A0A087X4M8_POEFO Loading...

Striatin interacting protein 1

Plays a role in the regulation of cell morphology and cytoskeletal organization. Required in the cortical actin filament dynamics and cell shape. Part of the striatin-interacting phosphatase and kinase (STRIPAK) complexes. STRIPAK complexes have critical roles in protein (de)phosphorylation and are regulators of multiple signaling pathways including Hippo, MAPK, nuclear receptor and cytoskeleton remodeling. Different types of STRIPAK complexes are involved in a variety of biological processes such as cell growth, differentiation, apoptosis, metabolism and immune regulation.

AlphaFold DB (A0A3B3TP98), UniProt , Accession A0A087X4M8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 816 aa.

						>A0A087X4M8_POEFO|A0A087X4M8
MEVGGNGGGLPVNNKQRAMLPNKGGRGEFPRTPRKDSEGLSESPDLEFEYSDTDKWAAELSELYSYTEGPEFALNRKCFEEEFRAHVSDKKWTDLDAAQHRAHAMRLLDGLEVIGREKRLKVARAILYMAQGAFADCSCEAEVQYWMRYNIFLLLDVGTFSALVELLNMEIDNSAACSSAVRKPAISLADSTDLRVLLNIMYLMVETIQQDDPADKPEWKIMKETFRAELGSPLFNNEPISVMLFGMVTKFCSGHAPHFPMKKVLLLLWKSILFTLGGFEQLQSIKVCKREELGLPPLPEDSIRVIRSMRAASPPASASDLIEQQQKRARREHKALIKQDNLDAFNEKDPYKADDSREDEDDNDDNDNSLEPETFPLERDEVMPPPIPHPPSERVSFPKGLPWAPKVREKDIENFLESSRSKFIGYTLGSDTDTVVGLPRPIHESIKTLKQHKYISVAEVQMAKEEEYQKTPLSVGEEEVEMCATELLYQGILPSLPQYMIALLKILLAAAPTSKAKTDSINILADVLPEEMPTTVLQSMKLGVDVNRHKEIIVKAISAILLLLLKHFKLNHVYQFEYMAQHLVFANCIPLILKFFNQNIMSYITAKNSISVLDFPYCVVHELPELTAESLEAGDNTQFCWRNLFSCINLLRILNKLTKWKHSRTMMLVVFKSAPILKRALKVKQAMMQLYVLKLLKVQTKYLGRQWRKSNMKTMSAIYQKVRHRLNDDWAYGNDLDARPWDFQAEECALRASIERFNSRRYDKSHSNPDFLPVDNCLQSVLGQRVDLPEDFQMNYDLWLEREVFSKPISWEELLQ
					

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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	32.8	Very low	28.1	Very low	224 Å²	224	126.3 Å²	126.3	100%	1.103	85%	0.852	S	S	*	*				0	74.1	0	-59.7	169.8	-173.2	0	0	106.5
2	E	26	Very low	28.1	Very low	178 Å²	178	128 Å²	128	83%	0.832	86%	0.856	S	S	*	*				79.6	137.3	62.1	-66.1	174.9	127.5	0	0	112.5
3	V	28.1	Very low	27.9	Very low	132 Å²	132	129.2 Å²	129.2	80%	0.8	85%	0.849	S	S	*	*			cis	-157.4	148.4	-6.9	119	0	0	0	0	110.1
4	G	27.2	Very low	28	Very low	79 Å²	79	130.9 Å²	130.9	81%	0.814	85%	0.846	S	S	*	*			trans	63.4	160.9	154.2	0	0	0	0	0	118.5
5	G	26.8	Very low	27.9	Very low	80 Å²	80	133.9 Å²	133.9	83%	0.825	84%	0.841	S	S	*	*			cis	149.2	166.7	4.1	0	0	0	0	0	108.4
6	N	27.2	Very low	27.9	Very low	168 Å²	168	138.3 Å²	138.3	90%	0.898	85%	0.848	S	S	*	*			cis	-166.3	142.4	-12.3	175.8	32.7	0	0	0	108.1
7	G	26.9	Very low	27.8	Very low	73 Å²	73	144.8 Å²	144.8	75%	0.753	85%	0.854	S	S	*	*			trans	69.5	162.2	173.2	0	0	0	0	0	116.7
8	G	24.9	Very low	27.6	Very low	88 Å²	88	142.3 Å²	142.3	91%	0.907	85%	0.852	S	S	*	*			cis	128.6	101.6	-6.2	0	0	0	0	0	113.6
9	G	25.8	Very low	27.6	Very low	74 Å²	74	145 Å²	145	76%	0.763	86%	0.857	S	S	*	*			trans	171.7	141.7	175	0	0	0	0	0	113.9
