CG 3.38Å; A534-K538 PolarHBondContact O-N 3.45Å; M535-K538 WeakPolarHBondContact O-CA 3.37Å; M535-K538 PolarHBondContact O-N 3.41Å; F536-K538 VanDerWaalsContact C-N 3.35Å; F536-K538 PolarHBondContact O-N 2.95Å; K538-M540 PolarHBondContact O-N 3.45Å; K538-T541 WeakPolarHBondContact O-CB 2.84Å; K538-T541 PolarHBondContact O-N 3.09Å; K538-I542 WeakPolarHBondContact O-CG1 3.27Å; K538-I542 PolarHBondContact O-N 3.06Å
539	L	91.3	Very high	89	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-44.4	175.4	-62	174.1	0	0	0	111.8	L519 M535 F536 T541 I542 A543 V556 N560	L519-L539 HydrophobicContact CD1-CD2 3.93Å; L519-L539 HydrophobicContact CD1-CG 4.27Å; L519-L539 HydrophobicContact CD2-CD2 3.61Å; L519-L539 HydrophobicContact CG-CD2 4.44Å; M535-L539 WeakPolarHBondContact O-CG 3.39Å; M535-L539 PolarHBondContact O-N 2.93Å; F536-L539 PolarHBondContact O-N 2.92Å; L539-T541 VanDerWaalsContact C-N 3.28Å; L539-T541 PolarHBondContact O-N 3.43Å; L539-I542 PolarHBondContact O-N 3.48Å; L539-A543 WeakPolarHBondContact O-CB 3.45Å; L539-A543 PolarHBondContact O-N 2.96Å; L539-V556 HydrophobicContact CB-CG1 4.12Å; L539-V556 HydrophobicContact CD2-CG1 3.57Å; L539-V556 HydrophobicContact CG-CG1 4.43Å; L539-N560 HydrophobicContact CD1-CB 3.95Å; L539-N560 HydrophobicContact CD2-CB 3.59Å; L539-N560 HydrophobicContact CG-CB 4.43Å
540	M	88.5	Confident	89	Confident	38 Å²	38	43.6 Å²	43.6	19%	0.187	27%	0.269	C	S	.	.	H	α-helix	trans	-61	-36.6	173.4	-65.4	-59.6	101.7	0	0	112.4	F536 K538 K544 Q553	F536-M540 HydrophobicContact CD1-CG 4.11Å; F536-M540 HydrophobicContact CD2-CE 4.32Å; F536-M540 HydrophobicContact CE1-CE 4.24Å; F536-M540 HydrophobicContact CE1-CG 3.79Å; F536-M540 HydrophobicContact CE1-SD 4.05Å; F536-M540 HydrophobicContact CE2-CE 3.68Å; F536-M540 HydrophobicContact CE2-SD 4.5Å; F536-M540 HydrophobicContact CZ-CE 3.63Å; F536-M540 HydrophobicContact CZ-CG 4.15Å; F536-M540 HydrophobicContact CZ-SD 3.85Å; F536-M540 WeakPolarHBondContact O-CG 3.45Å; F536-M540 PolarHBondContact O-N 3.28Å; K538-M540 PolarHBondContact O-N 3.45Å; M540-K544 WeakPolarHBondContact O-CG 3.14Å; M540-K544 PolarHBondContact O-N 3.1Å; M540-Q553 HydrophobicContact CE-CB 3.9Å; M540-Q553 HydrophobicContact CE-CG 3.7Å; M540-Q553 HydrophobicContact SD-CG 3.85Å; M540-Q553 PolarHBondContact SD-OE1 3.46Å
541	T	90.2	Very high	89.2	Confident	49 Å²	49	45.6 Å²	45.6	30%	0.301	26%	0.263	S	S	.	.	H	α-helix	trans	-71.7	-39.8	-179.5	-56	0	0	0	0	111.6	G537 K538 L539 N545	G537-T541 PolarHBondContact O-N 3.47Å; G537-T541 VanDerWaalsContact O-N 3.09Å; G537-T541 PolarHBondContact O-OG1 2.87Å; K538-T541 WeakPolarHBondContact O-CB 2.84Å; K538-T541 PolarHBondContact O-N 3.09Å; L539-T541 VanDerWaalsContact C-N 3.28Å; L539-T541 PolarHBondContact O-N 3.43Å; T541-N545 PolarHBondContact O-ND2 3.13Å
542	I	93.9	Very high	89.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-67.4	-45	174.4	-67.5	163.4	0	0	0	110.4	L512 H515 V516 L519 K538 L539 K544 N545 V556 L614	L512-I542 HydrophobicContact CD1-CG1 4.36Å; L512-I542 HydrophobicContact CD1-CG2 4.36Å; H515-I542 HydrophobicContact CB-CG1 4.11Å; V516-I542 HydrophobicContact CG2-CD1 4.17Å; L519-I542 HydrophobicContact CB-CD1 4.38Å; L519-I542 HydrophobicContact CD2-CD1 3.86Å; K538-I542 WeakPolarHBondContact O-CG1 3.27Å; K538-I542 PolarHBondContact O-N 3.06Å; L539-I542 PolarHBondContact O-N 3.48Å; I542-K544 VanDerWaalsContact C-N 3.29Å; I542-K544 PolarHBondContact O-N 3.18Å; I542-N545 WeakPolarHBondContact O-CB 3.49Å; I542-N545 PolarHBondContact O-N 3.28Å; I542-V556 HydrophobicContact CB-CG1 4.37Å; I542-V556 HydrophobicContact CG2-CG1 4.13Å; I542-V556 HydrophobicContact CG2-CG2 4.25Å; I542-L614 HydrophobicContact CG2-CD1 3.85Å; I542-L614 HydrophobicContact CG2-CD2 4.09Å
543	A	92.5	Very high	89.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.1	-31.2	-179.3	0	0	0	0	0	113.8	L539 N545 L546 A552 Q553	L539-A543 WeakPolarHBondContact O-CB 3.45Å; L539-A543 PolarHBondContact O-N 2.96Å; A543-N545 PolarHBondContact O-N 3.14Å; A543-L546 PolarHBondContact O-N 3.34Å; A543-A552 HydrophobicContact CB-CB 4.1Å; A543-Q553 HydrophobicContact CB-CB 4.35Å; A543-Q553 HydrophobicContact CB-CG 3.62Å
544	K	89.9	Confident	89.8	Confident	102 Å²	102	47.1 Å²	47.1	44%	0.443	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.9	172	-74.9	-176.4	-175.1	-175.8	0	114.3	M540 I542 E981	M540-K544 WeakPolarHBondContact O-CG 3.14Å; M540-K544 PolarHBondContact O-N 3.1Å; I542-K544 VanDerWaalsContact C-N 3.29Å; I542-K544 PolarHBondContact O-N 3.18Å; K544-E981 IonicContact NZ-OE1 2.69Å; K544-E981 PolarHBondContact NZ-OE1 2.95Å
545	N	91.8	Very high	90	Very high	36 Å²	36	47.3 Å²	47.3	19%	0.193	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	14.1	-178.2	-77.7	-80.9	0	0	0	113.6	L512 T541 I542 A543 R617	L512-N545 HydrophobicContact CD1-CB 3.94Å; L512-N545 HydrophobicContact CD2-CB 4.4Å; T541-N545 PolarHBondContact O-ND2 3.13Å; I542-N545 WeakPolarHBondContact O-CB 3.49Å; I542-N545 PolarHBondContact O-N 3.28Å; A543-N545 PolarHBondContact O-N 3.14Å; N545-R617 PolarHBondContact O-NH1 3.42Å
546	L	92.3	Very high	90.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-127.5	163.1	-175.5	-62.2	176.6	0	0	0	111.5	A543 A552 V556 M610 F613 L614	A543-L546 PolarHBondContact O-N 3.34Å; L546-A552 HydrophobicContact CB-CB 3.98Å; L546-A552 HydrophobicContact CD1-CB 4.32Å; L546-V556 HydrophobicContact CD1-CG2 3.63Å; L546-M610 HydrophobicContact CB-SD 3.82Å; L546-M610 HydrophobicContact CD1-CG 4.3Å; L546-M610 HydrophobicContact CD1-SD 4.01Å; L546-M610 HydrophobicContact CG-SD 4.43Å; L546-F613 HydrophobicContact CD2-CB 4.26Å; L546-L614 HydrophobicContact CD1-CB 4.37Å; L546-L614 HydrophobicContact CD2-CB 4.01Å; L546-L614 HydrophobicContact CD2-CD1 4.37Å
547	P	90.2	Very high	90.4	Very high	16 Å²	16	46.2 Å²	46.2	10%	0.104	25%	0.247	C	C	.	.	S	Bend	trans	-60.6	152.5	172	-14.8	28.2	0	0	0	111.3	L463 M610 F613	L463-P547 HydrophobicContact CD1-CG 3.57Å; P547-M610 VanDerWaalsContact O-CE 3.22Å; P547-M610 WeakPolarHBondContact O-CE 3.42Å; P547-F613 HydrophobicContact CG-CD1 4.13Å; P547-F613 HydrophobicContact CG-CD2 3.92Å; P547-F613 HydrophobicContact CG-CE1 4.29Å; P547-F613 HydrophobicContact CG-CE2 4.09Å; P547-F613 HydrophobicContact CG-CG 3.95Å; P547-F613 HydrophobicContact CG-CZ 4.26Å
548	D	87.6	Confident	90.6	Very high	67 Å²	67	49.5 Å²	49.5	36%	0.358	25%	0.252	S	S	.	.	S	Bend	trans	42.1	71.9	-179	-168.4	-23.2	0	0	0	112.6	G550 K551 A552	D548-G550 CarbonylContact O-C 3.24Å; D548-G550 PolarHBondContact O-N 3.16Å; D548-G550 PolarHBondContact OD1-N 3.45Å; D548-K551 HydrophobicContact CB-CB 4.41Å; D548-K551 PolarHBondContact O-N 3.03Å; D548-K551 PolarHBondContact OD1-N 3.32Å; D548-K551 VanDerWaalsContact OD1-N 3.12Å; D548-K551 WeakPolarHBondContact OD2-CD 3.49Å; D548-K551 WeakPolarHBondContact OD2-CG 3.23Å; D548-K551 IonicContact OD2-NZ 3.36Å; D548-K551 PolarHBondContact OD2-NZ 2.84Å; D548-A552 WeakPolarHBondContact O-CB 2.96Å; D548-A552 PolarHBondContact O-N 2.95Å
549	P	82.7	Confident	90.7	Very high	59 Å²	59	46.8 Å²	46.8	38%	0.383	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-4.8	-174.1	26.3	-35.8	0	0	0	114	Q553	P549-Q553 WeakPolarHBondContact O-CG 3.35Å; P549-Q553 PolarHBondContact O-NE2 3.21Å
550	G	83.9	Confident	90.8	Very high	40 Å²	40	47.6 Å²	47.6	41%	0.412	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-66.1	164	0	0	0	0	0	110.3	D548 A552 Q553	D548-G550 CarbonylContact O-C 3.24Å; D548-G550 PolarHBondContact O-N 3.16Å; D548-G550 PolarHBondContact OD1-N 3.45Å; G550-A552 PolarHBondContact O-N 3.29Å; G550-Q553 WeakPolarHBondContact O-CB 3.37Å; G550-Q553 PolarHBondContact O-N 3.37Å; G550-Q553 VanDerWaalsContact O-N 3.08Å
551	K	89.6	Confident	91	Very high	120 Å²	120	51.1 Å²	51.1	52%	0.522	26%	0.26	S	S	.	.	H	α-helix	trans	-61	-31.4	179.3	-63	-168.6	-170	89.9	0	113	D548 Q553 D554 F555	D548-K551 HydrophobicContact CB-CB 4.41Å; D548-K551 PolarHBondContact O-N 3.03Å; D548-K551 PolarHBondContact OD1-N 3.32Å; D548-K551 VanDerWaalsContact OD1-N 3.12Å; D548-K551 WeakPolarHBondContact OD2-CD 3.49Å; D548-K551 WeakPolarHBondContact OD2-CG 3.23Å; D548-K551 IonicContact OD2-NZ 3.36Å; D548-K551 PolarHBondContact OD2-NZ 2.84Å; K551-Q553 PolarHBondContact O-N 2.96Å; K551-D554 PolarHBondContact O-N 3.14Å; K551-F555 HydrophobicContact CB-CD2 4.24Å; K551-F555 HydrophobicContact CB-CE2 3.98Å; K551-F555 VanDerWaalsContact O-CD2 3.28Å; K551-F555 WeakPolarHBondContact O-CD2 3.3Å; K551-F555 PolarHBondContact O-N 2.73Å
552	A	91.8	Very high	91.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-30.3	176.9	0	0	0	0	0	112.8	A543 L546 D548 G550 V556 M610	A543-A552 HydrophobicContact CB-CB 4.1Å; L546-A552 HydrophobicContact CB-CB 3.98Å; L546-A552 HydrophobicContact CD1-CB 4.32Å; D548-A552 WeakPolarHBondContact O-CB 2.96Å; D548-A552 PolarHBondContact O-N 2.95Å; G550-A552 PolarHBondContact O-N 3.29Å; A552-V556 WeakPolarHBondContact O-CB 3.45Å; A552-V556 WeakPolarHBondContact O-CG2 3.38Å; A552-V556 PolarHBondContact O-N 2.88Å; A552-M610 HydrophobicContact CB-CE 4.01Å; A552-M610 HydrophobicContact CB-CG 4.38Å; A552-M610 HydrophobicContact CB-SD 3.79Å
553	Q	91.3	Very high	91.1	Very high	73 Å²	73	50.6 Å²	50.6	34%	0.341	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-47.2	176.6	-73.9	168.7	49.4	0	0	111.3	M540 A543 P549 G550 K551 K557	M540-Q553 HydrophobicContact CE-CB 3.9Å; M540-Q553 HydrophobicContact CE-CG 3.7Å; M540-Q553 HydrophobicContact SD-CG 3.85Å; M540-Q553 PolarHBondContact SD-OE1 3.46Å; A543-Q553 HydrophobicContact CB-CB 4.35Å; A543-Q553 HydrophobicContact CB-CG 3.62Å; P549-Q553 WeakPolarHBondContact O-CG 3.35Å; P549-Q553 PolarHBondContact O-NE2 3.21Å; G550-Q553 WeakPolarHBondContact O-CB 3.37Å; G550-Q553 PolarHBondContact O-N 3.37Å; G550-Q553 VanDerWaalsContact O-N 3.08Å; K551-Q553 PolarHBondContact O-N 2.96Å; Q553-K557 WeakPolarHBondContact O-CB 3.34Å; Q553-K557 PolarHBondContact O-N 3.42Å
554	D	92.3	Very high	90.9	Very high	110 Å²	110	52.2 Å²	52.2	59%	0.588	27%	0.274	S	S	*	.	H	α-helix	trans	-67.1	-41.4	178.3	-68.4	-44.1	0	0	0	112	K551 K557 K558	K551-D554 PolarHBondContact O-N 3.14Å; D554-K557 PolarHBondContact O-N 3.11Å; D554-K558 WeakPolarHBondContact O-CB 3.33Å; D554-K558 PolarHBondContact O-N 3.26Å
555	F	94	Very high	90.9	Very high	47 Å²	47	54.2 Å²	54.2	21%	0.206	29%	0.289	C	S	.	.	H	α-helix	trans	-69.9	-38	177.7	-66.2	-38.7	0	0	0	113.3	K551 K558 F559 P606 F607 M610	K551-F555 HydrophobicContact CB-CD2 4.24Å; K551-F555 HydrophobicContact CB-CE2 3.98Å; K551-F555 VanDerWaalsContact O-CD2 3.28Å; K551-F555 WeakPolarHBondContact O-CD2 3.3Å; K551-F555 PolarHBondContact O-N 2.73Å; F555-K558 PolarHBondContact O-N 3.19Å; F555-F559 WeakPolarHBondContact O-CB 3.32Å; F555-F559 PolarHBondContact O-N 3.21Å; F555-P606 HydrophobicContact CE2-CB 4.06Å; F555-P606 HydrophobicContact CZ-CB 3.81Å; F555-F607 HydrophobicContact CB-CD2 4.11Å; F555-F607 HydrophobicContact CD1-CB 3.7Å; F555-F607 HydrophobicContact CD1-CD2 4.03Å; F555-F607 HydrophobicContact CD1-CG 4.36Å; F555-F607 HydrophobicContact CE1-CB 3.92Å; F555-F607 HydrophobicContact CG-CB 4.37Å; F555-F607 HydrophobicContact CG-CD2 4.38Å; F555-F607 WeakPolarHBondContact O-CE2 3.35Å; F555-M610 HydrophobicContact CB-CB 3.96Å; F555-M610 HydrophobicContact CB-CG 3.83Å; F555-M610 HydrophobicContact CD2-CB 3.76Å; F555-M610 HydrophobicContact CD2-CE 4.18Å; F555-M610 HydrophobicContact CD2-CG 3.97Å; F555-M610 HydrophobicContact CG-CB 4.17Å; F555-M610 HydrophobicContact CG-CG 4.37Å
556	V	92.8	Very high	90.9	Very high	7 Å²	7	54.6 Å²	54.6	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-70.8	-35.7	174.5	169.1	0	0	0	0	111	L539 I542 L546 A552 F559 N560	L539-V556 HydrophobicContact CB-CG1 4.12Å; L539-V556 HydrophobicContact CD2-CG1 3.57Å; L539-V556 HydrophobicContact CG-CG1 4.43Å; I542-V556 HydrophobicContact CB-CG1 4.37Å; I542-V556 HydrophobicContact CG2-CG1 4.13Å; I542-V556 HydrophobicContact CG2-CG2 4.25Å; L546-V556 HydrophobicContact CD1-CG2 3.63Å; A552-V556 WeakPolarHBondContact O-CB 3.45Å; A552-V556 WeakPolarHBondContact O-CG2 3.38Å; A552-V556 PolarHBondContact O-N 2.88Å; V556-F559 PolarHBondContact O-N 3.48Å; V556-N560 WeakPolarHBondContact O-CB 3.48Å; V556-N560 PolarHBondContact O-N 3.17Å
557	K	92.7	Very high	90.9	Very high	103 Å²	103	61.3 Å²	61.3	45%	0.448	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-44.3	169.8	-177.8	-178.9	177.4	-175.7	0	112	Q553 D554 N560 Q561	Q553-K557 WeakPolarHBondContact O-CB 3.34Å; Q553-K557 PolarHBondContact O-N 3.42Å; D554-K557 PolarHBondContact O-N 3.11Å; K557-N560 WeakPolarHBondContact O-CB 3.38Å; K557-N560 PolarHBondContact O-N 2.96Å; K557-Q561 PolarHBondContact O-N 3.3Å; K557-Q561 VanDerWaalsContact O-N 3.16Å
558	K	92.7	Very high	91	Very high	102 Å²	102	68.1 Å²	68.1	44%	0.443	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-40.2	173.8	-175.8	177.3	177.3	179.6	0	112.1	D554 F555 N560 Q561 V562 F607	D554-K558 WeakPolarHBondContact O-CB 3.33Å; D554-K558 PolarHBondContact O-N 3.26Å; F555-K558 PolarHBondContact O-N 3.19Å; K558-N560 VanDerWaalsContact C-N 3.3Å; K558-N560 PolarHBondContact O-N 2.73Å; K558-Q561 WeakPolarHBondContact O-CB 3.06Å; K558-Q561 PolarHBondContact O-N 2.93Å; K558-V562 PolarHBondContact O-N 3.06Å; K558-F607 HydrophobicContact CB-CD2 4.24Å; K558-F607 HydrophobicContact CB-CE2 3.94Å; K558-F607 HydrophobicContact CD-CD2 3.86Å; K558-F607 HydrophobicContact CD-CE2 3.98Å; K558-F607 HydrophobicContact CD-CG 4.17Å; K558-F607 HydrophobicContact CD-CZ 4.38Å; K558-F607 HydrophobicContact CG-CD2 4.18Å; K558-F607 HydrophobicContact CG-CE2 3.81Å; K558-F607 HydrophobicContact CG-CZ 4.21Å
559	F	93.8	Very high	91.3	Very high	6 Å²	6	65 Å²	65	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-37.5	176.4	-175.9	-131	0	0	0	111.4	F555 V556 Q561 V562 L563 L569 L573 L597 F607 V611 L614	F555-F559 WeakPolarHBondContact O-CB 3.32Å; F555-F559 PolarHBondContact O-N 3.21Å; V556-F559 PolarHBondContact O-N 3.48Å; F559-Q561 VanDerWaalsContact C-N 3.34Å; F559-Q561 PolarHBondContact O-N 3.48Å; F559-V562 PolarHBondContact O-N 3.39Å; F559-L563 HydrophobicContact CD1-CD1 3.97Å; F559-L563 HydrophobicContact CE1-CD1 3.79Å; F559-L563 HydrophobicContact CE1-CG 4.47Å; F559-L563 HydrophobicContact CE2-CD1 4.5Å; F559-L563 HydrophobicContact CE2-CG 4.34Å; F559-L563 HydrophobicContact CG-CD1 4.42Å; F559-L563 HydrophobicContact CZ-CD1 4.07Å; F559-L563 HydrophobicContact CZ-CD2 4.44Å; F559-L563 HydrophobicContact CZ-CG 4.28Å; F559-L563 WeakPolarHBondContact O-CG 3.35Å; F559-L563 PolarHBondContact O-N 3.47Å; F559-L569 HydrophobicContact CE2-CD2 3.83Å; F559-L569 HydrophobicContact CZ-CD2 4.21Å; F559-L573 HydrophobicContact CE1-CD2 3.95Å; F559-L573 HydrophobicContact CZ-CD2 3.94Å; F559-L597 HydrophobicContact CD2-CD1 4.18Å; F559-L597 HydrophobicContact CE2-CD1 3.86Å; F559-F607 HydrophobicContact CB-CE2 3.99Å; F559-F607 HydrophobicContact CB-CZ 4.41Å; F559-V611 HydrophobicContact CB-CG2 4.05Å; F559-V611 HydrophobicContact CD1-CG2 4.39Å; F559-V611 HydrophobicContact CD2-CG1 4.15Å; F559-V611 HydrophobicContact CD2-CG2 3.86Å; F559-V611 HydrophobicContact CE1-CG1 4.33Å; F559-V611 HydrophobicContact CE2-CG1 3.87Å; F559-V611 HydrophobicContact CE2-CG2 4.42Å; F559-V611 HydrophobicContact CG-CG2 3.85Å; F559-V611 HydrophobicContact CZ-CG1 3.96Å; F559-L614 HydrophobicContact CD1-CD2 4.23Å; F559-L614 HydrophobicContact CE1-CD2 4.1Å
560	N	93.4	Very high	91.8	Very high	23 Å²	23	64.4 Å²	64.4	12%	0.123	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-33.5	174.7	-171	73.3	0	0	0	113.9	H523 L539 V556 K557 K558 G564	H523-N560 PolarHBondContact CE1-O 3.27Å; H523-N560 PolarHBondContact NE2-OD1 3.39Å; L539-N560 HydrophobicContact CD1-CB 3.95Å; L539-N560 HydrophobicContact CD2-CB 3.59Å; L539-N560 HydrophobicContact CG-CB 4.43Å; V556-N560 WeakPolarHBondContact O-CB 3.48Å; V556-N560 PolarHBondContact O-N 3.17Å; K557-N560 WeakPolarHBondContact O-CB 3.38Å; K557-N560 PolarHBondContact O-N 2.96Å; K558-N560 VanDerWaalsContact C-N 3.3Å; K558-N560 PolarHBondContact O-N 2.73Å; N560-G564 PolarHBondContact O-N 3.15Å; N560-G564 VanDerWaalsContact O-N 3.12Å
561	Q	92.4	Very high	92.3	Very high	112 Å²	112	65.6 Å²	65.6	52%	0.523	33%	0.326	S	S	.	.	H	α-helix	trans	-64.1	-50.7	172	-68.2	170.5	-46.9	0	0	110	K557 K558 F559 L563 G564 D565	K557-Q561 PolarHBondContact O-N 3.3Å; K557-Q561 VanDerWaalsContact O-N 3.16Å; K558-Q561 WeakPolarHBondContact O-CB 3.06Å; K558-Q561 PolarHBondContact O-N 2.93Å; F559-Q561 VanDerWaalsContact C-N 3.34Å; F559-Q561 PolarHBondContact O-N 3.48Å; Q561-L563 VanDerWaalsContact C-N 3.27Å; Q561-L563 PolarHBondContact O-N 3.42Å; Q561-G564 WeakPolarHBondContact O-CA 3.44Å; Q561-G564 PolarHBondContact O-N 2.98Å; Q561-D565 PolarHBondContact O-N 3.18Å; Q561-D565 VanDerWaalsContact O-N 3.07Å
562	V	92.5	Very high	92.6	Very high	38 Å²	38	61.9 Å²	61.9	23%	0.23	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-34.5	177	179.4	0	0	0	0	112.7	K558 F559 G564 D565 D566 L569 L597	K558-V562 PolarHBondContact O-N 3.06Å; F559-V562 PolarHBondContact O-N 3.39Å; V562-G564 VanDerWaalsContact C-N 3.31Å; V562-D565 PolarHBondContact O-N 2.88Å; V562-D566 WeakPolarHBondContact O-CB 3.27Å; V562-D566 PolarHBondContact O-N 2.95Å; V562-L569 HydrophobicContact CG1-CD1 4.19Å; V562-L597 HydrophobicContact CG1-CD2 3.89Å
563	L	92.2	Very high	92.8	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-66.9	-30.1	172.1	-78.3	166.8	0	0	0	113.2	L520 F559 Q561 L569 R570 L573	L520-L563 HydrophobicContact CD2-CD1 4.39Å; L520-L563 HydrophobicContact CD2-CD2 4.22Å; F559-L563 HydrophobicContact CD1-CD1 3.97Å; F559-L563 HydrophobicContact CE1-CD1 3.79Å; F559-L563 HydrophobicContact CE1-CG 4.47Å; F559-L563 HydrophobicContact CE2-CD1 4.5Å; F559-L563 HydrophobicContact CE2-CG 4.34Å; F559-L563 HydrophobicContact CG-CD1 4.42Å; F559-L563 HydrophobicContact CZ-CD1 4.07Å; F559-L563 HydrophobicContact CZ-CD2 4.44Å; F559-L563 HydrophobicContact CZ-CG 4.28Å; F559-L563 WeakPolarHBondContact O-CG 3.35Å; F559-L563 PolarHBondContact O-N 3.47Å; Q561-L563 VanDerWaalsContact C-N 3.27Å; Q561-L563 PolarHBondContact O-N 3.42Å; L563-L569 HydrophobicContact CD2-CD2 3.53Å; L563-L569 HydrophobicContact CG-CD2 4.25Å; L563-R570 HydrophobicContact CD2-CB 4.35Å; L563-R570 HydrophobicContact CD2-CG 4.44Å; L563-R570 VanDerWaalsContact O-CZ 3.27Å; L563-R570 PolarHBondContact O-NE 3.41Å; L563-R570 PolarHBondContact O-NH2 3.15Å; L563-L573 HydrophobicContact CD1-CD2 3.91Å; L563-L573 HydrophobicContact CD2-CB 4.48Å; L563-L573 HydrophobicContact CD2-CD2 3.81Å
564	G	89.5	Confident	93	Very high	34 Å²	34	61.4 Å²	61.4	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-67.4	-42.4	171.9	0	0	0	0	0	112.1	H523 N560 Q561 V562 R570	H523-G564 PolarHBondContact CE1-N 2.93Å; N560-G564 PolarHBondContact O-N 3.15Å; N560-G564 VanDerWaalsContact O-N 3.12Å; Q561-G564 WeakPolarHBondContact O-CA 3.44Å; Q561-G564 PolarHBondContact O-N 2.98Å; V562-G564 VanDerWaalsContact C-N 3.31Å; G564-R570 PolarHBondContact O-NH2 3.42Å
565	D	90	Very high	93.1	Very high	143 Å²	143	59.6 Å²	59.6	77%	0.765	30%	0.298	S	S	*	.	H	α-helix	trans	-82	-36.1	-175.3	-55	-36.8	0	0	0	113.8	Q561 V562	Q561-D565 PolarHBondContact O-N 3.18Å; Q561-D565 VanDerWaalsContact O-N 3.07Å; V562-D565 PolarHBondContact O-N 2.88Å
566	D	92.1	Very high	93.2	Very high	44 Å²	44	57.3 Å²	57.3	24%	0.235	29%	0.288	C	S	.	.			trans	-110.8	88.6	-173.7	-170.9	-20.3	0	0	0	112.3	V562 K568 L569 R570 K596	V562-D566 WeakPolarHBondContact O-CB 3.27Å; V562-D566 PolarHBondContact O-N 2.95Å; D566-K568 VanDerWaalsContact C-N 3.26Å; D566-K568 PolarHBondContact O-N 3.04Å; D566-K568 WeakPolarHBondContact OD1-CB 3.13Å; D566-K568 PolarHBondContact OD1-N 2.92Å; D566-K568 VanDerWaalsContact OD1-N 3.12Å; D566-L569 HydrophobicContact CB-CB 3.87Å; D566-L569 WeakPolarHBondContact O-CB 3.26Å; D566-L569 PolarHBondContact O-N 3.19Å; D566-L569 PolarHBondContact OD1-N 3.35Å; D566-R570 PolarHBondContact O-N 3.03Å; D566-K596 IonicContact OD1-NZ 3.45Å; D566-K596 PolarHBondContact OD1-NZ 3.36Å; D566-K596 WeakPolarHBondContact OD2-CD 3.34Å; D566-K596 WeakPolarHBondContact OD2-CE 3.44Å; D566-K596 IonicContact OD2-NZ 2.67Å; D566-K596 PolarHBondContact OD2-NZ 2.78Å
567	E	91.4	Very high	93.2	Very high	142 Å²	142	57.2 Å²	57.2	66%	0.664	29%	0.287	S	S	*	.	H	α-helix	trans	-52.1	-40.7	175.2	-175.5	-176.1	-159.1	0	0	112.7	L569 R570 S571	E567-L569 VanDerWaalsContact C-N 3.31Å; E567-L569 PolarHBondContact O-N 3.41Å; E567-R570 CarbonylContact O-C 3.58Å; E567-R570 WeakPolarHBondContact O-CA 3.39Å; E567-R570 WeakPolarHBondContact O-CB 3.48Å; E567-R570 PolarHBondContact O-N 3.44Å; E567-R570 VanDerWaalsContact O-N 3.1Å; E567-S571 PolarHBondContact O-N 2.96Å; E567-S571 PolarHBondContact O-OG 3.41Å; E567-S571 VanDerWaalsContact O-OG 3.05Å
568	K	92.4	Very high	93.2	Very high	159 Å²	159	54 Å²	54	69%	0.691	28%	0.278	S	S	*	.	H	α-helix	trans	-67.5	-32.7	179.9	-69.3	177	-178.9	177.8	0	112	D566 Q572	D566-K568 VanDerWaalsContact C-N 3.26Å; D566-K568 PolarHBondContact O-N 3.04Å; D566-K568 WeakPolarHBondContact OD1-CB 3.13Å; D566-K568 PolarHBondContact OD1-N 2.92Å; D566-K568 VanDerWaalsContact OD1-N 3.12Å; K568-Q572 WeakPolarHBondContact O-CG 3.4Å; K568-Q572 PolarHBondContact O-N 3.31Å
569	L	92.9	Very high	92.9	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-70.8	-37.8	172.3	-164.8	154	0	0	0	110.4	F559 V562 L563 D566 E567 Q572 L573 I593 K596 L597	F559-L569 HydrophobicContact CE2-CD2 3.83Å; F559-L569 HydrophobicContact CZ-CD2 4.21Å; V562-L569 HydrophobicContact CG1-CD1 4.19Å; L563-L569 HydrophobicContact CD2-CD2 3.53Å; L563-L569 HydrophobicContact CG-CD2 4.25Å; D566-L569 HydrophobicContact CB-CB 3.87Å; D566-L569 WeakPolarHBondContact O-CB 3.26Å; D566-L569 PolarHBondContact O-N 3.19Å; D566-L569 PolarHBondContact OD1-N 3.35Å; E567-L569 VanDerWaalsContact C-N 3.31Å; E567-L569 PolarHBondContact O-N 3.41Å; L569-Q572 PolarHBondContact O-N 2.84Å; L569-L573 PolarHBondContact O-N 3.35Å; L569-I593 HydrophobicContact CD1-CG2 4.37Å; L569-I593 HydrophobicContact CD2-CG2 4.21Å; L569-I593 HydrophobicContact CG-CG1 4.39Å; L569-I593 HydrophobicContact CG-CG2 4.28Å; L569-K596 HydrophobicContact CB-CD 4.27Å; L569-K596 HydrophobicContact CD1-CB 4.21Å; L569-K596 HydrophobicContact CD1-CD 4.03Å; L569-K596 HydrophobicContact CG-CD 4.46Å; L569-L597 HydrophobicContact CD1-CD2 3.86Å; L569-L597 HydrophobicContact CD1-CG 4.08Å
570	R	94.1	Very high	92.7	Very high	45 Å²	45	56.5 Å²	56.5	17%	0.17	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-50.9	171.3	-156.2	-174.5	-57.7	171.8	10.6	111.3	L520 H523 L563 G564 D566 E567 Q572 L573 E574	L520-R570 HydrophobicContact CD2-CG 3.69Å; H523-R570 PolarHBondContact O-NH1 3.22Å; L563-R570 HydrophobicContact CD2-CB 4.35Å; L563-R570 HydrophobicContact CD2-CG 4.44Å; L563-R570 VanDerWaalsContact O-CZ 3.27Å; L563-R570 PolarHBondContact O-NE 3.41Å; L563-R570 PolarHBondContact O-NH2 3.15Å; G564-R570 PolarHBondContact O-NH2 3.42Å; D566-R570 PolarHBondContact O-N 3.03Å; E567-R570 CarbonylContact O-C 3.58Å; E567-R570 WeakPolarHBondContact O-CA 3.39Å; E567-R570 WeakPolarHBondContact O-CB 3.48Å; E567-R570 PolarHBondContact O-N 3.44Å; E567-R570 VanDerWaalsContact O-N 3.1Å; R570-Q572 PolarHBondContact O-N 3.37Å; R570-L573 PolarHBondContact O-N 3.13Å; R570-L573 VanDerWaalsContact O-N 3.08Å; R570-E574 WeakPolarHBondContact O-CG 3.19Å; R570-E574 PolarHBondContact O-N 3.11Å
571	S	94.6	Very high	92.7	Very high	66 Å²	66	55.7 Å²	55.7	46%	0.462	30%	0.3	S	S	.	.	H	α-helix	trans	-59.8	-40.2	177.7	-45.6	0	0	0	0	113.2	E567 L573 E574 L575	E567-S571 PolarHBondContact O-N 2.96Å; E567-S571 PolarHBondContact O-OG 3.41Å; E567-S571 VanDerWaalsContact O-OG 3.05Å; S571-L573 VanDerWaalsContact C-N 3.32Å; S571-L573 PolarHBondContact O-N 3.47Å; S571-E574 PolarHBondContact O-N 2.97Å; S571-L575 PolarHBondContact O-N 3.04Å
572	Q	95.4	Very high	92.7	Very high	42 Å²	42	51.4 Å²	51.4	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-35.1	175.5	-74.9	-69.2	8.8	0	0	112.2	K568 L569 R570 L576 C589 E592 I593	K568-Q572 WeakPolarHBondContact O-CG 3.4Å; K568-Q572 PolarHBondContact O-N 3.31Å; L569-Q572 PolarHBondContact O-N 2.84Å; R570-Q572 PolarHBondContact O-N 3.37Å; Q572-L576 WeakPolarHBondContact O-CB 3.28Å; Q572-L576 PolarHBondContact O-N 3.17Å; Q572-C589 PolarHBondContact OE1-SG 3.02Å; Q572-E592 HydrophobicContact CG-CB 4.35Å; Q572-E592 PolarHBondContact NE2-OE2 2.73Å; Q572-I593 HydrophobicContact CB-CD1 4.14Å; Q572-I593 HydrophobicContact CB-CG1 3.94Å
573	L	95.8	Very high	92.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-74.4	-36.5	176.1	-169.5	60.2	0	0	0	112.2	V516 L520 F559 L563 L569 R570 S571 L576 I577 I593 L615 I618	V516-L573 HydrophobicContact CG1-CD1 4.48Å; V516-L573 HydrophobicContact CG1-CD2 4Å; V516-L573 HydrophobicContact CG1-CG 4.21Å; L520-L573 HydrophobicContact CD1-CB 4.22Å; L520-L573 HydrophobicContact CD1-CD2 4.08Å; L520-L573 HydrophobicContact CD1-CG 3.91Å; L520-L573 HydrophobicContact CD2-CD2 4.3Å; F559-L573 HydrophobicContact CE1-CD2 3.95Å; F559-L573 HydrophobicContact CZ-CD2 3.94Å; L563-L573 HydrophobicContact CD1-CD2 3.91Å; L563-L573 HydrophobicContact CD2-CB 4.48Å; L563-L573 HydrophobicContact CD2-CD2 3.81Å; L569-L573 PolarHBondContact O-N 3.35Å; R570-L573 PolarHBondContact O-N 3.13Å; R570-L573 VanDerWaalsContact O-N 3.08Å; S571-L573 VanDerWaalsContact C-N 3.32Å; S571-L573 PolarHBondContact O-N 3.47Å; L573-L576 HydrophobicContact CD1-CD2 4.15Å; L573-L576 PolarHBondContact O-N 3.41Å; L573-I577 WeakPolarHBondContact O-CG1 3.44Å; L573-I577 PolarHBondContact O-N 3.43Å; L573-I577 VanDerWaalsContact O-N 3.16Å; L573-I593 HydrophobicContact CB-CD1 4.27Å; L573-I593 HydrophobicContact CD1-CD1 4.21Å; L573-L615 HydrophobicContact CD1-CD2 4.06Å; L573-I618 HydrophobicContact CD1-CD1 3.74Å
574	E	95.5	Very high	92.7	Very high	63 Å²	63	55.5 Å²	55.5	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-41.9	172.4	-72.4	-167.7	-138.4	0	0	112	L520 K524 R570 S571 I577 S578	L520-E574 HydrophobicContact CB-CG 4.25Å; L520-E574 HydrophobicContact CD1-CG 3.63Å; L520-E574 HydrophobicContact CG-CG 4.41Å; K524-E574 VanDerWaalsContact CE-CD 3.41Å; K524-E574 WeakPolarHBondContact CE-OE1 3.4Å; K524-E574 WeakPolarHBondContact CE-OE2 3.25Å; K524-E574 VanDerWaalsContact NZ-CD 3.35Å; K524-E574 IonicContact NZ-OE1 2.73Å; K524-E574 IonicContact NZ-OE2 2.73Å; K524-E574 PolarHBondContact NZ-OE2 3.16Å; R570-E574 WeakPolarHBondContact O-CG 3.19Å; R570-E574 PolarHBondContact O-N 3.11Å; S571-E574 PolarHBondContact O-N 2.97Å; E574-I577 PolarHBondContact O-N 3.04Å; E574-S578 PolarHBondContact O-N 3.25Å; E574-S578 VanDerWaalsContact O-N 3.13Å
575	L	95	Very high	93	Very high	71 Å²	71	57.7 Å²	57.7	37%	0.372	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-43.7	173.5	179.2	57.5	0	0	0	111.6	S571 I577 S578 C581	S571-L575 PolarHBondContact O-N 3.04Å; L575-I577 VanDerWaalsContact C-N 3.3Å; L575-I577 PolarHBondContact O-N 2.99Å; L575-S578 VanDerWaalsContact O-CB 3.24Å; L575-S578 WeakPolarHBondContact O-CB 3.38Å; L575-S578 PolarHBondContact O-N 3.29Å; L575-S578 VanDerWaalsContact O-N 3.13Å; L575-C581 VanDerWaalsContact O-CB 3.29Å; L575-C581 WeakPolarHBondContact O-CB 3.34Å; L575-C581 PolarHBondContact O-SG 2.93Å
576	L	95.3	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-36.4	179.7	-178.9	61.2	0	0	0	113.4	Q572 L573 A586 C589 V590 I593 L615 I618 A619	Q572-L576 WeakPolarHBondContact O-CB 3.28Å; Q572-L576 PolarHBondContact O-N 3.17Å; L573-L576 HydrophobicContact CD1-CD2 4.15Å; L573-L576 PolarHBondContact O-N 3.41Å; L576-A586 HydrophobicContact CD1-CB 3.57Å; L576-C589 HydrophobicContact CB-CB 4.03Å; L576-C589 HydrophobicContact CD1-CB 4.18Å; L576-V590 HydrophobicContact CD1-CG2 3.89Å; L576-V590 HydrophobicContact CD2-CG2 3.76Å; L576-I593 HydrophobicContact CD2-CD1 4.41Å; L576-L615 HydrophobicContact CD2-CD2 3.5Å; L576-I618 HydrophobicContact CD2-CD1 4.29Å; L576-I618 HydrophobicContact CD2-CG1 4.15Å; L576-A619 HydrophobicContact CD1-CB 3.85Å
577	I	93.8	Very high	93.3	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	6.6	178.6	73.5	-178.1	0	0	0	113.4	V516 R517 L520 L573 E574 L575 I618	V516-I577 HydrophobicContact CB-CD1 4.33Å; V516-I577 HydrophobicContact CG1-CD1 4.04Å; V516-I577 HydrophobicContact CG1-CG2 4.29Å; R517-I577 VanDerWaalsContact CA-CD1 3.47Å; R517-I577 HydrophobicContact CB-CD1 3.7Å; R517-I577 HydrophobicContact CG-CD1 4.15Å; R517-I577 PolarHBondContact NH2-O 2.92Å; L520-I577 HydrophobicContact CD1-CD1 3.67Å; L573-I577 WeakPolarHBondContact O-CG1 3.44Å; L573-I577 PolarHBondContact O-N 3.43Å; L573-I577 VanDerWaalsContact O-N 3.16Å; E574-I577 PolarHBondContact O-N 3.04Å; L575-I577 VanDerWaalsContact C-N 3.3Å; L575-I577 PolarHBondContact O-N 2.99Å; I577-I618 HydrophobicContact CG2-CB 4.32Å; I577-I618 HydrophobicContact CG2-CD1 3.94Å; I577-I618 HydrophobicContact CG2-CG1 4.32Å
578	S	92.1	Very high	93.4	Very high	35 Å²	35	50 Å²	50	25%	0.245	26%	0.263	C	S	.	.			trans	-62.5	136.1	176.5	179.6	0	0	0	0	110.3	E574 L575 T580 C581	E574-S578 PolarHBondContact O-N 3.25Å; E574-S578 VanDerWaalsContact O-N 3.13Å; L575-S578 VanDerWaalsContact O-CB 3.24Å; L575-S578 WeakPolarHBondContact O-CB 3.38Å; L575-S578 PolarHBondContact O-N 3.29Å; L575-S578 VanDerWaalsContact O-N 3.13Å; S578-T580 PolarHBondContact O-N 3.47Å; S578-T580 PolarHBondContact OG-N 2.99Å; S578-T580 PolarHBondContact OG-OG1 2.96Å; S578-T580 VanDerWaalsContact OG-OG1 3.04Å; S578-C581 WeakPolarHBondContact O-CB 3.35Å; S578-C581 PolarHBondContact O-N 3.23Å; S578-C581 VanDerWaalsContact O-N 3.07Å
579	P	87.5	Confident	93.6	Very high	64 Å²	64	42.6 Å²	42.6	42%	0.416	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-4.2	171.5	-20.8	33.2	0	0	0	114.8	T672	P579-T672 HydrophobicContact CB-CG2 3.86Å; P579-T672 WeakPolarHBondContact CB-OG1 3.29Å; P579-T672 PolarHBondContact O-OG1 2.68Å
580	T	88.7	Confident	93.6	Very high	98 Å²	98	44 Å²	44	60%	0.601	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116	9.4	177	68.5	0	0	0	0	113.4	S578 S582	S578-T580 PolarHBondContact O-N 3.47Å; S578-T580 PolarHBondContact OG-N 2.99Å; S578-T580 PolarHBondContact OG-OG1 2.96Å; S578-T580 VanDerWaalsContact OG-OG1 3.04Å; T580-S582 PolarHBondContact O-N 2.96Å
581	C	93.1	Very high	93.6	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.041	25%	0.254	C	S	.	.			trans	-72.1	125.3	179.3	-163.3	0	0	0	0	110.4	L575 S578 P620	L575-C581 VanDerWaalsContact O-CB 3.29Å; L575-C581 WeakPolarHBondContact O-CB 3.34Å; L575-C581 PolarHBondContact O-SG 2.93Å; S578-C581 WeakPolarHBondContact O-CB 3.35Å; S578-C581 PolarHBondContact O-N 3.23Å; S578-C581 VanDerWaalsContact O-N 3.07Å; C581-P620 HydrophobicContact CB-CG 4.1Å
582	S	92.7	Very high	93.5	Very high	22 Å²	22	47.3 Å²	47.3	15%	0.154	24%	0.244	C	C	.	.			trans	-81.4	158	172.6	71.5	0	0	0	0	112.1	T580 K584 Q585 A586 D624	T580-S582 PolarHBondContact O-N 2.96Å; S582-K584 PolarHBondContact O-N 2.67Å; S582-Q585 WeakPolarHBondContact O-CB 3.23Å; S582-Q585 PolarHBondContact O-N 3.07Å; S582-Q585 WeakPolarHBondContact OG-CG 3.41Å; S582-Q585 PolarHBondContact OG-N 3.3Å; S582-A586 PolarHBondContact O-N 3.14Å; S582-D624 WeakPolarHBondContact CA-OD2 3.16Å; S582-D624 WeakPolarHBondContact CB-OD2 3.47Å
583	C	93	Very high	93.4	Very high	19 Å²	19	45.3 Å²	45.3	13%	0.128	24%	0.235	C	C	.	.	H	α-helix	trans	-57.2	-35.3	177.1	-61.5	0	0	0	0	111.9	A586 D587 P620 V621 D624	C583-A586 PolarHBondContact O-N 3.35Å; C583-D587 PolarHBondContact O-N 3.25Å; C583-D587 VanDerWaalsContact O-N 3.14Å; C583-P620 WeakPolarHBondContact CA-O 3.2Å; C583-P620 PolarHBondContact SG-O 3.03Å; C583-V621 VanDerWaalsContact SG-C 3.59Å; C583-D624 PolarHBondContact N-OD2 3.12Å; C583-D624 PolarHBondContact SG-OD2 3.03Å
584	K	92.6	Very high	93.2	Very high	106 Å²	106	46.1 Å²	46.1	46%	0.461	24%	0.242	S	C	.	.	H	α-helix	trans	-64.7	-41.3	174.8	-63.2	161.5	-173.4	158.7	0	111.9	S582 I588 E626	S582-K584 PolarHBondContact O-N 2.67Å; K584-I588 WeakPolarHBondContact O-CG1 3.43Å; K584-I588 PolarHBondContact O-N 3.45Å; K584-E626 IonicContact NZ-OE1 3.41Å; K584-E626 PolarHBondContact NZ-OE1 2.73Å; K584-E626 IonicContact NZ-OE2 3.52Å; K584-E626 PolarHBondContact NZ-OE2 3.32Å
585	Q	94.7	Very high	92.9	Very high	80 Å²	80	50.4 Å²	50.4	37%	0.374	26%	0.255	S	S	.	.	H	α-helix	trans	-69.5	-43.6	174.8	-73	170.6	-21.5	0	0	111.6	S582 D587 I588 C589	S582-Q585 WeakPolarHBondContact O-CB 3.23Å; S582-Q585 PolarHBondContact O-N 3.07Å; S582-Q585 WeakPolarHBondContact OG-CG 3.41Å; S582-Q585 PolarHBondContact OG-N 3.3Å; Q585-D587 PolarHBondContact O-N 3.02Å; Q585-I588 WeakPolarHBondContact O-CA 3.28Å; Q585-I588 WeakPolarHBondContact O-CB 3.41Å; Q585-I588 PolarHBondContact O-N 3.02Å; Q585-C589 PolarHBondContact O-N 2.87Å; Q585-C589 PolarHBondContact O-SG 3.4Å
586	A	94.8	Very high	92.6	Very high	2 Å²	2	51 Å²	51	2%	0.017	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-45.2	-179.2	0	0	0	0	0	112.5	L576 S582 C583 I588 C589 V590 A619 P620	L576-A586 HydrophobicContact CD1-CB 3.57Å; S582-A586 PolarHBondContact O-N 3.14Å; C583-A586 PolarHBondContact O-N 3.35Å; A586-I588 VanDerWaalsContact C-N 3.29Å; A586-I588 PolarHBondContact O-N 3.43Å; A586-C589 PolarHBondContact O-N 3.03Å; A586-V590 WeakPolarHBondContact O-CB 3.26Å; A586-V590 VanDerWaalsContact O-CG2 3.31Å; A586-V590 WeakPolarHBondContact O-CG2 3.46Å; A586-V590 PolarHBondContact O-N 3.18Å; A586-A619 HydrophobicContact CB-CB 4.28Å; A586-P620 HydrophobicContact CB-CG 3.85Å
587	D	93.2	Very high	92.3	Very high	78 Å²	78	51.7 Å²	51.7	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-61.7	-33.8	175.2	179.1	32.3	0	0	0	112.5	C583 Q585 R591	C583-D587 PolarHBondContact O-N 3.25Å; C583-D587 VanDerWaalsContact O-N 3.14Å; Q585-D587 PolarHBondContact O-N 3.02Å; D587-R591 WeakPolarHBondContact O-CB 3.48Å; D587-R591 VanDerWaalsContact O-CG 3.32Å; D587-R591 WeakPolarHBondContact O-CG 3.37Å; D587-R591 PolarHBondContact O-N 3.41Å; D587-R591 PolarHBondContact O-NE 3.3Å; D587-R591 VanDerWaalsContact O-NE 3.12Å; D587-R591 IonicContact OD1-CZ 2.7Å; D587-R591 IonicContact OD1-NE 2.85Å; D587-R591 IonicContact OD1-NH1 2.76Å; D587-R591 PolarHBondContact OD1-NH1 2.92Å; D587-R591 IonicContact OD1-NH2 3.53Å; D587-R591 PolarHBondContact OD1-NH2 3.48Å; D587-R591 IonicContact OD2-CZ 2.76Å; D587-R591 IonicContact OD2-NH1 3.51Å; D587-R591 PolarHBondContact OD2-NH1 3.32Å; D587-R591 IonicContact OD2-NH2 2.68Å; D587-R591 PolarHBondContact OD2-NH2 3.48Å
588	I	94.8	Very high	91.9	Very high	89 Å²	89	53 Å²	53	46%	0.456	27%	0.269	S	S	.	.	H	α-helix	trans	-66.3	-54.5	169.6	-64	166.8	0	0	0	110.5	K584 Q585 A586 V590 R591 E592	K584-I588 WeakPolarHBondContact O-CG1 3.43Å; K584-I588 PolarHBondContact O-N 3.45Å; Q585-I588 WeakPolarHBondContact O-CA 3.28Å; Q585-I588 WeakPolarHBondContact O-CB 3.41Å; Q585-I588 PolarHBondContact O-N 3.02Å; A586-I588 VanDerWaalsContact C-N 3.29Å; A586-I588 PolarHBondContact O-N 3.43Å; I588-V590 PolarHBondContact O-N 3.2Å; I588-R591 PolarHBondContact O-N 2.62Å; I588-R591 VanDerWaalsContact O-N 3.15Å; I588-E592 HydrophobicContact CG2-CG 4.09Å; I588-E592 WeakPolarHBondContact O-CG 3.08Å; I588-E592 PolarHBondContact O-N 3.36Å
589	C	95.5	Very high	91	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-57.7	-43.9	-178.3	-62.1	0	0	0	0	112.6	Q572 L576 Q585 A586 R591 E592 I593	Q572-C589 PolarHBondContact OE1-SG 3.02Å; L576-C589 HydrophobicContact CB-CB 4.03Å; L576-C589 HydrophobicContact CD1-CB 4.18Å; Q585-C589 PolarHBondContact O-N 2.87Å; Q585-C589 PolarHBondContact O-SG 3.4Å; A586-C589 PolarHBondContact O-N 3.03Å; C589-R591 PolarHBondContact O-N 3.12Å; C589-E592 WeakPolarHBondContact O-CB 3.4Å; C589-E592 PolarHBondContact O-N 3.4Å; C589-I593 WeakPolarHBondContact O-CD1 3.15Å; C589-I593 VanDerWaalsContact O-CG1 3.27Å; C589-I593 WeakPolarHBondContact O-CG1 3.07Å; C589-I593 PolarHBondContact O-N 2.95Å
590	V	94.4	Very high	89.9	Confident	32 Å²	32	59 Å²	59	19%	0.194	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-42.9	177.4	171.6	0	0	0	0	111	L576 A586 I588 A594 L615 A619	L576-V590 HydrophobicContact CD1-CG2 3.89Å; L576-V590 HydrophobicContact CD2-CG2 3.76Å; A586-V590 WeakPolarHBondContact O-CB 3.26Å; A586-V590 VanDerWaalsContact O-CG2 3.31Å; A586-V590 WeakPolarHBondContact O-CG2 3.46Å; A586-V590 PolarHBondContact O-N 3.18Å; I588-V590 PolarHBondContact O-N 3.2Å; V590-A594 WeakPolarHBondContact O-CB 3.48Å; V590-A594 PolarHBondContact O-N 2.69Å; V590-L615 HydrophobicContact CG1-CB 4.21Å; V590-L615 HydrophobicContact CG1-CD1 4.32Å; V590-L615 HydrophobicContact CG2-CB 4.19Å; V590-A619 HydrophobicContact CG2-CB 4.12Å
591	R	92.7	Very high	88.8	Confident	123 Å²	123	63.4 Å²	63.4	46%	0.464	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-40.1	174.4	-76.1	-175.9	-66.9	-123.2	-2.9	112.6	D587 I588 C589 R595	D587-R591 WeakPolarHBondContact O-CB 3.48Å; D587-R591 VanDerWaalsContact O-CG 3.32Å; D587-R591 WeakPolarHBondContact O-CG 3.37Å; D587-R591 PolarHBondContact O-N 3.41Å; D587-R591 PolarHBondContact O-NE 3.3Å; D587-R591 VanDerWaalsContact O-NE 3.12Å; D587-R591 IonicContact OD1-CZ 2.7Å; D587-R591 IonicContact OD1-NE 2.85Å; D587-R591 IonicContact OD1-NH1 2.76Å; D587-R591 PolarHBondContact OD1-NH1 2.92Å; D587-R591 IonicContact OD1-NH2 3.53Å; D587-R591 PolarHBondContact OD1-NH2 3.48Å; D587-R591 IonicContact OD2-CZ 2.76Å; D587-R591 IonicContact OD2-NH1 3.51Å; D587-R591 PolarHBondContact OD2-NH1 3.32Å; D587-R591 IonicContact OD2-NH2 2.68Å; D587-R591 PolarHBondContact OD2-NH2 3.48Å; I588-R591 PolarHBondContact O-N 2.62Å; I588-R591 VanDerWaalsContact O-N 3.15Å; C589-R591 PolarHBondContact O-N 3.12Å; R591-R595 WeakPolarHBondContact O-CB 3.48Å; R591-R595 PolarHBondContact O-N 3.35Å
592	E	92.1	Very high	87.6	Confident	57 Å²	57	69.1 Å²	69.1	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-60.2	-52.6	176.9	-66.8	-93.5	106.6	0	0	111.5	Q572 I588 C589 R595 K596	Q572-E592 HydrophobicContact CG-CB 4.35Å; Q572-E592 PolarHBondContact NE2-OE2 2.73Å; I588-E592 HydrophobicContact CG2-CG 4.09Å; I588-E592 WeakPolarHBondContact O-CG 3.08Å; I588-E592 PolarHBondContact O-N 3.36Å; C589-E592 WeakPolarHBondContact O-CB 3.4Å; C589-E592 PolarHBondContact O-N 3.4Å; E592-R595 PolarHBondContact O-N 3.03Å; E592-R595 IonicContact OE1-CZ 3.01Å; E592-R595 VanDerWaalsContact OE1-CZ 3.27Å; E592-R595 IonicContact OE1-NH1 4Å; E592-R595 PolarHBondContact OE1-NH1 2.81Å; E592-R595 IonicContact OE1-NH2 3.06Å; E592-R595 PolarHBondContact OE1-NH2 3.18Å; E592-K596 PolarHBondContact O-N 3.39Å; E592-K596 VanDerWaalsContact O-N 3.1Å
593	I	93.4	Very high	86.4	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-63.3	-48	-179.3	-63.6	163.9	0	0	0	110	L569 Q572 L573 L576 C589 R595 K596 L597 L615	L569-I593 HydrophobicContact CD1-CG2 4.37Å; L569-I593 HydrophobicContact CD2-CG2 4.21Å; L569-I593 HydrophobicContact CG-CG1 4.39Å; L569-I593 HydrophobicContact CG-CG2 4.28Å; Q572-I593 HydrophobicContact CB-CD1 4.14Å; Q572-I593 HydrophobicContact CB-CG1 3.94Å; L573-I593 HydrophobicContact CB-CD1 4.27Å; L573-I593 HydrophobicContact CD1-CD1 4.21Å; L576-I593 HydrophobicContact CD2-CD1 4.41Å; C589-I593 WeakPolarHBondContact O-CD1 3.15Å; C589-I593 VanDerWaalsContact O-CG1 3.27Å; C589-I593 WeakPolarHBondContact O-CG1 3.07Å; C589-I593 PolarHBondContact O-N 2.95Å; I593-R595 VanDerWaalsContact C-N 3.31Å; I593-R595 PolarHBondContact O-N 2.7Å; I593-K596 PolarHBondContact O-N 3.17Å; I593-L597 HydrophobicContact CG2-CD1 3.74Å; I593-L597 HydrophobicContact CG2-CG 4.4Å; I593-L597 WeakPolarHBondContact O-CG 3.44Å; I593-L597 PolarHBondContact O-N 3.16Å; I593-L615 HydrophobicContact CB-CD1 4.24Å; I593-L615 HydrophobicContact CD1-CD2 3.93Å; I593-L615 HydrophobicContact CG2-CD1 3.9Å; I593-L615 HydrophobicContact CG2-CD2 4.4Å
594	A	91.7	Very high	85.4	Confident	17 Å²	17	78.7 Å²	78.7	14%	0.14	40%	0.397	C	S	.	.	H	α-helix	trans	-62.7	-36	178.3	0	0	0	0	0	112.6	V590 A598 L608	V590-A594 WeakPolarHBondContact O-CB 3.48Å; V590-A594 PolarHBondContact O-N 2.69Å; A594-A598 WeakPolarHBondContact O-CB 3.49Å; A594-A598 PolarHBondContact O-N 3.18Å; A594-A598 VanDerWaalsContact O-N 3.11Å; A594-L608 HydrophobicContact CB-CD1 4.43Å
595	R	89.7	Confident	85.1	Confident	153 Å²	153	75 Å²	75	58%	0.577	38%	0.382	S	S	*	.	H	α-helix	trans	-65.8	-41.5	177.1	-167.4	-165	-44.9	124.1	2.2	112	R591 E592 I593	R591-R595 WeakPolarHBondContact O-CB 3.48Å; R591-R595 PolarHBondContact O-N 3.35Å; E592-R595 PolarHBondContact O-N 3.03Å; E592-R595 IonicContact OE1-CZ 3.01Å; E592-R595 VanDerWaalsContact OE1-CZ 3.27Å; E592-R595 IonicContact OE1-NH1 4Å; E592-R595 PolarHBondContact OE1-NH1 2.81Å; E592-R595 IonicContact OE1-NH2 3.06Å; E592-R595 PolarHBondContact OE1-NH2 3.18Å; I593-R595 VanDerWaalsContact C-N 3.31Å; I593-R595 PolarHBondContact O-N 2.7Å
596	K	88.4	Confident	84.8	Confident	83 Å²	83	74.4 Å²	74.4	36%	0.361	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-51.4	174.4	-80.3	-172.3	165.8	-166.3	0	112	D566 L569 E592 I593 A598 N599	D566-K596 IonicContact OD1-NZ 3.45Å; D566-K596 PolarHBondContact OD1-NZ 3.36Å; D566-K596 WeakPolarHBondContact OD2-CD 3.34Å; D566-K596 WeakPolarHBondContact OD2-CE 3.44Å; D566-K596 IonicContact OD2-NZ 2.67Å; D566-K596 PolarHBondContact OD2-NZ 2.78Å; L569-K596 HydrophobicContact CB-CD 4.27Å; L569-K596 HydrophobicContact CD1-CB 4.21Å; L569-K596 HydrophobicContact CD1-CD 4.03Å; L569-K596 HydrophobicContact CG-CD 4.46Å; E592-K596 PolarHBondContact O-N 3.39Å; E592-K596 VanDerWaalsContact O-N 3.1Å; I593-K596 PolarHBondContact O-N 3.17Å; K596-A598 PolarHBondContact O-N 2.84Å; K596-N599 PolarHBondContact O-N 2.79Å
597	L	88.6	Confident	84.6	Confident	15 Å²	15	75 Å²	75	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-71.8	-12.1	-175.4	-62.5	174.9	0	0	0	114.2	F559 V562 L569 I593 N599 F607 L608 V611	F559-L597 HydrophobicContact CD2-CD1 4.18Å; F559-L597 HydrophobicContact CE2-CD1 3.86Å; V562-L597 HydrophobicContact CG1-CD2 3.89Å; L569-L597 HydrophobicContact CD1-CD2 3.86Å; L569-L597 HydrophobicContact CD1-CG 4.08Å; I593-L597 HydrophobicContact CG2-CD1 3.74Å; I593-L597 HydrophobicContact CG2-CG 4.4Å; I593-L597 WeakPolarHBondContact O-CG 3.44Å; I593-L597 PolarHBondContact O-N 3.16Å; L597-N599 VanDerWaalsContact C-N 3.27Å; L597-N599 PolarHBondContact O-N 2.95Å; L597-F607 HydrophobicContact CD2-CE1 4.08Å; L597-F607 HydrophobicContact CD2-CZ 4.23Å; L597-L608 HydrophobicContact CB-CD1 3.76Å; L597-V611 HydrophobicContact CD1-CB 4.16Å; L597-V611 HydrophobicContact CD1-CG1 3.6Å; L597-V611 HydrophobicContact CD1-CG2 4.33Å
598	A	85.5	Confident	84.5	Confident	30 Å²	30	72.2 Å²	72.2	25%	0.248	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	6.6	176.6	0	0	0	0	0	114.4	A594 K596 P600 K601 L608	A594-A598 WeakPolarHBondContact O-CB 3.49Å; A594-A598 PolarHBondContact O-N 3.18Å; A594-A598 VanDerWaalsContact O-N 3.11Å; K596-A598 PolarHBondContact O-N 2.84Å; A598-P600 CarbonylContact O-C 3.58Å; A598-P600 VanDerWaalsContact O-C 3.24Å; A598-K601 WeakPolarHBondContact O-CA 3.33Å; A598-K601 PolarHBondContact O-N 3.31Å; A598-L608 HydrophobicContact CB-CD2 3.76Å
599	N	74.3	Confident	84.3	Confident	129 Å²	129	73 Å²	73	69%	0.69	37%	0.374	S	S	*	.			trans	-110.5	126.9	-178.9	-143.8	21.7	0	0	0	110.7	K596 L597	K596-N599 PolarHBondContact O-N 2.79Å; L597-N599 VanDerWaalsContact C-N 3.27Å; L597-N599 PolarHBondContact O-N 2.95Å
600	P	64.2	Low	84.1	Confident	96 Å²	96	73.7 Å²	73.7	62%	0.623	38%	0.378	S	S	*	.	S	Bend	cis	-69.6	147	-1.7	30.6	-35.9	0	0	0	113	A598 Q602	A598-P600 CarbonylContact O-C 3.58Å; A598-P600 VanDerWaalsContact O-C 3.24Å; P600-Q602 PolarHBondContact O-N 3.47Å
601	K	65.4	Low	84	Confident	191 Å²	191	72.4 Å²	72.4	83%	0.83	37%	0.37	S	S	*	.			trans	-68.3	94.8	-179.7	-69.3	-178.7	179	177.6	0	111.7	A598	A598-K601 WeakPolarHBondContact O-CA 3.33Å; A598-K601 PolarHBondContact O-N 3.31Å
602	Q	67.3	Low	84	Confident	127 Å²	127	70.7 Å²	70.7	59%	0.593	37%	0.366	S	S	*	.			trans	-94.7	145.2	167.1	-67.8	-175.7	-20.1	0	0	110.7	P600 T604	P600-Q602 PolarHBondContact O-N 3.47Å; Q602-T604 VanDerWaalsContact C-N 3.29Å; Q602-T604 PolarHBondContact O-N 3.29Å
603	P	67.3	Low	84	Confident	137 Å²	137	71.7 Å²	71.7	89%	0.89	37%	0.37	S	S	*	.	S	Bend	trans	-61	-36	-178.5	-23.8	34.2	0	0	0	113.6
604	T	72.7	Confident	84.1	Confident	104 Å²	104	72 Å²	72	64%	0.638	37%	0.371	S	S	*	.			trans	-129.2	114.8	176.2	46	0	0	0	0	108.4	Q602	Q602-T604 VanDerWaalsContact C-N 3.29Å; Q602-T604 PolarHBondContact O-N 3.29Å
605	N	85.8	Confident	84.2	Confident	28 Å²	28	71.2 Å²	71.2	15%	0.15	37%	0.365	C	S	.	.			trans	-125.4	90.5	179.7	179.1	-13.1	0	0	0	108.8	F607 L608 E609	N605-F607 PolarHBondContact O-N 2.68Å; N605-F607 VanDerWaalsContact O-N 3.16Å; N605-F607 WeakPolarHBondContact OD1-CB 3.14Å; N605-F607 PolarHBondContact OD1-N 2.88Å; N605-L608 HydrophobicContact CB-CB 3.99Å; N605-L608 WeakPolarHBondContact O-CB 3.38Å; N605-L608 PolarHBondContact O-N 2.82Å; N605-L608 PolarHBondContact OD1-N 3.08Å; N605-L608 VanDerWaalsContact OD1-N 3.13Å; N605-E609 PolarHBondContact O-N 3.49Å
606	P	88.7	Confident	84.3	Confident	69 Å²	69	68.2 Å²	68.2	45%	0.448	36%	0.357	S	S	.	.	H	α-helix	trans	-60.6	-27	-174.4	-26.8	36.1	0	0	0	114.2	F555 E609 M610	F555-P606 HydrophobicContact CE2-CB 4.06Å; F555-P606 HydrophobicContact CZ-CB 3.81Å; P606-E609 PolarHBondContact O-N 3.15Å; P606-M610 WeakPolarHBondContact O-CB 3.39Å; P606-M610 PolarHBondContact O-N 3.21Å
607	F	90.4	Very high	84.6	Confident	13 Å²	13	64.6 Å²	64.6	6%	0.057	34%	0.341	C	S	.	.	H	α-helix	trans	-66.5	-45.6	173.1	162.9	-106	0	0	0	111.3	F555 K558 F559 L597 N605 E609 M610 V611	F555-F607 HydrophobicContact CB-CD2 4.11Å; F555-F607 HydrophobicContact CD1-CB 3.7Å; F555-F607 HydrophobicContact CD1-CD2 4.03Å; F555-F607 HydrophobicContact CD1-CG 4.36Å; F555-F607 HydrophobicContact CE1-CB 3.92Å; F555-F607 HydrophobicContact CG-CB 4.37Å; F555-F607 HydrophobicContact CG-CD2 4.38Å; F555-F607 WeakPolarHBondContact O-CE2 3.35Å; K558-F607 HydrophobicContact CB-CD2 4.24Å; K558-F607 HydrophobicContact CB-CE2 3.94Å; K558-F607 HydrophobicContact CD-CD2 3.86Å; K558-F607 HydrophobicContact CD-CE2 3.98Å; K558-F607 HydrophobicContact CD-CG 4.17Å; K558-F607 HydrophobicContact CD-CZ 4.38Å; K558-F607 HydrophobicContact CG-CD2 4.18Å; K558-F607 HydrophobicContact CG-CE2 3.81Å; K558-F607 HydrophobicContact CG-CZ 4.21Å; F559-F607 HydrophobicContact CB-CE2 3.99Å; F559-F607 HydrophobicContact CB-CZ 4.41Å; L597-F607 HydrophobicContact CD2-CE1 4.08Å; L597-F607 HydrophobicContact CD2-CZ 4.23Å; N605-F607 PolarHBondContact O-N 2.68Å; N605-F607 VanDerWaalsContact O-N 3.16Å; N605-F607 WeakPolarHBondContact OD1-CB 3.14Å; N605-F607 PolarHBondContact OD1-N 2.88Å; F607-E609 VanDerWaalsContact C-N 3.33Å; F607-E609 PolarHBondContact O-N 3.32Å; F607-M610 PolarHBondContact O-N 2.86Å; F607-V611 HydrophobicContact CD2-CG2 4.34Å; F607-V611 HydrophobicContact CE2-CG2 3.95Å; F607-V611 HydrophobicContact CZ-CG2 4.21Å; F607-V611 WeakPolarHBondContact O-CG2 3.5Å; F607-V611 PolarHBondContact O-N 2.72Å
608	L	91.2	Very high	84.9	Confident	20 Å²	20	63.9 Å²	63.9	11%	0.105	34%	0.337	C	S	.	.	H	α-helix	trans	-63.9	-38	174.8	178.3	66.5	0	0	0	111.7	A594 L597 A598 N605 V611 K612	A594-L608 HydrophobicContact CB-CD1 4.43Å; L597-L608 HydrophobicContact CB-CD1 3.76Å; A598-L608 HydrophobicContact CB-CD2 3.76Å; N605-L608 HydrophobicContact CB-CB 3.99Å; N605-L608 WeakPolarHBondContact O-CB 3.38Å; N605-L608 PolarHBondContact O-N 2.82Å; N605-L608 PolarHBondContact OD1-N 3.08Å; N605-L608 VanDerWaalsContact OD1-N 3.13Å; L608-V611 PolarHBondContact O-N 3.26Å; L608-K612 HydrophobicContact CG-CD 4.44Å; L608-K612 WeakPolarHBondContact O-CB 3.36Å; L608-K612 VanDerWaalsContact O-CG 3.32Å; L608-K612 WeakPolarHBondContact O-CG 3.44Å; L608-K612 PolarHBondContact O-N 3.45Å
609	E	90.3	Very high	85.3	Confident	105 Å²	105	62.8 Å²	62.8	49%	0.491	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-43.6	175.1	-66.1	-173.2	137.4	0	0	111.8	N605 P606 F607 V611 K612 F613	N605-E609 PolarHBondContact O-N 3.49Å; P606-E609 PolarHBondContact O-N 3.15Å; F607-E609 VanDerWaalsContact C-N 3.33Å; F607-E609 PolarHBondContact O-N 3.32Å; E609-V611 PolarHBondContact O-N 3.16Å; E609-K612 WeakPolarHBondContact O-CB 3.48Å; E609-K612 PolarHBondContact O-N 3.41Å; E609-F613 WeakPolarHBondContact O-CD2 3.31Å; E609-F613 PolarHBondContact O-N 2.88Å
610	M	92	Very high	86.1	Confident	17 Å²	17	57.2 Å²	57.2	8%	0.084	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-41.8	175.9	-168	59	67.2	0	0	112.4	L546 P547 A552 F555 P606 F607 F613 L614	L546-M610 HydrophobicContact CB-SD 3.82Å; L546-M610 HydrophobicContact CD1-CG 4.3Å; L546-M610 HydrophobicContact CD1-SD 4.01Å; L546-M610 HydrophobicContact CG-SD 4.43Å; P547-M610 VanDerWaalsContact O-CE 3.22Å; P547-M610 WeakPolarHBondContact O-CE 3.42Å; A552-M610 HydrophobicContact CB-CE 4.01Å; A552-M610 HydrophobicContact CB-CG 4.38Å; A552-M610 HydrophobicContact CB-SD 3.79Å; F555-M610 HydrophobicContact CB-CB 3.96Å; F555-M610 HydrophobicContact CB-CG 3.83Å; F555-M610 HydrophobicContact CD2-CB 3.76Å; F555-M610 HydrophobicContact CD2-CE 4.18Å; F555-M610 HydrophobicContact CD2-CG 3.97Å; F555-M610 HydrophobicContact CG-CB 4.17Å; F555-M610 HydrophobicContact CG-CG 4.37Å; P606-M610 WeakPolarHBondContact O-CB 3.39Å; P606-M610 PolarHBondContact O-N 3.21Å; F607-M610 PolarHBondContact O-N 2.86Å; M610-F613 PolarHBondContact O-N 2.93Å; M610-L614 PolarHBondContact O-N 3.02Å
611	V	93	Very high	87.4	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.03	28%	0.283	C	S	.	.	H	α-helix	trans	-68.3	-36.2	175.2	178.1	0	0	0	0	111.3	F559 L597 F607 L608 E609 F613 L614 L615	F559-V611 HydrophobicContact CB-CG2 4.05Å; F559-V611 HydrophobicContact CD1-CG2 4.39Å; F559-V611 HydrophobicContact CD2-CG1 4.15Å; F559-V611 HydrophobicContact CD2-CG2 3.86Å; F559-V611 HydrophobicContact CE1-CG1 4.33Å; F559-V611 HydrophobicContact CE2-CG1 3.87Å; F559-V611 HydrophobicContact CE2-CG2 4.42Å; F559-V611 HydrophobicContact CG-CG2 3.85Å; F559-V611 HydrophobicContact CZ-CG1 3.96Å; L597-V611 HydrophobicContact CD1-CB 4.16Å; L597-V611 HydrophobicContact CD1-CG1 3.6Å; L597-V611 HydrophobicContact CD1-CG2 4.33Å; F607-V611 HydrophobicContact CD2-CG2 4.34Å; F607-V611 HydrophobicContact CE2-CG2 3.95Å; F607-V611 HydrophobicContact CZ-CG2 4.21Å; F607-V611 WeakPolarHBondContact O-CG2 3.5Å; F607-V611 PolarHBondContact O-N 2.72Å; L608-V611 PolarHBondContact O-N 3.26Å; E609-V611 PolarHBondContact O-N 3.16Å; V611-F613 PolarHBondContact O-N 2.82Å; V611-L614 WeakPolarHBondContact O-CB 3.49Å; V611-L614 PolarHBondContact O-N 2.79Å; V611-L614 VanDerWaalsContact O-N 3.17Å; V611-L615 HydrophobicContact CG1-CD1 3.94Å; V611-L615 HydrophobicContact CG1-CG 4.14Å; V611-L615 VanDerWaalsContact O-CG 3.29Å; V611-L615 WeakPolarHBondContact O-CG 3.36Å; V611-L615 PolarHBondContact O-N 2.95Å
612	K	92	Very high	88.8	Confident	87 Å²	87	45.9 Å²	45.9	38%	0.378	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-43	171.8	-78.4	174.3	178	-179.7	0	112.2	L608 E609 L614 L615 E616	L608-K612 HydrophobicContact CG-CD 4.44Å; L608-K612 WeakPolarHBondContact O-CB 3.36Å; L608-K612 VanDerWaalsContact O-CG 3.32Å; L608-K612 WeakPolarHBondContact O-CG 3.44Å; L608-K612 PolarHBondContact O-N 3.45Å; E609-K612 WeakPolarHBondContact O-CB 3.48Å; E609-K612 PolarHBondContact O-N 3.41Å; K612-L614 VanDerWaalsContact C-N 3.29Å; K612-L614 PolarHBondContact O-N 2.91Å; K612-L615 PolarHBondContact O-N 3.33Å; K612-E616 WeakPolarHBondContact O-CB 3.35Å; K612-E616 WeakPolarHBondContact O-CG 3.3Å; K612-E616 PolarHBondContact O-N 3.39Å
613	F	92	Very high	90	Very high	79 Å²	79	40 Å²	40	35%	0.346	22%	0.217	S	C	.	.	H	α-helix	trans	-59.7	-38.8	173.8	-78.1	-66.9	0	0	0	112.4	L546 P547 E609 M610 V611 R617	L546-F613 HydrophobicContact CD2-CB 4.26Å; P547-F613 HydrophobicContact CG-CD1 4.13Å; P547-F613 HydrophobicContact CG-CD2 3.92Å; P547-F613 HydrophobicContact CG-CE1 4.29Å; P547-F613 HydrophobicContact CG-CE2 4.09Å; P547-F613 HydrophobicContact CG-CG 3.95Å; P547-F613 HydrophobicContact CG-CZ 4.26Å; E609-F613 WeakPolarHBondContact O-CD2 3.31Å; E609-F613 PolarHBondContact O-N 2.88Å; M610-F613 PolarHBondContact O-N 2.93Å; V611-F613 PolarHBondContact O-N 2.82Å; F613-R617 WeakPolarHBondContact O-CG 3.27Å
614	L	94.9	Very high	91.2	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-65.5	-46.9	174.1	179.8	58.4	0	0	0	111.7	L512 V516 I542 L546 F559 M610 V611 K612 R617 I618	L512-L614 HydrophobicContact CD1-CD1 4.29Å; L512-L614 HydrophobicContact CD2-CD1 4.05Å; L512-L614 HydrophobicContact CG-CD1 4.28Å; V516-L614 HydrophobicContact CG2-CD1 4.24Å; I542-L614 HydrophobicContact CG2-CD1 3.85Å; I542-L614 HydrophobicContact CG2-CD2 4.09Å; L546-L614 HydrophobicContact CD1-CB 4.37Å; L546-L614 HydrophobicContact CD2-CB 4.01Å; L546-L614 HydrophobicContact CD2-CD1 4.37Å; F559-L614 HydrophobicContact CD1-CD2 4.23Å; F559-L614 HydrophobicContact CE1-CD2 4.1Å; M610-L614 PolarHBondContact O-N 3.02Å; V611-L614 WeakPolarHBondContact O-CB 3.49Å; V611-L614 PolarHBondContact O-N 2.79Å; V611-L614 VanDerWaalsContact O-N 3.17Å; K612-L614 VanDerWaalsContact C-N 3.29Å; K612-L614 PolarHBondContact O-N 2.91Å; L614-R617 PolarHBondContact O-N 2.93Å; L614-I618 HydrophobicContact CD1-CG2 4.18Å; L614-I618 HydrophobicContact CG-CD1 4.4Å; L614-I618 WeakPolarHBondContact O-CG1 3.18Å; L614-I618 PolarHBondContact O-N 2.87Å
615	L	94.9	Very high	92	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-45.3	180	-69.6	171.7	0	0	0	112.5	L573 L576 V590 I593 V611 K612 R617 I618 A619	L573-L615 HydrophobicContact CD1-CD2 4.06Å; L576-L615 HydrophobicContact CD2-CD2 3.5Å; V590-L615 HydrophobicContact CG1-CB 4.21Å; V590-L615 HydrophobicContact CG1-CD1 4.32Å; V590-L615 HydrophobicContact CG2-CB 4.19Å; I593-L615 HydrophobicContact CB-CD1 4.24Å; I593-L615 HydrophobicContact CD1-CD2 3.93Å; I593-L615 HydrophobicContact CG2-CD1 3.9Å; I593-L615 HydrophobicContact CG2-CD2 4.4Å; V611-L615 HydrophobicContact CG1-CD1 3.94Å; V611-L615 HydrophobicContact CG1-CG 4.14Å; V611-L615 VanDerWaalsContact O-CG 3.29Å; V611-L615 WeakPolarHBondContact O-CG 3.36Å; V611-L615 PolarHBondContact O-N 2.95Å; K612-L615 PolarHBondContact O-N 3.33Å; L615-R617 PolarHBondContact O-N 3.18Å; L615-R617 VanDerWaalsContact O-N 3.15Å; L615-I618 HydrophobicContact CD2-CD1 4.42Å; L615-I618 PolarHBondContact O-N 3.13Å; L615-A619 WeakPolarHBondContact O-CB 3.41Å; L615-A619 PolarHBondContact O-N 3.06Å; L615-A619 VanDerWaalsContact O-N 3.1Å
616	E	91.6	Very high	92.4	Very high	89 Å²	89	34 Å²	34	42%	0.416	18%	0.175	S	C	.	.	H	α-helix	trans	-60.4	-22	178.6	-76.2	-174.1	-158.4	0	0	113.3	K467 K612	K467-E616 IonicContact NZ-OE1 3.03Å; K467-E616 PolarHBondContact NZ-OE1 2.8Å; K467-E616 IonicContact NZ-OE2 2.73Å; K467-E616 PolarHBondContact NZ-OE2 2.86Å; K612-E616 WeakPolarHBondContact O-CB 3.35Å; K612-E616 WeakPolarHBondContact O-CG 3.3Å; K612-E616 PolarHBondContact O-N 3.39Å
617	R	94	Very high	92.6	Very high	7 Å²	7	30.7 Å²	30.7	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-94.1	-27.5	177.4	-63.4	-168.1	90.5	-166.4	-5.1	115.5	Y454 L463 E466 Q509 L512 N545 F613 L614 L615	Y454-R617 PolarHBondContact OH-NH2 3.11Å; L463-R617 HydrophobicContact CD2-CG 3.91Å; E466-R617 IonicContact OE1-CZ 3.48Å; E466-R617 IonicContact OE1-NE 3.1Å; E466-R617 IonicContact OE1-NH2 3.22Å; E466-R617 PolarHBondContact OE1-NH2 3.45Å; E466-R617 IonicContact OE2-CZ 2.74Å; E466-R617 IonicContact OE2-NE 2.78Å; E466-R617 PolarHBondContact OE2-NE 3.08Å; E466-R617 IonicContact OE2-NH2 3.24Å; E466-R617 PolarHBondContact OE2-NH2 3.19Å; Q509-R617 WeakPolarHBondContact CG-O 3.39Å; L512-R617 HydrophobicContact CD2-CB 3.83Å; N545-R617 PolarHBondContact O-NH1 3.42Å; F613-R617 WeakPolarHBondContact O-CG 3.27Å; L614-R617 PolarHBondContact O-N 2.93Å; L615-R617 PolarHBondContact O-N 3.18Å; L615-R617 VanDerWaalsContact O-N 3.15Å
618	I	94.7	Very high	92.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-95.7	-21.4	-175.7	66.3	-177.3	0	0	0	112.8	L512 R513 V516 L573 L576 I577 L614 L615	L512-I618 HydrophobicContact CB-CG2 4.39Å; L512-I618 HydrophobicContact CD2-CG2 3.93Å; L512-I618 HydrophobicContact CG-CG2 3.78Å; R513-I618 VanDerWaalsContact CD-O 3.29Å; R513-I618 WeakPolarHBondContact CD-O 3.4Å; R513-I618 HydrophobicContact CG-CB 4Å; R513-I618 HydrophobicContact CG-CG2 4.32Å; R513-I618 WeakPolarHBondContact CG-O 3.47Å; V516-I618 HydrophobicContact CG1-CD1 4.37Å; V516-I618 HydrophobicContact CG2-CD1 4.35Å; V516-I618 HydrophobicContact CG2-CG2 4.18Å; L573-I618 HydrophobicContact CD1-CD1 3.74Å; L576-I618 HydrophobicContact CD2-CD1 4.29Å; L576-I618 HydrophobicContact CD2-CG1 4.15Å; I577-I618 HydrophobicContact CG2-CB 4.32Å; I577-I618 HydrophobicContact CG2-CD1 3.94Å; I577-I618 HydrophobicContact CG2-CG1 4.32Å; L614-I618 HydrophobicContact CD1-CG2 4.18Å; L614-I618 HydrophobicContact CG-CD1 4.4Å; L614-I618 WeakPolarHBondContact O-CG1 3.18Å; L614-I618 PolarHBondContact O-N 2.87Å; L615-I618 HydrophobicContact CD2-CD1 4.42Å; L615-I618 PolarHBondContact O-N 3.13Å
619	A	93.6	Very high	92.9	Very high	7 Å²	7	30.3 Å²	30.3	6%	0.058	15%	0.154	C	C	.	.	S	Bend	trans	-62.9	135	173.7	0	0	0	0	0	111.5	L576 A586 V590 L615 V621	L576-A619 HydrophobicContact CD1-CB 3.85Å; A586-A619 HydrophobicContact CB-CB 4.28Å; V590-A619 HydrophobicContact CG2-CB 4.12Å; L615-A619 WeakPolarHBondContact O-CB 3.41Å; L615-A619 PolarHBondContact O-N 3.06Å; L615-A619 VanDerWaalsContact O-N 3.1Å; A619-V621 HydrophobicContact CB-CG2 4.21Å; A619-V621 PolarHBondContact O-N 3.09Å; A619-V621 VanDerWaalsContact O-N 3.13Å
620	P	91.7	Very high	93.1	Very high	13 Å²	13	25.7 Å²	25.7	8%	0.084	13%	0.134	C	C	.	.			trans	-68.9	105.4	162.6	26.7	-30.9	0	0	0	109.3	C581 C583 A586 I623	C581-P620 HydrophobicContact CB-CG 4.1Å; C583-P620 WeakPolarHBondContact CA-O 3.2Å; C583-P620 PolarHBondContact SG-O 3.03Å; A586-P620 HydrophobicContact CB-CG 3.85Å; P620-I623 WeakPolarHBondContact CB-O 3.48Å