10	L	25.3	Very low	27.6	Very low	177 Å²	177	146.2 Å²	146.2	93%	0.927	86%	0.859	S	S	*	*			trans	-115.6	-151.1	179.5	-65.2	163.4	0	0	0	110.4
11	P	38	Very low	27.5	Very low	116 Å²	116	145.2 Å²	145.2	75%	0.753	86%	0.857	S	S	*	*				-125.4	152.7	-112.6	36.7	-17.9	0	0	0	115.3
12	V	28.7	Very low	27.2	Very low	147 Å²	147	142 Å²	142	89%	0.891	84%	0.844	S	S	*	*			trans	-133.4	127.1	161.7	-175.6	0	0	0	0	109.9
13	N	25.5	Very low	27.5	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	85%	0.847	S	S	*	*			trans	-111.2	127	177.6	179.8	6.1	0	0	0	108.3
14	N	28.6	Very low	27.4	Very low	153 Å²	153	140.8 Å²	140.8	82%	0.818	85%	0.847	S	S	*	*			trans	-142.9	139.9	169.2	-153.7	-4	0	0	0	111.7
15	K	27.1	Very low	27.4	Very low	177 Å²	177	140.5 Å²	140.5	77%	0.77	85%	0.845	S	S	*	*			trans	-101.4	127.9	-171.3	-68.8	171.9	177.6	171.2	0	111
16	Q	27.8	Very low	27.5	Very low	204 Å²	204	148.4 Å²	148.4	95%	0.953	85%	0.85	S	S	*	*			trans	-151.6	153.8	142.3	-111.3	166	20.8	0	0	110.3
17	R	25.6	Very low	27.5	Very low	249 Å²	249	143.4 Å²	143.4	94%	0.94	84%	0.837	S	S	*	*			trans	-142.1	108.4	-157.2	-178.6	-170.7	-172.6	-164.6	4.2	111
18	A	25.3	Very low	27.5	Very low	99 Å²	99	149.1 Å²	149.1	82%	0.818	84%	0.844	S	S	*	*			trans	-145	94.7	176.1	0	0	0	0	0	112.5
19	M	26.2	Very low	27.6	Very low	194 Å²	194	154 Å²	154	96%	0.956	84%	0.841	S	S	*	*			trans	50.6	152.7	160.6	-64.7	-164.9	170.8	0	0	121.9
20	L	27.2	Very low	27.8	Very low	169 Å²	169	156.2 Å²	156.2	89%	0.885	84%	0.842	S	S	*	*			trans	-116	148.7	-170.1	-65.5	133.6	0	0	0	111.6
21	P	26.7	Very low	27.8	Very low	126 Å²	126	159.2 Å²	159.2	82%	0.818	84%	0.841	S	S	*	*			trans	-86.7	150.2	147.5	34.4	-29.9	0	0	0	111.1
22	N	26.7	Very low	27.2	Very low	155 Å²	155	159.6 Å²	159.6	83%	0.829	84%	0.842	S	S	*	*			trans	-86.9	134.6	-168.8	-168.3	0.6	0	0	0	113.3
23	K	30.9	Very low	27.2	Very low	206 Å²	206	158.1 Å²	158.1	90%	0.896	84%	0.835	S	S	*	*			trans	-139.6	103.1	166.7	-88.6	-170.2	174.2	-179.1	0	110.8	G25	K23-G25 PolarHBondContact O-N 3.15Å
24	G	27.3	Very low	27.3	Very low	79 Å²	79	162.2 Å²	162.2	81%	0.814	84%	0.84	S	S	*	*			trans	-77.6	84.4	178.7	0	0	0	0	0	113.6
25	G	27.1	Very low	27.2	Very low	74 Å²	74	163 Å²	163	76%	0.763	84%	0.836	S	S	*	*			trans	-79	119.3	163.8	0	0	0	0	0	110.8	K23 G27	K23-G25 PolarHBondContact O-N 3.15Å; G25-G27 PolarHBondContact O-N 3.47Å; G25-G27 VanDerWaalsContact O-N 3.15Å
26	R	28	Very low	27.3	Very low	246 Å²	246	161 Å²	161	93%	0.928	83%	0.834	S	S	*	*			trans	-75.2	99.7	172.2	-76.8	-176.5	173.9	176.1	-1.6	109.7
27	G	27.5	Very low	27.5	Very low	62 Å²	62	157.3 Å²	157.3	64%	0.639	83%	0.83	S	S	*	*			trans	-64.1	133.4	168.7	0	0	0	0	0	111.2	G25 F29	G25-G27 PolarHBondContact O-N 3.47Å; G25-G27 VanDerWaalsContact O-N 3.15Å; G27-F29 PolarHBondContact O-N 3.25Å