621	V	92	Very high	93.2	Very high	44 Å²	44	25 Å²	25	27%	0.267	13%	0.131	S	C	.	.	S	Bend	trans	-94	-30	-177.8	176.9	0	0	0	0	112.6	A470 H476 C583 A619	A470-V621 HydrophobicContact CB-CG1 4.2Å; H476-V621 HydrophobicContact CB-CG1 3.35Å; C583-V621 VanDerWaalsContact SG-C 3.59Å; A619-V621 HydrophobicContact CB-CG2 4.21Å; A619-V621 PolarHBondContact O-N 3.09Å; A619-V621 VanDerWaalsContact O-N 3.13Å
622	H	94	Very high	93.2	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.019	13%	0.13	C	C	.	.	S	Bend	trans	-120.1	-37.1	-178	-62.1	86.3	0	0	0	113.9	F469 V474 M484 W506 A627	F469-H622 AromaticContact CD1-CE1 3.68Å; F469-H622 AromaticContact CE1-CE1 3.61Å; F469-H622 AromaticContact CE1-ND1 3.93Å; F469-H622 AromaticContact CE1-NE2 3.75Å; V474-H622 PolarHBondContact O-NE2 3.48Å; M484-H622 HydrophobicContact CE-CB 4.36Å; M484-H622 VanDerWaalsContact CE-O 3.25Å; M484-H622 WeakPolarHBondContact CE-O 3.44Å; W506-H622 HydrophobicContact CH2-CB 4.19Å; W506-H622 AromaticContact CH2-ND1 3.58Å; H622-A627 VanDerWaalsContact O-CB 3.3Å; H622-A627 WeakPolarHBondContact O-CB 3.48Å
623	I	93.9	Very high	93.2	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.021	13%	0.131	C	C	.	.			trans	-113.4	117.5	-164.3	-48.7	-57.5	0	0	0	110.8	M484 L487 P620 I628 L666 H670	M484-I623 HydrophobicContact CE-CD1 4.41Å; M484-I623 HydrophobicContact SD-CD1 4.35Å; L487-I623 HydrophobicContact CD2-CD1 3.83Å; P620-I623 WeakPolarHBondContact CB-O 3.48Å; I623-I628 HydrophobicContact CG2-CD1 3.9Å; I623-I628 HydrophobicContact CG2-CG1 4.26Å; I623-L666 HydrophobicContact CD1-CD1 3.83Å; I623-L666 HydrophobicContact CD1-CD2 4.08Å; I623-L666 HydrophobicContact CG1-CD1 4.43Å; I623-L666 HydrophobicContact CG1-CD2 3.85Å; I623-L666 HydrophobicContact CG2-CD1 4.4Å; I623-L666 HydrophobicContact CG2-CD2 4.23Å; I623-H670 HydrophobicContact CG2-CB 4.03Å
624	D	91.8	Very high	93.2	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.021	12%	0.12	C	C	.	.	S	Bend	trans	-145.6	-169.9	166.9	62.4	26.2	0	0	0	109.5	S582 C583 E626 A627 I628	S582-D624 WeakPolarHBondContact CA-OD2 3.16Å; S582-D624 WeakPolarHBondContact CB-OD2 3.47Å; C583-D624 PolarHBondContact N-OD2 3.12Å; C583-D624 PolarHBondContact SG-OD2 3.03Å; D624-E626 VanDerWaalsContact C-N 3.35Å; D624-E626 PolarHBondContact O-N 3.19Å; D624-E626 WeakPolarHBondContact OD1-CB 3.34Å; D624-E626 PolarHBondContact OD1-N 3.45Å; D624-A627 PolarHBondContact O-N 2.97Å; D624-A627 PolarHBondContact OD1-N 3.36Å; D624-I628 WeakPolarHBondContact O-CG1 3.26Å; D624-I628 PolarHBondContact O-N 3.01Å
625	S	90.6	Very high	93.1	Very high	57 Å²	57	22.2 Å²	22.2	40%	0.399	12%	0.119	S	C	.	.	H	α-helix	trans	-68.9	-27.7	-178.5	-47.8	0	0	0	0	114.2	S629	S625-S629 WeakPolarHBondContact O-CB 3.36Å; S625-S629 PolarHBondContact O-N 2.84Å; S625-S629 PolarHBondContact O-OG 3.34Å
626	E	92.3	Very high	92.8	Very high	82 Å²	82	23.2 Å²	23.2	38%	0.383	12%	0.124	S	C	.	.	H	α-helix	trans	-68.9	-44.7	172.2	-59.2	178.7	-173.4	0	0	109	T480 K584 D624 S629 A630	T480-E626 HydrophobicContact CG2-CB 3.91Å; T480-E626 PolarHBondContact OG1-OE2 3.1Å; K584-E626 IonicContact NZ-OE1 3.41Å; K584-E626 PolarHBondContact NZ-OE1 2.73Å; K584-E626 IonicContact NZ-OE2 3.52Å; K584-E626 PolarHBondContact NZ-OE2 3.32Å; D624-E626 VanDerWaalsContact C-N 3.35Å; D624-E626 PolarHBondContact O-N 3.19Å; D624-E626 WeakPolarHBondContact OD1-CB 3.34Å; D624-E626 PolarHBondContact OD1-N 3.45Å; E626-S629 WeakPolarHBondContact O-CB 3.2Å; E626-S629 PolarHBondContact O-N 3.2Å; E626-A630 PolarHBondContact O-N 3.41Å
627	A	94.4	Very high	92.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.4	-43.3	-179.5	0	0	0	0	0	113.5	T480 M484 H622 D624 S629 A630 L631	T480-A627 HydrophobicContact CG2-CB 4.26Å; M484-A627 HydrophobicContact CE-CB 4.14Å; M484-A627 HydrophobicContact CG-CB 4.02Å; M484-A627 WeakPolarHBondContact CG-O 3.29Å; M484-A627 HydrophobicContact SD-CB 3.74Å; H622-A627 VanDerWaalsContact O-CB 3.3Å; H622-A627 WeakPolarHBondContact O-CB 3.48Å; D624-A627 PolarHBondContact O-N 2.97Å; D624-A627 PolarHBondContact OD1-N 3.36Å; A627-S629 VanDerWaalsContact C-N 3.33Å; A627-S629 PolarHBondContact O-N 2.96Å; A627-A630 PolarHBondContact O-N 2.87Å; A627-L631 WeakPolarHBondContact O-CG 3.22Å; A627-L631 PolarHBondContact O-N 3.01Å
628	I	94.6	Very high	92.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-42.4	174	-64.5	-57	0	0	0	110.9	I623 D624 A630 L631 V632 L663 L666 F674 T679	I623-I628 HydrophobicContact CG2-CD1 3.9Å; I623-I628 HydrophobicContact CG2-CG1 4.26Å; D624-I628 WeakPolarHBondContact O-CG1 3.26Å; D624-I628 PolarHBondContact O-N 3.01Å; I628-A630 VanDerWaalsContact C-N 3.31Å; I628-A630 PolarHBondContact O-N 3.26Å; I628-L631 HydrophobicContact CD1-CD1 4.43Å; I628-L631 PolarHBondContact O-N 3.36Å; I628-V632 HydrophobicContact CG2-CG2 4.4Å; I628-V632 WeakPolarHBondContact O-CG2 3.34Å; I628-V632 PolarHBondContact O-N 3.27Å; I628-L663 HydrophobicContact CD1-CD2 4.38Å; I628-L663 HydrophobicContact CG2-CD2 4.43Å; I628-L666 HydrophobicContact CD1-CB 4.06Å; I628-L666 HydrophobicContact CD1-CD1 3.72Å; I628-F674 HydrophobicContact CD1-CD2 4.34Å; I628-F674 HydrophobicContact CD1-CE2 3.61Å; I628-F674 HydrophobicContact CD1-CZ 3.76Å; I628-F674 HydrophobicContact CG1-CD2 4.18Å; I628-F674 HydrophobicContact CG1-CE2 3.95Å; I628-F674 HydrophobicContact CG1-CZ 4.4Å; I628-F674 HydrophobicContact CG2-CD1 3.82Å; I628-F674 HydrophobicContact CG2-CD2 4.11Å; I628-F674 HydrophobicContact CG2-CE1 3.95Å; I628-F674 HydrophobicContact CG2-CE2 4.2Å; I628-F674 HydrophobicContact CG2-CG 3.9Å; I628-F674 HydrophobicContact CG2-CZ 4.12Å; I628-T679 HydrophobicContact CG2-CG2 4.4Å
629	S	92.1	Very high	92.3	Very high	25 Å²	25	25.4 Å²	25.4	18%	0.175	14%	0.135	C	C	.	.	H	α-helix	trans	-62.1	-38.9	177.8	-55.3	0	0	0	0	112	S625 E626 A627 K633	S625-S629 WeakPolarHBondContact O-CB 3.36Å; S625-S629 PolarHBondContact O-N 2.84Å; S625-S629 PolarHBondContact O-OG 3.34Å; E626-S629 WeakPolarHBondContact O-CB 3.2Å; E626-S629 PolarHBondContact O-N 3.2Å; A627-S629 VanDerWaalsContact C-N 3.33Å; A627-S629 PolarHBondContact O-N 2.96Å; S629-K633 WeakPolarHBondContact O-CB 3.47Å; S629-K633 WeakPolarHBondContact O-CG 3.48Å; S629-K633 PolarHBondContact O-N 2.92Å
630	A	94.3	Very high	92	Very high	8 Å²	8	30.7 Å²	30.7	7%	0.066	16%	0.158	C	C	.	.	H	α-helix	trans	-68.7	-42.6	175.5	0	0	0	0	0	113	T480 E481 M484 E626 A627 I628 V632 K633 L634	T480-A630 HydrophobicContact CG2-CB 4.21Å; E481-A630 HydrophobicContact CG-CB 4.48Å; M484-A630 HydrophobicContact CB-CB 4.04Å; M484-A630 HydrophobicContact CG-CB 4.03Å; E626-A630 PolarHBondContact O-N 3.41Å; A627-A630 PolarHBondContact O-N 2.87Å; I628-A630 VanDerWaalsContact C-N 3.31Å; I628-A630 PolarHBondContact O-N 3.26Å; A630-V632 VanDerWaalsContact C-N 3.32Å; A630-V632 PolarHBondContact O-N 3.42Å; A630-K633 PolarHBondContact O-N 2.68Å; A630-L634 WeakPolarHBondContact O-CG 3.49Å; A630-L634 PolarHBondContact O-N 2.86Å
631	L	95.2	Very high	91.8	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-40.5	174.3	-75.8	171.1	0	0	0	112.4	M484 L487 Y488 A627 I628 L634 M635 L662 L663 L666	M484-L631 HydrophobicContact CB-CD2 3.9Å; M484-L631 HydrophobicContact CB-CG 3.99Å; M484-L631 HydrophobicContact CG-CD2 4.32Å; M484-L631 HydrophobicContact CG-CG 3.96Å; M484-L631 HydrophobicContact SD-CD1 3.7Å; M484-L631 HydrophobicContact SD-CD2 3.93Å; M484-L631 HydrophobicContact SD-CG 3.56Å; M484-L631 VanDerWaalsContact SD-CG 3.56Å; L487-L631 HydrophobicContact CD2-CD1 4.34Å; L487-L631 HydrophobicContact CD2-CD2 4.5Å; Y488-L631 HydrophobicContact CD2-CD2 4.46Å; A627-L631 WeakPolarHBondContact O-CG 3.22Å; A627-L631 PolarHBondContact O-N 3.01Å; I628-L631 HydrophobicContact CD1-CD1 4.43Å; I628-L631 PolarHBondContact O-N 3.36Å; L631-L634 PolarHBondContact O-N 3.26Å; L631-M635 PolarHBondContact O-N 2.94Å; L631-L662 HydrophobicContact CD1-CD2 4.14Å; L631-L662 HydrophobicContact CD2-CD2 3.99Å; L631-L663 HydrophobicContact CB-CD2 4.08Å; L631-L663 HydrophobicContact CD1-CD2 4.37Å; L631-L666 HydrophobicContact CD1-CD1 3.72Å
632	V	92.6	Very high	91.8	Very high	3 Å²	3	35 Å²	35	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-41.2	176.6	172.5	0	0	0	0	111	I628 A630 L634 M635 N636 L663 T679 S682	I628-V632 HydrophobicContact CG2-CG2 4.4Å; I628-V632 WeakPolarHBondContact O-CG2 3.34Å; I628-V632 PolarHBondContact O-N 3.27Å; A630-V632 VanDerWaalsContact C-N 3.32Å; A630-V632 PolarHBondContact O-N 3.42Å; V632-L634 VanDerWaalsContact C-N 3.35Å; V632-L634 PolarHBondContact O-N 2.78Å; V632-M635 PolarHBondContact O-N 3.41Å; V632-N636 VanDerWaalsContact O-CG 3.32Å; V632-N636 PolarHBondContact O-N 3.02Å; V632-N636 PolarHBondContact O-OD1 3.15Å; V632-L663 HydrophobicContact CG2-CD1 3.93Å; V632-L663 HydrophobicContact CG2-CD2 4.13Å; V632-T679 HydrophobicContact CG2-CG2 4.25Å; V632-S682 VanDerWaalsContact CG1-OG 3.28Å; V632-S682 WeakPolarHBondContact CG1-OG 3.5Å
633	K	91.8	Very high	91.6	Very high	94 Å²	94	35.9 Å²	35.9	41%	0.409	21%	0.205	S	C	.	.	H	α-helix	trans	-64.1	-36.6	175.5	-75.5	171.9	-177.8	175.8	0	112.8	S629 A630 K637 E678	S629-K633 WeakPolarHBondContact O-CB 3.47Å; S629-K633 WeakPolarHBondContact O-CG 3.48Å; S629-K633 PolarHBondContact O-N 2.92Å; A630-K633 PolarHBondContact O-N 2.68Å; K633-K637 WeakPolarHBondContact O-CG 3.21Å; K633-K637 PolarHBondContact O-N 3.4Å; K633-E678 WeakPolarHBondContact CE-OE2 3.45Å; K633-E678 IonicContact NZ-OE1 3.59Å; K633-E678 IonicContact NZ-OE2 2.72Å; K633-E678 PolarHBondContact NZ-OE2 3.22Å
634	L	93.3	Very high	91.4	Very high	21 Å²	21	39 Å²	39	11%	0.11	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-48.9	171.5	-74.4	160.1	0	0	0	111.6	M484 K485 A630 L631 V632 N636 K637 S638	M484-L634 HydrophobicContact CB-CD1 4.06Å; K485-L634 HydrophobicContact CB-CD1 4.19Å; K485-L634 HydrophobicContact CB-CD2 4.3Å; K485-L634 HydrophobicContact CG-CD2 4.24Å; A630-L634 WeakPolarHBondContact O-CG 3.49Å; A630-L634 PolarHBondContact O-N 2.86Å; L631-L634 PolarHBondContact O-N 3.26Å; V632-L634 VanDerWaalsContact C-N 3.35Å; V632-L634 PolarHBondContact O-N 2.78Å; L634-N636 VanDerWaalsContact C-N 3.3Å; L634-N636 PolarHBondContact O-N 3.34Å; L634-K637 WeakPolarHBondContact O-CB 3.34Å; L634-K637 PolarHBondContact O-N 2.64Å; L634-K637 VanDerWaalsContact O-N 3.11Å; L634-S638 PolarHBondContact O-N 3.42Å; L634-S638 VanDerWaalsContact O-N 3.08Å; L634-S638 PolarHBondContact O-OG 3.43Å
635	M	91.6	Very high	91.4	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-39.1	177.4	-175.5	-174	68.1	0	0	112.6	Y488 L631 V632 S638 I639 L660 L663 C686	Y488-M635 HydrophobicContact CE2-CB 4.25Å; L631-M635 PolarHBondContact O-N 2.94Å; V632-M635 PolarHBondContact O-N 3.41Å; M635-S638 PolarHBondContact O-N 3.22Å; M635-I639 HydrophobicContact CG-CD1 4.11Å; M635-I639 VanDerWaalsContact O-CG1 3.29Å; M635-I639 WeakPolarHBondContact O-CG1 3.27Å; M635-I639 PolarHBondContact O-N 2.88Å; M635-L660 HydrophobicContact CE-CD1 4.37Å; M635-L660 HydrophobicContact SD-CB 4.05Å; M635-L660 HydrophobicContact SD-CD1 3.82Å; M635-L660 HydrophobicContact SD-CG 4.49Å; M635-L663 HydrophobicContact CE-CD1 4Å; M635-L663 HydrophobicContact SD-CD1 3.8Å; M635-C686 WeakPolarHBondContact CE-SG 3.11Å
636	N	88.9	Confident	91.4	Very high	23 Å²	23	43.9 Å²	43.9	12%	0.123	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-43	174.9	-69.5	-0.3	0	0	0	111.7	V632 L634 S638 I639 E640 S682	V632-N636 VanDerWaalsContact O-CG 3.32Å; V632-N636 PolarHBondContact O-N 3.02Å; V632-N636 PolarHBondContact O-OD1 3.15Å; L634-N636 VanDerWaalsContact C-N 3.3Å; L634-N636 PolarHBondContact O-N 3.34Å; N636-S638 VanDerWaalsContact C-N 3.32Å; N636-S638 PolarHBondContact O-N 3.35Å; N636-I639 CarbonylContact O-C 3.53Å; N636-I639 WeakPolarHBondContact O-CB 3.35Å; N636-I639 PolarHBondContact O-N 3.37Å; N636-I639 VanDerWaalsContact O-N 3.15Å; N636-E640 WeakPolarHBondContact O-CB 3.43Å; N636-E640 VanDerWaalsContact O-CG 3.29Å; N636-E640 WeakPolarHBondContact O-CG 3.25Å; N636-E640 PolarHBondContact O-N 3.44Å; N636-S682 WeakPolarHBondContact ND2-CB 3.24Å; N636-S682 PolarHBondContact ND2-OG 2.72Å; N636-S682 WeakPolarHBondContact OD1-CB 3.15Å
637	K	92.2	Very high	91.1	Very high	98 Å²	98	47 Å²	47	43%	0.426	25%	0.253	S	S	.	.	H	α-helix	trans	-58.9	-42	174.8	-71.5	178.6	178.3	-176.3	0	112.1	K633 L634 E640 G641 T642 A643	K633-K637 WeakPolarHBondContact O-CG 3.21Å; K633-K637 PolarHBondContact O-N 3.4Å; L634-K637 WeakPolarHBondContact O-CB 3.34Å; L634-K637 PolarHBondContact O-N 2.64Å; L634-K637 VanDerWaalsContact O-N 3.11Å; K637-E640 CarbonylContact O-C 3.57Å; K637-E640 PolarHBondContact O-N 3.28Å; K637-G641 PolarHBondContact O-N 3.09Å; K637-T642 WeakPolarHBondContact CA-OG1 3.29Å; K637-T642 PolarHBondContact O-N 3.42Å; K637-T642 PolarHBondContact O-OG1 2.73Å; K637-A643 HydrophobicContact CB-CB 3.81Å; K637-A643 PolarHBondContact O-N 3.33Å
638	S	91.7	Very high	90.8	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.028	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-38.3	175.8	-55.1	0	0	0	0	111.8	Y488 L634 M635 N636 E640 G641 A643 D645	Y488-S638 PolarHBondContact OH-OG 3.45Å; L634-S638 PolarHBondContact O-N 3.42Å; L634-S638 VanDerWaalsContact O-N 3.08Å; L634-S638 PolarHBondContact O-OG 3.43Å; M635-S638 PolarHBondContact O-N 3.22Å; N636-S638 VanDerWaalsContact C-N 3.32Å; N636-S638 PolarHBondContact O-N 3.35Å; S638-E640 VanDerWaalsContact C-N 3.31Å; S638-E640 PolarHBondContact O-N 3.34Å; S638-G641 PolarHBondContact O-N 3.39Å; S638-A643 VanDerWaalsContact OG-CB 3.3Å; S638-A643 WeakPolarHBondContact OG-CB 3.5Å; S638-D645 VanDerWaalsContact CB-OD2 3.25Å; S638-D645 WeakPolarHBondContact CB-OD2 3.34Å; S638-D645 PolarHBondContact OG-OD1 3.04Å; S638-D645 PolarHBondContact OG-OD2 2.92Å
639	I	85.7	Confident	90.4	Very high	41 Å²	41	54.5 Å²	54.5	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-33.8	172.9	-67	165.1	0	0	0	111.9	M635 N636 I656 M689	M635-I639 HydrophobicContact CG-CD1 4.11Å; M635-I639 VanDerWaalsContact O-CG1 3.29Å; M635-I639 WeakPolarHBondContact O-CG1 3.27Å; M635-I639 PolarHBondContact O-N 2.88Å; N636-I639 CarbonylContact O-C 3.53Å; N636-I639 WeakPolarHBondContact O-CB 3.35Å; N636-I639 PolarHBondContact O-N 3.37Å; N636-I639 VanDerWaalsContact O-N 3.15Å; I639-I656 HydrophobicContact CB-CD1 4.49Å; I639-I656 HydrophobicContact CD1-CG2 4.47Å; I639-I656 HydrophobicContact CG1-CD1 3.85Å; I639-I656 HydrophobicContact CG1-CG1 3.96Å; I639-I656 HydrophobicContact CG1-CG2 4.09Å; I639-M689 HydrophobicContact CD1-SD 3.86Å; I639-M689 HydrophobicContact CG1-CE 4.11Å; I639-M689 HydrophobicContact CG1-SD 4.1Å; I639-M689 HydrophobicContact CG2-CE 4.34Å; I639-M689 HydrophobicContact CG2-SD 4.34Å
640	E	87.8	Confident	90.4	Very high	118 Å²	118	54.1 Å²	54.1	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-82.8	-8.4	178	-70.8	168.1	-164.9	0	0	113.8	N636 K637 S638 T642	N636-E640 WeakPolarHBondContact O-CB 3.43Å; N636-E640 VanDerWaalsContact O-CG 3.29Å; N636-E640 WeakPolarHBondContact O-CG 3.25Å; N636-E640 PolarHBondContact O-N 3.44Å; K637-E640 CarbonylContact O-C 3.57Å; K637-E640 PolarHBondContact O-N 3.28Å; S638-E640 VanDerWaalsContact C-N 3.31Å; S638-E640 PolarHBondContact O-N 3.34Å; E640-T642 VanDerWaalsContact C-N 3.29Å; E640-T642 HydrophobicContact CB-CG2 4.13Å
641	G	87.6	Confident	90.3	Very high	64 Å²	64	56.5 Å²	56.5	66%	0.66	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	24.5	-172.3	0	0	0	0	0	113.9	K637 S638	K637-G641 PolarHBondContact O-N 3.09Å; S638-G641 PolarHBondContact O-N 3.39Å
642	T	90.8	Very high	90	Very high	84 Å²	84	58.5 Å²	58.5	52%	0.515	33%	0.331	S	S	.	.			trans	-114.1	13.4	-178.3	65.4	0	0	0	0	113.6	K637 E640	K637-T642 WeakPolarHBondContact CA-OG1 3.29Å; K637-T642 PolarHBondContact O-N 3.42Å; K637-T642 PolarHBondContact O-OG1 2.73Å; E640-T642 VanDerWaalsContact C-N 3.29Å; E640-T642 HydrophobicContact CB-CG2 4.13Å
643	A	90.3	Very high	89.8	Confident	22 Å²	22	63.2 Å²	63.2	18%	0.182	36%	0.356	C	S	.	.	S	Bend	trans	-98.5	158.3	174.5	0	0	0	0	0	112.6	K637 S638 D645	K637-A643 HydrophobicContact CB-CB 3.81Å; K637-A643 PolarHBondContact O-N 3.33Å; S638-A643 VanDerWaalsContact OG-CB 3.3Å; S638-A643 WeakPolarHBondContact OG-CB 3.5Å; A643-D645 PolarHBondContact O-N 3.11Å
644	D	90.3	Very high	89.8	Confident	69 Å²	69	61.5 Å²	61.5	37%	0.369	35%	0.353	S	S	.	.			trans	-76	24.7	-179.7	-35.5	-42.8	0	0	0	113.3	K485 E646 E647 E648	K485-D644 WeakPolarHBondContact CE-OD2 3.3Å; K485-D644 IonicContact NZ-OD2 2.62Å; K485-D644 PolarHBondContact NZ-OD2 2.74Å; D644-E646 PolarHBondContact O-N 3.49Å; D644-E647 HydrophobicContact CB-CB 4.39Å; D644-E647 PolarHBondContact O-N 2.61Å; D644-E648 HydrophobicContact CB-CG 4.32Å; D644-E648 WeakPolarHBondContact O-CG 3.35Å; D644-E648 PolarHBondContact O-N 3.05Å
645	D	92.3	Very high	89.7	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.016	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-49.7	-164.9	-64.2	-50.5	0	0	0	112.2	Y489 S638 A643 E648 G649 V650 P652 A655	Y489-D645 HydrophobicContact CE1-CB 4.41Å; Y489-D645 WeakPolarHBondContact CE1-OD1 3.49Å; Y489-D645 PolarHBondContact OH-N 2.9Å; Y489-D645 PolarHBondContact OH-OD1 3.18Å; S638-D645 VanDerWaalsContact CB-OD2 3.25Å; S638-D645 WeakPolarHBondContact CB-OD2 3.34Å; S638-D645 PolarHBondContact OG-OD1 3.04Å; S638-D645 PolarHBondContact OG-OD2 2.92Å; A643-D645 PolarHBondContact O-N 3.11Å; D645-E648 PolarHBondContact O-N 3.21Å; D645-G649 PolarHBondContact O-N 3Å; D645-G649 VanDerWaalsContact O-N 3.11Å; D645-V650 CarbonylContact C-O 3.47Å; D645-V650 PolarHBondContact O-N 2.91Å; D645-P652 HydrophobicContact CB-CG 4.06Å; D645-A655 VanDerWaalsContact OD1-CB 3.28Å; D645-A655 WeakPolarHBondContact OD1-CB 3.36Å
646	E	89.1	Confident	89.6	Confident	160 Å²	160	61.1 Å²	61.1	75%	0.748	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.6	179.1	-62.1	-167.3	163	0	0	113	D644 E648 G649	D644-E646 PolarHBondContact O-N 3.49Å; E646-E648 VanDerWaalsContact C-N 3.33Å; E646-G649 PolarHBondContact O-N 3.16Å
647	E	86.9	Confident	89.7	Confident	148 Å²	148	66.2 Å²	66.2	69%	0.692	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-34.6	175.5	-63.3	-158.1	165.5	0	0	111.5	K437 D644 G649	K437-E647 WeakPolarHBondContact CE-O 3.29Å; K437-E647 PolarHBondContact NZ-O 3.09Å; D644-E647 HydrophobicContact CB-CB 4.39Å; D644-E647 PolarHBondContact O-N 2.61Å; E647-G649 VanDerWaalsContact C-N 3.27Å
648	E	88.7	Confident	89.7	Confident	94 Å²	94	62.7 Å²	62.7	44%	0.439	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.2	174.4	-61.6	-76.6	174.3	0	0	112.6	K485 Y489 D644 D645 E646	K485-E648 WeakPolarHBondContact CE-OE1 3.39Å; K485-E648 IonicContact NZ-OE1 3.95Å; K485-E648 PolarHBondContact NZ-OE1 3.22Å; Y489-E648 HydrophobicContact CD1-CB 3.82Å; Y489-E648 HydrophobicContact CD1-CG 4.34Å; Y489-E648 HydrophobicContact CD2-CB 3.98Å; Y489-E648 HydrophobicContact CD2-CG 3.67Å; Y489-E648 HydrophobicContact CE1-CB 4.06Å; Y489-E648 HydrophobicContact CE1-CG 4.33Å; Y489-E648 HydrophobicContact CE2-CB 4.2Å; Y489-E648 HydrophobicContact CE2-CG 3.64Å; Y489-E648 HydrophobicContact CG-CB 3.77Å; Y489-E648 HydrophobicContact CG-CG 4.02Å; D644-E648 HydrophobicContact CB-CG 4.32Å; D644-E648 WeakPolarHBondContact O-CG 3.35Å; D644-E648 PolarHBondContact O-N 3.05Å; D645-E648 PolarHBondContact O-N 3.21Å; E646-E648 VanDerWaalsContact C-N 3.33Å
649	G	86.4	Confident	89.8	Confident	64 Å²	64	62.6 Å²	62.6	66%	0.66	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	25.6	172.3	0	0	0	0	0	115.3	D645 E646 E647	D645-G649 PolarHBondContact O-N 3Å; D645-G649 VanDerWaalsContact O-N 3.11Å; E646-G649 PolarHBondContact O-N 3.16Å; E647-G649 VanDerWaalsContact C-N 3.27Å
650	V	91	Very high	90.1	Very high	16 Å²	16	60.8 Å²	60.8	10%	0.097	35%	0.347	C	S	.	.			trans	-125.7	141.9	-179.1	-175.2	0	0	0	0	109.3	Y489 A492 D645 T654 A655	Y489-V650 HydrophobicContact CD1-CB 4.44Å; Y489-V650 HydrophobicContact CD1-CG2 4.24Å; A492-V650 HydrophobicContact CB-CG1 3.94Å; A492-V650 HydrophobicContact CB-CG2 4.5Å; D645-V650 CarbonylContact C-O 3.47Å; D645-V650 PolarHBondContact O-N 2.91Å; V650-T654 HydrophobicContact CG1-CG2 3.96Å; V650-A655 HydrophobicContact CG1-CB 4.04Å
651	S	92.2	Very high	90.3	Very high	58 Å²	58	57.7 Å²	57.7	41%	0.406	33%	0.333	S	S	.	.			trans	-75.3	144.5	172.6	68.8	0	0	0	0	111.1	D653 T654 A655	S651-D653 VanDerWaalsContact C-N 3.29Å; S651-D653 PolarHBondContact O-N 3.18Å; S651-T654 WeakPolarHBondContact O-CA 3.29Å; S651-T654 WeakPolarHBondContact O-CB 3.41Å; S651-T654 PolarHBondContact O-N 2.85Å; S651-T654 PolarHBondContact OG-OG1 3.26Å; S651-A655 PolarHBondContact O-N 3.08Å
652	P	89.6	Confident	90.7	Very high	44 Å²	44	54.7 Å²	54.7	29%	0.286	30%	0.301	S	S	.	.	H	α-helix	trans	-51.1	-43.2	179.5	-30.1	35.2	0	0	0	113.8	D645 T654 A655 I656	D645-P652 HydrophobicContact CB-CG 4.06Å; P652-T654 VanDerWaalsContact C-N 3.27Å; P652-T654 PolarHBondContact O-N 2.89Å; P652-A655 PolarHBondContact O-N 3.37Å; P652-I656 WeakPolarHBondContact O-CB 3.26Å; P652-I656 WeakPolarHBondContact O-CD1 3.41Å; P652-I656 WeakPolarHBondContact O-CG1 3.37Å; P652-I656 PolarHBondContact O-N 3.26Å
653	D	88	Confident	90.9	Very high	103 Å²	103	50.8 Å²	50.8	55%	0.551	28%	0.277	S	S	*	.	H	α-helix	trans	-55.9	-40.2	174.4	-69.3	-31.8	0	0	0	113.2	S651 R657	S651-D653 VanDerWaalsContact C-N 3.29Å; S651-D653 PolarHBondContact O-N 3.18Å; D653-R657 WeakPolarHBondContact O-CB 3.46Å; D653-R657 VanDerWaalsContact O-CG 3.25Å; D653-R657 WeakPolarHBondContact O-CG 3.26Å; D653-R657 PolarHBondContact O-N 2.86Å; D653-R657 VanDerWaalsContact O-N 3.12Å
654	T	91.1	Very high	91	Very high	57 Å²	57	51.8 Å²	51.8	35%	0.35	28%	0.277	S	S	.	.	H	α-helix	trans	-74.1	-39.3	-179.8	-54.2	0	0	0	0	110.7	V650 S651 P652 S658	V650-T654 HydrophobicContact CG1-CG2 3.96Å; S651-T654 WeakPolarHBondContact O-CA 3.29Å; S651-T654 WeakPolarHBondContact O-CB 3.41Å; S651-T654 PolarHBondContact O-N 2.85Å; S651-T654 PolarHBondContact OG-OG1 3.26Å; P652-T654 VanDerWaalsContact C-N 3.27Å; P652-T654 PolarHBondContact O-N 2.89Å; T654-S658 WeakPolarHBondContact O-CB 3.24Å; T654-S658 PolarHBondContact O-N 3.38Å; T654-S658 PolarHBondContact O-OG 3.18Å
655	A	91.9	Very high	91.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-50.9	175.5	0	0	0	0	0	111.3	Y488 D645 V650 S651 P652 S658 G659	Y488-A655 HydrophobicContact CE1-CB 3.82Å; Y488-A655 PolarHBondContact OH-O 3.03Å; D645-A655 VanDerWaalsContact OD1-CB 3.28Å; D645-A655 WeakPolarHBondContact OD1-CB 3.36Å; V650-A655 HydrophobicContact CG1-CB 4.04Å; S651-A655 PolarHBondContact O-N 3.08Å; P652-A655 PolarHBondContact O-N 3.37Å; A655-S658 PolarHBondContact O-N 3.44Å; A655-G659 PolarHBondContact O-N 2.89Å
656	I	89.7	Confident	91.2	Very high	14 Å²	14	49.4 Å²	49.4	7%	0.072	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-52.1	178.7	-64.7	162.9	0	0	0	111	Y488 I639 P652 S658 G659 L660 M689 V694	Y488-I656 PolarHBondContact OH-N 2.89Å; I639-I656 HydrophobicContact CB-CD1 4.49Å; I639-I656 HydrophobicContact CD1-CG2 4.47Å; I639-I656 HydrophobicContact CG1-CD1 3.85Å; I639-I656 HydrophobicContact CG1-CG1 3.96Å; I639-I656 HydrophobicContact CG1-CG2 4.09Å; P652-I656 WeakPolarHBondContact O-CB 3.26Å; P652-I656 WeakPolarHBondContact O-CD1 3.41Å; P652-I656 WeakPolarHBondContact O-CG1 3.37Å; P652-I656 PolarHBondContact O-N 3.26Å; I656-S658 PolarHBondContact O-N 3.08Å; I656-G659 PolarHBondContact O-N 3.29Å; I656-L660 WeakPolarHBondContact O-CB 3.29Å; I656-L660 PolarHBondContact O-N 2.91Å; I656-M689 HydrophobicContact CG2-CE 4.42Å; I656-V694 HydrophobicContact CG2-CG2 4.43Å
657	R	90.2	Very high	91.4	Very high	129 Å²	129	41.8 Å²	41.8	49%	0.487	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-45	179.7	-74.8	173.7	176.8	147.6	3.7	112	D653 E661 D691 V694	D653-R657 WeakPolarHBondContact O-CB 3.46Å; D653-R657 VanDerWaalsContact O-CG 3.25Å; D653-R657 WeakPolarHBondContact O-CG 3.26Å; D653-R657 PolarHBondContact O-N 2.86Å; D653-R657 VanDerWaalsContact O-N 3.12Å; R657-E661 WeakPolarHBondContact O-CB 3.45Å; R657-E661 PolarHBondContact O-N 3.02Å; R657-D691 IonicContact CZ-OD2 2.8Å; R657-D691 IonicContact NE-OD2 2.73Å; R657-D691 PolarHBondContact NE-OD2 3.2Å; R657-D691 IonicContact NH2-OD2 2.73Å; R657-D691 PolarHBondContact NH2-OD2 3.28Å; R657-V694 HydrophobicContact CG-CG2 4.33Å
658	S	93.3	Very high	91.6	Very high	25 Å²	25	41.6 Å²	41.6	18%	0.175	23%	0.227	C	C	.	.	H	α-helix	trans	-70.3	-40.9	-178.5	-58.6	0	0	0	0	112.7	Y491 A492 T654 A655 I656 E661 L662	Y491-S658 VanDerWaalsContact CD1-O 3.32Å; Y491-S658 WeakPolarHBondContact CD1-O 3.19Å; Y491-S658 WeakPolarHBondContact CE1-O 3.17Å; A492-S658 VanDerWaalsContact CA-CB 3.45Å; T654-S658 WeakPolarHBondContact O-CB 3.24Å; T654-S658 PolarHBondContact O-N 3.38Å; T654-S658 PolarHBondContact O-OG 3.18Å; A655-S658 PolarHBondContact O-N 3.44Å; I656-S658 PolarHBondContact O-N 3.08Å; S658-E661 PolarHBondContact O-N 2.96Å; S658-L662 WeakPolarHBondContact O-CB 3.2Å; S658-L662 PolarHBondContact O-N 3.31Å
659	G	93.7	Very high	91.5	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-39.7	175.5	0	0	0	0	0	112.5	A655 I656 L662 L663	A655-G659 PolarHBondContact O-N 2.89Å; I656-G659 PolarHBondContact O-N 3.29Å; G659-L662 WeakPolarHBondContact O-CB 3.26Å; G659-L662 PolarHBondContact O-N 2.91Å; G659-L663 WeakPolarHBondContact O-CG 3.43Å; G659-L663 PolarHBondContact O-N 3.38Å
660	L	91.7	Very high	91.7	Very high	2 Å²	2	35 Å²	35	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-72.3	-32.6	175	-168.4	67.9	0	0	0	112.5	M635 I656 L663 K664 L683 V694 A697 I701	M635-L660 HydrophobicContact CE-CD1 4.37Å; M635-L660 HydrophobicContact SD-CB 4.05Å; M635-L660 HydrophobicContact SD-CD1 3.82Å; M635-L660 HydrophobicContact SD-CG 4.49Å; I656-L660 WeakPolarHBondContact O-CB 3.29Å; I656-L660 PolarHBondContact O-N 2.91Å; L660-L663 HydrophobicContact CD1-CD1 4.4Å; L660-L663 PolarHBondContact O-N 3.03Å; L660-K664 WeakPolarHBondContact O-CB 3.44Å; L660-K664 PolarHBondContact O-N 3.06Å; L660-L683 HydrophobicContact CD1-CD2 4.1Å; L660-V694 HydrophobicContact CD2-CB 4.04Å; L660-V694 HydrophobicContact CD2-CG1 3.79Å; L660-V694 HydrophobicContact CD2-CG2 4.19Å; L660-V694 WeakPolarHBondContact CD2-O 3.36Å; L660-A697 HydrophobicContact CD2-CB 3.78Å; L660-A697 HydrophobicContact CG-CB 3.88Å; L660-I701 HydrophobicContact CD1-CD1 3.57Å; L660-I701 HydrophobicContact CG-CD1 4.32Å
661	E	91.8	Very high	91.7	Very high	54 Å²	54	36.5 Å²	36.5	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-65.1	-41.8	170.9	-172.4	60.4	-156.5	0	0	111.7	Y491 R657 S658 K664 V665	Y491-E661 HydrophobicContact CE1-CB 4.29Å; Y491-E661 HydrophobicContact CE1-CG 4.38Å; R657-E661 WeakPolarHBondContact O-CB 3.45Å; R657-E661 PolarHBondContact O-N 3.02Å; S658-E661 PolarHBondContact O-N 2.96Å; E661-K664 VanDerWaalsContact CD-CE 3.5Å; E661-K664 WeakPolarHBondContact O-CB 3.33Å; E661-K664 PolarHBondContact O-N 2.77Å; E661-K664 WeakPolarHBondContact OE1-CE 3.46Å; E661-K664 IonicContact OE1-NZ 2.89Å; E661-K664 PolarHBondContact OE1-NZ 3.17Å; E661-K664 WeakPolarHBondContact OE2-CE 3.35Å; E661-K664 IonicContact OE2-NZ 3.12Å; E661-K664 PolarHBondContact OE2-NZ 2.79Å; E661-V665 WeakPolarHBondContact O-CG2 3.22Å; E661-V665 PolarHBondContact O-N 3.23Å
662	L	95.1	Very high	91.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57	-50.1	170.2	171.1	63.5	0	0	0	110.8	L487 Y491 L631 S658 G659 K664 V665 L666	L487-L662 HydrophobicContact CD2-CD2 4.08Å; L487-L662 HydrophobicContact CG-CD2 3.89Å; Y491-L662 HydrophobicContact CD1-CB 3.84Å; Y491-L662 HydrophobicContact CD2-CB 4.2Å; Y491-L662 HydrophobicContact CD2-CD1 3.81Å; Y491-L662 HydrophobicContact CD2-CG 4.4Å; Y491-L662 HydrophobicContact CE1-CB 3.84Å; Y491-L662 HydrophobicContact CE2-CB 4.2Å; Y491-L662 HydrophobicContact CE2-CD1 3.82Å; Y491-L662 HydrophobicContact CG-CB 4Å; Y491-L662 HydrophobicContact CG-CD1 4.37Å; Y491-L662 HydrophobicContact CG-CD2 4.41Å; Y491-L662 HydrophobicContact CG-CG 4.49Å; L631-L662 HydrophobicContact CD1-CD2 4.14Å; L631-L662 HydrophobicContact CD2-CD2 3.99Å; S658-L662 WeakPolarHBondContact O-CB 3.2Å; S658-L662 PolarHBondContact O-N 3.31Å; G659-L662 WeakPolarHBondContact O-CB 3.26Å; G659-L662 PolarHBondContact O-N 2.91Å; L662-K664 VanDerWaalsContact C-N 3.29Å; L662-K664 PolarHBondContact O-N 3.46Å; L662-V665 PolarHBondContact O-N 3.06Å; L662-V665 VanDerWaalsContact O-N 3.16Å; L662-L666 HydrophobicContact CD1-CD1 3.84Å; L662-L666 HydrophobicContact CD1-CG 3.95Å; L662-L666 HydrophobicContact CG-CD1 3.96Å; L662-L666 HydrophobicContact CG-CG 4.4Å; L662-L666 WeakPolarHBondContact O-CB 3.35Å; L662-L666 VanDerWaalsContact O-CG 3.31Å; L662-L666 WeakPolarHBondContact O-CG 3.29Å; L662-L666 PolarHBondContact O-N 3.47Å
663	L	95	Very high	91.6	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-37.2	175.4	-70.6	171.9	0	0	0	112	I628 L631 V632 M635 G659 L660 V665 L666 S667 F674 I701	I628-L663 HydrophobicContact CD1-CD2 4.38Å; I628-L663 HydrophobicContact CG2-CD2 4.43Å; L631-L663 HydrophobicContact CB-CD2 4.08Å; L631-L663 HydrophobicContact CD1-CD2 4.37Å; V632-L663 HydrophobicContact CG2-CD1 3.93Å; V632-L663 HydrophobicContact CG2-CD2 4.13Å; M635-L663 HydrophobicContact CE-CD1 4Å; M635-L663 HydrophobicContact SD-CD1 3.8Å; G659-L663 WeakPolarHBondContact O-CG 3.43Å; G659-L663 PolarHBondContact O-N 3.38Å; L660-L663 HydrophobicContact CD1-CD1 4.4Å; L660-L663 PolarHBondContact O-N 3.03Å; L663-V665 PolarHBondContact O-N 2.76Å; L663-L666 PolarHBondContact O-N 2.71Å; L663-S667 WeakPolarHBondContact O-CB 3.49Å; L663-S667 PolarHBondContact O-N 2.69Å; L663-F674 HydrophobicContact CB-CE1 4.16Å; L663-F674 HydrophobicContact CB-CZ 4.36Å; L663-F674 HydrophobicContact CD2-CE1 3.83Å; L663-F674 HydrophobicContact CD2-CZ 3.95Å; L663-F674 VanDerWaalsContact O-CZ 3.29Å; L663-F674 WeakPolarHBondContact O-CZ 3.22Å; L663-I701 HydrophobicContact CB-CD1 3.78Å
664	K	93.2	Very high	91.8	Very high	43 Å²	43	30.2 Å²	30.2	19%	0.187	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-41.2	174.8	-161.6	-174.7	78	-163.6	0	111.7	L660 E661 L662 S667 A697 Q700 I701	L660-K664 WeakPolarHBondContact O-CB 3.44Å; L660-K664 PolarHBondContact O-N 3.06Å; E661-K664 VanDerWaalsContact CD-CE 3.5Å; E661-K664 WeakPolarHBondContact O-CB 3.33Å; E661-K664 PolarHBondContact O-N 2.77Å; E661-K664 WeakPolarHBondContact OE1-CE 3.46Å; E661-K664 IonicContact OE1-NZ 2.89Å; E661-K664 PolarHBondContact OE1-NZ 3.17Å; E661-K664 WeakPolarHBondContact OE2-CE 3.35Å; E661-K664 IonicContact OE2-NZ 3.12Å; E661-K664 PolarHBondContact OE2-NZ 2.79Å; L662-K664 VanDerWaalsContact C-N 3.29Å; L662-K664 PolarHBondContact O-N 3.46Å; K664-S667 PolarHBondContact O-OG 3.09Å; K664-A697 HydrophobicContact CD-CB 3.92Å; K664-A697 HydrophobicContact CG-CB 4.5Å; K664-Q700 HydrophobicContact CD-CB 4.45Å; K664-Q700 HydrophobicContact CG-CB 4.38Å; K664-Q700 HydrophobicContact CG-CG 4.39Å; K664-I701 HydrophobicContact CB-CD1 4.45Å; K664-I701 HydrophobicContact CB-CG1 4.23Å; K664-I701 HydrophobicContact CG-CG1 4.48Å
665	V	92.6	Very high	91.8	Very high	23 Å²	23	30.4 Å²	30.4	14%	0.139	15%	0.149	C	C	.	.	H	α-helix	trans	-69.8	-44	175	173	0	0	0	0	111.7	N503 E661 L662 L663 S667 F668 T669	N503-V665 HydrophobicContact CB-CG1 4.05Å; N503-V665 HydrophobicContact CB-CG2 4.33Å; N503-V665 WeakPolarHBondContact ND2-CG2 3.45Å; E661-V665 WeakPolarHBondContact O-CG2 3.22Å; E661-V665 PolarHBondContact O-N 3.23Å; L662-V665 PolarHBondContact O-N 3.06Å; L662-V665 VanDerWaalsContact O-N 3.16Å; L663-V665 PolarHBondContact O-N 2.76Å; V665-S667 VanDerWaalsContact C-N 3.29Å; V665-S667 PolarHBondContact O-N 2.91Å; V665-F668 PolarHBondContact O-N 3.24Å; V665-T669 PolarHBondContact O-N 2.85Å; V665-T669 PolarHBondContact O-OG1 3.32Å
666	L	94.2	Very high	91.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-34.2	178.4	-67.9	-179.7	0	0	0	111.7	I623 I628 L631 L662 L663 F668 T669 H670 F674	I623-L666 HydrophobicContact CD1-CD1 3.83Å; I623-L666 HydrophobicContact CD1-CD2 4.08Å; I623-L666 HydrophobicContact CG1-CD1 4.43Å; I623-L666 HydrophobicContact CG1-CD2 3.85Å; I623-L666 HydrophobicContact CG2-CD1 4.4Å; I623-L666 HydrophobicContact CG2-CD2 4.23Å; I628-L666 HydrophobicContact CD1-CB 4.06Å; I628-L666 HydrophobicContact CD1-CD1 3.72Å; L631-L666 HydrophobicContact CD1-CD1 3.72Å; L662-L666 HydrophobicContact CD1-CD1 3.84Å; L662-L666 HydrophobicContact CD1-CG 3.95Å; L662-L666 HydrophobicContact CG-CD1 3.96Å; L662-L666 HydrophobicContact CG-CG 4.4Å; L662-L666 WeakPolarHBondContact O-CB 3.35Å; L662-L666 VanDerWaalsContact O-CG 3.31Å; L662-L666 WeakPolarHBondContact O-CG 3.29Å; L662-L666 PolarHBondContact O-N 3.47Å; L663-L666 PolarHBondContact O-N 2.71Å; L666-F668 PolarHBondContact O-N 3.08Å; L666-F668 VanDerWaalsContact O-N 3.14Å; L666-T669 WeakPolarHBondContact CA-OG1 3.08Å; L666-T669 PolarHBondContact O-N 3.06Å; L666-T669 PolarHBondContact O-OG1 3.32Å; L666-H670 PolarHBondContact O-N 3.06Å; L666-F674 HydrophobicContact CB-CE2 3.98Å; L666-F674 HydrophobicContact CB-CZ 3.9Å
667	S	94.4	Very high	91.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-26.2	175	79.4	0	0	0	0	113.5	L663 K664 V665 P671 N704	L663-S667 WeakPolarHBondContact O-CB 3.49Å; L663-S667 PolarHBondContact O-N 2.69Å; K664-S667 PolarHBondContact O-OG 3.09Å; V665-S667 VanDerWaalsContact C-N 3.29Å; V665-S667 PolarHBondContact O-N 2.91Å; S667-P671 WeakPolarHBondContact O-CB 3.36Å; S667-N704 PolarHBondContact OG-ND2 3.26Å
668	F	90.2	Very high	91.3	Very high	143 Å²	143	31.5 Å²	31.5	63%	0.627	17%	0.169	S	C	*	.	H	α-helix	trans	-90.1	-19.7	177.6	-164	-91.4	0	0	0	113.3	V665 L666	V665-F668 PolarHBondContact O-N 3.24Å; L666-F668 PolarHBondContact O-N 3.08Å; L666-F668 VanDerWaalsContact O-N 3.14Å
669	T	87.5	Confident	91.1	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-106.9	-25.4	-175.2	51.3	0	0	0	0	113.7	W506 N510 R513 V665 L666	W506-T669 HydrophobicContact CB-CG2 4.1Å; N510-T669 HydrophobicContact CB-CG2 4.24Å; N510-T669 PolarHBondContact ND2-O 3.16Å; N510-T669 PolarHBondContact OD1-O 3.35Å; R513-T669 PolarHBondContact NH2-O 3Å; V665-T669 PolarHBondContact O-N 2.85Å; V665-T669 PolarHBondContact O-OG1 3.32Å; L666-T669 WeakPolarHBondContact CA-OG1 3.08Å; L666-T669 PolarHBondContact O-N 3.06Å; L666-T669 PolarHBondContact O-OG1 3.32Å
670	H	89.1	Confident	91	Very high	15 Å²	15	30.2 Å²	30.2	7%	0.069	16%	0.16	C	C	.	.	S	Bend	trans	-140.4	49.6	-177.5	-54.3	85.6	0	0	0	111.3	R513 I623 L666 T672 S673	R513-H670 PolarHBondContact NH1-NE2 2.95Å; R513-H670 PolarHBondContact NH2-CD2 3.06Å; R513-H670 PolarHBondContact NH2-NE2 3.2Å; I623-H670 HydrophobicContact CG2-CB 4.03Å; L666-H670 PolarHBondContact O-N 3.06Å; H670-T672 VanDerWaalsContact C-N 3.26Å; H670-T672 PolarHBondContact O-N 3.34Å; H670-T672 VanDerWaalsContact O-N 3.15Å; H670-S673 WeakPolarHBondContact O-CB 3.47Å; H670-S673 PolarHBondContact O-N 3.05Å
671	P	91.7	Very high	91	Very high	48 Å²	48	34.8 Å²	34.8	31%	0.312	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-59.1	-32.3	-168.5	21.3	-33.4	0	0	0	114.6	S667 S673 F674 T705	S667-P671 WeakPolarHBondContact O-CB 3.36Å; P671-S673 VanDerWaalsContact C-N 3.28Å; P671-S673 PolarHBondContact O-N 3.45Å; P671-F674 PolarHBondContact O-N 3.11Å; P671-T705 HydrophobicContact CB-CG2 4.19Å
672	T	89.4	Confident	90.9	Very high	64 Å²	64	32.8 Å²	32.8	39%	0.393	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-66.9	-25.3	178.3	39.1	0	0	0	0	113.7	P579 H670 F674 H675	P579-T672 HydrophobicContact CB-CG2 3.86Å; P579-T672 WeakPolarHBondContact CB-OG1 3.29Å; P579-T672 PolarHBondContact O-OG1 2.68Å; H670-T672 VanDerWaalsContact C-N 3.26Å; H670-T672 PolarHBondContact O-N 3.34Å; H670-T672 VanDerWaalsContact O-N 3.15Å; T672-F674 PolarHBondContact O-N 3.04Å; T672-H675 PolarHBondContact O-N 2.93Å
673	S	89.4	Confident	90.6	Very high	8 Å²	8	32.8 Å²	32.8	6%	0.056	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-73.4	-11.7	179.9	-57.9	0	0	0	0	113.6	H670 P671	H670-S673 WeakPolarHBondContact O-CB 3.47Å; H670-S673 PolarHBondContact O-N 3.05Å; P671-S673 VanDerWaalsContact C-N 3.28Å; P671-S673 PolarHBondContact O-N 3.45Å
674	F	92.8	Very high	90.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-89.1	-5	176.5	-73.6	-106.5	0	0	0	113.7	I628 L663 L666 P671 T672 S676 T679 I701 T705	I628-F674 HydrophobicContact CD1-CD2 4.34Å; I628-F674 HydrophobicContact CD1-CE2 3.61Å; I628-F674 HydrophobicContact CD1-CZ 3.76Å; I628-F674 HydrophobicContact CG1-CD2 4.18Å; I628-F674 HydrophobicContact CG1-CE2 3.95Å; I628-F674 HydrophobicContact CG1-CZ 4.4Å; I628-F674 HydrophobicContact CG2-CD1 3.82Å; I628-F674 HydrophobicContact CG2-CD2 4.11Å; I628-F674 HydrophobicContact CG2-CE1 3.95Å; I628-F674 HydrophobicContact CG2-CE2 4.2Å; I628-F674 HydrophobicContact CG2-CG 3.9Å; I628-F674 HydrophobicContact CG2-CZ 4.12Å; L663-F674 HydrophobicContact CB-CE1 4.16Å; L663-F674 HydrophobicContact CB-CZ 4.36Å; L663-F674 HydrophobicContact CD2-CE1 3.83Å; L663-F674 HydrophobicContact CD2-CZ 3.95Å; L663-F674 VanDerWaalsContact O-CZ 3.29Å; L663-F674 WeakPolarHBondContact O-CZ 3.22Å; L666-F674 HydrophobicContact CB-CE2 3.98Å; L666-F674 HydrophobicContact CB-CZ 3.9Å; P671-F674 PolarHBondContact O-N 3.11Å; T672-F674 PolarHBondContact O-N 3.04Å; F674-S676 VanDerWaalsContact C-N 3.27Å; F674-S676 PolarHBondContact O-N 2.97Å; F674-T679 HydrophobicContact CB-CG2 4.14Å; F674-T679 HydrophobicContact CD1-CG2 3.91Å; F674-T679 HydrophobicContact CG-CG2 4.45Å; F674-T679 WeakPolarHBondContact O-CB 3.43Å; F674-T679 WeakPolarHBondContact O-CG2 3.27Å; F674-I701 HydrophobicContact CD1-CG2 3.75Å; F674-I701 HydrophobicContact CE1-CG2 3.78Å; F674-T705 HydrophobicContact CB-CG2 3.7Å; F674-T705 HydrophobicContact CD1-CG2 4.29Å; F674-T705 HydrophobicContact CD2-CG2 3.98Å; F674-T705 HydrophobicContact CG-CG2 3.74Å
675	H	90.1	Very high	90.2	Very high	61 Å²	61	35.1 Å²	35.1	28%	0.282	19%	0.185	S	C	.	.			trans	-83.3	66.6	-169.8	-165	62.8	0	0	0	112.6	T672 Y680 K708 D712	T672-H675 PolarHBondContact O-N 2.93Å; H675-Y680 AromaticContact ND1-CE2 3.65Å; H675-K708 WeakPolarHBondContact CE1-CB 3.32Å; H675-D712 IonicContact CD2-OD2 2.7Å; H675-D712 IonicContact CE1-OD2 2.62Å; H675-D712 IonicContact NE2-OD2 3.7Å; H675-D712 PolarHBondContact NE2-OD2 3.11Å
676	S	87	Confident	89.9	Confident	35 Å²	35	34.1 Å²	34.1	25%	0.245	18%	0.179	C	C	.	.	S	Bend	trans	-133.3	154.6	171	79.7	0	0	0	0	111.6	F674 T679 Y680	F674-S676 VanDerWaalsContact C-N 3.27Å; F674-S676 PolarHBondContact O-N 2.97Å; S676-T679 PolarHBondContact O-N 2.68Å; S676-T679 WeakPolarHBondContact OG-CB 3.45Å; S676-T679 PolarHBondContact OG-N 2.78Å; S676-T679 PolarHBondContact OG-OG1 2.9Å; S676-Y680 WeakPolarHBondContact O-CD2 3.2Å; S676-Y680 PolarHBondContact O-N 3.14Å
677	A	88.3	Confident	89.6	Confident	34 Å²	34	34.3 Å²	34.3	28%	0.281	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-50.3	177.4	0	0	0	0	0	111.4	T679 Y680 E681 L713	A677-T679 VanDerWaalsContact C-N 3.26Å; A677-T679 PolarHBondContact O-N 3.35Å; A677-Y680 PolarHBondContact O-N 3.32Å; A677-E681 WeakPolarHBondContact O-CG 3.47Å; A677-E681 PolarHBondContact O-N 3.14Å; A677-L713 HydrophobicContact CB-CD2 4.25Å
678	E	86.6	Confident	89.2	Confident	97 Å²	97	42.5 Å²	42.5	45%	0.453	21%	0.211	S	C	.	.	H	α-helix	trans	-52.6	-42.6	177.8	-60	-175.9	166.2	0	0	112.5	K633 S682	K633-E678 WeakPolarHBondContact CE-OE2 3.45Å; K633-E678 IonicContact NZ-OE1 3.59Å; K633-E678 IonicContact NZ-OE2 2.72Å; K633-E678 PolarHBondContact NZ-OE2 3.22Å; E678-S682 WeakPolarHBondContact O-CB 3.37Å; E678-S682 PolarHBondContact O-N 3.38Å; E678-S682 VanDerWaalsContact O-N 3.12Å; E678-S682 PolarHBondContact O-OG 2.69Å
679	T	89.4	Confident	88.8	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-48.2	178.1	-61.9	0	0	0	0	111.3	I628 V632 F674 S676 A677 L683	I628-T679 HydrophobicContact CG2-CG2 4.4Å; V632-T679 HydrophobicContact CG2-CG2 4.25Å; F674-T679 HydrophobicContact CB-CG2 4.14Å; F674-T679 HydrophobicContact CD1-CG2 3.91Å; F674-T679 HydrophobicContact CG-CG2 4.45Å; F674-T679 WeakPolarHBondContact O-CB 3.43Å; F674-T679 WeakPolarHBondContact O-CG2 3.27Å; S676-T679 PolarHBondContact O-N 2.68Å; S676-T679 WeakPolarHBondContact OG-CB 3.45Å; S676-T679 PolarHBondContact OG-N 2.78Å; S676-T679 PolarHBondContact OG-OG1 2.9Å; A677-T679 VanDerWaalsContact C-N 3.26Å; A677-T679 PolarHBondContact O-N 3.35Å; T679-L683 HydrophobicContact CG2-CD1 3.95Å; T679-L683 VanDerWaalsContact O-CG 3.29Å; T679-L683 WeakPolarHBondContact O-CG 3.38Å; T679-L683 PolarHBondContact O-N 2.78Å
680	Y	92.7	Very high	88.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-76.4	-29.3	-177	-67.2	-51.7	0	0	0	113.8	H675 S676 A677 L683 L684 F702 T705 I709 L713 I716	H675-Y680 AromaticContact ND1-CE2 3.65Å; S676-Y680 WeakPolarHBondContact O-CD2 3.2Å; S676-Y680 PolarHBondContact O-N 3.14Å; A677-Y680 PolarHBondContact O-N 3.32Å; Y680-L683 HydrophobicContact CD1-CD1 4.09Å; Y680-L683 PolarHBondContact O-N 2.99Å; Y680-L684 WeakPolarHBondContact O-CB 3.37Å; Y680-L684 WeakPolarHBondContact O-CG 3.18Å; Y680-L684 PolarHBondContact O-N 2.93Å; Y680-F702 AromaticContact CD1-CD1 3.78Å; Y680-F702 HydrophobicContact CD1-CD1 3.78Å; Y680-F702 AromaticContact CD1-CE1 3.4Å; Y680-F702 HydrophobicContact CD1-CE1 3.4Å; Y680-F702 VanDerWaalsContact CD1-CE1 3.4Å; Y680-F702 HydrophobicContact CD1-CZ 4.25Å; Y680-F702 HydrophobicContact CE1-CD1 4.14Å; Y680-F702 HydrophobicContact CE1-CE1 4.22Å; Y680-F702 HydrophobicContact CG-CE1 4.02Å; Y680-T705 WeakPolarHBondContact CE1-OG1 3.22Å; Y680-T705 WeakPolarHBondContact OH-CB 3.36Å; Y680-T705 PolarHBondContact OH-O 3.42Å; Y680-T705 PolarHBondContact OH-OG1 3.09Å; Y680-I709 HydrophobicContact CD1-CD1 3.93Å; Y680-I709 HydrophobicContact CD2-CD1 4.19Å; Y680-I709 HydrophobicContact CD2-CG1 4.12Å; Y680-I709 HydrophobicContact CE1-CD1 3.75Å; Y680-I709 HydrophobicContact CE1-CG1 4.41Å; Y680-I709 HydrophobicContact CE2-CD1 3.99Å; Y680-I709 HydrophobicContact CE2-CG1 3.77Å; Y680-I709 HydrophobicContact CG-CD1 4.15Å; Y680-L713 HydrophobicContact CD2-CD1 3.51Å; Y680-L713 HydrophobicContact CE2-CD1 3.87Å; Y680-I716 HydrophobicContact CG-CG2 4.37Å
681	E	91.5	Very high	88.4	Confident	97 Å²	97	48.1 Å²	48.1	45%	0.453	24%	0.24	S	C	.	.	H	α-helix	trans	-66.5	-42.2	173.6	-71	169.7	-174.1	0	0	110.8	A677 L684 Q685 I716	A677-E681 WeakPolarHBondContact O-CG 3.47Å; A677-E681 PolarHBondContact O-N 3.14Å; E681-L684 WeakPolarHBondContact O-CB 3.22Å; E681-L684 PolarHBondContact O-N 2.94Å; E681-Q685 PolarHBondContact O-N 2.96Å; E681-Q685 VanDerWaalsContact O-N 3.09Å; E681-I716 HydrophobicContact CG-CD1 3.49Å; E681-I716 VanDerWaalsContact CG-CD1 3.49Å
682	S	87.9	Confident	88.3	Confident	12 Å²	12	49.4 Å²	49.4	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-41.7	173	-53.2	0	0	0	0	112.4	V632 N636 E678 Q685 C686	V632-S682 VanDerWaalsContact CG1-OG 3.28Å; V632-S682 WeakPolarHBondContact CG1-OG 3.5Å; N636-S682 WeakPolarHBondContact ND2-CB 3.24Å; N636-S682 PolarHBondContact ND2-OG 2.72Å; N636-S682 WeakPolarHBondContact OD1-CB 3.15Å; E678-S682 WeakPolarHBondContact O-CB 3.37Å; E678-S682 PolarHBondContact O-N 3.38Å; E678-S682 VanDerWaalsContact O-N 3.12Å; E678-S682 PolarHBondContact O-OG 2.69Å; S682-Q685 WeakPolarHBondContact O-CB 3.28Å; S682-Q685 PolarHBondContact O-N 2.81Å; S682-C686 PolarHBondContact O-N 3.39Å; S682-C686 PolarHBondContact O-SG 3.43Å
683	L	90.3	Very high	88.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-31.3	174.6	-69.3	165.7	0	0	0	112.4	L660 T679 Y680 Q685 C686 L687 A698 I701 F702	L660-L683 HydrophobicContact CD1-CD2 4.1Å; T679-L683 HydrophobicContact CG2-CD1 3.95Å; T679-L683 VanDerWaalsContact O-CG 3.29Å; T679-L683 WeakPolarHBondContact O-CG 3.38Å; T679-L683 PolarHBondContact O-N 2.78Å; Y680-L683 HydrophobicContact CD1-CD1 4.09Å; Y680-L683 PolarHBondContact O-N 2.99Å; L683-Q685 VanDerWaalsContact C-N 3.29Å; L683-Q685 PolarHBondContact O-N 2.89Å; L683-C686 WeakPolarHBondContact O-CB 3.32Å; L683-C686 PolarHBondContact O-N 3.16Å; L683-L687 WeakPolarHBondContact O-CG 3.38Å; L683-L687 PolarHBondContact O-N 3.08Å; L683-L687 VanDerWaalsContact O-N 3.09Å; L683-A698 HydrophobicContact CD2-CB 4.48Å; L683-I701 HydrophobicContact CD1-CB 4.45Å; L683-I701 HydrophobicContact CD1-CG2 3.59Å; L683-I701 HydrophobicContact CD2-CB 4.44Å; L683-I701 HydrophobicContact CD2-CD1 3.87Å; L683-I701 HydrophobicContact CD2-CG2 4.25Å; L683-F702 HydrophobicContact CB-CD2 4.33Å; L683-F702 HydrophobicContact CB-CE1 4.46Å; L683-F702 HydrophobicContact CB-CE2 3.48Å; L683-F702 VanDerWaalsContact CB-CE2 3.48Å; L683-F702 HydrophobicContact CB-CZ 3.56Å
684	L	91.8	Very high	88.1	Confident	11 Å²	11	51.1 Å²	51.1	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-31.3	170.9	-78.2	172.4	0	0	0	112.2	Y680 E681 L687 F702 I716 T719 L720 I723	Y680-L684 WeakPolarHBondContact O-CB 3.37Å; Y680-L684 WeakPolarHBondContact O-CG 3.18Å; Y680-L684 PolarHBondContact O-N 2.93Å; E681-L684 WeakPolarHBondContact O-CB 3.22Å; E681-L684 PolarHBondContact O-N 2.94Å; L684-L687 HydrophobicContact CD2-CD1 4.29Å; L684-F702 HydrophobicContact CD2-CZ 4.17Å; L684-F702 HydrophobicContact CG-CZ 3.98Å; L684-I716 HydrophobicContact CD1-CD1 4.01Å; L684-I716 HydrophobicContact CD1-CG2 4.15Å; L684-T719 HydrophobicContact CD1-CG2 3.93Å; L684-T719 HydrophobicContact CD2-CG2 4.13Å; L684-L720 HydrophobicContact CD2-CB 4.16Å; L684-L720 HydrophobicContact CD2-CD1 4.08Å; L684-I723 HydrophobicContact CD2-CD1 4.1Å
685	Q	86.9	Confident	88	Confident	84 Å²	84	51.1 Å²	51.1	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-70	-44.7	171.8	-177.6	169.9	-20.3	0	0	111.1	E681 S682 L683 L687 R688	E681-Q685 PolarHBondContact O-N 2.96Å; E681-Q685 VanDerWaalsContact O-N 3.09Å; S682-Q685 WeakPolarHBondContact O-CB 3.28Å; S682-Q685 PolarHBondContact O-N 2.81Å; L683-Q685 VanDerWaalsContact C-N 3.29Å; L683-Q685 PolarHBondContact O-N 2.89Å; Q685-L687 VanDerWaalsContact C-N 3.26Å; Q685-L687 PolarHBondContact O-N 3.09Å; Q685-R688 WeakPolarHBondContact O-CB 3.46Å; Q685-R688 PolarHBondContact O-N 2.94Å
686	C	86.6	Confident	88	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-56.6	-37.4	174.7	-61.9	0	0	0	0	112.8	M635 S682 L683 R688 M689 V694 A698	M635-C686 WeakPolarHBondContact CE-SG 3.11Å; S682-C686 PolarHBondContact O-N 3.39Å; S682-C686 PolarHBondContact O-SG 3.43Å; L683-C686 WeakPolarHBondContact O-CB 3.32Å; L683-C686 PolarHBondContact O-N 3.16Å; C686-R688 PolarHBondContact O-N 3.41Å; C686-M689 PolarHBondContact O-N 3.16Å; C686-V694 HydrophobicContact CB-CG1 4.27Å; C686-A698 HydrophobicContact CB-CB 3.99Å
687	L	88.6	Confident	88.3	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.2	176.3	-72.2	178.7	0	0	0	114.8	L683 L684 Q685 A698 I699 F702 L720 I723	L683-L687 WeakPolarHBondContact O-CG 3.38Å; L683-L687 PolarHBondContact O-N 3.08Å; L683-L687 VanDerWaalsContact O-N 3.09Å; L684-L687 HydrophobicContact CD2-CD1 4.29Å; Q685-L687 VanDerWaalsContact C-N 3.26Å; Q685-L687 PolarHBondContact O-N 3.09Å; L687-A698 HydrophobicContact CD2-CB 3.7Å; L687-A698 HydrophobicContact CG-CB 4.06Å; L687-I699 HydrophobicContact CD2-CB 4.4Å; L687-I699 HydrophobicContact CD2-CD1 4.33Å; L687-I699 HydrophobicContact CD2-CG1 3.38Å; L687-F702 HydrophobicContact CD1-CD2 3.86Å; L687-F702 HydrophobicContact CD1-CE2 3.5Å; L687-F702 VanDerWaalsContact CD1-CE2 3.5Å; L687-F702 HydrophobicContact CD1-CZ 4.45Å; L687-F702 HydrophobicContact CG-CD2 4.44Å; L687-F702 HydrophobicContact CG-CE2 4.07Å; L687-L720 HydrophobicContact CD1-CD1 3.61Å; L687-I723 HydrophobicContact CB-CG2 4.07Å; L687-I723 HydrophobicContact CD1-CG2 4.13Å
688	R	84.7	Confident	88.5	Confident	173 Å²	173	46.9 Å²	46.9	65%	0.653	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-7.4	-179.9	-61.8	173.7	-175.7	179.4	2	113.3	Q685 C686	Q685-R688 WeakPolarHBondContact O-CB 3.46Å; Q685-R688 PolarHBondContact O-N 2.94Å; C686-R688 PolarHBondContact O-N 3.41Å
689	M	83.3	Confident	88.9	Confident	52 Å²	52	42.2 Å²	42.2	26%	0.256	20%	0.196	S	C	.	.	S	Bend	trans	-69.2	153.4	175.8	-62.4	179.2	71.7	0	0	111.1	I639 I656 C686 V694	I639-M689 HydrophobicContact CD1-SD 3.86Å; I639-M689 HydrophobicContact CG1-CE 4.11Å; I639-M689 HydrophobicContact CG1-SD 4.1Å; I639-M689 HydrophobicContact CG2-CE 4.34Å; I639-M689 HydrophobicContact CG2-SD 4.34Å; I656-M689 HydrophobicContact CG2-CE 4.42Å; C686-M689 PolarHBondContact O-N 3.16Å; M689-V694 HydrophobicContact CB-CG1 4.18Å; M689-V694 HydrophobicContact SD-CG1 3.84Å
690	E	82.4	Confident	89.2	Confident	192 Å²	192	44.6 Å²	44.6	90%	0.897	21%	0.207	S	C	*	.	S	Bend	trans	-76.2	-21.6	-178.9	-59.6	-168.4	154.3	0	0	113.2	D692	E690-D692 PolarHBondContact O-N 3.4Å
691	D	85.6	Confident	89.3	Confident	36 Å²	36	44.6 Å²	44.6	19%	0.193	21%	0.207	C	C	.	.			trans	-66.5	115	176.1	-177.1	-52.3	0	0	0	111.1	R657 K693 V694 A695	R657-D691 IonicContact CZ-OD2 2.8Å; R657-D691 IonicContact NE-OD2 2.73Å; R657-D691 PolarHBondContact NE-OD2 3.2Å; R657-D691 IonicContact NH2-OD2 2.73Å; R657-D691 PolarHBondContact NH2-OD2 3.28Å; D691-K693 VanDerWaalsContact C-N 3.31Å; D691-K693 PolarHBondContact O-N 3.16Å; D691-K693 WeakPolarHBondContact OD1-CA 3.32Å; D691-K693 WeakPolarHBondContact OD1-CB 3.34Å; D691-K693 PolarHBondContact OD1-N 3.32Å; D691-V694 HydrophobicContact CB-CB 3.91Å; D691-V694 HydrophobicContact CB-CG2 3.87Å; D691-V694 WeakPolarHBondContact O-CB 3.11Å; D691-V694 PolarHBondContact O-N 2.86Å; D691-V694 PolarHBondContact OD1-N 3.12Å; D691-A695 PolarHBondContact O-N 3Å
692	D	88.3	Confident	89.5	Confident	76 Å²	76	40 Å²	40	41%	0.406	19%	0.186	S	C	.	.	H	α-helix	trans	-67.9	-28.3	-174.9	-88	-36.5	0	0	0	114.2	E690 E696 T732 Q735	E690-D692 PolarHBondContact O-N 3.4Å; D692-E696 PolarHBondContact O-N 3.08Å; D692-T732 HydrophobicContact CB-CG2 3.9Å; D692-T732 WeakPolarHBondContact OD2-CG2 3.49Å; D692-Q735 VanDerWaalsContact CA-NE2 3.28Å; D692-Q735 PolarHBondContact O-NE2 3.46Å; D692-Q735 PolarHBondContact OD1-NE2 2.86Å
693	K	86.8	Confident	89.8	Confident	103 Å²	103	42.6 Å²	42.6	45%	0.448	19%	0.194	S	C	.	.	H	α-helix	trans	-75.7	-40.4	177.9	-55.7	-82.6	-179.6	167.9	0	109.7	D691 E696 A697 E1196	D691-K693 VanDerWaalsContact C-N 3.31Å; D691-K693 PolarHBondContact O-N 3.16Å; D691-K693 WeakPolarHBondContact OD1-CA 3.32Å; D691-K693 WeakPolarHBondContact OD1-CB 3.34Å; D691-K693 PolarHBondContact OD1-N 3.32Å; K693-E696 PolarHBondContact O-N 3.01Å; K693-A697 WeakPolarHBondContact O-CB 3.45Å; K693-A697 PolarHBondContact O-N 3.04Å; K693-E1196 IonicContact NZ-OE1 3.86Å; K693-E1196 PolarHBondContact NZ-OE1 3.12Å; K693-E1196 IonicContact NZ-OE2 2.67Å; K693-E1196 PolarHBondContact NZ-OE2 3.25Å
694	V	88.1	Confident	90	Very high	5 Å²	5	44 Å²	44	3%	0.03	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-51.4	171.9	163.6	0	0	0	0	110.4	I656 R657 L660 C686 M689 D691 E696 A697 A698	I656-V694 HydrophobicContact CG2-CG2 4.43Å; R657-V694 HydrophobicContact CG-CG2 4.33Å; L660-V694 HydrophobicContact CD2-CB 4.04Å; L660-V694 HydrophobicContact CD2-CG1 3.79Å; L660-V694 HydrophobicContact CD2-CG2 4.19Å; L660-V694 WeakPolarHBondContact CD2-O 3.36Å; C686-V694 HydrophobicContact CB-CG1 4.27Å; M689-V694 HydrophobicContact CB-CG1 4.18Å; M689-V694 HydrophobicContact SD-CG1 3.84Å; D691-V694 HydrophobicContact CB-CB 3.91Å; D691-V694 HydrophobicContact CB-CG2 3.87Å; D691-V694 WeakPolarHBondContact O-CB 3.11Å; D691-V694 PolarHBondContact O-N 2.86Å; D691-V694 PolarHBondContact OD1-N 3.12Å; V694-E696 VanDerWaalsContact C-N 3.34Å; V694-E696 PolarHBondContact O-N 3.36Å; V694-A697 PolarHBondContact O-N 3.41Å; V694-A698 WeakPolarHBondContact O-CB 3.17Å; V694-A698 PolarHBondContact O-N 3.3Å
695	A	90.1	Very high	90.1	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-34	177	0	0	0	0	0	113	D691 I699	D691-A695 PolarHBondContact O-N 3Å; A695-I699 WeakPolarHBondContact O-CD1 3.28Å; A695-I699 VanDerWaalsContact O-CG1 3.24Å; A695-I699 WeakPolarHBondContact O-CG1 3.39Å; A695-I699 PolarHBondContact O-N 3.22Å
696	E	91.8	Very high	90.4	Very high	32 Å²	32	40 Å²	40	15%	0.15	18%	0.183	C	C	.	.	H	α-helix	trans	-64.7	-49.8	172.7	-171.3	-175	178.2	0	0	111.9	D692 K693 V694 A698 I699 Q700 H734 Q735 Q738	D692-E696 PolarHBondContact O-N 3.08Å; K693-E696 PolarHBondContact O-N 3.01Å; V694-E696 VanDerWaalsContact C-N 3.34Å; V694-E696 PolarHBondContact O-N 3.36Å; E696-A698 VanDerWaalsContact C-N 3.33Å; E696-A698 PolarHBondContact O-N 3.41Å; E696-I699 PolarHBondContact O-N 2.91Å; E696-Q700 PolarHBondContact O-N 3.15Å; E696-H734 HydrophobicContact CG-CB 4.46Å; E696-H734 VanDerWaalsContact OE2-CB 3.22Å; E696-H734 WeakPolarHBondContact OE2-CB 2.97Å; E696-H734 IonicContact OE2-CG 2.76Å; E696-Q735 HydrophobicContact CB-CG 4.19Å; E696-Q738 HydrophobicContact CG-CG 3.57Å; E696-Q738 WeakPolarHBondContact OE1-CG 3.46Å; E696-Q738 PolarHBondContact OE1-NE2 2.95Å
697	A	92.1	Very high	90.6	Very high	8 Å²	8	45.8 Å²	45.8	7%	0.066	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-41.3	-177.5	0	0	0	0	0	111.7	L660 K664 K693 V694 Q700 I701	L660-A697 HydrophobicContact CD2-CB 3.78Å; L660-A697 HydrophobicContact CG-CB 3.88Å; K664-A697 HydrophobicContact CD-CB 3.92Å; K664-A697 HydrophobicContact CG-CB 4.5Å; K693-A697 WeakPolarHBondContact O-CB 3.45Å; K693-A697 PolarHBondContact O-N 3.04Å; V694-A697 PolarHBondContact O-N 3.41Å; A697-Q700 PolarHBondContact O-N 2.95Å; A697-Q700 VanDerWaalsContact O-N 3.15Å; A697-I701 WeakPolarHBondContact O-CG1 3.45Å; A697-I701 PolarHBondContact O-N 2.88Å
698	A	93.8	Very high	90.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-44.7	174.2	0	0	0	0	0	112.6	L683 C686 L687 V694 E696 Q700 I701 F702	L683-A698 HydrophobicContact CD2-CB 4.48Å; C686-A698 HydrophobicContact CB-CB 3.99Å; L687-A698 HydrophobicContact CD2-CB 3.7Å; L687-A698 HydrophobicContact CG-CB 4.06Å; V694-A698 WeakPolarHBondContact O-CB 3.17Å; V694-A698 PolarHBondContact O-N 3.3Å; E696-A698 VanDerWaalsContact C-N 3.33Å; E696-A698 PolarHBondContact O-N 3.41Å; A698-Q700 VanDerWaalsContact C-N 3.26Å; A698-Q700 PolarHBondContact O-N 2.85Å; A698-I701 PolarHBondContact O-N 3.2Å; A698-F702 VanDerWaalsContact O-CD2 3.26Å; A698-F702 WeakPolarHBondContact O-CD2 3.48Å; A698-F702 PolarHBondContact O-N 2.93Å
699	I	95	Very high	91	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-39.2	174	-60.3	163.3	0	0	0	110.6	L687 A695 E696 F702 R703 L724 K727 Q735 Q738 A739 C742	L687-I699 HydrophobicContact CD2-CB 4.4Å; L687-I699 HydrophobicContact CD2-CD1 4.33Å; L687-I699 HydrophobicContact CD2-CG1 3.38Å; A695-I699 WeakPolarHBondContact O-CD1 3.28Å; A695-I699 VanDerWaalsContact O-CG1 3.24Å; A695-I699 WeakPolarHBondContact O-CG1 3.39Å; A695-I699 PolarHBondContact O-N 3.22Å; E696-I699 PolarHBondContact O-N 2.91Å; I699-F702 PolarHBondContact O-N 3.44Å; I699-R703 WeakPolarHBondContact O-CB 3.44Å; I699-R703 PolarHBondContact O-N 3.01Å; I699-L724 HydrophobicContact CG1-CD2 4.07Å; I699-L724 HydrophobicContact CG2-CD2 3.85Å; I699-K727 HydrophobicContact CD1-CB 4.18Å; I699-K727 HydrophobicContact CD1-CG 4.32Å; I699-Q735 HydrophobicContact CD1-CB 4.12Å; I699-Q735 HydrophobicContact CD1-CG 4.37Å; I699-Q738 HydrophobicContact CB-CB 4.01Å; I699-Q738 VanDerWaalsContact CG2-C 3.5Å; I699-Q738 HydrophobicContact CG2-CB 3.57Å; I699-A739 HydrophobicContact CD1-CB 4.39Å; I699-C742 HydrophobicContact CG2-CB 3.77Å
700	Q	94.9	Very high	91.3	Very high	51 Å²	51	42.1 Å²	42.1	24%	0.238	20%	0.197	C	C	.	.	H	α-helix	trans	-70.3	-33.3	-179.8	-168.5	165.3	4	0	0	112.8	K664 E696 A697 A698 N704	K664-Q700 HydrophobicContact CD-CB 4.45Å; K664-Q700 HydrophobicContact CG-CB 4.38Å; K664-Q700 HydrophobicContact CG-CG 4.39Å; E696-Q700 PolarHBondContact O-N 3.15Å; A697-Q700 PolarHBondContact O-N 2.95Å; A697-Q700 VanDerWaalsContact O-N 3.15Å; A698-Q700 VanDerWaalsContact C-N 3.26Å; A698-Q700 PolarHBondContact O-N 2.85Å; Q700-N704 PolarHBondContact O-N 2.94Å; Q700-N704 PolarHBondContact O-ND2 3.32Å; Q700-N704 PolarHBondContact O-OD1 2.86Å
701	I	95.2	Very high	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.6	-53.1	170.3	-66.3	159.6	0	0	0	109.9	L660 L663 K664 F674 L683 A697 A698 R703 N704 T705	L660-I701 HydrophobicContact CD1-CD1 3.57Å; L660-I701 HydrophobicContact CG-CD1 4.32Å; L663-I701 HydrophobicContact CB-CD1 3.78Å; K664-I701 HydrophobicContact CB-CD1 4.45Å; K664-I701 HydrophobicContact CB-CG1 4.23Å; K664-I701 HydrophobicContact CG-CG1 4.48Å; F674-I701 HydrophobicContact CD1-CG2 3.75Å; F674-I701 HydrophobicContact CE1-CG2 3.78Å; L683-I701 HydrophobicContact CD1-CB 4.45Å; L683-I701 HydrophobicContact CD1-CG2 3.59Å; L683-I701 HydrophobicContact CD2-CB 4.44Å; L683-I701 HydrophobicContact CD2-CD1 3.87Å; L683-I701 HydrophobicContact CD2-CG2 4.25Å; A697-I701 WeakPolarHBondContact O-CG1 3.45Å; A697-I701 PolarHBondContact O-N 2.88Å; A698-I701 PolarHBondContact O-N 3.2Å; I701-R703 VanDerWaalsContact C-N 3.26Å; I701-R703 PolarHBondContact O-N 3.3Å; I701-N704 PolarHBondContact O-N 3.49Å; I701-T705 HydrophobicContact CG2-CG2 4.37Å; I701-T705 WeakPolarHBondContact O-CG2 2.9Å; I701-T705 PolarHBondContact O-N 3.3Å; I701-T705 VanDerWaalsContact O-N 3.11Å; I701-T705 PolarHBondContact O-OG1 3.05Å
702	F	95.6	Very high	92.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-51.2	-45.5	176	-85.7	-67.4	0	0	0	112.2	Y680 L683 L684 L687 A698 I699 N704 T705 G706 I709 I716 L720 I746	Y680-F702 AromaticContact CD1-CD1 3.78Å; Y680-F702 HydrophobicContact CD1-CD1 3.78Å; Y680-F702 AromaticContact CD1-CE1 3.4Å; Y680-F702 HydrophobicContact CD1-CE1 3.4Å; Y680-F702 VanDerWaalsContact CD1-CE1 3.4Å; Y680-F702 HydrophobicContact CD1-CZ 4.25Å; Y680-F702 HydrophobicContact CE1-CD1 4.14Å; Y680-F702 HydrophobicContact CE1-CE1 4.22Å; Y680-F702 HydrophobicContact CG-CE1 4.02Å; L683-F702 HydrophobicContact CB-CD2 4.33Å; L683-F702 HydrophobicContact CB-CE1 4.46Å; L683-F702 HydrophobicContact CB-CE2 3.48Å; L683-F702 VanDerWaalsContact CB-CE2 3.48Å; L683-F702 HydrophobicContact CB-CZ 3.56Å; L684-F702 HydrophobicContact CD2-CZ 4.17Å; L684-F702 HydrophobicContact CG-CZ 3.98Å; L687-F702 HydrophobicContact CD1-CD2 3.86Å; L687-F702 HydrophobicContact CD1-CE2 3.5Å; L687-F702 VanDerWaalsContact CD1-CE2 3.5Å; L687-F702 HydrophobicContact CD1-CZ 4.45Å; L687-F702 HydrophobicContact CG-CD2 4.44Å; L687-F702 HydrophobicContact CG-CE2 4.07Å; A698-F702 VanDerWaalsContact O-CD2 3.26Å; A698-F702 WeakPolarHBondContact O-CD2 3.48Å; A698-F702 PolarHBondContact O-N 2.93Å; I699-F702 PolarHBondContact O-N 3.44Å; F702-N704 VanDerWaalsContact C-N 3.31Å; F702-N704 PolarHBondContact O-N 3.2Å; F702-T705 PolarHBondContact O-N 2.98Å; F702-G706 VanDerWaalsContact O-CA 3.25Å; F702-G706 WeakPolarHBondContact O-CA 3.22Å; F702-G706 PolarHBondContact O-N 2.76Å; F702-I709 HydrophobicContact CD1-CD1 3.71Å; F702-I709 HydrophobicContact CE1-CD1 4.03Å; F702-I716 HydrophobicContact CE1-CG2 4.2Å; F702-L720 HydrophobicContact CD1-CD1 4.41Å; F702-L720 HydrophobicContact CD1-CD2 3.8Å; F702-L720 HydrophobicContact CD2-CD1 4.08Å; F702-L720 HydrophobicContact CE1-CD1 4.44Å; F702-L720 HydrophobicContact CE1-CD2 4.14Å; F702-L720 HydrophobicContact CE2-CD1 4.12Å; F702-L720 HydrophobicContact CG-CD1 4.25Å; F702-L720 HydrophobicContact CG-CD2 4.17Å; F702-L720 HydrophobicContact CZ-CD1 4.31Å; F702-I746 HydrophobicContact CB-CD1 4.31Å; F702-I746 WeakPolarHBondContact O-CD1 3.28Å
703	R	94.5	Very high	92.3	Very high	67 Å²	67	37.3 Å²	37.3	25%	0.253	18%	0.182	S	C	.	.	H	α-helix	trans	-60.1	-36.8	177.8	176.8	-168.5	166.1	173	5.7	113.4	I699 I701 H741 C742 A745	I699-R703 WeakPolarHBondContact O-CB 3.44Å; I699-R703 PolarHBondContact O-N 3.01Å; I701-R703 VanDerWaalsContact C-N 3.26Å; I701-R703 PolarHBondContact O-N 3.3Å; R703-H741 PolarHBondContact NH2-ND1 2.91Å; R703-C742 HydrophobicContact CB-CB 4.12Å; R703-A745 HydrophobicContact CG-CB 4.24Å
704	N	94	Very high	92.6	Very high	29 Å²	29	35.8 Å²	35.8	16%	0.155	18%	0.182	C	C	.	.	H	α-helix	trans	-83.6	-24.3	-174.8	-68.2	-15.9	0	0	0	113.3	S667 Q700 I701 F702	S667-N704 PolarHBondContact OG-ND2 3.26Å; Q700-N704 PolarHBondContact O-N 2.94Å; Q700-N704 PolarHBondContact O-ND2 3.32Å; Q700-N704 PolarHBondContact O-OD1 2.86Å; I701-N704 PolarHBondContact O-N 3.49Å; F702-N704 VanDerWaalsContact C-N 3.31Å; F702-N704 PolarHBondContact O-N 3.2Å
705	T	94.4	Very high	92.8	Very high	10 Å²	10	39.9 Å²	39.9	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-116.5	-27.6	-171.7	69.3	0	0	0	0	113	P671 F674 Y680 I701 F702 H707	P671-T705 HydrophobicContact CB-CG2 4.19Å; F674-T705 HydrophobicContact CB-CG2 3.7Å; F674-T705 HydrophobicContact CD1-CG2 4.29Å; F674-T705 HydrophobicContact CD2-CG2 3.98Å; F674-T705 HydrophobicContact CG-CG2 3.74Å; Y680-T705 WeakPolarHBondContact CE1-OG1 3.22Å; Y680-T705 WeakPolarHBondContact OH-CB 3.36Å; Y680-T705 PolarHBondContact OH-O 3.42Å; Y680-T705 PolarHBondContact OH-OG1 3.09Å; I701-T705 HydrophobicContact CG2-CG2 4.37Å; I701-T705 WeakPolarHBondContact O-CG2 2.9Å; I701-T705 PolarHBondContact O-N 3.3Å; I701-T705 VanDerWaalsContact O-N 3.11Å; I701-T705 PolarHBondContact O-OG1 3.05Å; F702-T705 PolarHBondContact O-N 2.98Å; T705-H707 PolarHBondContact O-N 3.3Å
706	G	92.4	Very high	93	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-74.9	9.2	-163.7	0	0	0	0	0	116.9	F702 K708 I709 I746	F702-G706 VanDerWaalsContact O-CA 3.25Å; F702-G706 WeakPolarHBondContact O-CA 3.22Å; F702-G706 PolarHBondContact O-N 2.76Å; G706-K708 PolarHBondContact O-N 3.46Å; G706-I709 VanDerWaalsContact CA-CD1 3.45Å; G706-I709 WeakPolarHBondContact O-CB 3.43Å; G706-I709 PolarHBondContact O-N 3.29Å; G706-I746 WeakPolarHBondContact O-CG2 3.31Å
707	H	90	Very high	93.1	Very high	123 Å²	123	41.8 Å²	41.8	57%	0.569	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-58.2	-13.3	-176.2	-58.6	-52.5	0	0	0	115.1	T705 A745	T705-H707 PolarHBondContact O-N 3.3Å; H707-A745 PolarHBondContact ND1-O 3.02Å
708	K	90.5	Very high	93.1	Very high	121 Å²	121	44.8 Å²	44.8	53%	0.526	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-113	3.1	174.7	-73.1	-169.6	171.5	-162	0	114.7	H675 G706 E710 T711 D712	H675-K708 WeakPolarHBondContact CE1-CB 3.32Å; G706-K708 PolarHBondContact O-N 3.46Å; K708-E710 VanDerWaalsContact C-N 3.29Å; K708-E710 PolarHBondContact O-N 2.82Å; K708-T711 PolarHBondContact O-N 2.87Å; K708-T711 PolarHBondContact O-OG1 3.37Å; K708-T711 VanDerWaalsContact O-OG1 3.11Å; K708-D712 WeakPolarHBondContact O-CB 3.46Å; K708-D712 PolarHBondContact O-N 3.26Å
709	I	92.4	Very high	93.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-36.8	-178.5	-72.4	171.9	0	0	0	111.3	Y680 F702 G706 L713 I716 R717 I746	Y680-I709 HydrophobicContact CD1-CD1 3.93Å; Y680-I709 HydrophobicContact CD2-CD1 4.19Å; Y680-I709 HydrophobicContact CD2-CG1 4.12Å; Y680-I709 HydrophobicContact CE1-CD1 3.75Å; Y680-I709 HydrophobicContact CE1-CG1 4.41Å; Y680-I709 HydrophobicContact CE2-CD1 3.99Å; Y680-I709 HydrophobicContact CE2-CG1 3.77Å; Y680-I709 HydrophobicContact CG-CD1 4.15Å; F702-I709 HydrophobicContact CD1-CD1 3.71Å; F702-I709 HydrophobicContact CE1-CD1 4.03Å; G706-I709 VanDerWaalsContact CA-CD1 3.45Å; G706-I709 WeakPolarHBondContact O-CB 3.43Å; G706-I709 PolarHBondContact O-N 3.29Å; I709-L713 CarbonylContact O-C 3.15Å; I709-L713 WeakPolarHBondContact O-CA 3.5Å; I709-L713 PolarHBondContact O-N 2.88Å; I709-I716 HydrophobicContact CD1-CG2 4.35Å; I709-I716 HydrophobicContact CG2-CB 4Å; I709-I716 HydrophobicContact CG2-CG2 3.87Å; I709-R717 HydrophobicContact CG2-CB 4.03Å; I709-I746 HydrophobicContact CB-CG2 4.25Å
710	E	90.1	Very high	93.2	Very high	31 Å²	31	47.4 Å²	47.4	15%	0.145	24%	0.244	C	C	.	.	H	α-helix	trans	-70.3	-31	179.8	-179.7	158.9	-106	0	0	113.6	K708 R717 T748	K708-E710 VanDerWaalsContact C-N 3.29Å; K708-E710 PolarHBondContact O-N 2.82Å; E710-R717 HydrophobicContact CB-CG 4.43Å; E710-R717 HydrophobicContact CG-CG 4.5Å; E710-R717 IonicContact OE1-CZ 2.79Å; E710-R717 IonicContact OE1-NE 2.72Å; E710-R717 PolarHBondContact OE1-NE 2.83Å; E710-R717 IonicContact OE1-NH2 3.31Å; E710-R717 PolarHBondContact OE1-NH2 3Å; E710-T748 VanDerWaalsContact OE2-CB 3.26Å; E710-T748 WeakPolarHBondContact OE2-CB 3.49Å; E710-T748 VanDerWaalsContact OE2-CG2 3.29Å; E710-T748 WeakPolarHBondContact OE2-CG2 3.39Å; E710-T748 PolarHBondContact OE2-N 3.28Å; E710-T748 PolarHBondContact OE2-OG1 3.22Å
711	T	90.6	Very high	93.2	Very high	106 Å²	106	46.1 Å²	46.1	65%	0.65	24%	0.238	S	C	*	.	H	α-helix	trans	-86.5	-41.7	178.6	50.9	0	0	0	0	112.7	K708	K708-T711 PolarHBondContact O-N 2.87Å; K708-T711 PolarHBondContact O-OG1 3.37Å; K708-T711 VanDerWaalsContact O-OG1 3.11Å
712	D	92.9	Very high	93.2	Very high	77 Å²	77	49.8 Å²	49.8	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-102.8	-23.9	-165.4	-57.1	13.7	0	0	0	112.4	H675 K708	H675-D712 IonicContact CD2-OD2 2.7Å; H675-D712 IonicContact CE1-OD2 2.62Å; H675-D712 IonicContact NE2-OD2 3.7Å; H675-D712 PolarHBondContact NE2-OD2 3.11Å; K708-D712 WeakPolarHBondContact O-CB 3.46Å; K708-D712 PolarHBondContact O-N 3.26Å
713	L	93.7	Very high	93.2	Very high	21 Å²	21	50.7 Å²	50.7	11%	0.11	27%	0.266	C	S	.	.			trans	-138.5	62.3	-169.4	-64.3	174.4	0	0	0	112.9	A677 Y680 I709 Q715 I716 R717	A677-L713 HydrophobicContact CB-CD2 4.25Å; Y680-L713 HydrophobicContact CD2-CD1 3.51Å; Y680-L713 HydrophobicContact CE2-CD1 3.87Å; I709-L713 CarbonylContact O-C 3.15Å; I709-L713 WeakPolarHBondContact O-CA 3.5Å; I709-L713 PolarHBondContact O-N 2.88Å; L713-Q715 VanDerWaalsContact C-OE1 3.29Å; L713-Q715 PolarHBondContact O-N 2.91Å; L713-Q715 VanDerWaalsContact O-N 3.13Å; L713-I716 HydrophobicContact CB-CB 4.14Å; L713-I716 HydrophobicContact CB-CG1 3.86Å; L713-I716 HydrophobicContact CD1-CG1 4.35Å; L713-I716 WeakPolarHBondContact O-CB 3.34Å; L713-I716 PolarHBondContact O-N 2.85Å; L713-R717 PolarHBondContact O-N 3.05Å; L713-R717 VanDerWaalsContact O-N 3.14Å
714	P	91.7	Very high	93.3	Very high	71 Å²	71	47.5 Å²	47.5	46%	0.461	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-23.8	-173.8	25.4	-35.5	0	0	0	114.7	S718	P714-S718 WeakPolarHBondContact O-CB 3.2Å; P714-S718 PolarHBondContact O-N 3.25Å; P714-S718 PolarHBondContact O-OG 3.32Å
715	Q	93.2	Very high	93.4	Very high	90 Å²	90	47.5 Å²	47.5	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-69.3	-39.6	173.8	73.1	-74.1	10.5	0	0	112.4	L713 S718 T719	L713-Q715 VanDerWaalsContact C-OE1 3.29Å; L713-Q715 PolarHBondContact O-N 2.91Å; L713-Q715 VanDerWaalsContact O-N 3.13Å; Q715-S718 PolarHBondContact O-N 3.35Å; Q715-T719 PolarHBondContact O-N 3.3Å; Q715-T719 PolarHBondContact O-OG1 3.36Å
716	I	94.1	Very high	93.5	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.015	28%	0.279	C	S	.	.	H	α-helix	trans	-67.6	-49	175.6	-54.8	-57	0	0	0	109.4	Y680 E681 L684 F702 I709 L713 S718 T719 L720	Y680-I716 HydrophobicContact CG-CG2 4.37Å; E681-I716 HydrophobicContact CG-CD1 3.49Å; E681-I716 VanDerWaalsContact CG-CD1 3.49Å; L684-I716 HydrophobicContact CD1-CD1 4.01Å; L684-I716 HydrophobicContact CD1-CG2 4.15Å; F702-I716 HydrophobicContact CE1-CG2 4.2Å; I709-I716 HydrophobicContact CD1-CG2 4.35Å; I709-I716 HydrophobicContact CG2-CB 4Å; I709-I716 HydrophobicContact CG2-CG2 3.87Å; L713-I716 HydrophobicContact CB-CB 4.14Å; L713-I716 HydrophobicContact CB-CG1 3.86Å; L713-I716 HydrophobicContact CD1-CG1 4.35Å; L713-I716 WeakPolarHBondContact O-CB 3.34Å; L713-I716 PolarHBondContact O-N 2.85Å; I716-S718 VanDerWaalsContact C-N 3.29Å; I716-S718 PolarHBondContact O-N 3.24Å; I716-T719 PolarHBondContact O-N 2.99Å; I716-T719 VanDerWaalsContact O-N 3.14Å; I716-L720 VanDerWaalsContact O-CB 3.24Å; I716-L720 WeakPolarHBondContact O-CB 3.24Å; I716-L720 PolarHBondContact O-N 2.92Å
717	R	93.4	Very high	93.6	Very high	69 Å²	69	54.4 Å²	54.4	26%	0.26	29%	0.285	S	S	.	.	H	α-helix	trans	-48.2	-50.2	173.8	-178.9	-148.1	-177.9	-139.6	10.4	111.9	I709 E710 L713 T719 L720 I721 F747	I709-R717 HydrophobicContact CG2-CB 4.03Å; E710-R717 HydrophobicContact CB-CG 4.43Å; E710-R717 HydrophobicContact CG-CG 4.5Å; E710-R717 IonicContact OE1-CZ 2.79Å; E710-R717 IonicContact OE1-NE 2.72Å; E710-R717 PolarHBondContact OE1-NE 2.83Å; E710-R717 IonicContact OE1-NH2 3.31Å; E710-R717 PolarHBondContact OE1-NH2 3Å; L713-R717 PolarHBondContact O-N 3.05Å; L713-R717 VanDerWaalsContact O-N 3.14Å; R717-T719 VanDerWaalsContact C-N 3.32Å; R717-T719 PolarHBondContact O-N 3.47Å; R717-L720 PolarHBondContact O-N 3.36Å; R717-I721 HydrophobicContact CG-CD1 4.2Å; R717-I721 WeakPolarHBondContact O-CG1 3.37Å; R717-I721 PolarHBondContact O-N 2.99Å; R717-F747 HydrophobicContact CG-CD1 4.06Å; R717-F747 HydrophobicContact CG-CE1 3.76Å
718	S	92.8	Very high	93.9	Very high	72 Å²	72	48.6 Å²	48.6	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-67.1	-32.4	-175.9	-57.1	0	0	0	0	112.8	P714 Q715 I716 P722	P714-S718 WeakPolarHBondContact O-CB 3.2Å; P714-S718 PolarHBondContact O-N 3.25Å; P714-S718 PolarHBondContact O-OG 3.32Å; Q715-S718 PolarHBondContact O-N 3.35Å; I716-S718 VanDerWaalsContact C-N 3.29Å; I716-S718 PolarHBondContact O-N 3.24Å; S718-P722 VanDerWaalsContact O-CD 3.29Å; S718-P722 WeakPolarHBondContact O-CD 3.37Å
719	T	95.1	Very high	94.2	Very high	55 Å²	55	45.3 Å²	45.3	34%	0.337	24%	0.244	S	C	.	.	H	α-helix	trans	-80	-32.4	176.1	-51.1	0	0	0	0	112.3	L684 Q715 I716 R717 I723	L684-T719 HydrophobicContact CD1-CG2 3.93Å; L684-T719 HydrophobicContact CD2-CG2 4.13Å; Q715-T719 PolarHBondContact O-N 3.3Å; Q715-T719 PolarHBondContact O-OG1 3.36Å; I716-T719 PolarHBondContact O-N 2.99Å; I716-T719 VanDerWaalsContact O-N 3.14Å; R717-T719 VanDerWaalsContact C-N 3.32Å; R717-T719 PolarHBondContact O-N 3.47Å; T719-I723 HydrophobicContact CG2-CD1 4.47Å; T719-I723 WeakPolarHBondContact O-CD1 3.43Å
720	L	95.3	Very high	94.2	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-75.1	-40.2	-175	-176.6	60.9	0	0	0	113	L684 L687 F702 I716 R717 I723 L724 I746 F747	L684-L720 HydrophobicContact CD2-CB 4.16Å; L684-L720 HydrophobicContact CD2-CD1 4.08Å; L687-L720 HydrophobicContact CD1-CD1 3.61Å; F702-L720 HydrophobicContact CD1-CD1 4.41Å; F702-L720 HydrophobicContact CD1-CD2 3.8Å; F702-L720 HydrophobicContact CD2-CD1 4.08Å; F702-L720 HydrophobicContact CE1-CD1 4.44Å; F702-L720 HydrophobicContact CE1-CD2 4.14Å; F702-L720 HydrophobicContact CE2-CD1 4.12Å; F702-L720 HydrophobicContact CG-CD1 4.25Å; F702-L720 HydrophobicContact CG-CD2 4.17Å; F702-L720 HydrophobicContact CZ-CD1 4.31Å; I716-L720 VanDerWaalsContact O-CB 3.24Å; I716-L720 WeakPolarHBondContact O-CB 3.24Å; I716-L720 PolarHBondContact O-N 2.92Å; R717-L720 PolarHBondContact O-N 3.36Å; L720-I723 PolarHBondContact O-N 2.64Å; L720-L724 HydrophobicContact CD1-CD1 4.01Å; L720-L724 HydrophobicContact CD1-CD2 4.19Å; L720-L724 HydrophobicContact CD1-CG 3.88Å; L720-L724 HydrophobicContact CD2-CD1 4.17Å; L720-L724 HydrophobicContact CG-CD1 3.69Å; L720-L724 HydrophobicContact CG-CG 4.01Å; L720-L724 WeakPolarHBondContact O-CG 3.35Å; L720-L724 PolarHBondContact O-N 2.82Å; L720-I746 HydrophobicContact CD2-CD1 4.04Å; L720-F747 HydrophobicContact CD2-CZ 4.2Å; L720-F747 HydrophobicContact CG-CZ 4.4Å
721	I	95	Very high	94.3	Very high	24 Å²	24	55.1 Å²	55.1	12%	0.123	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-50.4	-176.2	-71.8	167.9	0	0	0	112.9	R717 I723 L724 H725 F747	R717-I721 HydrophobicContact CG-CD1 4.2Å; R717-I721 WeakPolarHBondContact O-CG1 3.37Å; R717-I721 PolarHBondContact O-N 2.99Å; I721-I723 VanDerWaalsContact C-N 3.33Å; I721-I723 PolarHBondContact O-N 2.95Å; I721-L724 PolarHBondContact O-N 3.48Å; I721-H725 PolarHBondContact O-CD2 2.99Å; I721-H725 PolarHBondContact O-N 3.26Å; I721-F747 HydrophobicContact CD1-CD1 4.1Å; I721-F747 HydrophobicContact CD1-CE1 3.94Å; I721-F747 HydrophobicContact CD1-CE2 4.45Å; I721-F747 HydrophobicContact CD1-CG 4.44Å; I721-F747 HydrophobicContact CD1-CZ 4.14Å; I721-F747 HydrophobicContact CG1-CD1 4.23Å; I721-F747 HydrophobicContact CG1-CD2 4.18Å; I721-F747 HydrophobicContact CG1-CE1 3.7Å; I721-F747 HydrophobicContact CG1-CE2 3.64Å; I721-F747 HydrophobicContact CG1-CG 4.47Å; I721-F747 HydrophobicContact CG1-CZ 3.39Å
722	P	95.6	Very high	94.5	Very high	77 Å²	77	51.7 Å²	51.7	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-39.3	178.4	-25.6	35.5	0	0	0	113.6	S718 H725 Q726	S718-P722 VanDerWaalsContact O-CD 3.29Å; S718-P722 WeakPolarHBondContact O-CD 3.37Å; P722-H725 WeakPolarHBondContact O-CB 3.5Å; P722-H725 PolarHBondContact O-N 2.67Å; P722-Q726 PolarHBondContact O-N 3.48Å
723	I	95.4	Very high	94.5	Very high	18 Å²	18	49.9 Å²	49.9	9%	0.092	25%	0.254	C	S	.	.	H	α-helix	trans	-66.9	-44.2	180	-59.5	173	0	0	0	110.3	L684 L687 T719 L720 I721 H725 Q726 K727	L684-I723 HydrophobicContact CD2-CD1 4.1Å; L687-I723 HydrophobicContact CB-CG2 4.07Å; L687-I723 HydrophobicContact CD1-CG2 4.13Å; T719-I723 HydrophobicContact CG2-CD1 4.47Å; T719-I723 WeakPolarHBondContact O-CD1 3.43Å; L720-I723 PolarHBondContact O-N 2.64Å; I721-I723 VanDerWaalsContact C-N 3.33Å; I721-I723 PolarHBondContact O-N 2.95Å; I723-H725 VanDerWaalsContact C-N 3.34Å; I723-H725 PolarHBondContact O-N 3.31Å; I723-Q726 PolarHBondContact O-N 3.3Å; I723-K727 HydrophobicContact CG2-CG 4.44Å; I723-K727 WeakPolarHBondContact O-CB 3.48Å; I723-K727 WeakPolarHBondContact O-CG 3.33Å; I723-K727 PolarHBondContact O-N 3.16Å
724	L	95.9	Very high	94.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-36.6	175.5	-63.7	179.4	0	0	0	111.8	I699 L720 I721 A728 A739 C742 I743 F747	I699-L724 HydrophobicContact CG1-CD2 4.07Å; I699-L724 HydrophobicContact CG2-CD2 3.85Å; L720-L724 HydrophobicContact CD1-CD1 4.01Å; L720-L724 HydrophobicContact CD1-CD2 4.19Å; L720-L724 HydrophobicContact CD1-CG 3.88Å; L720-L724 HydrophobicContact CD2-CD1 4.17Å; L720-L724 HydrophobicContact CG-CD1 3.69Å; L720-L724 HydrophobicContact CG-CG 4.01Å; L720-L724 WeakPolarHBondContact O-CG 3.35Å; L720-L724 PolarHBondContact O-N 2.82Å; I721-L724 PolarHBondContact O-N 3.48Å; L724-A728 WeakPolarHBondContact O-CB 3.48Å; L724-A728 PolarHBondContact O-N 3.25Å; L724-A739 HydrophobicContact CB-CB 4.4Å; L724-A739 HydrophobicContact CD2-CB 4.09Å; L724-C742 HydrophobicContact CD1-CB 4.03Å; L724-C742 HydrophobicContact CD2-CB 4.25Å; L724-I743 HydrophobicContact CB-CD1 3.93Å; L724-I743 HydrophobicContact CB-CG1 3.91Å; L724-I743 HydrophobicContact CD1-CG1 3.96Å; L724-F747 HydrophobicContact CD1-CE2 3.97Å; L724-F747 HydrophobicContact CD1-CZ 4.26Å
725	H	96.9	Very high	94.7	Very high	29 Å²	29	50.5 Å²	50.5	13%	0.134	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-44.8	171.1	-86	-142.4	0	0	0	112.1	I721 P722 I723 K729 Q753 Q756	I721-H725 PolarHBondContact O-CD2 2.99Å; I721-H725 PolarHBondContact O-N 3.26Å; P722-H725 WeakPolarHBondContact O-CB 3.5Å; P722-H725 PolarHBondContact O-N 2.67Å; I723-H725 VanDerWaalsContact C-N 3.34Å; I723-H725 PolarHBondContact O-N 3.31Å; H725-K729 PolarHBondContact CE1-NZ 2.91Å; H725-K729 VanDerWaalsContact CE1-NZ 3.29Å; H725-K729 WeakPolarHBondContact O-CB 3.16Å; H725-K729 WeakPolarHBondContact O-CD 3.36Å; H725-K729 VanDerWaalsContact O-CG 3.24Å; H725-K729 WeakPolarHBondContact O-CG 3.46Å; H725-K729 PolarHBondContact O-N 3.48Å; H725-Q753 PolarHBondContact NE2-O 3.15Å; H725-Q753 PolarHBondContact NE2-OE1 2.78Å; H725-Q756 WeakPolarHBondContact NE2-CB 3.32Å; H725-Q756 VanDerWaalsContact NE2-CD 3.33Å; H725-Q756 PolarHBondContact NE2-OE1 3.44Å
726	Q	96.1	Very high	94.9	Very high	129 Å²	129	46.2 Å²	46.2	60%	0.603	23%	0.23	S	C	*	.	H	α-helix	trans	-62.3	-51.9	177.6	-179.6	-176.9	-5.4	0	0	111.1	P722 I723 A728 K729 R730	P722-Q726 PolarHBondContact O-N 3.48Å; I723-Q726 PolarHBondContact O-N 3.3Å; Q726-A728 VanDerWaalsContact C-N 3.33Å; Q726-A728 PolarHBondContact O-N 3.28Å; Q726-K729 PolarHBondContact O-N 3.12Å; Q726-K729 VanDerWaalsContact O-N 3.11Å; Q726-R730 PolarHBondContact O-N 3.46Å
727	K	95.4	Very high	95	Very high	27 Å²	27	47.7 Å²	47.7	12%	0.117	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-33.7	-179.8	-68.6	-81	-177.3	177.4	0	111.9	I699 I723 G731 Q735 A739	I699-K727 HydrophobicContact CD1-CB 4.18Å; I699-K727 HydrophobicContact CD1-CG 4.32Å; I723-K727 HydrophobicContact CG2-CG 4.44Å; I723-K727 WeakPolarHBondContact O-CB 3.48Å; I723-K727 WeakPolarHBondContact O-CG 3.33Å; I723-K727 PolarHBondContact O-N 3.16Å; K727-G731 VanDerWaalsContact O-CA 3.3Å; K727-G731 WeakPolarHBondContact O-CA 3.15Å; K727-G731 PolarHBondContact O-N 3.3Å; K727-Q735 HydrophobicContact CB-CB 4.47Å; K727-Q735 HydrophobicContact CD-CB 4.26Å; K727-Q735 HydrophobicContact CD-CG 4.3Å; K727-Q735 VanDerWaalsContact NZ-NE2 3.15Å; K727-A739 HydrophobicContact CB-CB 4.32Å
728	A	96.3	Very high	95.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-71.8	-24.3	172.3	0	0	0	0	0	114.7	L724 Q726 A739 V740 I757 S779	L724-A728 WeakPolarHBondContact O-CB 3.48Å; L724-A728 PolarHBondContact O-N 3.25Å; Q726-A728 VanDerWaalsContact C-N 3.33Å; Q726-A728 PolarHBondContact O-N 3.28Å; A728-A739 HydrophobicContact CB-CB 4.05Å; A728-V740 HydrophobicContact CB-CG2 4.03Å; A728-I757 HydrophobicContact CB-CD1 3.93Å; A728-I757 HydrophobicContact CB-CG2 4.2Å; A728-S779 WeakPolarHBondContact O-CB 3.19Å; A728-S779 PolarHBondContact O-OG 3.11Å
729	K	95.6	Very high	95.3	Very high	53 Å²	53	41.1 Å²	41.1	23%	0.23	20%	0.201	C	C	.	.	H	α-helix	trans	-97	-32.8	-178.8	-73.2	167.1	176.9	163	0	113.9	H725 Q726 Q756 I757 L761	H725-K729 PolarHBondContact CE1-NZ 2.91Å; H725-K729 VanDerWaalsContact CE1-NZ 3.29Å; H725-K729 WeakPolarHBondContact O-CB 3.16Å; H725-K729 WeakPolarHBondContact O-CD 3.36Å; H725-K729 VanDerWaalsContact O-CG 3.24Å; H725-K729 WeakPolarHBondContact O-CG 3.46Å; H725-K729 PolarHBondContact O-N 3.48Å; Q726-K729 PolarHBondContact O-N 3.12Å; Q726-K729 VanDerWaalsContact O-N 3.11Å; K729-Q756 WeakPolarHBondContact CE-O 3.5Å; K729-Q756 PolarHBondContact NZ-O 3.02Å; K729-I757 HydrophobicContact CG-CG2 4.28Å; K729-L761 HydrophobicContact CB-CD2 4.41Å; K729-L761 HydrophobicContact CG-CD1 4.45Å; K729-L761 HydrophobicContact CG-CD2 4.34Å; K729-L761 HydrophobicContact CG-CG 4.37Å
730	R	93	Very high	95.5	Very high	225 Å²	225	38.5 Å²	38.5	85%	0.849	19%	0.185	S	C	*	.	H	α-helix	trans	-140.9	-1.7	-170.2	-64.7	-173.4	178.4	178.8	-1.1	114.9	Q726	Q726-R730 PolarHBondContact O-N 3.46Å
731	G	92.9	Very high	95.5	Very high	12 Å²	12	39.7 Å²	39.7	12%	0.124	19%	0.19	C	C	.	.	S	Bend	trans	-74.8	-178.3	175.5	0	0	0	0	0	112.5	K727 T775	K727-G731 VanDerWaalsContact O-CA 3.3Å; K727-G731 WeakPolarHBondContact O-CA 3.15Å; K727-G731 PolarHBondContact O-N 3.3Å; G731-T775 VanDerWaalsContact O-CG2 3.32Å; G731-T775 WeakPolarHBondContact O-CG2 3.18Å; G731-T775 PolarHBondContact O-OG1 3.42Å
732	T	93.8	Very high	95.6	Very high	34 Å²	34	38.5 Å²	38.5	21%	0.209	18%	0.184	C	C	.	.			trans	-63	157.6	173.2	67.4	0	0	0	0	111.4	D692 H734 Q735 A736	D692-T732 HydrophobicContact CB-CG2 3.9Å; D692-T732 WeakPolarHBondContact OD2-CG2 3.49Å; T732-H734 PolarHBondContact O-N 3.4Å; T732-Q735 VanDerWaalsContact N-OE1 3.1Å; T732-Q735 PolarHBondContact O-N 3.4Å; T732-Q735 VanDerWaalsContact O-N 3.17Å; T732-Q735 WeakPolarHBondContact OG1-CG 3.39Å; T732-Q735 PolarHBondContact OG1-N 3.42Å; T732-A736 VanDerWaalsContact O-CB 3.31Å; T732-A736 WeakPolarHBondContact O-CB 3.35Å; T732-A736 PolarHBondContact O-N 2.61Å
733	P	93.6	Very high	95.6	Very high	38 Å²	38	34.9 Å²	34.9	25%	0.247	16%	0.16	C	C	.	.	H	α-helix	trans	-53.4	-31.5	176.8	-30.8	38.3	0	0	0	113.7	K737 I774 V778	P733-K737 WeakPolarHBondContact O-CB 3.32Å; P733-K737 PolarHBondContact O-N 2.87Å; P733-K737 VanDerWaalsContact O-N 3.15Å; P733-I774 HydrophobicContact CB-CG2 4.46Å; P733-I774 HydrophobicContact CG-CB 4.47Å; P733-I774 HydrophobicContact CG-CG2 3.61Å; P733-V778 HydrophobicContact CB-CG2 4.28Å; P733-V778 WeakPolarHBondContact O-CG1 3.46Å
734	H	93.9	Very high	95.6	Very high	104 Å²	104	37.2 Å²	37.2	48%	0.481	17%	0.171	S	C	.	.	H	α-helix	trans	-76.9	-48.5	177.9	-64.2	111.4	0	0	0	112.4	E696 T732 A736 K737 Q738	E696-H734 HydrophobicContact CG-CB 4.46Å; E696-H734 VanDerWaalsContact OE2-CB 3.22Å; E696-H734 WeakPolarHBondContact OE2-CB 2.97Å; E696-H734 IonicContact OE2-CG 2.76Å; T732-H734 PolarHBondContact O-N 3.4Å; H734-A736 VanDerWaalsContact C-N 3.25Å; H734-A736 PolarHBondContact O-N 3.46Å; H734-K737 WeakPolarHBondContact O-CB 3.2Å; H734-K737 PolarHBondContact O-N 2.85Å; H734-Q738 WeakPolarHBondContact O-CG 3.32Å; H734-Q738 PolarHBondContact O-N 2.7Å
735	Q	95.3	Very high	95.5	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-55.5	-42.2	171.8	-71.7	168.3	-1.8	0	0	112	D692 E696 I699 K727 T732 Q738 A739	D692-Q735 VanDerWaalsContact CA-NE2 3.28Å; D692-Q735 PolarHBondContact O-NE2 3.46Å; D692-Q735 PolarHBondContact OD1-NE2 2.86Å; E696-Q735 HydrophobicContact CB-CG 4.19Å; I699-Q735 HydrophobicContact CD1-CB 4.12Å; I699-Q735 HydrophobicContact CD1-CG 4.37Å; K727-Q735 HydrophobicContact CB-CB 4.47Å; K727-Q735 HydrophobicContact CD-CB 4.26Å; K727-Q735 HydrophobicContact CD-CG 4.3Å; K727-Q735 VanDerWaalsContact NZ-NE2 3.15Å; T732-Q735 VanDerWaalsContact N-OE1 3.1Å; T732-Q735 PolarHBondContact O-N 3.4Å; T732-Q735 VanDerWaalsContact O-N 3.17Å; T732-Q735 WeakPolarHBondContact OG1-CG 3.39Å; T732-Q735 PolarHBondContact OG1-N 3.42Å; Q735-Q738 PolarHBondContact O-N 2.86Å; Q735-A739 VanDerWaalsContact O-CB 3.27Å; Q735-A739 WeakPolarHBondContact O-CB 3.43Å; Q735-A739 PolarHBondContact O-N 2.95Å
736	A	96.8	Very high	95.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.2	-43	-179.5	0	0	0	0	0	112.4	T732 H734 A739 V740 T775	T732-A736 VanDerWaalsContact O-CB 3.31Å; T732-A736 WeakPolarHBondContact O-CB 3.35Å; T732-A736 PolarHBondContact O-N 2.61Å; H734-A736 VanDerWaalsContact C-N 3.25Å; H734-A736 PolarHBondContact O-N 3.46Å; A736-A739 PolarHBondContact O-N 2.9Å; A736-V740 WeakPolarHBondContact O-CG2 3.49Å; A736-V740 PolarHBondContact O-N 2.95Å; A736-V740 VanDerWaalsContact O-N 3.09Å; A736-T775 HydrophobicContact CB-CG2 3.8Å
737	K	97	Very high	95.2	Very high	35 Å²	35	31.9 Å²	31.9	15%	0.152	15%	0.152	C	C	.	.	H	α-helix	trans	-52.5	-53.3	167.3	154.1	-156.4	171.4	-160.4	0	110.8	P733 H734 H741 V778 E1199	P733-K737 WeakPolarHBondContact O-CB 3.32Å; P733-K737 PolarHBondContact O-N 2.87Å; P733-K737 VanDerWaalsContact O-N 3.15Å; H734-K737 WeakPolarHBondContact O-CB 3.2Å; H734-K737 PolarHBondContact O-N 2.85Å; K737-H741 PolarHBondContact O-CD2 3.23Å; K737-H741 PolarHBondContact O-N 2.97Å; K737-V778 HydrophobicContact CB-CG1 4.17Å; K737-E1199 IonicContact NZ-OE1 2.69Å; K737-E1199 PolarHBondContact NZ-OE1 3.45Å
738	Q	96	Very high	95	Very high	3 Å²	3	35.8 Å²	35.8	1%	0.014	18%	0.178	C	C	.	.	H	α-helix	trans	-67.8	-38.8	-177	-55.2	-62.1	1.9	0	0	111.6	E696 I699 H734 Q735 H741 C742	E696-Q738 HydrophobicContact CG-CG 3.57Å; E696-Q738 WeakPolarHBondContact OE1-CG 3.46Å; E696-Q738 PolarHBondContact OE1-NE2 2.95Å; I699-Q738 HydrophobicContact CB-CB 4.01Å; I699-Q738 VanDerWaalsContact CG2-C 3.5Å; I699-Q738 HydrophobicContact CG2-CB 3.57Å; H734-Q738 WeakPolarHBondContact O-CG 3.32Å; H734-Q738 PolarHBondContact O-N 2.7Å; Q735-Q738 PolarHBondContact O-N 2.86Å; Q738-H741 CarbonylContact O-C 3.51Å; Q738-H741 PolarHBondContact O-N 3.01Å; Q738-C742 VanDerWaalsContact O-CB 3.25Å; Q738-C742 WeakPolarHBondContact O-CB 3.45Å; Q738-C742 PolarHBondContact O-N 2.89Å
739	A	97	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-44.2	-177.6	0	0	0	0	0	112.4	I699 L724 K727 A728 Q735 A736 H741 C742 I743	I699-A739 HydrophobicContact CD1-CB 4.39Å; L724-A739 HydrophobicContact CB-CB 4.4Å; L724-A739 HydrophobicContact CD2-CB 4.09Å; K727-A739 HydrophobicContact CB-CB 4.32Å; A728-A739 HydrophobicContact CB-CB 4.05Å; Q735-A739 VanDerWaalsContact O-CB 3.27Å; Q735-A739 WeakPolarHBondContact O-CB 3.43Å; Q735-A739 PolarHBondContact O-N 2.95Å; A736-A739 PolarHBondContact O-N 2.9Å; A739-H741 VanDerWaalsContact C-N 3.34Å; A739-H741 PolarHBondContact O-N 2.91Å; A739-C742 WeakPolarHBondContact O-CB 3.43Å; A739-C742 PolarHBondContact O-N 3.27Å; A739-I743 WeakPolarHBondContact O-CG1 3.42Å; A739-I743 PolarHBondContact O-N 3.31Å
740	V	97.7	Very high	94.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-40.5	174.3	169.3	0	0	0	0	111.5	A728 A736 H744 L754 H782 I783 L786	A728-V740 HydrophobicContact CB-CG2 4.03Å; A736-V740 WeakPolarHBondContact O-CG2 3.49Å; A736-V740 PolarHBondContact O-N 2.95Å; A736-V740 VanDerWaalsContact O-N 3.09Å; V740-H744 PolarHBondContact O-N 3.39Å; V740-L754 HydrophobicContact CG1-CD2 4.03Å; V740-H782 HydrophobicContact CB-CB 4.35Å; V740-H782 HydrophobicContact CG1-CB 3.83Å; V740-I783 HydrophobicContact CG1-CG1 3.86Å; V740-I783 HydrophobicContact CG2-CG1 4.26Å; V740-L786 HydrophobicContact CG1-CD1 4.18Å
741	H	96.9	Very high	94.6	Very high	24 Å²	24	32.9 Å²	32.9	11%	0.111	18%	0.176	C	C	.	.	H	α-helix	trans	-69.2	-35.5	174.3	-81.5	-111.3	0	0	0	112.8	R703 K737 Q738 A739 H744 A745 H782	R703-H741 PolarHBondContact NH2-ND1 2.91Å; K737-H741 PolarHBondContact O-CD2 3.23Å; K737-H741 PolarHBondContact O-N 2.97Å; Q738-H741 CarbonylContact O-C 3.51Å; Q738-H741 PolarHBondContact O-N 3.01Å; A739-H741 VanDerWaalsContact C-N 3.34Å; A739-H741 PolarHBondContact O-N 2.91Å; H741-H744 PolarHBondContact O-N 3Å; H741-A745 WeakPolarHBondContact O-CB 3.29Å; H741-A745 PolarHBondContact O-N 3.12Å; H741-H782 AromaticContact CD2-ND1 3.94Å; H741-H782 AromaticContact NE2-CE1 3.76Å; H741-H782 AromaticContact NE2-CG 3.84Å; H741-H782 AromaticContact NE2-ND1 3.18Å; H741-H782 PolarHBondContact NE2-ND1 3.18Å; H741-H782 VanDerWaalsContact NE2-ND1 3.18Å
742	C	96	Very high	94.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-45.2	177.8	-167.1	0	0	0	0	111.1	I699 R703 L724 Q738 A739 H744 A745 I746	I699-C742 HydrophobicContact CG2-CB 3.77Å; R703-C742 HydrophobicContact CB-CB 4.12Å; L724-C742 HydrophobicContact CD1-CB 4.03Å; L724-C742 HydrophobicContact CD2-CB 4.25Å; Q738-C742 VanDerWaalsContact O-CB 3.25Å; Q738-C742 WeakPolarHBondContact O-CB 3.45Å; Q738-C742 PolarHBondContact O-N 2.89Å; A739-C742 WeakPolarHBondContact O-CB 3.43Å; A739-C742 PolarHBondContact O-N 3.27Å; C742-H744 VanDerWaalsContact C-N 3.33Å; C742-H744 PolarHBondContact O-N 3.42Å; C742-A745 PolarHBondContact O-N 2.95Å; C742-I746 WeakPolarHBondContact O-CG1 3.24Å; C742-I746 PolarHBondContact O-N 3.47Å; C742-I746 WeakPolarHBondContact SG-CD1 3.44Å
743	I	96.9	Very high	94.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.2	-46.2	174.3	-73.3	169.3	0	0	0	111.1	L724 A739 A745 F747 Q753 L754 I757	L724-I743 HydrophobicContact CB-CD1 3.93Å; L724-I743 HydrophobicContact CB-CG1 3.91Å; L724-I743 HydrophobicContact CD1-CG1 3.96Å; A739-I743 WeakPolarHBondContact O-CG1 3.42Å; A739-I743 PolarHBondContact O-N 3.31Å; I743-A745 VanDerWaalsContact C-N 3.33Å; I743-A745 PolarHBondContact O-N 2.87Å; I743-F747 HydrophobicContact CB-CD2 4.27Å; I743-F747 HydrophobicContact CB-CE2 4.45Å; I743-F747 HydrophobicContact CG1-CD2 4.32Å; I743-F747 HydrophobicContact CG1-CE2 4.08Å; I743-F747 HydrophobicContact CG2-CD2 4.21Å; I743-F747 WeakPolarHBondContact O-CD2 3.49Å; I743-F747 PolarHBondContact O-N 3.3Å; I743-Q753 HydrophobicContact CG2-CB 3.57Å; I743-Q753 HydrophobicContact CG2-CG 4.3Å; I743-L754 HydrophobicContact CB-CD2 4.49Å; I743-L754 HydrophobicContact CG2-CD2 3.92Å; I743-L754 HydrophobicContact CG2-CG 4.08Å; I743-I757 HydrophobicContact CD1-CD1 3.39Å
744	H	94.9	Very high	94.9	Very high	67 Å²	67	33.4 Å²	33.4	31%	0.31	17%	0.174	S	C	.	.	H	α-helix	trans	-67.7	-29.9	179	179.6	96.2	0	0	0	113.5	V740 H741 C742 L786	V740-H744 PolarHBondContact O-N 3.39Å; H741-H744 PolarHBondContact O-N 3Å; C742-H744 VanDerWaalsContact C-N 3.33Å; C742-H744 PolarHBondContact O-N 3.42Å; H744-L786 HydrophobicContact CB-CD1 3.98Å; H744-L786 PolarHBondContact CE1-O 2.68Å
745	A	92.6	Very high	95	Very high	32 Å²	32	29.3 Å²	29.3	26%	0.264	16%	0.158	S	C	.	.	H	α-helix	trans	-90.4	-18.5	-175	0	0	0	0	0	115.1	R703 H707 H741 C742 I743	R703-A745 HydrophobicContact CG-CB 4.24Å; H707-A745 PolarHBondContact ND1-O 3.02Å; H741-A745 WeakPolarHBondContact O-CB 3.29Å; H741-A745 PolarHBondContact O-N 3.12Å; C742-A745 PolarHBondContact O-N 2.95Å; I743-A745 VanDerWaalsContact C-N 3.33Å; I743-A745 PolarHBondContact O-N 2.87Å
746	I	93.1	Very high	95	Very high	11 Å²	11	33.8 Å²	33.8	6%	0.056	18%	0.179	C	C	.	.	H	α-helix	trans	-107.7	-42.6	-176.3	-62	179.4	0	0	0	112.6	F702 G706 I709 L720 C742	F702-I746 HydrophobicContact CB-CD1 4.31Å; F702-I746 WeakPolarHBondContact O-CD1 3.28Å; G706-I746 WeakPolarHBondContact O-CG2 3.31Å; I709-I746 HydrophobicContact CB-CG2 4.25Å; L720-I746 HydrophobicContact CD2-CD1 4.04Å; C742-I746 WeakPolarHBondContact O-CG1 3.24Å; C742-I746 PolarHBondContact O-N 3.47Å; C742-I746 WeakPolarHBondContact SG-CD1 3.44Å
747	F	93.7	Very high	95.1	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.018	18%	0.179	C	C	.	.			trans	-101.3	129.6	-167	-47.9	-61	0	0	0	112.8	R717 L720 I721 L724 I743 N749 K750	R717-F747 HydrophobicContact CG-CD1 4.06Å; R717-F747 HydrophobicContact CG-CE1 3.76Å; L720-F747 HydrophobicContact CD2-CZ 4.2Å; L720-F747 HydrophobicContact CG-CZ 4.4Å; I721-F747 HydrophobicContact CD1-CD1 4.1Å; I721-F747 HydrophobicContact CD1-CE1 3.94Å; I721-F747 HydrophobicContact CD1-CE2 4.45Å; I721-F747 HydrophobicContact CD1-CG 4.44Å; I721-F747 HydrophobicContact CD1-CZ 4.14Å; I721-F747 HydrophobicContact CG1-CD1 4.23Å; I721-F747 HydrophobicContact CG1-CD2 4.18Å; I721-F747 HydrophobicContact CG1-CE1 3.7Å; I721-F747 HydrophobicContact CG1-CE2 3.64Å; I721-F747 HydrophobicContact CG1-CG 4.47Å; I721-F747 HydrophobicContact CG1-CZ 3.39Å; L724-F747 HydrophobicContact CD1-CE2 3.97Å; L724-F747 HydrophobicContact CD1-CZ 4.26Å; I743-F747 HydrophobicContact CB-CD2 4.27Å; I743-F747 HydrophobicContact CB-CE2 4.45Å; I743-F747 HydrophobicContact CG1-CD2 4.32Å; I743-F747 HydrophobicContact CG1-CE2 4.08Å; I743-F747 HydrophobicContact CG2-CD2 4.21Å; I743-F747 WeakPolarHBondContact O-CD2 3.49Å; I743-F747 PolarHBondContact O-N 3.3Å; F747-N749 VanDerWaalsContact C-N 3.33Å; F747-N749 PolarHBondContact O-N 3.16Å; F747-K750 VanDerWaalsContact O-CB 3.31Å; F747-K750 WeakPolarHBondContact O-CB 3.41Å; F747-K750 PolarHBondContact O-N 3.37Å
748	T	91.4	Very high	95.1	Very high	108 Å²	108	32.5 Å²	32.5	66%	0.663	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-45.5	171.9	52.5	0	0	0	0	111.3	E710 K750	E710-T748 VanDerWaalsContact OE2-CB 3.26Å; E710-T748 WeakPolarHBondContact OE2-CB 3.49Å; E710-T748 VanDerWaalsContact OE2-CG2 3.29Å; E710-T748 WeakPolarHBondContact OE2-CG2 3.39Å; E710-T748 PolarHBondContact OE2-N 3.28Å; E710-T748 PolarHBondContact OE2-OG1 3.22Å; T748-K750 PolarHBondContact O-N 3.18Å; T748-K750 VanDerWaalsContact O-N 3.12Å; T748-K750 PolarHBondContact O-NZ 3.02Å
749	N	91.6	Very high	95	Very high	54 Å²	54	36.7 Å²	36.7	29%	0.289	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	20	179.5	75.6	1.2	0	0	0	114.9	F747 E751 V752 Q753	F747-N749 VanDerWaalsContact C-N 3.33Å; F747-N749 PolarHBondContact O-N 3.16Å; N749-E751 PolarHBondContact O-N 3.28Å; N749-V752 PolarHBondContact O-N 2.92Å; N749-Q753 PolarHBondContact ND2-NE2 3.35Å; N749-Q753 PolarHBondContact O-N 3.18Å; N749-Q753 WeakPolarHBondContact OD1-CG 3.45Å; N749-Q753 PolarHBondContact OD1-NE2 3.48Å
750	K	93.4	Very high	94.9	Very high	58 Å²	58	39.6 Å²	39.6	25%	0.252	21%	0.212	S	C	.	.	H	α-helix	trans	-41.6	-39.6	179.3	59.1	-163.4	178.4	-62	0	115	F747 T748 V752 Q753 L754	F747-K750 VanDerWaalsContact O-CB 3.31Å; F747-K750 WeakPolarHBondContact O-CB 3.41Å; F747-K750 PolarHBondContact O-N 3.37Å; T748-K750 PolarHBondContact O-N 3.18Å; T748-K750 VanDerWaalsContact O-N 3.12Å; T748-K750 PolarHBondContact O-NZ 3.02Å; K750-V752 VanDerWaalsContact C-N 3.31Å; K750-V752 PolarHBondContact O-N 2.95Å; K750-Q753 PolarHBondContact O-N 3.17Å; K750-L754 HydrophobicContact CB-CD1 4.43Å; K750-L754 WeakPolarHBondContact O-CB 3.45Å; K750-L754 WeakPolarHBondContact O-CG 3.5Å; K750-L754 PolarHBondContact O-N 2.96Å
751	E	91.7	Very high	94.9	Very high	106 Å²	106	40 Å²	40	50%	0.495	21%	0.214	S	C	.	.	H	α-helix	trans	-59.1	-39.3	179.3	-73	157.1	-135	0	0	112.6	N749 A755 Q790	N749-E751 PolarHBondContact O-N 3.28Å; E751-A755 WeakPolarHBondContact O-CB 3.46Å; E751-A755 PolarHBondContact O-N 3Å; E751-Q790 PolarHBondContact O-NE2 3.26Å; E751-Q790 PolarHBondContact O-OE1 3.38Å
752	V	94.9	Very high	94.7	Very high	77 Å²	77	40.2 Å²	40.2	47%	0.467	22%	0.219	S	C	.	.	H	α-helix	trans	-70.6	-42.9	176	-177.2	0	0	0	0	110.7	N749 K750 A755 Q756	N749-V752 PolarHBondContact O-N 2.92Å; K750-V752 VanDerWaalsContact C-N 3.31Å; K750-V752 PolarHBondContact O-N 2.95Å; V752-A755 PolarHBondContact O-N 3.46Å; V752-Q756 WeakPolarHBondContact O-CG 3.31Å; V752-Q756 PolarHBondContact O-N 3.47Å
753	Q	96.1	Very high	94.6	Very high	16 Å²	16	49.2 Å²	49.2	8%	0.075	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-44.4	178.8	-53.2	-54.7	-27.2	0	0	111.6	H725 I743 N749 K750 Q756 I757	H725-Q753 PolarHBondContact NE2-O 3.15Å; H725-Q753 PolarHBondContact NE2-OE1 2.78Å; I743-Q753 HydrophobicContact CG2-CB 3.57Å; I743-Q753 HydrophobicContact CG2-CG 4.3Å; N749-Q753 PolarHBondContact ND2-NE2 3.35Å; N749-Q753 PolarHBondContact O-N 3.18Å; N749-Q753 WeakPolarHBondContact OD1-CG 3.45Å; N749-Q753 PolarHBondContact OD1-NE2 3.48Å; K750-Q753 PolarHBondContact O-N 3.17Å; Q753-Q756 PolarHBondContact O-N 3.2Å; Q753-I757 WeakPolarHBondContact O-CG1 3.5Å; Q753-I757 PolarHBondContact O-N 2.89Å
754	L	96.6	Very high	94.3	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-36.2	178.4	-64	170	0	0	0	111.4	V740 I743 K750 I757 F758 I783 A787 F791	V740-L754 HydrophobicContact CG1-CD2 4.03Å; I743-L754 HydrophobicContact CB-CD2 4.49Å; I743-L754 HydrophobicContact CG2-CD2 3.92Å; I743-L754 HydrophobicContact CG2-CG 4.08Å; K750-L754 HydrophobicContact CB-CD1 4.43Å; K750-L754 WeakPolarHBondContact O-CB 3.45Å; K750-L754 WeakPolarHBondContact O-CG 3.5Å; K750-L754 PolarHBondContact O-N 2.96Å; L754-I757 PolarHBondContact O-N 3.33Å; L754-I757 VanDerWaalsContact O-N 3.15Å; L754-F758 WeakPolarHBondContact O-CB 3.32Å; L754-F758 PolarHBondContact O-N 3.48Å; L754-I783 HydrophobicContact CB-CG2 4.43Å; L754-I783 HydrophobicContact CD2-CG1 4.07Å; L754-A787 HydrophobicContact CD1-CB 4.11Å; L754-F791 HydrophobicContact CB-CE2 4.04Å; L754-F791 HydrophobicContact CB-CZ 4.22Å
755	A	95.6	Very high	94.3	Very high	18 Å²	18	50.7 Å²	50.7	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-44.4	174.3	0	0	0	0	0	112.1	E751 V752 I757 F758 E759 F791	E751-A755 WeakPolarHBondContact O-CB 3.46Å; E751-A755 PolarHBondContact O-N 3Å; V752-A755 PolarHBondContact O-N 3.46Å; A755-I757 PolarHBondContact O-N 2.95Å; A755-I757 VanDerWaalsContact O-N 3.1Å; A755-F758 PolarHBondContact O-N 3.48Å; A755-F758 VanDerWaalsContact O-N 3.13Å; A755-E759 PolarHBondContact O-N 3.05Å; A755-F791 HydrophobicContact CB-CE1 4.3Å; A755-F791 HydrophobicContact CB-CZ 4.07Å
756	Q	96.1	Very high	94.3	Very high	96 Å²	96	52.8 Å²	52.8	45%	0.449	28%	0.275	S	S	.	.	H	α-helix	trans	-63.8	-12	174.4	-70.8	179.9	7.2	0	0	113.9	H725 K729 V752 Q753 P760	H725-Q756 WeakPolarHBondContact NE2-CB 3.32Å; H725-Q756 VanDerWaalsContact NE2-CD 3.33Å; H725-Q756 PolarHBondContact NE2-OE1 3.44Å; K729-Q756 WeakPolarHBondContact CE-O 3.5Å; K729-Q756 PolarHBondContact NZ-O 3.02Å; V752-Q756 WeakPolarHBondContact O-CG 3.31Å; V752-Q756 PolarHBondContact O-N 3.47Å; Q753-Q756 PolarHBondContact O-N 3.2Å; Q756-P760 WeakPolarHBondContact O-CD 3.3Å
757	I	97.2	Very high	94.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-97.2	-42.6	169.7	-63.4	163.7	0	0	0	111.1	A728 K729 I743 Q753 L754 A755 L761 I783	A728-I757 HydrophobicContact CB-CD1 3.93Å; A728-I757 HydrophobicContact CB-CG2 4.2Å; K729-I757 HydrophobicContact CG-CG2 4.28Å; I743-I757 HydrophobicContact CD1-CD1 3.39Å; Q753-I757 WeakPolarHBondContact O-CG1 3.5Å; Q753-I757 PolarHBondContact O-N 2.89Å; L754-I757 PolarHBondContact O-N 3.33Å; L754-I757 VanDerWaalsContact O-N 3.15Å; A755-I757 PolarHBondContact O-N 2.95Å; A755-I757 VanDerWaalsContact O-N 3.1Å; I757-L761 HydrophobicContact CG2-CD1 3.66Å; I757-L761 HydrophobicContact CG2-CG 4.48Å; I757-L761 WeakPolarHBondContact O-CB 3.4Å; I757-L761 VanDerWaalsContact O-CG 3.26Å; I757-L761 WeakPolarHBondContact O-CG 3.41Å; I757-L761 PolarHBondContact O-N 3.4Å; I757-I783 HydrophobicContact CB-CD1 4.25Å; I757-I783 HydrophobicContact CG2-CD1 3.82Å
758	F	97	Very high	94.1	Very high	8 Å²	8	57.8 Å²	57.8	4%	0.035	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-48.5	-178.6	-174.3	-81.5	0	0	0	113.1	L754 A755 L761 S762 L780 I783 F791 P794 M795	L754-F758 WeakPolarHBondContact O-CB 3.32Å; L754-F758 PolarHBondContact O-N 3.48Å; A755-F758 PolarHBondContact O-N 3.48Å; A755-F758 VanDerWaalsContact O-N 3.13Å; F758-L761 PolarHBondContact O-N 3.11Å; F758-S762 VanDerWaalsContact O-CB 3.3Å; F758-S762 WeakPolarHBondContact O-CB 3.41Å; F758-S762 PolarHBondContact O-N 3.28Å; F758-S762 PolarHBondContact O-OG 3.3Å; F758-L780 HydrophobicContact CD2-CD2 3.51Å; F758-L780 HydrophobicContact CE2-CD2 3.75Å; F758-L780 HydrophobicContact CG-CD2 4.03Å; F758-L780 HydrophobicContact CZ-CD2 4.42Å; F758-I783 HydrophobicContact CB-CD1 4.34Å; F758-I783 HydrophobicContact CD2-CG2 3.99Å; F758-F791 HydrophobicContact CB-CD1 4.04Å; F758-F791 HydrophobicContact CB-CE1 3.6Å; F758-F791 HydrophobicContact CB-CZ 4.14Å; F758-F791 AromaticContact CD1-CD1 3.83Å; F758-F791 HydrophobicContact CD1-CD1 3.83Å; F758-F791 HydrophobicContact CD1-CE1 4.02Å; F758-F791 HydrophobicContact CD2-CB 4.34Å; F758-F791 AromaticContact CD2-CD1 3.52Å; F758-F791 HydrophobicContact CD2-CD1 3.52Å; F758-F791 HydrophobicContact CD2-CE1 4.01Å; F758-F791 AromaticContact CD2-CG 3.92Å; F758-F791 HydrophobicContact CD2-CG 3.92Å; F758-F791 HydrophobicContact CE1-CD1 4.19Å; F758-F791 HydrophobicContact CE2-CB 4.05Å; F758-F791 AromaticContact CE2-CD1 3.88Å; F758-F791 HydrophobicContact CE2-CD1 3.88Å; F758-F791 HydrophobicContact CE2-CG 4.13Å; F758-F791 AromaticContact CG-CD1 3.5Å; F758-F791 HydrophobicContact CG-CD1 3.5Å; F758-F791 AromaticContact CG-CE1 3.6Å; F758-F791 HydrophobicContact CG-CE1 3.6Å; F758-F791 HydrophobicContact CG-CG 4.34Å; F758-F791 HydrophobicContact CG-CZ 4.49Å; F758-F791 HydrophobicContact CZ-CD1 4.21Å; F758-P794 HydrophobicContact CE1-CB 3.61Å; F758-P794 HydrophobicContact CZ-CB 3.68Å; F758-M795 HydrophobicContact CE2-CE 3.78Å; F758-M795 HydrophobicContact CZ-CE 4.49Å
759	E	95	Very high	94.2	Very high	91 Å²	91	55.1 Å²	55.1	43%	0.425	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-47	-174.1	-80.7	-173.7	-129	0	0	114	A755 S762 R763	A755-E759 PolarHBondContact O-N 3.05Å; E759-S762 PolarHBondContact O-OG 2.85Å; E759-R763 VanDerWaalsContact O-CG 3.32Å; E759-R763 WeakPolarHBondContact O-CG 3.43Å; E759-R763 PolarHBondContact O-N 2.85Å; E759-R763 IonicContact OE2-CZ 3.45Å; E759-R763 IonicContact OE2-NH1 2.81Å; E759-R763 IonicContact OE2-NH2 3.69Å; E759-R763 PolarHBondContact OE2-NH2 3.13Å
760	P	95.7	Very high	94.1	Very high	61 Å²	61	53.6 Å²	53.6	40%	0.396	28%	0.28	S	S	.	.	H	α-helix	trans	-64.1	-45	175.6	-23.6	35	0	0	0	112.4	Q756 R763 S764	Q756-P760 WeakPolarHBondContact O-CD 3.3Å; P760-R763 PolarHBondContact O-N 3.39Å; P760-S764 WeakPolarHBondContact O-CB 3.31Å; P760-S764 PolarHBondContact O-N 3.26Å; P760-S764 PolarHBondContact O-OG 2.87Å
761	L	96.1	Very high	93.9	Very high	8 Å²	8	57.5 Å²	57.5	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-35.5	-175	-68.1	-178.3	0	0	0	112.8	K729 I757 F758 S764 L765 P776 L780	K729-L761 HydrophobicContact CB-CD2 4.41Å; K729-L761 HydrophobicContact CG-CD1 4.45Å; K729-L761 HydrophobicContact CG-CD2 4.34Å; K729-L761 HydrophobicContact CG-CG 4.37Å; I757-L761 HydrophobicContact CG2-CD1 3.66Å; I757-L761 HydrophobicContact CG2-CG 4.48Å; I757-L761 WeakPolarHBondContact O-CB 3.4Å; I757-L761 VanDerWaalsContact O-CG 3.26Å; I757-L761 WeakPolarHBondContact O-CG 3.41Å; I757-L761 PolarHBondContact O-N 3.4Å; F758-L761 PolarHBondContact O-N 3.11Å; L761-S764 PolarHBondContact O-N 3.46Å; L761-S764 PolarHBondContact O-OG 2.89Å; L761-L765 WeakPolarHBondContact O-CD2 3.46Å; L761-L765 WeakPolarHBondContact O-CG 3.08Å; L761-P776 HydrophobicContact CD2-CB 4.15Å; L761-P776 HydrophobicContact CD2-CG 4.06Å; L761-L780 HydrophobicContact CB-CD1 4.39Å; L761-L780 HydrophobicContact CB-CD2 4.16Å; L761-L780 HydrophobicContact CB-CG 4.2Å
762	S	94.1	Very high	93.9	Very high	29 Å²	29	59.3 Å²	59.3	20%	0.203	31%	0.307	C	S	.	.	H	α-helix	trans	-72.5	-28.9	176.6	53.9	0	0	0	0	112.9	F758 E759	F758-S762 VanDerWaalsContact O-CB 3.3Å; F758-S762 WeakPolarHBondContact O-CB 3.41Å; F758-S762 PolarHBondContact O-N 3.28Å; F758-S762 PolarHBondContact O-OG 3.3Å; E759-S762 PolarHBondContact O-OG 2.85Å
763	R	92.7	Very high	93.9	Very high	188 Å²	188	55.8 Å²	55.8	71%	0.709	29%	0.286	S	S	*	.	H	α-helix	trans	-80.1	-24.1	173.7	-68.1	177.6	-169.4	142.5	15.2	113.3	E759 P760	E759-R763 VanDerWaalsContact O-CG 3.32Å; E759-R763 WeakPolarHBondContact O-CG 3.43Å; E759-R763 PolarHBondContact O-N 2.85Å; E759-R763 IonicContact OE2-CZ 3.45Å; E759-R763 IonicContact OE2-NH1 2.81Å; E759-R763 IonicContact OE2-NH2 3.69Å; E759-R763 PolarHBondContact OE2-NH2 3.13Å; P760-R763 PolarHBondContact O-N 3.39Å
764	S	91.5	Very high	93.8	Very high	74 Å²	74	56.4 Å²	56.4	52%	0.517	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	15.5	-178.2	75.3	0	0	0	0	114.6	P760 L761 N766	P760-S764 WeakPolarHBondContact O-CB 3.31Å; P760-S764 PolarHBondContact O-N 3.26Å; P760-S764 PolarHBondContact O-OG 2.87Å; L761-S764 PolarHBondContact O-N 3.46Å; L761-S764 PolarHBondContact O-OG 2.89Å; S764-N766 PolarHBondContact O-N 2.97Å
765	L	94.6	Very high	93.8	Very high	25 Å²	25	57.2 Å²	57.2	13%	0.131	29%	0.294	C	S	.	.			trans	-76.6	109.7	177.6	-62.2	-179.2	0	0	0	110.3	L761 L773 P776 L780 V798 F802	L761-L765 WeakPolarHBondContact O-CD2 3.46Å; L761-L765 WeakPolarHBondContact O-CG 3.08Å; L765-L773 HydrophobicContact CB-CD2 4.42Å; L765-L773 HydrophobicContact CD2-CD2 3.97Å; L765-P776 HydrophobicContact CD2-CB 4.04Å; L765-L780 HydrophobicContact CD1-CD1 3.99Å; L765-L780 HydrophobicContact CD2-CD1 3.95Å; L765-L780 HydrophobicContact CG-CD1 4.34Å; L765-V798 HydrophobicContact CD1-CG1 3.63Å; L765-F802 HydrophobicContact CB-CD1 4.05Å; L765-F802 HydrophobicContact CB-CD2 3.98Å; L765-F802 HydrophobicContact CB-CE1 3.89Å; L765-F802 HydrophobicContact CB-CE2 3.8Å; L765-F802 HydrophobicContact CB-CG 4.1Å; L765-F802 HydrophobicContact CB-CZ 3.77Å; L765-F802 HydrophobicContact CD1-CD1 3.81Å; L765-F802 HydrophobicContact CD1-CE1 4.24Å; L765-F802 HydrophobicContact CD1-CG 4.14Å; L765-F802 HydrophobicContact CG-CD1 4.46Å; L765-F802 HydrophobicContact CG-CE1 4.46Å; L765-F802 WeakPolarHBondContact O-CE2 3.47Å
766	N	93.3	Very high	93.9	Very high	75 Å²	75	56.9 Å²	56.9	40%	0.401	29%	0.291	S	S	.	.			trans	-119.5	123.7	172.1	-175	-0.3	0	0	0	110.2	S764 D768 L773	S764-N766 PolarHBondContact O-N 2.97Å; N766-D768 VanDerWaalsContact C-N 3.29Å; N766-D768 PolarHBondContact O-N 3.07Å; N766-D768 PolarHBondContact OD1-N 3.24Å; N766-L773 WeakPolarHBondContact O-CD2 3.35Å; N766-L773 WeakPolarHBondContact O-CG 3.39Å
767	A	92.1	Very high	93.9	Very high	5 Å²	5	52.3 Å²	52.3	4%	0.041	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-17.8	-179.1	0	0	0	0	0	113.4	V769 F802 R812	A767-V769 VanDerWaalsContact C-N 3.32Å; A767-F802 HydrophobicContact CB-CE2 3.85Å; A767-F802 HydrophobicContact CB-CZ 3.92Å; A767-R812 VanDerWaalsContact CB-CZ 3.47Å; A767-R812 WeakPolarHBondContact O-CD 3.41Å; A767-R812 PolarHBondContact O-NE 2.9Å
768	D	90.8	Very high	93.9	Very high	116 Å²	116	52.5 Å²	52.5	62%	0.62	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.9	-175.5	-52.4	-29.6	0	0	0	112.7	N766 R812	N766-D768 VanDerWaalsContact C-N 3.29Å; N766-D768 PolarHBondContact O-N 3.07Å; N766-D768 PolarHBondContact OD1-N 3.24Å; D768-R812 IonicContact OD1-CZ 3.72Å; D768-R812 IonicContact OD1-NE 2.96Å; D768-R812 PolarHBondContact OD1-NE 2.68Å; D768-R812 IonicContact OD1-NH2 3.6Å
769	V	92.4	Very high	94	Very high	51 Å²	51	52.1 Å²	52.1	31%	0.309	27%	0.269	S	S	.	.	S	Bend	trans	-127	68	172	-165.1	0	0	0	0	109.5	A767 E771 Q772	A767-V769 VanDerWaalsContact C-N 3.32Å; V769-E771 VanDerWaalsContact C-N 3.26Å; V769-E771 PolarHBondContact O-N 2.9Å; V769-E771 VanDerWaalsContact O-N 3.17Å; V769-Q772 HydrophobicContact CG1-CB 4.27Å; V769-Q772 HydrophobicContact CG1-CG 3.77Å; V769-Q772 PolarHBondContact O-N 2.85Å
770	P	89.6	Confident	94.1	Very high	23 Å²	23	47.8 Å²	47.8	15%	0.149	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-62.8	-27.5	-166.3	23.3	-34.5	0	0	0	114.6	Q772 L773 P830 E831 A834	P770-Q772 PolarHBondContact O-N 2.99Å; P770-L773 WeakPolarHBondContact O-CB 3.32Å; P770-L773 PolarHBondContact O-N 3.34Å; P770-P830 HydrophobicContact CB-CB 4.5Å; P770-P830 HydrophobicContact CG-CB 4.23Å; P770-E831 HydrophobicContact CB-CB 4.25Å; P770-E831 HydrophobicContact CG-CB 4.22Å; P770-A834 HydrophobicContact CB-CB 4.19Å
771	E	88.4	Confident	94.1	Very high	139 Å²	139	44.9 Å²	44.9	65%	0.65	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-55.1	-38.7	172.7	-65.9	164.1	-160	0	0	112.3	V769 L773 P830	V769-E771 VanDerWaalsContact C-N 3.26Å; V769-E771 PolarHBondContact O-N 2.9Å; V769-E771 VanDerWaalsContact O-N 3.17Å; E771-L773 PolarHBondContact O-N 3.18Å; E771-P830 HydrophobicContact CG-CB 3.59Å; E771-P830 HydrophobicContact CG-CG 3.87Å
772	Q	92.5	Very high	94.2	Very high	145 Å²	145	45.5 Å²	45.5	68%	0.678	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-76.9	-10.1	-179.5	-65.5	-176.7	14.5	0	0	112.9	V769 P770 P776	V769-Q772 HydrophobicContact CG1-CB 4.27Å; V769-Q772 HydrophobicContact CG1-CG 3.77Å; V769-Q772 PolarHBondContact O-N 2.85Å; P770-Q772 PolarHBondContact O-N 2.99Å; Q772-P776 WeakPolarHBondContact O-CD 3.45Å; Q772-P776 VanDerWaalsContact O-CG 3.23Å; Q772-P776 WeakPolarHBondContact O-CG 3.32Å
773	L	95	Very high	94.4	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.016	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-82.8	-22.5	179.6	-64.6	179.7	0	0	0	114.2	L765 N766 P770 E771 T775 P776 L777 F802 L807 A834	L765-L773 HydrophobicContact CB-CD2 4.42Å; L765-L773 HydrophobicContact CD2-CD2 3.97Å; N766-L773 WeakPolarHBondContact O-CD2 3.35Å; N766-L773 WeakPolarHBondContact O-CG 3.39Å; P770-L773 WeakPolarHBondContact O-CB 3.32Å; P770-L773 PolarHBondContact O-N 3.34Å; E771-L773 PolarHBondContact O-N 3.18Å; L773-T775 PolarHBondContact O-N 2.91Å; L773-P776 WeakPolarHBondContact O-CD 3.46Å; L773-L777 HydrophobicContact CB-CD1 3.83Å; L773-L777 HydrophobicContact CB-CG 4.2Å; L773-L777 VanDerWaalsContact O-CB 3.31Å; L773-L777 WeakPolarHBondContact O-CB 3.29Å; L773-L777 WeakPolarHBondContact O-CG 3.49Å; L773-L777 PolarHBondContact O-N 3.48Å; L773-F802 HydrophobicContact CD1-CE1 4.09Å; L773-F802 HydrophobicContact CD1-CZ 3.87Å; L773-F802 HydrophobicContact CD2-CE1 4.08Å; L773-F802 HydrophobicContact CD2-CZ 3.81Å; L773-L807 HydrophobicContact CD1-CD1 4.18Å; L773-L807 HydrophobicContact CD1-CD2 4.23Å; L773-A834 HydrophobicContact CB-CB 4.2Å; L773-A834 HydrophobicContact CD1-CB 4.17Å
774	I	94.5	Very high	94.5	Very high	28 Å²	28	35.2 Å²	35.2	14%	0.144	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-48.9	-166.6	-49.2	-53.8	0	0	0	111.8	P733 V778 L833 A834 Q837	P733-I774 HydrophobicContact CB-CG2 4.46Å; P733-I774 HydrophobicContact CG-CB 4.47Å; P733-I774 HydrophobicContact CG-CG2 3.61Å; I774-V778 VanDerWaalsContact O-CG2 3.29Å; I774-V778 WeakPolarHBondContact O-CG2 3.31Å; I774-V778 PolarHBondContact O-N 2.94Å; I774-L833 HydrophobicContact CD1-CB 3.84Å; I774-A834 HydrophobicContact CD1-CB 3.84Å; I774-Q837 HydrophobicContact CG2-CG 3.98Å
775	T	95.4	Very high	94.6	Very high	18 Å²	18	34.3 Å²	34.3	11%	0.11	18%	0.177	C	C	.	.	H	α-helix	trans	-70.7	-50.6	176.6	-75.2	0	0	0	0	112.7	G731 A736 L773 L777 V778 S779	G731-T775 VanDerWaalsContact O-CG2 3.32Å; G731-T775 WeakPolarHBondContact O-CG2 3.18Å; G731-T775 PolarHBondContact O-OG1 3.42Å; A736-T775 HydrophobicContact CB-CG2 3.8Å; L773-T775 PolarHBondContact O-N 2.91Å; T775-L777 VanDerWaalsContact C-N 3.34Å; T775-L777 PolarHBondContact O-N 3.2Å; T775-V778 PolarHBondContact O-N 2.87Å; T775-S779 PolarHBondContact O-N 2.97Å
776	P	97.2	Very high	94.6	Very high	12 Å²	12	34.8 Å²	34.8	8%	0.078	18%	0.18	C	C	.	.	H	α-helix	trans	-52.2	-45.1	176	-30.4	35.9	0	0	0	114.4	L761 L765 Q772 L773 V778 S779 L780	L761-P776 HydrophobicContact CD2-CB 4.15Å; L761-P776 HydrophobicContact CD2-CG 4.06Å; L765-P776 HydrophobicContact CD2-CB 4.04Å; Q772-P776 WeakPolarHBondContact O-CD 3.45Å; Q772-P776 VanDerWaalsContact O-CG 3.23Å; Q772-P776 WeakPolarHBondContact O-CG 3.32Å; L773-P776 WeakPolarHBondContact O-CD 3.46Å; P776-V778 VanDerWaalsContact C-N 3.3Å; P776-V778 PolarHBondContact O-N 3.28Å; P776-S779 PolarHBondContact O-N 2.71Å; P776-L780 VanDerWaalsContact O-CB 3.27Å; P776-L780 WeakPolarHBondContact O-CB 3.36Å; P776-L780 VanDerWaalsContact O-CG 3.25Å; P776-L780 WeakPolarHBondContact O-CG 3.46Å; P776-L780 PolarHBondContact O-N 3.34Å
777	L	97.3	Very high	94.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-34.1	177.8	-69.8	173.5	0	0	0	112.6	L773 T775 G781 I803 L807 A834 Q837 A838 L841	L773-L777 HydrophobicContact CB-CD1 3.83Å; L773-L777 HydrophobicContact CB-CG 4.2Å; L773-L777 VanDerWaalsContact O-CB 3.31Å; L773-L777 WeakPolarHBondContact O-CB 3.29Å; L773-L777 WeakPolarHBondContact O-CG 3.49Å; L773-L777 PolarHBondContact O-N 3.48Å; T775-L777 VanDerWaalsContact C-N 3.34Å; T775-L777 PolarHBondContact O-N 3.2Å; L777-G781 PolarHBondContact O-N 2.79Å; L777-I803 HydrophobicContact CD2-CD1 3.37Å; L777-L807 HydrophobicContact CD1-CD2 4.16Å; L777-A834 HydrophobicContact CD1-CB 4.38Å; L777-A834 WeakPolarHBondContact CD1-O 3.41Å; L777-Q837 HydrophobicContact CB-CB 4.09Å; L777-Q837 HydrophobicContact CD1-CB 4.24Å; L777-A838 HydrophobicContact CD1-CB 4.22Å; L777-L841 HydrophobicContact CD2-CD1 3.92Å
778	V	97.3	Very high	94.6	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.024	17%	0.171	C	C	.	.	H	α-helix	trans	-72.7	-43.7	176.9	170.9	0	0	0	0	111.3	P733 K737 I774 T775 P776 H782 Q837	P733-V778 HydrophobicContact CB-CG2 4.28Å; P733-V778 WeakPolarHBondContact O-CG1 3.46Å; K737-V778 HydrophobicContact CB-CG1 4.17Å; I774-V778 VanDerWaalsContact O-CG2 3.29Å; I774-V778 WeakPolarHBondContact O-CG2 3.31Å; I774-V778 PolarHBondContact O-N 2.94Å; T775-V778 PolarHBondContact O-N 2.87Å; P776-V778 VanDerWaalsContact C-N 3.3Å; P776-V778 PolarHBondContact O-N 3.28Å; V778-H782 PolarHBondContact O-CD2 3.27Å; V778-H782 VanDerWaalsContact O-CD2 3.3Å; V778-H782 PolarHBondContact O-N 3.28Å; V778-Q837 HydrophobicContact CG2-CB 4.39Å; V778-Q837 HydrophobicContact CG2-CG 4.1Å; V778-Q837 VanDerWaalsContact CG2-OE1 3.26Å
779	S	97.9	Very high	94.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-53.1	175	-73.5	0	0	0	0	112.3	A728 T775 P776 G781 H782 I783	A728-S779 WeakPolarHBondContact O-CB 3.19Å; A728-S779 PolarHBondContact O-OG 3.11Å; T775-S779 PolarHBondContact O-N 2.97Å; P776-S779 PolarHBondContact O-N 2.71Å; S779-G781 VanDerWaalsContact C-N 3.28Å; S779-G781 PolarHBondContact O-N 3.15Å; S779-H782 PolarHBondContact O-N 2.67Å; S779-H782 VanDerWaalsContact O-N 3.1Å; S779-I783 VanDerWaalsContact O-CG1 3.25Å; S779-I783 WeakPolarHBondContact O-CG1 3.33Å; S779-I783 PolarHBondContact O-N 2.87Å
780	L	97.6	Very high	94.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57	-42.5	177.3	-72.3	173.3	0	0	0	111.5	F758 L761 L765 P776 I783 S784 M795 L841	F758-L780 HydrophobicContact CD2-CD2 3.51Å; F758-L780 HydrophobicContact CE2-CD2 3.75Å; F758-L780 HydrophobicContact CG-CD2 4.03Å; F758-L780 HydrophobicContact CZ-CD2 4.42Å; L761-L780 HydrophobicContact CB-CD1 4.39Å; L761-L780 HydrophobicContact CB-CD2 4.16Å; L761-L780 HydrophobicContact CB-CG 4.2Å; L765-L780 HydrophobicContact CD1-CD1 3.99Å; L765-L780 HydrophobicContact CD2-CD1 3.95Å; L765-L780 HydrophobicContact CG-CD1 4.34Å; P776-L780 VanDerWaalsContact O-CB 3.27Å; P776-L780 WeakPolarHBondContact O-CB 3.36Å; P776-L780 VanDerWaalsContact O-CG 3.25Å; P776-L780 WeakPolarHBondContact O-CG 3.46Å; P776-L780 PolarHBondContact O-N 3.34Å; L780-I783 PolarHBondContact O-N 3.49Å; L780-S784 WeakPolarHBondContact O-CB 3.2Å; L780-S784 PolarHBondContact O-N 2.98Å; L780-S784 PolarHBondContact O-OG 3.01Å; L780-M795 HydrophobicContact CB-CE 3.92Å; L780-M795 WeakPolarHBondContact O-CE 3.39Å; L780-L841 HydrophobicContact CB-CD1 4.01Å
781	G	96.6	Very high	94.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-49.3	173.3	0	0	0	0	0	112.7	L777 S779 S784 M785 R844	L777-G781 PolarHBondContact O-N 2.79Å; S779-G781 VanDerWaalsContact C-N 3.28Å; S779-G781 PolarHBondContact O-N 3.15Å; G781-S784 PolarHBondContact O-N 3.41Å; G781-S784 PolarHBondContact O-OG 3.3Å; G781-M785 PolarHBondContact O-N 2.99Å; G781-R844 WeakPolarHBondContact O-CB 3.17Å
782	H	97.8	Very high	94.3	Very high	20 Å²	20	29.9 Å²	29.9	9%	0.093	16%	0.159	C	C	.	.	H	α-helix	trans	-70.1	-32.5	179.6	-80.6	-63.7	0	0	0	113.6	V740 H741 V778 S779 M785 L786 R844	V740-H782 HydrophobicContact CB-CB 4.35Å; V740-H782 HydrophobicContact CG1-CB 3.83Å; H741-H782 AromaticContact CD2-ND1 3.94Å; H741-H782 AromaticContact NE2-CE1 3.76Å; H741-H782 AromaticContact NE2-CG 3.84Å; H741-H782 AromaticContact NE2-ND1 3.18Å; H741-H782 PolarHBondContact NE2-ND1 3.18Å; H741-H782 VanDerWaalsContact NE2-ND1 3.18Å; V778-H782 PolarHBondContact O-CD2 3.27Å; V778-H782 VanDerWaalsContact O-CD2 3.3Å; V778-H782 PolarHBondContact O-N 3.28Å; S779-H782 PolarHBondContact O-N 2.67Å; S779-H782 VanDerWaalsContact O-N 3.1Å; H782-M785 PolarHBondContact O-N 2.63Å; H782-L786 WeakPolarHBondContact O-CG 3.46Å; H782-L786 PolarHBondContact O-N 3.12Å; H782-R844 PolarHBondContact CD2-NE 3.41Å; H782-R844 PolarHBondContact CE1-NE 3.21Å; H782-R844 VanDerWaalsContact CE1-NE 3.29Å; H782-R844 PolarHBondContact NE2-NE 3.2Å; H782-R844 PolarHBondContact NE2-NH2 3.43Å
783	I	97.4	Very high	94	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-50.5	170.9	-67.7	162.9	0	0	0	109.9	V740 L754 I757 F758 S779 L780 M785 L786 A787 F791	V740-I783 HydrophobicContact CG1-CG1 3.86Å; V740-I783 HydrophobicContact CG2-CG1 4.26Å; L754-I783 HydrophobicContact CB-CG2 4.43Å; L754-I783 HydrophobicContact CD2-CG1 4.07Å; I757-I783 HydrophobicContact CB-CD1 4.25Å; I757-I783 HydrophobicContact CG2-CD1 3.82Å; F758-I783 HydrophobicContact CB-CD1 4.34Å; F758-I783 HydrophobicContact CD2-CG2 3.99Å; S779-I783 VanDerWaalsContact O-CG1 3.25Å; S779-I783 WeakPolarHBondContact O-CG1 3.33Å; S779-I783 PolarHBondContact O-N 2.87Å; L780-I783 PolarHBondContact O-N 3.49Å; I783-M785 PolarHBondContact O-N 2.82Å; I783-M785 VanDerWaalsContact O-N 3.14Å; I783-L786 PolarHBondContact O-N 3.19Å; I783-L786 VanDerWaalsContact O-N 3.09Å; I783-A787 PolarHBondContact O-N 3.01Å; I783-F791 HydrophobicContact CG2-CD2 3.32Å; I783-F791 HydrophobicContact CG2-CE2 3.44Å; I783-F791 VanDerWaalsContact CG2-CE2 3.44Å; I783-F791 HydrophobicContact CG2-CG 3.93Å; I783-F791 HydrophobicContact CG2-CZ 4.14Å
784	S	94.6	Very high	93.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.007	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-20.2	-179.2	71.3	0	0	0	0	114.9	L780 G781 W845	L780-S784 WeakPolarHBondContact O-CB 3.2Å; L780-S784 PolarHBondContact O-N 2.98Å; L780-S784 PolarHBondContact O-OG 3.01Å; G781-S784 PolarHBondContact O-N 3.41Å; G781-S784 PolarHBondContact O-OG 3.3Å; S784-W845 WeakPolarHBondContact OG-CA 3.29Å
785	M	95.4	Very high	93.9	Very high	56 Å²	56	28.9 Å²	28.9	28%	0.276	17%	0.169	S	C	.	.	H	α-helix	trans	-86.9	-26.4	176.9	-165.8	-171.3	76.1	0	0	112.9	G781 H782 I783 R844	G781-M785 PolarHBondContact O-N 2.99Å; H782-M785 PolarHBondContact O-N 2.63Å; I783-M785 PolarHBondContact O-N 2.82Å; I783-M785 VanDerWaalsContact O-N 3.14Å; M785-R844 HydrophobicContact CB-CB 4.16Å; M785-R844 WeakPolarHBondContact CB-O 3.49Å; M785-R844 HydrophobicContact SD-CB 4.47Å; M785-R844 HydrophobicContact SD-CG 4.17Å
786	L	94.5	Very high	93.7	Very high	35 Å²	35	33 Å²	33	18%	0.183	19%	0.185	C	C	.	.	H	α-helix	trans	-105.7	-22.2	-173.1	-69.2	178.4	0	0	0	113.9	V740 H744 H782 I783	V740-L786 HydrophobicContact CG1-CD1 4.18Å; H744-L786 HydrophobicContact CB-CD1 3.98Å; H744-L786 PolarHBondContact CE1-O 2.68Å; H782-L786 WeakPolarHBondContact O-CG 3.46Å; H782-L786 PolarHBondContact O-N 3.12Å; I783-L786 PolarHBondContact O-N 3.19Å; I783-L786 VanDerWaalsContact O-N 3.09Å
787	A	93.5	Very high	93.5	Very high	12 Å²	12	35.4 Å²	35.4	10%	0.099	20%	0.203	C	C	.	.	S	Bend	trans	-134.8	60.4	175.3	0	0	0	0	0	110.1	L754 I783 D789 Q790 F791	L754-A787 HydrophobicContact CD1-CB 4.11Å; I783-A787 PolarHBondContact O-N 3.01Å; A787-D789 PolarHBondContact O-N 3.27Å; A787-Q790 HydrophobicContact CB-CB 4.47Å; A787-F791 HydrophobicContact CB-CD2 3.84Å; A787-F791 HydrophobicContact CB-CE2 3.88Å; A787-F791 WeakPolarHBondContact O-CD2 3.44Å; A787-F791 PolarHBondContact O-N 3.24Å