28	E	27.7	Very low	27.7	Very low	193 Å²	193	152.7 Å²	152.7	90%	0.902	82%	0.819	S	S	*	*			trans	-75	112.4	173.2	-65	-168.2	119.5	0	0	109.8	P30	E28-P30 WeakPolarHBondContact O-CD 3.35Å
29	F	27.1	Very low	27.9	Very low	190 Å²	190	150.6 Å²	150.6	83%	0.833	81%	0.808	S	S	*	*			trans	-66.8	123.4	167.7	-75	-94.4	0	0	0	109	G27 R31	G27-F29 PolarHBondContact O-N 3.25Å; F29-R31 PolarHBondContact O-N 3.35Å
30	P	28.8	Very low	28.2	Very low	122 Å²	122	149.5 Å²	149.5	79%	0.792	81%	0.805	S	S	*	*			trans	-65.7	100.4	170.9	27.5	-32.8	0	0	0	108.2	E28 T32	E28-P30 WeakPolarHBondContact O-CD 3.35Å; P30-T32 PolarHBondContact O-N 3.49Å; P30-T32 VanDerWaalsContact O-N 3.17Å
31	R	27	Very low	28.7	Very low	239 Å²	239	143.9 Å²	143.9	90%	0.902	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-61.2	120.8	177.4	-80.2	-179.5	167.8	153	-2.6	108.9	F29	F29-R31 PolarHBondContact O-N 3.35Å
32	T	25.4	Very low	29.5	Very low	124 Å²	124	147.2 Å²	147.2	76%	0.761	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-51.3	138.4	167.8	39.5	0	0	0	0	109.6	P30 R34	P30-T32 PolarHBondContact O-N 3.49Å; P30-T32 VanDerWaalsContact O-N 3.17Å; T32-R34 PolarHBondContact O-N 2.95Å
33	P	28.2	Very low	30.7	Very low	117 Å²	117	141.6 Å²	141.6	76%	0.76	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-58.7	135.7	172	26.4	-33.3	0	0	0	108	K35	P33-K35 PolarHBondContact O-N 2.79Å
34	R	26	Very low	32.3	Very low	228 Å²	228	135.4 Å²	135.4	86%	0.86	74%	0.738	S	S	*	*			trans	-59.2	115.2	172.6	-81.2	-178.4	171	165.2	-3.9	107.7	T32 D36	T32-R34 PolarHBondContact O-N 2.95Å; R34-D36 PolarHBondContact O-N 2.95Å
35	K	27.8	Very low	34.4	Very low	170 Å²	170	136 Å²	136	74%	0.739	72%	0.723	S	S	*	*			trans	-72.5	81	170.4	-158	173.5	-173.7	-179.1	0	107.4	P33 S37 E38	P33-K35 PolarHBondContact O-N 2.79Å; K35-S37 PolarHBondContact O-N 3.27Å; K35-E38 WeakPolarHBondContact CE-OE2 3.46Å; K35-E38 IonicContact NZ-OE2 3.49Å
36	D	28.9	Very low	36.9	Very low	136 Å²	136	133.6 Å²	133.6	73%	0.727	69%	0.692	S	S	*	*			trans	-49	132.3	168	-81.5	-27.2	0	0	0	107.6	R34 E38	R34-D36 PolarHBondContact O-N 2.95Å; D36-E38 PolarHBondContact O-N 3.32Å
37	S	31.1	Very low	39.2	Very low	125 Å²	125	130.6 Å²	130.6	87%	0.874	69%	0.689	S	S	*	*			trans	-64	103.7	-162.1	-52.7	0	0	0	0	112.4	K35 G39	K35-S37 PolarHBondContact O-N 3.27Å; S37-G39 PolarHBondContact O-N 3.26Å
38	E	31.6	Very low	41.9	Very low	152 Å²	152	128.5 Å²	128.5	71%	0.71	66%	0.662	S	S	*	*			trans	-66.4	68	167.3	-65.6	175.7	133.2	0	0	110	K35 D36 L40	K35-E38 WeakPolarHBondContact CE-OE2 3.46Å; K35-E38 IonicContact NZ-OE2 3.49Å; D36-E38 PolarHBondContact O-N 3.32Å; E38-L40 PolarHBondContact O-N 2.64Å
39	G	29.6	Very low	44.6	Very low	56 Å²	56	125 Å²	125	58%	0.577	65%	0.646	S	S	*	*			trans	-63.7	128.8	161.6	0	0	0	0	0	108.5	S37 S41	S37-G39 PolarHBondContact O-N 3.26Å; G39-S41 PolarHBondContact O-N 3.04Å; G39-S41 VanDerWaalsContact O-N 3.16Å