788	P	91.2	Very high	93.4	Very high	24 Å²	24	36.3 Å²	36.3	16%	0.156	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-44.3	-173.6	25.1	-34.3	0	0	0	112	Q790 F791 A792	P788-Q790 PolarHBondContact O-N 2.83Å; P788-F791 PolarHBondContact O-N 2.68Å; P788-A792 WeakPolarHBondContact O-CA 3.48Å; P788-A792 WeakPolarHBondContact O-CB 3.32Å; P788-A792 PolarHBondContact O-N 3.29Å
789	D	87.7	Confident	93.3	Very high	155 Å²	155	36.6 Å²	36.6	83%	0.829	21%	0.21	S	C	*	.	H	α-helix	trans	-64.6	-39.2	-173.2	-50.3	-66.4	0	0	0	112.7	A787	A787-D789 PolarHBondContact O-N 3.27Å
790	Q	90	Very high	93.1	Very high	74 Å²	74	39.1 Å²	39.1	35%	0.346	23%	0.231	S	C	.	.	H	α-helix	trans	-68.5	-36.8	177.8	-169.4	-176	9.6	0	0	112.4	E751 A787 P788	E751-Q790 PolarHBondContact O-NE2 3.26Å; E751-Q790 PolarHBondContact O-OE1 3.38Å; A787-Q790 HydrophobicContact CB-CB 4.47Å; P788-Q790 PolarHBondContact O-N 2.83Å
791	F	91.5	Very high	92.9	Very high	10 Å²	10	43.4 Å²	43.4	4%	0.044	25%	0.254	C	S	.	.	H	α-helix	trans	-111.8	-0.3	-170.5	-60.5	-69.1	0	0	0	115	L754 A755 F758 I783 A787 P788 S793 P794 M795	L754-F791 HydrophobicContact CB-CE2 4.04Å; L754-F791 HydrophobicContact CB-CZ 4.22Å; A755-F791 HydrophobicContact CB-CE1 4.3Å; A755-F791 HydrophobicContact CB-CZ 4.07Å; F758-F791 HydrophobicContact CB-CD1 4.04Å; F758-F791 HydrophobicContact CB-CE1 3.6Å; F758-F791 HydrophobicContact CB-CZ 4.14Å; F758-F791 AromaticContact CD1-CD1 3.83Å; F758-F791 HydrophobicContact CD1-CD1 3.83Å; F758-F791 HydrophobicContact CD1-CE1 4.02Å; F758-F791 HydrophobicContact CD2-CB 4.34Å; F758-F791 AromaticContact CD2-CD1 3.52Å; F758-F791 HydrophobicContact CD2-CD1 3.52Å; F758-F791 HydrophobicContact CD2-CE1 4.01Å; F758-F791 AromaticContact CD2-CG 3.92Å; F758-F791 HydrophobicContact CD2-CG 3.92Å; F758-F791 HydrophobicContact CE1-CD1 4.19Å; F758-F791 HydrophobicContact CE2-CB 4.05Å; F758-F791 AromaticContact CE2-CD1 3.88Å; F758-F791 HydrophobicContact CE2-CD1 3.88Å; F758-F791 HydrophobicContact CE2-CG 4.13Å; F758-F791 AromaticContact CG-CD1 3.5Å; F758-F791 HydrophobicContact CG-CD1 3.5Å; F758-F791 AromaticContact CG-CE1 3.6Å; F758-F791 HydrophobicContact CG-CE1 3.6Å; F758-F791 HydrophobicContact CG-CG 4.34Å; F758-F791 HydrophobicContact CG-CZ 4.49Å; F758-F791 HydrophobicContact CZ-CD1 4.21Å; I783-F791 HydrophobicContact CG2-CD2 3.32Å; I783-F791 HydrophobicContact CG2-CE2 3.44Å; I783-F791 VanDerWaalsContact CG2-CE2 3.44Å; I783-F791 HydrophobicContact CG2-CG 3.93Å; I783-F791 HydrophobicContact CG2-CZ 4.14Å; A787-F791 HydrophobicContact CB-CD2 3.84Å; A787-F791 HydrophobicContact CB-CE2 3.88Å; A787-F791 WeakPolarHBondContact O-CD2 3.44Å; A787-F791 PolarHBondContact O-N 3.24Å; P788-F791 PolarHBondContact O-N 2.68Å; F791-S793 PolarHBondContact O-N 2.68Å; F791-P794 WeakPolarHBondContact O-CD 3.39Å; F791-M795 WeakPolarHBondContact O-CB 3.19Å; F791-M795 PolarHBondContact O-N 2.75Å
792	A	85.3	Confident	92.9	Very high	31 Å²	31	44.5 Å²	44.5	26%	0.256	26%	0.259	S	S	.	.	H	α-helix	trans	-56.3	-46	-174.4	0	0	0	0	0	113.5	P788 K796	P788-A792 WeakPolarHBondContact O-CA 3.48Å; P788-A792 WeakPolarHBondContact O-CB 3.32Å; P788-A792 PolarHBondContact O-N 3.29Å; A792-K796 VanDerWaalsContact O-CB 3.31Å; A792-K796 WeakPolarHBondContact O-CB 3.39Å; A792-K796 PolarHBondContact O-N 3.02Å
793	S	86.9	Confident	92.9	Very high	96 Å²	96	43.5 Å²	43.5	67%	0.671	25%	0.254	S	S	*	.	H	α-helix	trans	-72.3	-51.3	-179.4	179.4	0	0	0	0	112.6	F791 M795 K796 S797	F791-S793 PolarHBondContact O-N 2.68Å; S793-M795 VanDerWaalsContact C-N 3.34Å; S793-M795 PolarHBondContact O-N 3.27Å; S793-K796 PolarHBondContact O-N 3.29Å; S793-S797 PolarHBondContact O-N 2.9Å
794	P	92.3	Very high	92.8	Very high	58 Å²	58	45.6 Å²	45.6	38%	0.377	27%	0.267	S	S	.	.	H	α-helix	trans	-54.7	-44.8	171.3	-27.8	35.3	0	0	0	113.8	F758 F791 K796 S797 V798	F758-P794 HydrophobicContact CE1-CB 3.61Å; F758-P794 HydrophobicContact CZ-CB 3.68Å; F791-P794 WeakPolarHBondContact O-CD 3.39Å; P794-K796 PolarHBondContact O-N 3.25Å; P794-S797 WeakPolarHBondContact O-CB 3.19Å; P794-S797 PolarHBondContact O-N 3.45Å; P794-V798 PolarHBondContact O-N 3.24Å
795	M	94.2	Very high	92.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.2	-38.2	178.9	-175.2	54.9	76.3	0	0	111.9	F758 L780 F791 S793 S797 V798 V799 L841 W845	F758-M795 HydrophobicContact CE2-CE 3.78Å; F758-M795 HydrophobicContact CZ-CE 4.49Å; L780-M795 HydrophobicContact CB-CE 3.92Å; L780-M795 WeakPolarHBondContact O-CE 3.39Å; F791-M795 WeakPolarHBondContact O-CB 3.19Å; F791-M795 PolarHBondContact O-N 2.75Å; S793-M795 VanDerWaalsContact C-N 3.34Å; S793-M795 PolarHBondContact O-N 3.27Å; M795-S797 PolarHBondContact O-N 3.39Å; M795-V798 PolarHBondContact O-N 3.23Å; M795-V798 HydrophobicContact SD-CB 4.25Å; M795-V798 HydrophobicContact SD-CG1 4.31Å; M795-V799 HydrophobicContact CG-CG2 4.12Å; M795-V799 WeakPolarHBondContact O-CB 3.36Å; M795-V799 VanDerWaalsContact O-CG2 3.3Å; M795-V799 WeakPolarHBondContact O-CG2 3.49Å; M795-V799 PolarHBondContact O-N 3.27Å; M795-V799 HydrophobicContact SD-CG2 4Å; M795-L841 HydrophobicContact CE-CD1 4.43Å; M795-L841 HydrophobicContact SD-CD1 4.44Å; M795-L841 HydrophobicContact SD-CD2 3.92Å; M795-L841 HydrophobicContact SD-CG 4.49Å; M795-W845 HydrophobicContact CG-CB 4.28Å; M795-W845 VanDerWaalsContact CG-CD1 3.43Å; M795-W845 HydrophobicContact CG-CD2 4.24Å; M795-W845 HydrophobicContact CG-CG 3.73Å
796	K	91.8	Very high	92.7	Very high	104 Å²	104	51.2 Å²	51.2	45%	0.452	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-36.5	174.7	-169.8	-179.1	-178.6	-172.2	0	112	A792 S793 P794 A800 W845	A792-K796 VanDerWaalsContact O-CB 3.31Å; A792-K796 WeakPolarHBondContact O-CB 3.39Å; A792-K796 PolarHBondContact O-N 3.02Å; S793-K796 PolarHBondContact O-N 3.29Å; P794-K796 PolarHBondContact O-N 3.25Å; K796-A800 WeakPolarHBondContact O-CB 3.39Å; K796-A800 PolarHBondContact O-N 3.27Å; K796-W845 HydrophobicContact CB-CZ2 3.96Å; K796-W845 HydrophobicContact CG-CH2 4.36Å; K796-W845 HydrophobicContact CG-CZ2 4.15Å
797	S	92.9	Very high	92.7	Very high	64 Å²	64	49.5 Å²	49.5	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-67.6	-48.8	173.9	-173.6	0	0	0	0	112	S793 P794 M795 V799 A800 N801	S793-S797 PolarHBondContact O-N 2.9Å; P794-S797 WeakPolarHBondContact O-CB 3.19Å; P794-S797 PolarHBondContact O-N 3.45Å; M795-S797 PolarHBondContact O-N 3.39Å; S797-V799 VanDerWaalsContact C-N 3.28Å; S797-V799 PolarHBondContact O-N 3.44Å; S797-A800 PolarHBondContact O-N 2.99Å; S797-N801 WeakPolarHBondContact O-CB 3.43Å; S797-N801 PolarHBondContact O-N 3.28Å; S797-N801 PolarHBondContact O-ND2 3.09Å; S797-N801 PolarHBondContact OG-ND2 3.36Å; S797-N801 VanDerWaalsContact OG-ND2 3.13Å
798	V	96	Very high	92.7	Very high	18 Å²	18	49 Å²	49	11%	0.109	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-41.8	175.5	172.5	0	0	0	0	111.2	L765 P794 M795 F802 I803	L765-V798 HydrophobicContact CD1-CG1 3.63Å; P794-V798 PolarHBondContact O-N 3.24Å; M795-V798 PolarHBondContact O-N 3.23Å; M795-V798 HydrophobicContact SD-CB 4.25Å; M795-V798 HydrophobicContact SD-CG1 4.31Å; V798-F802 WeakPolarHBondContact O-CA 3.47Å; V798-F802 WeakPolarHBondContact O-CB 3.44Å; V798-F802 PolarHBondContact O-N 2.86Å; V798-I803 HydrophobicContact CG1-CG1 4.3Å; V798-I803 PolarHBondContact O-N 2.9Å
799	V	95.1	Very high	92.8	Very high	10 Å²	10	51.9 Å²	51.9	6%	0.061	29%	0.291	C	S	.	.	I	π-helix	trans	-64.3	-50.5	178.3	163.2	0	0	0	0	112	M795 S797 I803 V804 L841 L842 W845	M795-V799 HydrophobicContact CG-CG2 4.12Å; M795-V799 WeakPolarHBondContact O-CB 3.36Å; M795-V799 VanDerWaalsContact O-CG2 3.3Å; M795-V799 WeakPolarHBondContact O-CG2 3.49Å; M795-V799 PolarHBondContact O-N 3.27Å; M795-V799 HydrophobicContact SD-CG2 4Å; S797-V799 VanDerWaalsContact C-N 3.28Å; S797-V799 PolarHBondContact O-N 3.44Å; V799-I803 HydrophobicContact CG2-CG1 4.45Å; V799-I803 WeakPolarHBondContact O-CB 3.34Å; V799-V804 HydrophobicContact CG1-CG2 4.42Å; V799-V804 WeakPolarHBondContact O-CG2 3.25Å; V799-V804 PolarHBondContact O-N 3.48Å; V799-L841 HydrophobicContact CG2-CD2 3.91Å; V799-L842 HydrophobicContact CB-CD2 4.27Å; V799-L842 HydrophobicContact CG1-CD2 3.48Å; V799-L842 VanDerWaalsContact CG1-CD2 3.48Å; V799-L842 HydrophobicContact CG2-CD2 3.85Å; V799-W845 HydrophobicContact CB-CZ3 4.33Å; V799-W845 HydrophobicContact CG1-CE3 4.31Å; V799-W845 HydrophobicContact CG1-CH2 4.21Å; V799-W845 HydrophobicContact CG1-CZ3 3.78Å; V799-W845 HydrophobicContact CG2-CD2 4.22Å; V799-W845 HydrophobicContact CG2-CE3 3.96Å; V799-W845 HydrophobicContact CG2-CZ3 4.2Å
800	A	93	Very high	93	Very high	54 Å²	54	47.8 Å²	47.8	45%	0.446	27%	0.269	S	S	.	.	I	π-helix	trans	-67.4	-47.9	-177.3	0	0	0	0	0	112.3	K796 S797 K805	K796-A800 WeakPolarHBondContact O-CB 3.39Å; K796-A800 PolarHBondContact O-N 3.27Å; S797-A800 PolarHBondContact O-N 2.99Å; A800-K805 PolarHBondContact O-N 3.11Å
801	N	93.9	Very high	93	Very high	89 Å²	89	44.9 Å²	44.9	48%	0.476	26%	0.256	S	S	.	.	I	π-helix	trans	-83.1	-52.8	-171.3	-62.6	-43.8	0	0	0	112	S797 K805 D806	S797-N801 WeakPolarHBondContact O-CB 3.43Å; S797-N801 PolarHBondContact O-N 3.28Å; S797-N801 PolarHBondContact O-ND2 3.09Å; S797-N801 PolarHBondContact OG-ND2 3.36Å; S797-N801 VanDerWaalsContact OG-ND2 3.13Å; N801-K805 WeakPolarHBondContact O-CB 3.28Å; N801-D806 VanDerWaalsContact O-CG 3.31Å; N801-D806 PolarHBondContact O-N 2.97Å
802	F	96.6	Very high	92.8	Very high	23 Å²	23	48.6 Å²	48.6	10%	0.101	27%	0.27	C	S	.	.	I	π-helix	trans	-89.2	-54.7	-174.6	-173.2	-95.2	0	0	0	112.6	L765 A767 L773 V798 D806 L807	L765-F802 HydrophobicContact CB-CD1 4.05Å; L765-F802 HydrophobicContact CB-CD2 3.98Å; L765-F802 HydrophobicContact CB-CE1 3.89Å; L765-F802 HydrophobicContact CB-CE2 3.8Å; L765-F802 HydrophobicContact CB-CG 4.1Å; L765-F802 HydrophobicContact CB-CZ 3.77Å; L765-F802 HydrophobicContact CD1-CD1 3.81Å; L765-F802 HydrophobicContact CD1-CE1 4.24Å; L765-F802 HydrophobicContact CD1-CG 4.14Å; L765-F802 HydrophobicContact CG-CD1 4.46Å; L765-F802 HydrophobicContact CG-CE1 4.46Å; L765-F802 WeakPolarHBondContact O-CE2 3.47Å; A767-F802 HydrophobicContact CB-CE2 3.85Å; A767-F802 HydrophobicContact CB-CZ 3.92Å; L773-F802 HydrophobicContact CD1-CE1 4.09Å; L773-F802 HydrophobicContact CD1-CZ 3.87Å; L773-F802 HydrophobicContact CD2-CE1 4.08Å; L773-F802 HydrophobicContact CD2-CZ 3.81Å; V798-F802 WeakPolarHBondContact O-CA 3.47Å; V798-F802 WeakPolarHBondContact O-CB 3.44Å; V798-F802 PolarHBondContact O-N 2.86Å; F802-D806 PolarHBondContact O-N 2.65Å; F802-L807 HydrophobicContact CE1-CB 4.36Å; F802-L807 HydrophobicContact CE1-CD2 4.25Å; F802-L807 WeakPolarHBondContact O-CB 3.12Å; F802-L807 PolarHBondContact O-N 2.71Å
803	I	96.6	Very high	92.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-66.1	-52.7	-170.8	-59.6	-67.8	0	0	0	111.9	L777 V798 V799 L808 A838 L841 L842	L777-I803 HydrophobicContact CD2-CD1 3.37Å; V798-I803 HydrophobicContact CG1-CG1 4.3Å; V798-I803 PolarHBondContact O-N 2.9Å; V799-I803 HydrophobicContact CG2-CG1 4.45Å; V799-I803 WeakPolarHBondContact O-CB 3.34Å; I803-L808 HydrophobicContact CG2-CD1 3.9Å; I803-L808 WeakPolarHBondContact O-CB 3.33Å; I803-L808 VanDerWaalsContact O-CG 3.25Å; I803-L808 WeakPolarHBondContact O-CG 2.98Å; I803-L808 PolarHBondContact O-N 3.05Å; I803-A838 HydrophobicContact CD1-CB 4.07Å; I803-A838 HydrophobicContact CG2-CB 4Å; I803-L841 HydrophobicContact CD1-CD1 4.15Å; I803-L841 HydrophobicContact CD1-CD2 4.36Å; I803-L841 HydrophobicContact CG1-CD2 4.21Å; I803-L842 HydrophobicContact CG2-CD1 4.16Å; I803-L842 HydrophobicContact CG2-CD2 3.9Å; I803-L842 HydrophobicContact CG2-CG 4Å
804	V	95	Very high	92.1	Very high	43 Å²	43	50 Å²	50	26%	0.261	27%	0.273	S	S	.	.	I	π-helix	trans	-78.6	-63.3	-177.3	177.7	0	0	0	0	110.5	V799 M809 L863	V799-V804 HydrophobicContact CG1-CG2 4.42Å; V799-V804 WeakPolarHBondContact O-CG2 3.25Å; V799-V804 PolarHBondContact O-N 3.48Å; V804-M809 HydrophobicContact CG1-CG 4.39Å; V804-M809 WeakPolarHBondContact O-CB 3.47Å; V804-M809 WeakPolarHBondContact O-CG 3.15Å; V804-M809 PolarHBondContact O-N 2.88Å; V804-L863 HydrophobicContact CG1-CD2 4.35Å; V804-L863 HydrophobicContact CG2-CD2 3.88Å
805	K	93.7	Very high	91.1	Very high	124 Å²	124	47.9 Å²	47.9	54%	0.539	26%	0.262	S	S	.	.	I	π-helix	trans	-68.4	-48	-170.3	172.9	-171.3	162.2	-78.1	0	113.2	A800 N801 N810	A800-K805 PolarHBondContact O-N 3.11Å; N801-K805 WeakPolarHBondContact O-CB 3.28Å; K805-N810 PolarHBondContact O-ND2 2.9Å
806	D	94	Very high	90	Very high	51 Å²	51	54.9 Å²	54.9	27%	0.273	30%	0.295	S	S	.	.	I	π-helix	trans	-90.6	-41.5	-171.2	-63.8	-21.8	0	0	0	113.1	N801 F802 N810 R812	N801-D806 VanDerWaalsContact O-CG 3.31Å; N801-D806 PolarHBondContact O-N 2.97Å; F802-D806 PolarHBondContact O-N 2.65Å; D806-N810 PolarHBondContact O-ND2 3.49Å; D806-R812 PolarHBondContact O-NH1 2.75Å; D806-R812 PolarHBondContact O-NH2 3.26Å
807	L	95.2	Very high	89	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.315	C	S	.	.	I	π-helix	trans	-87.3	-59.1	-177.5	-179.9	60.4	0	0	0	113.6	L773 L777 F802 A834 K835 A838	L773-L807 HydrophobicContact CD1-CD1 4.18Å; L773-L807 HydrophobicContact CD1-CD2 4.23Å; L777-L807 HydrophobicContact CD1-CD2 4.16Å; F802-L807 HydrophobicContact CE1-CB 4.36Å; F802-L807 HydrophobicContact CE1-CD2 4.25Å; F802-L807 WeakPolarHBondContact O-CB 3.12Å; F802-L807 PolarHBondContact O-N 2.71Å; L807-A834 HydrophobicContact CD1-CB 4.37Å; L807-A834 HydrophobicContact CD2-CB 4.5Å; L807-K835 HydrophobicContact CD1-CG 4.36Å; L807-K835 HydrophobicContact CG-CG 4.35Å; L807-K835 VanDerWaalsContact O-CE 3.25Å; L807-K835 WeakPolarHBondContact O-CE 3.47Å; L807-A838 HydrophobicContact CD2-CB 3.72Å
808	L	94.2	Very high	88.1	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	31%	0.311	C	S	.	.	I	π-helix	trans	-71.8	-39.5	-171.4	-73.3	167.6	0	0	0	113.2	I803 N810 K835 I839 L842 L863 M867 L874	I803-L808 HydrophobicContact CG2-CD1 3.9Å; I803-L808 WeakPolarHBondContact O-CB 3.33Å; I803-L808 VanDerWaalsContact O-CG 3.25Å; I803-L808 WeakPolarHBondContact O-CG 2.98Å; I803-L808 PolarHBondContact O-N 3.05Å; L808-N810 VanDerWaalsContact C-N 3.34Å; L808-N810 PolarHBondContact O-N 3.26Å; L808-K835 HydrophobicContact CD2-CB 3.82Å; L808-K835 HydrophobicContact CD2-CD 4.4Å; L808-K835 HydrophobicContact CD2-CG 3.94Å; L808-K835 PolarHBondContact O-NZ 3.01Å; L808-K835 VanDerWaalsContact O-NZ 3.16Å; L808-I839 HydrophobicContact CD2-CD1 4.44Å; L808-I839 HydrophobicContact CD2-CG1 4.18Å; L808-L842 HydrophobicContact CD1-CD1 4.07Å; L808-L863 HydrophobicContact CD1-CD2 4.05Å; L808-M867 HydrophobicContact CD2-CE 4.31Å; L808-L874 HydrophobicContact CB-CD2 4.37Å
809	M	92.3	Very high	87.3	Confident	84 Å²	84	61.5 Å²	61.5	41%	0.414	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	9.9	-173.7	-65.6	-68.8	-57.8	0	0	115.3	V804 L874 T875	V804-M809 HydrophobicContact CG1-CG 4.39Å; V804-M809 WeakPolarHBondContact O-CB 3.47Å; V804-M809 WeakPolarHBondContact O-CG 3.15Å; V804-M809 PolarHBondContact O-N 2.88Å; M809-L874 HydrophobicContact SD-CD2 3.69Å; M809-L874 HydrophobicContact SD-CG 3.89Å; M809-T875 WeakPolarHBondContact O-CG2 3.25Å
810	N	91.7	Very high	87.1	Confident	69 Å²	69	65.1 Å²	65.1	37%	0.369	35%	0.349	S	S	.	.			trans	-133.2	150.3	176.3	-60.5	-76.4	0	0	0	110.7	K805 D806 L808 K835	K805-N810 PolarHBondContact O-ND2 2.9Å; D806-N810 PolarHBondContact O-ND2 3.49Å; L808-N810 VanDerWaalsContact C-N 3.34Å; L808-N810 PolarHBondContact O-N 3.26Å; N810-K835 WeakPolarHBondContact O-CE 3.33Å; N810-K835 PolarHBondContact O-NZ 3.09Å
811	D	89.8	Confident	87	Confident	13 Å²	13	64.8 Å²	64.8	7%	0.07	34%	0.339	C	S	.	.			trans	-124.2	107.1	172.6	-59.7	-63	0	0	0	109.6	K835 T875 R879	D811-K835 IonicContact OD1-NZ 2.68Å; D811-K835 PolarHBondContact OD1-NZ 3.32Å; D811-T875 WeakPolarHBondContact OD2-CB 3.36Å; D811-T875 WeakPolarHBondContact OD2-CG2 3.35Å; D811-T875 PolarHBondContact OD2-OG1 3.19Å; D811-R879 HydrophobicContact CB-CB 4.03Å; D811-R879 PolarHBondContact O-NH1 2.93Å
812	R	88.5	Confident	87	Confident	87 Å²	87	62.6 Å²	62.6	33%	0.328	32%	0.324	S	S	.	.			trans	-84.2	-40.7	-177.5	-64.9	163.2	179.8	70.4	10.2	111.3	A767 D768 D806 E831	A767-R812 VanDerWaalsContact CB-CZ 3.47Å; A767-R812 WeakPolarHBondContact O-CD 3.41Å; A767-R812 PolarHBondContact O-NE 2.9Å; D768-R812 IonicContact OD1-CZ 3.72Å; D768-R812 IonicContact OD1-NE 2.96Å; D768-R812 PolarHBondContact OD1-NE 2.68Å; D768-R812 IonicContact OD1-NH2 3.6Å; D806-R812 PolarHBondContact O-NH1 2.75Å; D806-R812 PolarHBondContact O-NH2 3.26Å; R812-E831 WeakPolarHBondContact CB-OE1 3.44Å; R812-E831 WeakPolarHBondContact CG-OE1 3.27Å; R812-E831 PolarHBondContact N-OE1 3.39Å; R812-E831 PolarHBondContact N-OE2 3.38Å; R812-E831 IonicContact NH1-OE1 2.7Å; R812-E831 PolarHBondContact NH1-OE1 2.91Å
813	S	79.8	Confident	86.7	Confident	48 Å²	48	61.5 Å²	61.5	34%	0.336	32%	0.32	S	S	.	.	S	Bend	trans	-90.9	142.8	177	58.6	0	0	0	0	111.4	E831	S813-E831 WeakPolarHBondContact CB-OE2 3.43Å; S813-E831 PolarHBondContact N-OE2 3.25Å; S813-E831 PolarHBondContact OG-OE2 3.36Å
814	T	78.3	Confident	86.3	Confident	108 Å²	108	64.6 Å²	64.6	66%	0.663	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-100.8	117.1	168	52.9	0	0	0	0	108.8	R879	T814-R879 CarbonylContact C-O 3.59Å; T814-R879 WeakPolarHBondContact CA-O 3.49Å; T814-R879 HydrophobicContact CG2-CB 4.4Å; T814-R879 HydrophobicContact CG2-CG 4.42Å
815	G	71.1	Confident	85.9	Confident	15 Å²	15	66.9 Å²	66.9	16%	0.155	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.8	153.5	-176.2	0	0	0	0	0	113.3	R879	G815-R879 PolarHBondContact N-O 2.83Å
816	E	70.2	Confident	85.5	Confident	147 Å²	147	69.6 Å²	69.6	69%	0.687	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-61.9	138.4	178.5	-69.7	-161.1	152.8	0	0	112.5	N818	E816-N818 PolarHBondContact O-N 3.01Å; E816-N818 PolarHBondContact OE2-ND2 3.39Å
817	K	70.6	Confident	85.2	Confident	199 Å²	199	71.9 Å²	71.9	87%	0.865	37%	0.374	S	S	*	.			trans	-91.1	41.1	-179.7	-62.7	-176.8	180	178.1	0	112.2	G819	K817-G819 PolarHBondContact O-N 2.88Å
818	N	74.9	Confident	84.9	Confident	68 Å²	68	72.2 Å²	72.2	36%	0.364	38%	0.376	S	S	.	.	S	Bend	trans	-74.8	-7.4	179.9	65.2	32.6	0	0	0	113.9	E816 K820	E816-N818 PolarHBondContact O-N 3.01Å; E816-N818 PolarHBondContact OE2-ND2 3.39Å; N818-K820 PolarHBondContact O-N 3.34Å; N818-K820 WeakPolarHBondContact OD1-CB 3.44Å; N818-K820 WeakPolarHBondContact OD1-CG 3.32Å; N818-K820 PolarHBondContact OD1-N 3.08Å
819	G	79.6	Confident	84.7	Confident	58 Å²	58	73.1 Å²	73.1	60%	0.598	38%	0.383	S	S	*	.			trans	76.5	-4.2	175.6	0	0	0	0	0	115.6	K817	K817-G819 PolarHBondContact O-N 2.88Å
820	K	89.1	Confident	84.6	Confident	86 Å²	86	71.4 Å²	71.4	37%	0.374	38%	0.378	S	S	.	.			trans	-61.3	136.5	177.4	-60.9	-178	-169.2	179.6	0	110.4	N818 W822 E827 S883	N818-K820 PolarHBondContact O-N 3.34Å; N818-K820 WeakPolarHBondContact OD1-CB 3.44Å; N818-K820 WeakPolarHBondContact OD1-CG 3.32Å; N818-K820 PolarHBondContact OD1-N 3.08Å; K820-W822 VanDerWaalsContact C-N 3.32Å; K820-W822 WeakPolarHBondContact CB-O 3.49Å; K820-E827 IonicContact NZ-OE1 3.21Å; K820-E827 PolarHBondContact NZ-OE1 3.06Å; K820-E827 IonicContact NZ-OE2 3.89Å; K820-E827 PolarHBondContact NZ-OE2 3.08Å; K820-S883 PolarHBondContact O-N 3.44Å; K820-S883 VanDerWaalsContact O-N 3.16Å
821	L	92.8	Very high	84.6	Confident	46 Å²	46	68.3 Å²	68.3	24%	0.241	36%	0.361	C	S	.	.	S	Bend	trans	-80.5	-15.4	171	-63.3	-178.4	0	0	0	113.3	K882 S886 E924 C925	L821-K882 HydrophobicContact CD2-CB 4.46Å; L821-K882 HydrophobicContact CD2-CD 3.46Å; L821-K882 VanDerWaalsContact CD2-CD 3.46Å; L821-S886 WeakPolarHBondContact O-CB 3.26Å; L821-S886 PolarHBondContact O-OG 3.08Å; L821-E924 HydrophobicContact CD1-CB 4.29Å; L821-E924 HydrophobicContact CD1-CG 3.62Å; L821-E924 HydrophobicContact CD2-CG 4.41Å; L821-E924 WeakPolarHBondContact CD2-OE2 3.29Å; L821-C925 HydrophobicContact CB-CB 4.21Å; L821-C925 PolarHBondContact O-SG 3.44Å; L821-C925 VanDerWaalsContact O-SG 3.36Å
822	W	93.9	Very high	84.8	Confident	43 Å²	43	67.9 Å²	67.9	16%	0.163	36%	0.359	C	S	.	.			trans	-151.4	145.5	178.5	-167.2	-94	0	0	0	109.7	K820 R887 L890 Q927 V928 I931	K820-W822 VanDerWaalsContact C-N 3.32Å; K820-W822 WeakPolarHBondContact CB-O 3.49Å; W822-R887 HydrophobicContact CZ3-CG 4.43Å; W822-L890 HydrophobicContact CH2-CD2 3.69Å; W822-L890 HydrophobicContact CZ3-CD2 4.04Å; W822-Q927 HydrophobicContact CB-CG 4.32Å; W822-Q927 HydrophobicContact CD2-CB 3.48Å; W822-Q927 VanDerWaalsContact CD2-CB 3.48Å; W822-Q927 HydrophobicContact CD2-CG 3.81Å; W822-Q927 HydrophobicContact CE3-CB 3.7Å; W822-Q927 HydrophobicContact CG-CB 3.9Å; W822-Q927 HydrophobicContact CG-CG 3.71Å; W822-Q927 HydrophobicContact CH2-CB 4.2Å; W822-Q927 HydrophobicContact CZ2-CB 4.03Å; W822-Q927 HydrophobicContact CZ3-CB 4.05Å; W822-V928 HydrophobicContact CE3-CG2 4.31Å; W822-V928 HydrophobicContact CZ3-CG2 3.94Å; W822-I931 HydrophobicContact CH2-CD1 3.86Å; W822-I931 HydrophobicContact CZ2-CD1 3.92Å
823	S	89.9	Confident	85	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.007	36%	0.357	C	S	.	.			trans	-126.9	152	175.1	58.3	0	0	0	0	109.4	E827 R887	S823-E827 VanDerWaalsContact CB-OE2 3.31Å; S823-E827 WeakPolarHBondContact CB-OE2 3.44Å; S823-R887 PolarHBondContact O-NH2 3.16Å
824	P	88.9	Confident	85.8	Confident	64 Å²	64	64.1 Å²	64.1	42%	0.416	34%	0.341	S	S	.	.			trans	-52.8	157.1	168.1	-25.8	35.3	0	0	0	112.2	E826 E827 V828	P824-E826 PolarHBondContact O-N 2.97Å; P824-E826 VanDerWaalsContact O-N 3.11Å; P824-E827 WeakPolarHBondContact CD-OE2 3.49Å; P824-E827 PolarHBondContact O-N 3.24Å; P824-V828 WeakPolarHBondContact O-CG2 3.24Å; P824-V828 PolarHBondContact O-N 3.36Å
825	D	85.5	Confident	86.6	Confident	91 Å²	91	59.1 Å²	59.1	49%	0.487	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-60.7	-23.6	-176.7	-79.7	48.8	0	0	0	113.3	R887	D825-R887 IonicContact OD1-CZ 2.67Å; D825-R887 IonicContact OD1-NH1 2.91Å; D825-R887 PolarHBondContact OD1-NH1 3.06Å; D825-R887 IonicContact OD1-NH2 2.71Å; D825-R887 PolarHBondContact OD1-NH2 2.95Å; D825-R887 IonicContact OD2-NH1 2.92Å; D825-R887 PolarHBondContact OD2-NH1 3.3Å
826	E	85.7	Confident	87.8	Confident	182 Å²	182	59.5 Å²	59.5	85%	0.85	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-74.3	-28	172.8	-66.9	141.7	-136.7	0	0	114	P824	P824-E826 PolarHBondContact O-N 2.97Å; P824-E826 VanDerWaalsContact O-N 3.11Å
827	E	86.8	Confident	89	Confident	99 Å²	99	53.9 Å²	53.9	46%	0.463	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-90.2	1	177.6	-79.4	-173.1	-165.8	0	0	112.4	K820 S823 P824	K820-E827 IonicContact NZ-OE1 3.21Å; K820-E827 PolarHBondContact NZ-OE1 3.06Å; K820-E827 IonicContact NZ-OE2 3.89Å; K820-E827 PolarHBondContact NZ-OE2 3.08Å; S823-E827 VanDerWaalsContact CB-OE2 3.31Å; S823-E827 WeakPolarHBondContact CB-OE2 3.44Å; P824-E827 WeakPolarHBondContact CD-OE2 3.49Å; P824-E827 PolarHBondContact O-N 3.24Å
828	V	89	Confident	90.3	Very high	7 Å²	7	44.4 Å²	44.4	4%	0.042	24%	0.242	C	C	.	.	S	Bend	trans	-80.7	133.7	178.3	-177.4	0	0	0	0	109.7	P824 V832 L833 D884 R887	P824-V828 WeakPolarHBondContact O-CG2 3.24Å; P824-V828 PolarHBondContact O-N 3.36Å; V828-V832 HydrophobicContact CG1-CB 4.29Å; V828-V832 HydrophobicContact CG1-CG1 4.09Å; V828-L833 HydrophobicContact CB-CD2 3.91Å; V828-L833 HydrophobicContact CB-CG 4.07Å; V828-L833 HydrophobicContact CG1-CD2 3.67Å; V828-L833 HydrophobicContact CG1-CG 3.78Å; V828-D884 WeakPolarHBondContact CG1-OD1 3.32Å; V828-R887 HydrophobicContact CG1-CG 4.37Å; V828-R887 HydrophobicContact CG2-CG 4.31Å
829	S	89.8	Confident	91.4	Very high	21 Å²	21	41.3 Å²	41.3	15%	0.147	23%	0.225	C	C	.	.			trans	-61.1	135.2	-179.2	57.8	0	0	0	0	111.6	E831 V832 L833 D884	S829-E831 PolarHBondContact O-N 3.48Å; S829-V832 WeakPolarHBondContact O-CA 3.49Å; S829-V832 PolarHBondContact O-N 2.92Å; S829-V832 WeakPolarHBondContact OG-CB 3.09Å; S829-V832 WeakPolarHBondContact OG-CG2 3.08Å; S829-L833 PolarHBondContact O-N 3.15Å; S829-D884 PolarHBondContact N-OD1 3.13Å; S829-D884 VanDerWaalsContact OG-CG 3.25Å; S829-D884 PolarHBondContact OG-OD1 3.16Å; S829-D884 PolarHBondContact OG-OD2 3.46Å
830	P	91	Very high	92.3	Very high	48 Å²	48	42.8 Å²	42.8	31%	0.312	22%	0.215	S	C	.	.	H	α-helix	trans	-59	-31.9	-177.2	-28.7	35.7	0	0	0	114.2	P770 E771 V832 L833 A834	P770-P830 HydrophobicContact CB-CB 4.5Å; P770-P830 HydrophobicContact CG-CB 4.23Å; E771-P830 HydrophobicContact CG-CB 3.59Å; E771-P830 HydrophobicContact CG-CG 3.87Å; P830-V832 VanDerWaalsContact C-N 3.31Å; P830-V832 PolarHBondContact O-N 2.94Å; P830-L833 PolarHBondContact O-N 2.99Å; P830-A834 WeakPolarHBondContact O-CB 3.46Å; P830-A834 PolarHBondContact O-N 2.85Å
831	E	92.5	Very high	92.7	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.019	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-40.7	172.3	-174.3	166.8	-152.1	0	0	111.5	P770 R812 S813 S829 A834 K835	P770-E831 HydrophobicContact CB-CB 4.25Å; P770-E831 HydrophobicContact CG-CB 4.22Å; R812-E831 WeakPolarHBondContact CB-OE1 3.44Å; R812-E831 WeakPolarHBondContact CG-OE1 3.27Å; R812-E831 PolarHBondContact N-OE1 3.39Å; R812-E831 PolarHBondContact N-OE2 3.38Å; R812-E831 IonicContact NH1-OE1 2.7Å; R812-E831 PolarHBondContact NH1-OE1 2.91Å; S813-E831 WeakPolarHBondContact CB-OE2 3.43Å; S813-E831 PolarHBondContact N-OE2 3.25Å; S813-E831 PolarHBondContact OG-OE2 3.36Å; S829-E831 PolarHBondContact O-N 3.48Å; E831-A834 WeakPolarHBondContact O-CB 3.35Å; E831-A834 PolarHBondContact O-N 3.36Å; E831-K835 WeakPolarHBondContact O-CG 3.2Å; E831-K835 PolarHBondContact O-N 3.16Å
832	V	93.4	Very high	92.9	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-77	-34.8	179.3	171.4	0	0	0	0	111.6	V828 S829 P830 A834 K835 V836 I880 D884 R887 L888	V828-V832 HydrophobicContact CG1-CB 4.29Å; V828-V832 HydrophobicContact CG1-CG1 4.09Å; S829-V832 WeakPolarHBondContact O-CA 3.49Å; S829-V832 PolarHBondContact O-N 2.92Å; S829-V832 WeakPolarHBondContact OG-CB 3.09Å; S829-V832 WeakPolarHBondContact OG-CG2 3.08Å; P830-V832 VanDerWaalsContact C-N 3.31Å; P830-V832 PolarHBondContact O-N 2.94Å; V832-A834 VanDerWaalsContact C-N 3.28Å; V832-A834 PolarHBondContact O-N 3.01Å; V832-K835 PolarHBondContact O-N 3.42Å; V832-V836 HydrophobicContact CG1-CG2 4.46Å; V832-V836 WeakPolarHBondContact O-CB 3.45Å; V832-V836 VanDerWaalsContact O-CG2 3.27Å; V832-V836 WeakPolarHBondContact O-CG2 3.39Å; V832-V836 PolarHBondContact O-N 3.49Å; V832-I880 HydrophobicContact CG2-CD1 3.84Å; V832-I880 HydrophobicContact CG2-CG1 4.34Å; V832-D884 HydrophobicContact CB-CB 4.19Å; V832-D884 HydrophobicContact CG1-CB 3.89Å; V832-D884 HydrophobicContact CG2-CB 3.72Å; V832-R887 HydrophobicContact CG1-CB 4.19Å; V832-L888 HydrophobicContact CG1-CD2 4.29Å; V832-L888 HydrophobicContact CG1-CG 4.23Å
833	L	93.3	Very high	93.1	Very high	56 Å²	56	35 Å²	35	29%	0.293	18%	0.182	S	C	.	.	H	α-helix	trans	-58	-42.2	167.1	-67.1	177.5	0	0	0	111.2	I774 V828 S829 P830 V836 Q837	I774-L833 HydrophobicContact CD1-CB 3.84Å; V828-L833 HydrophobicContact CB-CD2 3.91Å; V828-L833 HydrophobicContact CB-CG 4.07Å; V828-L833 HydrophobicContact CG1-CD2 3.67Å; V828-L833 HydrophobicContact CG1-CG 3.78Å; S829-L833 PolarHBondContact O-N 3.15Å; P830-L833 PolarHBondContact O-N 2.99Å; L833-V836 PolarHBondContact O-N 3.21Å; L833-Q837 WeakPolarHBondContact O-CG 3.32Å; L833-Q837 PolarHBondContact O-N 3.44Å
834	A	94.9	Very high	93.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-47.1	174.9	0	0	0	0	0	112	P770 L773 I774 L777 L807 P830 E831 V832 V836 Q837 A838	P770-A834 HydrophobicContact CB-CB 4.19Å; L773-A834 HydrophobicContact CB-CB 4.2Å; L773-A834 HydrophobicContact CD1-CB 4.17Å; I774-A834 HydrophobicContact CD1-CB 3.84Å; L777-A834 HydrophobicContact CD1-CB 4.38Å; L777-A834 WeakPolarHBondContact CD1-O 3.41Å; L807-A834 HydrophobicContact CD1-CB 4.37Å; L807-A834 HydrophobicContact CD2-CB 4.5Å; P830-A834 WeakPolarHBondContact O-CB 3.46Å; P830-A834 PolarHBondContact O-N 2.85Å; E831-A834 WeakPolarHBondContact O-CB 3.35Å; E831-A834 PolarHBondContact O-N 3.36Å; V832-A834 VanDerWaalsContact C-N 3.28Å; V832-A834 PolarHBondContact O-N 3.01Å; A834-V836 VanDerWaalsContact C-N 3.3Å; A834-V836 PolarHBondContact O-N 3.01Å; A834-Q837 PolarHBondContact O-N 3.43Å; A834-Q837 VanDerWaalsContact O-N 3.15Å; A834-A838 WeakPolarHBondContact O-CB 3.34Å; A834-A838 PolarHBondContact O-N 3.48Å
835	K	96.1	Very high	93.8	Very high	4 Å²	4	34 Å²	34	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-56.5	-41.6	173.9	-70.6	-175	-175.4	-159.3	0	111.8	L807 L808 N810 D811 E831 V832 A838 I839 L888	L807-K835 HydrophobicContact CD1-CG 4.36Å; L807-K835 HydrophobicContact CG-CG 4.35Å; L807-K835 VanDerWaalsContact O-CE 3.25Å; L807-K835 WeakPolarHBondContact O-CE 3.47Å; L808-K835 HydrophobicContact CD2-CB 3.82Å; L808-K835 HydrophobicContact CD2-CD 4.4Å; L808-K835 HydrophobicContact CD2-CG 3.94Å; L808-K835 PolarHBondContact O-NZ 3.01Å; L808-K835 VanDerWaalsContact O-NZ 3.16Å; N810-K835 WeakPolarHBondContact O-CE 3.33Å; N810-K835 PolarHBondContact O-NZ 3.09Å; D811-K835 IonicContact OD1-NZ 2.68Å; D811-K835 PolarHBondContact OD1-NZ 3.32Å; E831-K835 WeakPolarHBondContact O-CG 3.2Å; E831-K835 PolarHBondContact O-N 3.16Å; V832-K835 PolarHBondContact O-N 3.42Å; K835-A838 WeakPolarHBondContact O-CB 3.15Å; K835-A838 PolarHBondContact O-N 3.5Å; K835-I839 WeakPolarHBondContact O-CG1 3.5Å; K835-I839 PolarHBondContact O-N 3.4Å; K835-L888 HydrophobicContact CB-CD2 3.9Å; K835-L888 HydrophobicContact CD-CD1 4.44Å
836	V	96.2	Very high	94.2	Very high	22 Å²	22	29.6 Å²	29.6	13%	0.133	15%	0.146	C	C	.	.	H	α-helix	trans	-66.2	-38.6	176.3	168.6	0	0	0	0	112.3	V832 L833 A834 K840 L888 A891	V832-V836 HydrophobicContact CG1-CG2 4.46Å; V832-V836 WeakPolarHBondContact O-CB 3.45Å; V832-V836 VanDerWaalsContact O-CG2 3.27Å; V832-V836 WeakPolarHBondContact O-CG2 3.39Å; V832-V836 PolarHBondContact O-N 3.49Å; L833-V836 PolarHBondContact O-N 3.21Å; A834-V836 VanDerWaalsContact C-N 3.3Å; A834-V836 PolarHBondContact O-N 3.01Å; V836-K840 HydrophobicContact CG1-CD 4.5Å; V836-K840 VanDerWaalsContact O-CG 3.31Å; V836-K840 WeakPolarHBondContact O-CG 3.43Å; V836-K840 PolarHBondContact O-N 2.91Å; V836-L888 HydrophobicContact CG2-CD2 4Å; V836-A891 HydrophobicContact CG1-CB 4.4Å; V836-A891 HydrophobicContact CG2-CB 4.1Å
837	Q	96.4	Very high	94.7	Very high	30 Å²	30	22 Å²	22	14%	0.14	11%	0.111	C	C	.	.	H	α-helix	trans	-71.2	-33.4	172.8	-64	-60.6	-8.9	0	0	112.5	I774 L777 V778 L833 A834 K840 L841	I774-Q837 HydrophobicContact CG2-CG 3.98Å; L777-Q837 HydrophobicContact CB-CB 4.09Å; L777-Q837 HydrophobicContact CD1-CB 4.24Å; V778-Q837 HydrophobicContact CG2-CB 4.39Å; V778-Q837 HydrophobicContact CG2-CG 4.1Å; V778-Q837 VanDerWaalsContact CG2-OE1 3.26Å; L833-Q837 WeakPolarHBondContact O-CG 3.32Å; L833-Q837 PolarHBondContact O-N 3.44Å; A834-Q837 PolarHBondContact O-N 3.43Å; A834-Q837 VanDerWaalsContact O-N 3.15Å; Q837-K840 CarbonylContact O-C 3.52Å; Q837-K840 WeakPolarHBondContact O-CB 3.43Å; Q837-K840 PolarHBondContact O-N 3.2Å; Q837-K840 VanDerWaalsContact OE1-CD 3.24Å; Q837-L841 PolarHBondContact O-N 2.79Å
838	A	97.5	Very high	95	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65	-42.9	175.4	0	0	0	0	0	112	L777 I803 L807 A834 K835 K840 L841 L842	L777-A838 HydrophobicContact CD1-CB 4.22Å; I803-A838 HydrophobicContact CD1-CB 4.07Å; I803-A838 HydrophobicContact CG2-CB 4Å; L807-A838 HydrophobicContact CD2-CB 3.72Å; A834-A838 WeakPolarHBondContact O-CB 3.34Å; A834-A838 PolarHBondContact O-N 3.48Å; K835-A838 WeakPolarHBondContact O-CB 3.15Å; K835-A838 PolarHBondContact O-N 3.5Å; A838-K840 VanDerWaalsContact C-N 3.31Å; A838-K840 PolarHBondContact O-N 2.89Å; A838-L841 WeakPolarHBondContact O-CA 3.4Å; A838-L841 WeakPolarHBondContact O-CB 3.37Å; A838-L841 PolarHBondContact O-N 3.29Å; A838-L841 VanDerWaalsContact O-N 3.07Å; A838-L842 WeakPolarHBondContact O-CG 3.49Å; A838-L842 PolarHBondContact O-N 2.89Å
839	I	98.1	Very high	95.1	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-57.9	-43.5	170.5	-69.7	162.8	0	0	0	110.9	L808 K835 L841 L842 V843 L864 M867 L888 A891 A895	L808-I839 HydrophobicContact CD2-CD1 4.44Å; L808-I839 HydrophobicContact CD2-CG1 4.18Å; K835-I839 WeakPolarHBondContact O-CG1 3.5Å; K835-I839 PolarHBondContact O-N 3.4Å; I839-L841 VanDerWaalsContact C-N 3.33Å; I839-L841 PolarHBondContact O-N 3.28Å; I839-L842 PolarHBondContact O-N 3.15Å; I839-V843 WeakPolarHBondContact O-CG2 3.4Å; I839-V843 PolarHBondContact O-N 3.28Å; I839-V843 VanDerWaalsContact O-N 3.16Å; I839-L864 HydrophobicContact CG1-CD2 4.48Å; I839-L864 HydrophobicContact CG2-CD2 3.87Å; I839-M867 HydrophobicContact CD1-CE 4.12Å; I839-M867 HydrophobicContact CD1-SD 3.63Å; I839-L888 HydrophobicContact CD1-CD2 4.09Å; I839-A891 HydrophobicContact CD1-CB 3.91Å; I839-A891 HydrophobicContact CG2-CB 4.3Å; I839-A895 HydrophobicContact CG2-CB 3.78Å
840	K	98	Very high	95.2	Very high	88 Å²	88	23.2 Å²	23.2	38%	0.383	12%	0.116	S	C	.	.	H	α-helix	trans	-66.4	-31.7	175.1	-64.2	163.1	-171.2	169.5	0	112.3	V836 Q837 A838 R844	V836-K840 HydrophobicContact CG1-CD 4.5Å; V836-K840 VanDerWaalsContact O-CG 3.31Å; V836-K840 WeakPolarHBondContact O-CG 3.43Å; V836-K840 PolarHBondContact O-N 2.91Å; Q837-K840 CarbonylContact O-C 3.52Å; Q837-K840 WeakPolarHBondContact O-CB 3.43Å; Q837-K840 PolarHBondContact O-N 3.2Å; Q837-K840 VanDerWaalsContact OE1-CD 3.24Å; A838-K840 VanDerWaalsContact C-N 3.31Å; A838-K840 PolarHBondContact O-N 2.89Å; K840-R844 VanDerWaalsContact CB-NH1 3.34Å; K840-R844 WeakPolarHBondContact O-CB 3.38Å; K840-R844 WeakPolarHBondContact O-CG 3.42Å; K840-R844 PolarHBondContact O-N 3.18Å
841	L	97.8	Very high	95.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-47	172.2	174.2	160.6	0	0	0	110.7	L777 L780 M795 V799 I803 Q837 A838 I839 V843 R844 W845	L777-L841 HydrophobicContact CD2-CD1 3.92Å; L780-L841 HydrophobicContact CB-CD1 4.01Å; M795-L841 HydrophobicContact CE-CD1 4.43Å; M795-L841 HydrophobicContact SD-CD1 4.44Å; M795-L841 HydrophobicContact SD-CD2 3.92Å; M795-L841 HydrophobicContact SD-CG 4.49Å; V799-L841 HydrophobicContact CG2-CD2 3.91Å; I803-L841 HydrophobicContact CD1-CD1 4.15Å; I803-L841 HydrophobicContact CD1-CD2 4.36Å; I803-L841 HydrophobicContact CG1-CD2 4.21Å; Q837-L841 PolarHBondContact O-N 2.79Å; A838-L841 WeakPolarHBondContact O-CA 3.4Å; A838-L841 WeakPolarHBondContact O-CB 3.37Å; A838-L841 PolarHBondContact O-N 3.29Å; A838-L841 VanDerWaalsContact O-N 3.07Å; I839-L841 VanDerWaalsContact C-N 3.33Å; I839-L841 PolarHBondContact O-N 3.28Å; L841-V843 VanDerWaalsContact C-N 3.3Å; L841-V843 PolarHBondContact O-N 3.34Å; L841-R844 PolarHBondContact O-N 2.76Å; L841-R844 VanDerWaalsContact O-N 3.15Å; L841-W845 WeakPolarHBondContact O-CB 3.43Å; L841-W845 PolarHBondContact O-N 3.4Å
842	L	97	Very high	95	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-55.5	-45.4	176.9	-66	174.6	0	0	0	111.8	V799 I803 L808 A838 I839 L846 T860 L863	V799-L842 HydrophobicContact CB-CD2 4.27Å; V799-L842 HydrophobicContact CG1-CD2 3.48Å; V799-L842 VanDerWaalsContact CG1-CD2 3.48Å; V799-L842 HydrophobicContact CG2-CD2 3.85Å; I803-L842 HydrophobicContact CG2-CD1 4.16Å; I803-L842 HydrophobicContact CG2-CD2 3.9Å; I803-L842 HydrophobicContact CG2-CG 4Å; L808-L842 HydrophobicContact CD1-CD1 4.07Å; A838-L842 WeakPolarHBondContact O-CG 3.49Å; A838-L842 PolarHBondContact O-N 2.89Å; I839-L842 PolarHBondContact O-N 3.15Å; L842-L846 WeakPolarHBondContact O-CG 3.44Å; L842-L846 PolarHBondContact O-N 3.31Å; L842-T860 HydrophobicContact CB-CG2 4.08Å; L842-T860 HydrophobicContact CD1-CG2 4.36Å; L842-L863 HydrophobicContact CD1-CD2 4.17Å
843	V	97.3	Very high	94.6	Very high	12 Å²	12	33 Å²	33	7%	0.073	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-44.2	176.8	175.5	0	0	0	0	111.8	I839 L841 L846 L847 A895 K898 L899	I839-V843 WeakPolarHBondContact O-CG2 3.4Å; I839-V843 PolarHBondContact O-N 3.28Å; I839-V843 VanDerWaalsContact O-N 3.16Å; L841-V843 VanDerWaalsContact C-N 3.3Å; L841-V843 PolarHBondContact O-N 3.34Å; V843-L846 PolarHBondContact O-N 2.92Å; V843-L847 HydrophobicContact CG1-CD1 3.75Å; V843-L847 HydrophobicContact CG1-CG 4.3Å; V843-L847 WeakPolarHBondContact O-CB 3.42Å; V843-L847 VanDerWaalsContact O-CG 3.26Å; V843-L847 WeakPolarHBondContact O-CG 3.37Å; V843-L847 PolarHBondContact O-N 3.37Å; V843-A895 HydrophobicContact CG2-CB 3.47Å; V843-A895 VanDerWaalsContact CG2-CB 3.47Å; V843-K898 HydrophobicContact CG1-CB 4.17Å; V843-K898 HydrophobicContact CG1-CG 3.74Å; V843-L899 HydrophobicContact CG1-CD2 4.21Å; V843-L899 HydrophobicContact CG1-CG 4.4Å; V843-L899 HydrophobicContact CG2-CG 4.39Å
844	R	97	Very high	94.2	Very high	35 Å²	35	32.7 Å²	32.7	13%	0.132	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-42.5	178	-77.3	176.5	-172	115.4	-15.3	112.5	G781 H782 M785 K840 L841 L847 G848	G781-R844 WeakPolarHBondContact O-CB 3.17Å; H782-R844 PolarHBondContact CD2-NE 3.41Å; H782-R844 PolarHBondContact CE1-NE 3.21Å; H782-R844 VanDerWaalsContact CE1-NE 3.29Å; H782-R844 PolarHBondContact NE2-NE 3.2Å; H782-R844 PolarHBondContact NE2-NH2 3.43Å; M785-R844 HydrophobicContact CB-CB 4.16Å; M785-R844 WeakPolarHBondContact CB-O 3.49Å; M785-R844 HydrophobicContact SD-CB 4.47Å; M785-R844 HydrophobicContact SD-CG 4.17Å; K840-R844 VanDerWaalsContact CB-NH1 3.34Å; K840-R844 WeakPolarHBondContact O-CB 3.38Å; K840-R844 WeakPolarHBondContact O-CG 3.42Å; K840-R844 PolarHBondContact O-N 3.18Å; L841-R844 PolarHBondContact O-N 2.76Å; L841-R844 VanDerWaalsContact O-N 3.15Å; R844-L847 PolarHBondContact O-N 3.11Å; R844-G848 PolarHBondContact O-N 2.97Å
845	W	95.8	Very high	94	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.027	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-48	177.6	169.5	53.4	0	0	0	111.7	S784 M795 K796 V799 L841 G848 M849	S784-W845 WeakPolarHBondContact OG-CA 3.29Å; M795-W845 HydrophobicContact CG-CB 4.28Å; M795-W845 VanDerWaalsContact CG-CD1 3.43Å; M795-W845 HydrophobicContact CG-CD2 4.24Å; M795-W845 HydrophobicContact CG-CG 3.73Å; K796-W845 HydrophobicContact CB-CZ2 3.96Å; K796-W845 HydrophobicContact CG-CH2 4.36Å; K796-W845 HydrophobicContact CG-CZ2 4.15Å; V799-W845 HydrophobicContact CB-CZ3 4.33Å; V799-W845 HydrophobicContact CG1-CE3 4.31Å; V799-W845 HydrophobicContact CG1-CH2 4.21Å; V799-W845 HydrophobicContact CG1-CZ3 3.78Å; V799-W845 HydrophobicContact CG2-CD2 4.22Å; V799-W845 HydrophobicContact CG2-CE3 3.96Å; V799-W845 HydrophobicContact CG2-CZ3 4.2Å; L841-W845 WeakPolarHBondContact O-CB 3.43Å; L841-W845 PolarHBondContact O-N 3.4Å; W845-G848 PolarHBondContact O-N 2.96Å; W845-M849 HydrophobicContact CD2-SD 4.26Å; W845-M849 VanDerWaalsContact CE2-SD 3.56Å; W845-M849 HydrophobicContact CZ2-SD 3.75Å; W845-M849 PolarHBondContact NE1-SD 3.12Å; W845-M849 WeakPolarHBondContact O-CG 3.21Å; W845-M849 PolarHBondContact O-N 3.25Å
846	L	95.2	Very high	93.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-44.5	174.6	-67.3	178.3	0	0	0	111.8	L842 V843 G848 M849 K850 A857 T860 L899 Y905	L842-L846 WeakPolarHBondContact O-CG 3.44Å; L842-L846 PolarHBondContact O-N 3.31Å; V843-L846 PolarHBondContact O-N 2.92Å; L846-G848 PolarHBondContact O-N 3.11Å; L846-M849 PolarHBondContact O-N 3.06Å; L846-K850 PolarHBondContact O-N 3.01Å; L846-A857 HydrophobicContact CD1-CB 3.92Å; L846-A857 HydrophobicContact CD2-CB 4.01Å; L846-T860 HydrophobicContact CD1-CG2 3.92Å; L846-L899 HydrophobicContact CB-CD2 3.88Å; L846-L899 HydrophobicContact CD1-CD1 4.09Å; L846-L899 HydrophobicContact CD1-CD2 3.91Å; L846-Y905 HydrophobicContact CB-CE2 3.85Å; L846-Y905 WeakPolarHBondContact O-CE2 3.31Å; L846-Y905 PolarHBondContact O-OH 3.36Å
847	L	94.9	Very high	93.7	Very high	23 Å²	23	39.2 Å²	39.2	12%	0.12	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-15.4	176.8	-69.3	175.7	0	0	0	114.4	V843 R844 K850 K898 E902	V843-L847 HydrophobicContact CG1-CD1 3.75Å; V843-L847 HydrophobicContact CG1-CG 4.3Å; V843-L847 WeakPolarHBondContact O-CB 3.42Å; V843-L847 VanDerWaalsContact O-CG 3.26Å; V843-L847 WeakPolarHBondContact O-CG 3.37Å; V843-L847 PolarHBondContact O-N 3.37Å; R844-L847 PolarHBondContact O-N 3.11Å; L847-K850 WeakPolarHBondContact O-CG 3.21Å; L847-K898 HydrophobicContact CD1-CD 4.49Å; L847-K898 HydrophobicContact CD1-CG 4.12Å; L847-E902 HydrophobicContact CD2-CB 3.79Å; L847-E902 HydrophobicContact CD2-CG 4.18Å
848	G	93.4	Very high	93.6	Very high	11 Å²	11	41 Å²	41	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-77.3	-52.1	163	0	0	0	0	0	111.7	R844 W845 L846 K850	R844-G848 PolarHBondContact O-N 2.97Å; W845-G848 PolarHBondContact O-N 2.96Å; L846-G848 PolarHBondContact O-N 3.11Å; G848-K850 VanDerWaalsContact C-N 3.35Å; G848-K850 PolarHBondContact O-N 3.41Å
849	M	92.1	Very high	93.5	Very high	33 Å²	33	44.2 Å²	44.2	16%	0.163	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-36.1	-177.9	-71.2	-176.8	65.9	0	0	114.5	W845 L846 N851	W845-M849 HydrophobicContact CD2-SD 4.26Å; W845-M849 VanDerWaalsContact CE2-SD 3.56Å; W845-M849 HydrophobicContact CZ2-SD 3.75Å; W845-M849 PolarHBondContact NE1-SD 3.12Å; W845-M849 WeakPolarHBondContact O-CG 3.21Å; W845-M849 PolarHBondContact O-N 3.25Å; L846-M849 PolarHBondContact O-N 3.06Å; M849-N851 PolarHBondContact O-N 3.09Å; M849-N851 PolarHBondContact O-ND2 3.26Å
850	K	91.6	Very high	93.4	Very high	108 Å²	108	44.4 Å²	44.4	47%	0.47	23%	0.225	S	C	.	.			trans	48.9	24.3	-179.2	-68.9	174.4	169.5	-77.5	0	115.2	L846 L847 G848 E902 C904 Y905	L846-K850 PolarHBondContact O-N 3.01Å; L847-K850 WeakPolarHBondContact O-CG 3.21Å; G848-K850 VanDerWaalsContact C-N 3.35Å; G848-K850 PolarHBondContact O-N 3.41Å; K850-E902 HydrophobicContact CG-CG 4.48Å; K850-E902 IonicContact NZ-OE1 2.68Å; K850-E902 PolarHBondContact NZ-OE1 3.41Å; K850-E902 IonicContact NZ-OE2 3.46Å; K850-E902 PolarHBondContact NZ-OE2 3.13Å; K850-C904 VanDerWaalsContact C-SG 3.5Å; K850-C904 PolarHBondContact O-SG 3.48Å; K850-Y905 PolarHBondContact N-OH 3.28Å
851	N	90.7	Very high	93.4	Very high	50 Å²	50	40.3 Å²	40.3	27%	0.267	21%	0.207	S	C	.	.			trans	-146.8	165.6	177.4	81.1	81.6	0	0	0	111	M849 Q853 Y905	M849-N851 PolarHBondContact O-N 3.09Å; M849-N851 PolarHBondContact O-ND2 3.26Å; N851-Q853 PolarHBondContact OD1-N 3.31Å; N851-Q853 VanDerWaalsContact OD1-N 3.09Å; N851-Y905 PolarHBondContact N-OH 3.31Å; N851-Y905 VanDerWaalsContact N-OH 3.11Å; N851-Y905 WeakPolarHBondContact O-CE1 3.39Å; N851-Y905 PolarHBondContact O-OH 3.47Å
852	N	88.5	Confident	93.3	Very high	31 Å²	31	48.9 Å²	48.9	17%	0.166	24%	0.239	C	C	.	.			trans	-128.2	22.3	178.2	-171.4	44.8	0	0	0	113.2	S854 K855 S856 A857 N858 Y905 I908	N852-S854 PolarHBondContact O-N 3.39Å; N852-S854 VanDerWaalsContact O-N 3.14Å; N852-K855 PolarHBondContact O-N 3.06Å; N852-K855 WeakPolarHBondContact OD1-CA 3.35Å; N852-S856 PolarHBondContact OD1-N 3.03Å; N852-A857 HydrophobicContact CB-CB 4.42Å; N852-A857 WeakPolarHBondContact OD1-CB 3.48Å; N852-A857 PolarHBondContact OD1-N 3.32Å; N852-N858 PolarHBondContact ND2-OD1 3.4Å; N852-Y905 HydrophobicContact CB-CE1 4.2Å; N852-I908 HydrophobicContact CB-CD1 4.29Å; N852-I908 WeakPolarHBondContact ND2-CD1 3.49Å
853	Q	84.6	Confident	93.3	Very high	180 Å²	180	50.1 Å²	50.1	84%	0.841	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-34.4	-178.2	-64.3	177.7	-4.6	0	0	112.1	N851 K855	N851-Q853 PolarHBondContact OD1-N 3.31Å; N851-Q853 VanDerWaalsContact OD1-N 3.09Å; Q853-K855 VanDerWaalsContact C-N 3.31Å; Q853-K855 PolarHBondContact O-N 3.45Å
854	S	84.7	Confident	93.3	Very high	48 Å²	48	49.7 Å²	49.7	34%	0.336	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	3.3	178	61.8	0	0	0	0	115.2	N852 S856	N852-S854 PolarHBondContact O-N 3.39Å; N852-S854 VanDerWaalsContact O-N 3.14Å; S854-S856 PolarHBondContact O-N 3.25Å; S854-S856 PolarHBondContact OG-OG 2.92Å
855	K	91.4	Very high	93.3	Very high	151 Å²	151	48.6 Å²	48.6	66%	0.657	24%	0.241	S	C	*	.	S	Bend	trans	56.1	12.2	-171.3	-58.6	-177.7	-180	179.5	0	115.2	N852 Q853 A857 N858 S859	N852-K855 PolarHBondContact O-N 3.06Å; N852-K855 WeakPolarHBondContact OD1-CA 3.35Å; Q853-K855 VanDerWaalsContact C-N 3.31Å; Q853-K855 PolarHBondContact O-N 3.45Å; K855-A857 VanDerWaalsContact C-N 3.27Å; K855-A857 PolarHBondContact O-N 2.97Å; K855-N858 PolarHBondContact O-N 3.46Å; K855-S859 PolarHBondContact O-N 3.25Å
856	S	92.2	Very high	93.4	Very high	12 Å²	12	50.3 Å²	50.3	8%	0.084	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-32.9	-176.8	-59.1	0	0	0	0	112.7	N852 S854 S859 T860	N852-S856 PolarHBondContact OD1-N 3.03Å; S854-S856 PolarHBondContact O-N 3.25Å; S854-S856 PolarHBondContact OG-OG 2.92Å; S856-S859 PolarHBondContact O-N 2.89Å; S856-T860 PolarHBondContact O-N 2.91Å; S856-T860 VanDerWaalsContact O-N 3.08Å; S856-T860 PolarHBondContact O-OG1 3Å; S856-T860 VanDerWaalsContact O-OG1 3.08Å
857	A	93.8	Very high	93.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-75.2	-33.8	177.9	0	0	0	0	0	112.6	L846 N852 K855 S859 T860 L861 Y905 I908	L846-A857 HydrophobicContact CD1-CB 3.92Å; L846-A857 HydrophobicContact CD2-CB 4.01Å; N852-A857 HydrophobicContact CB-CB 4.42Å; N852-A857 WeakPolarHBondContact OD1-CB 3.48Å; N852-A857 PolarHBondContact OD1-N 3.32Å; K855-A857 VanDerWaalsContact C-N 3.27Å; K855-A857 PolarHBondContact O-N 2.97Å; A857-S859 VanDerWaalsContact C-N 3.33Å; A857-S859 PolarHBondContact O-N 3.06Å; A857-T860 PolarHBondContact O-N 3.4Å; A857-L861 WeakPolarHBondContact O-CB 3.33Å; A857-L861 VanDerWaalsContact O-CG 3.27Å; A857-L861 WeakPolarHBondContact O-CG 3.49Å; A857-L861 PolarHBondContact O-N 3.16Å; A857-Y905 HydrophobicContact CB-CD1 3.51Å; A857-Y905 HydrophobicContact CB-CE1 3.41Å; A857-Y905 VanDerWaalsContact CB-CE1 3.41Å; A857-I908 HydrophobicContact CB-CD1 3.55Å
858	N	95.1	Very high	93.5	Very high	69 Å²	69	50 Å²	50	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-44.5	170.1	-69.1	92.1	0	0	0	111.4	N852 K855 L861 R862	N852-N858 PolarHBondContact ND2-OD1 3.4Å; K855-N858 PolarHBondContact O-N 3.46Å; N858-L861 PolarHBondContact O-N 3.3Å; N858-R862 WeakPolarHBondContact O-CB 3.46Å; N858-R862 PolarHBondContact O-N 3.17Å
859	S	94.8	Very high	93.7	Very high	67 Å²	67	52.8 Å²	52.8	47%	0.469	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-45	177.7	-62.9	0	0	0	0	111.8	K855 S856 A857 L863	K855-S859 PolarHBondContact O-N 3.25Å; S856-S859 PolarHBondContact O-N 2.89Å; A857-S859 VanDerWaalsContact C-N 3.33Å; A857-S859 PolarHBondContact O-N 3.06Å; S859-L863 PolarHBondContact O-N 2.94Å; S859-L863 VanDerWaalsContact O-N 3.09Å
860	T	96.1	Very high	93.8	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.043	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-46.2	176.3	-58.7	0	0	0	0	112.1	L842 L846 S856 A857 R862 L863 L864	L842-T860 HydrophobicContact CB-CG2 4.08Å; L842-T860 HydrophobicContact CD1-CG2 4.36Å; L846-T860 HydrophobicContact CD1-CG2 3.92Å; S856-T860 PolarHBondContact O-N 2.91Å; S856-T860 VanDerWaalsContact O-N 3.08Å; S856-T860 PolarHBondContact O-OG1 3Å; S856-T860 VanDerWaalsContact O-OG1 3.08Å; A857-T860 PolarHBondContact O-N 3.4Å; T860-R862 VanDerWaalsContact C-N 3.33Å; T860-R862 PolarHBondContact O-N 3.24Å; T860-L863 WeakPolarHBondContact O-CB 3.34Å; T860-L863 PolarHBondContact O-N 3.03Å; T860-L863 VanDerWaalsContact O-N 3.16Å; T860-L864 HydrophobicContact CG2-CD1 3.99Å; T860-L864 HydrophobicContact CG2-CG 4.34Å; T860-L864 VanDerWaalsContact O-CG 3.29Å; T860-L864 WeakPolarHBondContact O-CG 3.46Å; T860-L864 PolarHBondContact O-N 3.21Å
861	L	97	Very high	93.9	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-41.7	177.9	-73.9	169.8	0	0	0	111.6	A857 N858 L863 L864 S865 I896 L899 I908 I909	A857-L861 WeakPolarHBondContact O-CB 3.33Å; A857-L861 VanDerWaalsContact O-CG 3.27Å; A857-L861 WeakPolarHBondContact O-CG 3.49Å; A857-L861 PolarHBondContact O-N 3.16Å; N858-L861 PolarHBondContact O-N 3.3Å; L861-L863 PolarHBondContact O-N 2.98Å; L861-L864 PolarHBondContact O-N 3.45Å; L861-S865 WeakPolarHBondContact O-CB 3.44Å; L861-S865 PolarHBondContact O-N 3.29Å; L861-S865 PolarHBondContact O-OG 3.15Å; L861-I896 HydrophobicContact CD2-CG1 4.26Å; L861-I896 HydrophobicContact CD2-CG2 4.42Å; L861-L899 HydrophobicContact CD2-CD1 3.88Å; L861-L899 HydrophobicContact CG-CD1 4.43Å; L861-I908 HydrophobicContact CD1-CD1 3.82Å; L861-I908 HydrophobicContact CD1-CG1 3.81Å; L861-I909 HydrophobicContact CD1-CG1 3.69Å; L861-I909 HydrophobicContact CD2-CD1 4.18Å; L861-I909 HydrophobicContact CD2-CG1 3.87Å; L861-I909 HydrophobicContact CG-CG1 4.45Å
862	R	96.6	Very high	94	Very high	181 Å²	181	49.9 Å²	49.9	68%	0.683	26%	0.257	S	S	*	.	H	α-helix	trans	-62.2	-40.6	174.6	-172.7	178.5	66.2	176.2	1.2	112.3	N858 T860 S865 A866	N858-R862 WeakPolarHBondContact O-CB 3.46Å; N858-R862 PolarHBondContact O-N 3.17Å; T860-R862 VanDerWaalsContact C-N 3.33Å; T860-R862 PolarHBondContact O-N 3.24Å; R862-S865 PolarHBondContact O-N 3.46Å; R862-A866 WeakPolarHBondContact O-CB 3.49Å; R862-A866 PolarHBondContact O-N 2.63Å
863	L	96.5	Very high	94.3	Very high	26 Å²	26	48.8 Å²	48.8	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-45.5	175.5	177.5	64	0	0	0	112	V804 L808 L842 S859 T860 L861 S865 A866 M867 L874	V804-L863 HydrophobicContact CG1-CD2 4.35Å; V804-L863 HydrophobicContact CG2-CD2 3.88Å; L808-L863 HydrophobicContact CD1-CD2 4.05Å; L842-L863 HydrophobicContact CD1-CD2 4.17Å; S859-L863 PolarHBondContact O-N 2.94Å; S859-L863 VanDerWaalsContact O-N 3.09Å; T860-L863 WeakPolarHBondContact O-CB 3.34Å; T860-L863 PolarHBondContact O-N 3.03Å; T860-L863 VanDerWaalsContact O-N 3.16Å; L861-L863 PolarHBondContact O-N 2.98Å; L863-S865 VanDerWaalsContact C-N 3.32Å; L863-S865 PolarHBondContact O-N 2.7Å; L863-A866 PolarHBondContact O-N 2.85Å; L863-M867 PolarHBondContact O-N 2.74Å; L863-M867 VanDerWaalsContact O-N 3.09Å; L863-L874 HydrophobicContact CD1-CD1 4.35Å; L863-L874 HydrophobicContact CD1-CD2 3.7Å
864	L	97.8	Very high	94.6	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-34.8	176.8	-61.5	170.3	0	0	0	111.9	I839 T860 L861 L868 A892 A895 I896 L899	I839-L864 HydrophobicContact CG1-CD2 4.48Å; I839-L864 HydrophobicContact CG2-CD2 3.87Å; T860-L864 HydrophobicContact CG2-CD1 3.99Å; T860-L864 HydrophobicContact CG2-CG 4.34Å; T860-L864 VanDerWaalsContact O-CG 3.29Å; T860-L864 WeakPolarHBondContact O-CG 3.46Å; T860-L864 PolarHBondContact O-N 3.21Å; L861-L864 PolarHBondContact O-N 3.45Å; L864-L868 PolarHBondContact O-N 3.16Å; L864-A892 HydrophobicContact CB-CB 4.47Å; L864-A892 HydrophobicContact CD2-CB 4.38Å; L864-A895 HydrophobicContact CD1-CB 3.64Å; L864-A895 HydrophobicContact CD2-CB 3.92Å; L864-A895 HydrophobicContact CG-CB 4.41Å; L864-I896 HydrophobicContact CB-CD1 4.04Å; L864-I896 HydrophobicContact CB-CG1 3.88Å; L864-I896 HydrophobicContact CD1-CG1 4.06Å; L864-L899 HydrophobicContact CD1-CD1 4.28Å
865	S	97.4	Very high	94.9	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-68.3	-45.6	175.1	-51.7	0	0	0	0	111.1	L861 R862 L863 M867 L868 V869 Q913 L916	L861-S865 WeakPolarHBondContact O-CB 3.44Å; L861-S865 PolarHBondContact O-N 3.29Å; L861-S865 PolarHBondContact O-OG 3.15Å; R862-S865 PolarHBondContact O-N 3.46Å; L863-S865 VanDerWaalsContact C-N 3.32Å; L863-S865 PolarHBondContact O-N 2.7Å; S865-M867 VanDerWaalsContact C-N 3.3Å; S865-M867 PolarHBondContact O-N 3.41Å; S865-L868 WeakPolarHBondContact O-CB 3.41Å; S865-L868 PolarHBondContact O-N 3.31Å; S865-V869 PolarHBondContact O-N 3.42Å; S865-Q913 WeakPolarHBondContact OG-CG 3.48Å; S865-Q913 PolarHBondContact OG-NE2 3.37Å; S865-L916 WeakPolarHBondContact O-CD2 3.46Å
866	A	96.8	Very high	94.8	Very high	43 Å²	43	40.3 Å²	40.3	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-57.3	-43.4	176	0	0	0	0	0	111.8	R862 L863 L868 V869 S870 L874	R862-A866 WeakPolarHBondContact O-CB 3.49Å; R862-A866 PolarHBondContact O-N 2.63Å; L863-A866 PolarHBondContact O-N 2.85Å; A866-L868 PolarHBondContact O-N 2.86Å; A866-V869 PolarHBondContact O-N 3.32Å; A866-V869 VanDerWaalsContact O-N 3.15Å; A866-S870 PolarHBondContact O-N 3.4Å; A866-S870 PolarHBondContact O-OG 3.46Å; A866-L874 HydrophobicContact CB-CD1 4.11Å
867	M	96.4	Very high	94.6	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.02	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-22.8	175.1	-178.7	173.6	-77.7	0	0	114.1	L808 I839 L863 S865 G872 L874 L888 A892	L808-M867 HydrophobicContact CD2-CE 4.31Å; I839-M867 HydrophobicContact CD1-CE 4.12Å; I839-M867 HydrophobicContact CD1-SD 3.63Å; L863-M867 PolarHBondContact O-N 2.74Å; L863-M867 VanDerWaalsContact O-N 3.09Å; S865-M867 VanDerWaalsContact C-N 3.3Å; S865-M867 PolarHBondContact O-N 3.41Å; M867-G872 WeakPolarHBondContact O-CA 3.45Å; M867-G872 PolarHBondContact O-N 3.42Å; M867-L874 HydrophobicContact CB-CD1 4.45Å; M867-L874 HydrophobicContact CE-CB 4.28Å; M867-L874 HydrophobicContact CE-CD2 3.98Å; M867-L888 HydrophobicContact CE-CD1 4.27Å; M867-L888 HydrophobicContact CE-CD2 4.37Å; M867-L888 HydrophobicContact CG-CB 4.37Å; M867-L888 HydrophobicContact SD-CB 3.91Å; M867-L888 HydrophobicContact SD-CD2 4.3Å; M867-A892 HydrophobicContact CB-CB 4.34Å; M867-A892 HydrophobicContact CG-CB 4.15Å; M867-A892 HydrophobicContact SD-CB 4.1Å
868	L	97.1	Very high	94.2	Very high	13 Å²	13	53.2 Å²	53.2	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-83.7	-38.1	170.8	-71.4	175.8	0	0	0	112.1	L864 S865 A866 E871 R889 A892 I896 L916 V920	L864-L868 PolarHBondContact O-N 3.16Å; S865-L868 WeakPolarHBondContact O-CB 3.41Å; S865-L868 PolarHBondContact O-N 3.31Å; A866-L868 PolarHBondContact O-N 2.86Å; L868-E871 PolarHBondContact O-N 3Å; L868-R889 HydrophobicContact CD2-CB 4.1Å; L868-R889 HydrophobicContact CD2-CG 4.43Å; L868-R889 WeakPolarHBondContact CD2-O 3.4Å; L868-A892 HydrophobicContact CD2-CB 4.01Å; L868-A892 HydrophobicContact CG-CB 3.91Å; L868-I896 HydrophobicContact CD1-CD1 3.89Å; L868-L916 HydrophobicContact CB-CD1 4.07Å; L868-L916 HydrophobicContact CB-CD2 3.85Å; L868-L916 HydrophobicContact CB-CG 3.81Å; L868-L916 HydrophobicContact CD1-CD2 4.48Å; L868-L916 HydrophobicContact CD1-CG 4.1Å; L868-V920 HydrophobicContact CD1-CG2 4.28Å; L868-V920 HydrophobicContact CD2-CG2 3.77Å
869	V	96.6	Very high	93.8	Very high	68 Å²	68	55 Å²	55	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-40.9	176.6	176.4	0	0	0	0	111.7	S865 A866 E871 L916	S865-V869 PolarHBondContact O-N 3.42Å; A866-V869 PolarHBondContact O-N 3.32Å; A866-V869 VanDerWaalsContact O-N 3.15Å; V869-E871 PolarHBondContact O-N 2.92Å; V869-L916 HydrophobicContact CG2-CD1 4.29Å; V869-L916 HydrophobicContact CG2-CD2 3.69Å
870	S	94.9	Very high	93.6	Very high	21 Å²	21	52.6 Å²	52.6	15%	0.147	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	20.8	178.5	76.2	0	0	0	0	113.8	A866 G872 D873	A866-S870 PolarHBondContact O-N 3.4Å; A866-S870 PolarHBondContact O-OG 3.46Å; S870-G872 PolarHBondContact O-N 2.85Å; S870-D873 WeakPolarHBondContact CB-O 3.09Å; S870-D873 PolarHBondContact O-N 2.85Å; S870-D873 PolarHBondContact OG-O 3.34Å
871	E	93.6	Very high	93.3	Very high	109 Å²	109	52.7 Å²	52.7	51%	0.509	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	15	-179.7	-58.5	-174.7	171.7	0	0	115.6	L868 V869 M885 R889	L868-E871 PolarHBondContact O-N 3Å; V869-E871 PolarHBondContact O-N 2.92Å; E871-M885 HydrophobicContact CB-CE 3.79Å; E871-M885 WeakPolarHBondContact O-CE 3.44Å; E871-R889 VanDerWaalsContact C-CG 3.5Å; E871-R889 WeakPolarHBondContact O-CD 3.25Å; E871-R889 VanDerWaalsContact O-CG 3.24Å; E871-R889 WeakPolarHBondContact O-CG 3.45Å; E871-R889 PolarHBondContact O-NH1 2.79Å
872	G	92.5	Very high	93.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.5	-17.6	-176.9	0	0	0	0	0	114.5	M867 S870 L874 L888	M867-G872 WeakPolarHBondContact O-CA 3.45Å; M867-G872 PolarHBondContact O-N 3.42Å; S870-G872 PolarHBondContact O-N 2.85Å; G872-L874 PolarHBondContact O-N 3.49Å; G872-L888 WeakPolarHBondContact O-CD1 3.22Å
873	D	93.7	Very high	92.9	Very high	9 Å²	9	48.8 Å²	48.8	5%	0.048	24%	0.241	C	C	.	.			trans	-86.6	87.1	174.7	-177.4	-0	0	0	0	109.7	S870 T875 E876 Q877 K878 I880 M885	S870-D873 WeakPolarHBondContact CB-O 3.09Å; S870-D873 PolarHBondContact O-N 2.85Å; S870-D873 PolarHBondContact OG-O 3.34Å; D873-T875 PolarHBondContact O-N 3.17Å; D873-T875 PolarHBondContact OD1-N 2.83Å; D873-T875 PolarHBondContact OD1-OG1 3.45Å; D873-E876 PolarHBondContact O-N 3.35Å; D873-E876 PolarHBondContact OD1-N 3.28Å; D873-E876 WeakPolarHBondContact OD2-CA 3.38Å; D873-Q877 PolarHBondContact OD2-N 3.36Å; D873-K878 VanDerWaalsContact OD2-CA 3.28Å; D873-K878 WeakPolarHBondContact OD2-CA 3.45Å; D873-K878 PolarHBondContact OD2-N 2.84Å; D873-I880 HydrophobicContact CB-CG2 3.77Å; D873-M885 HydrophobicContact CB-CE 3.97Å; D873-M885 HydrophobicContact CB-SD 4.39Å
874	L	92.2	Very high	92.8	Very high	26 Å²	26	47.8 Å²	47.8	14%	0.136	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-15.6	-176.1	-173.5	63.6	0	0	0	113.5	L808 M809 L863 A866 M867 G872	L808-L874 HydrophobicContact CB-CD2 4.37Å; M809-L874 HydrophobicContact SD-CD2 3.69Å; M809-L874 HydrophobicContact SD-CG 3.89Å; L863-L874 HydrophobicContact CD1-CD1 4.35Å; L863-L874 HydrophobicContact CD1-CD2 3.7Å; A866-L874 HydrophobicContact CB-CD1 4.11Å; M867-L874 HydrophobicContact CB-CD1 4.45Å; M867-L874 HydrophobicContact CE-CB 4.28Å; M867-L874 HydrophobicContact CE-CD2 3.98Å; G872-L874 PolarHBondContact O-N 3.49Å
875	T	90.6	Very high	92.6	Very high	27 Å²	27	49 Å²	49	17%	0.166	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.1	176.3	71.2	0	0	0	0	113.2	M809 D811 D873 Q877	M809-T875 WeakPolarHBondContact O-CG2 3.25Å; D811-T875 WeakPolarHBondContact OD2-CB 3.36Å; D811-T875 WeakPolarHBondContact OD2-CG2 3.35Å; D811-T875 PolarHBondContact OD2-OG1 3.19Å; D873-T875 PolarHBondContact O-N 3.17Å; D873-T875 PolarHBondContact OD1-N 2.83Å; D873-T875 PolarHBondContact OD1-OG1 3.45Å; T875-Q877 PolarHBondContact O-N 2.93Å; T875-Q877 VanDerWaalsContact O-N 3.15Å; T875-Q877 WeakPolarHBondContact OG1-CB 3.41Å; T875-Q877 WeakPolarHBondContact OG1-CG 3.27Å; T875-Q877 PolarHBondContact OG1-N 3.15Å
876	E	88.7	Confident	92.6	Very high	147 Å²	147	48.5 Å²	48.5	69%	0.687	24%	0.238	S	C	*	.			trans	57.7	15.1	-172.6	-58.3	-177.7	-176.9	0	0	113.8	D873	D873-E876 PolarHBondContact O-N 3.35Å; D873-E876 PolarHBondContact OD1-N 3.28Å; D873-E876 WeakPolarHBondContact OD2-CA 3.38Å
877	Q	87.6	Confident	92.5	Very high	106 Å²	106	47.8 Å²	47.8	50%	0.495	23%	0.226	S	C	.	.	S	Bend	trans	-85.3	-5	-176.5	-63.4	-174	30.9	0	0	114.1	D873 T875 R879	D873-Q877 PolarHBondContact OD2-N 3.36Å; T875-Q877 PolarHBondContact O-N 2.93Å; T875-Q877 VanDerWaalsContact O-N 3.15Å; T875-Q877 WeakPolarHBondContact OG1-CB 3.41Å; T875-Q877 WeakPolarHBondContact OG1-CG 3.27Å; T875-Q877 PolarHBondContact OG1-N 3.15Å; Q877-R879 HydrophobicContact CB-CG 4.01Å; Q877-R879 PolarHBondContact O-N 3.23Å
878	K	85.5	Confident	92.6	Very high	177 Å²	177	47.7 Å²	47.7	77%	0.77	23%	0.225	S	C	*	.	S	Bend	trans	57.5	33.2	178.7	-53.1	-179.4	-176.2	179.1	0	113.4	D873	D873-K878 VanDerWaalsContact OD2-CA 3.28Å; D873-K878 WeakPolarHBondContact OD2-CA 3.45Å; D873-K878 PolarHBondContact OD2-N 2.84Å
879	R	87.6	Confident	92.6	Very high	106 Å²	106	48.4 Å²	48.4	40%	0.4	23%	0.227	S	C	.	.			trans	-87.3	-34.8	176.2	-68.6	178.7	176	-139.7	-4.1	112.9	D811 T814 G815 Q877	D811-R879 HydrophobicContact CB-CB 4.03Å; D811-R879 PolarHBondContact O-NH1 2.93Å; T814-R879 CarbonylContact C-O 3.59Å; T814-R879 WeakPolarHBondContact CA-O 3.49Å; T814-R879 HydrophobicContact CG2-CB 4.4Å; T814-R879 HydrophobicContact CG2-CG 4.42Å; G815-R879 PolarHBondContact N-O 2.83Å; Q877-R879 HydrophobicContact CB-CG 4.01Å; Q877-R879 PolarHBondContact O-N 3.23Å
880	I	90.1	Very high	92.7	Very high	18 Å²	18	45.9 Å²	45.9	9%	0.092	21%	0.211	C	C	.	.	S	Bend	trans	-74.1	148.3	-177.6	-172.6	161.4	0	0	0	111.7	V832 D873 D884 M885 L888	V832-I880 HydrophobicContact CG2-CD1 3.84Å; V832-I880 HydrophobicContact CG2-CG1 4.34Å; D873-I880 HydrophobicContact CB-CG2 3.77Å; I880-D884 HydrophobicContact CD1-CB 3.87Å; I880-D884 HydrophobicContact CG1-CB 3.49Å; I880-D884 VanDerWaalsContact CG1-CB 3.49Å; I880-M885 HydrophobicContact CB-CG 4.47Å; I880-M885 HydrophobicContact CG1-CG 4.21Å; I880-M885 HydrophobicContact CG2-CG 3.57Å; I880-M885 HydrophobicContact CG2-SD 4.06Å; I880-L888 HydrophobicContact CD1-CD1 3.43Å; I880-L888 VanDerWaalsContact CD1-CD1 3.43Å; I880-L888 HydrophobicContact CD1-CG 4.4Å
881	S	90.7	Very high	92.8	Very high	8 Å²	8	45.5 Å²	45.5	6%	0.056	21%	0.209	C	C	.	.			trans	-75.6	154.9	178.5	72.5	0	0	0	0	112.1	S883 D884 M885	S881-S883 VanDerWaalsContact C-N 3.26Å; S881-S883 PolarHBondContact O-N 3.24Å; S881-S883 PolarHBondContact OG-OG 2.97Å; S881-D884 PolarHBondContact O-N 2.99Å; S881-D884 VanDerWaalsContact O-N 3.14Å; S881-D884 VanDerWaalsContact OG-CB 3.22Å; S881-D884 WeakPolarHBondContact OG-CB 3.45Å; S881-D884 PolarHBondContact OG-N 3.48Å; S881-D884 PolarHBondContact OG-OD2 2.92Å; S881-M885 WeakPolarHBondContact O-CG 3.19Å; S881-M885 PolarHBondContact O-N 2.7Å
882	K	92	Very high	93	Very high	96 Å²	96	40.3 Å²	40.3	42%	0.417	19%	0.185	S	C	.	.	H	α-helix	trans	-58.8	-36.5	174.2	-95.7	-138.9	173.1	-161.7	0	112.3	L821 S886 E924	L821-K882 HydrophobicContact CD2-CB 4.46Å; L821-K882 HydrophobicContact CD2-CD 3.46Å; L821-K882 VanDerWaalsContact CD2-CD 3.46Å; K882-S886 PolarHBondContact O-N 3.42Å; K882-S886 PolarHBondContact O-OG 2.81Å; K882-E924 IonicContact NZ-OE1 3.17Å; K882-E924 PolarHBondContact NZ-OE1 3.4Å; K882-E924 VanDerWaalsContact NZ-OE1 3.12Å; K882-E924 IonicContact NZ-OE2 3.24Å; K882-E924 PolarHBondContact NZ-OE2 3.49Å
883	S	93.1	Very high	93.3	Very high	5 Å²	5	40.3 Å²	40.3	4%	0.035	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-42.4	174.1	36.3	0	0	0	0	112.7	K820 S881 S886 R887	K820-S883 PolarHBondContact O-N 3.44Å; K820-S883 VanDerWaalsContact O-N 3.16Å; S881-S883 VanDerWaalsContact C-N 3.26Å; S881-S883 PolarHBondContact O-N 3.24Å; S881-S883 PolarHBondContact OG-OG 2.97Å; S883-S886 WeakPolarHBondContact O-CB 3.47Å; S883-S886 PolarHBondContact O-N 3.41Å; S883-R887 WeakPolarHBondContact O-CG 3.31Å; S883-R887 PolarHBondContact O-N 3.32Å; S883-R887 VanDerWaalsContact O-N 3.14Å
884	D	93.4	Very high	93.5	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.027	19%	0.19	C	C	.	.	H	α-helix	trans	-70.3	-38.9	177.9	-72.1	-35.4	0	0	0	112.5	V828 S829 V832 I880 S881 S886 R887 L888	V828-D884 WeakPolarHBondContact CG1-OD1 3.32Å; S829-D884 PolarHBondContact N-OD1 3.13Å; S829-D884 VanDerWaalsContact OG-CG 3.25Å; S829-D884 PolarHBondContact OG-OD1 3.16Å; S829-D884 PolarHBondContact OG-OD2 3.46Å; V832-D884 HydrophobicContact CB-CB 4.19Å; V832-D884 HydrophobicContact CG1-CB 3.89Å; V832-D884 HydrophobicContact CG2-CB 3.72Å; I880-D884 HydrophobicContact CD1-CB 3.87Å; I880-D884 HydrophobicContact CG1-CB 3.49Å; I880-D884 VanDerWaalsContact CG1-CB 3.49Å; S881-D884 PolarHBondContact O-N 2.99Å; S881-D884 VanDerWaalsContact O-N 3.14Å; S881-D884 VanDerWaalsContact OG-CB 3.22Å; S881-D884 WeakPolarHBondContact OG-CB 3.45Å; S881-D884 PolarHBondContact OG-N 3.48Å; S881-D884 PolarHBondContact OG-OD2 2.92Å; D884-S886 VanDerWaalsContact C-N 3.29Å; D884-S886 PolarHBondContact O-N 3.18Å; D884-R887 WeakPolarHBondContact O-CA 3.12Å; D884-R887 WeakPolarHBondContact O-CB 3.46Å; D884-R887 PolarHBondContact O-N 3.35Å; D884-R887 VanDerWaalsContact O-N 3.08Å; D884-L888 PolarHBondContact O-N 3.16Å
885	M	94.9	Very high	93.8	Very high	29 Å²	29	39.8 Å²	39.8	14%	0.143	19%	0.185	C	C	.	.	H	α-helix	trans	-55.5	-45.3	171.4	-72.3	173.9	73.3	0	0	111	E871 D873 I880 S881 R887 L888 R889	E871-M885 HydrophobicContact CB-CE 3.79Å; E871-M885 WeakPolarHBondContact O-CE 3.44Å; D873-M885 HydrophobicContact CB-CE 3.97Å; D873-M885 HydrophobicContact CB-SD 4.39Å; I880-M885 HydrophobicContact CB-CG 4.47Å; I880-M885 HydrophobicContact CG1-CG 4.21Å; I880-M885 HydrophobicContact CG2-CG 3.57Å; I880-M885 HydrophobicContact CG2-SD 4.06Å; S881-M885 WeakPolarHBondContact O-CG 3.19Å; S881-M885 PolarHBondContact O-N 2.7Å; M885-R887 VanDerWaalsContact C-N 3.34Å; M885-R887 PolarHBondContact O-N 2.59Å; M885-L888 PolarHBondContact O-N 3.37Å; M885-L888 VanDerWaalsContact O-N 3.16Å; M885-R889 WeakPolarHBondContact O-CG 3.38Å; M885-R889 PolarHBondContact O-N 2.86Å
886	S	96.3	Very high	94.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-38.6	174.3	-60.8	0	0	0	0	112.9	L821 K882 S883 D884 L888 R889 L890 V928	L821-S886 WeakPolarHBondContact O-CB 3.26Å; L821-S886 PolarHBondContact O-OG 3.08Å; K882-S886 PolarHBondContact O-N 3.42Å; K882-S886 PolarHBondContact O-OG 2.81Å; S883-S886 WeakPolarHBondContact O-CB 3.47Å; S883-S886 PolarHBondContact O-N 3.41Å; D884-S886 VanDerWaalsContact C-N 3.29Å; D884-S886 PolarHBondContact O-N 3.18Å; S886-L888 VanDerWaalsContact C-N 3.35Å; S886-R889 PolarHBondContact OG-NH2 3.33Å; S886-L890 WeakPolarHBondContact O-CB 3.3Å; S886-L890 PolarHBondContact O-N 2.81Å; S886-L890 VanDerWaalsContact O-N 3.09Å; S886-V928 WeakPolarHBondContact O-CG2 3.46Å
887	R	95.9	Very high	94.6	Very high	29 Å²	29	31.7 Å²	31.7	11%	0.109	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-40.5	173.8	-65.9	-76.8	-176.2	157.2	-3.7	111.5	W822 S823 D825 V828 V832 S883 D884 M885 A891	W822-R887 HydrophobicContact CZ3-CG 4.43Å; S823-R887 PolarHBondContact O-NH2 3.16Å; D825-R887 IonicContact OD1-CZ 2.67Å; D825-R887 IonicContact OD1-NH1 2.91Å; D825-R887 PolarHBondContact OD1-NH1 3.06Å; D825-R887 IonicContact OD1-NH2 2.71Å; D825-R887 PolarHBondContact OD1-NH2 2.95Å; D825-R887 IonicContact OD2-NH1 2.92Å; D825-R887 PolarHBondContact OD2-NH1 3.3Å; V828-R887 HydrophobicContact CG1-CG 4.37Å; V828-R887 HydrophobicContact CG2-CG 4.31Å; V832-R887 HydrophobicContact CG1-CB 4.19Å; S883-R887 WeakPolarHBondContact O-CG 3.31Å; S883-R887 PolarHBondContact O-N 3.32Å; S883-R887 VanDerWaalsContact O-N 3.14Å; D884-R887 WeakPolarHBondContact O-CA 3.12Å; D884-R887 WeakPolarHBondContact O-CB 3.46Å; D884-R887 PolarHBondContact O-N 3.35Å; D884-R887 VanDerWaalsContact O-N 3.08Å; M885-R887 VanDerWaalsContact C-N 3.34Å; M885-R887 PolarHBondContact O-N 2.59Å; R887-A891 WeakPolarHBondContact O-CB 3.36Å; R887-A891 PolarHBondContact O-N 2.85Å
888	L	96.8	Very high	95.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-71.5	-43.9	178.1	-69.7	-177.2	0	0	0	113.1	V832 K835 V836 I839 M867 G872 I880 D884 M885 S886 L890 A891 A892	V832-L888 HydrophobicContact CG1-CD2 4.29Å; V832-L888 HydrophobicContact CG1-CG 4.23Å; K835-L888 HydrophobicContact CB-CD2 3.9Å; K835-L888 HydrophobicContact CD-CD1 4.44Å; V836-L888 HydrophobicContact CG2-CD2 4Å; I839-L888 HydrophobicContact CD1-CD2 4.09Å; M867-L888 HydrophobicContact CE-CD1 4.27Å; M867-L888 HydrophobicContact CE-CD2 4.37Å; M867-L888 HydrophobicContact CG-CB 4.37Å; M867-L888 HydrophobicContact SD-CB 3.91Å; M867-L888 HydrophobicContact SD-CD2 4.3Å; G872-L888 WeakPolarHBondContact O-CD1 3.22Å; I880-L888 HydrophobicContact CD1-CD1 3.43Å; I880-L888 VanDerWaalsContact CD1-CD1 3.43Å; I880-L888 HydrophobicContact CD1-CG 4.4Å; D884-L888 PolarHBondContact O-N 3.16Å; M885-L888 PolarHBondContact O-N 3.37Å; M885-L888 VanDerWaalsContact O-N 3.16Å; S886-L888 VanDerWaalsContact C-N 3.35Å; L888-L890 VanDerWaalsContact C-N 3.33Å; L888-L890 PolarHBondContact O-N 3.49Å; L888-A891 WeakPolarHBondContact O-CB 3.48Å; L888-A891 PolarHBondContact O-N 2.95Å; L888-A891 VanDerWaalsContact O-N 3.11Å; L888-A892 WeakPolarHBondContact O-CB 3.36Å; L888-A892 PolarHBondContact O-N 2.94Å
889	R	98.1	Very high	95.7	Very high	27 Å²	27	21.9 Å²	21.9	10%	0.102	10%	0.101	C	C	.	.	H	α-helix	trans	-57.4	-46	173.2	-67.8	-167.1	-54.6	-79.9	-0.8	111.6	L868 E871 M885 S886 A891 A892 G893 D923	L868-R889 HydrophobicContact CD2-CB 4.1Å; L868-R889 HydrophobicContact CD2-CG 4.43Å; L868-R889 WeakPolarHBondContact CD2-O 3.4Å; E871-R889 VanDerWaalsContact C-CG 3.5Å; E871-R889 WeakPolarHBondContact O-CD 3.25Å; E871-R889 VanDerWaalsContact O-CG 3.24Å; E871-R889 WeakPolarHBondContact O-CG 3.45Å; E871-R889 PolarHBondContact O-NH1 2.79Å; M885-R889 WeakPolarHBondContact O-CG 3.38Å; M885-R889 PolarHBondContact O-N 2.86Å; S886-R889 PolarHBondContact OG-NH2 3.33Å; R889-A891 VanDerWaalsContact C-N 3.32Å; R889-A891 PolarHBondContact O-N 3.28Å; R889-A892 PolarHBondContact O-N 3.06Å; R889-G893 PolarHBondContact O-N 3.47Å; R889-D923 IonicContact CZ-OD1 2.72Å; R889-D923 IonicContact CZ-OD2 3.62Å; R889-D923 IonicContact NE-OD1 2.82Å; R889-D923 IonicContact NE-OD2 2.63Å; R889-D923 PolarHBondContact NE-OD2 3.49Å; R889-D923 IonicContact NH2-OD1 3.79Å; R889-D923 PolarHBondContact NH2-OD1 3.34Å; R889-D923 IonicContact NH2-OD2 3.65Å; R889-D923 PolarHBondContact NH2-OD2 2.86Å
890	L	98.2	Very high	96.1	Very high	15 Å²	15	17 Å²	17	8%	0.079	8%	0.083	C	C	.	.	H	α-helix	trans	-60.4	-40.4	174.9	-179.8	57.6	0	0	0	112.4	W822 S886 L888 S894 V928 I931 F932	W822-L890 HydrophobicContact CH2-CD2 3.69Å; W822-L890 HydrophobicContact CZ3-CD2 4.04Å; S886-L890 WeakPolarHBondContact O-CB 3.3Å; S886-L890 PolarHBondContact O-N 2.81Å; S886-L890 VanDerWaalsContact O-N 3.09Å; L888-L890 VanDerWaalsContact C-N 3.33Å; L888-L890 PolarHBondContact O-N 3.49Å; L890-S894 WeakPolarHBondContact O-CB 3.43Å; L890-S894 PolarHBondContact O-N 3.09Å; L890-S894 PolarHBondContact O-OG 3.16Å; L890-V928 HydrophobicContact CB-CG1 4.04Å; L890-V928 HydrophobicContact CB-CG2 4.17Å; L890-V928 HydrophobicContact CD1-CG1 4.24Å; L890-I931 HydrophobicContact CD1-CB 4.16Å; L890-I931 HydrophobicContact CD1-CG2 4.02Å; L890-I931 HydrophobicContact CD2-CB 4.02Å; L890-I931 HydrophobicContact CD2-CD1 3.99Å; L890-I931 HydrophobicContact CD2-CG2 3.88Å; L890-I931 HydrophobicContact CG-CG2 4.44Å; L890-F932 HydrophobicContact CD1-CB 4.03Å
891	A	97.9	Very high	96.4	Very high	13 Å²	13	17.8 Å²	17.8	11%	0.107	9%	0.086	C	C	.	.	H	α-helix	trans	-66.2	-43.8	177.1	0	0	0	0	0	111.8	V836 I839 R887 L888 R889 S894 A895	V836-A891 HydrophobicContact CG1-CB 4.4Å; V836-A891 HydrophobicContact CG2-CB 4.1Å; I839-A891 HydrophobicContact CD1-CB 3.91Å; I839-A891 HydrophobicContact CG2-CB 4.3Å; R887-A891 WeakPolarHBondContact O-CB 3.36Å; R887-A891 PolarHBondContact O-N 2.85Å; L888-A891 WeakPolarHBondContact O-CB 3.48Å; L888-A891 PolarHBondContact O-N 2.95Å; L888-A891 VanDerWaalsContact O-N 3.11Å; R889-A891 VanDerWaalsContact C-N 3.32Å; R889-A891 PolarHBondContact O-N 3.28Å; A891-S894 PolarHBondContact O-N 3.4Å; A891-A895 VanDerWaalsContact O-CB 3.24Å; A891-A895 WeakPolarHBondContact O-CB 3.36Å; A891-A895 PolarHBondContact O-N 3.37Å
892	A	98.3	Very high	96.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.3	-50.7	179.1	0	0	0	0	0	112.6	L864 M867 L868 L888 R889 S894 A895 I896	L864-A892 HydrophobicContact CB-CB 4.47Å; L864-A892 HydrophobicContact CD2-CB 4.38Å; M867-A892 HydrophobicContact CB-CB 4.34Å; M867-A892 HydrophobicContact CG-CB 4.15Å; M867-A892 HydrophobicContact SD-CB 4.1Å; L868-A892 HydrophobicContact CD2-CB 4.01Å; L868-A892 HydrophobicContact CG-CB 3.91Å; L888-A892 WeakPolarHBondContact O-CB 3.36Å; L888-A892 PolarHBondContact O-N 2.94Å; R889-A892 PolarHBondContact O-N 3.06Å; A892-S894 VanDerWaalsContact C-N 3.35Å; A892-S894 PolarHBondContact O-N 2.92Å; A892-A895 WeakPolarHBondContact O-CB 3.42Å; A892-A895 PolarHBondContact O-N 3.17Å; A892-A895 VanDerWaalsContact O-N 3.08Å; A892-I896 PolarHBondContact O-N 2.66Å
893	G	98	Very high	96.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.5	-41.2	174.6	0	0	0	0	0	112.5	R889 A895 M897 C917	R889-G893 PolarHBondContact O-N 3.47Å; G893-A895 VanDerWaalsContact C-N 3.26Å; G893-A895 PolarHBondContact O-N 3.41Å; G893-M897 VanDerWaalsContact O-CB 3.32Å; G893-M897 WeakPolarHBondContact O-CB 3.44Å; G893-M897 PolarHBondContact O-N 2.81Å; G893-M897 VanDerWaalsContact O-N 3.08Å; G893-C917 PolarHBondContact O-SG 3.44Å
894	S	98.3	Very high	96.7	Very high	21 Å²	21	20 Å²	20	15%	0.147	11%	0.107	C	C	.	.	H	α-helix	trans	-62.2	-32.4	173.4	-64.2	0	0	0	0	113	L890 A891 A892 K898 K935	L890-S894 WeakPolarHBondContact O-CB 3.43Å; L890-S894 PolarHBondContact O-N 3.09Å; L890-S894 PolarHBondContact O-OG 3.16Å; A891-S894 PolarHBondContact O-N 3.4Å; A892-S894 VanDerWaalsContact C-N 3.35Å; A892-S894 PolarHBondContact O-N 2.92Å; S894-K898 WeakPolarHBondContact O-CB 3.42Å; S894-K898 PolarHBondContact O-N 3.07Å; S894-K935 WeakPolarHBondContact OG-CD 3.49Å; S894-K935 WeakPolarHBondContact OG-CE 3.39Å
895	A	98.3	Very high	96.9	Very high	4 Å²	4	19.8 Å²	19.8	3%	0.033	11%	0.106	C	C	.	.	H	α-helix	trans	-74.5	-47.4	-179.9	0	0	0	0	0	112	I839 V843 L864 A891 A892 G893 K898 L899	I839-A895 HydrophobicContact CG2-CB 3.78Å; V843-A895 HydrophobicContact CG2-CB 3.47Å; V843-A895 VanDerWaalsContact CG2-CB 3.47Å; L864-A895 HydrophobicContact CD1-CB 3.64Å; L864-A895 HydrophobicContact CD2-CB 3.92Å; L864-A895 HydrophobicContact CG-CB 4.41Å; A891-A895 VanDerWaalsContact O-CB 3.24Å; A891-A895 WeakPolarHBondContact O-CB 3.36Å; A891-A895 PolarHBondContact O-N 3.37Å; A892-A895 WeakPolarHBondContact O-CB 3.42Å; A892-A895 PolarHBondContact O-N 3.17Å; A892-A895 VanDerWaalsContact O-N 3.08Å; G893-A895 VanDerWaalsContact C-N 3.26Å; G893-A895 PolarHBondContact O-N 3.41Å; A895-K898 PolarHBondContact O-N 3.27Å; A895-L899 WeakPolarHBondContact O-CG 3.48Å; A895-L899 PolarHBondContact O-N 3.44Å
896	I	98.3	Very high	96.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.7	-51.7	175.4	-62.8	170.9	0	0	0	109.8	L861 L864 L868 A892 K898 L899 A900 I909 C917	L861-I896 HydrophobicContact CD2-CG1 4.26Å; L861-I896 HydrophobicContact CD2-CG2 4.42Å; L864-I896 HydrophobicContact CB-CD1 4.04Å; L864-I896 HydrophobicContact CB-CG1 3.88Å; L864-I896 HydrophobicContact CD1-CG1 4.06Å; L868-I896 HydrophobicContact CD1-CD1 3.89Å; A892-I896 PolarHBondContact O-N 2.66Å; I896-K898 PolarHBondContact O-N 2.92Å; I896-K898 VanDerWaalsContact O-N 3.16Å; I896-L899 PolarHBondContact O-N 3.36Å; I896-L899 VanDerWaalsContact O-N 3.15Å; I896-A900 WeakPolarHBondContact O-CB 3.21Å; I896-A900 PolarHBondContact O-N 2.9Å; I896-I909 HydrophobicContact CG2-CD1 4.15Å; I896-C917 HydrophobicContact CB-CB 4.38Å; I896-C917 HydrophobicContact CD1-CB 4.4Å; I896-C917 HydrophobicContact CG2-CB 4Å
897	M	97.6	Very high	96.7	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.015	14%	0.138	C	C	.	.	H	α-helix	trans	-61.7	-22.4	175.9	179.2	174	54.6	0	0	113.6	G893 Q901 F932 K935 L936 L945 Y949	G893-M897 VanDerWaalsContact O-CB 3.32Å; G893-M897 WeakPolarHBondContact O-CB 3.44Å; G893-M897 PolarHBondContact O-N 2.81Å; G893-M897 VanDerWaalsContact O-N 3.08Å; M897-Q901 PolarHBondContact O-NE2 2.89Å; M897-F932 HydrophobicContact CB-CE2 4.37Å; M897-F932 HydrophobicContact CE-CD2 3.59Å; M897-F932 HydrophobicContact CE-CE2 3.44Å; M897-F932 VanDerWaalsContact CE-CE2 3.44Å; M897-F932 HydrophobicContact CE-CG 4.46Å; M897-F932 HydrophobicContact CE-CZ 4.23Å; M897-F932 HydrophobicContact SD-CE2 3.98Å; M897-F932 HydrophobicContact SD-CZ 4.21Å; M897-K935 HydrophobicContact CE-CB 3.55Å; M897-L936 HydrophobicContact CE-CB 4.42Å; M897-L936 VanDerWaalsContact SD-CA 3.51Å; M897-L936 HydrophobicContact SD-CB 3.69Å; M897-L936 HydrophobicContact SD-CD1 3.76Å; M897-L936 HydrophobicContact SD-CG 4.34Å; M897-L945 HydrophobicContact CG-CD1 4.28Å; M897-L945 HydrophobicContact CG-CD2 3.89Å; M897-L945 HydrophobicContact SD-CD2 4.21Å; M897-Y949 HydrophobicContact CG-CD1 4.44Å
898	K	97.8	Very high	96.6	Very high	78 Å²	78	27.3 Å²	27.3	34%	0.339	14%	0.142	S	C	.	.	H	α-helix	trans	-85.1	-32.6	175.7	-178.2	58.1	-159.6	134.5	0	113	V843 L847 S894 A895 I896	V843-K898 HydrophobicContact CG1-CB 4.17Å; V843-K898 HydrophobicContact CG1-CG 3.74Å; L847-K898 HydrophobicContact CD1-CD 4.49Å; L847-K898 HydrophobicContact CD1-CG 4.12Å; S894-K898 WeakPolarHBondContact O-CB 3.42Å; S894-K898 PolarHBondContact O-N 3.07Å; A895-K898 PolarHBondContact O-N 3.27Å; I896-K898 PolarHBondContact O-N 2.92Å; I896-K898 VanDerWaalsContact O-N 3.16Å
899	L	97.6	Very high	96.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.3	-38.4	170.3	-68.8	171	0	0	0	111.2	V843 L846 L861 L864 A895 I896 Q901 E902 Y905	V843-L899 HydrophobicContact CG1-CD2 4.21Å; V843-L899 HydrophobicContact CG1-CG 4.4Å; V843-L899 HydrophobicContact CG2-CG 4.39Å; L846-L899 HydrophobicContact CB-CD2 3.88Å; L846-L899 HydrophobicContact CD1-CD1 4.09Å; L846-L899 HydrophobicContact CD1-CD2 3.91Å; L861-L899 HydrophobicContact CD2-CD1 3.88Å; L861-L899 HydrophobicContact CG-CD1 4.43Å; L864-L899 HydrophobicContact CD1-CD1 4.28Å; A895-L899 WeakPolarHBondContact O-CG 3.48Å; A895-L899 PolarHBondContact O-N 3.44Å; I896-L899 PolarHBondContact O-N 3.36Å; I896-L899 VanDerWaalsContact O-N 3.15Å; L899-Q901 PolarHBondContact O-N 3.2Å; L899-E902 PolarHBondContact O-N 3.49Å; L899-Y905 HydrophobicContact CD2-CD2 3.94Å; L899-Y905 HydrophobicContact CD2-CE2 4.43Å; L899-Y905 HydrophobicContact CD2-CG 4.45Å
900	A	97	Very high	96.6	Very high	2 Å²	2	29 Å²	29	2%	0.017	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-2.6	175.2	0	0	0	0	0	115.5	I896 I909 L945 P946 Y949	I896-A900 WeakPolarHBondContact O-CB 3.21Å; I896-A900 PolarHBondContact O-N 2.9Å; A900-I909 HydrophobicContact CB-CD1 3.79Å; A900-L945 HydrophobicContact CB-CD1 3.81Å; A900-P946 WeakPolarHBondContact O-CD 3.38Å; A900-Y949 HydrophobicContact CB-CE1 4.21Å; A900-Y949 HydrophobicContact CB-CE2 3.71Å; A900-Y949 VanDerWaalsContact CB-CZ 3.49Å; A900-Y949 WeakPolarHBondContact CB-OH 3.28Å
901	Q	96.2	Very high	96.4	Very high	36 Å²	36	29.4 Å²	29.4	17%	0.168	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.7	171.4	-67	161.9	39.6	0	0	113	M897 L899 A939 L944 L945	M897-Q901 PolarHBondContact O-NE2 2.89Å; L899-Q901 PolarHBondContact O-N 3.2Å; Q901-A939 HydrophobicContact CG-CB 4.39Å; Q901-L944 WeakPolarHBondContact CA-O 3.49Å; Q901-L944 HydrophobicContact CB-CB 4.36Å; Q901-L944 HydrophobicContact CG-CB 4.31Å; Q901-L945 HydrophobicContact CG-CB 4.26Å; Q901-L945 HydrophobicContact CG-CD1 3.81Å
902	E	95.8	Very high	96.4	Very high	39 Å²	39	35.1 Å²	35.1	18%	0.182	18%	0.184	C	C	.	.	S	Bend	trans	-115.9	121.3	177.4	-167.2	73.9	-136	0	0	108.4	L847 K850 L899 C904 Y905 H906	L847-E902 HydrophobicContact CD2-CB 3.79Å; L847-E902 HydrophobicContact CD2-CG 4.18Å; K850-E902 HydrophobicContact CG-CG 4.48Å; K850-E902 IonicContact NZ-OE1 2.68Å; K850-E902 PolarHBondContact NZ-OE1 3.41Å; K850-E902 IonicContact NZ-OE2 3.46Å; K850-E902 PolarHBondContact NZ-OE2 3.13Å; L899-E902 PolarHBondContact O-N 3.49Å; E902-C904 PolarHBondContact O-N 3.03Å; E902-Y905 HydrophobicContact CB-CD2 3.93Å; E902-Y905 HydrophobicContact CG-CD2 4.04Å; E902-Y905 HydrophobicContact CG-CE2 4.35Å; E902-Y905 PolarHBondContact O-N 2.97Å; E902-H906 PolarHBondContact O-N 2.95Å
903	P	92.6	Very high	96.3	Very high	86 Å²	86	36.4 Å²	36.4	56%	0.558	19%	0.19	S	C	*	.	H	α-helix	trans	-54.6	-46.1	-167.8	-30.2	36	0	0	0	114.9	Y905 H906 E907	P903-Y905 PolarHBondContact O-N 3.24Å; P903-Y905 VanDerWaalsContact O-N 3.08Å; P903-H906 PolarHBondContact O-N 3.01Å; P903-H906 VanDerWaalsContact O-N 3.09Å; P903-E907 WeakPolarHBondContact O-CG 3.46Å; P903-E907 PolarHBondContact O-N 2.98Å
904	C	94.5	Very high	96.3	Very high	30 Å²	30	36.4 Å²	36.4	20%	0.203	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-13	-179.7	62.6	0	0	0	0	114.4	K850 E902	K850-C904 VanDerWaalsContact C-SG 3.5Å; K850-C904 PolarHBondContact O-SG 3.48Å; E902-C904 PolarHBondContact O-N 3.03Å
905	Y	96.3	Very high	96.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-101.4	-29.3	171.8	-59.5	-41.8	0	0	0	112.6	L846 K850 N851 N852 A857 L899 E902 P903 E907 I908 I909	L846-Y905 HydrophobicContact CB-CE2 3.85Å; L846-Y905 WeakPolarHBondContact O-CE2 3.31Å; L846-Y905 PolarHBondContact O-OH 3.36Å; K850-Y905 PolarHBondContact N-OH 3.28Å; N851-Y905 PolarHBondContact N-OH 3.31Å; N851-Y905 VanDerWaalsContact N-OH 3.11Å; N851-Y905 WeakPolarHBondContact O-CE1 3.39Å; N851-Y905 PolarHBondContact O-OH 3.47Å; N852-Y905 HydrophobicContact CB-CE1 4.2Å; A857-Y905 HydrophobicContact CB-CD1 3.51Å; A857-Y905 HydrophobicContact CB-CE1 3.41Å; A857-Y905 VanDerWaalsContact CB-CE1 3.41Å; L899-Y905 HydrophobicContact CD2-CD2 3.94Å; L899-Y905 HydrophobicContact CD2-CE2 4.43Å; L899-Y905 HydrophobicContact CD2-CG 4.45Å; E902-Y905 HydrophobicContact CB-CD2 3.93Å; E902-Y905 HydrophobicContact CG-CD2 4.04Å; E902-Y905 HydrophobicContact CG-CE2 4.35Å; E902-Y905 PolarHBondContact O-N 2.97Å; P903-Y905 PolarHBondContact O-N 3.24Å; P903-Y905 VanDerWaalsContact O-N 3.08Å; Y905-E907 VanDerWaalsContact C-N 3.32Å; Y905-I908 HydrophobicContact CD1-CD1 4.04Å; Y905-I908 WeakPolarHBondContact O-CG1 3.41Å; Y905-I908 PolarHBondContact O-N 3.25Å; Y905-I909 VanDerWaalsContact O-CG1 3.31Å; Y905-I909 WeakPolarHBondContact O-CG1 3.24Å; Y905-I909 PolarHBondContact O-N 2.94Å
906	H	94.9	Very high	96.2	Very high	41 Å²	41	37.5 Å²	37.5	19%	0.19	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-37.8	166.2	176.6	-129	0	0	0	112.4	E902 P903 I908 I909 E948 K1106	E902-H906 PolarHBondContact O-N 2.95Å; P903-H906 PolarHBondContact O-N 3.01Å; P903-H906 VanDerWaalsContact O-N 3.09Å; H906-I908 VanDerWaalsContact C-N 3.29Å; H906-I908 PolarHBondContact O-N 2.95Å; H906-I909 PolarHBondContact O-N 2.94Å; H906-E948 IonicContact CD2-OE1 2.93Å; H906-E948 PolarHBondContact CD2-OE1 2.86Å; H906-E948 IonicContact CE1-OE2 3.27Å; H906-E948 PolarHBondContact CE1-OE2 2.9Å; H906-E948 IonicContact NE2-OE1 2.62Å; H906-E948 PolarHBondContact NE2-OE1 3.36Å; H906-E948 IonicContact NE2-OE2 2.88Å; H906-E948 PolarHBondContact NE2-OE2 2.96Å; H906-K1106 PolarHBondContact O-NZ 3.09Å
907	E	92.1	Very high	96.2	Very high	137 Å²	137	37.5 Å²	37.5	64%	0.64	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-38.3	177.3	-79.1	170.9	-172.3	0	0	113	P903 Y905 K1106	P903-E907 WeakPolarHBondContact O-CG 3.46Å; P903-E907 PolarHBondContact O-N 2.98Å; Y905-E907 VanDerWaalsContact C-N 3.32Å; E907-K1106 WeakPolarHBondContact O-CE 3.18Å; E907-K1106 PolarHBondContact O-NZ 3.4Å
908	I	94.9	Very high	96.2	Very high	39 Å²	39	37.4 Å²	37.4	20%	0.2	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-9.8	-177.3	66.1	171.8	0	0	0	114.9	N852 A857 L861 Y905 H906 T910	N852-I908 HydrophobicContact CB-CD1 4.29Å; N852-I908 WeakPolarHBondContact ND2-CD1 3.49Å; A857-I908 HydrophobicContact CB-CD1 3.55Å; L861-I908 HydrophobicContact CD1-CD1 3.82Å; L861-I908 HydrophobicContact CD1-CG1 3.81Å; Y905-I908 HydrophobicContact CD1-CD1 4.04Å; Y905-I908 WeakPolarHBondContact O-CG1 3.41Å; Y905-I908 PolarHBondContact O-N 3.25Å; H906-I908 VanDerWaalsContact C-N 3.29Å; H906-I908 PolarHBondContact O-N 2.95Å; I908-T910 PolarHBondContact O-N 3.03Å
909	I	97.1	Very high	96.2	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.026	19%	0.189	C	C	.	.			trans	-69.3	127.2	171.5	-73.2	164.4	0	0	0	108.2	L861 I896 A900 Y905 H906 Q913 F914 K1106	L861-I909 HydrophobicContact CD1-CG1 3.69Å; L861-I909 HydrophobicContact CD2-CD1 4.18Å; L861-I909 HydrophobicContact CD2-CG1 3.87Å; L861-I909 HydrophobicContact CG-CG1 4.45Å; I896-I909 HydrophobicContact CG2-CD1 4.15Å; A900-I909 HydrophobicContact CB-CD1 3.79Å; Y905-I909 VanDerWaalsContact O-CG1 3.31Å; Y905-I909 WeakPolarHBondContact O-CG1 3.24Å; Y905-I909 PolarHBondContact O-N 2.94Å; H906-I909 PolarHBondContact O-N 2.94Å; I909-Q913 HydrophobicContact CG2-CB 4.2Å; I909-F914 HydrophobicContact CG2-CB 4.29Å; I909-K1106 PolarHBondContact O-NZ 3.41Å
910	T	96.1	Very high	96.2	Very high	59 Å²	59	36.4 Å²	36.4	36%	0.362	19%	0.191	S	C	.	.			trans	-85	157.5	178.6	59.6	0	0	0	0	111.5	I908 E912 Q913 F914	I908-T910 PolarHBondContact O-N 3.03Å; T910-E912 VanDerWaalsContact C-N 3.26Å; T910-E912 PolarHBondContact O-N 3.39Å; T910-Q913 PolarHBondContact O-N 3.14Å; T910-Q913 VanDerWaalsContact O-N 3.13Å; T910-Q913 WeakPolarHBondContact OG1-CG 3.37Å; T910-Q913 PolarHBondContact OG1-N 3.39Å; T910-Q913 PolarHBondContact OG1-OE1 2.71Å; T910-Q913 VanDerWaalsContact OG1-OE1 3.08Å; T910-F914 PolarHBondContact O-N 2.69Å
911	P	95.9	Very high	96.3	Very high	25 Å²	25	36.3 Å²	36.3	16%	0.162	19%	0.19	C	C	.	.	H	α-helix	trans	-53.1	-41.2	174.1	-29.1	37.3	0	0	0	113.3	Q913 F914 Q915 F1107	P911-Q913 PolarHBondContact O-N 3.45Å; P911-F914 WeakPolarHBondContact O-CB 3.46Å; P911-F914 PolarHBondContact O-N 3.46Å; P911-Q915 WeakPolarHBondContact O-CB 3.08Å; P911-Q915 VanDerWaalsContact O-CD 3.3Å; P911-Q915 WeakPolarHBondContact O-CG 3.39Å; P911-Q915 PolarHBondContact O-N 2.91Å; P911-Q915 PolarHBondContact O-OE1 3.07Å; P911-F1107 HydrophobicContact CB-CD1 4.36Å; P911-F1107 HydrophobicContact CB-CE1 4.01Å; P911-F1107 HydrophobicContact CG-CD1 4.46Å; P911-F1107 HydrophobicContact CG-CE1 4.26Å
912	E	96	Very high	96.3	Very high	132 Å²	132	37 Å²	37	62%	0.617	20%	0.195	S	C	*	.	H	α-helix	trans	-58.6	-45.6	175.6	-173.5	-174.7	-175.8	0	0	112.5	T910 F914 Q915 L916	T910-E912 VanDerWaalsContact C-N 3.26Å; T910-E912 PolarHBondContact O-N 3.39Å; E912-F914 VanDerWaalsContact C-N 3.35Å; E912-Q915 PolarHBondContact O-N 3.1Å; E912-L916 WeakPolarHBondContact O-CB 3.29Å; E912-L916 PolarHBondContact O-N 2.83Å
913	Q	97.6	Very high	96.3	Very high	27 Å²	27	36 Å²	36	13%	0.126	19%	0.191	C	C	.	.	H	α-helix	trans	-69.6	-33.4	178.4	-69.2	174.9	-45.3	0	0	112.5	S865 I909 T910 P911 C917	S865-Q913 WeakPolarHBondContact OG-CG 3.48Å; S865-Q913 PolarHBondContact OG-NE2 3.37Å; I909-Q913 HydrophobicContact CG2-CB 4.2Å; T910-Q913 PolarHBondContact O-N 3.14Å; T910-Q913 VanDerWaalsContact O-N 3.13Å; T910-Q913 WeakPolarHBondContact OG1-CG 3.37Å; T910-Q913 PolarHBondContact OG1-N 3.39Å; T910-Q913 PolarHBondContact OG1-OE1 2.71Å; T910-Q913 VanDerWaalsContact OG1-OE1 3.08Å; P911-Q913 PolarHBondContact O-N 3.45Å; Q913-C917 VanDerWaalsContact O-CB 3.24Å; Q913-C917 WeakPolarHBondContact O-CB 3.46Å; Q913-C917 PolarHBondContact O-N 3.39Å
914	F	97.7	Very high	96.5	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-66.1	-47.1	171.2	158.9	-103.1	0	0	0	111.4	I909 T910 P911 E912 C917 A918 E948 Y949 I952 L1008 F1107	I909-F914 HydrophobicContact CG2-CB 4.29Å; T910-F914 PolarHBondContact O-N 2.69Å; P911-F914 WeakPolarHBondContact O-CB 3.46Å; P911-F914 PolarHBondContact O-N 3.46Å; E912-F914 VanDerWaalsContact C-N 3.35Å; F914-C917 CarbonylContact O-C 3.1Å; F914-C917 PolarHBondContact O-N 3.08Å; F914-A918 WeakPolarHBondContact O-CB 3.25Å; F914-A918 PolarHBondContact O-N 3.35Å; F914-E948 HydrophobicContact CD2-CG 4.08Å; F914-E948 HydrophobicContact CE2-CB 4Å; F914-E948 HydrophobicContact CE2-CG 3.84Å; F914-E948 WeakPolarHBondContact CE2-O 3.36Å; F914-E948 HydrophobicContact CZ-CB 3.99Å; F914-E948 HydrophobicContact CZ-CG 4.34Å; F914-E948 VanDerWaalsContact CZ-O 3.26Å; F914-E948 WeakPolarHBondContact CZ-O 3.35Å; F914-Y949 HydrophobicContact CD2-CD1 4.32Å; F914-Y949 AromaticContact CD2-CE1 3.96Å; F914-Y949 HydrophobicContact CD2-CE1 3.96Å; F914-Y949 HydrophobicContact CD2-CE2 4.19Å; F914-Y949 AromaticContact CD2-CZ 3.85Å; F914-Y949 HydrophobicContact CE2-CD1 4.32Å; F914-Y949 HydrophobicContact CE2-CE1 4.41Å; F914-Y949 HydrophobicContact CE2-CG 4.34Å; F914-I952 HydrophobicContact CE2-CD1 4.08Å; F914-I952 HydrophobicContact CE2-CG1 4.11Å; F914-I952 HydrophobicContact CZ-CG1 4.4Å; F914-L1008 HydrophobicContact CE1-CD1 4.11Å; F914-L1008 HydrophobicContact CZ-CD1 4.48Å; F914-L1008 HydrophobicContact CZ-CD2 4.33Å; F914-F1107 HydrophobicContact CD1-CE1 4.08Å; F914-F1107 HydrophobicContact CD1-CZ 4.28Å; F914-F1107 HydrophobicContact CE1-CE1 4.35Å
915	Q	97.9	Very high	96.6	Very high	21 Å²	21	35.4 Å²	35.4	10%	0.098	18%	0.177	C	C	.	.	H	α-helix	trans	-58.3	-50.8	176.8	-73.7	156.1	-5.4	0	0	111.2	P911 E912 C917 A918 L919 H1007 L1008 H1011	P911-Q915 WeakPolarHBondContact O-CB 3.08Å; P911-Q915 VanDerWaalsContact O-CD 3.3Å; P911-Q915 WeakPolarHBondContact O-CG 3.39Å; P911-Q915 PolarHBondContact O-N 2.91Å; P911-Q915 PolarHBondContact O-OE1 3.07Å; E912-Q915 PolarHBondContact O-N 3.1Å; Q915-C917 VanDerWaalsContact C-N 3.3Å; Q915-C917 PolarHBondContact O-N 2.89Å; Q915-A918 VanDerWaalsContact O-CB 3.3Å; Q915-A918 WeakPolarHBondContact O-CB 3.3Å; Q915-A918 PolarHBondContact O-N 2.61Å; Q915-L919 WeakPolarHBondContact O-CG 3.27Å; Q915-L919 PolarHBondContact O-N 3.19Å; Q915-H1007 PolarHBondContact NE2-CE1 3.16Å; Q915-L1008 HydrophobicContact CG-CD1 4.19Å; Q915-H1011 HydrophobicContact CG-CB 4.39Å; Q915-H1011 VanDerWaalsContact NE2-CG 3.33Å
916	L	97	Very high	96.6	Very high	27 Å²	27	39.2 Å²	39.2	14%	0.141	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-39	176.9	-177.4	64.4	0	0	0	112.2	S865 L868 V869 E912 A918 L1148	S865-L916 WeakPolarHBondContact O-CD2 3.46Å; L868-L916 HydrophobicContact CB-CD1 4.07Å; L868-L916 HydrophobicContact CB-CD2 3.85Å; L868-L916 HydrophobicContact CB-CG 3.81Å; L868-L916 HydrophobicContact CD1-CD2 4.48Å; L868-L916 HydrophobicContact CD1-CG 4.1Å; V869-L916 HydrophobicContact CG2-CD1 4.29Å; V869-L916 HydrophobicContact CG2-CD2 3.69Å; E912-L916 WeakPolarHBondContact O-CB 3.29Å; E912-L916 PolarHBondContact O-N 2.83Å; L916-A918 VanDerWaalsContact C-N 3.33Å; L916-L1148 HydrophobicContact CD1-CD1 4.48Å
917	C	97.9	Very high	96.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.4	-30.6	173.6	-171.6	0	0	0	0	112.8	G893 I896 Q913 F914 Q915 F932	G893-C917 PolarHBondContact O-SG 3.44Å; I896-C917 HydrophobicContact CB-CB 4.38Å; I896-C917 HydrophobicContact CD1-CB 4.4Å; I896-C917 HydrophobicContact CG2-CB 4Å; Q913-C917 VanDerWaalsContact O-CB 3.24Å; Q913-C917 WeakPolarHBondContact O-CB 3.46Å; Q913-C917 PolarHBondContact O-N 3.39Å; F914-C917 CarbonylContact O-C 3.1Å; F914-C917 PolarHBondContact O-N 3.08Å; Q915-C917 VanDerWaalsContact C-N 3.3Å; Q915-C917 PolarHBondContact O-N 2.89Å; C917-F932 WeakPolarHBondContact O-CZ 3.32Å
918	A	98.1	Very high	96.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.1	-40.8	178.2	0	0	0	0	0	112	F914 Q915 L916 V920 I921 I952 L955 L1008	F914-A918 WeakPolarHBondContact O-CB 3.25Å; F914-A918 PolarHBondContact O-N 3.35Å; Q915-A918 VanDerWaalsContact O-CB 3.3Å; Q915-A918 WeakPolarHBondContact O-CB 3.3Å; Q915-A918 PolarHBondContact O-N 2.61Å; L916-A918 VanDerWaalsContact C-N 3.33Å; A918-V920 PolarHBondContact O-N 3.01Å; A918-I921 WeakPolarHBondContact O-CB 3.34Å; A918-I921 WeakPolarHBondContact O-CG2 3.41Å; A918-I921 PolarHBondContact O-N 2.85Å; A918-I952 HydrophobicContact CB-CB 4.46Å; A918-I952 HydrophobicContact CB-CD1 4.02Å; A918-I952 HydrophobicContact CB-CG1 3.71Å; A918-I952 HydrophobicContact CB-CG2 4.16Å; A918-L955 HydrophobicContact CB-CD1 4.29Å; A918-L1008 HydrophobicContact CB-CD1 3.85Å; A918-L1008 HydrophobicContact CB-CD2 4.21Å
919	L	97.6	Very high	97	Very high	53 Å²	53	33 Å²	33	28%	0.277	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-60.4	-19	-177.7	-64.6	172	0	0	0	114.1	Q915 I921 N922 D923 P1013	Q915-L919 WeakPolarHBondContact O-CG 3.27Å; Q915-L919 PolarHBondContact O-N 3.19Å; L919-I921 PolarHBondContact O-N 2.97Å; L919-I921 VanDerWaalsContact O-N 3.09Å; L919-N922 WeakPolarHBondContact O-CA 3.38Å; L919-N922 PolarHBondContact O-N 3.36Å; L919-D923 PolarHBondContact O-N 3.24Å; L919-P1013 HydrophobicContact CD1-CG 3.72Å; L919-P1013 HydrophobicContact CD2-CG 4.07Å
920	V	98.1	Very high	96.9	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.03	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-59.7	-18.1	171.5	-173.5	0	0	0	0	112.3	L868 A918 N922 V928 F932	L868-V920 HydrophobicContact CD1-CG2 4.28Å; L868-V920 HydrophobicContact CD2-CG2 3.77Å; A918-V920 PolarHBondContact O-N 3.01Å; V920-N922 PolarHBondContact O-N 3.21Å; V920-V928 HydrophobicContact CG1-CG1 3.66Å; V920-F932 HydrophobicContact CB-CD1 4.01Å; V920-F932 HydrophobicContact CB-CD2 4.3Å; V920-F932 HydrophobicContact CB-CE1 4.03Å; V920-F932 HydrophobicContact CB-CE2 4.31Å; V920-F932 HydrophobicContact CB-CG 4.17Å; V920-F932 HydrophobicContact CB-CZ 4.19Å; V920-F932 HydrophobicContact CG1-CB 4.08Å; V920-F932 HydrophobicContact CG1-CD1 4.07Å; V920-F932 HydrophobicContact CG1-CD2 3.9Å; V920-F932 HydrophobicContact CG1-CE2 4.36Å; V920-F932 HydrophobicContact CG1-CG 3.75Å
921	I	97.4	Very high	97	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-71.2	-17.3	171.7	-152.5	73.2	0	0	0	113.2	A918 L919 R929 F932 A933 L936 I952 L955 C956	A918-I921 WeakPolarHBondContact O-CB 3.34Å; A918-I921 WeakPolarHBondContact O-CG2 3.41Å; A918-I921 PolarHBondContact O-N 2.85Å; L919-I921 PolarHBondContact O-N 2.97Å; L919-I921 VanDerWaalsContact O-N 3.09Å; I921-R929 VanDerWaalsContact O-CD 3.26Å; I921-R929 WeakPolarHBondContact O-CD 3.47Å; I921-R929 VanDerWaalsContact O-CG 3.23Å; I921-R929 WeakPolarHBondContact O-CG 3.34Å; I921-F932 HydrophobicContact CB-CD1 4.16Å; I921-F932 HydrophobicContact CB-CE1 4.23Å; I921-F932 HydrophobicContact CD1-CD1 3.73Å; I921-F932 HydrophobicContact CD1-CE1 4.22Å; I921-A933 HydrophobicContact CD1-CB 3.61Å; I921-L936 HydrophobicContact CD1-CD2 4.28Å; I921-I952 HydrophobicContact CB-CG2 3.68Å; I921-I952 HydrophobicContact CD1-CG2 4.33Å; I921-I952 HydrophobicContact CG1-CG2 3.98Å; I921-I952 HydrophobicContact CG2-CG2 3.71Å; I921-L955 HydrophobicContact CG2-CB 3.77Å; I921-L955 HydrophobicContact CG2-CD1 4.06Å; I921-L955 HydrophobicContact CG2-CG 4.5Å; I921-C956 VanDerWaalsContact CG1-SG 3.52Å
922	N	96.4	Very high	97.1	Very high	51 Å²	51	33.7 Å²	33.7	27%	0.273	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-116.2	12.2	179.7	-69.6	93.2	0	0	0	114.1	L919 V920 L955	L919-N922 WeakPolarHBondContact O-CA 3.38Å; L919-N922 PolarHBondContact O-N 3.36Å; V920-N922 PolarHBondContact O-N 3.21Å; N922-L955 PolarHBondContact ND2-O 3.39Å; N922-L955 VanDerWaalsContact ND2-O 3.09Å; N922-L955 WeakPolarHBondContact OD1-CB 3.31Å; N922-L955 PolarHBondContact OD1-O 3.15Å
923	D	97.5	Very high	97.1	Very high	18 Å²	18	27.4 Å²	27.4	10%	0.096	13%	0.13	C	C	.	.			trans	-46.2	143.6	177.1	-164.8	-73	0	0	0	114.2	R889 L919 C925 V928 R929	R889-D923 IonicContact CZ-OD1 2.72Å; R889-D923 IonicContact CZ-OD2 3.62Å; R889-D923 IonicContact NE-OD1 2.82Å; R889-D923 IonicContact NE-OD2 2.63Å; R889-D923 PolarHBondContact NE-OD2 3.49Å; R889-D923 IonicContact NH2-OD1 3.79Å; R889-D923 PolarHBondContact NH2-OD1 3.34Å; R889-D923 IonicContact NH2-OD2 3.65Å; R889-D923 PolarHBondContact NH2-OD2 2.86Å; L919-D923 PolarHBondContact O-N 3.24Å; D923-C925 PolarHBondContact O-N 2.89Å; D923-C925 VanDerWaalsContact O-N 3.14Å; D923-C925 VanDerWaalsContact OD1-CB 3.3Å; D923-C925 WeakPolarHBondContact OD1-CB 3.29Å; D923-C925 PolarHBondContact OD1-N 3.05Å; D923-V928 HydrophobicContact CB-CB 3.97Å; D923-V928 HydrophobicContact CB-CG1 3.7Å; D923-V928 WeakPolarHBondContact OD2-CG1 3.34Å; D923-R929 HydrophobicContact CB-CG 3.91Å; D923-R929 WeakPolarHBondContact O-CD 3.41Å; D923-R929 WeakPolarHBondContact O-CG 3.45Å; D923-R929 PolarHBondContact O-NE 3.1Å
924	E	95.3	Very high	97	Very high	103 Å²	103	29.6 Å²	29.6	48%	0.481	14%	0.14	S	C	.	.	S	Bend	trans	-48.3	-43.5	175.6	-162.2	-166.9	179.9	0	0	110.8	L821 K882 Y926	L821-E924 HydrophobicContact CD1-CB 4.29Å; L821-E924 HydrophobicContact CD1-CG 3.62Å; L821-E924 HydrophobicContact CD2-CG 4.41Å; L821-E924 WeakPolarHBondContact CD2-OE2 3.29Å; K882-E924 IonicContact NZ-OE1 3.17Å; K882-E924 PolarHBondContact NZ-OE1 3.4Å; K882-E924 VanDerWaalsContact NZ-OE1 3.12Å; K882-E924 IonicContact NZ-OE2 3.24Å; K882-E924 PolarHBondContact NZ-OE2 3.49Å; E924-Y926 PolarHBondContact O-N 2.88Å
925	C	96.5	Very high	97	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-78.2	118.3	-178.7	-174	0	0	0	0	112.5	L821 D923 Q927 V928 R929	L821-C925 HydrophobicContact CB-CB 4.21Å; L821-C925 PolarHBondContact O-SG 3.44Å; L821-C925 VanDerWaalsContact O-SG 3.36Å; D923-C925 PolarHBondContact O-N 2.89Å; D923-C925 VanDerWaalsContact O-N 3.14Å; D923-C925 VanDerWaalsContact OD1-CB 3.3Å; D923-C925 WeakPolarHBondContact OD1-CB 3.29Å; D923-C925 PolarHBondContact OD1-N 3.05Å; C925-Q927 VanDerWaalsContact C-N 3.33Å; C925-Q927 PolarHBondContact O-N 3.06Å; C925-Q927 PolarHBondContact SG-OE1 2.66Å; C925-V928 HydrophobicContact CB-CB 4.11Å; C925-V928 HydrophobicContact CB-CG2 3.65Å; C925-V928 WeakPolarHBondContact O-CB 3.42Å; C925-V928 PolarHBondContact O-N 3.12Å; C925-V928 VanDerWaalsContact O-N 3.16Å; C925-R929 PolarHBondContact O-N 3.27Å
926	Y	95.9	Very high	96.9	Very high	80 Å²	80	33 Å²	33	31%	0.314	16%	0.155	S	C	.	.	H	α-helix	trans	-53.6	-45	177.3	170.9	-97.4	0	0	0	113.5	E924 V928 R929 Q930 V961 R964	E924-Y926 PolarHBondContact O-N 2.88Å; Y926-V928 VanDerWaalsContact C-N 3.34Å; Y926-V928 PolarHBondContact O-N 3.11Å; Y926-R929 PolarHBondContact O-N 3.22Å; Y926-Q930 HydrophobicContact CE1-CB 4.42Å; Y926-Q930 VanDerWaalsContact CE1-OE1 3.23Å; Y926-Q930 WeakPolarHBondContact O-CB 3.47Å; Y926-Q930 PolarHBondContact O-N 3.28Å; Y926-V961 HydrophobicContact CD2-CG2 4.01Å; Y926-V961 HydrophobicContact CE2-CB 4.41Å; Y926-V961 HydrophobicContact CE2-CG1 4.23Å; Y926-V961 HydrophobicContact CE2-CG2 4.07Å; Y926-R964 HydrophobicContact CD2-CG 4.35Å; Y926-R964 HydrophobicContact CE2-CG 3.59Å
927	Q	96.3	Very high	96.9	Very high	63 Å²	63	32.7 Å²	32.7	29%	0.294	15%	0.152	S	C	.	.	H	α-helix	trans	-64	-37.1	-178.9	-68.7	82.5	-14.3	0	0	112	W822 C925 Q930 I931	W822-Q927 HydrophobicContact CB-CG 4.32Å; W822-Q927 HydrophobicContact CD2-CB 3.48Å; W822-Q927 VanDerWaalsContact CD2-CB 3.48Å; W822-Q927 HydrophobicContact CD2-CG 3.81Å; W822-Q927 HydrophobicContact CE3-CB 3.7Å; W822-Q927 HydrophobicContact CG-CB 3.9Å; W822-Q927 HydrophobicContact CG-CG 3.71Å; W822-Q927 HydrophobicContact CH2-CB 4.2Å; W822-Q927 HydrophobicContact CZ2-CB 4.03Å; W822-Q927 HydrophobicContact CZ3-CB 4.05Å; C925-Q927 VanDerWaalsContact C-N 3.33Å; C925-Q927 PolarHBondContact O-N 3.06Å; C925-Q927 PolarHBondContact SG-OE1 2.66Å; Q927-Q930 PolarHBondContact O-N 2.67Å; Q927-I931 HydrophobicContact CB-CD1 4.49Å; Q927-I931 WeakPolarHBondContact O-CB 3.37Å; Q927-I931 WeakPolarHBondContact O-CD1 3.31Å; Q927-I931 VanDerWaalsContact O-CG1 3.26Å; Q927-I931 WeakPolarHBondContact O-CG1 3.42Å; Q927-I931 PolarHBondContact O-N 2.81Å
928	V	97.8	Very high	96.8	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-53.2	174.2	177	0	0	0	0	109.9	W822 S886 L890 V920 D923 C925 Y926 Q930 I931 F932	W822-V928 HydrophobicContact CE3-CG2 4.31Å; W822-V928 HydrophobicContact CZ3-CG2 3.94Å; S886-V928 WeakPolarHBondContact O-CG2 3.46Å; L890-V928 HydrophobicContact CB-CG1 4.04Å; L890-V928 HydrophobicContact CB-CG2 4.17Å; L890-V928 HydrophobicContact CD1-CG1 4.24Å; V920-V928 HydrophobicContact CG1-CG1 3.66Å; D923-V928 HydrophobicContact CB-CB 3.97Å; D923-V928 HydrophobicContact CB-CG1 3.7Å; D923-V928 WeakPolarHBondContact OD2-CG1 3.34Å; C925-V928 HydrophobicContact CB-CB 4.11Å; C925-V928 HydrophobicContact CB-CG2 3.65Å; C925-V928 WeakPolarHBondContact O-CB 3.42Å; C925-V928 PolarHBondContact O-N 3.12Å; C925-V928 VanDerWaalsContact O-N 3.16Å; Y926-V928 VanDerWaalsContact C-N 3.34Å; Y926-V928 PolarHBondContact O-N 3.11Å; V928-Q930 VanDerWaalsContact C-N 3.3Å; V928-Q930 PolarHBondContact O-N 3.3Å; V928-I931 PolarHBondContact O-N 3.08Å; V928-F932 WeakPolarHBondContact O-CB 3.18Å; V928-F932 PolarHBondContact O-N 2.97Å
929	R	97	Very high	96.7	Very high	22 Å²	22	36.2 Å²	36.2	8%	0.083	17%	0.168	C	C	.	.	H	α-helix	trans	-57.1	-42.1	176.5	-64.2	-172.7	-92.1	135.5	-13.9	112.7	I921 D923 C925 Y926 A933 D959 R964	I921-R929 VanDerWaalsContact O-CD 3.26Å; I921-R929 WeakPolarHBondContact O-CD 3.47Å; I921-R929 VanDerWaalsContact O-CG 3.23Å; I921-R929 WeakPolarHBondContact O-CG 3.34Å; D923-R929 HydrophobicContact CB-CG 3.91Å; D923-R929 WeakPolarHBondContact O-CD 3.41Å; D923-R929 WeakPolarHBondContact O-CG 3.45Å; D923-R929 PolarHBondContact O-NE 3.1Å; C925-R929 PolarHBondContact O-N 3.27Å; Y926-R929 PolarHBondContact O-N 3.22Å; R929-A933 WeakPolarHBondContact O-CB 3.43Å; R929-A933 PolarHBondContact O-N 3.01Å; R929-A933 VanDerWaalsContact O-N 3.12Å; R929-D959 IonicContact NH1-OD1 3.18Å; R929-D959 PolarHBondContact NH1-OD1 3.19Å; R929-D959 IonicContact NH1-OD2 2.83Å; R929-D959 PolarHBondContact NH1-OD2 2.92Å; R929-R964 PolarHBondContact O-NH1 3.25Å; R929-R964 PolarHBondContact O-NH2 3.15Å
930	Q	95.6	Very high	96.6	Very high	64 Å²	64	33.7 Å²	33.7	30%	0.299	16%	0.155	S	C	.	.	H	α-helix	trans	-64.4	-54.2	-179.5	-171	-175.6	12.9	0	0	111.4	Y926 Q927 V928 A933 Q934	Y926-Q930 HydrophobicContact CE1-CB 4.42Å; Y926-Q930 VanDerWaalsContact CE1-OE1 3.23Å; Y926-Q930 WeakPolarHBondContact O-CB 3.47Å; Y926-Q930 PolarHBondContact O-N 3.28Å; Q927-Q930 PolarHBondContact O-N 2.67Å; V928-Q930 VanDerWaalsContact C-N 3.3Å; V928-Q930 PolarHBondContact O-N 3.3Å; Q930-A933 PolarHBondContact O-N 2.84Å; Q930-Q934 WeakPolarHBondContact O-CG 3.46Å; Q930-Q934 PolarHBondContact O-N 3.4Å; Q930-Q934 VanDerWaalsContact O-N 3.1Å
931	I	97	Very high	96.3	Very high	41 Å²	41	35.2 Å²	35.2	21%	0.21	16%	0.164	C	C	.	.	H	α-helix	trans	-71	-38	-175	-65.1	164.7	0	0	0	110.9	W822 L890 Q927 V928 Q934 K935	W822-I931 HydrophobicContact CH2-CD1 3.86Å; W822-I931 HydrophobicContact CZ2-CD1 3.92Å; L890-I931 HydrophobicContact CD1-CB 4.16Å; L890-I931 HydrophobicContact CD1-CG2 4.02Å; L890-I931 HydrophobicContact CD2-CB 4.02Å; L890-I931 HydrophobicContact CD2-CD1 3.99Å; L890-I931 HydrophobicContact CD2-CG2 3.88Å; L890-I931 HydrophobicContact CG-CG2 4.44Å; Q927-I931 HydrophobicContact CB-CD1 4.49Å; Q927-I931 WeakPolarHBondContact O-CB 3.37Å; Q927-I931 WeakPolarHBondContact O-CD1 3.31Å; Q927-I931 VanDerWaalsContact O-CG1 3.26Å; Q927-I931 WeakPolarHBondContact O-CG1 3.42Å; Q927-I931 PolarHBondContact O-N 2.81Å; V928-I931 PolarHBondContact O-N 3.08Å; I931-Q934 PolarHBondContact O-N 3.12Å; I931-K935 HydrophobicContact CG2-CD 4.38Å; I931-K935 VanDerWaalsContact CG2-CE 3.49Å; I931-K935 WeakPolarHBondContact O-CG 3.31Å; I931-K935 PolarHBondContact O-N 2.93Å
932	F	97.9	Very high	96.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.7	-48.1	174.6	-176.8	-109.7	0	0	0	111.2	L890 M897 C917 V920 I921 V928 Q934 K935 L936 I952	L890-F932 HydrophobicContact CD1-CB 4.03Å; M897-F932 HydrophobicContact CB-CE2 4.37Å; M897-F932 HydrophobicContact CE-CD2 3.59Å; M897-F932 HydrophobicContact CE-CE2 3.44Å; M897-F932 VanDerWaalsContact CE-CE2 3.44Å; M897-F932 HydrophobicContact CE-CG 4.46Å; M897-F932 HydrophobicContact CE-CZ 4.23Å; M897-F932 HydrophobicContact SD-CE2 3.98Å; M897-F932 HydrophobicContact SD-CZ 4.21Å; C917-F932 WeakPolarHBondContact O-CZ 3.32Å; V920-F932 HydrophobicContact CB-CD1 4.01Å; V920-F932 HydrophobicContact CB-CD2 4.3Å; V920-F932 HydrophobicContact CB-CE1 4.03Å; V920-F932 HydrophobicContact CB-CE2 4.31Å; V920-F932 HydrophobicContact CB-CG 4.17Å; V920-F932 HydrophobicContact CB-CZ 4.19Å; V920-F932 HydrophobicContact CG1-CB 4.08Å; V920-F932 HydrophobicContact CG1-CD1 4.07Å; V920-F932 HydrophobicContact CG1-CD2 3.9Å; V920-F932 HydrophobicContact CG1-CE2 4.36Å; V920-F932 HydrophobicContact CG1-CG 3.75Å; I921-F932 HydrophobicContact CB-CD1 4.16Å; I921-F932 HydrophobicContact CB-CE1 4.23Å; I921-F932 HydrophobicContact CD1-CD1 3.73Å; I921-F932 HydrophobicContact CD1-CE1 4.22Å; V928-F932 WeakPolarHBondContact O-CB 3.18Å; V928-F932 PolarHBondContact O-N 2.97Å; F932-Q934 VanDerWaalsContact C-N 3.31Å; F932-Q934 PolarHBondContact O-N 2.88Å; F932-K935 PolarHBondContact O-N 3.25Å; F932-L936 WeakPolarHBondContact O-CB 3.46Å; F932-L936 PolarHBondContact O-N 3.39Å; F932-I952 HydrophobicContact CE1-CG2 4.35Å
933	A	96.5	Very high	95.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-36.3	176.2	0	0	0	0	0	113.7	I921 R929 Q930 H937 F953 R964	I921-A933 HydrophobicContact CD1-CB 3.61Å; R929-A933 WeakPolarHBondContact O-CB 3.43Å; R929-A933 PolarHBondContact O-N 3.01Å; R929-A933 VanDerWaalsContact O-N 3.12Å; Q930-A933 PolarHBondContact O-N 2.84Å; A933-H937 WeakPolarHBondContact O-CB 3.46Å; A933-H937 PolarHBondContact O-N 2.82Å; A933-F953 HydrophobicContact CB-CE1 4.46Å; A933-R964 VanDerWaalsContact CB-NH1 3.29Å
934	Q	95.8	Very high	95.6	Very high	73 Å²	73	45.1 Å²	45.1	34%	0.341	21%	0.21	S	C	.	.	H	α-helix	trans	-68	-43.3	176.1	-74	171.2	-4.8	0	0	111.8	Q930 I931 F932 H937 K938	Q930-Q934 WeakPolarHBondContact O-CG 3.46Å; Q930-Q934 PolarHBondContact O-N 3.4Å; Q930-Q934 VanDerWaalsContact O-N 3.1Å; I931-Q934 PolarHBondContact O-N 3.12Å; F932-Q934 VanDerWaalsContact C-N 3.31Å; F932-Q934 PolarHBondContact O-N 2.88Å; Q934-H937 PolarHBondContact O-N 3.42Å; Q934-K938 WeakPolarHBondContact O-CB 3.17Å; Q934-K938 PolarHBondContact O-N 3.26Å
935	K	97.1	Very high	95.5	Very high	93 Å²	93	40.4 Å²	40.4	40%	0.404	19%	0.189	S	C	.	.	H	α-helix	trans	-63.1	-42.2	174.2	-68.8	174.3	-166.4	-65.7	0	111.4	S894 M897 I931 F932 K938 A939	S894-K935 WeakPolarHBondContact OG-CD 3.49Å; S894-K935 WeakPolarHBondContact OG-CE 3.39Å; M897-K935 HydrophobicContact CE-CB 3.55Å; I931-K935 HydrophobicContact CG2-CD 4.38Å; I931-K935 VanDerWaalsContact CG2-CE 3.49Å; I931-K935 WeakPolarHBondContact O-CG 3.31Å; I931-K935 PolarHBondContact O-N 2.93Å; F932-K935 PolarHBondContact O-N 3.25Å; K935-K938 PolarHBondContact O-N 3.07Å; K935-A939 WeakPolarHBondContact O-CB 3.4Å; K935-A939 PolarHBondContact O-N 2.81Å
936	L	97.3	Very high	95.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58	-51.8	174.8	176.8	59.7	0	0	0	111.6	M897 I921 F932 K938 A939 L940 L945 Y949 I952 F953	M897-L936 HydrophobicContact CE-CB 4.42Å; M897-L936 VanDerWaalsContact SD-CA 3.51Å; M897-L936 HydrophobicContact SD-CB 3.69Å; M897-L936 HydrophobicContact SD-CD1 3.76Å; M897-L936 HydrophobicContact SD-CG 4.34Å; I921-L936 HydrophobicContact CD1-CD2 4.28Å; F932-L936 WeakPolarHBondContact O-CB 3.46Å; F932-L936 PolarHBondContact O-N 3.39Å; L936-K938 PolarHBondContact O-N 3.47Å; L936-A939 PolarHBondContact O-N 3.34Å; L936-L940 HydrophobicContact CD1-CD1 3.66Å; L936-L940 HydrophobicContact CD1-CG 4.16Å; L936-L940 HydrophobicContact CG-CD1 3.89Å; L936-L940 WeakPolarHBondContact O-CB 3.48Å; L936-L940 WeakPolarHBondContact O-CG 3.5Å; L936-L940 PolarHBondContact O-N 2.91Å; L936-L945 HydrophobicContact CD1-CD2 3.63Å; L936-Y949 WeakPolarHBondContact CD1-O 3.27Å; L936-I952 HydrophobicContact CD1-CD1 4.49Å; L936-I952 HydrophobicContact CD2-CB 3.99Å; L936-I952 HydrophobicContact CD2-CG2 4.02Å; L936-F953 HydrophobicContact CB-CZ 4.46Å; L936-F953 HydrophobicContact CD2-CD1 4.41Å; L936-F953 HydrophobicContact CD2-CD2 4.21Å; L936-F953 HydrophobicContact CD2-CE1 4.09Å; L936-F953 HydrophobicContact CD2-CE2 3.89Å; L936-F953 HydrophobicContact CD2-CG 4.46Å; L936-F953 HydrophobicContact CD2-CZ 3.81Å; L936-F953 HydrophobicContact CG-CE2 3.94Å; L936-F953 HydrophobicContact CG-CZ 3.91Å
937	H	96.6	Very high	95.2	Very high	20 Å²	20	38.1 Å²	38.1	9%	0.093	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-47.9	175.7	-179.1	52.9	0	0	0	112.1	A933 Q934 A939 L940 V941 F953 C971 N975	A933-H937 WeakPolarHBondContact O-CB 3.46Å; A933-H937 PolarHBondContact O-N 2.82Å; Q934-H937 PolarHBondContact O-N 3.42Å; H937-A939 VanDerWaalsContact C-N 3.29Å; H937-A939 PolarHBondContact O-N 2.81Å; H937-L940 PolarHBondContact O-N 3.36Å; H937-V941 WeakPolarHBondContact CE1-CG2 3.44Å; H937-V941 VanDerWaalsContact O-CB 3.31Å; H937-V941 WeakPolarHBondContact O-CB 3.14Å; H937-V941 VanDerWaalsContact O-CG2 3.29Å; H937-V941 WeakPolarHBondContact O-CG2 3.48Å; H937-V941 PolarHBondContact O-N 2.9Å; H937-F953 HydrophobicContact CB-CZ 4.19Å; H937-C971 HydrophobicContact CB-CB 4.17Å; H937-C971 WeakPolarHBondContact ND1-CB 3.39Å; H937-N975 PolarHBondContact ND1-ND2 3.3Å
938	K	94.7	Very high	95.2	Very high	69 Å²	69	35.4 Å²	35.4	30%	0.3	17%	0.171	S	C	.	.	H	α-helix	trans	-57.8	-37.9	178.5	-178.3	178.9	-176.8	164.4	0	112.6	Q934 K935 L936 K942 E1199 N1200	Q934-K938 WeakPolarHBondContact O-CB 3.17Å; Q934-K938 PolarHBondContact O-N 3.26Å; K935-K938 PolarHBondContact O-N 3.07Å; L936-K938 PolarHBondContact O-N 3.47Å; K938-K942 WeakPolarHBondContact O-CG 3.44Å; K938-E1199 PolarHBondContact NZ-O 2.74Å; K938-N1200 WeakPolarHBondContact CD-OD1 3.26Å; K938-N1200 WeakPolarHBondContact CE-OD1 3.29Å; K938-N1200 VanDerWaalsContact NZ-CG 3.26Å; K938-N1200 PolarHBondContact NZ-ND2 2.59Å; K938-N1200 PolarHBondContact NZ-OD1 3.37Å
939	A	95.6	Very high	95.2	Very high	5 Å²	5	35.4 Å²	35.4	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-76.4	-44.5	179.5	0	0	0	0	0	112.4	Q901 K935 L936 H937 V941 K942 L944 L945	Q901-A939 HydrophobicContact CG-CB 4.39Å; K935-A939 WeakPolarHBondContact O-CB 3.4Å; K935-A939 PolarHBondContact O-N 2.81Å; L936-A939 PolarHBondContact O-N 3.34Å; H937-A939 VanDerWaalsContact C-N 3.29Å; H937-A939 PolarHBondContact O-N 2.81Å; A939-V941 PolarHBondContact O-N 3.31Å; A939-K942 PolarHBondContact O-N 3.05Å; A939-L944 PolarHBondContact O-N 3.17Å; A939-L945 HydrophobicContact CB-CB 3.93Å; A939-L945 HydrophobicContact CB-CD2 3.99Å
940	L	95.9	Very high	95.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-36.1	177.6	-72	166.6	0	0	0	112.8	L936 H937 K942 L943 L945 M950 F953 N975 R979	L936-L940 HydrophobicContact CD1-CD1 3.66Å; L936-L940 HydrophobicContact CD1-CG 4.16Å; L936-L940 HydrophobicContact CG-CD1 3.89Å; L936-L940 WeakPolarHBondContact O-CB 3.48Å; L936-L940 WeakPolarHBondContact O-CG 3.5Å; L936-L940 PolarHBondContact O-N 2.91Å; H937-L940 PolarHBondContact O-N 3.36Å; L940-K942 VanDerWaalsContact C-N 3.29Å; L940-K942 PolarHBondContact O-N 3.32Å; L940-L943 PolarHBondContact O-N 2.89Å; L940-L943 VanDerWaalsContact O-N 3.12Å; L940-L945 HydrophobicContact CD2-CB 4.06Å; L940-L945 HydrophobicContact CD2-CD2 4.24Å; L940-L945 HydrophobicContact CD2-CG 4.36Å; L940-L945 HydrophobicContact CG-CB 4.36Å; L940-L945 HydrophobicContact CG-CD2 4.11Å; L940-M950 HydrophobicContact CD1-CB 4Å; L940-M950 HydrophobicContact CD1-CG 4.18Å; L940-M950 HydrophobicContact CD2-CB 4.06Å; L940-F953 HydrophobicContact CD1-CD2 4.33Å; L940-F953 HydrophobicContact CD1-CE2 3.75Å; L940-N975 VanDerWaalsContact CB-OD1 3.22Å; L940-N975 WeakPolarHBondContact CB-OD1 3.45Å; L940-N975 PolarHBondContact O-OD1 3.19Å; L940-R979 PolarHBondContact O-NH1 3.02Å; L940-R979 PolarHBondContact O-NH2 3.17Å
941	V	92.9	Very high	95.3	Very high	37 Å²	37	31.3 Å²	31.3	22%	0.224	15%	0.152	C	C	.	.	H	α-helix	trans	-66.8	-30.5	177.6	160.2	0	0	0	0	112	H937 A939 L943 N975 I978	H937-V941 WeakPolarHBondContact CE1-CG2 3.44Å; H937-V941 VanDerWaalsContact O-CB 3.31Å; H937-V941 WeakPolarHBondContact O-CB 3.14Å; H937-V941 VanDerWaalsContact O-CG2 3.29Å; H937-V941 WeakPolarHBondContact O-CG2 3.48Å; H937-V941 PolarHBondContact O-N 2.9Å; A939-V941 PolarHBondContact O-N 3.31Å; V941-L943 PolarHBondContact O-N 3.35Å; V941-N975 WeakPolarHBondContact CA-OD1 3.43Å; V941-N975 PolarHBondContact N-OD1 3.46Å; V941-N975 VanDerWaalsContact N-OD1 3.11Å; V941-I978 HydrophobicContact CB-CD1 4.46Å; V941-I978 HydrophobicContact CG1-CD1 3.85Å; V941-I978 HydrophobicContact CG2-CD1 4.25Å
942	K	91.7	Very high	95.3	Very high	134 Å²	134	29.4 Å²	29.4	58%	0.583	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-0.3	174.1	-71.6	-173.2	174.2	-157.8	0	113.8	K938 A939 L940 L944	K938-K942 WeakPolarHBondContact O-CG 3.44Å; A939-K942 PolarHBondContact O-N 3.05Å; L940-K942 VanDerWaalsContact C-N 3.29Å; L940-K942 PolarHBondContact O-N 3.32Å; K942-L944 HydrophobicContact CB-CB 4.49Å; K942-L944 HydrophobicContact CB-CD1 4.04Å; K942-L944 HydrophobicContact CB-CG 3.96Å; K942-L944 HydrophobicContact CD-CD1 4.27Å; K942-L944 PolarHBondContact O-N 2.82Å; K942-L944 VanDerWaalsContact O-N 3.16Å
943	L	92.2	Very high	95.3	Very high	50 Å²	50	29.4 Å²	29.4	26%	0.262	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	22.7	-173.6	-51.3	179	0	0	0	113.8	L940 V941 I978 R979 Y982 L996	L940-L943 PolarHBondContact O-N 2.89Å; L940-L943 VanDerWaalsContact O-N 3.12Å; V941-L943 PolarHBondContact O-N 3.35Å; L943-I978 HydrophobicContact CD2-CG2 4.36Å; L943-R979 HydrophobicContact CD2-CG 3.67Å; L943-Y982 HydrophobicContact CD1-CD1 4.26Å; L943-Y982 HydrophobicContact CD1-CD2 4.02Å; L943-Y982 HydrophobicContact CD1-CE2 4.47Å; L943-Y982 HydrophobicContact CD1-CG 3.91Å; L943-L996 HydrophobicContact CB-CD2 4.49Å; L943-L996 HydrophobicContact CD1-CD2 4.16Å; L943-L996 HydrophobicContact CD2-CD2 4.31Å
944	L	91.3	Very high	95.3	Very high	93 Å²	93	29.4 Å²	29.4	49%	0.487	14%	0.143	S	C	.	.			trans	-93.7	-16.8	179.9	-66.3	177.8	0	0	0	113.6	Q901 A939 K942	Q901-L944 WeakPolarHBondContact CA-O 3.49Å; Q901-L944 HydrophobicContact CB-CB 4.36Å; Q901-L944 HydrophobicContact CG-CB 4.31Å; A939-L944 PolarHBondContact O-N 3.17Å; K942-L944 HydrophobicContact CB-CB 4.49Å; K942-L944 HydrophobicContact CB-CD1 4.04Å; K942-L944 HydrophobicContact CB-CG 3.96Å; K942-L944 HydrophobicContact CD-CD1 4.27Å; K942-L944 PolarHBondContact O-N 2.82Å; K942-L944 VanDerWaalsContact O-N 3.16Å
945	L	94.3	Very high	95.4	Very high	5 Å²	5	26 Å²	26	3%	0.026	13%	0.127	C	C	.	.	S	Bend	trans	-109.7	134.1	-177.5	-166.9	70.7	0	0	0	110.2	M897 A900 Q901 L936 A939 L940 Y949	M897-L945 HydrophobicContact CG-CD1 4.28Å; M897-L945 HydrophobicContact CG-CD2 3.89Å; M897-L945 HydrophobicContact SD-CD2 4.21Å; A900-L945 HydrophobicContact CB-CD1 3.81Å; Q901-L945 HydrophobicContact CG-CB 4.26Å; Q901-L945 HydrophobicContact CG-CD1 3.81Å; L936-L945 HydrophobicContact CD1-CD2 3.63Å; A939-L945 HydrophobicContact CB-CB 3.93Å; A939-L945 HydrophobicContact CB-CD2 3.99Å; L940-L945 HydrophobicContact CD2-CB 4.06Å; L940-L945 HydrophobicContact CD2-CD2 4.24Å; L940-L945 HydrophobicContact CD2-CG 4.36Å; L940-L945 HydrophobicContact CG-CB 4.36Å; L940-L945 HydrophobicContact CG-CD2 4.11Å; L945-Y949 HydrophobicContact CD1-CD1 4.23Å; L945-Y949 HydrophobicContact CD1-CD2 3.75Å; L945-Y949 HydrophobicContact CD1-CE2 4.14Å; L945-Y949 HydrophobicContact CD1-CG 3.85Å; L945-Y949 HydrophobicContact CD2-CD1 4Å; L945-Y949 HydrophobicContact CD2-CD2 4.24Å; L945-Y949 HydrophobicContact CD2-CG 3.59Å; L945-Y949 HydrophobicContact CG-CD1 4.34Å; L945-Y949 HydrophobicContact CG-CD2 3.75Å; L945-Y949 HydrophobicContact CG-CG 3.64Å
946	P	93.3	Very high	95.4	Very high	28 Å²	28	21.6 Å²	21.6	18%	0.182	11%	0.108	C	C	.	.			trans	-60.8	159.4	-178.6	-25.1	34.4	0	0	0	114.6	A900 E948 Y949	A900-P946 WeakPolarHBondContact O-CD 3.38Å; P946-E948 HydrophobicContact CB-CG 4.17Å; P946-E948 PolarHBondContact O-N 3.01Å; P946-Y949 HydrophobicContact CB-CD2 4.42Å; P946-Y949 PolarHBondContact O-N 3.25Å; P946-Y949 VanDerWaalsContact O-N 3.16Å
947	L	93.4	Very high	95.3	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-25.9	-178.1	-76.1	171.7	0	0	0	113.9	Y949 M950 A951 S995 L997 Y1004	L947-Y949 PolarHBondContact O-N 2.86Å; L947-M950 HydrophobicContact CD2-CE 3.82Å; L947-M950 HydrophobicContact CD2-SD 4.43Å; L947-M950 WeakPolarHBondContact O-CA 3.47Å; L947-M950 VanDerWaalsContact O-CB 3.29Å; L947-M950 WeakPolarHBondContact O-CB 3.46Å; L947-M950 PolarHBondContact O-N 2.92Å; L947-A951 PolarHBondContact O-N 3.37Å; L947-S995 WeakPolarHBondContact CG-O 3.41Å; L947-L997 WeakPolarHBondContact CD1-O 3.4Å; L947-Y1004 HydrophobicContact CB-CD2 4.26Å; L947-Y1004 HydrophobicContact CB-CE2 4Å
948	E	95.4	Very high	95.2	Very high	6 Å²	6	23.8 Å²	23.8	3%	0.028	12%	0.12	C	C	.	.	H	α-helix	trans	-55.2	-39.1	173.8	70.9	-156.4	-138.7	0	0	112	H906 F914 P946 M950 A951 Y1004	H906-E948 IonicContact CD2-OE1 2.93Å; H906-E948 PolarHBondContact CD2-OE1 2.86Å; H906-E948 IonicContact CE1-OE2 3.27Å; H906-E948 PolarHBondContact CE1-OE2 2.9Å; H906-E948 IonicContact NE2-OE1 2.62Å; H906-E948 PolarHBondContact NE2-OE1 3.36Å; H906-E948 IonicContact NE2-OE2 2.88Å; H906-E948 PolarHBondContact NE2-OE2 2.96Å; F914-E948 HydrophobicContact CD2-CG 4.08Å; F914-E948 HydrophobicContact CE2-CB 4Å; F914-E948 HydrophobicContact CE2-CG 3.84Å; F914-E948 WeakPolarHBondContact CE2-O 3.36Å; F914-E948 HydrophobicContact CZ-CB 3.99Å; F914-E948 HydrophobicContact CZ-CG 4.34Å; F914-E948 VanDerWaalsContact CZ-O 3.26Å; F914-E948 WeakPolarHBondContact CZ-O 3.35Å; P946-E948 HydrophobicContact CB-CG 4.17Å; P946-E948 PolarHBondContact O-N 3.01Å; E948-M950 VanDerWaalsContact C-N 3.27Å; E948-M950 PolarHBondContact O-N 3.2Å; E948-A951 WeakPolarHBondContact O-CB 3.33Å; E948-A951 PolarHBondContact O-N 2.76Å; E948-A951 VanDerWaalsContact O-N 3.09Å; E948-Y1004 HydrophobicContact CB-CD1 3.48Å; E948-Y1004 VanDerWaalsContact CB-CD1 3.48Å; E948-Y1004 HydrophobicContact CB-CD2 4.17Å; E948-Y1004 HydrophobicContact CB-CE1 3.84Å; E948-Y1004 HydrophobicContact CB-CG 3.67Å