40	L	32	Very low	47.5	Very low	171 Å²	171	116.8 Å²	116.8	90%	0.895	61%	0.609	S	S	*	*			trans	-37.4	118.1	-179.1	-93	61.4	0	0	0	111.6	E38	E38-L40 PolarHBondContact O-N 2.64Å
41	S	36.7	Very low	50.5	Low	50 Å²	50	112.8 Å²	112.8	35%	0.35	58%	0.584	S	S	.	*			trans	-150.2	78.7	-177.1	-174	0	0	0	0	108.3	G39 S43 K684	G39-S41 PolarHBondContact O-N 3.04Å; G39-S41 VanDerWaalsContact O-N 3.16Å; S41-S43 PolarHBondContact O-N 2.92Å; S41-K684 PolarHBondContact O-NZ 2.82Å; S41-K684 PolarHBondContact OG-NZ 3.01Å
42	E	43.3	Very low	53.5	Low	196 Å²	196	102.9 Å²	102.9	92%	0.916	55%	0.549	S	S	*	.			trans	-60.1	9.5	-162	-58.3	164.7	121	0	0	117
43	S	53.7	Low	56.6	Low	38 Å²	38	98.1 Å²	98.1	27%	0.266	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-98.3	130.1	174	28.5	0	0	0	0	110.2	S41 K684	S41-S43 PolarHBondContact O-N 2.92Å; S43-K684 WeakPolarHBondContact O-CD 3.45Å; S43-K684 WeakPolarHBondContact O-CE 3.49Å; S43-K684 PolarHBondContact O-NZ 3.09Å; S43-K684 VanDerWaalsContact OG-CE 3.29Å; S43-K684 WeakPolarHBondContact OG-CE 3.37Å
44	P	64.3	Low	59.6	Low	75 Å²	75	94 Å²	94	49%	0.487	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-66.1	164.8	163.6	29.3	-33.8	0	0	0	111.1
45	D	71.6	Confident	62.7	Low	92 Å²	92	91.1 Å²	91.1	49%	0.492	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-68.8	136.2	163.4	-83.8	1.5	0	0	0	108.5	K684	D45-K684 WeakPolarHBondContact OD1-CD 3.39Å
46	L	78.3	Confident	65.7	Low	24 Å²	24	84.8 Å²	84.8	13%	0.126	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-85.7	116.5	-175.3	-58.1	-179.1	0	0	0	111.1	F48 I604 Q638 F639 L644 V683 K684	L46-F48 VanDerWaalsContact C-N 3.28Å; L46-F48 PolarHBondContact O-N 3.32Å; L46-I604 HydrophobicContact CD1-CD1 3.72Å; L46-Q638 HydrophobicContact CD2-CB 4.44Å; L46-F639 HydrophobicContact CB-CD1 4.21Å; L46-F639 HydrophobicContact CB-CE1 4.42Å; L46-F639 HydrophobicContact CD2-CD1 4.23Å; L46-L644 HydrophobicContact CD1-CD2 4.23Å; L46-V683 HydrophobicContact CD1-CG1 3.91Å; L46-K684 PolarHBondContact N-O 3.43Å
47	E	77.3	Confident	68.7	Low	183 Å²	183	79.9 Å²	79.9	86%	0.855	44%	0.435	S	S	*	.			trans	-75.2	78.5	174.6	-170.3	163.4	-147.5	0	0	110.8	F639	E47-F639 WeakPolarHBondContact O-CE1 3.28Å; E47-F639 WeakPolarHBondContact O-CZ 3.38Å
48	F	83.6	Confident	71.6	Confident	17 Å²	17	75.3 Å²	75.3	8%	0.075	41%	0.405	C	S	.	.			trans	-121.2	111.9	179.6	171.3	-93.6	0	0	0	110.4	L46 Y50 F639 W641 L644 F645 I648 Q685	L46-F48 VanDerWaalsContact C-N 3.28Å; L46-F48 PolarHBondContact O-N 3.32Å; F48-Y50 AromaticContact CE1-CD2 3.91Å; F48-Y50 HydrophobicContact CE1-CD2 3.91Å; F48-Y50 HydrophobicContact CE1-CG 4.35Å; F48-Y50 HydrophobicContact CZ-CD2 4.17Å; F48-F639 HydrophobicContact CB-CE1 4.17Å; F48-F639 HydrophobicContact CB-CE2 4.17Å; F48-F639 HydrophobicContact CB-CZ 3.78Å; F48-F639 HydrophobicContact CD2-CD2 4.23Å; F48-F639 AromaticContact CD2-CE2 