949	Y	97.6	Very high	95.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70.9	-21.3	176	-67.4	-93.5	0	0	0	112.8	M897 A900 F914 L936 L945 P946 L947 A951 I952	M897-Y949 HydrophobicContact CG-CD1 4.44Å; A900-Y949 HydrophobicContact CB-CE1 4.21Å; A900-Y949 HydrophobicContact CB-CE2 3.71Å; A900-Y949 VanDerWaalsContact CB-CZ 3.49Å; A900-Y949 WeakPolarHBondContact CB-OH 3.28Å; F914-Y949 HydrophobicContact CD2-CD1 4.32Å; F914-Y949 AromaticContact CD2-CE1 3.96Å; F914-Y949 HydrophobicContact CD2-CE1 3.96Å; F914-Y949 HydrophobicContact CD2-CE2 4.19Å; F914-Y949 AromaticContact CD2-CZ 3.85Å; F914-Y949 HydrophobicContact CE2-CD1 4.32Å; F914-Y949 HydrophobicContact CE2-CE1 4.41Å; F914-Y949 HydrophobicContact CE2-CG 4.34Å; L936-Y949 WeakPolarHBondContact CD1-O 3.27Å; L945-Y949 HydrophobicContact CD1-CD1 4.23Å; L945-Y949 HydrophobicContact CD1-CD2 3.75Å; L945-Y949 HydrophobicContact CD1-CE2 4.14Å; L945-Y949 HydrophobicContact CD1-CG 3.85Å; L945-Y949 HydrophobicContact CD2-CD1 4Å; L945-Y949 HydrophobicContact CD2-CD2 4.24Å; L945-Y949 HydrophobicContact CD2-CG 3.59Å; L945-Y949 HydrophobicContact CG-CD1 4.34Å; L945-Y949 HydrophobicContact CG-CD2 3.75Å; L945-Y949 HydrophobicContact CG-CG 3.64Å; P946-Y949 HydrophobicContact CB-CD2 4.42Å; P946-Y949 PolarHBondContact O-N 3.25Å; P946-Y949 VanDerWaalsContact O-N 3.16Å; L947-Y949 PolarHBondContact O-N 2.86Å; Y949-A951 VanDerWaalsContact C-N 3.28Å; Y949-I952 HydrophobicContact CD1-CD1 3.65Å; Y949-I952 HydrophobicContact CE1-CD1 4.48Å; Y949-I952 HydrophobicContact CG-CD1 4.24Å; Y949-I952 WeakPolarHBondContact O-CB 3.36Å; Y949-I952 WeakPolarHBondContact O-CG1 3.36Å; Y949-I952 PolarHBondContact O-N 3.25Å
950	M	97.3	Very high	95	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-70.1	-28.1	171.7	-163.8	169.9	73	0	0	111.7	L940 L947 E948 I952 F953 L972 N975 P998 V1001 M1034	L940-M950 HydrophobicContact CD1-CB 4Å; L940-M950 HydrophobicContact CD1-CG 4.18Å; L940-M950 HydrophobicContact CD2-CB 4.06Å; L947-M950 HydrophobicContact CD2-CE 3.82Å; L947-M950 HydrophobicContact CD2-SD 4.43Å; L947-M950 WeakPolarHBondContact O-CA 3.47Å; L947-M950 VanDerWaalsContact O-CB 3.29Å; L947-M950 WeakPolarHBondContact O-CB 3.46Å; L947-M950 PolarHBondContact O-N 2.92Å; E948-M950 VanDerWaalsContact C-N 3.27Å; E948-M950 PolarHBondContact O-N 3.2Å; M950-I952 PolarHBondContact O-N 2.87Å; M950-F953 HydrophobicContact CG-CD2 4.46Å; M950-F953 PolarHBondContact O-N 3.06Å; M950-L972 HydrophobicContact CG-CD2 3.79Å; M950-L972 HydrophobicContact SD-CD2 4.32Å; M950-N975 HydrophobicContact SD-CB 3.93Å; M950-P998 HydrophobicContact CE-CB 4.37Å; M950-V1001 HydrophobicContact CB-CG2 3.94Å; M950-V1001 HydrophobicContact CE-CB 3.71Å; M950-V1001 HydrophobicContact CE-CG1 3.98Å; M950-V1001 HydrophobicContact CE-CG2 3.88Å; M950-V1001 HydrophobicContact CG-CG2 4.35Å; M950-M1034 WeakPolarHBondContact O-CE 3.23Å
951	A	97.1	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-26.8	176.8	0	0	0	0	0	113	L947 E948 Y949 F953 A954 V1001 M1005 L1008	L947-A951 PolarHBondContact O-N 3.37Å; E948-A951 WeakPolarHBondContact O-CB 3.33Å; E948-A951 PolarHBondContact O-N 2.76Å; E948-A951 VanDerWaalsContact O-N 3.09Å; Y949-A951 VanDerWaalsContact C-N 3.28Å; A951-F953 PolarHBondContact O-N 2.67Å; A951-F953 VanDerWaalsContact O-N 3.11Å; A951-A954 VanDerWaalsContact O-CB 3.26Å; A951-A954 WeakPolarHBondContact O-CB 3.43Å; A951-A954 PolarHBondContact O-N 2.96Å; A951-V1001 HydrophobicContact CB-CG2 3.88Å; A951-M1005 HydrophobicContact CB-CB 4.02Å; A951-L1008 HydrophobicContact CB-CD2 4.26Å
952	I	98.1	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-54.9	-31.7	177.3	-56.4	176.1	0	0	0	111.7	F914 A918 I921 F932 L936 Y949 M950 A954 L955 L1008	F914-I952 HydrophobicContact CE2-CD1 4.08Å; F914-I952 HydrophobicContact CE2-CG1 4.11Å; F914-I952 HydrophobicContact CZ-CG1 4.4Å; A918-I952 HydrophobicContact CB-CB 4.46Å; A918-I952 HydrophobicContact CB-CD1 4.02Å; A918-I952 HydrophobicContact CB-CG1 3.71Å; A918-I952 HydrophobicContact CB-CG2 4.16Å; I921-I952 HydrophobicContact CB-CG2 3.68Å; I921-I952 HydrophobicContact CD1-CG2 4.33Å; I921-I952 HydrophobicContact CG1-CG2 3.98Å; I921-I952 HydrophobicContact CG2-CG2 3.71Å; F932-I952 HydrophobicContact CE1-CG2 4.35Å; L936-I952 HydrophobicContact CD1-CD1 4.49Å; L936-I952 HydrophobicContact CD2-CB 3.99Å; L936-I952 HydrophobicContact CD2-CG2 4.02Å; Y949-I952 HydrophobicContact CD1-CD1 3.65Å; Y949-I952 HydrophobicContact CE1-CD1 4.48Å; Y949-I952 HydrophobicContact CG-CD1 4.24Å; Y949-I952 WeakPolarHBondContact O-CB 3.36Å; Y949-I952 WeakPolarHBondContact O-CG1 3.36Å; Y949-I952 PolarHBondContact O-N 3.25Å; M950-I952 PolarHBondContact O-N 2.87Å; I952-A954 PolarHBondContact O-N 3.17Å; I952-L955 PolarHBondContact O-N 3.04Å; I952-L1008 HydrophobicContact CG1-CD2 4.38Å
953	F	97.6	Very high	94.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-66.4	-13.4	176.8	-75.8	-61.9	0	0	0	114.5	A933 L936 H937 L940 M950 A951 L955 C956 A968 C971 L972 F1033 M1034	A933-F953 HydrophobicContact CB-CE1 4.46Å; L936-F953 HydrophobicContact CB-CZ 4.46Å; L936-F953 HydrophobicContact CD2-CD1 4.41Å; L936-F953 HydrophobicContact CD2-CD2 4.21Å; L936-F953 HydrophobicContact CD2-CE1 4.09Å; L936-F953 HydrophobicContact CD2-CE2 3.89Å; L936-F953 HydrophobicContact CD2-CG 4.46Å; L936-F953 HydrophobicContact CD2-CZ 3.81Å; L936-F953 HydrophobicContact CG-CE2 3.94Å; L936-F953 HydrophobicContact CG-CZ 3.91Å; H937-F953 HydrophobicContact CB-CZ 4.19Å; L940-F953 HydrophobicContact CD1-CD2 4.33Å; L940-F953 HydrophobicContact CD1-CE2 3.75Å; M950-F953 HydrophobicContact CG-CD2 4.46Å; M950-F953 PolarHBondContact O-N 3.06Å; A951-F953 PolarHBondContact O-N 2.67Å; A951-F953 VanDerWaalsContact O-N 3.11Å; F953-L955 VanDerWaalsContact C-N 3.34Å; F953-C956 VanDerWaalsContact O-CB 3.32Å; F953-C956 WeakPolarHBondContact O-CB 3.41Å; F953-C956 PolarHBondContact O-N 3.01Å; F953-A968 HydrophobicContact CD1-CB 3.88Å; F953-A968 HydrophobicContact CE1-CB 4.38Å; F953-C971 HydrophobicContact CE1-CB 3.96Å; F953-C971 HydrophobicContact CE2-CB 4.21Å; F953-C971 HydrophobicContact CZ-CB 3.68Å; F953-L972 HydrophobicContact CB-CD1 3.9Å; F953-L972 HydrophobicContact CB-CD2 3.87Å; F953-L972 HydrophobicContact CB-CG 3.88Å; F953-L972 HydrophobicContact CD2-CD2 3.88Å; F953-L972 HydrophobicContact CD2-CG 4.2Å; F953-L972 HydrophobicContact CG-CD2 4.2Å; F953-L972 HydrophobicContact CG-CG 4.17Å; F953-F1033 WeakPolarHBondContact O-CD1 3.05Å; F953-F1033 VanDerWaalsContact O-CE1 3.25Å; F953-F1033 WeakPolarHBondContact O-CE1 3.4Å; F953-M1034 HydrophobicContact CB-CE 4Å
954	A	96.8	Very high	94.5	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-66	-39.6	172.7	0	0	0	0	0	111.1	A951 I952 C956 A957 M1005 C1030 M1034	A951-A954 VanDerWaalsContact O-CB 3.26Å; A951-A954 WeakPolarHBondContact O-CB 3.43Å; A951-A954 PolarHBondContact O-N 2.96Å; I952-A954 PolarHBondContact O-N 3.17Å; A954-C956 PolarHBondContact O-N 3.02Å; A954-A957 VanDerWaalsContact O-CB 3.32Å; A954-A957 WeakPolarHBondContact O-CB 3.48Å; A954-A957 PolarHBondContact O-N 3.15Å; A954-M1005 HydrophobicContact CB-CG 3.87Å; A954-M1005 HydrophobicContact CB-SD 3.81Å; A954-C1030 HydrophobicContact CB-CB 4.43Å; A954-M1034 HydrophobicContact CB-CE 3.88Å
955	L	97.2	Very high	94.7	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-65.8	-18.4	179.6	-50.2	176.3	0	0	0	112.9	A918 I921 N922 I952 F953 A957 K958 L1008 L1009	A918-L955 HydrophobicContact CB-CD1 4.29Å; I921-L955 HydrophobicContact CG2-CB 3.77Å; I921-L955 HydrophobicContact CG2-CD1 4.06Å; I921-L955 HydrophobicContact CG2-CG 4.5Å; N922-L955 PolarHBondContact ND2-O 3.39Å; N922-L955 VanDerWaalsContact ND2-O 3.09Å; N922-L955 WeakPolarHBondContact OD1-CB 3.31Å; N922-L955 PolarHBondContact OD1-O 3.15Å; I952-L955 PolarHBondContact O-N 3.04Å; F953-L955 VanDerWaalsContact C-N 3.34Å; L955-A957 PolarHBondContact O-N 3.35Å; L955-A957 VanDerWaalsContact O-N 3.14Å; L955-K958 WeakPolarHBondContact O-CB 3.41Å; L955-K958 PolarHBondContact O-N 3.41Å; L955-K958 VanDerWaalsContact O-N 3.09Å; L955-L1008 HydrophobicContact CD1-CD2 4.02Å; L955-L1008 HydrophobicContact CD1-CG 4.33Å; L955-L1008 HydrophobicContact CG-CD2 4.26Å; L955-L1009 HydrophobicContact CD2-CD2 3.56Å
956	C	96.7	Very high	94.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61.2	-15.5	169.8	-66.3	0	0	0	0	113.4	I921 F953 A954 K958 D959 R965 A968 F1033	I921-C956 VanDerWaalsContact CG1-SG 3.52Å; F953-C956 VanDerWaalsContact O-CB 3.32Å; F953-C956 WeakPolarHBondContact O-CB 3.41Å; F953-C956 PolarHBondContact O-N 3.01Å; A954-C956 PolarHBondContact O-N 3.02Å; C956-K958 PolarHBondContact O-N 3.08Å; C956-D959 VanDerWaalsContact O-CB 3.31Å; C956-D959 WeakPolarHBondContact O-CB 3.21Å; C956-D959 PolarHBondContact O-N 3.34Å; C956-R965 WeakPolarHBondContact O-CG 3.45Å; C956-A968 HydrophobicContact CB-CB 3.72Å; C956-F1033 HydrophobicContact CB-CE1 3.99Å; C956-F1033 HydrophobicContact CB-CZ 3.97Å
957	A	95.7	Very high	94.4	Very high	13 Å²	13	31.4 Å²	31.4	11%	0.107	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-57.7	-35.9	171.1	0	0	0	0	0	112	A954 L955 D959 C1030 F1033	A954-A957 VanDerWaalsContact O-CB 3.32Å; A954-A957 WeakPolarHBondContact O-CB 3.48Å; A954-A957 PolarHBondContact O-N 3.15Å; L955-A957 PolarHBondContact O-N 3.35Å; L955-A957 VanDerWaalsContact O-N 3.14Å; A957-D959 VanDerWaalsContact C-N 3.29Å; A957-D959 PolarHBondContact O-N 2.92Å; A957-C1030 HydrophobicContact CB-CB 4.46Å; A957-F1033 HydrophobicContact CB-CB 3.87Å; A957-F1033 HydrophobicContact CB-CD2 3.89Å; A957-F1033 HydrophobicContact CB-CG 4Å
958	K	94.3	Very high	94.4	Very high	54 Å²	54	31.2 Å²	31.2	24%	0.235	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-74.6	-6.9	175	-60.3	176.7	173.5	-179.3	0	113.9	L955 C956 P960 D1012 D1014	L955-K958 WeakPolarHBondContact O-CB 3.41Å; L955-K958 PolarHBondContact O-N 3.41Å; L955-K958 VanDerWaalsContact O-N 3.09Å; C956-K958 PolarHBondContact O-N 3.08Å; K958-P960 WeakPolarHBondContact O-CD 3.31Å; K958-D1012 IonicContact NZ-OD1 2.64Å; K958-D1012 PolarHBondContact NZ-OD1 3.11Å; K958-D1012 IonicContact NZ-OD2 2.79Å; K958-D1012 PolarHBondContact NZ-OD2 3.17Å; K958-D1014 IonicContact NZ-OD2 2.87Å; K958-D1014 PolarHBondContact NZ-OD2 3.41Å
959	D	94.4	Very high	94.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.171	C	C	.	.			trans	-69.8	118.3	-179.1	-168.5	-40.7	0	0	0	109.9	R929 C956 A957 V961 R964 R965	R929-D959 IonicContact NH1-OD1 3.18Å; R929-D959 PolarHBondContact NH1-OD1 3.19Å; R929-D959 IonicContact NH1-OD2 2.83Å; R929-D959 PolarHBondContact NH1-OD2 2.92Å; C956-D959 VanDerWaalsContact O-CB 3.31Å; C956-D959 WeakPolarHBondContact O-CB 3.21Å; C956-D959 PolarHBondContact O-N 3.34Å; A957-D959 VanDerWaalsContact C-N 3.29Å; A957-D959 PolarHBondContact O-N 2.92Å; D959-V961 PolarHBondContact O-N 2.96Å; D959-V961 WeakPolarHBondContact OD1-CB 3.33Å; D959-V961 PolarHBondContact OD1-N 2.83Å; D959-R964 HydrophobicContact CB-CB 4.29Å; D959-R964 VanDerWaalsContact CG-CB 3.44Å; D959-R964 VanDerWaalsContact OD2-CB 3.28Å; D959-R964 WeakPolarHBondContact OD2-CB 3.5Å; D959-R964 WeakPolarHBondContact OD2-CG 3.48Å; D959-R964 IonicContact OD2-CZ 3Å; D959-R964 IonicContact OD2-NE 2.77Å; D959-R964 PolarHBondContact OD2-NE 3.05Å; D959-R964 IonicContact OD2-NH2 3.94Å; D959-R965 HydrophobicContact CB-CG 4.37Å; D959-R965 VanDerWaalsContact O-CD 3.3Å; D959-R965 WeakPolarHBondContact O-CD 3.16Å; D959-R965 PolarHBondContact O-NE 3.41Å
960	P	92.8	Very high	94.1	Very high	75 Å²	75	36.8 Å²	36.8	49%	0.487	18%	0.183	S	C	.	.	S	Bend	trans	-61.8	-28.6	-176.6	24	-33.9	0	0	0	112.4	K958 R965	K958-P960 WeakPolarHBondContact O-CD 3.31Å; P960-R965 PolarHBondContact O-NH2 2.99Å
961	V	93.5	Very high	93.9	Very high	42 Å²	42	36.9 Å²	36.9	26%	0.255	18%	0.184	S	C	.	.			trans	-76.6	128.1	-177.1	-176.2	0	0	0	0	110	Y926 D959 E963 R964 R965	Y926-V961 HydrophobicContact CD2-CG2 4.01Å; Y926-V961 HydrophobicContact CE2-CB 4.41Å; Y926-V961 HydrophobicContact CE2-CG1 4.23Å; Y926-V961 HydrophobicContact CE2-CG2 4.07Å; D959-V961 PolarHBondContact O-N 2.96Å; D959-V961 WeakPolarHBondContact OD1-CB 3.33Å; D959-V961 PolarHBondContact OD1-N 2.83Å; V961-E963 HydrophobicContact CG1-CB 4.13Å; V961-E963 WeakPolarHBondContact CG1-OE2 3.32Å; V961-R964 HydrophobicContact CB-CB 3.97Å; V961-R964 HydrophobicContact CB-CG 3.68Å; V961-R964 HydrophobicContact CG1-CB 4.3Å; V961-R964 HydrophobicContact CG1-CG 3.86Å; V961-R964 HydrophobicContact CG2-CG 4.46Å; V961-R964 WeakPolarHBondContact O-CB 3.5Å; V961-R964 PolarHBondContact O-N 2.83Å; V961-R965 PolarHBondContact O-N 3.31Å; V961-R965 PolarHBondContact O-NE 3.01Å
962	K	92	Very high	93.7	Very high	154 Å²	154	36.9 Å²	36.9	67%	0.67	18%	0.184	S	C	*	.	H	α-helix	trans	-69.9	-36.9	-175.9	178.6	-172.6	176.6	-169.8	0	111.6	R964 R965 A966	K962-R964 VanDerWaalsContact C-N 3.3Å; K962-R964 PolarHBondContact O-N 3.22Å; K962-R965 WeakPolarHBondContact O-CB 3.44Å; K962-R965 PolarHBondContact O-N 2.99Å; K962-A966 PolarHBondContact O-N 3.31Å
963	E	88.4	Confident	93.4	Very high	121 Å²	121	41.3 Å²	41.3	57%	0.565	21%	0.207	S	C	*	.	H	α-helix	trans	-67.8	-35.2	-178.4	-64.4	56.2	-122.4	0	0	110.1	V961 A966 H967	V961-E963 HydrophobicContact CG1-CB 4.13Å; V961-E963 WeakPolarHBondContact CG1-OE2 3.32Å; E963-A966 PolarHBondContact O-N 3.2Å; E963-H967 VanDerWaalsContact O-CB 3.28Å; E963-H967 WeakPolarHBondContact O-CB 3.31Å; E963-H967 PolarHBondContact O-N 3.39Å
964	R	88.3	Confident	93.1	Very high	5 Å²	5	46.7 Å²	46.7	2%	0.019	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-46.5	172.4	-74.4	-74.5	-57.9	147.3	2	112.3	Y926 R929 A933 D959 V961 K962 H967 A968	Y926-R964 HydrophobicContact CD2-CG 4.35Å; Y926-R964 HydrophobicContact CE2-CG 3.59Å; R929-R964 PolarHBondContact O-NH1 3.25Å; R929-R964 PolarHBondContact O-NH2 3.15Å; A933-R964 VanDerWaalsContact CB-NH1 3.29Å; D959-R964 HydrophobicContact CB-CB 4.29Å; D959-R964 VanDerWaalsContact CG-CB 3.44Å; D959-R964 VanDerWaalsContact OD2-CB 3.28Å; D959-R964 WeakPolarHBondContact OD2-CB 3.5Å; D959-R964 WeakPolarHBondContact OD2-CG 3.48Å; D959-R964 IonicContact OD2-CZ 3Å; D959-R964 IonicContact OD2-NE 2.77Å; D959-R964 PolarHBondContact OD2-NE 3.05Å; D959-R964 IonicContact OD2-NH2 3.94Å; V961-R964 HydrophobicContact CB-CB 3.97Å; V961-R964 HydrophobicContact CB-CG 3.68Å; V961-R964 HydrophobicContact CG1-CB 4.3Å; V961-R964 HydrophobicContact CG1-CG 3.86Å; V961-R964 HydrophobicContact CG2-CG 4.46Å; V961-R964 WeakPolarHBondContact O-CB 3.5Å; V961-R964 PolarHBondContact O-N 2.83Å; K962-R964 VanDerWaalsContact C-N 3.3Å; K962-R964 PolarHBondContact O-N 3.22Å; R964-H967 PolarHBondContact O-N 3.39Å; R964-A968 WeakPolarHBondContact O-CB 3.29Å; R964-A968 PolarHBondContact O-N 3.4Å
965	R	94.9	Very high	93	Very high	91 Å²	91	46.7 Å²	46.7	34%	0.343	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-43.2	174.1	-78.8	179.1	-77.9	174.7	-7.9	111.9	C956 D959 P960 V961 K962 R969 F1033	C956-R965 WeakPolarHBondContact O-CG 3.45Å; D959-R965 HydrophobicContact CB-CG 4.37Å; D959-R965 VanDerWaalsContact O-CD 3.3Å; D959-R965 WeakPolarHBondContact O-CD 3.16Å; D959-R965 PolarHBondContact O-NE 3.41Å; P960-R965 PolarHBondContact O-NH2 2.99Å; V961-R965 PolarHBondContact O-N 3.31Å; V961-R965 PolarHBondContact O-NE 3.01Å; K962-R965 WeakPolarHBondContact O-CB 3.44Å; K962-R965 PolarHBondContact O-N 2.99Å; R965-R969 WeakPolarHBondContact O-CG 3.47Å; R965-R969 PolarHBondContact O-N 3.01Å; R965-R969 VanDerWaalsContact O-N 3.12Å; R965-F1033 HydrophobicContact CB-CE2 3.97Å; R965-F1033 HydrophobicContact CB-CZ 4.4Å; R965-F1033 HydrophobicContact CG-CE2 3.96Å; R965-F1033 HydrophobicContact CG-CZ 4.49Å; R965-F1033 WeakPolarHBondContact O-CZ 3.12Å
966	A	91.9	Very high	92.7	Very high	60 Å²	60	47.2 Å²	47.2	50%	0.496	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-46.3	174.2	0	0	0	0	0	112.5	K962 E963 R969 Q970	K962-A966 PolarHBondContact O-N 3.31Å; E963-A966 PolarHBondContact O-N 3.2Å; A966-R969 PolarHBondContact O-N 3.47Å; A966-Q970 PolarHBondContact O-N 2.99Å
967	H	89.7	Confident	92.4	Very high	31 Å²	31	50.5 Å²	50.5	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-47.3	176.8	176.6	-78	0	0	0	112	E963 R964 R969 Q970 C971	E963-H967 VanDerWaalsContact O-CB 3.28Å; E963-H967 WeakPolarHBondContact O-CB 3.31Å; E963-H967 PolarHBondContact O-N 3.39Å; R964-H967 PolarHBondContact O-N 3.39Å; H967-R969 PolarHBondContact O-N 3.45Å; H967-Q970 PolarHBondContact O-N 2.95Å; H967-Q970 VanDerWaalsContact O-N 3.17Å; H967-C971 PolarHBondContact CE1-SG 3.25Å; H967-C971 PolarHBondContact O-N 3.04Å; H967-C971 PolarHBondContact O-SG 3.25Å
968	A	93.6	Very high	92.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.2	-40.2	178.5	0	0	0	0	0	112.5	F953 C956 R964 Q970 C971 L972 F1033	F953-A968 HydrophobicContact CD1-CB 3.88Å; F953-A968 HydrophobicContact CE1-CB 4.38Å; C956-A968 HydrophobicContact CB-CB 3.72Å; R964-A968 WeakPolarHBondContact O-CB 3.29Å; R964-A968 PolarHBondContact O-N 3.4Å; A968-Q970 PolarHBondContact O-N 3.26Å; A968-C971 WeakPolarHBondContact O-CB 3.35Å; A968-C971 PolarHBondContact O-N 3.43Å; A968-L972 PolarHBondContact O-N 3.29Å; A968-F1033 HydrophobicContact CB-CE1 4.02Å; A968-F1033 HydrophobicContact CB-CZ 3.91Å
969	R	93.6	Very high	91.9	Very high	69 Å²	69	49.5 Å²	49.5	26%	0.26	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-41	172	-78.7	165.2	167.3	-108.2	-6.1	112.5	R965 A966 H967 L972 L973 F1033 E1036	R965-R969 WeakPolarHBondContact O-CG 3.47Å; R965-R969 PolarHBondContact O-N 3.01Å; R965-R969 VanDerWaalsContact O-N 3.12Å; A966-R969 PolarHBondContact O-N 3.47Å; H967-R969 PolarHBondContact O-N 3.45Å; R969-L972 PolarHBondContact O-N 2.95Å; R969-L973 WeakPolarHBondContact O-CG 3.49Å; R969-L973 PolarHBondContact O-N 3.02Å; R969-F1033 HydrophobicContact CG-CD1 4.49Å; R969-F1033 HydrophobicContact CG-CD2 4.47Å; R969-F1033 HydrophobicContact CG-CE1 3.94Å; R969-F1033 HydrophobicContact CG-CE2 3.92Å; R969-F1033 HydrophobicContact CG-CZ 3.64Å; R969-E1036 IonicContact CZ-OE1 2.66Å; R969-E1036 IonicContact CZ-OE2 2.86Å; R969-E1036 IonicContact NH1-OE1 3.46Å; R969-E1036 PolarHBondContact NH1-OE1 3.2Å; R969-E1036 IonicContact NH1-OE2 2.86Å; R969-E1036 PolarHBondContact NH1-OE2 3.31Å; R969-E1036 IonicContact NH2-OE1 3.45Å; R969-E1036 IonicContact NH2-OE2 3.53Å; R969-E1036 PolarHBondContact NH2-OE2 3.32Å
970	Q	91.3	Very high	91.6	Very high	54 Å²	54	51.6 Å²	51.6	25%	0.252	26%	0.259	S	S	.	.	H	α-helix	trans	-65.3	-40.6	173.2	178.9	160.6	43.7	0	0	112.5	A966 H967 A968 L972 L973 K974 I1205	A966-Q970 PolarHBondContact O-N 2.99Å; H967-Q970 PolarHBondContact O-N 2.95Å; H967-Q970 VanDerWaalsContact O-N 3.17Å; A968-Q970 PolarHBondContact O-N 3.26Å; Q970-L972 VanDerWaalsContact C-N 3.28Å; Q970-L972 PolarHBondContact O-N 3.34Å; Q970-L973 PolarHBondContact O-N 3.03Å; Q970-K974 WeakPolarHBondContact O-CB 3.25Å; Q970-K974 PolarHBondContact O-N 3.29Å; Q970-I1205 PolarHBondContact NE2-O 2.91Å
971	C	93.2	Very high	91.2	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-36.2	175.1	-69.9	0	0	0	0	112.5	H937 F953 H967 A968 N975	H937-C971 HydrophobicContact CB-CB 4.17Å; H937-C971 WeakPolarHBondContact ND1-CB 3.39Å; F953-C971 HydrophobicContact CE1-CB 3.96Å; F953-C971 HydrophobicContact CE2-CB 4.21Å; F953-C971 HydrophobicContact CZ-CB 3.68Å; H967-C971 PolarHBondContact CE1-SG 3.25Å; H967-C971 PolarHBondContact O-N 3.04Å; H967-C971 PolarHBondContact O-SG 3.25Å; A968-C971 WeakPolarHBondContact O-CB 3.35Å; A968-C971 PolarHBondContact O-N 3.43Å; C971-N975 WeakPolarHBondContact O-CB 3.33Å; C971-N975 PolarHBondContact O-N 3.18Å; C971-N975 PolarHBondContact O-ND2 3.27Å
972	L	93.9	Very high	90.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-54.4	173	-76.1	171.3	0	0	0	111.9	M950 F953 A968 R969 Q970 K974 N975 I976 F1033 M1034 V1037	M950-L972 HydrophobicContact CG-CD2 3.79Å; M950-L972 HydrophobicContact SD-CD2 4.32Å; F953-L972 HydrophobicContact CB-CD1 3.9Å; F953-L972 HydrophobicContact CB-CD2 3.87Å; F953-L972 HydrophobicContact CB-CG 3.88Å; F953-L972 HydrophobicContact CD2-CD2 3.88Å; F953-L972 HydrophobicContact CD2-CG 4.2Å; F953-L972 HydrophobicContact CG-CD2 4.2Å; F953-L972 HydrophobicContact CG-CG 4.17Å; A968-L972 PolarHBondContact O-N 3.29Å; R969-L972 PolarHBondContact O-N 2.95Å; Q970-L972 VanDerWaalsContact C-N 3.28Å; Q970-L972 PolarHBondContact O-N 3.34Å; L972-K974 PolarHBondContact O-N 2.88Å; L972-N975 PolarHBondContact O-N 3.15Å; L972-I976 HydrophobicContact CB-CD1 4.44Å; L972-I976 WeakPolarHBondContact O-CG1 3.49Å; L972-I976 PolarHBondContact O-N 3.07Å; L972-F1033 HydrophobicContact CD1-CD1 4.31Å; L972-F1033 HydrophobicContact CD1-CE1 4.26Å; L972-M1034 HydrophobicContact CD1-CE 4.2Å; L972-M1034 HydrophobicContact CD1-CG 4.48Å; L972-M1034 HydrophobicContact CD2-CE 3.94Å; L972-V1037 HydrophobicContact CB-CG1 4.11Å; L972-V1037 HydrophobicContact CB-CG2 4.45Å; L972-V1037 HydrophobicContact CD1-CG2 4.45Å
973	L	92.3	Very high	90.4	Very high	93 Å²	93	48 Å²	48	49%	0.487	23%	0.233	S	C	.	.	H	α-helix	trans	-49.2	-46.3	177.9	-80.9	166.8	0	0	0	111.9	R969 Q970 S977 V1037	R969-L973 WeakPolarHBondContact O-CG 3.49Å; R969-L973 PolarHBondContact O-N 3.02Å; Q970-L973 PolarHBondContact O-N 3.03Å; L973-S977 VanDerWaalsContact O-CB 3.23Å; L973-S977 WeakPolarHBondContact O-CB 3.48Å; L973-S977 PolarHBondContact O-N 3.03Å; L973-V1037 HydrophobicContact CB-CG1 4.36Å; L973-V1037 HydrophobicContact CD2-CG1 3.57Å; L973-V1037 HydrophobicContact CG-CG1 3.63Å
974	K	90.9	Very high	90	Very high	114 Å²	114	50.1 Å²	50.1	50%	0.496	24%	0.24	S	C	.	.	H	α-helix	trans	-70.5	-37.9	-179.4	-170.3	58.3	167.5	177.1	0	112.7	Q970 L972 I978	Q970-K974 WeakPolarHBondContact O-CB 3.25Å; Q970-K974 PolarHBondContact O-N 3.29Å; L972-K974 PolarHBondContact O-N 2.88Å; K974-I978 HydrophobicContact CD-CD1 4.19Å; K974-I978 HydrophobicContact CD-CG1 4.42Å; K974-I978 HydrophobicContact CG-CD1 4.08Å; K974-I978 VanDerWaalsContact O-CG1 3.29Å; K974-I978 WeakPolarHBondContact O-CG1 3.29Å; K974-I978 PolarHBondContact O-N 3.43Å
975	N	93.9	Very high	89.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68	-39.9	177.1	-91.9	-56.6	0	0	0	113.3	H937 L940 V941 M950 C971 L972 R979	H937-N975 PolarHBondContact ND1-ND2 3.3Å; L940-N975 VanDerWaalsContact CB-OD1 3.22Å; L940-N975 WeakPolarHBondContact CB-OD1 3.45Å; L940-N975 PolarHBondContact O-OD1 3.19Å; V941-N975 WeakPolarHBondContact CA-OD1 3.43Å; V941-N975 PolarHBondContact N-OD1 3.46Å; V941-N975 VanDerWaalsContact N-OD1 3.11Å; M950-N975 HydrophobicContact SD-CB 3.93Å; C971-N975 WeakPolarHBondContact O-CB 3.33Å; C971-N975 PolarHBondContact O-N 3.18Å; C971-N975 PolarHBondContact O-ND2 3.27Å; L972-N975 PolarHBondContact O-N 3.15Å; N975-R979 WeakPolarHBondContact O-CB 3.32Å; N975-R979 WeakPolarHBondContact O-CG 3.35Å; N975-R979 PolarHBondContact O-N 3.3Å; N975-R979 PolarHBondContact O-NH1 2.9Å; N975-R979 PolarHBondContact OD1-NH1 3.26Å
976	I	92.3	Very high	88.5	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.062	26%	0.261	C	S	.	.	H	α-helix	trans	-66.3	-48.1	175.5	-67.7	159.9	0	0	0	109.6	L972 I978 R979 R980 P998 V1037 L1038	L972-I976 HydrophobicContact CB-CD1 4.44Å; L972-I976 WeakPolarHBondContact O-CG1 3.49Å; L972-I976 PolarHBondContact O-N 3.07Å; I976-I978 PolarHBondContact O-N 2.82Å; I976-R979 PolarHBondContact O-N 3.48Å; I976-R980 PolarHBondContact O-N 3.15Å; I976-P998 HydrophobicContact CB-CB 4.48Å; I976-P998 HydrophobicContact CB-CG 4.43Å; I976-P998 HydrophobicContact CG1-CB 4.03Å; I976-P998 HydrophobicContact CG1-CG 4.47Å; I976-P998 HydrophobicContact CG2-CB 4.25Å; I976-P998 HydrophobicContact CG2-CG 4.13Å; I976-V1037 HydrophobicContact CD1-CB 4.18Å; I976-V1037 HydrophobicContact CD1-CG1 3.61Å; I976-L1038 HydrophobicContact CD1-CD2 3.76Å; I976-L1038 HydrophobicContact CD1-CG 4.21Å; I976-L1038 HydrophobicContact CG1-CD2 4.08Å
977	S	90.2	Very high	87.3	Confident	69 Å²	69	55.4 Å²	55.4	48%	0.483	27%	0.27	S	S	.	.	H	α-helix	trans	-58.3	-45.4	178.3	170.6	0	0	0	0	113.1	L973 E981	L973-S977 VanDerWaalsContact O-CB 3.23Å; L973-S977 WeakPolarHBondContact O-CB 3.48Å; L973-S977 PolarHBondContact O-N 3.03Å; S977-E981 WeakPolarHBondContact O-CB 3.47Å; S977-E981 PolarHBondContact O-N 3.36Å; S977-E981 VanDerWaalsContact O-N 3.08Å
978	I	89.1	Confident	85.8	Confident	44 Å²	44	62.5 Å²	62.5	23%	0.226	31%	0.305	C	S	.	.	H	α-helix	trans	-64.6	-43.2	178.3	-71.6	170.9	0	0	0	111.1	V941 L943 K974 I976 Y982	V941-I978 HydrophobicContact CB-CD1 4.46Å; V941-I978 HydrophobicContact CG1-CD1 3.85Å; V941-I978 HydrophobicContact CG2-CD1 4.25Å; L943-I978 HydrophobicContact CD2-CG2 4.36Å; K974-I978 HydrophobicContact CD-CD1 4.19Å; K974-I978 HydrophobicContact CD-CG1 4.42Å; K974-I978 HydrophobicContact CG-CD1 4.08Å; K974-I978 VanDerWaalsContact O-CG1 3.29Å; K974-I978 WeakPolarHBondContact O-CG1 3.29Å; K974-I978 PolarHBondContact O-N 3.43Å; I976-I978 PolarHBondContact O-N 2.82Å; I978-Y982 VanDerWaalsContact O-CB 3.3Å; I978-Y982 WeakPolarHBondContact O-CB 3.24Å; I978-Y982 PolarHBondContact O-N 3.36Å
979	R	90.4	Very high	84.2	Confident	3 Å²	3	64.2 Å²	64.2	1%	0.011	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-49.5	178.2	-82.4	167.7	178.5	70.5	4.8	112.3	L940 L943 N975 I976 E981 Y982 I983 L996 P998	L940-R979 PolarHBondContact O-NH1 3.02Å; L940-R979 PolarHBondContact O-NH2 3.17Å; L943-R979 HydrophobicContact CD2-CG 3.67Å; N975-R979 WeakPolarHBondContact O-CB 3.32Å; N975-R979 WeakPolarHBondContact O-CG 3.35Å; N975-R979 PolarHBondContact O-N 3.3Å; N975-R979 PolarHBondContact O-NH1 2.9Å; N975-R979 PolarHBondContact OD1-NH1 3.26Å; I976-R979 PolarHBondContact O-N 3.48Å; R979-E981 PolarHBondContact O-N 2.97Å; R979-Y982 PolarHBondContact O-N 3.29Å; R979-I983 VanDerWaalsContact O-CG1 3.29Å; R979-I983 WeakPolarHBondContact O-CG1 3.49Å; R979-I983 PolarHBondContact O-N 3.47Å; R979-L996 VanDerWaalsContact CB-O 3.32Å; R979-L996 WeakPolarHBondContact CB-O 3.46Å; R979-L996 VanDerWaalsContact CD-O 3.29Å; R979-L996 WeakPolarHBondContact CD-O 3.43Å; R979-L996 WeakPolarHBondContact CG-O 3.5Å; R979-P998 HydrophobicContact CB-CG 3.78Å
980	R	87.6	Confident	82.5	Confident	44 Å²	44	65.1 Å²	65.1	17%	0.166	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-39.6	179.7	-65.9	-164.9	-174.4	166.2	5.5	112.2	I976 K984 P998 E999 L1038 K1041 E1043	I976-R980 PolarHBondContact O-N 3.15Å; R980-K984 WeakPolarHBondContact O-CB 3.47Å; R980-K984 PolarHBondContact O-N 3Å; R980-P998 HydrophobicContact CG-CG 4.08Å; R980-E999 IonicContact CZ-OE1 2.68Å; R980-E999 IonicContact NE-OE1 2.85Å; R980-E999 PolarHBondContact NE-OE1 3.2Å; R980-E999 IonicContact NH2-OE1 2.75Å; R980-E999 PolarHBondContact NH2-OE1 3.29Å; R980-L1038 PolarHBondContact NH2-O 2.86Å; R980-L1038 VanDerWaalsContact NH2-O 3.15Å; R980-K1041 PolarHBondContact NH1-O 3.41Å; R980-K1041 VanDerWaalsContact NH1-O 3.17Å; R980-E1043 WeakPolarHBondContact CD-OE2 3.43Å; R980-E1043 IonicContact CZ-OE2 3.83Å; R980-E1043 IonicContact NE-OE2 3.77Å; R980-E1043 IonicContact NH1-OE2 2.9Å; R980-E1043 PolarHBondContact NH1-OE2 3.32Å
981	E	83.4	Confident	80.8	Confident	69 Å²	69	71.4 Å²	71.4	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-70	-36.8	175	-179.8	60.6	-162.8	0	0	112.5	K544 S977 R979 K984 Q985	K544-E981 IonicContact NZ-OE1 2.69Å; K544-E981 PolarHBondContact NZ-OE1 2.95Å; S977-E981 WeakPolarHBondContact O-CB 3.47Å; S977-E981 PolarHBondContact O-N 3.36Å; S977-E981 VanDerWaalsContact O-N 3.08Å; R979-E981 PolarHBondContact O-N 2.97Å; E981-K984 PolarHBondContact O-N 3.41Å; E981-Q985 VanDerWaalsContact O-CG 3.31Å; E981-Q985 WeakPolarHBondContact O-CG 3.41Å; E981-Q985 PolarHBondContact O-N 3.33Å; E981-Q985 PolarHBondContact OE1-NE2 3.5Å
982	Y	84.5	Confident	79.6	Confident	89 Å²	89	77.7 Å²	77.7	35%	0.349	39%	0.389	S	S	.	.	H	α-helix	trans	-63.6	-45	174.2	-178.9	-89	0	0	0	111.9	L943 I978 R979 K984 Q985 N986 L996	L943-Y982 HydrophobicContact CD1-CD1 4.26Å; L943-Y982 HydrophobicContact CD1-CD2 4.02Å; L943-Y982 HydrophobicContact CD1-CE2 4.47Å; L943-Y982 HydrophobicContact CD1-CG 3.91Å; I978-Y982 VanDerWaalsContact O-CB 3.3Å; I978-Y982 WeakPolarHBondContact O-CB 3.24Å; I978-Y982 PolarHBondContact O-N 3.36Å; R979-Y982 PolarHBondContact O-N 3.29Å; Y982-K984 VanDerWaalsContact C-N 3.33Å; Y982-K984 PolarHBondContact O-N 3.24Å; Y982-Q985 PolarHBondContact O-N 3.35Å; Y982-Q985 VanDerWaalsContact O-N 3.16Å; Y982-N986 HydrophobicContact CE1-CB 4.26Å; Y982-N986 WeakPolarHBondContact O-CB 3.38Å; Y982-N986 PolarHBondContact O-N 3.08Å; Y982-N986 PolarHBondContact O-ND2 3.08Å; Y982-L996 HydrophobicContact CD1-CD1 3.85Å; Y982-L996 HydrophobicContact CE1-CD1 3.65Å
983	I	84.1	Confident	78.7	Confident	39 Å²	39	79.9 Å²	79.9	20%	0.2	40%	0.401	C	S	.	.	H	α-helix	trans	-59.8	-45.1	175.2	-68.3	163.3	0	0	0	110.3	R979 Q985 N986 L993 L996 L997	R979-I983 VanDerWaalsContact O-CG1 3.29Å; R979-I983 WeakPolarHBondContact O-CG1 3.49Å; R979-I983 PolarHBondContact O-N 3.47Å; I983-Q985 PolarHBondContact O-N 3.17Å; I983-N986 CarbonylContact O-C 3.5Å; I983-N986 PolarHBondContact O-N 2.94Å; I983-N986 VanDerWaalsContact O-N 3.11Å; I983-L993 HydrophobicContact CD1-CD1 4.16Å; I983-L993 HydrophobicContact CG1-CD1 4.3Å; I983-L993 HydrophobicContact CG2-CD1 3.85Å; I983-L996 HydrophobicContact CD1-CB 4.07Å; I983-L996 HydrophobicContact CG1-CB 4.14Å; I983-L997 HydrophobicContact CD1-CB 4.07Å
984	K	81.3	Confident	78.1	Confident	165 Å²	165	79.3 Å²	79.3	72%	0.717	40%	0.398	S	S	*	.	H	α-helix	trans	-60.9	-30.2	176.7	-173.2	178.7	179	-176.9	0	113.4	R980 E981 Y982	R980-K984 WeakPolarHBondContact O-CB 3.47Å; R980-K984 PolarHBondContact O-N 3Å; E981-K984 PolarHBondContact O-N 3.41Å; Y982-K984 VanDerWaalsContact C-N 3.33Å; Y982-K984 PolarHBondContact O-N 3.24Å
985	Q	74.1	Confident	77.8	Confident	101 Å²	101	77.2 Å²	77.2	47%	0.472	40%	0.397	S	S	.	.	H	α-helix	trans	-83.9	-21	175.9	-70.8	177.5	19.3	0	0	113.8	E981 Y982 I983 P987	E981-Q985 VanDerWaalsContact O-CG 3.31Å; E981-Q985 WeakPolarHBondContact O-CG 3.41Å; E981-Q985 PolarHBondContact O-N 3.33Å; E981-Q985 PolarHBondContact OE1-NE2 3.5Å; Y982-Q985 PolarHBondContact O-N 3.35Å; Y982-Q985 VanDerWaalsContact O-N 3.16Å; I983-Q985 PolarHBondContact O-N 3.17Å; Q985-P987 VanDerWaalsContact C-CD 3.45Å; Q985-P987 WeakPolarHBondContact O-CD 3.21Å
986	N	77	Confident	77.4	Confident	61 Å²	61	78.1 Å²	78.1	33%	0.326	40%	0.402	S	S	.	.			trans	-128.3	59.1	-171.9	-61	-91.9	0	0	0	111.8	Y982 I983 M988 A989	Y982-N986 HydrophobicContact CE1-CB 4.26Å; Y982-N986 WeakPolarHBondContact O-CB 3.38Å; Y982-N986 PolarHBondContact O-N 3.08Å; Y982-N986 PolarHBondContact O-ND2 3.08Å; I983-N986 CarbonylContact O-C 3.5Å; I983-N986 PolarHBondContact O-N 2.94Å; I983-N986 VanDerWaalsContact O-N 3.11Å; N986-M988 PolarHBondContact O-N 3.48Å; N986-M988 VanDerWaalsContact O-N 3.11Å; N986-A989 HydrophobicContact CB-CB 4.36Å; N986-A989 WeakPolarHBondContact O-CB 3.37Å; N986-A989 PolarHBondContact O-N 3.02Å; N986-A989 VanDerWaalsContact O-N 3.12Å
987	P	66.7	Low	77.3	Confident	104 Å²	104	79.2 Å²	79.2	68%	0.675	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-21	-170.2	25.8	-35.8	0	0	0	114.7	Q985 A989	Q985-P987 VanDerWaalsContact C-CD 3.45Å; Q985-P987 WeakPolarHBondContact O-CD 3.21Å; P987-A989 VanDerWaalsContact C-N 3.32Å
988	M	59.1	Low	77.4	Confident	180 Å²	180	76 Å²	76	89%	0.887	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-1.4	179	-55.2	-168.4	83.9	0	0	113.9	N986 T990	N986-M988 PolarHBondContact O-N 3.48Å; N986-M988 VanDerWaalsContact O-N 3.11Å; M988-T990 PolarHBondContact O-N 2.89Å
989	A	59.9	Low	77.6	Confident	36 Å²	36	74.2 Å²	74.2	30%	0.298	38%	0.376	S	S	.	.			trans	-78.4	41.1	-178.4	0	0	0	0	0	113.5	N986 P987 E991 K992 L993	N986-A989 HydrophobicContact CB-CB 4.36Å; N986-A989 WeakPolarHBondContact O-CB 3.37Å; N986-A989 PolarHBondContact O-N 3.02Å; N986-A989 VanDerWaalsContact O-N 3.12Å; P987-A989 VanDerWaalsContact C-N 3.32Å; A989-E991 PolarHBondContact O-N 3.14Å; A989-K992 CarbonylContact O-C 3.54Å; A989-K992 PolarHBondContact O-N 2.8Å; A989-L993 PolarHBondContact O-N 2.99Å
990	T	57.9	Low	77.8	Confident	88 Å²	88	74.6 Å²	74.6	54%	0.54	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-58	-40	-165.3	-42.8	0	0	0	0	113.8	M988 K992 L993	M988-T990 PolarHBondContact O-N 2.89Å; T990-K992 VanDerWaalsContact C-N 3.31Å; T990-K992 PolarHBondContact O-N 3.34Å; T990-L993 WeakPolarHBondContact O-CB 3.29Å; T990-L993 PolarHBondContact O-N 3.28Å
991	E	56	Low	78.1	Confident	187 Å²	187	72.5 Å²	72.5	87%	0.874	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-64.2	-34.3	176.3	-61.9	-177.3	135.3	0	0	112.7	A989 L993	A989-E991 PolarHBondContact O-N 3.14Å; E991-L993 VanDerWaalsContact C-N 3.31Å
992	K	67.3	Low	78.8	Confident	133 Å²	133	69.2 Å²	69.2	58%	0.578	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-86.2	-0.8	178.7	-64.1	-175.3	179.9	178.3	0	113	A989 T990 L994 S995 L996	A989-K992 CarbonylContact O-C 3.54Å; A989-K992 PolarHBondContact O-N 2.8Å; T990-K992 VanDerWaalsContact C-N 3.31Å; T990-K992 PolarHBondContact O-N 3.34Å; K992-L994 VanDerWaalsContact C-N 3.28Å; K992-L994 PolarHBondContact O-N 3.03Å; K992-S995 PolarHBondContact O-N 3.47Å; K992-S995 PolarHBondContact O-OG 3.4Å; K992-L996 HydrophobicContact CB-CD1 4.03Å; K992-L996 WeakPolarHBondContact O-CB 3.32Å; K992-L996 WeakPolarHBondContact O-CD1 3.35Å; K992-L996 VanDerWaalsContact O-CG 3.32Å; K992-L996 WeakPolarHBondContact O-CG 3.41Å; K992-L996 PolarHBondContact O-N 2.62Å
993	L	74.1	Confident	79.3	Confident	47 Å²	47	65 Å²	65	25%	0.246	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-39	-179.3	-171.8	63.5	0	0	0	111.5	I983 A989 T990 E991 S995 L996 L997	I983-L993 HydrophobicContact CD1-CD1 4.16Å; I983-L993 HydrophobicContact CG1-CD1 4.3Å; I983-L993 HydrophobicContact CG2-CD1 3.85Å; A989-L993 PolarHBondContact O-N 2.99Å; T990-L993 WeakPolarHBondContact O-CB 3.29Å; T990-L993 PolarHBondContact O-N 3.28Å; E991-L993 VanDerWaalsContact C-N 3.31Å; L993-S995 PolarHBondContact O-N 2.94Å; L993-L996 PolarHBondContact O-N 2.98Å; L993-L997 HydrophobicContact CD1-CB 4.27Å; L993-L997 HydrophobicContact CD1-CD1 3.89Å; L993-L997 HydrophobicContact CG-CB 4.44Å; L993-L997 HydrophobicContact CG-CD1 4.2Å; L993-L997 WeakPolarHBondContact O-CB 3.26Å; L993-L997 PolarHBondContact O-N 2.93Å
994	L	80.6	Confident	80	Confident	81 Å²	81	65 Å²	65	42%	0.424	34%	0.335	S	S	.	.	H	α-helix	trans	-62.5	-37.9	179.9	-56.6	-179.8	0	0	0	113.1	K992 Y1000	K992-L994 VanDerWaalsContact C-N 3.28Å; K992-L994 PolarHBondContact O-N 3.03Å; L994-Y1000 HydrophobicContact CD2-CD2 4.46Å; L994-Y1000 HydrophobicContact CD2-CE1 4.44Å; L994-Y1000 HydrophobicContact CD2-CE2 3.53Å; L994-Y1000 VanDerWaalsContact CD2-OH 3.32Å; L994-Y1000 WeakPolarHBondContact CD2-OH 3.35Å
995	S	83.3	Confident	80.7	Confident	70 Å²	70	57.1 Å²	57.1	49%	0.49	30%	0.301	S	S	.	.	H	α-helix	trans	-87.4	-6.3	-178.5	55.8	0	0	0	0	114	L947 K992 L993	L947-S995 WeakPolarHBondContact CG-O 3.41Å; K992-S995 PolarHBondContact O-N 3.47Å; K992-S995 PolarHBondContact O-OG 3.4Å; L993-S995 PolarHBondContact O-N 2.94Å
996	L	87	Confident	81.9	Confident	19 Å²	19	52.3 Å²	52.3	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-113.3	-31.5	-178.6	-67.9	172.1	0	0	0	113.6	L943 R979 Y982 I983 K992 L993 P998	L943-L996 HydrophobicContact CB-CD2 4.49Å; L943-L996 HydrophobicContact CD1-CD2 4.16Å; L943-L996 HydrophobicContact CD2-CD2 4.31Å; R979-L996 VanDerWaalsContact CB-O 3.32Å; R979-L996 WeakPolarHBondContact CB-O 3.46Å; R979-L996 VanDerWaalsContact CD-O 3.29Å; R979-L996 WeakPolarHBondContact CD-O 3.43Å; R979-L996 WeakPolarHBondContact CG-O 3.5Å; Y982-L996 HydrophobicContact CD1-CD1 3.85Å; Y982-L996 HydrophobicContact CE1-CD1 3.65Å; I983-L996 HydrophobicContact CD1-CB 4.07Å; I983-L996 HydrophobicContact CG1-CB 4.14Å; K992-L996 HydrophobicContact CB-CD1 4.03Å; K992-L996 WeakPolarHBondContact O-CB 3.32Å; K992-L996 WeakPolarHBondContact O-CD1 3.35Å; K992-L996 VanDerWaalsContact O-CG 3.32Å; K992-L996 WeakPolarHBondContact O-CG 3.41Å; K992-L996 PolarHBondContact O-N 2.62Å; L993-L996 PolarHBondContact O-N 2.98Å; L996-P998 WeakPolarHBondContact O-CD 3.35Å
997	L	90	Very high	82.8	Confident	35 Å²	35	49.4 Å²	49.4	18%	0.183	26%	0.263	C	S	.	.			trans	-74.4	114.6	-172.3	-174.2	134.9	0	0	0	110.7	L947 I983 L993 E999 Y1000 F1049	L947-L997 WeakPolarHBondContact CD1-O 3.4Å; I983-L997 HydrophobicContact CD1-CB 4.07Å; L993-L997 HydrophobicContact CD1-CB 4.27Å; L993-L997 HydrophobicContact CD1-CD1 3.89Å; L993-L997 HydrophobicContact CG-CB 4.44Å; L993-L997 HydrophobicContact CG-CD1 4.2Å; L993-L997 WeakPolarHBondContact O-CB 3.26Å; L993-L997 PolarHBondContact O-N 2.93Å; L997-E999 HydrophobicContact CD2-CB 3.87Å; L997-E999 HydrophobicContact CD2-CG 4.37Å; L997-E999 VanDerWaalsContact CD2-OE2 3.24Å; L997-E999 WeakPolarHBondContact CD2-OE2 3.42Å; L997-E999 WeakPolarHBondContact CG-OE2 3.49Å; L997-E999 PolarHBondContact O-N 3.24Å; L997-Y1000 HydrophobicContact CB-CD2 4.42Å; L997-Y1000 HydrophobicContact CD2-CD2 3.95Å; L997-Y1000 HydrophobicContact CD2-CE2 4.32Å; L997-Y1000 PolarHBondContact O-N 3.05Å; L997-Y1000 VanDerWaalsContact O-N 3.17Å; L997-F1049 HydrophobicContact CD2-CD1 4.02Å; L997-F1049 HydrophobicContact CD2-CE1 3.55Å
998	P	93	Very high	84.3	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-59.1	-28.1	-163	-29	36.7	0	0	0	116.3	M950 I976 R979 R980 L996 Y1000 V1001 L1038	M950-P998 HydrophobicContact CE-CB 4.37Å; I976-P998 HydrophobicContact CB-CB 4.48Å; I976-P998 HydrophobicContact CB-CG 4.43Å; I976-P998 HydrophobicContact CG1-CB 4.03Å; I976-P998 HydrophobicContact CG1-CG 4.47Å; I976-P998 HydrophobicContact CG2-CB 4.25Å; I976-P998 HydrophobicContact CG2-CG 4.13Å; R979-P998 HydrophobicContact CB-CG 3.78Å; R980-P998 HydrophobicContact CG-CG 4.08Å; L996-P998 WeakPolarHBondContact O-CD 3.35Å; P998-Y1000 PolarHBondContact O-N 3.49Å; P998-V1001 WeakPolarHBondContact O-CB 3.34Å; P998-V1001 WeakPolarHBondContact O-CG1 3.36Å; P998-V1001 PolarHBondContact O-N 3.15Å; P998-L1038 HydrophobicContact CB-CD2 3.87Å
999	E	92.8	Very high	86.2	Confident	6 Å²	6	36.2 Å²	36.2	3%	0.028	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-61.2	-27.6	-177.8	-66	60.5	-140.5	0	0	111.8	R980 L997 V1001 V1002 F1049 M1050	R980-E999 IonicContact CZ-OE1 2.68Å; R980-E999 IonicContact NE-OE1 2.85Å; R980-E999 PolarHBondContact NE-OE1 3.2Å; R980-E999 IonicContact NH2-OE1 2.75Å; R980-E999 PolarHBondContact NH2-OE1 3.29Å; L997-E999 HydrophobicContact CD2-CB 3.87Å; L997-E999 HydrophobicContact CD2-CG 4.37Å; L997-E999 VanDerWaalsContact CD2-OE2 3.24Å; L997-E999 WeakPolarHBondContact CD2-OE2 3.42Å; L997-E999 WeakPolarHBondContact CG-OE2 3.49Å; L997-E999 PolarHBondContact O-N 3.24Å; E999-V1001 PolarHBondContact O-N 3.47Å; E999-V1002 WeakPolarHBondContact O-CB 3.43Å; E999-V1002 WeakPolarHBondContact O-CG2 3.37Å; E999-V1002 PolarHBondContact O-N 2.81Å; E999-F1049 HydrophobicContact CB-CD1 4.05Å; E999-M1050 HydrophobicContact CB-CG 3.77Å; E999-M1050 HydrophobicContact CB-SD 4.37Å; E999-M1050 HydrophobicContact CG-CE 4.44Å; E999-M1050 HydrophobicContact CG-CG 3.82Å; E999-M1050 HydrophobicContact CG-SD 4.06Å
1000	Y	93.6	Very high	87.9	Confident	12 Å²	12	34.5 Å²	34.5	5%	0.047	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-64.8	-2.7	172.8	-87.1	-73.1	0	0	0	114.6	L994 L997 P998 V1002 Y1004 F1049 M1053 P1101 V1102	L994-Y1000 HydrophobicContact CD2-CD2 4.46Å; L994-Y1000 HydrophobicContact CD2-CE1 4.44Å; L994-Y1000 HydrophobicContact CD2-CE2 3.53Å; L994-Y1000 VanDerWaalsContact CD2-OH 3.32Å; L994-Y1000 WeakPolarHBondContact CD2-OH 3.35Å; L997-Y1000 HydrophobicContact CB-CD2 4.42Å; L997-Y1000 HydrophobicContact CD2-CD2 3.95Å; L997-Y1000 HydrophobicContact CD2-CE2 4.32Å; L997-Y1000 PolarHBondContact O-N 3.05Å; L997-Y1000 VanDerWaalsContact O-N 3.17Å; P998-Y1000 PolarHBondContact O-N 3.49Å; Y1000-V1002 VanDerWaalsContact C-N 3.27Å; Y1000-Y1004 WeakPolarHBondContact O-CD2 3.42Å; Y1000-Y1004 VanDerWaalsContact O-CE2 3.31Å; Y1000-Y1004 WeakPolarHBondContact O-CE2 3.47Å; Y1000-F1049 HydrophobicContact CD2-CE1 4.28Å; Y1000-F1049 AromaticContact CE2-CE1 3.79Å; Y1000-F1049 HydrophobicContact CE2-CE1 3.79Å; Y1000-F1049 AromaticContact CE2-CZ 3.72Å; Y1000-F1049 HydrophobicContact CE2-CZ 3.72Å; Y1000-F1049 AromaticContact CZ-CZ 3.82Å; Y1000-M1053 HydrophobicContact CD1-CE 3.55Å; Y1000-M1053 HydrophobicContact CD1-SD 4.27Å; Y1000-M1053 HydrophobicContact CD2-CE 3.9Å; Y1000-M1053 HydrophobicContact CE1-CE 3.53Å; Y1000-M1053 HydrophobicContact CE2-CE 3.88Å; Y1000-M1053 HydrophobicContact CG-CE 3.73Å; Y1000-P1101 HydrophobicContact CE1-CB 4.38Å; Y1000-P1101 WeakPolarHBondContact OH-CA 3.17Å; Y1000-V1102 WeakPolarHBondContact CE1-O 3.34Å; Y1000-V1102 PolarHBondContact OH-N 3.03Å; Y1000-V1102 VanDerWaalsContact OH-N 3.09Å
1001	V	95.6	Very high	89.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-25.2	166.4	78.9	0	0	0	0	112.7	M950 A951 P998 E999 Y1004 M1005 M1034 L1038	M950-V1001 HydrophobicContact CB-CG2 3.94Å; M950-V1001 HydrophobicContact CE-CB 3.71Å; M950-V1001 HydrophobicContact CE-CG1 3.98Å; M950-V1001 HydrophobicContact CE-CG2 3.88Å; M950-V1001 HydrophobicContact CG-CG2 4.35Å; A951-V1001 HydrophobicContact CB-CG2 3.88Å; P998-V1001 WeakPolarHBondContact O-CB 3.34Å; P998-V1001 WeakPolarHBondContact O-CG1 3.36Å; P998-V1001 PolarHBondContact O-N 3.15Å; E999-V1001 PolarHBondContact O-N 3.47Å; V1001-Y1004 PolarHBondContact O-N 2.74Å; V1001-M1005 WeakPolarHBondContact O-CB 3.4Å; V1001-M1005 PolarHBondContact O-N 3.08Å; V1001-M1034 HydrophobicContact CB-SD 4.31Å; V1001-M1034 HydrophobicContact CG1-CG 4.26Å; V1001-M1034 HydrophobicContact CG1-SD 3.66Å; V1001-M1034 HydrophobicContact CG2-CE 4.49Å; V1001-M1034 HydrophobicContact CG2-SD 3.62Å; V1001-L1038 HydrophobicContact CG1-CD1 3.63Å; V1001-L1038 HydrophobicContact CG1-CD2 4.33Å
1002	V	96.3	Very high	91.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-47.3	-173.9	172.7	0	0	0	0	112.6	E999 Y1000 Y1004 M1005 I1006 L1035 L1038 M1050	E999-V1002 WeakPolarHBondContact O-CB 3.43Å; E999-V1002 WeakPolarHBondContact O-CG2 3.37Å; E999-V1002 PolarHBondContact O-N 2.81Å; Y1000-V1002 VanDerWaalsContact C-N 3.27Å; V1002-Y1004 PolarHBondContact O-N 3.29Å; V1002-M1005 HydrophobicContact CG2-CE 4.28Å; V1002-M1005 PolarHBondContact O-N 3.2Å; V1002-I1006 HydrophobicContact CG1-CD1 3.75Å; V1002-I1006 HydrophobicContact CG1-CG1 4.4Å; V1002-I1006 WeakPolarHBondContact O-CG1 3.29Å; V1002-I1006 PolarHBondContact O-N 2.7Å; V1002-L1035 HydrophobicContact CG2-CD2 3.97Å; V1002-L1038 HydrophobicContact CG2-CD1 3.99Å; V1002-M1050 HydrophobicContact CG2-CB 4.41Å; V1002-M1050 HydrophobicContact CG2-CG 3.95Å; V1002-M1050 HydrophobicContact CG2-SD 3.9Å
1003	P	96.5	Very high	92.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-55.3	-49.4	171.9	-26.9	33.7	0	0	0	113.7	M1005 I1006 H1007 M1053 I1057 L1103 F1108	P1003-M1005 VanDerWaalsContact C-N 3.3Å; P1003-M1005 PolarHBondContact O-N 3.11Å; P1003-I1006 PolarHBondContact O-N 2.68Å; P1003-H1007 PolarHBondContact O-N 3.07Å; P1003-M1053 VanDerWaalsContact CD-SD 3.56Å; P1003-M1053 HydrophobicContact CG-CB 4.22Å; P1003-M1053 HydrophobicContact CG-CG 4.24Å; P1003-M1053 HydrophobicContact CG-SD 3.79Å; P1003-I1057 HydrophobicContact CB-CD1 3.87Å; P1003-I1057 HydrophobicContact CG-CD1 4.15Å; P1003-L1103 HydrophobicContact CB-CD2 4.33Å; P1003-L1103 HydrophobicContact CG-CD2 3.98Å; P1003-F1108 HydrophobicContact CB-CE2 3.62Å; P1003-F1108 HydrophobicContact CB-CZ 3.96Å; P1003-F1108 WeakPolarHBondContact O-CZ 3.33Å
1004	Y	97.2	Very high	93.8	Very high	38 Å²	38	23 Å²	23	15%	0.149	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-35.4	180	-57.6	-69.7	0	0	0	112.5	L947 E948 Y1000 V1001 V1002 L1008 P1104 F1107	L947-Y1004 HydrophobicContact CB-CD2 4.26Å; L947-Y1004 HydrophobicContact CB-CE2 4Å; E948-Y1004 HydrophobicContact CB-CD1 3.48Å; E948-Y1004 VanDerWaalsContact CB-CD1 3.48Å; E948-Y1004 HydrophobicContact CB-CD2 4.17Å; E948-Y1004 HydrophobicContact CB-CE1 3.84Å; E948-Y1004 HydrophobicContact CB-CG 3.67Å; Y1000-Y1004 WeakPolarHBondContact O-CD2 3.42Å; Y1000-Y1004 VanDerWaalsContact O-CE2 3.31Å; Y1000-Y1004 WeakPolarHBondContact O-CE2 3.47Å; V1001-Y1004 PolarHBondContact O-N 2.74Å; V1002-Y1004 PolarHBondContact O-N 3.29Å; Y1004-L1008 WeakPolarHBondContact O-CB 3.47Å; Y1004-L1008 PolarHBondContact O-N 3Å; Y1004-P1104 HydrophobicContact CD1-CG 4.36Å; Y1004-P1104 HydrophobicContact CE1-CB 3.75Å; Y1004-P1104 HydrophobicContact CE1-CG 3.56Å; Y1004-P1104 HydrophobicContact CE2-CG 4.15Å; Y1004-P1104 VanDerWaalsContact CZ-CG 3.43Å; Y1004-P1104 WeakPolarHBondContact OH-CG 3.36Å; Y1004-F1107 AromaticContact CD1-CD2 3.91Å; Y1004-F1107 HydrophobicContact CD1-CD2 3.91Å; Y1004-F1107 AromaticContact CD1-CE2 3.78Å; Y1004-F1107 HydrophobicContact CD1-CE2 3.78Å; Y1004-F1107 HydrophobicContact CD1-CG 4.42Å; Y1004-F1107 HydrophobicContact CD1-CZ 4.19Å; Y1004-F1107 AromaticContact CE1-CD2 3.7Å; Y1004-F1107 HydrophobicContact CE1-CD2 3.7Å; Y1004-F1107 AromaticContact CE1-CE2 3.57Å; Y1004-F1107 HydrophobicContact CE1-CE2 3.57Å; Y1004-F1107 HydrophobicContact CE1-CZ 4.38Å
1005	M	97.3	Very high	94.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.9	-44.4	174.5	176.4	-178.6	56.3	0	0	111.9	A951 A954 V1001 V1002 P1003 L1008 L1009 L1031 M1034 L1035	A951-M1005 HydrophobicContact CB-CB 4.02Å; A954-M1005 HydrophobicContact CB-CG 3.87Å; A954-M1005 HydrophobicContact CB-SD 3.81Å; V1001-M1005 WeakPolarHBondContact O-CB 3.4Å; V1001-M1005 PolarHBondContact O-N 3.08Å; V1002-M1005 HydrophobicContact CG2-CE 4.28Å; V1002-M1005 PolarHBondContact O-N 3.2Å; P1003-M1005 VanDerWaalsContact C-N 3.3Å; P1003-M1005 PolarHBondContact O-N 3.11Å; M1005-L1008 PolarHBondContact O-N 3.5Å; M1005-L1009 HydrophobicContact CG-CD1 3.78Å; M1005-L1009 HydrophobicContact CG-CG 4.42Å; M1005-L1009 WeakPolarHBondContact O-CB 3.44Å; M1005-L1009 VanDerWaalsContact O-CG 3.27Å; M1005-L1009 WeakPolarHBondContact O-CG 3.45Å; M1005-L1009 PolarHBondContact O-N 3.26Å; M1005-L1031 HydrophobicContact CE-CD2 3.68Å; M1005-L1031 HydrophobicContact CG-CD2 4.16Å; M1005-L1031 HydrophobicContact SD-CD2 4.02Å; M1005-M1034 HydrophobicContact CB-SD 4.34Å; M1005-M1034 HydrophobicContact CE-CB 4.34Å; M1005-M1034 HydrophobicContact CE-SD 4.47Å; M1005-M1034 HydrophobicContact CG-SD 4.42Å; M1005-M1034 HydrophobicContact SD-CB 3.54Å; M1005-M1034 VanDerWaalsContact SD-CB 3.54Å; M1005-M1034 HydrophobicContact SD-CG 4.05Å; M1005-M1034 HydrophobicContact SD-SD 3.68Å; M1005-M1034 VanDerWaalsContact SD-SD 3.68Å; M1005-L1035 HydrophobicContact CE-CD2 4.47Å; M1005-L1035 HydrophobicContact CE-CG 4.21Å
1006	I	97.9	Very high	94.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-47.7	176.9	-73.7	170.1	0	0	0	110.2	V1002 P1003 L1009 A1010 L1031 A1054 I1057 L1075 V1078 A1082	V1002-I1006 HydrophobicContact CG1-CD1 3.75Å; V1002-I1006 HydrophobicContact CG1-CG1 4.4Å; V1002-I1006 WeakPolarHBondContact O-CG1 3.29Å; V1002-I1006 PolarHBondContact O-N 2.7Å; P1003-I1006 PolarHBondContact O-N 2.68Å; I1006-L1009 PolarHBondContact O-N 3.49Å; I1006-A1010 WeakPolarHBondContact O-CB 3.24Å; I1006-A1010 PolarHBondContact O-N 3.13Å; I1006-L1031 HydrophobicContact CG1-CD2 4.29Å; I1006-A1054 HydrophobicContact CD1-CB 4.01Å; I1006-I1057 HydrophobicContact CD1-CD1 4.03Å; I1006-I1057 HydrophobicContact CG2-CD1 4.47Å; I1006-I1057 HydrophobicContact CG2-CG2 4.48Å; I1006-L1075 HydrophobicContact CG2-CD1 3.71Å; I1006-V1078 HydrophobicContact CB-CG1 4.26Å; I1006-V1078 HydrophobicContact CG1-CG1 4.27Å; I1006-V1078 HydrophobicContact CG2-CB 4.33Å; I1006-V1078 HydrophobicContact CG2-CG1 4Å; I1006-A1082 HydrophobicContact CD1-CB 4.09Å; I1006-A1082 HydrophobicContact CG1-CB 4.34Å
1007	H	97.9	Very high	94.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.6	-39	177.6	-172.1	-54	0	0	0	112.8	Q915 P1003 L1009 A1010 H1011 D1062 Q1064 F1107 F1108	Q915-H1007 PolarHBondContact NE2-CE1 3.16Å; P1003-H1007 PolarHBondContact O-N 3.07Å; H1007-L1009 VanDerWaalsContact C-N 3.32Å; H1007-L1009 PolarHBondContact O-N 2.8Å; H1007-A1010 PolarHBondContact O-N 3.13Å; H1007-H1011 AromaticContact CE1-CD2 3.34Å; H1007-H1011 PolarHBondContact CE1-CD2 2.97Å; H1007-H1011 AromaticContact CE1-NE2 3.42Å; H1007-H1011 PolarHBondContact CE1-NE2 3.32Å; H1007-H1011 AromaticContact ND1-CD2 3.39Å; H1007-H1011 PolarHBondContact ND1-CD2 3.06Å; H1007-H1011 AromaticContact ND1-NE2 3.93Å; H1007-H1011 AromaticContact NE2-NE2 3.99Å; H1007-H1011 PolarHBondContact O-CD2 3.34Å; H1007-H1011 PolarHBondContact O-N 3.34Å; H1007-D1062 IonicContact CD2-OD2 2.71Å; H1007-D1062 IonicContact NE2-OD2 3.01Å; H1007-Q1064 PolarHBondContact CE1-OE1 3.49Å; H1007-F1107 HydrophobicContact CB-CD1 4.49Å; H1007-F1107 AromaticContact CD2-CD1 3.71Å; H1007-F1107 PolarHBondContact CD2-O 2.97Å; H1007-F1107 AromaticContact CE1-CD1 3.86Å; H1007-F1107 AromaticContact CG-CD1 3.82Å; H1007-F1107 AromaticContact ND1-CD1 3.93Å; H1007-F1107 AromaticContact NE2-CD1 3.68Å; H1007-F1107 PolarHBondContact NE2-O 2.87Å; H1007-F1108 HydrophobicContact CB-CE1 4.33Å; H1007-F1108 HydrophobicContact CB-CZ 3.93Å
1008	L	97.7	Very high	94.6	Very high	6 Å²	6	26.9 Å²	26.9	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-39.3	177	179.6	60.2	0	0	0	111.4	F914 Q915 A918 A951 I952 L955 Y1004 M1005 H1011 D1012	F914-L1008 HydrophobicContact CE1-CD1 4.11Å; F914-L1008 HydrophobicContact CZ-CD1 4.48Å; F914-L1008 HydrophobicContact CZ-CD2 4.33Å; Q915-L1008 HydrophobicContact CG-CD1 4.19Å; A918-L1008 HydrophobicContact CB-CD1 3.85Å; A918-L1008 HydrophobicContact CB-CD2 4.21Å; A951-L1008 HydrophobicContact CB-CD2 4.26Å; I952-L1008 HydrophobicContact CG1-CD2 4.38Å; L955-L1008 HydrophobicContact CD1-CD2 4.02Å; L955-L1008 HydrophobicContact CD1-CG 4.33Å; L955-L1008 HydrophobicContact CG-CD2 4.26Å; Y1004-L1008 WeakPolarHBondContact O-CB 3.47Å; Y1004-L1008 PolarHBondContact O-N 3Å; M1005-L1008 PolarHBondContact O-N 3.5Å; L1008-H1011 CarbonylContact O-C 3.41Å; L1008-H1011 PolarHBondContact O-N 3.5Å; L1008-D1012 PolarHBondContact O-N 2.91Å; L1008-D1012 VanDerWaalsContact O-N 3.15Å
1009	L	97.6	Very high	94.3	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-76.4	-31.2	177.4	-68.6	173.4	0	0	0	112.8	L955 M1005 I1006 H1007 H1011 D1012 I1027 C1030 L1031 V1078	L955-L1009 HydrophobicContact CD2-CD2 3.56Å; M1005-L1009 HydrophobicContact CG-CD1 3.78Å; M1005-L1009 HydrophobicContact CG-CG 4.42Å; M1005-L1009 WeakPolarHBondContact O-CB 3.44Å; M1005-L1009 VanDerWaalsContact O-CG 3.27Å; M1005-L1009 WeakPolarHBondContact O-CG 3.45Å; M1005-L1009 PolarHBondContact O-N 3.26Å; I1006-L1009 PolarHBondContact O-N 3.49Å; H1007-L1009 VanDerWaalsContact C-N 3.32Å; H1007-L1009 PolarHBondContact O-N 2.8Å; L1009-H1011 PolarHBondContact O-N 3.16Å; L1009-D1012 WeakPolarHBondContact O-CB 3.38Å; L1009-D1012 PolarHBondContact O-N 2.86Å; L1009-I1027 HydrophobicContact CB-CD1 3.83Å; L1009-I1027 HydrophobicContact CD2-CD1 4.21Å; L1009-I1027 WeakPolarHBondContact O-CD1 3.48Å; L1009-C1030 HydrophobicContact CD1-CB 3.8Å; L1009-C1030 HydrophobicContact CD2-CB 3.57Å; L1009-C1030 HydrophobicContact CG-CB 4.37Å; L1009-L1031 HydrophobicContact CD1-CD2 3.7Å; L1009-L1031 HydrophobicContact CD1-CG 3.71Å; L1009-V1078 HydrophobicContact CB-CG1 4.13Å
1010	A	96.7	Very high	94.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-27.9	171.9	0	0	0	0	0	112.6	I1006 H1007 K1074 L1075 V1078	I1006-A1010 WeakPolarHBondContact O-CB 3.24Å; I1006-A1010 PolarHBondContact O-N 3.13Å; H1007-A1010 PolarHBondContact O-N 3.13Å; A1010-K1074 WeakPolarHBondContact O-CE 3.49Å; A1010-K1074 PolarHBondContact O-NZ 2.88Å; A1010-L1075 HydrophobicContact CB-CB 4.29Å; A1010-L1075 HydrophobicContact CB-CD1 4.02Å; A1010-V1078 HydrophobicContact CB-CG2 4.23Å
1011	H	96.6	Very high	93.9	Very high	40 Å²	40	35.1 Å²	35.1	19%	0.185	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	11.8	175.5	-72.4	-97.8	0	0	0	113.9	Q915 H1007 L1008 L1009 D1062	Q915-H1011 HydrophobicContact CG-CB 4.39Å; Q915-H1011 VanDerWaalsContact NE2-CG 3.33Å; H1007-H1011 AromaticContact CE1-CD2 3.34Å; H1007-H1011 PolarHBondContact CE1-CD2 2.97Å; H1007-H1011 AromaticContact CE1-NE2 3.42Å; H1007-H1011 PolarHBondContact CE1-NE2 3.32Å; H1007-H1011 AromaticContact ND1-CD2 3.39Å; H1007-H1011 PolarHBondContact ND1-CD2 3.06Å; H1007-H1011 AromaticContact ND1-NE2 3.93Å; H1007-H1011 AromaticContact NE2-NE2 3.99Å; H1007-H1011 PolarHBondContact O-CD2 3.34Å; H1007-H1011 PolarHBondContact O-N 3.34Å; L1008-H1011 CarbonylContact O-C 3.41Å; L1008-H1011 PolarHBondContact O-N 3.5Å; L1009-H1011 PolarHBondContact O-N 3.16Å; H1011-D1062 IonicContact CD2-OD2 3.89Å; H1011-D1062 IonicContact CE1-OD1 3.76Å; H1011-D1062 IonicContact CE1-OD2 3.04Å; H1011-D1062 IonicContact NE2-OD1 2.72Å; H1011-D1062 IonicContact NE2-OD2 3.33Å; H1011-D1062 PolarHBondContact NE2-OD2 3.16Å
1012	D	95.1	Very high	93.6	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.037	20%	0.203	C	C	.	.			trans	-64.4	131.5	176.2	-178.8	-79.6	0	0	0	110.8	K958 L1008 L1009 D1014 F1015	K958-D1012 IonicContact NZ-OD1 2.64Å; K958-D1012 PolarHBondContact NZ-OD1 3.11Å; K958-D1012 IonicContact NZ-OD2 2.79Å; K958-D1012 PolarHBondContact NZ-OD2 3.17Å; L1008-D1012 PolarHBondContact O-N 2.91Å; L1008-D1012 VanDerWaalsContact O-N 3.15Å; L1009-D1012 WeakPolarHBondContact O-CB 3.38Å; L1009-D1012 PolarHBondContact O-N 2.86Å; D1012-D1014 VanDerWaalsContact C-N 3.29Å; D1012-D1014 PolarHBondContact O-N 3Å; D1012-D1014 WeakPolarHBondContact OD1-CB 3.49Å; D1012-D1014 PolarHBondContact OD1-N 2.88Å; D1012-F1015 HydrophobicContact CB-CB 4.36Å; D1012-F1015 PolarHBondContact O-N 3.08Å; D1012-F1015 PolarHBondContact OD1-N 3.04Å
1013	P	93.7	Very high	93.5	Very high	64 Å²	64	41.3 Å²	41.3	42%	0.416	21%	0.211	S	C	.	.	S	Bend	trans	-64.2	-25.3	-175.7	-25.4	34.8	0	0	0	115.5	L919 T1016	L919-P1013 HydrophobicContact CD1-CG 3.72Å; L919-P1013 HydrophobicContact CD2-CG 4.07Å; P1013-T1016 WeakPolarHBondContact O-CG2 3.39Å
1014	D	92.6	Very high	93.3	Very high	102 Å²	102	41.3 Å²	41.3	55%	0.545	21%	0.211	S	C	.	.	S	Bend	trans	-77.5	-30.9	178.5	-57	-40.3	0	0	0	110.6	K958 D1012 T1016 Q1023	K958-D1014 IonicContact NZ-OD2 2.87Å; K958-D1014 PolarHBondContact NZ-OD2 3.41Å; D1012-D1014 VanDerWaalsContact C-N 3.29Å; D1012-D1014 PolarHBondContact O-N 3Å; D1012-D1014 WeakPolarHBondContact OD1-CB 3.49Å; D1012-D1014 PolarHBondContact OD1-N 2.88Å; D1014-T1016 PolarHBondContact O-N 3.37Å; D1014-T1016 PolarHBondContact O-OG1 3.37Å; D1014-Q1023 VanDerWaalsContact O-CD 3.32Å; D1014-Q1023 PolarHBondContact O-OE1 2.92Å
1015	F	95.2	Very high	93.1	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.013	22%	0.217	C	C	.	.			trans	-76.1	89.5	175	-174.6	-139.5	0	0	0	110.3	D1012 R1017 Q1023 L1024 I1027 K1074 V1078	D1012-F1015 HydrophobicContact CB-CB 4.36Å; D1012-F1015 PolarHBondContact O-N 3.08Å; D1012-F1015 PolarHBondContact OD1-N 3.04Å; F1015-R1017 WeakPolarHBondContact CE2-O 3.48Å; F1015-Q1023 HydrophobicContact CD2-CB 4.11Å; F1015-L1024 HydrophobicContact CE2-CD2 3.78Å; F1015-L1024 HydrophobicContact CZ-CD2 4.05Å; F1015-I1027 HydrophobicContact CB-CD1 3.98Å; F1015-I1027 HydrophobicContact CB-CG1 4.32Å; F1015-I1027 HydrophobicContact CD1-CD1 4.04Å; F1015-I1027 HydrophobicContact CD1-CG1 4.43Å; F1015-I1027 HydrophobicContact CD2-CG1 4.23Å; F1015-I1027 HydrophobicContact CG-CD1 3.99Å; F1015-I1027 HydrophobicContact CG-CG1 4.1Å; F1015-K1074 HydrophobicContact CD1-CB 4.47Å; F1015-K1074 HydrophobicContact CD1-CG 4.5Å; F1015-K1074 HydrophobicContact CE1-CB 3.76Å; F1015-K1074 HydrophobicContact CE1-CD 4.49Å; F1015-K1074 HydrophobicContact CE1-CG 3.97Å; F1015-K1074 HydrophobicContact CZ-CB 4.4Å; F1015-K1074 HydrophobicContact CZ-CG 4.35Å; F1015-K1074 WeakPolarHBondContact O-CE 3.42Å; F1015-K1074 PolarHBondContact O-NZ 3.49Å; F1015-V1078 HydrophobicContact CD1-CG2 4.25Å; F1015-V1078 HydrophobicContact CE1-CG2 3.64Å; F1015-V1078 HydrophobicContact CZ-CG2 4.33Å
1016	T	91.7	Very high	92.9	Very high	96 Å²	96	46.1 Å²	46.1	59%	0.589	23%	0.234	S	C	*	.			trans	-106.4	-15.1	-175.9	46.9	0	0	0	0	113.3	P1013 D1014 Q1023	P1013-T1016 WeakPolarHBondContact O-CG2 3.39Å; D1014-T1016 PolarHBondContact O-N 3.37Å; D1014-T1016 PolarHBondContact O-OG1 3.37Å; T1016-Q1023 PolarHBondContact OG1-NE2 3.05Å; T1016-Q1023 PolarHBondContact OG1-OE1 3.26Å
1017	R	88.2	Confident	92.8	Very high	163 Å²	163	46.3 Å²	46.3	62%	0.615	24%	0.235	S	C	*	.			trans	-138.9	115.1	-174	-71.2	175.4	174.2	-179.8	-4.2	110.9	F1015 Q1019 D1020	F1015-R1017 WeakPolarHBondContact CE2-O 3.48Å; R1017-Q1019 PolarHBondContact O-N 3.18Å; R1017-Q1019 VanDerWaalsContact O-N 3.09Å; R1017-D1020 HydrophobicContact CB-CB 3.58Å; R1017-D1020 IonicContact NH1-OD2 2.73Å; R1017-D1020 PolarHBondContact O-N 3.23Å; R1017-D1020 VanDerWaalsContact O-N 3.15Å
1018	S	83.8	Confident	92.7	Very high	25 Å²	25	48.2 Å²	48.2	18%	0.175	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.6	-176.3	50	0	0	0	0	115.2	T1077	S1018-T1077 VanDerWaalsContact O-CG2 3.29Å; S1018-T1077 WeakPolarHBondContact O-CG2 3.28Å
1019	Q	85.9	Confident	92.5	Very high	101 Å²	101	51.3 Å²	51.3	47%	0.472	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	8.1	180	-59.7	-58.7	-53.4	0	0	113.9	R1017 V1021 Y1121	R1017-Q1019 PolarHBondContact O-N 3.18Å; R1017-Q1019 VanDerWaalsContact O-N 3.09Å; Q1019-V1021 PolarHBondContact O-N 3.3Å; Q1019-Y1121 PolarHBondContact NE2-O 2.91Å
1020	D	90.4	Very high	92.5	Very high	39 Å²	39	51.2 Å²	51.2	21%	0.209	26%	0.257	C	S	.	.			trans	-81.9	113.3	-176.2	-169.9	-63.1	0	0	0	111.4	R1017 D1022 Q1023 L1024	R1017-D1020 HydrophobicContact CB-CB 3.58Å; R1017-D1020 IonicContact NH1-OD2 2.73Å; R1017-D1020 PolarHBondContact O-N 3.23Å; R1017-D1020 VanDerWaalsContact O-N 3.15Å; D1020-D1022 VanDerWaalsContact C-N 3.33Å; D1020-D1022 PolarHBondContact O-N 3.39Å; D1020-D1022 PolarHBondContact OD1-N 3.37Å; D1020-Q1023 HydrophobicContact CB-CB 4.18Å; D1020-Q1023 HydrophobicContact CB-CG 4.07Å; D1020-Q1023 PolarHBondContact O-N 2.99Å; D1020-Q1023 PolarHBondContact OD1-N 3.37Å; D1020-L1024 WeakPolarHBondContact O-CB 3.5Å; D1020-L1024 VanDerWaalsContact O-CG 3.25Å; D1020-L1024 WeakPolarHBondContact O-CG 3.34Å; D1020-L1024 PolarHBondContact O-N 3.21Å
1021	V	89	Confident	92.5	Very high	52 Å²	52	51.2 Å²	51.2	32%	0.315	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-31.8	-167.7	179.2	0	0	0	0	113	Q1019 R1025 T1126 L1129	Q1019-V1021 PolarHBondContact O-N 3.3Å; V1021-R1025 PolarHBondContact O-N 3.5Å; V1021-R1025 VanDerWaalsContact O-N 3.09Å; V1021-T1126 HydrophobicContact CG2-CG2 4.35Å; V1021-L1129 HydrophobicContact CG1-CD2 3.54Å
1022	D	88.7	Confident	92.4	Very high	94 Å²	94	52.5 Å²	52.5	50%	0.503	26%	0.26	S	S	.	.	H	α-helix	trans	-71.7	-44.9	175.1	-86.8	-68.2	0	0	0	110.6	D1020 L1024 R1025 D1026	D1020-D1022 VanDerWaalsContact C-N 3.33Å; D1020-D1022 PolarHBondContact O-N 3.39Å; D1020-D1022 PolarHBondContact OD1-N 3.37Å; D1022-L1024 VanDerWaalsContact C-N 3.32Å; D1022-L1024 PolarHBondContact O-N 2.85Å; D1022-R1025 WeakPolarHBondContact O-CB 3.36Å; D1022-R1025 PolarHBondContact O-N 2.87Å; D1022-R1025 IonicContact OD1-CZ 3.45Å; D1022-R1025 IonicContact OD1-NH1 2.78Å; D1022-R1025 PolarHBondContact OD1-NH1 2.76Å; D1022-R1025 IonicContact OD1-NH2 3.2Å; D1022-R1025 PolarHBondContact OD1-NH2 3.27Å; D1022-D1026 PolarHBondContact O-N 3.1Å
1023	Q	93.2	Very high	92.4	Very high	36 Å²	36	52.6 Å²	52.6	17%	0.168	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-39.6	174.6	-61.2	178.3	15	0	0	111.8	D1014 F1015 T1016 D1020 R1025 D1026 I1027	D1014-Q1023 VanDerWaalsContact O-CD 3.32Å; D1014-Q1023 PolarHBondContact O-OE1 2.92Å; F1015-Q1023 HydrophobicContact CD2-CB 4.11Å; T1016-Q1023 PolarHBondContact OG1-NE2 3.05Å; T1016-Q1023 PolarHBondContact OG1-OE1 3.26Å; D1020-Q1023 HydrophobicContact CB-CB 4.18Å; D1020-Q1023 HydrophobicContact CB-CG 4.07Å; D1020-Q1023 PolarHBondContact O-N 2.99Å; D1020-Q1023 PolarHBondContact OD1-N 3.37Å; Q1023-R1025 VanDerWaalsContact C-N 3.34Å; Q1023-R1025 PolarHBondContact O-N 3.05Å; Q1023-D1026 PolarHBondContact O-N 3.05Å; Q1023-I1027 VanDerWaalsContact O-CG1 3.3Å; Q1023-I1027 WeakPolarHBondContact O-CG1 3.2Å; Q1023-I1027 PolarHBondContact O-N 3.39Å
1024	L	93.8	Very high	92.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-30.2	177.5	-68.1	174.5	0	0	0	113.2	F1015 D1020 D1022 K1028 T1077 V1081 T1126 L1130	F1015-L1024 HydrophobicContact CE2-CD2 3.78Å; F1015-L1024 HydrophobicContact CZ-CD2 4.05Å; D1020-L1024 WeakPolarHBondContact O-CB 3.5Å; D1020-L1024 VanDerWaalsContact O-CG 3.25Å; D1020-L1024 WeakPolarHBondContact O-CG 3.34Å; D1020-L1024 PolarHBondContact O-N 3.21Å; D1022-L1024 VanDerWaalsContact C-N 3.32Å; D1022-L1024 PolarHBondContact O-N 2.85Å; L1024-K1028 WeakPolarHBondContact O-CB 3.41Å; L1024-K1028 PolarHBondContact O-N 3.12Å; L1024-T1077 HydrophobicContact CD1-CG2 4.47Å; L1024-T1077 HydrophobicContact CD2-CG2 3.61Å; L1024-V1081 HydrophobicContact CD2-CG2 4.19Å; L1024-T1126 HydrophobicContact CD1-CG2 3.91Å; L1024-L1130 HydrophobicContact CB-CD1 4.43Å; L1024-L1130 HydrophobicContact CB-CD2 4.32Å
1025	R	91.9	Very high	92.5	Very high	70 Å²	70	44.7 Å²	44.7	26%	0.264	22%	0.215	S	C	.	.	H	α-helix	trans	-64.2	-46.2	169.9	179.1	-165.7	56.4	-113.8	-15.5	110.4	V1021 D1022 Q1023 I1027 K1028 E1029 L1130	V1021-R1025 PolarHBondContact O-N 3.5Å; V1021-R1025 VanDerWaalsContact O-N 3.09Å; D1022-R1025 WeakPolarHBondContact O-CB 3.36Å; D1022-R1025 PolarHBondContact O-N 2.87Å; D1022-R1025 IonicContact OD1-CZ 3.45Å; D1022-R1025 IonicContact OD1-NH1 2.78Å; D1022-R1025 PolarHBondContact OD1-NH1 2.76Å; D1022-R1025 IonicContact OD1-NH2 3.2Å; D1022-R1025 PolarHBondContact OD1-NH2 3.27Å; Q1023-R1025 VanDerWaalsContact C-N 3.34Å; Q1023-R1025 PolarHBondContact O-N 3.05Å; R1025-I1027 PolarHBondContact O-N 2.69Å; R1025-K1028 CarbonylContact O-C 3.54Å; R1025-K1028 WeakPolarHBondContact O-CA 3.48Å; R1025-K1028 WeakPolarHBondContact O-CB 3.3Å; R1025-K1028 PolarHBondContact O-N 2.87Å; R1025-K1028 VanDerWaalsContact O-N 3.11Å; R1025-E1029 PolarHBondContact O-N 3.29Å; R1025-L1130 HydrophobicContact CB-CD2 4.19Å
1026	D	92.7	Very high	92.4	Very high	68 Å²	68	47.6 Å²	47.6	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-68.4	-37.9	-175.8	-62.4	4.3	0	0	0	110.7	D1022 Q1023 E1029 C1030	D1022-D1026 PolarHBondContact O-N 3.1Å; Q1023-D1026 PolarHBondContact O-N 3.05Å; D1026-E1029 PolarHBondContact O-N 3.15Å; D1026-C1030 PolarHBondContact O-N 3.28Å; D1026-C1030 PolarHBondContact O-SG 3.49Å
1027	I	96.2	Very high	92.5	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-57.6	-47	167.1	-69.9	-74.9	0	0	0	111.5	L1009 F1015 Q1023 R1025 E1029 C1030 L1031 V1078 V1081	L1009-I1027 HydrophobicContact CB-CD1 3.83Å; L1009-I1027 HydrophobicContact CD2-CD1 4.21Å; L1009-I1027 WeakPolarHBondContact O-CD1 3.48Å; F1015-I1027 HydrophobicContact CB-CD1 3.98Å; F1015-I1027 HydrophobicContact CB-CG1 4.32Å; F1015-I1027 HydrophobicContact CD1-CD1 4.04Å; F1015-I1027 HydrophobicContact CD1-CG1 4.43Å; F1015-I1027 HydrophobicContact CD2-CG1 4.23Å; F1015-I1027 HydrophobicContact CG-CD1 3.99Å; F1015-I1027 HydrophobicContact CG-CG1 4.1Å; Q1023-I1027 VanDerWaalsContact O-CG1 3.3Å; Q1023-I1027 WeakPolarHBondContact O-CG1 3.2Å; Q1023-I1027 PolarHBondContact O-N 3.39Å; R1025-I1027 PolarHBondContact O-N 2.69Å; I1027-E1029 VanDerWaalsContact C-N 3.32Å; I1027-E1029 PolarHBondContact O-N 2.98Å; I1027-C1030 PolarHBondContact O-N 3.04Å; I1027-L1031 HydrophobicContact CG2-CD1 3.92Å; I1027-L1031 HydrophobicContact CG2-CG 4.49Å; I1027-L1031 WeakPolarHBondContact O-CG 3.47Å; I1027-L1031 PolarHBondContact O-N 3.14Å; I1027-V1078 HydrophobicContact CG2-CG1 4.28Å; I1027-V1078 HydrophobicContact CG2-CG2 4.15Å; I1027-V1081 HydrophobicContact CG2-CG1 4.45Å
1028	K	95.2	Very high	92.6	Very high	41 Å²	41	35.9 Å²	35.9	18%	0.178	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-36.4	176.9	173.5	-116.9	171.2	171.6	0	112.1	L1024 R1025 W1032 V1081 V1085 L1130	L1024-K1028 WeakPolarHBondContact O-CB 3.41Å; L1024-K1028 PolarHBondContact O-N 3.12Å; R1025-K1028 CarbonylContact O-C 3.54Å; R1025-K1028 WeakPolarHBondContact O-CA 3.48Å; R1025-K1028 WeakPolarHBondContact O-CB 3.3Å; R1025-K1028 PolarHBondContact O-N 2.87Å; R1025-K1028 VanDerWaalsContact O-N 3.11Å; K1028-W1032 VanDerWaalsContact O-CB 3.26Å; K1028-W1032 WeakPolarHBondContact O-CB 3.45Å; K1028-W1032 PolarHBondContact O-N 2.85Å; K1028-V1081 HydrophobicContact CB-CG1 3.6Å; K1028-V1081 HydrophobicContact CG-CG1 4.2Å; K1028-V1085 HydrophobicContact CG-CG2 3.8Å; K1028-L1130 HydrophobicContact CB-CD2 4.11Å; K1028-L1130 HydrophobicContact CD-CD2 4.26Å; K1028-L1130 WeakPolarHBondContact CE-O 3.36Å; K1028-L1130 HydrophobicContact CG-CD2 4.42Å; K1028-L1130 PolarHBondContact NZ-O 3.27Å
1029	E	94.5	Very high	93	Very high	70 Å²	70	35.7 Å²	35.7	33%	0.327	17%	0.171	S	C	.	.	H	α-helix	trans	-69.7	-41.3	175	-72	-168.3	-159.6	0	0	112.1	R1025 D1026 I1027 W1032 F1033	R1025-E1029 PolarHBondContact O-N 3.29Å; D1026-E1029 PolarHBondContact O-N 3.15Å; I1027-E1029 VanDerWaalsContact C-N 3.32Å; I1027-E1029 PolarHBondContact O-N 2.98Å; E1029-W1032 PolarHBondContact O-N 3.3Å; E1029-F1033 VanDerWaalsContact O-CB 3.29Å; E1029-F1033 WeakPolarHBondContact O-CB 3.29Å; E1029-F1033 PolarHBondContact O-N 3.17Å
1030	C	96.7	Very high	93	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59	-49	170.8	-71.2	0	0	0	0	112.5	A954 A957 L1009 D1026 I1027 F1033	A954-C1030 HydrophobicContact CB-CB 4.43Å; A957-C1030 HydrophobicContact CB-CB 4.46Å; L1009-C1030 HydrophobicContact CD1-CB 3.8Å; L1009-C1030 HydrophobicContact CD2-CB 3.57Å; L1009-C1030 HydrophobicContact CG-CB 4.37Å; D1026-C1030 PolarHBondContact O-N 3.28Å; D1026-C1030 PolarHBondContact O-SG 3.49Å; I1027-C1030 PolarHBondContact O-N 3.04Å; C1030-F1033 WeakPolarHBondContact O-CB 3.42Å; C1030-F1033 PolarHBondContact O-N 2.97Å
1031	L	96.5	Very high	92.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.8	-49.4	177	-73.8	167.7	0	0	0	111.3	M1005 I1006 L1009 I1027 F1033 M1034 L1035 V1078 V1081 A1082	M1005-L1031 HydrophobicContact CE-CD2 3.68Å; M1005-L1031 HydrophobicContact CG-CD2 4.16Å; M1005-L1031 HydrophobicContact SD-CD2 4.02Å; I1006-L1031 HydrophobicContact CG1-CD2 4.29Å; L1009-L1031 HydrophobicContact CD1-CD2 3.7Å; L1009-L1031 HydrophobicContact CD1-CG 3.71Å; I1027-L1031 HydrophobicContact CG2-CD1 3.92Å; I1027-L1031 HydrophobicContact CG2-CG 4.49Å; I1027-L1031 WeakPolarHBondContact O-CG 3.47Å; I1027-L1031 PolarHBondContact O-N 3.14Å; L1031-F1033 VanDerWaalsContact C-N 3.34Å; L1031-F1033 PolarHBondContact O-N 3.26Å; L1031-M1034 PolarHBondContact O-N 3.09Å; L1031-L1035 HydrophobicContact CB-CD1 4.35Å; L1031-L1035 WeakPolarHBondContact O-CB 3.3Å; L1031-L1035 VanDerWaalsContact O-CG 3.32Å; L1031-L1035 WeakPolarHBondContact O-CG 3.4Å; L1031-L1035 PolarHBondContact O-N 3.24Å; L1031-V1078 HydrophobicContact CD1-CG1 4.24Å; L1031-V1078 HydrophobicContact CD2-CG1 4.36Å; L1031-V1081 HydrophobicContact CD1-CB 4Å; L1031-V1081 HydrophobicContact CD1-CG1 3.64Å; L1031-A1082 HydrophobicContact CD1-CB 4.05Å; L1031-A1082 HydrophobicContact CD2-CB 4.11Å
1032	W	95.1	Very high	92.2	Very high	68 Å²	68	38.8 Å²	38.8	26%	0.258	19%	0.187	S	C	.	.	H	α-helix	trans	-64.5	-37.3	-179.5	178.6	-114.6	0	0	0	112.4	K1028 E1029 M1034 L1035 E1036 V1085 K1089	K1028-W1032 VanDerWaalsContact O-CB 3.26Å; K1028-W1032 WeakPolarHBondContact O-CB 3.45Å; K1028-W1032 PolarHBondContact O-N 2.85Å; E1029-W1032 PolarHBondContact O-N 3.3Å; W1032-M1034 PolarHBondContact O-N 3.34Å; W1032-M1034 VanDerWaalsContact O-N 3.1Å; W1032-L1035 HydrophobicContact CE3-CB 4.32Å; W1032-L1035 PolarHBondContact O-N 3.02Å; W1032-E1036 HydrophobicContact CD2-CB 4Å; W1032-E1036 HydrophobicContact CE3-CB 4.17Å; W1032-E1036 HydrophobicContact CH2-CB 3.86Å; W1032-E1036 HydrophobicContact CH2-CG 3.94Å; W1032-E1036 HydrophobicContact CZ2-CB 3.65Å; W1032-E1036 HydrophobicContact CZ2-CG 3.49Å; W1032-E1036 VanDerWaalsContact CZ2-CG 3.49Å; W1032-E1036 HydrophobicContact CZ3-CB 4.1Å; W1032-E1036 PolarHBondContact NE1-OE2 3.27Å; W1032-E1036 WeakPolarHBondContact O-CB 3.44Å; W1032-E1036 PolarHBondContact O-N 2.83Å; W1032-V1085 HydrophobicContact CB-CG1 4.36Å; W1032-V1085 HydrophobicContact CD2-CG1 4.41Å; W1032-V1085 HydrophobicContact CE3-CG1 3.57Å; W1032-V1085 HydrophobicContact CZ3-CG1 4.34Å; W1032-K1089 HydrophobicContact CE3-CG 4.17Å; W1032-K1089 HydrophobicContact CH2-CB 4.27Å; W1032-K1089 HydrophobicContact CH2-CD 3.75Å; W1032-K1089 HydrophobicContact CH2-CG 3.83Å; W1032-K1089 HydrophobicContact CZ2-CD 4.31Å; W1032-K1089 HydrophobicContact CZ3-CB 3.96Å; W1032-K1089 HydrophobicContact CZ3-CD 3.98Å; W1032-K1089 HydrophobicContact CZ3-CG 3.52Å
1033	F	95.3	Very high	91.6	Very high	9 Å²	9	38 Å²	38	4%	0.039	18%	0.18	C	C	.	.	H	α-helix	trans	-55.5	-30.4	178.4	-171.1	-84.5	0	0	0	113.5	F953 C956 A957 R965 A968 R969 L972 E1029 C1030 L1031	F953-F1033 WeakPolarHBondContact O-CD1 3.05Å; F953-F1033 VanDerWaalsContact O-CE1 3.25Å; F953-F1033 WeakPolarHBondContact O-CE1 3.4Å; C956-F1033 HydrophobicContact CB-CE1 3.99Å; C956-F1033 HydrophobicContact CB-CZ 3.97Å; A957-F1033 HydrophobicContact CB-CB 3.87Å; A957-F1033 HydrophobicContact CB-CD2 3.89Å; A957-F1033 HydrophobicContact CB-CG 4Å; R965-F1033 HydrophobicContact CB-CE2 3.97Å; R965-F1033 HydrophobicContact CB-CZ 4.4Å; R965-F1033 HydrophobicContact CG-CE2 3.96Å; R965-F1033 HydrophobicContact CG-CZ 4.49Å; R965-F1033 WeakPolarHBondContact O-CZ 3.12Å; A968-F1033 HydrophobicContact CB-CE1 4.02Å; A968-F1033 HydrophobicContact CB-CZ 3.91Å; R969-F1033 HydrophobicContact CG-CD1 4.49Å; R969-F1033 HydrophobicContact CG-CD2 4.47Å; R969-F1033 HydrophobicContact CG-CE1 3.94Å; R969-F1033 HydrophobicContact CG-CE2 3.92Å; R969-F1033 HydrophobicContact CG-CZ 3.64Å; L972-F1033 HydrophobicContact CD1-CD1 4.31Å; L972-F1033 HydrophobicContact CD1-CE1 4.26Å; E1029-F1033 VanDerWaalsContact O-CB 3.29Å; E1029-F1033 WeakPolarHBondContact O-CB 3.29Å; E1029-F1033 PolarHBondContact O-N 3.17Å; C1030-F1033 WeakPolarHBondContact O-CB 3.42Å; C1030-F1033 PolarHBondContact O-N 2.97Å; L1031-F1033 VanDerWaalsContact C-N 3.34Å; L1031-F1033 PolarHBondContact O-N 3.26Å
1034	M	94.2	Very high	90.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-94.7	-44.3	175.2	-166.6	162	-73.7	0	0	112.9	M950 F953 A954 L972 V1001 M1005 L1031 W1032 E1036 V1037 L1038	M950-M1034 WeakPolarHBondContact O-CE 3.23Å; F953-M1034 HydrophobicContact CB-CE 4Å; A954-M1034 HydrophobicContact CB-CE 3.88Å; L972-M1034 HydrophobicContact CD1-CE 4.2Å; L972-M1034 HydrophobicContact CD1-CG 4.48Å; L972-M1034 HydrophobicContact CD2-CE 3.94Å; V1001-M1034 HydrophobicContact CB-SD 4.31Å; V1001-M1034 HydrophobicContact CG1-CG 4.26Å; V1001-M1034 HydrophobicContact CG1-SD 3.66Å; V1001-M1034 HydrophobicContact CG2-CE 4.49Å; V1001-M1034 HydrophobicContact CG2-SD 3.62Å; M1005-M1034 HydrophobicContact CB-SD 4.34Å; M1005-M1034 HydrophobicContact CE-CB 4.34Å; M1005-M1034 HydrophobicContact CE-SD 4.47Å; M1005-M1034 HydrophobicContact CG-SD 4.42Å; M1005-M1034 HydrophobicContact SD-CB 3.54Å; M1005-M1034 VanDerWaalsContact SD-CB 3.54Å; M1005-M1034 HydrophobicContact SD-CG 4.05Å; M1005-M1034 HydrophobicContact SD-SD 3.68Å; M1005-M1034 VanDerWaalsContact SD-SD 3.68Å; L1031-M1034 PolarHBondContact O-N 3.09Å; W1032-M1034 PolarHBondContact O-N 3.34Å; W1032-M1034 VanDerWaalsContact O-N 3.1Å; M1034-E1036 VanDerWaalsContact C-N 3.34Å; M1034-E1036 PolarHBondContact O-N 3.49Å; M1034-V1037 PolarHBondContact O-N 3.48Å; M1034-V1037 VanDerWaalsContact O-N 3.13Å; M1034-L1038 HydrophobicContact CG-CD1 4.01Å; M1034-L1038 PolarHBondContact O-N 3.01Å; M1034-L1038 VanDerWaalsContact O-N 3.15Å
1035	L	94.6	Very high	90.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-38.2	-178.6	-73.1	170	0	0	0	112.3	V1002 M1005 L1031 W1032 V1037 L1038 M1039 M1050 V1085 I1086	V1002-L1035 HydrophobicContact CG2-CD2 3.97Å; M1005-L1035 HydrophobicContact CE-CD2 4.47Å; M1005-L1035 HydrophobicContact CE-CG 4.21Å; L1031-L1035 HydrophobicContact CB-CD1 4.35Å; L1031-L1035 WeakPolarHBondContact O-CB 3.3Å; L1031-L1035 VanDerWaalsContact O-CG 3.32Å; L1031-L1035 WeakPolarHBondContact O-CG 3.4Å; L1031-L1035 PolarHBondContact O-N 3.24Å; W1032-L1035 HydrophobicContact CE3-CB 4.32Å; W1032-L1035 PolarHBondContact O-N 3.02Å; L1035-V1037 PolarHBondContact O-N 2.95Å; L1035-L1038 HydrophobicContact CD2-CD1 4.48Å; L1035-L1038 PolarHBondContact O-N 2.98Å; L1035-M1039 HydrophobicContact CB-SD 4.17Å; L1035-M1039 HydrophobicContact CD2-SD 4.48Å; L1035-M1039 WeakPolarHBondContact O-CB 3.47Å; L1035-M1039 VanDerWaalsContact O-CG 3.26Å; L1035-M1039 WeakPolarHBondContact O-CG 3.5Å; L1035-M1039 PolarHBondContact O-N 3.06Å; L1035-M1050 HydrophobicContact CD2-SD 4.17Å; L1035-V1085 HydrophobicContact CD1-CB 4.28Å; L1035-V1085 HydrophobicContact CD1-CG1 3.75Å; L1035-I1086 HydrophobicContact CD1-CG1 4.04Å; L1035-I1086 HydrophobicContact CD2-CD1 4.29Å; L1035-I1086 HydrophobicContact CD2-CG1 4.19Å
1036	E	93.3	Very high	90.3	Very high	63 Å²	63	43.2 Å²	43.2	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-52.8	-39.8	174.6	-173	-178.6	147	0	0	111.7	R969 W1032 M1034 T1040	R969-E1036 IonicContact CZ-OE1 2.66Å; R969-E1036 IonicContact CZ-OE2 2.86Å; R969-E1036 IonicContact NH1-OE1 3.46Å; R969-E1036 PolarHBondContact NH1-OE1 3.2Å; R969-E1036 IonicContact NH1-OE2 2.86Å; R969-E1036 PolarHBondContact NH1-OE2 3.31Å; R969-E1036 IonicContact NH2-OE1 3.45Å; R969-E1036 IonicContact NH2-OE2 3.53Å; R969-E1036 PolarHBondContact NH2-OE2 3.32Å; W1032-E1036 HydrophobicContact CD2-CB 4Å; W1032-E1036 HydrophobicContact CE3-CB 4.17Å; W1032-E1036 HydrophobicContact CH2-CB 3.86Å; W1032-E1036 HydrophobicContact CH2-CG 3.94Å; W1032-E1036 HydrophobicContact CZ2-CB 3.65Å; W1032-E1036 HydrophobicContact CZ2-CG 3.49Å; W1032-E1036 VanDerWaalsContact CZ2-CG 3.49Å; W1032-E1036 HydrophobicContact CZ3-CB 4.1Å; W1032-E1036 PolarHBondContact NE1-OE2 3.27Å; W1032-E1036 WeakPolarHBondContact O-CB 3.44Å; W1032-E1036 PolarHBondContact O-N 2.83Å; M1034-E1036 VanDerWaalsContact C-N 3.34Å; M1034-E1036 PolarHBondContact O-N 3.49Å; E1036-T1040 PolarHBondContact O-N 3.09Å; E1036-T1040 PolarHBondContact O-OG1 2.97Å
1037	V	92.6	Very high	90.3	Very high	12 Å²	12	40.4 Å²	40.4	7%	0.073	20%	0.2	C	C	.	.	H	α-helix	trans	-78.3	-41.3	-178.3	-167.9	0	0	0	0	111.8	L972 L973 I976 M1034 L1035 T1040	L972-V1037 HydrophobicContact CB-CG1 4.11Å; L972-V1037 HydrophobicContact CB-CG2 4.45Å; L972-V1037 HydrophobicContact CD1-CG2 4.45Å; L973-V1037 HydrophobicContact CB-CG1 4.36Å; L973-V1037 HydrophobicContact CD2-CG1 3.57Å; L973-V1037 HydrophobicContact CG-CG1 3.63Å; I976-V1037 HydrophobicContact CD1-CB 4.18Å; I976-V1037 HydrophobicContact CD1-CG1 3.61Å; M1034-V1037 PolarHBondContact O-N 3.48Å; M1034-V1037 VanDerWaalsContact O-N 3.13Å; L1035-V1037 PolarHBondContact O-N 2.95Å; V1037-T1040 WeakPolarHBondContact O-CB 3.43Å; V1037-T1040 PolarHBondContact O-OG1 3.09Å
1038	L	91.9	Very high	90.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-43	176.7	-67.9	163.3	0	0	0	111.8	I976 R980 P998 V1001 V1002 M1034 L1035 T1040 M1050	I976-L1038 HydrophobicContact CD1-CD2 3.76Å; I976-L1038 HydrophobicContact CD1-CG 4.21Å; I976-L1038 HydrophobicContact CG1-CD2 4.08Å; R980-L1038 PolarHBondContact NH2-O 2.86Å; R980-L1038 VanDerWaalsContact NH2-O 3.15Å; P998-L1038 HydrophobicContact CB-CD2 3.87Å; V1001-L1038 HydrophobicContact CG1-CD1 3.63Å; V1001-L1038 HydrophobicContact CG1-CD2 4.33Å; V1002-L1038 HydrophobicContact CG2-CD1 3.99Å; M1034-L1038 HydrophobicContact CG-CD1 4.01Å; M1034-L1038 PolarHBondContact O-N 3.01Å; M1034-L1038 VanDerWaalsContact O-N 3.15Å; L1035-L1038 HydrophobicContact CD2-CD1 4.48Å; L1035-L1038 PolarHBondContact O-N 2.98Å; L1038-T1040 VanDerWaalsContact C-N 3.28Å; L1038-T1040 PolarHBondContact O-N 2.65Å; L1038-M1050 HydrophobicContact CB-CE 4.14Å; L1038-M1050 HydrophobicContact CB-SD 3.79Å; L1038-M1050 HydrophobicContact CD1-SD 3.91Å; L1038-M1050 HydrophobicContact CG-SD 4.39Å
1039	M	91.2	Very high	89.9	Confident	21 Å²	21	39.1 Å²	39.1	10%	0.103	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	1.1	-178	-61.4	176	71	0	0	113.8	L1035 K1041 H1047 M1050 I1086 K1089	L1035-M1039 HydrophobicContact CB-SD 4.17Å; L1035-M1039 HydrophobicContact CD2-SD 4.48Å; L1035-M1039 WeakPolarHBondContact O-CB 3.47Å; L1035-M1039 VanDerWaalsContact O-CG 3.26Å; L1035-M1039 WeakPolarHBondContact O-CG 3.5Å; L1035-M1039 PolarHBondContact O-N 3.06Å; M1039-K1041 PolarHBondContact O-N 3.02Å; M1039-K1041 VanDerWaalsContact O-N 3.15Å; M1039-H1047 VanDerWaalsContact CA-NE2 3.3Å; M1039-H1047 WeakPolarHBondContact CA-NE2 3.43Å; M1039-H1047 PolarHBondContact O-CE1 3.31Å; M1039-H1047 PolarHBondContact O-NE2 3.36Å; M1039-M1050 HydrophobicContact CG-CE 3.63Å; M1039-I1086 HydrophobicContact CE-CG2 4.22Å; M1039-I1086 HydrophobicContact SD-CG1 4.24Å; M1039-K1089 HydrophobicContact CE-CB 4.11Å
1040	T	86.3	Confident	89.9	Confident	94 Å²	94	35.8 Å²	35.8	58%	0.577	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.2	170.9	-67.3	0	0	0	0	111.9	E1036 V1037 L1038	E1036-T1040 PolarHBondContact O-N 3.09Å; E1036-T1040 PolarHBondContact O-OG1 2.97Å; V1037-T1040 WeakPolarHBondContact O-CB 3.43Å; V1037-T1040 PolarHBondContact O-OG1 3.09Å; L1038-T1040 VanDerWaalsContact C-N 3.28Å; L1038-T1040 PolarHBondContact O-N 2.65Å
1041	K	80.7	Confident	89.7	Confident	117 Å²	117	37.5 Å²	37.5	51%	0.509	19%	0.186	S	C	.	.			trans	-147.6	118.8	172.5	-71	-169.4	178.4	-177.4	0	112.9	R980 M1039 E1043 S1046	R980-K1041 PolarHBondContact NH1-O 3.41Å; R980-K1041 VanDerWaalsContact NH1-O 3.17Å; M1039-K1041 PolarHBondContact O-N 3.02Å; M1039-K1041 VanDerWaalsContact O-N 3.15Å; K1041-E1043 HydrophobicContact CB-CG 4.21Å; K1041-E1043 VanDerWaalsContact CD-CD 3.5Å; K1041-E1043 HydrophobicContact CD-CG 4.21Å; K1041-E1043 WeakPolarHBondContact CD-OE1 3.49Å; K1041-E1043 IonicContact NZ-OE1 3.68Å; K1041-E1043 PolarHBondContact NZ-OE1 2.88Å; K1041-E1043 PolarHBondContact O-N 3.22Å; K1041-S1046 PolarHBondContact O-OG 2.79Å
1042	N	82.7	Confident	89.6	Confident	46 Å²	46	40.3 Å²	40.3	25%	0.246	20%	0.199	C	C	.	.			trans	-77.4	67.5	168.1	-169	48.4	0	0	0	111.8	N1045 S1046 H1047 L1092	N1042-N1045 WeakPolarHBondContact OD1-CA 3.39Å; N1042-S1046 PolarHBondContact OD1-N 2.87Å; N1042-H1047 PolarHBondContact N-NE2 3.02Å; N1042-H1047 WeakPolarHBondContact OD1-CB 3.27Å; N1042-H1047 PolarHBondContact OD1-CD2 3.35Å; N1042-H1047 VanDerWaalsContact OD1-CG 3.31Å; N1042-H1047 PolarHBondContact OD1-N 2.88Å; N1042-L1092 HydrophobicContact CB-CD1 4.15Å
1043	E	74.6	Confident	89.5	Confident	77 Å²	77	37.1 Å²	37.1	36%	0.36	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-80.2	128.4	170.9	-73.4	164.6	163.1	0	0	108.6	R980 K1041 N1045 S1046	R980-E1043 WeakPolarHBondContact CD-OE2 3.43Å; R980-E1043 IonicContact CZ-OE2 3.83Å; R980-E1043 IonicContact NE-OE2 3.77Å; R980-E1043 IonicContact NH1-OE2 2.9Å; R980-E1043 PolarHBondContact NH1-OE2 3.32Å; K1041-E1043 HydrophobicContact CB-CG 4.21Å; K1041-E1043 VanDerWaalsContact CD-CD 3.5Å; K1041-E1043 HydrophobicContact CD-CG 4.21Å; K1041-E1043 WeakPolarHBondContact CD-OE1 3.49Å; K1041-E1043 IonicContact NZ-OE1 3.68Å; K1041-E1043 PolarHBondContact NZ-OE1 2.88Å; K1041-E1043 PolarHBondContact O-N 3.22Å; E1043-N1045 PolarHBondContact O-N 3.2Å; E1043-S1046 WeakPolarHBondContact O-CB 3.47Å; E1043-S1046 PolarHBondContact O-N 3.07Å; E1043-S1046 PolarHBondContact O-OG 2.7Å
1044	N	79.1	Confident	89.5	Confident	148 Å²	148	36.7 Å²	36.7	79%	0.791	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	51.6	48.1	179	-58.5	-9.4	0	0	0	115.4	S1046	N1044-S1046 PolarHBondContact O-N 3.41Å
1045	N	85.3	Confident	89.4	Confident	63 Å²	63	39.6 Å²	39.6	34%	0.337	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	54.8	29.8	-178.2	-69.5	8.8	0	0	0	114.4	N1042 E1043 H1047 A1048 F1049 D1096	N1042-N1045 WeakPolarHBondContact OD1-CA 3.39Å; E1043-N1045 PolarHBondContact O-N 3.2Å; N1045-H1047 PolarHBondContact O-N 3.12Å; N1045-A1048 HydrophobicContact CB-CB 4.41Å; N1045-A1048 PolarHBondContact O-N 3.36Å; N1045-F1049 PolarHBondContact O-N 2.77Å; N1045-D1096 PolarHBondContact ND2-O 2.91Å
1046	S	87.7	Confident	89.3	Confident	5 Å²	5	40.4 Å²	40.4	4%	0.035	20%	0.203	C	C	.	.	H	α-helix	trans	-53.1	-30.7	179.5	60.3	0	0	0	0	113.9	K1041 N1042 E1043 N1044 F1049 M1050	K1041-S1046 PolarHBondContact O-OG 2.79Å; N1042-S1046 PolarHBondContact OD1-N 2.87Å; E1043-S1046 WeakPolarHBondContact O-CB 3.47Å; E1043-S1046 PolarHBondContact O-N 3.07Å; E1043-S1046 PolarHBondContact O-OG 2.7Å; N1044-S1046 PolarHBondContact O-N 3.41Å; S1046-F1049 PolarHBondContact O-N 3.38Å; S1046-M1050 WeakPolarHBondContact O-CE 3.41Å; S1046-M1050 WeakPolarHBondContact O-CG 3.27Å; S1046-M1050 PolarHBondContact O-N 3.33Å
1047	H	92.6	Very high	89.4	Confident	9 Å²	9	37.4 Å²	37.4	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-68.5	-40.3	178.4	-65.6	-164	0	0	0	112.2	M1039 N1042 N1045 K1051 S1090 C1093	M1039-H1047 VanDerWaalsContact CA-NE2 3.3Å; M1039-H1047 WeakPolarHBondContact CA-NE2 3.43Å; M1039-H1047 PolarHBondContact O-CE1 3.31Å; M1039-H1047 PolarHBondContact O-NE2 3.36Å; N1042-H1047 PolarHBondContact N-NE2 3.02Å; N1042-H1047 WeakPolarHBondContact OD1-CB 3.27Å; N1042-H1047 PolarHBondContact OD1-CD2 3.35Å; N1042-H1047 VanDerWaalsContact OD1-CG 3.31Å; N1042-H1047 PolarHBondContact OD1-N 2.88Å; N1045-H1047 PolarHBondContact O-N 3.12Å; H1047-K1051 PolarHBondContact O-N 3.36Å; H1047-S1090 VanDerWaalsContact ND1-CB 3.3Å; H1047-S1090 WeakPolarHBondContact ND1-CB 3.41Å; H1047-S1090 PolarHBondContact ND1-OG 3.07Å; H1047-C1093 HydrophobicContact CB-CB 4.22Å
1048	A	91.5	Very high	89.4	Confident	3 Å²	3	37.7 Å²	37.7	3%	0.025	19%	0.189	C	C	.	.	H	α-helix	trans	-69.8	-39.7	173.4	0	0	0	0	0	111.1	N1045 M1050 K1051 K1052 A1095	N1045-A1048 HydrophobicContact CB-CB 4.41Å; N1045-A1048 PolarHBondContact O-N 3.36Å; A1048-M1050 PolarHBondContact O-N 2.79Å; A1048-K1051 WeakPolarHBondContact O-CB 3.29Å; A1048-K1051 PolarHBondContact O-N 2.98Å; A1048-K1052 WeakPolarHBondContact O-CB 3.25Å; A1048-K1052 PolarHBondContact O-N 3.25Å; A1048-A1095 WeakPolarHBondContact CB-O 3.11Å
1049	F	92.1	Very high	89.5	Confident	15 Å²	15	40.3 Å²	40.3	7%	0.066	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-43.6	177.5	-165.8	-130.5	0	0	0	112.4	L997 E999 Y1000 N1045 S1046 K1052 M1053 S1097 P1098 K1099 P1101	L997-F1049 HydrophobicContact CD2-CD1 4.02Å; L997-F1049 HydrophobicContact CD2-CE1 3.55Å; E999-F1049 HydrophobicContact CB-CD1 4.05Å; Y1000-F1049 HydrophobicContact CD2-CE1 4.28Å; Y1000-F1049 AromaticContact CE2-CE1 3.79Å; Y1000-F1049 HydrophobicContact CE2-CE1 3.79Å; Y1000-F1049 AromaticContact CE2-CZ 3.72Å; Y1000-F1049 HydrophobicContact CE2-CZ 3.72Å; Y1000-F1049 AromaticContact CZ-CZ 3.82Å; N1045-F1049 PolarHBondContact O-N 2.77Å; S1046-F1049 PolarHBondContact O-N 3.38Å; F1049-K1052 PolarHBondContact O-N 3.47Å; F1049-M1053 HydrophobicContact CD1-CE 3.63Å; F1049-M1053 HydrophobicContact CE1-CE 3.18Å; F1049-M1053 HydrophobicContact CE2-CE 4.19Å; F1049-M1053 HydrophobicContact CG-CE 4.28Å; F1049-M1053 HydrophobicContact CZ-CE 3.51Å; F1049-M1053 WeakPolarHBondContact O-CG 3.32Å; F1049-M1053 PolarHBondContact O-N 3.17Å; F1049-S1097 WeakPolarHBondContact CD2-OG 3.49Å; F1049-P1098 HydrophobicContact CB-CG 4.2Å; F1049-P1098 HydrophobicContact CD2-CG 4.21Å; F1049-P1098 HydrophobicContact CG-CG 4.26Å; F1049-K1099 HydrophobicContact CE2-CB 4.5Å; F1049-K1099 WeakPolarHBondContact CE2-O 3.42Å; F1049-P1101 HydrophobicContact CD2-CB 4.47Å; F1049-P1101 HydrophobicContact CE2-CB 3.74Å; F1049-P1101 HydrophobicContact CE2-CG 4.39Å; F1049-P1101 HydrophobicContact CZ-CB 4.05Å
1050	M	93.5	Very high	89.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-37.4	174.7	-72.8	-176.6	-71.8	0	0	112.8	E999 V1002 L1035 L1038 M1039 S1046 A1048 M1053 A1054 I1086	E999-M1050 HydrophobicContact CB-CG 3.77Å; E999-M1050 HydrophobicContact CB-SD 4.37Å; E999-M1050 HydrophobicContact CG-CE 4.44Å; E999-M1050 HydrophobicContact CG-CG 3.82Å; E999-M1050 HydrophobicContact CG-SD 4.06Å; V1002-M1050 HydrophobicContact CG2-CB 4.41Å; V1002-M1050 HydrophobicContact CG2-CG 3.95Å; V1002-M1050 HydrophobicContact CG2-SD 3.9Å; L1035-M1050 HydrophobicContact CD2-SD 4.17Å; L1038-M1050 HydrophobicContact CB-CE 4.14Å; L1038-M1050 HydrophobicContact CB-SD 3.79Å; L1038-M1050 HydrophobicContact CD1-SD 3.91Å; L1038-M1050 HydrophobicContact CG-SD 4.39Å; M1039-M1050 HydrophobicContact CG-CE 3.63Å; S1046-M1050 WeakPolarHBondContact O-CE 3.41Å; S1046-M1050 WeakPolarHBondContact O-CG 3.27Å; S1046-M1050 PolarHBondContact O-N 3.33Å; A1048-M1050 PolarHBondContact O-N 2.79Å; M1050-M1053 PolarHBondContact O-N 2.77Å; M1050-A1054 PolarHBondContact O-N 3.23Å; M1050-I1086 HydrophobicContact CB-CD1 4.31Å
1051	K	93.6	Very high	89.9	Confident	36 Å²	36	38 Å²	38	16%	0.157	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-49.4	173	-169.9	-163.4	178	-153.6	0	110.6	H1047 A1048 M1053 A1054 E1055 L1083 I1086 N1087 C1093 N1094	H1047-K1051 PolarHBondContact O-N 3.36Å; A1048-K1051 WeakPolarHBondContact O-CB 3.29Å; A1048-K1051 PolarHBondContact O-N 2.98Å; K1051-M1053 VanDerWaalsContact C-N 3.27Å; K1051-M1053 PolarHBondContact O-N 3.45Å; K1051-A1054 PolarHBondContact O-N 2.84Å; K1051-E1055 WeakPolarHBondContact CD-OE1 3.28Å; K1051-E1055 WeakPolarHBondContact CE-OE1 3.5Å; K1051-E1055 IonicContact NZ-OE1 3.22Å; K1051-E1055 PolarHBondContact NZ-OE1 2.96Å; K1051-E1055 WeakPolarHBondContact O-CG 3.01Å; K1051-E1055 PolarHBondContact O-N 3.1Å; K1051-L1083 HydrophobicContact CG-CD2 3.7Å; K1051-I1086 HydrophobicContact CB-CG2 4.2Å; K1051-N1087 WeakPolarHBondContact CE-OD1 3.48Å; K1051-C1093 HydrophobicContact CB-CB 4.21Å; K1051-C1093 HydrophobicContact CD-CB 4.09Å; K1051-C1093 WeakPolarHBondContact CD-O 3.39Å; K1051-N1094 PolarHBondContact NZ-OD1 3.3Å
1052	K	93.2	Very high	90.6	Very high	60 Å²	60	32.5 Å²	32.5	26%	0.261	16%	0.159	S	C	.	.	H	α-helix	trans	-62.7	-30.4	-179.9	-172.7	53.3	174.3	155.4	0	113.1	A1048 F1049 E1055 N1056 P1101	A1048-K1052 WeakPolarHBondContact O-CB 3.25Å; A1048-K1052 PolarHBondContact O-N 3.25Å; F1049-K1052 PolarHBondContact O-N 3.47Å; K1052-E1055 WeakPolarHBondContact CD-OE2 3.4Å; K1052-N1056 WeakPolarHBondContact CD-OD1 3.34Å; K1052-N1056 WeakPolarHBondContact CE-OD1 3.37Å; K1052-N1056 PolarHBondContact NZ-OD1 3.03Å; K1052-N1056 WeakPolarHBondContact O-CB 3.33Å; K1052-N1056 VanDerWaalsContact O-CG 3.3Å; K1052-N1056 PolarHBondContact O-N 3.22Å; K1052-N1056 PolarHBondContact O-OD1 3.24Å; K1052-P1101 HydrophobicContact CG-CG 4.13Å
1053	M	93.7	Very high	91.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-49.8	169	-75.6	178.9	-171.5	0	0	112.3	Y1000 P1003 F1049 M1050 K1051 E1055 N1056 I1057 P1101	Y1000-M1053 HydrophobicContact CD1-CE 3.55Å; Y1000-M1053 HydrophobicContact CD1-SD 4.27Å; Y1000-M1053 HydrophobicContact CD2-CE 3.9Å; Y1000-M1053 HydrophobicContact CE1-CE 3.53Å; Y1000-M1053 HydrophobicContact CE2-CE 3.88Å; Y1000-M1053 HydrophobicContact CG-CE 3.73Å; P1003-M1053 VanDerWaalsContact CD-SD 3.56Å; P1003-M1053 HydrophobicContact CG-CB 4.22Å; P1003-M1053 HydrophobicContact CG-CG 4.24Å; P1003-M1053 HydrophobicContact CG-SD 3.79Å; F1049-M1053 HydrophobicContact CD1-CE 3.63Å; F1049-M1053 HydrophobicContact CE1-CE 3.18Å; F1049-M1053 HydrophobicContact CE2-CE 4.19Å; F1049-M1053 HydrophobicContact CG-CE 4.28Å; F1049-M1053 HydrophobicContact CZ-CE 3.51Å; F1049-M1053 WeakPolarHBondContact O-CG 3.32Å; F1049-M1053 PolarHBondContact O-N 3.17Å; M1050-M1053 PolarHBondContact O-N 2.77Å; K1051-M1053 VanDerWaalsContact C-N 3.27Å; K1051-M1053 PolarHBondContact O-N 3.45Å; M1053-E1055 VanDerWaalsContact C-N 3.33Å; M1053-E1055 PolarHBondContact O-N 2.96Å; M1053-N1056 PolarHBondContact O-N 3.45Å; M1053-I1057 WeakPolarHBondContact O-CD1 3.25Å; M1053-I1057 VanDerWaalsContact O-CG1 3.26Å; M1053-I1057 WeakPolarHBondContact O-CG1 3.47Å; M1053-I1057 PolarHBondContact O-N 2.8Å; M1053-P1101 HydrophobicContact CB-CG 4.43Å; M1053-P1101 HydrophobicContact CE-CB 3.89Å; M1053-P1101 HydrophobicContact CG-CB 3.5Å; M1053-P1101 HydrophobicContact CG-CG 3.72Å
1054	A	94.8	Very high	92	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.9	-34.3	-179.5	0	0	0	0	0	112.4	I1006 M1050 K1051 L1083	I1006-A1054 HydrophobicContact CD1-CB 4.01Å; M1050-A1054 PolarHBondContact O-N 3.23Å; K1051-A1054 PolarHBondContact O-N 2.84Å; A1054-L1083 HydrophobicContact CB-CD2 3.8Å; A1054-L1083 HydrophobicContact CB-CG 3.89Å
1055	E	92.8	Very high	92.7	Very high	61 Å²	61	26.2 Å²	26.2	29%	0.285	13%	0.134	S	C	.	.	H	α-helix	trans	-61.5	-53.2	168.8	-68.9	168.5	177.7	0	0	111.4	K1051 K1052 M1053 I1057 K1058 L1083	K1051-E1055 WeakPolarHBondContact CD-OE1 3.28Å; K1051-E1055 WeakPolarHBondContact CE-OE1 3.5Å; K1051-E1055 IonicContact NZ-OE1 3.22Å; K1051-E1055 PolarHBondContact NZ-OE1 2.96Å; K1051-E1055 WeakPolarHBondContact O-CG 3.01Å; K1051-E1055 PolarHBondContact O-N 3.1Å; K1052-E1055 WeakPolarHBondContact CD-OE2 3.4Å; M1053-E1055 VanDerWaalsContact C-N 3.33Å; M1053-E1055 PolarHBondContact O-N 2.96Å; E1055-I1057 VanDerWaalsContact C-N 3.26Å; E1055-I1057 PolarHBondContact O-N 3.22Å; E1055-K1058 PolarHBondContact O-N 2.75Å; E1055-L1083 HydrophobicContact CG-CD1 4.49Å; E1055-L1083 HydrophobicContact CG-CD2 4.03Å
1056	N	92.7	Very high	92.9	Very high	18 Å²	18	25.2 Å²	25.2	10%	0.096	13%	0.131	C	C	.	.	H	α-helix	trans	-62.2	-30.3	-178.6	-75.7	11.2	0	0	0	112.7	K1052 M1053 K1058 L1059 D1100 L1103	K1052-N1056 WeakPolarHBondContact CD-OD1 3.34Å; K1052-N1056 WeakPolarHBondContact CE-OD1 3.37Å; K1052-N1056 PolarHBondContact NZ-OD1 3.03Å; K1052-N1056 WeakPolarHBondContact O-CB 3.33Å; K1052-N1056 VanDerWaalsContact O-CG 3.3Å; K1052-N1056 PolarHBondContact O-N 3.22Å; K1052-N1056 PolarHBondContact O-OD1 3.24Å; M1053-N1056 PolarHBondContact O-N 3.45Å; N1056-K1058 VanDerWaalsContact C-N 3.29Å; N1056-K1058 PolarHBondContact O-N 3.49Å; N1056-L1059 WeakPolarHBondContact O-CB 3.3Å; N1056-L1059 PolarHBondContact O-N 3.01Å; N1056-L1059 VanDerWaalsContact O-N 3.14Å; N1056-D1100 PolarHBondContact ND2-OD1 3.21Å; N1056-L1103 HydrophobicContact CB-CD1 4.04Å
1057	I	94.4	Very high	93.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-27.7	175.6	-67.6	161.1	0	0	0	112.1	P1003 I1006 M1053 E1055 L1059 T1060 L1075 C1079 L1103 F1108	P1003-I1057 HydrophobicContact CB-CD1 3.87Å; P1003-I1057 HydrophobicContact CG-CD1 4.15Å; I1006-I1057 HydrophobicContact CD1-CD1 4.03Å; I1006-I1057 HydrophobicContact CG2-CD1 4.47Å; I1006-I1057 HydrophobicContact CG2-CG2 4.48Å; M1053-I1057 WeakPolarHBondContact O-CD1 3.25Å; M1053-I1057 VanDerWaalsContact O-CG1 3.26Å; M1053-I1057 WeakPolarHBondContact O-CG1 3.47Å; M1053-I1057 PolarHBondContact O-N 2.8Å; E1055-I1057 VanDerWaalsContact C-N 3.26Å; E1055-I1057 PolarHBondContact O-N 3.22Å; I1057-L1059 PolarHBondContact O-N 3.42Å; I1057-T1060 PolarHBondContact O-N 3.27Å; I1057-T1060 PolarHBondContact O-OG1 2.68Å; I1057-T1060 VanDerWaalsContact O-OG1 3.07Å; I1057-L1075 HydrophobicContact CG2-CD1 4.05Å; I1057-L1075 HydrophobicContact CG2-CD2 4.1Å; I1057-L1075 HydrophobicContact CG2-CG 4.05Å; I1057-C1079 WeakPolarHBondContact CG2-SG 3.47Å; I1057-L1103 HydrophobicContact CB-CD1 4.4Å; I1057-L1103 HydrophobicContact CD1-CD2 4.25Å; I1057-L1103 HydrophobicContact CG1-CD1 3.67Å; I1057-L1103 HydrophobicContact CG1-CD2 3.73Å; I1057-L1103 HydrophobicContact CG1-CG 4.37Å; I1057-F1108 HydrophobicContact CB-CE1 4.4Å; I1057-F1108 HydrophobicContact CD1-CE1 4.18Å; I1057-F1108 HydrophobicContact CD1-CZ 4Å; I1057-F1108 HydrophobicContact CG1-CD1 4.23Å; I1057-F1108 HydrophobicContact CG1-CE1 3.95Å; I1057-F1108 HydrophobicContact CG1-CZ 4.14Å; I1057-F1108 HydrophobicContact CG2-CD1 3.87Å; I1057-F1108 HydrophobicContact CG2-CE1 3.55Å; I1057-F1108 HydrophobicContact CG2-CZ 4.41Å
1058	K	93.7	Very high	93	Very high	18 Å²	18	36.5 Å²	36.5	8%	0.078	19%	0.188	C	C	.	.	H	α-helix	trans	-69.4	-20.9	173.9	-66.8	-172.8	66.8	175.3	0	112.7	E1055 N1056 Y1076 C1079 D1080 L1083 N1117 K1119	E1055-K1058 PolarHBondContact O-N 2.75Å; N1056-K1058 VanDerWaalsContact C-N 3.29Å; N1056-K1058 PolarHBondContact O-N 3.49Å; K1058-Y1076 HydrophobicContact CB-CD1 4.41Å; K1058-Y1076 HydrophobicContact CG-CD1 4.34Å; K1058-C1079 HydrophobicContact CD-CB 4.12Å; K1058-C1079 HydrophobicContact CG-CB 3.74Å; K1058-D1080 WeakPolarHBondContact CD-OD1 3.36Å; K1058-D1080 WeakPolarHBondContact CE-OD1 3.3Å; K1058-D1080 VanDerWaalsContact NZ-CG 3.27Å; K1058-D1080 IonicContact NZ-OD1 2.63Å; K1058-D1080 PolarHBondContact NZ-OD1 3.5Å; K1058-D1080 IonicContact NZ-OD2 3.19Å; K1058-D1080 PolarHBondContact NZ-OD2 3.39Å; K1058-L1083 HydrophobicContact CD-CD1 4.41Å; K1058-N1117 HydrophobicContact CB-CB 4.49Å; K1058-N1117 WeakPolarHBondContact CE-O 3.34Å; K1058-N1117 WeakPolarHBondContact O-CB 3.46Å; K1058-N1117 PolarHBondContact O-ND2 3.29Å; K1058-K1119 PolarHBondContact NZ-O 2.92Å
1059	L	92.4	Very high	92.9	Very high	56 Å²	56	40.3 Å²	40.3	29%	0.293	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0.6	177.5	-53	178.6	0	0	0	113.2	N1056 I1057 P1111 F1115	N1056-L1059 WeakPolarHBondContact O-CB 3.3Å; N1056-L1059 PolarHBondContact O-N 3.01Å; N1056-L1059 VanDerWaalsContact O-N 3.14Å; I1057-L1059 PolarHBondContact O-N 3.42Å; L1059-P1111 HydrophobicContact CB-CB 4.19Å; L1059-P1111 VanDerWaalsContact O-CA 3.28Å; L1059-P1111 WeakPolarHBondContact O-CA 3.43Å; L1059-P1111 WeakPolarHBondContact O-CB 3.25Å; L1059-F1115 WeakPolarHBondContact O-CD1 3.39Å
1060	T	92.9	Very high	92.9	Very high	2 Å²	2	47 Å²	47	1%	0.012	24%	0.244	C	C	.	.	S	Bend	trans	-113.6	172.8	174.3	64.6	0	0	0	0	110.4	I1057 Y1076 L1103 F1108 T1109 P1111	I1057-T1060 PolarHBondContact O-N 3.27Å; I1057-T1060 PolarHBondContact O-OG1 2.68Å; I1057-T1060 VanDerWaalsContact O-OG1 3.07Å; T1060-Y1076 VanDerWaalsContact O-CE1 3.28Å; T1060-Y1076 WeakPolarHBondContact O-CE1 3.16Å; T1060-Y1076 PolarHBondContact O-OH 3.14Å; T1060-L1103 HydrophobicContact CG2-CD1 3.84Å; T1060-F1108 HydrophobicContact CG2-CB 4.4Å; T1060-T1109 WeakPolarHBondContact CB-O 3.47Å; T1060-T1109 WeakPolarHBondContact CG2-O 3.26Å; T1060-P1111 HydrophobicContact CG2-CB 4.16Å
1061	R	93.5	Very high	92.8	Very high	65 Å²	65	47.9 Å²	47.9	25%	0.245	25%	0.249	C	C	.	.			trans	-106.3	160.5	164.8	-63.8	-169.2	-163.2	113.3	19.1	110.5	A1063 P1066 N1072 F1108 T1109 E1112	R1061-A1063 PolarHBondContact O-N 2.96Å; R1061-P1066 HydrophobicContact CB-CB 4.18Å; R1061-P1066 VanDerWaalsContact CD-O 3.27Å; R1061-P1066 WeakPolarHBondContact CD-O 3.49Å; R1061-N1072 WeakPolarHBondContact CA-OD1 3.45Å; R1061-N1072 WeakPolarHBondContact CB-OD1 3.38Å; R1061-F1108 WeakPolarHBondContact O-CA 3.37Å; R1061-T1109 HydrophobicContact CB-CG2 3.88Å; R1061-T1109 PolarHBondContact N-OG1 3.2Å; R1061-T1109 PolarHBondContact O-N 3.34Å; R1061-E1112 IonicContact CZ-OE1 3.28Å; R1061-E1112 VanDerWaalsContact CZ-OE1 3.23Å; R1061-E1112 IonicContact CZ-OE2 3.65Å; R1061-E1112 IonicContact NH1-OE1 2.8Å; R1061-E1112 PolarHBondContact NH1-OE1 3.14Å; R1061-E1112 IonicContact NH1-OE2 3.46Å; R1061-E1112 IonicContact NH2-OE1 2.61Å; R1061-E1112 PolarHBondContact NH2-OE1 3.36Å; R1061-E1112 IonicContact NH2-OE2 3.11Å; R1061-E1112 PolarHBondContact NH2-OE2 3.47Å
1062	D	94.7	Very high	92.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-59.7	123.2	169.8	-175	-79.4	0	0	0	110.3	H1007 H1011 Q1064 S1065 P1066 T1071 N1072 L1075	H1007-D1062 IonicContact CD2-OD2 2.71Å; H1007-D1062 IonicContact NE2-OD2 3.01Å; H1011-D1062 IonicContact CD2-OD2 3.89Å; H1011-D1062 IonicContact CE1-OD1 3.76Å; H1011-D1062 IonicContact CE1-OD2 3.04Å; H1011-D1062 IonicContact NE2-OD1 2.72Å; H1011-D1062 IonicContact NE2-OD2 3.33Å; H1011-D1062 PolarHBondContact NE2-OD2 3.16Å; D1062-Q1064 VanDerWaalsContact C-N 3.31Å; D1062-Q1064 PolarHBondContact O-N 3.45Å; D1062-Q1064 WeakPolarHBondContact OD1-CA 3.32Å; D1062-Q1064 WeakPolarHBondContact OD1-CB 3.34Å; D1062-Q1064 PolarHBondContact OD1-N 3.23Å; D1062-S1065 CarbonylContact O-C 3.57Å; D1062-S1065 PolarHBondContact OD1-N 3.09Å; D1062-P1066 WeakPolarHBondContact O-CA 3.42Å; D1062-P1066 VanDerWaalsContact O-CB 3.31Å; D1062-P1066 WeakPolarHBondContact O-CB 3.47Å; D1062-P1066 WeakPolarHBondContact O-CD 3.49Å; D1062-T1071 HydrophobicContact CB-CG2 4.29Å; D1062-N1072 PolarHBondContact N-OD1 3.05Å; D1062-L1075 HydrophobicContact CB-CD2 4.07Å
1063	A	94.3	Very high	92.8	Very high	37 Å²	37	46.7 Å²	46.7	31%	0.306	25%	0.246	S	C	.	.	S	Bend	trans	-78.9	-13.5	-176.5	0	0	0	0	0	113.9	R1061 F1107	R1061-A1063 PolarHBondContact O-N 2.96Å; A1063-F1107 WeakPolarHBondContact CB-O 3.43Å; A1063-F1107 PolarHBondContact N-O 3.01Å
1064	Q	94	Very high	92.9	Very high	59 Å²	59	48.5 Å²	48.5	28%	0.276	25%	0.253	S	S	.	.	S	Bend	trans	-85.3	-26.7	178	-177.9	172.3	-8.4	0	0	111.3	H1007 D1062	H1007-Q1064 PolarHBondContact CE1-OE1 3.49Å; D1062-Q1064 VanDerWaalsContact C-N 3.31Å; D1062-Q1064 PolarHBondContact O-N 3.45Å; D1062-Q1064 WeakPolarHBondContact OD1-CA 3.32Å; D1062-Q1064 WeakPolarHBondContact OD1-CB 3.34Å; D1062-Q1064 PolarHBondContact OD1-N 3.23Å
1065	S	92.5	Very high	92.9	Very high	43 Å²	43	48.5 Å²	48.5	30%	0.301	25%	0.253	S	S	.	.	S	Bend	trans	-151.6	70.2	172.2	-71.1	0	0	0	0	112.6	D1062 D1067 E1068 N1072	D1062-S1065 CarbonylContact O-C 3.57Å; D1062-S1065 PolarHBondContact OD1-N 3.09Å; S1065-D1067 VanDerWaalsContact C-N 3.29Å; S1065-D1067 PolarHBondContact O-N 3.11Å; S1065-E1068 PolarHBondContact O-N 2.97Å; S1065-E1068 VanDerWaalsContact O-N 3.08Å; S1065-N1072 PolarHBondContact O-ND2 3.38Å
1066	P	90.2	Very high	93	Very high	43 Å²	43	46.1 Å²	46.1	28%	0.279	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-27.3	-172	24.8	-34.3	0	0	0	113.9	R1061 D1062 N1072 T1109	R1061-P1066 HydrophobicContact CB-CB 4.18Å; R1061-P1066 VanDerWaalsContact CD-O 3.27Å; R1061-P1066 WeakPolarHBondContact CD-O 3.49Å; D1062-P1066 WeakPolarHBondContact O-CA 3.42Å; D1062-P1066 VanDerWaalsContact O-CB 3.31Å; D1062-P1066 WeakPolarHBondContact O-CB 3.47Å; D1062-P1066 WeakPolarHBondContact O-CD 3.49Å; P1066-N1072 PolarHBondContact O-ND2 3.33Å; P1066-T1109 HydrophobicContact CB-CG2 4.14Å
1067	D	91.3	Very high	93.2	Very high	158 Å²	158	45.2 Å²	45.2	85%	0.845	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.7	177.2	-55.1	-51.5	0	0	0	113	S1065 S1069	S1065-D1067 VanDerWaalsContact C-N 3.29Å; S1065-D1067 PolarHBondContact O-N 3.11Å; D1067-S1069 PolarHBondContact O-N 3.19Å
1068	E	91.6	Very high	93.3	Very high	92 Å²	92	45.2 Å²	45.2	43%	0.43	24%	0.237	S	C	.	.			trans	-85.8	98.6	-178.2	-170.2	178.2	-154.8	0	0	111.3	S1065 K1070 T1071 N1072	S1065-E1068 PolarHBondContact O-N 2.97Å; S1065-E1068 VanDerWaalsContact O-N 3.08Å; E1068-K1070 VanDerWaalsContact C-N 3.26Å; E1068-K1070 HydrophobicContact CG-CB 4.41Å; E1068-K1070 PolarHBondContact O-N 2.99Å; E1068-K1070 VanDerWaalsContact O-N 3.16Å; E1068-T1071 PolarHBondContact O-N 3Å; E1068-T1071 VanDerWaalsContact O-N 3.11Å; E1068-T1071 WeakPolarHBondContact OE2-CB 3.37Å; E1068-T1071 PolarHBondContact OE2-OG1 3.4Å; E1068-N1072 PolarHBondContact O-N 3.36Å; E1068-N1072 VanDerWaalsContact O-N 3.13Å; E1068-N1072 PolarHBondContact O-ND2 2.81Å
1069	S	89	Confident	93.4	Very high	84 Å²	84	44.4 Å²	44.4	59%	0.587	23%	0.234	S	C	*	.	H	α-helix	trans	-47.2	-44.5	177.2	168.5	0	0	0	0	113.4	D1067 T1071 N1072 E1073	D1067-S1069 PolarHBondContact O-N 3.19Å; S1069-T1071 PolarHBondContact O-N 3.4Å; S1069-N1072 PolarHBondContact O-N 2.9Å; S1069-E1073 WeakPolarHBondContact O-CG 3.22Å; S1069-E1073 PolarHBondContact O-N 3.43Å
1070	K	91.3	Very high	93.5	Very high	154 Å²	154	42.5 Å²	42.5	67%	0.67	22%	0.224	S	C	*	.	H	α-helix	trans	-64.3	-40	-178.9	-68.5	-178.2	179.7	176.8	0	113.7	E1068 E1073 K1074	E1068-K1070 VanDerWaalsContact C-N 3.26Å; E1068-K1070 HydrophobicContact CG-CB 4.41Å; E1068-K1070 PolarHBondContact O-N 2.99Å; E1068-K1070 VanDerWaalsContact O-N 3.16Å; K1070-E1073 PolarHBondContact O-N 2.93Å; K1070-K1074 WeakPolarHBondContact O-CG 3.25Å; K1070-K1074 PolarHBondContact O-N 3.31Å
1071	T	92.2	Very high	93.6	Very high	19 Å²	19	42.4 Å²	42.4	12%	0.117	22%	0.223	C	C	.	.	H	α-helix	trans	-71.4	-35.9	-179.9	-68.7	0	0	0	0	110.6	D1062 E1068 S1069 K1074 L1075	D1062-T1071 HydrophobicContact CB-CG2 4.29Å; E1068-T1071 PolarHBondContact O-N 3Å; E1068-T1071 VanDerWaalsContact O-N 3.11Å; E1068-T1071 WeakPolarHBondContact OE2-CB 3.37Å; E1068-T1071 PolarHBondContact OE2-OG1 3.4Å; S1069-T1071 PolarHBondContact O-N 3.4Å; T1071-K1074 PolarHBondContact O-N 2.71Å; T1071-L1075 PolarHBondContact O-N 3.05Å
1072	N	92.9	Very high	93.7	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.043	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-41.6	168.8	-71.4	-86.9	0	0	0	112.6	R1061 D1062 S1065 P1066 E1068 S1069 K1074 L1075 Y1076	R1061-N1072 WeakPolarHBondContact CA-OD1 3.45Å; R1061-N1072 WeakPolarHBondContact CB-OD1 3.38Å; D1062-N1072 PolarHBondContact N-OD1 3.05Å; S1065-N1072 PolarHBondContact O-ND2 3.38Å; P1066-N1072 PolarHBondContact O-ND2 3.33Å; E1068-N1072 PolarHBondContact O-N 3.36Å; E1068-N1072 VanDerWaalsContact O-N 3.13Å; E1068-N1072 PolarHBondContact O-ND2 2.81Å; S1069-N1072 PolarHBondContact O-N 2.9Å; N1072-K1074 PolarHBondContact O-N 3.11Å; N1072-L1075 WeakPolarHBondContact O-CB 3.44Å; N1072-L1075 PolarHBondContact O-N 3.2Å; N1072-L1075 VanDerWaalsContact O-N 3.17Å; N1072-Y1076 HydrophobicContact CB-CE2 3.87Å; N1072-Y1076 WeakPolarHBondContact O-CD2 3.42Å; N1072-Y1076 PolarHBondContact O-N 2.69Å
1073	E	93.3	Very high	93.6	Very high	63 Å²	63	40.3 Å²	40.3	29%	0.294	22%	0.217	S	C	.	.	H	α-helix	trans	-59.2	-43.6	173.3	-72.1	-163.8	140	0	0	112.2	S1069 K1070 L1075 Y1076 T1077 Y1121	S1069-E1073 WeakPolarHBondContact O-CG 3.22Å; S1069-E1073 PolarHBondContact O-N 3.43Å; K1070-E1073 PolarHBondContact O-N 2.93Å; E1073-L1075 VanDerWaalsContact C-N 3.34Å; E1073-L1075 PolarHBondContact O-N 2.77Å; E1073-Y1076 PolarHBondContact O-N 2.92Å; E1073-T1077 WeakPolarHBondContact O-CB 3.32Å; E1073-T1077 PolarHBondContact O-N 3.09Å; E1073-T1077 PolarHBondContact O-OG1 2.85Å; E1073-Y1121 HydrophobicContact CB-CD1 4.48Å; E1073-Y1121 HydrophobicContact CB-CE1 4.47Å; E1073-Y1121 HydrophobicContact CG-CD1 4.46Å; E1073-Y1121 HydrophobicContact CG-CE1 4.07Å
1074	K	95.4	Very high	93.5	Very high	38 Å²	38	39 Å²	39	17%	0.165	21%	0.206	C	C	.	.	H	α-helix	trans	-57.2	-47.3	173.3	-72.1	179.7	77.7	-163	0	111	A1010 F1015 K1070 T1071 N1072 T1077 V1078	A1010-K1074 WeakPolarHBondContact O-CE 3.49Å; A1010-K1074 PolarHBondContact O-NZ 2.88Å; F1015-K1074 HydrophobicContact CD1-CB 4.47Å; F1015-K1074 HydrophobicContact CD1-CG 4.5Å; F1015-K1074 HydrophobicContact CE1-CB 3.76Å; F1015-K1074 HydrophobicContact CE1-CD 4.49Å; F1015-K1074 HydrophobicContact CE1-CG 3.97Å; F1015-K1074 HydrophobicContact CZ-CB 4.4Å; F1015-K1074 HydrophobicContact CZ-CG 4.35Å; F1015-K1074 WeakPolarHBondContact O-CE 3.42Å; F1015-K1074 PolarHBondContact O-NZ 3.49Å; K1070-K1074 WeakPolarHBondContact O-CG 3.25Å; K1070-K1074 PolarHBondContact O-N 3.31Å; T1071-K1074 PolarHBondContact O-N 2.71Å; N1072-K1074 PolarHBondContact O-N 3.11Å; K1074-T1077 PolarHBondContact O-N 2.86Å; K1074-V1078 WeakPolarHBondContact O-CG2 3.46Å; K1074-V1078 PolarHBondContact O-N 3.4Å
1075	L	95.6	Very high	93.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.2	-51	179	-179.4	62.2	0	0	0	112	I1006 A1010 I1057 D1062 T1071 N1072 E1073 T1077 V1078 C1079 F1108	I1006-L1075 HydrophobicContact CG2-CD1 3.71Å; A1010-L1075 HydrophobicContact CB-CB 4.29Å; A1010-L1075 HydrophobicContact CB-CD1 4.02Å; I1057-L1075 HydrophobicContact CG2-CD1 4.05Å; I1057-L1075 HydrophobicContact CG2-CD2 4.1Å; I1057-L1075 HydrophobicContact CG2-CG 4.05Å; D1062-L1075 HydrophobicContact CB-CD2 4.07Å; T1071-L1075 PolarHBondContact O-N 3.05Å; N1072-L1075 WeakPolarHBondContact O-CB 3.44Å; N1072-L1075 PolarHBondContact O-N 3.2Å; N1072-L1075 VanDerWaalsContact O-N 3.17Å; E1073-L1075 VanDerWaalsContact C-N 3.34Å; E1073-L1075 PolarHBondContact O-N 2.77Å; L1075-T1077 VanDerWaalsContact C-N 3.3Å; L1075-T1077 PolarHBondContact O-N 2.91Å; L1075-V1078 PolarHBondContact O-N 2.7Å; L1075-C1079 PolarHBondContact O-N 3.36Å; L1075-F1108 HydrophobicContact CD1-CE1 4.12Å; L1075-F1108 HydrophobicContact CD2-CD1 4.29Å; L1075-F1108 HydrophobicContact CD2-CE1 4.22Å
1076	Y	95.7	Very high	93.4	Very high	11 Å²	11	34.5 Å²	34.5	4%	0.043	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-34.1	179.9	-52.9	-37.8	0	0	0	112.6	K1058 T1060 N1072 E1073 C1079 D1080 N1117 Y1121	K1058-Y1076 HydrophobicContact CB-CD1 4.41Å; K1058-Y1076 HydrophobicContact CG-CD1 4.34Å; T1060-Y1076 VanDerWaalsContact O-CE1 3.28Å; T1060-Y1076 WeakPolarHBondContact O-CE1 3.16Å; T1060-Y1076 PolarHBondContact O-OH 3.14Å; N1072-Y1076 HydrophobicContact CB-CE2 3.87Å; N1072-Y1076 WeakPolarHBondContact O-CD2 3.42Å; N1072-Y1076 PolarHBondContact O-N 2.69Å; E1073-Y1076 PolarHBondContact O-N 2.92Å; Y1076-C1079 WeakPolarHBondContact O-CB 3.4Å; Y1076-C1079 PolarHBondContact O-N 3.43Å; Y1076-D1080 PolarHBondContact O-N 3.21Å; Y1076-N1117 WeakPolarHBondContact CD2-ND2 3.15Å; Y1076-N1117 WeakPolarHBondContact CE2-ND2 3.05Å; Y1076-Y1121 AromaticContact CD2-CE1 3.88Å; Y1076-Y1121 HydrophobicContact CD2-CE1 3.88Å; Y1076-Y1121 AromaticContact CD2-CE2 3.86Å; Y1076-Y1121 HydrophobicContact CD2-CE2 3.86Å; Y1076-Y1121 AromaticContact CD2-CZ 3.46Å; Y1076-Y1121 VanDerWaalsContact CD2-CZ 3.46Å; Y1076-Y1121 WeakPolarHBondContact CD2-OH 3.34Å; Y1076-Y1121 HydrophobicContact CG-CD2 4.44Å; Y1076-Y1121 HydrophobicContact CG-CE2 4.04Å
1077	T	95.4	Very high	93.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-43.7	173.8	-49.9	0	0	0	0	111.3	S1018 L1024 E1073 K1074 L1075 C1079 D1080 V1081 I1122	S1018-T1077 VanDerWaalsContact O-CG2 3.29Å; S1018-T1077 WeakPolarHBondContact O-CG2 3.28Å; L1024-T1077 HydrophobicContact CD1-CG2 4.47Å; L1024-T1077 HydrophobicContact CD2-CG2 3.61Å; E1073-T1077 WeakPolarHBondContact O-CB 3.32Å; E1073-T1077 PolarHBondContact O-N 3.09Å; E1073-T1077 PolarHBondContact O-OG1 2.85Å; K1074-T1077 PolarHBondContact O-N 2.86Å; L1075-T1077 VanDerWaalsContact C-N 3.3Å; L1075-T1077 PolarHBondContact O-N 2.91Å; T1077-C1079 VanDerWaalsContact C-N 3.32Å; T1077-C1079 PolarHBondContact O-N 3.04Å; T1077-D1080 PolarHBondContact O-N 3.25Å; T1077-V1081 WeakPolarHBondContact O-CG2 3.26Å; T1077-V1081 PolarHBondContact O-N 3.28Å; T1077-I1122 HydrophobicContact CG2-CG2 3.84Å
1078	V	96.5	Very high	93.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.7	-36.5	176.1	179.7	0	0	0	0	111.2	I1006 L1009 A1010 F1015 I1027 L1031 K1074 L1075 V1081 A1082	I1006-V1078 HydrophobicContact CB-CG1 4.26Å; I1006-V1078 HydrophobicContact CG1-CG1 4.27Å; I1006-V1078 HydrophobicContact CG2-CB 4.33Å; I1006-V1078 HydrophobicContact CG2-CG1 4Å; L1009-V1078 HydrophobicContact CB-CG1 4.13Å; A1010-V1078 HydrophobicContact CB-CG2 4.23Å; F1015-V1078 HydrophobicContact CD1-CG2 4.25Å; F1015-V1078 HydrophobicContact CE1-CG2 3.64Å; F1015-V1078 HydrophobicContact CZ-CG2 4.33Å; I1027-V1078 HydrophobicContact CG2-CG1 4.28Å; I1027-V1078 HydrophobicContact CG2-CG2 4.15Å; L1031-V1078 HydrophobicContact CD1-CG1 4.24Å; L1031-V1078 HydrophobicContact CD2-CG1 4.36Å; K1074-V1078 WeakPolarHBondContact O-CG2 3.46Å; K1074-V1078 PolarHBondContact O-N 3.4Å; L1075-V1078 PolarHBondContact O-N 2.7Å; V1078-V1081 PolarHBondContact O-N 3.41Å; V1078-A1082 WeakPolarHBondContact O-CB 3.41Å; V1078-A1082 PolarHBondContact O-N 3.34Å
1079	C	96.3	Very high	93.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-47.1	169.8	-75.3	0	0	0	0	112.6	I1057 K1058 L1075 Y1076 T1077 V1081 A1082 L1083	I1057-C1079 WeakPolarHBondContact CG2-SG 3.47Å; K1058-C1079 HydrophobicContact CD-CB 4.12Å; K1058-C1079 HydrophobicContact CG-CB 3.74Å; L1075-C1079 PolarHBondContact O-N 3.36Å; Y1076-C1079 WeakPolarHBondContact O-CB 3.4Å; Y1076-C1079 PolarHBondContact O-N 3.43Å; T1077-C1079 VanDerWaalsContact C-N 3.32Å; T1077-C1079 PolarHBondContact O-N 3.04Å; C1079-V1081 VanDerWaalsContact C-N 3.35Å; C1079-V1081 PolarHBondContact O-N 3.44Å; C1079-A1082 WeakPolarHBondContact O-CB 3.24Å; C1079-A1082 PolarHBondContact O-N 3.41Å; C1079-A1082 VanDerWaalsContact O-N 3.14Å; C1079-L1083 WeakPolarHBondContact O-CB 3.14Å; C1079-L1083 VanDerWaalsContact O-CG 3.32Å; C1079-L1083 WeakPolarHBondContact O-CG 3.32Å; C1079-L1083 PolarHBondContact O-N 3.26Å
1080	D	95.1	Very high	92.9	Very high	16 Å²	16	29 Å²	29	9%	0.086	14%	0.144	C	C	.	.	H	α-helix	trans	-67.4	-34.1	-179	-74.1	-23.7	0	0	0	112.5	K1058 Y1076 T1077 C1084 Y1121 I1122	K1058-D1080 WeakPolarHBondContact CD-OD1 3.36Å; K1058-D1080 WeakPolarHBondContact CE-OD1 3.3Å; K1058-D1080 VanDerWaalsContact NZ-CG 3.27Å; K1058-D1080 IonicContact NZ-OD1 2.63Å; K1058-D1080 PolarHBondContact NZ-OD1 3.5Å; K1058-D1080 IonicContact NZ-OD2 3.19Å; K1058-D1080 PolarHBondContact NZ-OD2 3.39Å; Y1076-D1080 PolarHBondContact O-N 3.21Å; T1077-D1080 PolarHBondContact O-N 3.25Å; D1080-C1084 VanDerWaalsContact O-CB 3.23Å; D1080-C1084 WeakPolarHBondContact O-CB 3.49Å; D1080-C1084 PolarHBondContact O-N 3.03Å; D1080-Y1121 PolarHBondContact OD2-N 3.38Å; D1080-I1122 HydrophobicContact CB-CD1 4.19Å; D1080-I1122 HydrophobicContact CB-CG1 4.12Å; D1080-I1122 HydrophobicContact CB-CG2 4.48Å
1081	V	94.9	Very high	92.4	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-42.9	169.5	179	0	0	0	0	111	L1024 I1027 K1028 L1031 T1077 V1078 C1079 C1084 V1085 I1122 L1130	L1024-V1081 HydrophobicContact CD2-CG2 4.19Å; I1027-V1081 HydrophobicContact CG2-CG1 4.45Å; K1028-V1081 HydrophobicContact CB-CG1 3.6Å; K1028-V1081 HydrophobicContact CG-CG1 4.2Å; L1031-V1081 HydrophobicContact CD1-CB 4Å; L1031-V1081 HydrophobicContact CD1-CG1 3.64Å; T1077-V1081 WeakPolarHBondContact O-CG2 3.26Å; T1077-V1081 PolarHBondContact O-N 3.28Å; V1078-V1081 PolarHBondContact O-N 3.41Å; C1079-V1081 VanDerWaalsContact C-N 3.35Å; C1079-V1081 PolarHBondContact O-N 3.44Å; V1081-C1084 WeakPolarHBondContact O-CB 3.44Å; V1081-C1084 PolarHBondContact O-N 3.11Å; V1081-V1085 WeakPolarHBondContact O-CG2 3.32Å; V1081-V1085 PolarHBondContact O-N 3.05Å; V1081-I1122 HydrophobicContact CG2-CG2 4.07Å; V1081-L1130 HydrophobicContact CG2-CD1 4.19Å
1082	A	95.3	Very high	91.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-44	177.1	0	0	0	0	0	112	I1006 L1031 V1078 C1079 V1085 I1086	I1006-A1082 HydrophobicContact CD1-CB 4.09Å; I1006-A1082 HydrophobicContact CG1-CB 4.34Å; L1031-A1082 HydrophobicContact CD1-CB 4.05Å; L1031-A1082 HydrophobicContact CD2-CB 4.11Å; V1078-A1082 WeakPolarHBondContact O-CB 3.41Å; V1078-A1082 PolarHBondContact O-N 3.34Å; C1079-A1082 WeakPolarHBondContact O-CB 3.24Å; C1079-A1082 PolarHBondContact O-N 3.41Å; C1079-A1082 VanDerWaalsContact O-N 3.14Å; A1082-V1085 PolarHBondContact O-N 3.37Å; A1082-I1086 VanDerWaalsContact O-CG1 3.31Å; A1082-I1086 WeakPolarHBondContact O-CG1 3.46Å; A1082-I1086 PolarHBondContact O-N 3.23Å
1083	L	93.6	Very high	91.2	Very high	21 Å²	21	29.2 Å²	29.2	11%	0.11	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-40.6	174.1	-71	169.4	0	0	0	111.5	K1051 A1054 E1055 K1058 C1079 V1085 I1086 N1087	K1051-L1083 HydrophobicContact CG-CD2 3.7Å; A1054-L1083 HydrophobicContact CB-CD2 3.8Å; A1054-L1083 HydrophobicContact CB-CG 3.89Å; E1055-L1083 HydrophobicContact CG-CD1 4.49Å; E1055-L1083 HydrophobicContact CG-CD2 4.03Å; K1058-L1083 HydrophobicContact CD-CD1 4.41Å; C1079-L1083 WeakPolarHBondContact O-CB 3.14Å; C1079-L1083 VanDerWaalsContact O-CG 3.32Å; C1079-L1083 WeakPolarHBondContact O-CG 3.32Å; C1079-L1083 PolarHBondContact O-N 3.26Å; L1083-V1085 PolarHBondContact O-N 3.23Å; L1083-I1086 PolarHBondContact O-N 2.92Å; L1083-N1087 VanDerWaalsContact O-CB 3.31Å; L1083-N1087 WeakPolarHBondContact O-CB 3.42Å; L1083-N1087 PolarHBondContact O-N 2.89Å; L1083-N1087 PolarHBondContact O-ND2 3.48Å
1084	C	92	Very high	90.6	Very high	10 Å²	10	31.4 Å²	31.4	7%	0.068	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-44.3	173.8	-176.5	0	0	0	0	111.9	D1080 V1081 S1088 I1122 R1127	D1080-C1084 VanDerWaalsContact O-CB 3.23Å; D1080-C1084 WeakPolarHBondContact O-CB 3.49Å; D1080-C1084 PolarHBondContact O-N 3.03Å; V1081-C1084 WeakPolarHBondContact O-CB 3.44Å; V1081-C1084 PolarHBondContact O-N 3.11Å; C1084-S1088 VanDerWaalsContact O-CB 3.26Å; C1084-S1088 WeakPolarHBondContact O-CB 3.4Å; C1084-S1088 PolarHBondContact O-N 3.18Å; C1084-S1088 VanDerWaalsContact O-N 3.11Å; C1084-S1088 PolarHBondContact O-OG 2.95Å; C1084-I1122 HydrophobicContact CB-CD1 4.34Å; C1084-R1127 HydrophobicContact CB-CG 4.46Å; C1084-R1127 WeakPolarHBondContact SG-CG 3.37Å
1085	V	91.3	Very high	90.1	Very high	6 Å²	6	31.7 Å²	31.7	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-45.9	176.3	171.6	0	0	0	0	111.7	K1028 W1032 L1035 V1081 A1082 L1083 S1088 K1089	K1028-V1085 HydrophobicContact CG-CG2 3.8Å; W1032-V1085 HydrophobicContact CB-CG1 4.36Å; W1032-V1085 HydrophobicContact CD2-CG1 4.41Å; W1032-V1085 HydrophobicContact CE3-CG1 3.57Å; W1032-V1085 HydrophobicContact CZ3-CG1 4.34Å; L1035-V1085 HydrophobicContact CD1-CB 4.28Å; L1035-V1085 HydrophobicContact CD1-CG1 3.75Å; V1081-V1085 WeakPolarHBondContact O-CG2 3.32Å; V1081-V1085 PolarHBondContact O-N 3.05Å; A1082-V1085 PolarHBondContact O-N 3.37Å; L1083-V1085 PolarHBondContact O-N 3.23Å; V1085-S1088 PolarHBondContact O-OG 3.32Å; V1085-S1088 VanDerWaalsContact O-OG 3.13Å; V1085-K1089 WeakPolarHBondContact O-CB 3.24Å; V1085-K1089 WeakPolarHBondContact O-CG 3.37Å; V1085-K1089 PolarHBondContact O-N 3Å
1086	I	92.4	Very high	89.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-52.7	-179.5	-67.8	165.6	0	0	0	110.8	L1035 M1039 M1050 K1051 A1082 L1083 S1088 K1089 S1090 C1093	L1035-I1086 HydrophobicContact CD1-CG1 4.04Å; L1035-I1086 HydrophobicContact CD2-CD1 4.29Å; L1035-I1086 HydrophobicContact CD2-CG1 4.19Å; M1039-I1086 HydrophobicContact CE-CG2 4.22Å; M1039-I1086 HydrophobicContact SD-CG1 4.24Å; M1050-I1086 HydrophobicContact CB-CD1 4.31Å; K1051-I1086 HydrophobicContact CB-CG2 4.2Å; A1082-I1086 VanDerWaalsContact O-CG1 3.31Å; A1082-I1086 WeakPolarHBondContact O-CG1 3.46Å; A1082-I1086 PolarHBondContact O-N 3.23Å; L1083-I1086 PolarHBondContact O-N 2.92Å; I1086-S1088 VanDerWaalsContact C-N 3.31Å; I1086-S1088 PolarHBondContact O-N 2.88Å; I1086-K1089 PolarHBondContact O-N 2.87Å; I1086-K1089 VanDerWaalsContact O-N 3.08Å; I1086-S1090 PolarHBondContact O-N 3.33Å; I1086-S1090 VanDerWaalsContact O-N 3.11Å; I1086-C1093 HydrophobicContact CG2-CB 3.68Å
1087	N	90.8	Very high	88.7	Confident	62 Å²	62	39.9 Å²	39.9	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-63	-34.7	-177.4	-70.8	-57.5	0	0	0	112.5	K1051 L1083 K1089 C1093	K1051-N1087 WeakPolarHBondContact CE-OD1 3.48Å; L1083-N1087 VanDerWaalsContact O-CB 3.31Å; L1083-N1087 WeakPolarHBondContact O-CB 3.42Å; L1083-N1087 PolarHBondContact O-N 2.89Å; L1083-N1087 PolarHBondContact O-ND2 3.48Å; N1087-K1089 VanDerWaalsContact C-N 3.27Å; N1087-K1089 PolarHBondContact O-N 3.23Å; N1087-C1093 PolarHBondContact OD1-SG 3.13Å
1088	S	88.9	Confident	88	Confident	56 Å²	56	43.3 Å²	43.3	39%	0.392	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.3	177.4	63.3	0	0	0	0	114.6	C1084 V1085 I1086 L1131	C1084-S1088 VanDerWaalsContact O-CB 3.26Å; C1084-S1088 WeakPolarHBondContact O-CB 3.4Å; C1084-S1088 PolarHBondContact O-N 3.18Å; C1084-S1088 VanDerWaalsContact O-N 3.11Å; C1084-S1088 PolarHBondContact O-OG 2.95Å; V1085-S1088 PolarHBondContact O-OG 3.32Å; V1085-S1088 VanDerWaalsContact O-OG 3.13Å; I1086-S1088 VanDerWaalsContact C-N 3.31Å; I1086-S1088 PolarHBondContact O-N 2.88Å; S1088-L1131 VanDerWaalsContact CB-CD2 3.45Å; S1088-L1131 VanDerWaalsContact OG-CD2 3.25Å; S1088-L1131 WeakPolarHBondContact OG-CD2 3.45Å
1089	K	86.5	Confident	87.3	Confident	125 Å²	125	49.7 Å²	49.7	54%	0.543	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-11.5	-174.7	-63.6	-66.4	-177.2	-167.1	0	114.5	W1032 M1039 V1085 I1086 N1087	W1032-K1089 HydrophobicContact CE3-CG 4.17Å; W1032-K1089 HydrophobicContact CH2-CB 4.27Å; W1032-K1089 HydrophobicContact CH2-CD 3.75Å; W1032-K1089 HydrophobicContact CH2-CG 3.83Å; W1032-K1089 HydrophobicContact CZ2-CD 4.31Å; W1032-K1089 HydrophobicContact CZ3-CB 3.96Å; W1032-K1089 HydrophobicContact CZ3-CD 3.98Å; W1032-K1089 HydrophobicContact CZ3-CG 3.52Å; M1039-K1089 HydrophobicContact CE-CB 4.11Å; V1085-K1089 WeakPolarHBondContact O-CB 3.24Å; V1085-K1089 WeakPolarHBondContact O-CG 3.37Å; V1085-K1089 PolarHBondContact O-N 3Å; I1086-K1089 PolarHBondContact O-N 2.87Å; I1086-K1089 VanDerWaalsContact O-N 3.08Å; N1087-K1089 VanDerWaalsContact C-N 3.27Å; N1087-K1089 PolarHBondContact O-N 3.23Å