3.59Å; F48-F639 HydrophobicContact CD2-CE2 3.59Å; F48-F639 HydrophobicContact CD2-CZ 4.04Å; F48-F639 HydrophobicContact CG-CE2 4.35Å; F48-F639 HydrophobicContact CG-CZ 4.42Å; F48-W641 AromaticContact CD2-CD1 3.8Å; F48-W641 HydrophobicContact CD2-CG 4.42Å; F48-W641 AromaticContact CE2-CD1 3.4Å; F48-W641 HydrophobicContact CE2-CD2 4.1Å; F48-W641 AromaticContact CE2-CE2 3.92Å; F48-W641 AromaticContact CE2-CG 3.77Å; F48-W641 HydrophobicContact CE2-CG 3.77Å; F48-W641 AromaticContact CE2-NE1 3.45Å; F48-L644 HydrophobicContact CB-CD2 3.67Å; F48-L644 HydrophobicContact CD1-CD2 3.99Å; F48-L644 HydrophobicContact CD1-CG 4.04Å; F48-L644 HydrophobicContact CD2-CB 4.33Å; F48-L644 HydrophobicContact CD2-CD2 3.62Å; F48-L644 HydrophobicContact CD2-CG 3.97Å; F48-L644 HydrophobicContact CE1-CG 4.15Å; F48-L644 HydrophobicContact CE2-CB 4.13Å; F48-L644 HydrophobicContact CE2-CD2 4.21Å; F48-L644 HydrophobicContact CE2-CG 4.06Å; F48-L644 HydrophobicContact CG-CD2 3.48Å; F48-L644 VanDerWaalsContact CG-CD2 3.48Å; F48-L644 HydrophobicContact CG-CG 3.96Å; F48-L644 HydrophobicContact CZ-CB 4.44Å; F48-L644 HydrophobicContact CZ-CG 4.16Å; F48-F645 HydrophobicContact CZ-CB 4.14Å; F48-I648 HydrophobicContact CD1-CD1 4.03Å; F48-I648 HydrophobicContact CE1-CD1 3.42Å; F48-I648 VanDerWaalsContact CE1-CD1 3.42Å; F48-I648 HydrophobicContact CZ-CD1 4.22Å; F48-Q685 HydrophobicContact CB-CG 4.15Å; F48-Q685 HydrophobicContact CD1-CG 4.09Å; F48-Q685 PolarHBondContact O-NE2 3.46Å
49	E	83.6	Confident	74.5	Confident	120 Å²	120	68.1 Å²	68.1	56%	0.561	37%	0.371	S	S	*	.			trans	-78.3	136.8	162.6	178.8	150.1	-145	0	0	110.5	R307	E49-R307 IonicContact OE1-CZ 3.21Å; E49-R307 IonicContact OE1-NE 2.72Å; E49-R307 PolarHBondContact OE1-NE 3.14Å; E49-R307 IonicContact OE1-NH2 2.76Å; E49-R307 PolarHBondContact OE1-NH2 3.13Å
50	Y	89.1	Confident	77.6	Confident	18 Å²	18	65.4 Å²	65.4	7%	0.071	34%	0.344	C	S	.	.			trans	-101.9	111.1	174.2	-177.9	-84.5	0	0	0	109.7	F48 F279 F645 I648 N649 R652 M687	F48-Y50 AromaticContact CE1-CD2 3.91Å; F48-Y50 HydrophobicContact CE1-CD2 3.91Å; F48-Y50 HydrophobicContact CE1-CG 4.35Å; F48-Y50 HydrophobicContact CZ-CD2 4.17Å; Y50-F279 AromaticContact CE1-CD2 3.81Å; Y50-F279 HydrophobicContact CE1-CD2 3.81Å; Y50-F279 AromaticContact CE1-CE2 3.59Å; Y50-F279 HydrophobicContact CE1-CE2 3.59Å; Y50-F279 AromaticContact CZ-CE2 3.84Å; Y50-F279 VanDerWaalsContact OH-CE2 3.22Å; Y50-F279 WeakPolarHBondContact OH-CE2 3.45Å; Y50-F645 AromaticContact CD2-CD2 3.94Å; Y50-F645 HydrophobicContact CD2-CD2 3.94Å; Y50-F645 AromaticContact CE2-CD2 3.42Å; Y50-F645 HydrophobicContact CE2-CD2 3.42Å; Y50-F645 VanDerWaalsContact CE2-CD2 3.42Å; Y50-F645 AromaticContact CE2-CE2 3.75Å; Y50-F645 HydrophobicContact CE2-CE2 3.75Å; Y50-F645 HydrophobicContact CE2-CG 4.4Å; Y50-F645 AromaticContact CZ-CE2 3.86Å; Y50-I648 HydrophobicContact CD2-CB 4.25Å; Y50-I648 HydrophobicContact CD2-CD1 4.1Å; Y50-I648 HydrophobicContact CD2-CG2 3.68Å; Y50-I648 HydrophobicContact CE2-CB 4.08Å; Y50-I648 HydrophobicContact CE2-CG2 3.46Å; Y50-I648 VanDerWaalsContact CE2-CG2 3.46Å; Y50-N649 WeakPolarHBondContact CE2-OD1 3.36Å; Y50-N649 PolarHBondContact OH-OD1 2.97Å; Y50-R652 PolarHBondContact OH-NH1 2.85Å; Y50-M687 HydrophobicContact CD1-CE 3.82Å; Y50-M687 HydrophobicContact CD1-SD 3.87Å; Y50-M687 HydrophobicContact CD2-SD 4.15Å; Y50-M687 HydrophobicContact CE1-SD 4.37Å; Y50-M687 HydrophobicContact CG-CE 3.82Å; Y50-M687 HydrophobicContact CG-SD 3.76Å
51	S	90.9	Very high	80.6	Confident	38 Å²	38	57.4 Å²	57.4	27%	0.266	30%	0.302	S	S	.	.			trans	-115.9	175.9	177.5	42.7	0	0	0	0	111	T53 F645	S51-T53 VanDerWaalsContact CB-O 3.28Å; S51-T53 WeakPolarHBondContact CB-O 3.41Å; S51-T53 PolarHBondContact OG-O 2.98Å; S51-F645 WeakPolarHBondContact O-CE2 3.42Å
52	D	91.4	Very high	83.3	Confident	31 Å²	31	55 Å²	55	17%	0.166	29%	0.285	C	S	.	.	S	Bend	trans	-80.1	-21.1	171.9	-77.8	-82.6	0	0	0	113	W269 L273 F279	D52-W269 VanDerWaalsContact O-CZ2 3.27Å; D52-W269 WeakPolarHBondContact O-CZ2 3.33Å; D52-L273 HydrophobicContact CB-CD1 3.98Å; D52-L273 HydrophobicContact CB-CD2 4.26Å; D52-F279 WeakPolarHBondContact OD1-CD1 3.41Å; D52-F279 WeakPolarHBondContact OD1-CD2 3.34Å; D52-F279 WeakPolarHBondContact OD1-CE2 3.45Å; D52-F279 WeakPolarHBondContact OD1-CG 3.46Å; D52-F279 WeakPolarHBondContact OD1-CZ 3.33Å; D52-F279 PolarHBondContact OD1-N 2.89Å; D52-F279 WeakPolarHBondContact OD2-CB 3.37Å; D52-F279 WeakPolarHBondContact OD2-CD2 3.24Å; D52-F279 WeakPolarHBondContact OD2-CG 3.39Å; D52-F279 PolarHBondContact OD2-N 3.4Å
53	T	90.5	Very high	85.8	Confident	24 Å²	24	45.7 Å²	45.7	15%	0.147	24%	0.242	C	C	.	.	S	Bend	trans	-138	157.3	172.1	62.6	0	0	0	0	110.5	S51 L273	S51-T53 VanDerWaalsContact CB-O 3.28Å; S51-T53 WeakPolarHBondContact CB-O 3.41Å; S51-T53 PolarHBondContact OG-O 2.98Å; T53-L273 HydrophobicContact CG2-CD2 3.74Å
54	D	90.8	Very high	87.8	Confident	31 Å²	31	44.5 Å²	44.5	17%	0.166	23%	0.231	C	C	.	.			trans	-76.4	-171.5	164.5	-152.8	-23.7	0	0	0	110.3	A58 E59 W641	D54-A58 HydrophobicContact CB-CB 4.23Å; D54-E59 HydrophobicContact CB-CG 4.15Å; D54-E59 VanDerWaalsContact CB-OE1 3.24Å; D54-E59 WeakPolarHBondContact CB-OE1 3.48Å; D54-E59 PolarHBondContact N-OE1 3.11Å; D54-W641 HydrophobicContact CB-CD2 4Å; D54-W641 HydrophobicContact CB-CE3 3.94Å; D54-W641 HydrophobicContact CB-CH2 4.17Å; D54-W641 HydrophobicContact CB-CZ2 4.2Å; D54-W641 HydrophobicContact CB-CZ3 4.05Å; D54-W641 WeakPolarHBondContact OD2-CB 3.34Å; D54-W641 VanDerWaalsContact OD2-CD2 3.23Å
55	K	90.6	Very high	89.3	Confident	166 Å²	166	41 Å²	41	72%	0.722	21%	0.209	S	C	*	.			trans	-65	149.2	175.3	-60	178	-176.1	178.1	0	111.8	A57 A58 E59	K55-A57 PolarHBondContact O-N 3.02Å; K55-A58 WeakPolarHBondContact O-CA 3.49Å; K55-A58 WeakPolarHBondContact O-CB 3.3Å; K55-A58 PolarHBondContact O-N 2.82Å; K55-E59 PolarHBondContact O-N 2.89Å