1090	S	85.5	Confident	86.8	Confident	18 Å²	18	55 Å²	55	13%	0.126	31%	0.313	C	S	.	.			trans	-155.9	125	170.9	-161.7	0	0	0	0	113.3	H1047 I1086 L1092 C1093	H1047-S1090 VanDerWaalsContact ND1-CB 3.3Å; H1047-S1090 WeakPolarHBondContact ND1-CB 3.41Å; H1047-S1090 PolarHBondContact ND1-OG 3.07Å; I1086-S1090 PolarHBondContact O-N 3.33Å; I1086-S1090 VanDerWaalsContact O-N 3.11Å; S1090-L1092 PolarHBondContact O-N 3.24Å; S1090-L1092 PolarHBondContact OG-N 3.32Å; S1090-C1093 PolarHBondContact O-N 3.19Å; S1090-C1093 PolarHBondContact O-SG 3.37Å
1091	A	81	Confident	86.4	Confident	88 Å²	88	54.5 Å²	54.5	73%	0.727	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.7	-21.2	168.7	0	0	0	0	0	113	C1093 N1094	A1091-C1093 PolarHBondContact O-N 2.81Å; A1091-N1094 PolarHBondContact O-N 3.47Å
1092	L	79.4	Confident	86.1	Confident	96 Å²	96	58.8 Å²	58.8	50%	0.503	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-73.1	-7.1	-177.4	-60.4	172.2	0	0	0	113.7	N1042 S1090 N1094	N1042-L1092 HydrophobicContact CB-CD1 4.15Å; S1090-L1092 PolarHBondContact O-N 3.24Å; S1090-L1092 PolarHBondContact OG-N 3.32Å; L1092-N1094 PolarHBondContact O-N 3.24Å
1093	C	80.2	Confident	85.9	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.02	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-74.8	-6.5	173.6	69.3	0	0	0	0	113.8	H1047 K1051 I1086 N1087 S1090 A1091	H1047-C1093 HydrophobicContact CB-CB 4.22Å; K1051-C1093 HydrophobicContact CB-CB 4.21Å; K1051-C1093 HydrophobicContact CD-CB 4.09Å; K1051-C1093 WeakPolarHBondContact CD-O 3.39Å; I1086-C1093 HydrophobicContact CG2-CB 3.68Å; N1087-C1093 PolarHBondContact OD1-SG 3.13Å; S1090-C1093 PolarHBondContact O-N 3.19Å; S1090-C1093 PolarHBondContact O-SG 3.37Å; A1091-C1093 PolarHBondContact O-N 2.81Å
1094	N	81.8	Confident	85.9	Confident	109 Å²	109	59.9 Å²	59.9	58%	0.583	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-98	7.4	176.6	-65.4	-30.5	0	0	0	113.5	K1051 A1091 L1092	K1051-N1094 PolarHBondContact NZ-OD1 3.3Å; A1091-N1094 PolarHBondContact O-N 3.47Å; L1092-N1094 PolarHBondContact O-N 3.24Å
1095	A	83.7	Confident	85.8	Confident	44 Å²	44	65.5 Å²	65.5	36%	0.364	37%	0.371	S	S	.	.	S	Bend	trans	-77	164.6	164.4	0	0	0	0	0	110.7	A1048	A1048-A1095 WeakPolarHBondContact CB-O 3.11Å
1096	D	80.9	Confident	85.8	Confident	145 Å²	145	69.3 Å²	69.3	78%	0.775	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-63	141	176.2	-68.1	-60.3	0	0	0	112.7	N1045	N1045-D1096 PolarHBondContact ND2-O 2.91Å
1097	S	82.3	Confident	86	Confident	37 Å²	37	69.5 Å²	69.5	26%	0.259	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-68.4	133	174.3	-171.3	0	0	0	0	110.1	F1049 K1099	F1049-S1097 WeakPolarHBondContact CD2-OG 3.49Å; S1097-K1099 PolarHBondContact O-N 3.27Å; S1097-K1099 PolarHBondContact OG-O 3.06Å
1098	P	79.7	Confident	86.2	Confident	72 Å²	72	66.7 Å²	66.7	47%	0.468	37%	0.372	S	S	.	.	S	Bend	trans	-66.9	-23.1	-174.7	29.3	-37.4	0	0	0	113.4	F1049	F1049-P1098 HydrophobicContact CB-CG 4.2Å; F1049-P1098 HydrophobicContact CD2-CG 4.21Å; F1049-P1098 HydrophobicContact CG-CG 4.26Å
1099	K	82.2	Confident	86.4	Confident	135 Å²	135	65.9 Å²	65.9	59%	0.587	37%	0.365	S	S	*	.	S	Bend	trans	-152.8	163.2	170.9	-64.6	-167.5	177.5	-174.5	0	108.7	F1049 S1097	F1049-K1099 HydrophobicContact CE2-CB 4.5Å; F1049-K1099 WeakPolarHBondContact CE2-O 3.42Å; S1097-K1099 PolarHBondContact O-N 3.27Å; S1097-K1099 PolarHBondContact OG-O 3.06Å
1100	D	85.3	Confident	86.4	Confident	112 Å²	112	66.6 Å²	66.6	60%	0.599	37%	0.37	S	S	*	.			trans	-76.6	131	165.1	-168	47.9	0	0	0	109.7	N1056	N1056-D1100 PolarHBondContact ND2-OD1 3.21Å
1101	P	86.8	Confident	86	Confident	4 Å²	4	69.5 Å²	69.5	3%	0.026	39%	0.389	C	S	.	.			trans	-80.3	131.9	-175.8	28.2	-33	0	0	0	113.3	Y1000 F1049 K1052 M1053 L1103	Y1000-P1101 HydrophobicContact CE1-CB 4.38Å; Y1000-P1101 WeakPolarHBondContact OH-CA 3.17Å; F1049-P1101 HydrophobicContact CD2-CB 4.47Å; F1049-P1101 HydrophobicContact CE2-CB 3.74Å; F1049-P1101 HydrophobicContact CE2-CG 4.39Å; F1049-P1101 HydrophobicContact CZ-CB 4.05Å; K1052-P1101 HydrophobicContact CG-CG 4.13Å; M1053-P1101 HydrophobicContact CB-CG 4.43Å; M1053-P1101 HydrophobicContact CE-CB 3.89Å; M1053-P1101 HydrophobicContact CG-CB 3.5Å; M1053-P1101 HydrophobicContact CG-CG 3.72Å; P1101-L1103 PolarHBondContact O-N 2.98Å
1102	V	89.3	Confident	85.7	Confident	91 Å²	91	69.9 Å²	69.9	55%	0.552	38%	0.376	S	S	*	.			trans	-86.8	107.6	177.2	-178.7	0	0	0	0	109.5	Y1000	Y1000-V1102 WeakPolarHBondContact CE1-O 3.34Å; Y1000-V1102 PolarHBondContact OH-N 3.03Å; Y1000-V1102 VanDerWaalsContact OH-N 3.09Å
1103	L	91.4	Very high	85.2	Confident	24 Å²	24	75.2 Å²	75.2	13%	0.126	39%	0.394	C	S	.	.			trans	-73.4	143.2	-176.8	-63.6	179	0	0	0	112.6	P1003 N1056 I1057 T1060 P1101 M1105 F1108	P1003-L1103 HydrophobicContact CB-CD2 4.33Å; P1003-L1103 HydrophobicContact CG-CD2 3.98Å; N1056-L1103 HydrophobicContact CB-CD1 4.04Å; I1057-L1103 HydrophobicContact CB-CD1 4.4Å; I1057-L1103 HydrophobicContact CD1-CD2 4.25Å; I1057-L1103 HydrophobicContact CG1-CD1 3.67Å; I1057-L1103 HydrophobicContact CG1-CD2 3.73Å; I1057-L1103 HydrophobicContact CG1-CG 4.37Å; T1060-L1103 HydrophobicContact CG2-CD1 3.84Å; P1101-L1103 PolarHBondContact O-N 2.98Å; L1103-M1105 PolarHBondContact O-N 3.32Å; L1103-M1105 VanDerWaalsContact O-N 3.12Å; L1103-F1108 HydrophobicContact CB-CB 4.27Å; L1103-F1108 HydrophobicContact CB-CD2 4.05Å; L1103-F1108 HydrophobicContact CB-CG 4.37Å
1104	P	91.8	Very high	84.6	Confident	20 Å²	20	82.8 Å²	82.8	13%	0.13	44%	0.435	C	S	.	.			trans	-63.3	108.8	178.7	-25.4	34.9	0	0	0	113.8	Y1004 K1106 F1107 F1108	Y1004-P1104 HydrophobicContact CD1-CG 4.36Å; Y1004-P1104 HydrophobicContact CE1-CB 3.75Å; Y1004-P1104 HydrophobicContact CE1-CG 3.56Å; Y1004-P1104 HydrophobicContact CE2-CG 4.15Å; Y1004-P1104 VanDerWaalsContact CZ-CG 3.43Å; Y1004-P1104 WeakPolarHBondContact OH-CG 3.36Å; P1104-K1106 PolarHBondContact O-N 2.78Å; P1104-F1107 HydrophobicContact CB-CD2 3.96Å; P1104-F1107 PolarHBondContact O-N 2.91Å; P1104-F1108 PolarHBondContact O-N 3.42Å
1105	M	91.3	Very high	84.2	Confident	129 Å²	129	80.2 Å²	80.2	64%	0.635	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-10.5	-178.1	-72.9	-174.5	-84.2	0	0	115.7	L1103 F1107 F1108 Q1110	L1103-M1105 PolarHBondContact O-N 3.32Å; L1103-M1105 VanDerWaalsContact O-N 3.12Å; M1105-F1107 VanDerWaalsContact C-N 3.3Å; M1105-F1108 WeakPolarHBondContact CA-O 3.31Å; M1105-Q1110 HydrophobicContact SD-CG 4.09Å; M1105-Q1110 PolarHBondContact SD-NE2 3.36Å; M1105-Q1110 VanDerWaalsContact SD-NE2 3.41Å
1106	K	91.7	Very high	83.5	Confident	85 Å²	85	82.5 Å²	82.5	37%	0.37	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.9	169.3	-90.1	-165.8	169.2	-162.3	0	113.8	H906 E907 I909 P1104	H906-K1106 PolarHBondContact O-NZ 3.09Å; E907-K1106 WeakPolarHBondContact O-CE 3.18Å; E907-K1106 PolarHBondContact O-NZ 3.4Å; I909-K1106 PolarHBondContact O-NZ 3.41Å; P1104-K1106 PolarHBondContact O-N 2.78Å
1107	F	95.1	Very high	83.5	Confident	5 Å²	5	76.1 Å²	76.1	2%	0.022	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-27	-168.7	-67.2	-84.8	0	0	0	111.8	P911 F914 Y1004 H1007 A1063 P1104 M1105	P911-F1107 HydrophobicContact CB-CD1 4.36Å; P911-F1107 HydrophobicContact CB-CE1 4.01Å; P911-F1107 HydrophobicContact CG-CD1 4.46Å; P911-F1107 HydrophobicContact CG-CE1 4.26Å; F914-F1107 HydrophobicContact CD1-CE1 4.08Å; F914-F1107 HydrophobicContact CD1-CZ 4.28Å; F914-F1107 HydrophobicContact CE1-CE1 4.35Å; Y1004-F1107 AromaticContact CD1-CD2 3.91Å; Y1004-F1107 HydrophobicContact CD1-CD2 3.91Å; Y1004-F1107 AromaticContact CD1-CE2 3.78Å; Y1004-F1107 HydrophobicContact CD1-CE2 3.78Å; Y1004-F1107 HydrophobicContact CD1-CG 4.42Å; Y1004-F1107 HydrophobicContact CD1-CZ 4.19Å; Y1004-F1107 AromaticContact CE1-CD2 3.7Å; Y1004-F1107 HydrophobicContact CE1-CD2 3.7Å; Y1004-F1107 AromaticContact CE1-CE2 3.57Å; Y1004-F1107 HydrophobicContact CE1-CE2 3.57Å; Y1004-F1107 HydrophobicContact CE1-CZ 4.38Å; H1007-F1107 HydrophobicContact CB-CD1 4.49Å; H1007-F1107 AromaticContact CD2-CD1 3.71Å; H1007-F1107 PolarHBondContact CD2-O 2.97Å; H1007-F1107 AromaticContact CE1-CD1 3.86Å; H1007-F1107 AromaticContact CG-CD1 3.82Å; H1007-F1107 AromaticContact ND1-CD1 3.93Å; H1007-F1107 AromaticContact NE2-CD1 3.68Å; H1007-F1107 PolarHBondContact NE2-O 2.87Å; A1063-F1107 WeakPolarHBondContact CB-O 3.43Å; A1063-F1107 PolarHBondContact N-O 3.01Å; P1104-F1107 HydrophobicContact CB-CD2 3.96Å; P1104-F1107 PolarHBondContact O-N 2.91Å; M1105-F1107 VanDerWaalsContact C-N 3.3Å
1108	F	95.5	Very high	83.3	Confident	2 Å²	2	81.2 Å²	81.2	1%	0.009	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-129.4	140.8	179.8	-52.4	-74.2	0	0	0	110.4	P1003 H1007 I1057 T1060 R1061 L1075 L1103 P1104 M1105	P1003-F1108 HydrophobicContact CB-CE2 3.62Å; P1003-F1108 HydrophobicContact CB-CZ 3.96Å; P1003-F1108 WeakPolarHBondContact O-CZ 3.33Å; H1007-F1108 HydrophobicContact CB-CE1 4.33Å; H1007-F1108 HydrophobicContact CB-CZ 3.93Å; I1057-F1108 HydrophobicContact CB-CE1 4.4Å; I1057-F1108 HydrophobicContact CD1-CE1 4.18Å; I1057-F1108 HydrophobicContact CD1-CZ 4Å; I1057-F1108 HydrophobicContact CG1-CD1 4.23Å; I1057-F1108 HydrophobicContact CG1-CE1 3.95Å; I1057-F1108 HydrophobicContact CG1-CZ 4.14Å; I1057-F1108 HydrophobicContact CG2-CD1 3.87Å; I1057-F1108 HydrophobicContact CG2-CE1 3.55Å; I1057-F1108 HydrophobicContact CG2-CZ 4.41Å; T1060-F1108 HydrophobicContact CG2-CB 4.4Å; R1061-F1108 WeakPolarHBondContact O-CA 3.37Å; L1075-F1108 HydrophobicContact CD1-CE1 4.12Å; L1075-F1108 HydrophobicContact CD2-CD1 4.29Å; L1075-F1108 HydrophobicContact CD2-CE1 4.22Å; L1103-F1108 HydrophobicContact CB-CB 4.27Å; L1103-F1108 HydrophobicContact CB-CD2 4.05Å; L1103-F1108 HydrophobicContact CB-CG 4.37Å; P1104-F1108 PolarHBondContact O-N 3.42Å; M1105-F1108 WeakPolarHBondContact CA-O 3.31Å
1109	T	93.5	Very high	83.7	Confident	40 Å²	40	83.2 Å²	83.2	25%	0.245	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-63.4	166.3	167.2	68.6	0	0	0	0	110.3	T1060 R1061 P1066	T1060-T1109 WeakPolarHBondContact CB-O 3.47Å; T1060-T1109 WeakPolarHBondContact CG2-O 3.26Å; R1061-T1109 HydrophobicContact CB-CG2 3.88Å; R1061-T1109 PolarHBondContact N-OG1 3.2Å; R1061-T1109 PolarHBondContact O-N 3.34Å; P1066-T1109 HydrophobicContact CB-CG2 4.14Å
1110	Q	86.2	Confident	83.9	Confident	140 Å²	140	80.1 Å²	80.1	65%	0.654	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-64.7	147.8	159.5	-65.9	-172.2	4.5	0	0	109.1	M1105 E1112	M1105-Q1110 HydrophobicContact SD-CG 4.09Å; M1105-Q1110 PolarHBondContact SD-NE2 3.36Å; M1105-Q1110 VanDerWaalsContact SD-NE2 3.41Å; Q1110-E1112 PolarHBondContact O-N 3.06Å
1111	P	78	Confident	84.1	Confident	79 Å²	79	76.1 Å²	76.1	51%	0.513	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-68.6	125.8	174.2	27.6	-33	0	0	0	109.8	L1059 T1060	L1059-P1111 HydrophobicContact CB-CB 4.19Å; L1059-P1111 VanDerWaalsContact O-CA 3.28Å; L1059-P1111 WeakPolarHBondContact O-CA 3.43Å; L1059-P1111 WeakPolarHBondContact O-CB 3.25Å; T1060-P1111 HydrophobicContact CG2-CB 4.16Å
1112	E	74.4	Confident	84.3	Confident	96 Å²	96	76.4 Å²	76.4	45%	0.449	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-71.3	134	174.1	-68.7	171.9	-176	0	0	108.8	R1061 Q1110 D1114 F1115	R1061-E1112 IonicContact CZ-OE1 3.28Å; R1061-E1112 VanDerWaalsContact CZ-OE1 3.23Å; R1061-E1112 IonicContact CZ-OE2 3.65Å; R1061-E1112 IonicContact NH1-OE1 2.8Å; R1061-E1112 PolarHBondContact NH1-OE1 3.14Å; R1061-E1112 IonicContact NH1-OE2 3.46Å; R1061-E1112 IonicContact NH2-OE1 2.61Å; R1061-E1112 PolarHBondContact NH2-OE1 3.36Å; R1061-E1112 IonicContact NH2-OE2 3.11Å; R1061-E1112 PolarHBondContact NH2-OE2 3.47Å; Q1110-E1112 PolarHBondContact O-N 3.06Å; E1112-D1114 PolarHBondContact O-N 2.94Å; E1112-F1115 HydrophobicContact CB-CB 3.76Å; E1112-F1115 PolarHBondContact O-N 3.19Å
1113	K	67.5	Low	84.2	Confident	207 Å²	207	74.3 Å²	74.3	90%	0.9	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.1	-170.9	-71.6	-175.1	176.5	-179.1	0	114.5
1114	D	67.5	Low	83.7	Confident	162 Å²	162	78.4 Å²	78.4	87%	0.866	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	4.7	-175.6	-47.6	-63.1	0	0	0	112.3	E1112	E1112-D1114 PolarHBondContact O-N 2.94Å
1115	F	74.3	Confident	83.3	Confident	56 Å²	56	85.4 Å²	85.4	25%	0.246	44%	0.435	C	S	.	.			trans	-95.4	98.2	-178.3	-176.2	-102.5	0	0	0	111.6	L1059 E1112 N1117	L1059-F1115 WeakPolarHBondContact O-CD1 3.39Å; E1112-F1115 HydrophobicContact CB-CB 3.76Å; E1112-F1115 PolarHBondContact O-N 3.19Å; F1115-N1117 HydrophobicContact CE1-CB 4.13Å; F1115-N1117 HydrophobicContact CZ-CB 4.38Å
1116	C	68.7	Low	83	Confident	91 Å²	91	80 Å²	80	62%	0.615	41%	0.409	S	S	*	.			trans	-101.6	136.4	173.2	171.4	0	0	0	0	110.3	D1118	C1116-D1118 VanDerWaalsContact SG-CG 3.57Å
1117	N	81.9	Confident	82.7	Confident	12 Å²	12	80.4 Å²	80.4	6%	0.064	41%	0.408	C	S	.	.			trans	-138	57.1	-172.5	-169.4	12.7	0	0	0	112.8	K1058 Y1076 F1115 K1119 Y1121	K1058-N1117 HydrophobicContact CB-CB 4.49Å; K1058-N1117 WeakPolarHBondContact CE-O 3.34Å; K1058-N1117 WeakPolarHBondContact O-CB 3.46Å; K1058-N1117 PolarHBondContact O-ND2 3.29Å; Y1076-N1117 WeakPolarHBondContact CD2-ND2 3.15Å; Y1076-N1117 WeakPolarHBondContact CE2-ND2 3.05Å; F1115-N1117 HydrophobicContact CE1-CB 4.13Å; F1115-N1117 HydrophobicContact CZ-CB 4.38Å; N1117-K1119 PolarHBondContact O-N 2.89Å; N1117-Y1121 WeakPolarHBondContact OD1-CE2 3.49Å; N1117-Y1121 PolarHBondContact OD1-OH 3.14Å; N1117-Y1121 VanDerWaalsContact OD1-OH 3.11Å
1118	D	78.3	Confident	82.1	Confident	144 Å²	144	83.6 Å²	83.6	77%	0.77	43%	0.428	S	S	*	.			trans	-78	-1.8	-178.9	-64.2	-7.6	0	0	0	113.3	C1116 S1120	C1116-D1118 VanDerWaalsContact SG-CG 3.57Å; D1118-S1120 PolarHBondContact O-N 2.76Å
1119	K	86.6	Confident	81.5	Confident	114 Å²	114	88.2 Å²	88.2	50%	0.496	45%	0.452	S	S	.	.			trans	-61.6	131.8	178	179.8	-174.8	172.4	-166	0	110.7	K1058 N1117 Y1121	K1058-K1119 PolarHBondContact NZ-O 2.92Å; N1117-K1119 PolarHBondContact O-N 2.89Å; K1119-Y1121 HydrophobicContact CB-CE2 3.98Å; K1119-Y1121 HydrophobicContact CD-CE1 4.16Å; K1119-Y1121 HydrophobicContact CD-CE2 4.14Å; K1119-Y1121 HydrophobicContact CG-CE2 4.13Å; K1119-Y1121 VanDerWaalsContact O-CD2 3.22Å; K1119-Y1121 WeakPolarHBondContact O-CD2 3.43Å; K1119-Y1121 WeakPolarHBondContact O-CE2 3.4Å
1120	S	86.8	Confident	81.1	Confident	70 Å²	70	86.7 Å²	86.7	49%	0.49	44%	0.442	S	S	.	.			trans	-76.6	130.3	165.6	-172.4	0	0	0	0	110.6	D1118 I1122	D1118-S1120 PolarHBondContact O-N 2.76Å; S1120-I1122 PolarHBondContact OG-N 3.31Å; S1120-I1122 PolarHBondContact OG-O 3.33Å
1121	Y	90.5	Very high	80.8	Confident	27 Å²	27	84 Å²	84	11%	0.106	43%	0.432	C	S	.	.	S	Bend	trans	-98.2	0.9	175.3	-69.2	-98.4	0	0	0	112.8	Q1019 E1073 Y1076 D1080 N1117 K1119	Q1019-Y1121 PolarHBondContact NE2-O 2.91Å; E1073-Y1121 HydrophobicContact CB-CD1 4.48Å; E1073-Y1121 HydrophobicContact CB-CE1 4.47Å; E1073-Y1121 HydrophobicContact CG-CD1 4.46Å; E1073-Y1121 HydrophobicContact CG-CE1 4.07Å; Y1076-Y1121 AromaticContact CD2-CE1 3.88Å; Y1076-Y1121 HydrophobicContact CD2-CE1 3.88Å; Y1076-Y1121 AromaticContact CD2-CE2 3.86Å; Y1076-Y1121 HydrophobicContact CD2-CE2 3.86Å; Y1076-Y1121 AromaticContact CD2-CZ 3.46Å; Y1076-Y1121 VanDerWaalsContact CD2-CZ 3.46Å; Y1076-Y1121 WeakPolarHBondContact CD2-OH 3.34Å; Y1076-Y1121 HydrophobicContact CG-CD2 4.44Å; Y1076-Y1121 HydrophobicContact CG-CE2 4.04Å; D1080-Y1121 PolarHBondContact OD2-N 3.38Å; N1117-Y1121 WeakPolarHBondContact OD1-CE2 3.49Å; N1117-Y1121 PolarHBondContact OD1-OH 3.14Å; N1117-Y1121 VanDerWaalsContact OD1-OH 3.11Å; K1119-Y1121 HydrophobicContact CB-CE2 3.98Å; K1119-Y1121 HydrophobicContact CD-CE1 4.16Å; K1119-Y1121 HydrophobicContact CD-CE2 4.14Å; K1119-Y1121 HydrophobicContact CG-CE2 4.13Å; K1119-Y1121 VanDerWaalsContact O-CD2 3.22Å; K1119-Y1121 WeakPolarHBondContact O-CD2 3.43Å; K1119-Y1121 WeakPolarHBondContact O-CE2 3.4Å
1122	I	89.6	Confident	80.5	Confident	10 Å²	10	85 Å²	85	5%	0.051	44%	0.437	C	S	.	.	S	Bend	trans	-116.5	143	165.4	62.2	-178.6	0	0	0	110.1	T1077 D1080 V1081 C1084 S1120 R1127	T1077-I1122 HydrophobicContact CG2-CG2 3.84Å; D1080-I1122 HydrophobicContact CB-CD1 4.19Å; D1080-I1122 HydrophobicContact CB-CG1 4.12Å; D1080-I1122 HydrophobicContact CB-CG2 4.48Å; V1081-I1122 HydrophobicContact CG2-CG2 4.07Å; C1084-I1122 HydrophobicContact CB-CD1 4.34Å; S1120-I1122 PolarHBondContact OG-N 3.31Å; S1120-I1122 PolarHBondContact OG-O 3.33Å; I1122-R1127 HydrophobicContact CD1-CB 4.07Å; I1122-R1127 HydrophobicContact CD1-CG 4.04Å; I1122-R1127 HydrophobicContact CG1-CB 4.5Å
1123	S	86.8	Confident	79.7	Confident	48 Å²	48	82.4 Å²	82.4	34%	0.336	44%	0.436	S	S	.	.			trans	-73	155.8	170.3	73.4	0	0	0	0	110.9	E1125 T1126 R1127	S1123-E1125 VanDerWaalsContact C-N 3.26Å; S1123-E1125 PolarHBondContact O-N 3.25Å; S1123-T1126 PolarHBondContact O-N 2.96Å; S1123-T1126 WeakPolarHBondContact OG-CB 3.48Å; S1123-T1126 PolarHBondContact OG-N 3.13Å; S1123-T1126 VanDerWaalsContact OG-N 3.11Å; S1123-T1126 PolarHBondContact OG-OG1 2.81Å; S1123-T1126 VanDerWaalsContact OG-OG1 3.06Å; S1123-R1127 WeakPolarHBondContact O-CB 3.18Å; S1123-R1127 PolarHBondContact O-N 3.1Å
1124	E	82.2	Confident	78.5	Confident	109 Å²	109	82 Å²	82	51%	0.509	43%	0.434	S	S	.	.	H	α-helix	trans	-65.7	-30.9	177.5	-165.8	63.2	-161	0	0	111.6	R1127 V1128	E1124-R1127 WeakPolarHBondContact O-CB 3.32Å; E1124-R1127 PolarHBondContact O-N 3.15Å; E1124-R1127 WeakPolarHBondContact OE1-CD 3.15Å; E1124-R1127 IonicContact OE1-CZ 2.78Å; E1124-R1127 IonicContact OE1-NE 2.69Å; E1124-R1127 IonicContact OE1-NH1 3.76Å; E1124-R1127 PolarHBondContact OE1-NH1 3.29Å; E1124-R1127 WeakPolarHBondContact OE2-CD 3.35Å; E1124-R1127 IonicContact OE2-CZ 3.58Å; E1124-R1127 IonicContact OE2-NE 3.35Å; E1124-R1127 IonicContact OE2-NH1 3.5Å; E1124-R1127 PolarHBondContact OE2-NH1 2.76Å; E1124-V1128 WeakPolarHBondContact O-CB 3.36Å; E1124-V1128 VanDerWaalsContact O-CG2 3.31Å; E1124-V1128 WeakPolarHBondContact O-CG2 3.44Å; E1124-V1128 PolarHBondContact O-N 3.07Å
1125	E	82.9	Confident	77.4	Confident	168 Å²	168	78.7 Å²	78.7	79%	0.785	42%	0.422	S	S	*	.	H	α-helix	trans	-61.6	-50.2	171.5	-64.4	-179.6	177.1	0	0	111.7	S1123 R1127 V1128 L1129	S1123-E1125 VanDerWaalsContact C-N 3.26Å; S1123-E1125 PolarHBondContact O-N 3.25Å; E1125-R1127 VanDerWaalsContact C-N 3.29Å; E1125-R1127 PolarHBondContact O-N 2.7Å; E1125-V1128 PolarHBondContact O-N 3.4Å; E1125-L1129 WeakPolarHBondContact O-CB 3.44Å; E1125-L1129 PolarHBondContact O-N 3.25Å
1126	T	84.5	Confident	75.6	Confident	14 Å²	14	84.6 Å²	84.6	9%	0.086	45%	0.447	C	S	.	.	H	α-helix	trans	-61	-40.7	175.8	-65	0	0	0	0	110.7	V1021 L1024 S1123 L1129 L1130	V1021-T1126 HydrophobicContact CG2-CG2 4.35Å; L1024-T1126 HydrophobicContact CD1-CG2 3.91Å; S1123-T1126 PolarHBondContact O-N 2.96Å; S1123-T1126 WeakPolarHBondContact OG-CB 3.48Å; S1123-T1126 PolarHBondContact OG-N 3.13Å; S1123-T1126 VanDerWaalsContact OG-N 3.11Å; S1123-T1126 PolarHBondContact OG-OG1 2.81Å; S1123-T1126 VanDerWaalsContact OG-OG1 3.06Å; T1126-L1129 PolarHBondContact O-N 3.5Å; T1126-L1130 HydrophobicContact CG2-CD1 3.91Å; T1126-L1130 HydrophobicContact CG2-CG 4.28Å; T1126-L1130 WeakPolarHBondContact O-CB 2.96Å; T1126-L1130 WeakPolarHBondContact O-CG 3.46Å; T1126-L1130 PolarHBondContact O-N 3.32Å
1127	R	85.1	Confident	73.9	Confident	94 Å²	94	86.4 Å²	86.4	36%	0.355	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-47.6	176.4	-169	-165.3	-176	-166.6	1.7	112	C1084 I1122 S1123 E1124 E1125 L1130 L1131	C1084-R1127 HydrophobicContact CB-CG 4.46Å; C1084-R1127 WeakPolarHBondContact SG-CG 3.37Å; I1122-R1127 HydrophobicContact CD1-CB 4.07Å; I1122-R1127 HydrophobicContact CD1-CG 4.04Å; I1122-R1127 HydrophobicContact CG1-CB 4.5Å; S1123-R1127 WeakPolarHBondContact O-CB 3.18Å; S1123-R1127 PolarHBondContact O-N 3.1Å; E1124-R1127 WeakPolarHBondContact O-CB 3.32Å; E1124-R1127 PolarHBondContact O-N 3.15Å; E1124-R1127 WeakPolarHBondContact OE1-CD 3.15Å; E1124-R1127 IonicContact OE1-CZ 2.78Å; E1124-R1127 IonicContact OE1-NE 2.69Å; E1124-R1127 IonicContact OE1-NH1 3.76Å; E1124-R1127 PolarHBondContact OE1-NH1 3.29Å; E1124-R1127 WeakPolarHBondContact OE2-CD 3.35Å; E1124-R1127 IonicContact OE2-CZ 3.58Å; E1124-R1127 IonicContact OE2-NE 3.35Å; E1124-R1127 IonicContact OE2-NH1 3.5Å; E1124-R1127 PolarHBondContact OE2-NH1 2.76Å; E1125-R1127 VanDerWaalsContact C-N 3.29Å; E1125-R1127 PolarHBondContact O-N 2.7Å; R1127-L1130 PolarHBondContact O-N 2.87Å; R1127-L1131 WeakPolarHBondContact O-CG 3.29Å; R1127-L1131 PolarHBondContact O-N 3.28Å; R1127-L1131 VanDerWaalsContact O-N 3.08Å
1128	V	83.1	Confident	71.8	Confident	72 Å²	72	89.9 Å²	89.9	44%	0.436	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-43.2	175.7	168.9	0	0	0	0	110.7	E1124 E1125 L1131 T1132	E1124-V1128 WeakPolarHBondContact O-CB 3.36Å; E1124-V1128 VanDerWaalsContact O-CG2 3.31Å; E1124-V1128 WeakPolarHBondContact O-CG2 3.44Å; E1124-V1128 PolarHBondContact O-N 3.07Å; E1125-V1128 PolarHBondContact O-N 3.4Å; V1128-L1131 PolarHBondContact O-N 2.43Å; V1128-T1132 HydrophobicContact CG1-CG2 4.24Å; V1128-T1132 WeakPolarHBondContact O-CB 3.41Å; V1128-T1132 WeakPolarHBondContact O-CG2 3.31Å; V1128-T1132 PolarHBondContact O-N 3.44Å; V1128-T1132 PolarHBondContact O-OG1 3.14Å
1129	L	84.2	Confident	69.4	Low	100 Å²	100	86.9 Å²	86.9	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-65.7	-41.9	178.7	-160.2	79.9	0	0	0	112.1	V1021 E1125 T1126 L1131 T1132 G1133	V1021-L1129 HydrophobicContact CG1-CD2 3.54Å; E1125-L1129 WeakPolarHBondContact O-CB 3.44Å; E1125-L1129 PolarHBondContact O-N 3.25Å; T1126-L1129 PolarHBondContact O-N 3.5Å; L1129-L1131 VanDerWaalsContact C-N 3.25Å; L1129-L1131 PolarHBondContact O-N 3.38Å; L1129-T1132 PolarHBondContact O-N 3.21Å; L1129-G1133 PolarHBondContact O-N 3.21Å
1130	L	84.6	Confident	66.8	Low	8 Å²	8	86.2 Å²	86.2	4%	0.042	50%	0.496	C	S	.	.	H	α-helix	trans	-60.8	-33.6	174.3	-74	171.5	0	0	0	112.1	L1024 R1025 K1028 V1081 T1126 R1127	L1024-L1130 HydrophobicContact CB-CD1 4.43Å; L1024-L1130 HydrophobicContact CB-CD2 4.32Å; R1025-L1130 HydrophobicContact CB-CD2 4.19Å; K1028-L1130 HydrophobicContact CB-CD2 4.11Å; K1028-L1130 HydrophobicContact CD-CD2 4.26Å; K1028-L1130 WeakPolarHBondContact CE-O 3.36Å; K1028-L1130 HydrophobicContact CG-CD2 4.42Å; K1028-L1130 PolarHBondContact NZ-O 3.27Å; V1081-L1130 HydrophobicContact CG2-CD1 4.19Å; T1126-L1130 HydrophobicContact CG2-CD1 3.91Å; T1126-L1130 HydrophobicContact CG2-CG 4.28Å; T1126-L1130 WeakPolarHBondContact O-CB 2.96Å; T1126-L1130 WeakPolarHBondContact O-CG 3.46Å; T1126-L1130 PolarHBondContact O-N 3.32Å; R1127-L1130 PolarHBondContact O-N 2.87Å
1131	L	79.4	Confident	64.1	Low	83 Å²	83	91.2 Å²	91.2	44%	0.435	52%	0.516	S	S	.	.	H	α-helix	trans	-81	-34.6	177.7	-69.2	178	0	0	0	113.9	S1088 R1127 V1128 L1129	S1088-L1131 VanDerWaalsContact CB-CD2 3.45Å; S1088-L1131 VanDerWaalsContact OG-CD2 3.25Å; S1088-L1131 WeakPolarHBondContact OG-CD2 3.45Å; R1127-L1131 WeakPolarHBondContact O-CG 3.29Å; R1127-L1131 PolarHBondContact O-N 3.28Å; R1127-L1131 VanDerWaalsContact O-N 3.08Å; V1128-L1131 PolarHBondContact O-N 2.43Å; L1129-L1131 VanDerWaalsContact C-N 3.25Å; L1129-L1131 PolarHBondContact O-N 3.38Å
1132	T	72.1	Confident	61.1	Low	100 Å²	100	94 Å²	94	61%	0.613	55%	0.553	S	S	*	*	H	α-helix	trans	-99.6	-21.1	-171.1	56.5	0	0	0	0	114.9	V1128 L1129 K1134	V1128-T1132 HydrophobicContact CG1-CG2 4.24Å; V1128-T1132 WeakPolarHBondContact O-CB 3.41Å; V1128-T1132 WeakPolarHBondContact O-CG2 3.31Å; V1128-T1132 PolarHBondContact O-N 3.44Å; V1128-T1132 PolarHBondContact O-OG1 3.14Å; L1129-T1132 PolarHBondContact O-N 3.21Å; T1132-K1134 PolarHBondContact O-N 2.98Å
1133	G	58.1	Low	58.1	Low	41 Å²	41	97.8 Å²	97.8	42%	0.423	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-63.7	127.2	-174.4	0	0	0	0	0	114.2	L1129	L1129-G1133 PolarHBondContact O-N 3.21Å
1134	K	41.1	Very low	55.5	Low	198 Å²	198	101.4 Å²	101.4	86%	0.861	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-72.9	141	162.4	-67.4	-178.9	-179.3	176.3	0	109.4	T1132 K1136	T1132-K1134 PolarHBondContact O-N 2.98Å; K1134-K1136 PolarHBondContact O-N 3.29Å
1135	P	43.9	Very low	52.9	Low	94 Å²	94	103.9 Å²	103.9	61%	0.61	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-66.4	134	175.2	28	-34.1	0	0	0	110.8
1136	K	36.6	Very low	50.2	Low	180 Å²	180	105 Å²	105	78%	0.783	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-73.5	153.8	161.1	-85.5	-177.7	175.6	175.2	0	109.2	K1134 A1138	K1134-K1136 PolarHBondContact O-N 3.29Å; K1136-A1138 PolarHBondContact O-N 3.48Å
1137	P	32.9	Very low	47.5	Very low	129 Å²	129	109.8 Å²	109.8	84%	0.838	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-61.2	121.6	162.7	-14.4	28.9	0	0	0	108.9	G1139	P1137-G1139 PolarHBondContact O-N 3.37Å
1138	A	37.5	Very low	44.8	Very low	84 Å²	84	110 Å²	110	69%	0.694	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-72.5	116.3	-179.2	0	0	0	0	0	110.6	K1136 V1140	K1136-A1138 PolarHBondContact O-N 3.48Å; A1138-V1140 VanDerWaalsContact C-N 3.27Å; A1138-V1140 HydrophobicContact CB-CG2 3.72Å; A1138-V1140 PolarHBondContact O-N 3.04Å
1139	G	28.6	Very low	42.2	Very low	81 Å²	81	111.5 Å²	111.5	84%	0.835	68%	0.678	S	S	*	*			trans	-77.7	71.4	173	0	0	0	0	0	111.5	P1137 L1141	P1137-G1139 PolarHBondContact O-N 3.37Å; G1139-L1141 PolarHBondContact O-N 3.35Å
1140	V	32.3	Very low	39.5	Very low	101 Å²	101	111.2 Å²	111.2	61%	0.612	69%	0.69	S	S	*	*			trans	-80.9	66.6	-174.6	-167.2	0	0	0	0	111.9	A1138	A1138-V1140 VanDerWaalsContact C-N 3.27Å; A1138-V1140 HydrophobicContact CB-CG2 3.72Å; A1138-V1140 PolarHBondContact O-N 3.04Å
1141	L	29.1	Very low	36.8	Very low	174 Å²	174	118 Å²	118	91%	0.911	73%	0.732	S	S	*	*	S	Bend	trans	-147.1	93.7	161.6	-77.4	-177.9	0	0	0	108.3	G1139	G1139-L1141 PolarHBondContact O-N 3.35Å
1142	G	27.9	Very low	34.3	Very low	85 Å²	85	117.1 Å²	117.1	88%	0.876	74%	0.743	S	S	*	*	S	Bend	trans	164.3	6.2	178.5	0	0	0	0	0	119.8
1143	A	28.2	Very low	32.1	Very low	90 Å²	90	124 Å²	124	74%	0.744	76%	0.758	S	S	*	*			trans	-135.8	-6.7	-175	0	0	0	0	0	117	N1145	A1143-N1145 PolarHBondContact O-N 2.86Å; A1143-N1145 VanDerWaalsContact O-N 3.13Å
1144	V	31.2	Very low	30.5	Very low	125 Å²	125	131.8 Å²	131.8	76%	0.758	78%	0.78	S	S	*	*			trans	-90.3	72.6	177.6	-170.6	0	0	0	0	109.9
1145	N	27.9	Very low	30	Very low	160 Å²	160	128.1 Å²	128.1	86%	0.856	78%	0.776	S	S	*	*			trans	-164.9	61.5	171.7	-106.2	-40.6	0	0	0	111.5	A1143	A1143-N1145 PolarHBondContact O-N 2.86Å; A1143-N1145 VanDerWaalsContact O-N 3.13Å
1146	K	26.8	Very low	29.2	Very low	192 Å²	192	134.6 Å²	134.6	84%	0.835	79%	0.79	S	S	*	*			trans	-136.3	123.8	159.7	-76.9	-172.4	177.8	177.1	0	108.6
1147	P	26.9	Very low	28.7	Very low	114 Å²	114	131.8 Å²	131.8	74%	0.74	79%	0.787	S	S	*	*			trans	-66	148.2	177.2	28.3	-34.5	0	0	0	110.6	S1149	P1147-S1149 VanDerWaalsContact C-N 3.35Å; P1147-S1149 PolarHBondContact O-N 2.81Å
1148	L	28.9	Very low	28.5	Very low	98 Å²	98	136.6 Å²	136.6	51%	0.513	79%	0.789	S	S	.	*			trans	-66.4	86.7	176.5	-70.1	168	0	0	0	110.7	L916 A1150	L916-L1148 HydrophobicContact CD1-CD1 4.48Å; L1148-A1150 PolarHBondContact O-N 3.41Å
1149	S	27.3	Very low	28.1	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	79%	0.789	S	S	*	*			trans	-73.3	94.7	178.6	64.2	0	0	0	0	110.9	P1147 T1151	P1147-S1149 VanDerWaalsContact C-N 3.35Å; P1147-S1149 PolarHBondContact O-N 2.81Å; S1149-T1151 PolarHBondContact O-N 3.18Å; S1149-T1151 VanDerWaalsContact O-N 3.13Å
1150	A	29.3	Very low	28.1	Very low	94 Å²	94	140.6 Å²	140.6	78%	0.777	79%	0.793	S	S	*	*			trans	-58.6	113.8	179	0	0	0	0	0	112.1	L1148 G1152	L1148-A1150 PolarHBondContact O-N 3.41Å; A1150-G1152 PolarHBondContact O-N 3.05Å
1151	T	26.2	Very low	28	Very low	151 Å²	151	139.6 Å²	139.6	93%	0.926	80%	0.803	S	S	*	*			trans	-74.2	72.2	176.8	43.7	0	0	0	0	111.1	S1149	S1149-T1151 PolarHBondContact O-N 3.18Å; S1149-T1151 VanDerWaalsContact O-N 3.13Å
1152	G	26.7	Very low	28.1	Very low	64 Å²	64	137.7 Å²	137.7	66%	0.66	80%	0.799	S	S	*	*			trans	-140.2	12.2	-162.9	0	0	0	0	0	118.4	A1150	A1150-G1152 PolarHBondContact O-N 3.05Å
1153	R	25.9	Very low	28.3	Very low	245 Å²	245	141.8 Å²	141.8	93%	0.925	80%	0.795	S	S	*	*			trans	-140	127.3	172.5	-74.7	-168.4	174.4	-178.8	-0.2	113.6
1154	K	26.1	Very low	28.5	Very low	204 Å²	204	144.1 Å²	144.1	89%	0.887	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.4	135.2	165.8	-65.6	179.7	178	179.9	0	109.3
1155	P	29.8	Very low	28.4	Very low	121 Å²	121	141.9 Å²	141.9	79%	0.786	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-76.4	141.9	174.7	31.2	-33.8	0	0	0	111.3
1156	Y	26.9	Very low	28.6	Very low	230 Å²	230	139.9 Å²	139.9	90%	0.902	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-104	132.4	168.3	-155.2	-85.5	0	0	0	108.5
1157	V	26.9	Very low	28.6	Very low	120 Å²	120	138.6 Å²	138.6	73%	0.727	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-99.9	125.1	-171.8	176.1	0	0	0	0	111
1158	R	29.3	Very low	28.8	Very low	231 Å²	231	141.3 Å²	141.3	87%	0.872	81%	0.81	S	S	*	*			trans	-167.5	111.7	144.5	-110.5	167.3	-170.4	-165.5	1.6	114.4
1159	S	27.2	Very low	28.7	Very low	99 Å²	99	143.6 Å²	143.6	69%	0.692	82%	0.823	S	S	*	*			trans	51.3	136.7	138.4	-61.2	0	0	0	0	124.8
1160	T	29.5	Very low	28.8	Very low	149 Å²	149	145.2 Å²	145.2	91%	0.914	83%	0.828	S	S	*	*			trans	73.3	116.3	140.2	47.3	0	0	0	0	120.9
1161	G	30.6	Very low	28.7	Very low	80 Å²	80	147.2 Å²	147.2	83%	0.825	83%	0.825	S	S	*	*			trans	169.4	111.3	165.8	0	0	0	0	0	110.3
1162	T	30.1	Very low	28.9	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	82%	0.824	S	S	*	*			trans	-81	169	172.5	42.5	0	0	0	0	110
1163	E	32.5	Very low	29	Very low	172 Å²	172	151 Å²	151	80%	0.804	83%	0.83	S	S	*	*			cis	-152.5	175.8	41.7	-66.7	177.3	143	0	0	114.3
1164	T	32.7	Very low	29.1	Very low	138 Å²	138	146.1 Å²	146.1	85%	0.847	82%	0.821	S	S	*	*			trans	-1.9	133.9	161.5	56.4	0	0	0	0	118.8
1165	G	29.8	Very low	29.2	Very low	79 Å²	79	143.3 Å²	143.3	81%	0.814	82%	0.816	S	S	*	*				122	154.9	54.8	0	0	0	0	0	108.2
1166	S	32.4	Very low	29.5	Very low	118 Å²	118	143 Å²	143	83%	0.825	81%	0.814	S	S	*	*			cis	-156.1	160.5	7.6	52.7	0	0	0	0	111
1167	N	24.8	Very low	29.6	Very low	164 Å²	164	137.7 Å²	137.7	88%	0.877	81%	0.811	S	S	*	*			trans	-92.3	139.1	175.5	-71.1	-32.2	0	0	0	112.9
1168	I	32.8	Very low	29.5	Very low	171 Å²	171	139.2 Å²	139.2	88%	0.877	82%	0.82	S	S	*	*			trans	-139.2	136.9	149.5	-65.8	-172.3	0	0	0	109.5
1169	N	25.2	Very low	29.5	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	82%	0.816	S	S	*	*			trans	-113.1	151.6	171.3	-128	6.2	0	0	0	108.2
1170	V	30.5	Very low	29.4	Very low	138 Å²	138	135.2 Å²	135.2	84%	0.836	83%	0.827	S	S	*	*			trans	-179	144.3	142.8	140.3	0	0	0	0	110.6
1171	N	26.9	Very low	29.5	Very low	136 Å²	136	140 Å²	140	73%	0.727	83%	0.828	S	S	*	*			trans	-84.8	164.9	-179.1	-61.5	-13.8	0	0	0	113.1
1172	S	31.2	Very low	29.4	Very low	130 Å²	130	141.5 Å²	141.5	91%	0.909	83%	0.826	S	S	*	*			trans	-151.9	150.5	140.3	-78.4	0	0	0	0	110.1
1173	E	28.6	Very low	29.1	Very low	164 Å²	164	146.1 Å²	146.1	77%	0.766	83%	0.828	S	S	*	*			trans	-120.1	152.2	-168.4	-77	-171.5	131.3	0	0	112.6
1174	L	28.1	Very low	28.9	Very low	144 Å²	144	146.7 Å²	146.7	75%	0.754	83%	0.831	S	S	*	*			trans	60.7	144.1	151.1	-63.2	164.5	0	0	0	117.3
1175	N	27.9	Very low	28.5	Very low	144 Å²	144	148.8 Å²	148.8	77%	0.77	83%	0.831	S	S	*	*			cis	-154	176.6	34.7	-118.3	-22.3	0	0	0	111.5
1176	P	35.6	Very low	28.3	Very low	115 Å²	115	150.5 Å²	150.5	75%	0.747	83%	0.831	S	S	*	*			trans	-99.8	168.4	-163.5	39.1	-38.8	0	0	0	116.2
1177	S	29.6	Very low	28.1	Very low	119 Å²	119	149.9 Å²	149.9	83%	0.832	83%	0.826	S	S	*	*			trans	-140.9	136.8	160.4	62.8	0	0	0	0	112
1178	T	25	Very low	28	Very low	151 Å²	151	151.8 Å²	151.8	93%	0.926	83%	0.83	S	S	*	*			trans	-68.5	143	179.3	41.2	0	0	0	0	113.9
1179	G	28.6	Very low	27.8	Very low	77 Å²	77	147.1 Å²	147.1	79%	0.794	82%	0.817	S	S	*	*			trans	-153.2	125.2	170	0	0	0	0	0	111.9
1180	N	25	Very low	27.7	Very low	170 Å²	170	145.1 Å²	145.1	91%	0.909	82%	0.82	S	S	*	*			trans	-67.4	134.9	-177.6	-79.7	-28.4	0	0	0	112.5
1181	R	31	Very low	27.5	Very low	249 Å²	249	147 Å²	147	94%	0.94	82%	0.82	S	S	*	*			trans	-150.5	135	138.3	-113.5	166.6	-163.8	-163.1	2.1	113.4
1182	S	29.7	Very low	27.3	Very low	111 Å²	111	147 Å²	147	78%	0.776	83%	0.825	S	S	*	*			trans	-40.3	150.9	-173.2	-49	0	0	0	0	118.5
1183	R	24.1	Very low	26.9	Very low	232 Å²	232	144.4 Å²	144.4	88%	0.875	82%	0.819	S	S	*	*			trans	-66.7	130.8	154.5	-85.6	171.9	159.2	160.3	-8.6	110.5
1184	E	26.7	Very low	26.6	Very low	183 Å²	183	143.4 Å²	143.4	86%	0.855	82%	0.824	S	S	*	*			trans	-110.6	132.9	142.2	-65.9	168.3	166.4	0	0	104
1185	Q	24.5	Very low	26.5	Very low	183 Å²	183	141.1 Å²	141.1	86%	0.855	82%	0.82	S	S	*	*			cis	62.6	41.3	24.8	-77	-166.8	-26.3	0	0	114.7	S1187	Q1185-S1187 PolarHBondContact O-N 3.14Å
1186	S	26.5	Very low	26.3	Very low	115 Å²	115	140.1 Å²	140.1	80%	0.804	81%	0.811	S	S	*	*			trans	-57.5	118.1	150.5	54.6	0	0	0	0	110.2
1187	S	27.6	Very low	25.8	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	81%	0.809	S	S	*	*			trans	-67.9	150.7	-178	49.4	0	0	0	0	114	Q1185 A1189	Q1185-S1187 PolarHBondContact O-N 3.14Å; S1187-A1189 PolarHBondContact O-N 3.03Å
1188	E	23.9	Very low	25.6	Very low	205 Å²	205	141.4 Å²	141.4	96%	0.958	80%	0.798	S	S	*	*			trans	-67.2	100	161.9	-66.8	-178.5	128.6	0	0	109.6
1189	A	27.8	Very low	25.6	Very low	73 Å²	73	140 Å²	140	60%	0.603	78%	0.781	S	S	*	*			trans	-83.9	123.4	171.3	0	0	0	0	0	110	S1187 E1191	S1187-A1189 PolarHBondContact O-N 3.03Å; A1189-E1191 VanDerWaalsContact C-N 3.33Å; A1189-E1191 PolarHBondContact O-N 3.24Å
1190	A	24.2	Very low	25.5	Very low	104 Å²	104	140.1 Å²	140.1	86%	0.86	76%	0.763	S	S	*	*			trans	-80.3	76	177.7	0	0	0	0	0	111.2	T1192	A1190-T1192 PolarHBondContact O-N 3.13Å
1191	E	25.1	Very low	25.6	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	75%	0.754	S	S	*	*			trans	-74.3	112.7	177.8	-70.9	-168.6	155	0	0	112.3	A1189 G1193	A1189-E1191 VanDerWaalsContact C-N 3.33Å; A1189-E1191 PolarHBondContact O-N 3.24Å; E1191-G1193 PolarHBondContact O-N 3.02Å
1192	T	22.3	Very low	25.3	Very low	135 Å²	135	128.8 Å²	128.8	83%	0.828	73%	0.73	S	S	*	*			trans	-74.9	69.5	172.2	49.3	0	0	0	0	111.4	A1190 V1194	A1190-T1192 PolarHBondContact O-N 3.13Å; T1192-V1194 PolarHBondContact O-N 3.35Å
1193	G	23.6	Very low	25.4	Very low	76 Å²	76	134 Å²	134	78%	0.784	73%	0.732	S	S	*	*			trans	-70.4	84.4	-177.9	0	0	0	0	0	114.3	E1191	E1191-G1193 PolarHBondContact O-N 3.02Å
1194	V	22.5	Very low	25.5	Very low	143 Å²	143	126.7 Å²	126.7	87%	0.867	71%	0.71	S	S	*	*			trans	-80.4	112.9	167.6	179.3	0	0	0	0	109.1	T1192	T1192-V1194 PolarHBondContact O-N 3.35Å
1195	S	25.8	Very low	25.5	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	69%	0.693	S	S	*	*			trans	-154.5	152.2	169.8	-162.9	0	0	0	0	111.9
1196	E	23.6	Very low	25.5	Very low	122 Å²	122	118.7 Å²	118.7	57%	0.57	69%	0.686	S	S	*	*			trans	-83.3	150.3	-157.9	-54	-161.6	107.1	0	0	115.1	K693	K693-E1196 IonicContact NZ-OE1 3.86Å; K693-E1196 PolarHBondContact NZ-OE1 3.12Å; K693-E1196 IonicContact NZ-OE2 2.67Å; K693-E1196 PolarHBondContact NZ-OE2 3.25Å
1197	N	25.9	Very low	25.3	Very low	132 Å²	132	119.1 Å²	119.1	71%	0.706	68%	0.683	S	S	*	*			trans	-153	46.4	159.8	-121.1	-86	0	0	0	112.7	E1199	N1197-E1199 PolarHBondContact O-N 3.44Å
1198	E	24.8	Very low	25.3	Very low	130 Å²	130	120 Å²	120	61%	0.607	68%	0.684	S	S	*	*			trans	-70.9	59	-179.1	-84.8	-70.1	113.5	0	0	113.7	K500	K500-E1198 IonicContact NZ-OE1 3.51Å
1199	E	24.8	Very low	25.3	Very low	122 Å²	122	116.1 Å²	116.1	57%	0.57	68%	0.677	S	S	*	*	S	Bend	trans	-157.9	38.6	164.1	-134.7	-167.9	-131.1	0	0	115.3	K737 K938 N1197	K737-E1199 IonicContact NZ-OE1 2.69Å; K737-E1199 PolarHBondContact NZ-OE1 3.45Å; K938-E1199 PolarHBondContact NZ-O 2.74Å; N1197-E1199 PolarHBondContact O-N 3.44Å
1200	N	27.1	Very low	25.3	Very low	78 Å²	78	119.1 Å²	119.1	42%	0.417	69%	0.687	S	S	.	*			trans	-154.9	121.6	170.3	-85.3	-63.9	0	0	0	117.3	K938 V1202	K938-N1200 WeakPolarHBondContact CD-OD1 3.26Å; K938-N1200 WeakPolarHBondContact CE-OD1 3.29Å; K938-N1200 VanDerWaalsContact NZ-CG 3.26Å; K938-N1200 PolarHBondContact NZ-ND2 2.59Å; K938-N1200 PolarHBondContact NZ-OD1 3.37Å; N1200-V1202 PolarHBondContact O-N 3.05Å
1201	P	26.4	Very low	25.4	Very low	110 Å²	110	123.1 Å²	123.1	71%	0.714	69%	0.685	S	S	*	*			trans	-91.2	64.8	166.2	36.9	-33.9	0	0	0	112.2
1202	V	23.7	Very low	25.4	Very low	72 Å²	72	122.1 Å²	122.1	44%	0.436	69%	0.686	S	S	.	*			trans	-142.1	102.2	168	-171.9	0	0	0	0	110.9	N1200	N1200-V1202 PolarHBondContact O-N 3.05Å
1203	R	32.6	Very low	25.8	Very low	219 Å²	219	123.3 Å²	123.3	83%	0.826	69%	0.686	S	S	*	*			trans	-126.5	120.2	158.5	-73.6	-171.6	176.2	-173.7	-0.6	106.6
1204	I	26.9	Very low	25.9	Very low	80 Å²	80	126.1 Å²	126.1	41%	0.41	68%	0.683	S	S	.	*				63.4	78.7	79.6	-59.7	162.6	0	0	0	109.3
1205	I	25.2	Very low	26.3	Very low	96 Å²	96	125.3 Å²	125.3	49%	0.492	68%	0.68	S	S	.	*			trans	-90.3	103.9	168.1	-64.4	173.4	0	0	0	106.7	Q970 V1207	Q970-I1205 PolarHBondContact NE2-O 2.91Å; I1205-V1207 HydrophobicContact CG2-CG2 3.91Å
1206	S	26.2	Very low	26.4	Very low	102 Å²	102	126.9 Å²	126.9	71%	0.713	69%	0.685	S	S	*	*			trans	-96.7	119.5	169.9	52.3	0	0	0	0	109.1
1207	V	22.4	Very low	26.6	Very low	124 Å²	124	130.1 Å²	130.1	75%	0.752	70%	0.698	S	S	*	*			trans	-119.4	103.3	172.9	177	0	0	0	0	108.2	I1205	I1205-V1207 HydrophobicContact CG2-CG2 3.91Å
1208	T	26	Very low	26.8	Very low	122 Å²	122	132 Å²	132	75%	0.748	71%	0.707	S	S	*	*			trans	-150.6	116.5	162.7	-3.5	0	0	0	0	107.7	V1210	T1208-V1210 PolarHBondContact O-N 3.32Å
1209	P	23.6	Very low	27	Very low	124 Å²	124	134.2 Å²	134.2	81%	0.805	72%	0.715	S	S	*	*			trans	-76.8	104.3	178.5	30	-32.3	0	0	0	109.6
1210	V	28.2	Very low	27	Very low	135 Å²	135	137.6 Å²	137.6	82%	0.818	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-78.1	134.7	165.9	-177.5	0	0	0	0	107.9	T1208	T1208-V1210 PolarHBondContact O-N 3.32Å
1211	K	26.7	Very low	27.2	Very low	188 Å²	188	140.5 Å²	140.5	82%	0.817	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-70.8	145.6	-177.3	-62.8	177.6	179.4	179.9	0	110.6
1212	N	26	Very low	27.1	Very low	158 Å²	158	142.4 Å²	142.4	85%	0.845	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-58.1	144.2	164.8	-65.5	-6.5	0	0	0	110.1
1213	I	29	Very low	27.5	Very low	160 Å²	160	145 Å²	145	82%	0.821	77%	0.77	S	S	*	*			trans	-119	135.2	160.4	-64.8	177.3	0	0	0	105.5
1214	D	26	Very low	27.3	Very low	135 Å²	135	141.5 Å²	141.5	72%	0.722	77%	0.768	S	S	*	*			trans	-71	141.9	-168.3	-54.9	-80.5	0	0	0	113.4	V1216	D1214-V1216 PolarHBondContact O-N 3.11Å; D1214-V1216 VanDerWaalsContact O-N 3.11Å
1215	P	31.2	Very low	27.5	Very low	126 Å²	126	146.9 Å²	146.9	82%	0.818	79%	0.792	S	S	*	*			trans	-70.2	103.8	161.3	29.9	-31.3	0	0	0	108.8
1216	V	28.9	Very low	27.8	Very low	129 Å²	129	146.5 Å²	146.5	78%	0.782	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-64	141.3	177.9	175.3	0	0	0	0	110.4	D1214 N1218	D1214-V1216 PolarHBondContact O-N 3.11Å; D1214-V1216 VanDerWaalsContact O-N 3.11Å; V1216-N1218 PolarHBondContact O-N 2.68Å
1217	K	26.9	Very low	28	Very low	190 Å²	190	147.5 Å²	147.5	83%	0.826	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-57.8	120.9	-178.9	-63.6	168.6	-179.9	174.9	0	111.4	K1219	K1217-K1219 PolarHBondContact O-N 2.7Å
1218	N	29.5	Very low	28.6	Very low	171 Å²	171	150.7 Å²	150.7	91%	0.914	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-63.5	116.1	158.1	-84.1	-7.6	0	0	0	108.5	V1216	V1216-N1218 PolarHBondContact O-N 2.68Å
1219	K	29.1	Very low	28.8	Very low	178 Å²	178	148.4 Å²	148.4	77%	0.774	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-102	125.2	169	-120.8	-169.4	176.3	-167.7	0	107.9	K1217 I1221	K1217-K1219 PolarHBondContact O-N 2.7Å; K1219-I1221 PolarHBondContact O-N 3.25Å
1220	E	24.7	Very low	29.1	Very low	192 Å²	192	149.9 Å²	149.9	90%	0.897	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.2	164.7	-57.5	162.7	124.9	0	0	108.6
1221	I	31.2	Very low	29.5	Very low	139 Å²	139	151 Å²	151	71%	0.713	81%	0.813	S	S	*	*			trans	-141	119.1	160.4	-64.3	-174.2	0	0	0	108.3	K1219	K1219-I1221 PolarHBondContact O-N 3.25Å
1222	N	26	Very low	29.7	Very low	150 Å²	150	146.7 Å²	146.7	80%	0.802	81%	0.807	S	S	*	*			trans	-65.2	150.2	170.4	-64.8	-30.9	0	0	0	111.1
1223	S	30.9	Very low	30	Very low	126 Å²	126	144.5 Å²	144.5	88%	0.881	80%	0.803	S	S	*	*			trans	-127.4	65.6	167.5	41.4	0	0	0	0	111.4
1224	D	27.9	Very low	30	Very low	147 Å²	147	143.7 Å²	143.7	79%	0.786	80%	0.801	S	S	*	*			trans	-104	109.9	168.9	-100.7	-39	0	0	0	110.7
1225	Q	32.9	Very low	30.2	Very low	193 Å²	193	148.5 Å²	148.5	90%	0.902	81%	0.809	S	S	*	*			trans	-177	100.1	149	-104.5	165.8	47.1	0	0	107.3
1226	A	30.1	Very low	30.1	Very low	87 Å²	87	145.8 Å²	145.8	72%	0.719	80%	0.804	S	S	*	*			cis	89.7	119.9	45.6	0	0	0	0	0	114.1
1227	T	31.3	Very low	30.3	Very low	123 Å²	123	149.1 Å²	149.1	76%	0.755	81%	0.808	S	S	*	*			trans	-165.7	125	150.9	8.9	0	0	0	0	110.3
1228	Q	35	Very low	30.5	Very low	192 Å²	192	149.9 Å²	149.9	90%	0.897	81%	0.811	S	S	*	*			trans	62	132.7	155	-54.2	169.5	9.5	0	0	118.6
1229	G	29.4	Very low	30.5	Very low	73 Å²	73	152.7 Å²	152.7	75%	0.753	81%	0.809	S	S	*	*			cis	172.9	139	-10.5	0	0	0	0	0	114.1
1230	N	31.2	Very low	30.6	Very low	156 Å²	156	150.4 Å²	150.4	83%	0.834	81%	0.81	S	S	*	*			trans	32.8	115.9	149.9	-75.9	1.6	0	0	0	121.8
1231	I	34.8	Very low	30.8	Very low	157 Å²	157	147 Å²	147	81%	0.805	80%	0.803	S	S	*	*				168.1	119.1	113.2	-87.8	152.4	0	0	0	114.6
1232	S	31.8	Very low	30.6	Very low	99 Å²	99	146.7 Å²	146.7	69%	0.692	81%	0.807	S	S	*	*			trans	37.3	121.7	138.7	-44	0	0	0	0	125.1
1233	S	31.8	Very low	30.8	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	81%	0.806	S	S	*	*				29.8	154.1	120.1	72	0	0	0	0	122.4
1234	D	30.5	Very low	30.8	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	81%	0.807	S	S	*	*			cis	-158.1	-173.9	21.8	-153.8	-6.2	0	0	0	114.4
1235	R	30.2	Very low	30.9	Very low	236 Å²	236	140 Å²	140	89%	0.891	81%	0.809	S	S	*	*			trans	-84.6	172.6	-170.4	-61.6	150.9	152.6	169.3	-8.1	116
1236	G	28.5	Very low	30.8	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	80%	0.801	S	S	*	*			trans	-165.9	82.8	166	0	0	0	0	0	119.6
1237	K	32.4	Very low	30.9	Very low	199 Å²	199	139 Å²	139	87%	0.865	81%	0.805	S	S	*	*			trans	171.7	95.6	148.8	-97.7	161.1	-175.3	178.9	0	108.4
1238	K	32	Very low	30.8	Very low	206 Å²	206	138.6 Å²	138.6	90%	0.896	80%	0.798	S	S	*	*				79.9	149	73.9	-80.7	-168.8	176.4	-174.1	0	114.1
1239	R	29	Very low	30.7	Very low	229 Å²	229	135.3 Å²	135.3	86%	0.864	79%	0.785	S	S	*	*			cis	-179.5	-177.6	-47.9	-123.9	-174.7	171.4	176.5	-2.8	108
1240	T	31.1	Very low	30.7	Very low	131 Å²	131	139.2 Å²	139.2	80%	0.804	78%	0.784	S	S	*	*			trans	67.6	140.5	169.3	49.5	0	0	0	0	118.3
1241	V	28	Very low	30.5	Very low	121 Å²	121	138.9 Å²	138.9	73%	0.733	78%	0.777	S	S	*	*			cis	139.6	118.7	-24.8	169	0	0	0	0	112.2
1242	T	28.4	Very low	30.3	Very low	131 Å²	131	140 Å²	140	80%	0.804	78%	0.776	S	S	*	*			trans	51.3	125.8	164.1	56	0	0	0	0	122
1243	A	29.9	Very low	30	Very low	96 Å²	96	140.7 Å²	140.7	79%	0.793	78%	0.776	S	S	*	*				166.5	149	96	0	0	0	0	0	116.4
1244	A	30.3	Very low	30.1	Very low	107 Å²	107	142.5 Å²	142.5	88%	0.884	78%	0.777	S	S	*	*			trans	73	139.9	149.1	0	0	0	0	0	123.8
1245	G	29.4	Very low	30.1	Very low	81 Å²	81	142.5 Å²	142.5	84%	0.835	77%	0.773	S	S	*	*			trans	82.1	120.7	176.2	0	0	0	0	0	114
1246	A	32.4	Very low	30.1	Very low	90 Å²	90	139 Å²	139	74%	0.744	76%	0.764	S	S	*	*			cis	-167.6	170.8	7.5	0	0	0	0	0	107.8
1247	E	30.9	Very low	30.2	Very low	168 Å²	168	141.9 Å²	141.9	79%	0.785	77%	0.767	S	S	*	*			cis	-176.2	163	-14.9	-106.3	-167.4	-104.5	0	0	108.4
1248	N	30.7	Very low	29.9	Very low	114 Å²	114	139.5 Å²	139.5	61%	0.61	76%	0.764	S	S	*	*			cis	-160.3	161	-18.2	-135.9	-13.5	0	0	0	113.4
1249	I	32.3	Very low	29.8	Very low	123 Å²	123	138.1 Å²	138.1	63%	0.631	76%	0.761	S	S	*	*			trans	53.9	114	143.6	-74.1	162.6	0	0	0	124.6
1250	Q	29.3	Very low	29.7	Very low	155 Å²	155	133.5 Å²	133.5	72%	0.724	76%	0.764	S	S	*	*				49.6	133.9	129.1	-54	-179.5	-65.9	0	0	126.6
1251	Q	27.5	Very low	29.6	Very low	150 Å²	150	130.9 Å²	130.9	70%	0.701	76%	0.762	S	S	*	*			trans	80.9	130.2	136.7	-82.8	-173.2	27.9	0	0	123.4
1252	K	29.4	Very low	29.9	Very low	180 Å²	180	130.9 Å²	130.9	78%	0.783	77%	0.765	S	S	*	*			trans	68.5	142.7	160.2	-62.8	175.5	-178.1	176.6	0	116.7
1253	T	26.9	Very low	29.9	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.693	76%	0.763	S	S	*	*			cis	-154.1	173.9	-13.1	7.5	0	0	0	0	108.7
1254	D	32.1	Very low	30	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	76%	0.76	S	S	*	*			trans	71.6	126.6	170.3	-48.2	-35	0	0	0	116.1
1255	E	30.6	Very low	29.9	Very low	144 Å²	144	130.8 Å²	130.8	67%	0.673	76%	0.757	S	S	*	*			cis	-136.1	151.3	-3.4	-69	-157.2	101.4	0	0	112.5
1256	K	31.4	Very low	30	Very low	162 Å²	162	131.9 Å²	131.9	70%	0.704	75%	0.752	S	S	*	*			trans	55.6	118.8	143.1	-70.3	161.1	-172.2	157.6	0	119.7
1257	V	31.3	Very low	29.8	Very low	131 Å²	131	136.6 Å²	136.6	79%	0.794	76%	0.755	S	S	*	*				62.4	105.5	83.8	173.8	0	0	0	0	110.4
1258	D	24.9	Very low	29.7	Very low	149 Å²	149	135 Å²	135	80%	0.797	76%	0.759	S	S	*	*			cis	73.3	150.6	32.8	-145.8	-4.8	0	0	0	114.7
1259	E	29.2	Very low	29.6	Very low	177 Å²	177	140.4 Å²	140.4	83%	0.827	77%	0.771	S	S	*	*			trans	62.8	140.3	-171.5	-65.3	-157.3	109.5	0	0	119.8
1260	S	28.7	Very low	29.4	Very low	132 Å²	132	146 Å²	146	92%	0.923	79%	0.785	S	S	*	*			trans	71.1	130.9	164.2	80.1	0	0	0	0	119.4
1261	G	29.2	Very low	29.2	Very low	75 Å²	75	141.9 Å²	141.9	77%	0.773	78%	0.784	S	S	*	*			trans	141.5	80	176.4	0	0	0	0	0	114.4
1262	P	33.1	Very low	29.3	Very low	121 Å²	121	145.4 Å²	145.4	79%	0.786	79%	0.791	S	S	*	*			trans	-89.2	175.1	-169.6	38.3	-37.3	0	0	0	113.4
1263	P	28.9	Very low	29.2	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	79%	0.792	S	S	*	*			trans	-75.5	136.9	-160.8	29.2	-35.7	0	0	0	114.8
1264	A	31.7	Very low	29.5	Very low	88 Å²	88	146.9 Å²	146.9	73%	0.727	79%	0.793	S	S	*	*			trans	-86.1	105.7	163.1	0	0	0	0	0	109.5
1265	P	28.7	Very low	29.1	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	80%	0.796	S	S	*	*				-118	84.1	98.8	34.1	-33.8	0	0	0	112.4	K1267	P1265-K1267 PolarHBondContact O-N 3.06Å
1266	S	31	Very low	28.9	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	80%	0.798	S	S	*	*			trans	-88.9	95.6	178.9	59.8	0	0	0	0	112.8
1267	K	29.1	Very low	28.7	Very low	188 Å²	188	148 Å²	148	82%	0.817	80%	0.804	S	S	*	*			trans	25.4	130.7	147.5	-65.2	173.4	179.4	172	0	119.6	P1265	P1265-K1267 PolarHBondContact O-N 3.06Å
1268	P	27.5	Very low	28.6	Very low	134 Å²	134	146.7 Å²	146.7	87%	0.87	80%	0.801	S	S	*	*			trans	-70.4	149.3	176.5	32.4	-36.7	0	0	0	112.7
1269	R	28.4	Very low	28.9	Very low	228 Å²	228	149.1 Å²	149.1	86%	0.86	81%	0.808	S	S	*	*			trans	-146.8	95	170.8	-147.7	177	-165	-164.2	4.2	114.2
1270	R	28.4	Very low	28.9	Very low	241 Å²	241	144.5 Å²	144.5	91%	0.909	81%	0.808	S	S	*	*			trans	68.2	124.2	168.2	-60.2	176	173	176.7	-4.3	115
1271	G	26	Very low	29	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	81%	0.807	S	S	*	*			cis	-161.1	162.5	5.7	0	0	0	0	0	117.1
1272	R	28.4	Very low	29.2	Very low	224 Å²	224	146.6 Å²	146.6	85%	0.845	80%	0.802	S	S	*	*				33.9	121.2	120.9	-155.2	-172.5	-154	-150	7.2	115.3
1273	R	28.2	Very low	29.2	Very low	211 Å²	211	147.1 Å²	147.1	80%	0.796	80%	0.803	S	S	*	*			cis	-162.2	167.2	2.2	-117.6	-178.3	178.6	-177	-1.8	107.5
1274	P	32.3	Very low	29.5	Very low	113 Å²	113	148 Å²	148	73%	0.734	80%	0.795	S	S	*	*			trans	-81.7	166.6	168	35.1	-35	0	0	0	112.9
1275	K	25	Very low	29.6	Very low	196 Å²	196	150.2 Å²	150.2	85%	0.852	80%	0.795	S	S	*	*			trans	77.9	135.3	172.2	-63	-172.2	174.1	-176.8	0	118.9
1276	S	25.7	Very low	30	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	78%	0.782	S	S	*	*			trans	64.8	128.2	141.5	54.5	0	0	0	0	122.7
1277	E	27.4	Very low	30.2	Very low	180 Å²	180	149.3 Å²	149.3	84%	0.841	78%	0.775	S	S	*	*			trans	85.3	129.1	141.3	-71.4	179.1	153.5	0	0	123
1278	S	28.9	Very low	30.5	Very low	104 Å²	104	146.1 Å²	146.1	73%	0.727	77%	0.766	S	S	*	*			trans	63.5	113	147.4	57.1	0	0	0	0	123
1279	Q	30.3	Very low	30.9	Very low	201 Å²	201	146.7 Å²	146.7	94%	0.939	76%	0.762	S	S	*	*				43	126.1	122.1	-58.9	179.4	0.2	0	0	120.7
1280	G	29.9	Very low	31.2	Very low	80 Å²	80	142.4 Å²	142.4	83%	0.825	75%	0.749	S	S	*	*			trans	178.7	79.4	165.4	0	0	0	0	0	116.9
1281	N	31	Very low	31.6	Very low	170 Å²	170	135.5 Å²	135.5	91%	0.909	74%	0.735	S	S	*	*			trans	-66.3	171.3	166.4	-79.2	-0.9	0	0	0	112.5
1282	A	33.5	Very low	31.9	Very low	81 Å²	81	139.4 Å²	139.4	67%	0.669	74%	0.738	S	S	*	*			cis	173.8	154.9	-29.5	0	0	0	0	0	108.8
1283	T	33.5	Very low	32.1	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	73%	0.729	S	S	*	*			trans	-146.5	124.2	162	25.4	0	0	0	0	107.7
1284	K	35.4	Very low	32.2	Very low	138 Å²	138	133.5 Å²	133.5	60%	0.6	73%	0.731	S	S	*	*				83.2	149.3	56.5	-76.3	-178.5	143.6	-68.5	0	112.6	D1286	K1284-D1286 VanDerWaalsContact NZ-CG 3.33Å; K1284-D1286 IonicContact NZ-OD1 3.84Å; K1284-D1286 IonicContact NZ-OD2 2.83Å; K1284-D1286 PolarHBondContact NZ-OD2 2.72Å
1285	N	33.4	Very low	32.1	Very low	134 Å²	134	131.7 Å²	131.7	72%	0.717	73%	0.732	S	S	*	*			cis	-152.2	147.2	18.2	-161.6	86.6	0	0	0	111.6
1286	D	35.8	Very low	32.3	Very low	102 Å²	102	134.2 Å²	134.2	55%	0.545	74%	0.736	S	S	.	*			cis	-167.1	166.3	-31	-104.6	18.4	0	0	0	107.7	K1284	K1284-D1286 VanDerWaalsContact NZ-CG 3.33Å; K1284-D1286 IonicContact NZ-OD1 3.84Å; K1284-D1286 IonicContact NZ-OD2 2.83Å; K1284-D1286 PolarHBondContact NZ-OD2 2.72Å
1287	D	35.8	Very low	32.6	Very low	109 Å²	109	139.9 Å²	139.9	58%	0.583	75%	0.748	S	S	*	*			trans	64	-161.3	173.4	-132.2	-18.6	0	0	0	112.3	N1289 K1290	D1287-N1289 PolarHBondContact OD1-N 2.73Å; D1287-N1289 VanDerWaalsContact OD1-N 3.07Å; D1287-K1290 WeakPolarHBondContact OD1-CG 3.36Å; D1287-K1290 PolarHBondContact OD1-N 2.93Å; D1287-K1290 VanDerWaalsContact OD1-N 3.11Å; D1287-K1290 WeakPolarHBondContact OD2-CE 3.35Å; D1287-K1290 WeakPolarHBondContact OD2-CG 3.38Å
1288	L	36.2	Very low	32.9	Very low	121 Å²	121	142.8 Å²	142.8	63%	0.634	75%	0.751	S	S	*	*	S	Bend	cis	-128.6	85.7	9.5	-149.7	-169.8	0	0	0	113.4	K1290	L1288-K1290 HydrophobicContact CD2-CD 4.03Å; L1288-K1290 HydrophobicContact CD2-CG 4.27Å
1289	N	35	Very low	33	Very low	146 Å²	146	142.8 Å²	142.8	78%	0.781	76%	0.757	S	S	*	*	S	Bend	trans	-175.7	67.8	137.5	-96.9	-21.5	0	0	0	112.4	D1287	D1287-N1289 PolarHBondContact OD1-N 2.73Å; D1287-N1289 VanDerWaalsContact OD1-N 3.07Å
1290	K	36.2	Very low	32.9	Very low	137 Å²	137	137.3 Å²	137.3	60%	0.596	75%	0.746	S	S	*	*				41.4	151.9	112	-67.8	-172.7	-177.2	174.6	0	121	D1287 L1288	D1287-K1290 WeakPolarHBondContact OD1-CG 3.36Å; D1287-K1290 PolarHBondContact OD1-N 2.93Å; D1287-K1290 VanDerWaalsContact OD1-N 3.11Å; D1287-K1290 WeakPolarHBondContact OD2-CE 3.35Å; D1287-K1290 WeakPolarHBondContact OD2-CG 3.38Å; L1288-K1290 HydrophobicContact CD2-CD 4.03Å; L1288-K1290 HydrophobicContact CD2-CG 4.27Å
1291	P	34.7	Very low	32.9	Very low	96 Å²	96	140.5 Å²	140.5	62%	0.623	75%	0.75	S	S	*	*			cis	-148.3	173.4	-28.4	40.5	-22.6	0	0	0	116.7
1292	I	34.1	Very low	32.8	Very low	151 Å²	151	135.1 Å²	135.1	77%	0.774	74%	0.735	S	S	*	*			trans	68.1	131	142.2	-80.3	161.7	0	0	0	118.6
1293	N	30.8	Very low	32.8	Very low	120 Å²	120	139.5 Å²	139.5	64%	0.642	74%	0.741	S	S	*	*			cis	-164.2	180	-12.9	-141.2	-23.7	0	0	0	112.9
1294	K	30.9	Very low	32.8	Very low	192 Å²	192	141 Å²	141	84%	0.835	74%	0.739	S	S	*	*			trans	-55	163.7	175.5	-51.3	138.1	-169.1	175.4	0	114
1295	G	30.1	Very low	32.5	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	75%	0.747	S	S	*	*			cis	154.8	158.8	-4	0	0	0	0	0	114.2
1296	R	30.6	Very low	33	Very low	249 Å²	249	139.5 Å²	139.5	94%	0.94	75%	0.754	S	S	*	*			trans	26.3	114.1	167.9	-77.1	-177.7	167.1	178.6	-3.4	120.7
1297	K	31.1	Very low	32.9	Very low	220 Å²	220	138.8 Å²	138.8	96%	0.957	77%	0.77	S	S	*	*				-176.7	174.2	112	-105	177.9	178.8	-179.3	0	112.8
1298	R	33	Very low	32.8	Very low	242 Å²	242	137.2 Å²	137.2	91%	0.913	78%	0.779	S	S	*	*			trans	-92.9	145	179.1	-72.9	176.7	168	172.6	-5.7	112
1299	A	30.8	Very low	32.7	Very low	103 Å²	103	139.6 Å²	139.6	85%	0.851	79%	0.792	S	S	*	*			trans	57.4	144.9	146.2	0	0	0	0	0	119.9
1300	A	28.9	Very low	32.9	Very low	86 Å²	86	141.2 Å²	141.2	71%	0.711	80%	0.795	S	S	*	*			cis	-168.2	178.8	-13.3	0	0	0	0	0	109.4
1301	V	30.3	Very low	32.9	Very low	147 Å²	147	139.9 Å²	139.9	89%	0.891	81%	0.81	S	S	*	*			trans	73.5	138	175.3	-168.6	0	0	0	0	114.2
1302	G	29.2	Very low	32.9	Very low	58 Å²	58	139 Å²	139	60%	0.598	82%	0.818	S	S	*	*			cis	175.8	-172.9	-4.9	0	0	0	0	0	112.5
1303	Q	32.1	Very low	32.8	Very low	173 Å²	173	139.7 Å²	139.7	81%	0.808	82%	0.823	S	S	*	*			trans	68.7	146	179.3	-66.5	163.8	-93	0	0	115.3
1304	E	34.3	Very low	33.1	Very low	163 Å²	163	137.2 Å²	137.2	76%	0.762	82%	0.819	S	S	*	*			cis	-146.9	164.6	3.4	-142.1	144.2	-124.7	0	0	113.2
1305	S	28.6	Very low	33.1	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	82%	0.822	S	S	*	*			trans	-105.9	-177.6	-172.3	-48.7	0	0	0	0	112.8
1306	P	45.6	Very low	33.1	Very low	131 Å²	131	138.6 Å²	138.6	85%	0.851	82%	0.821	S	S	*	*				-157.9	157.7	86.5	39.9	-19.8	0	0	0	119.6
1307	G	32.5	Very low	33.6	Very low	86 Å²	86	132.1 Å²	132.1	89%	0.887	81%	0.811	S	S	*	*			trans	77.6	141.5	154.2	0	0	0	0	0	118.2
1308	G	34.4	Very low	33.6	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	81%	0.805	S	S	*	*			cis	-172.9	179	-5.9	0	0	0	0	0	108.1
1309	L	34.5	Very low	33.6	Very low	171 Å²	171	125.9 Å²	125.9	90%	0.895	80%	0.797	S	S	*	*			cis	-161.8	-179.6	-4	-119.7	170.2	0	0	0	108.7
1310	E	38.3	Very low	33.7	Very low	180 Å²	180	128.2 Å²	128.2	84%	0.841	79%	0.79	S	S	*	*			trans	68.2	118.4	178.4	-49.9	-171.2	162.5	0	0	115.5
1311	A	36.2	Very low	33.8	Very low	110 Å²	110	130.1 Å²	130.1	91%	0.909	79%	0.789	S	S	*	*			cis	85.7	118.6	32.9	0	0	0	0	0	114.3
1312	G	33.7	Very low	34	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	79%	0.791	S	S	*	*			cis	-153.9	-142.5	0.2	0	0	0	0	0	111.6
1313	N	33.8	Very low	34.1	Very low	164 Å²	164	133.3 Å²	133.3	88%	0.877	80%	0.798	S	S	*	*			cis	-163.8	-174.1	-1.3	-155.3	-10.5	0	0	0	112
1314	A	35.4	Very low	34.3	Very low	68 Å²	68	135.4 Å²	135.4	56%	0.562	81%	0.805	S	S	*	*			trans	-40.8	163.6	170.9	0	0	0	0	0	120.2
1315	K	32	Very low	34.1	Very low	205 Å²	205	137.4 Å²	137.4	89%	0.891	81%	0.811	S	S	*	*			cis	-165.2	170.7	-2.9	-110.3	167	-167.4	177.9	0	111.7
1316	A	30.6	Very low	34.3	Very low	90 Å²	90	137.1 Å²	137.1	74%	0.744	82%	0.815	S	S	*	*			trans	-105.1	-164.3	168.9	0	0	0	0	0	110.5
1317	P	41.1	Very low	33.6	Very low	113 Å²	113	135 Å²	135	73%	0.734	81%	0.808	S	S	*	*			cis	-142.5	-167.6	0.3	44.4	-23.4	0	0	0	116.8
1318	K	31.3	Very low	33.7	Very low	191 Å²	191	137.3 Å²	137.3	83%	0.83	81%	0.808	S	S	*	*			trans	6.9	146.8	151.8	-61.5	-178	176.7	-176.9	0	120.1
1319	L	32.4	Very low	33.8	Very low	141 Å²	141	138.7 Å²	138.7	74%	0.738	81%	0.812	S	S	*	*				-175.4	153.4	61.2	-127.7	162.2	0	0	0	113.7
1320	Q	32.5	Very low	33.6	Very low	151 Å²	151	137.3 Å²	137.3	71%	0.706	80%	0.801	S	S	*	*			trans	63.5	136.7	151.4	-97.7	177.7	-58.7	0	0	126.9
1321	D	30.4	Very low	33.1	Very low	127 Å²	127	138.4 Å²	138.4	68%	0.679	80%	0.797	S	S	*	*			trans	47.6	118.4	143.5	-56.3	-20.1	0	0	0	124.6
1322	L	34.8	Very low	32.9	Very low	181 Å²	181	141.9 Å²	141.9	95%	0.948	80%	0.795	S	S	*	*				-168.4	149.7	118.3	-106.1	166	0	0	0	112.1
1323	A	31.6	Very low	32.7	Very low	90 Å²	90	145.1 Å²	145.1	74%	0.744	79%	0.792	S	S	*	*			trans	-106.8	152.1	-173.8	0	0	0	0	0	114.1
1324	K	35.6	Very low	32.7	Very low	217 Å²	217	144.5 Å²	144.5	94%	0.943	79%	0.789	S	S	*	*			trans	-157.8	157.2	159.9	-112.1	160	-172.5	175.4	0	112.6
1325	K	30.2	Very low	32.3	Very low	205 Å²	205	148.3 Å²	148.3	89%	0.891	80%	0.799	S	S	*	*			trans	-103.7	177.8	-175.7	-76.4	-178.5	172.1	-179.7	0	112.1
1326	A	32.7	Very low	32.1	Very low	104 Å²	104	146.5 Å²	146.5	86%	0.86	79%	0.794	S	S	*	*			trans	81.4	143.1	169.1	0	0	0	0	0	115.3
1327	A	32.1	Very low	32.2	Very low	86 Å²	86	157.2 Å²	157.2	71%	0.711	82%	0.815	S	S	*	*			cis	-154.9	161.8	-8.6	0	0	0	0	0	110.2
1328	P	34.5	Very low	31.7	Very low	135 Å²	135	159.4 Å²	159.4	88%	0.877	82%	0.819	S	S	*	*			trans	-76.7	154.5	172.3	33.2	-35.3	0	0	0	112.1
1329	A	35.7	Very low	31.7	Very low	105 Å²	105	157.7 Å²	157.7	87%	0.868	82%	0.818	S	S	*	*			trans	-125.5	143.1	175.2	0	0	0	0	0	111.4
1330	E	30.8	Very low	31.7	Very low	143 Å²	143	158.7 Å²	158.7	67%	0.668	82%	0.823	S	S	*	*			trans	-100.7	152.3	-176.3	-84.2	-161.7	87.3	0	0	113.4
1331	R	28.2	Very low	31.7	Very low	202 Å²	202	159.1 Å²	159.1	76%	0.762	83%	0.83	S	S	*	*			trans	66.2	161.5	159.5	-61.4	155.6	-155.9	-158.5	11.8	113.7
1332	Q	31.1	Very low	31.7	Very low	183 Å²	183	161.1 Å²	161.1	86%	0.855	84%	0.839	S	S	*	*			cis	-126.4	127.8	14.8	-117	160	-41.9	0	0	109.1
1333	I	29.1	Very low	31.5	Very low	147 Å²	147	159.8 Å²	159.8	75%	0.754	83%	0.832	S	S	*	*				4.6	114.5	100.7	-53	176.5	0	0	0	114.7
1334	D	35.3	Very low	31.5	Very low	151 Å²	151	164.8 Å²	164.8	81%	0.807	84%	0.838	S	S	*	*			trans	-135.9	143.8	147.4	-156.4	-10	0	0	0	109.5
1335	L	25.3	Very low	31.2	Very low	147 Å²	147	160.8 Å²	160.8	77%	0.77	83%	0.83	S	S	*	*			trans	-159.9	87	-165	-155.6	179.6	0	0	0	110.4
1336	Q	29.3	Very low	31.3	Very low	168 Å²	168	157.1 Å²	157.1	79%	0.785	83%	0.825	S	S	*	*			trans	-155.6	126	173.7	-121.5	172.2	93.7	0	0	114.6
1337	R	31.4	Very low	31.2	Very low	314 Å²	314	161.9 Å²	161.9	100%	1.185	82%	0.822	S	S	*	*			trans	73.7	0	170	-60.7	-175.7	175.2	-179.2	-0.9	117.9

Retrieved 1,337 of 1,337 residues in 385.8 ms (Link to these results)

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