56	W	91.5	Very high	90.3	Very high	37 Å²	37	37.1 Å²	37.1	14%	0.14	19%	0.188	C	C	.	.	H	α-helix	trans	-42.9	-57.7	179.2	175.6	77.5	0	0	0	114.1	A58 E59 L60 Q144 M147 P616	W56-A58 VanDerWaalsContact C-N 3.28Å; W56-A58 PolarHBondContact O-N 3.17Å; W56-E59 PolarHBondContact O-N 3.39Å; W56-L60 HydrophobicContact CD2-CD1 4.04Å; W56-L60 HydrophobicContact CH2-CD1 4.07Å; W56-L60 HydrophobicContact CZ2-CD1 3.35Å; W56-L60 WeakPolarHBondContact O-CG 3.37Å; W56-L60 PolarHBondContact O-N 3.12Å; W56-Q144 HydrophobicContact CD2-CG 4.01Å; W56-Q144 HydrophobicContact CE3-CB 4.44Å; W56-Q144 HydrophobicContact CE3-CG 4.32Å; W56-Q144 HydrophobicContact CH2-CB 3.51Å; W56-Q144 HydrophobicContact CH2-CG 4.04Å; W56-Q144 HydrophobicContact CZ2-CB 3.57Å; W56-Q144 HydrophobicContact CZ2-CG 3.68Å; W56-Q144 HydrophobicContact CZ3-CB 3.96Å; W56-Q144 HydrophobicContact CZ3-CG 4.33Å; W56-M147 HydrophobicContact CZ2-CE 4.31Å; W56-M147 HydrophobicContact CZ2-SD 3.88Å; W56-P616 HydrophobicContact CH2-CG 3.8Å; W56-P616 HydrophobicContact CZ3-CG 3.77Å
57	A	91.7	Very high	90.9	Very high	34 Å²	34	37.7 Å²	37.7	28%	0.281	19%	0.192	S	C	.	.	H	α-helix	trans	-61	-32.1	-180	0	0	0	0	0	113.6	K55 S61	K55-A57 PolarHBondContact O-N 3.02Å; A57-S61 WeakPolarHBondContact O-CB 3.41Å; A57-S61 PolarHBondContact O-N 3.26Å
58	A	91.8	Very high	91.7	Very high	29 Å²	29	29.1 Å²	29.1	24%	0.24	15%	0.152	C	C	.	.	H	α-helix	trans	-73	-42.3	175.8	0	0	0	0	0	111.9	D54 K55 W56 L60 S61 E62	D54-A58 HydrophobicContact CB-CB 4.23Å; K55-A58 WeakPolarHBondContact O-CA 3.49Å; K55-A58 WeakPolarHBondContact O-CB 3.3Å; K55-A58 PolarHBondContact O-N 2.82Å; W56-A58 VanDerWaalsContact C-N 3.28Å; W56-A58 PolarHBondContact O-N 3.17Å; A58-L60 VanDerWaalsContact C-N 3.29Å; A58-L60 PolarHBondContact O-N 3.26Å; A58-S61 WeakPolarHBondContact O-CB 3.43Å; A58-S61 PolarHBondContact O-N 2.86Å; A58-E62 WeakPolarHBondContact O-CG 3.47Å; A58-E62 PolarHBondContact O-N 3.44Å
59	E	93.4	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68	-26.8	176.8	-66.6	-66.8	154.1	0	0	113	D54 K55 W56 Y202 K270 K555	D54-E59 HydrophobicContact CB-CG 4.15Å; D54-E59 VanDerWaalsContact CB-OE1 3.24Å; D54-E59 WeakPolarHBondContact CB-OE1 3.48Å; D54-E59 PolarHBondContact N-OE1 3.11Å; K55-E59 PolarHBondContact O-N 2.89Å; W56-E59 PolarHBondContact O-N 3.39Å; E59-Y202 PolarHBondContact O-OH 2.92Å; E59-K270 WeakPolarHBondContact OE2-CE 3.06Å; E59-K270 IonicContact OE2-NZ 3.41Å; E59-K270 PolarHBondContact OE2-NZ 2.66Å; E59-K555 WeakPolarHBondContact OE1-CE 3.34Å; E59-K555 IonicContact OE1-NZ 3.72Å; E59-K555 PolarHBondContact OE1-NZ 3.3Å; E59-K555 IonicContact OE2-NZ 3.43Å
60	L	94.1	Very high	92.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-80.9	-41.7	170.5	-66.4	-168.4	0	0	0	113	W56 A58 E62 L63 M147 L203 F615	W56-L60 HydrophobicContact CD2-CD1 4.04Å; W56-L60 HydrophobicContact CH2-CD1 4.07Å; W56-L60 HydrophobicContact CZ2-CD1 3.35Å; W56-L60 WeakPolarHBondContact O-CG 3.37Å; W56-L60 PolarHBondContact O-N 3.12Å; A58-L60 VanDerWaalsContact C-N 3.29Å; A58-L60 PolarHBondContact O-N 3.26Å; L60-E62 VanDerWaalsContact C-N 3.28Å; L60-E62 PolarHBondContact O-N 2.89Å; L60-L63 WeakPolarHBondContact O-CB 3.36Å; L60-L63 PolarHBondContact O-N 2.89Å; L60-M147 HydrophobicContact CD1-CE 3.78Å; L60-M147 HydrophobicContact CD1-SD 3.68Å; L60-M147 HydrophobicContact CD2-SD 4.46Å; L60-L203 HydrophobicContact CD2-CD2 3.6Å; L60-F615 HydrophobicContact CB-CD1 4.19Å; L60-F615 HydrophobicContact CD1-CD1 4.46Å; L60-F615 HydrophobicContact CD1-CE1 4.18Å
61	S	93.9	Very high	92.8	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-50.6	-49.2	172.6	161.6	0	0	0	0	111	A57 A58 L63 Y64 R548 D614 F615	A57-S61 WeakPolarHBondContact O-CB 3.41Å; A57-S61 PolarHBondContact O-N 3.26Å; A58-S61 WeakPolarHBondContact O-CB 3.43Å; A58-S61 PolarHBondContact O-N 2.86Å; S61-L63 VanDerWaalsContact C-N 3.26Å; S61-L63 PolarHBondContact O-N 3.19Å; S61-Y64 PolarHBondContact O-N 3.28Å; S61-Y64 VanDerWaalsContact O-N 3.17Å; S61-Y64 VanDerWaalsContact O-O 3.08Å; S61-R548 PolarHBondContact O-NH2 3.49Å; S61-R548 PolarHBondContact OG-NH2 3.1Å; S61-D614 WeakPolarHBondContact CB-OD2 3.43Å; S61-D614 PolarHBondContact OG-OD1 3.43Å; S61-D614 PolarHBondContact OG-OD2 2.85Å; S61-F615 PolarHBondContact N-O 2.88Å
62	E	94.7	Very high	93	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.4	-175.8	-73	-178.6	-162.3	0	0	114.4	A58 L60 Y64 K262 I552 K555 R642	A58-E62 WeakPolarHBondContact O-CG 3.47Å; A58-E62 PolarHBondContact O-N 3.44Å; L60-E62 VanDerWaalsContact C-N 3.28Å; L60-E62 PolarHBondContact O-N 2.89Å; E62-Y64 VanDerWaalsContact C-N 3.29Å; E62-Y64 PolarHBondContact O-N 2.83Å; E62-K262 WeakPolarHBondContact O-CD 3.43Å; E62-K262 WeakPolarHBondContact O-CE 3.41Å; E62-K262 PolarHBondContact O-NZ 3.46Å; E62-I552 HydrophobicContact CB-CD1 3.79Å; E62-I552 HydrophobicContact CB-CG1 4.01Å; E62-I552 HydrophobicContact CB-CG2 4.19Å; E62-I552 HydrophobicContact CG-CD1 3.78Å; E62-I552 HydrophobicContact CG-CG1 3.73Å; E62-K555 IonicContact OE1-NZ 2.67Å; E62-K555 PolarHBondContact OE1-NZ 3.02Å; E62-K555 VanDerWaalsContact OE2-CD 3.3Å; E62-K555 WeakPolarHBondContact OE2-CD 3.35Å; E62-K555 WeakPolarHBondContact OE2-CE 3.14Å; E62-K555 IonicContact OE2-NZ 2.61Å; E62-K555 PolarHBondContact OE2-NZ 3.28Å; E62-R642 WeakPolarHBondContact OE1-CD 3.3Å; E62-R642 WeakPolarHBondContact OE1-CG 3.3Å; E62-R642 IonicContact OE1-NH1 2.63Å
63	L	96	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-43.2	175.6	-178.1	64.9	0	0	0	111.5	L60 S61 N199 Y202 L203 K262 K263 L266	L60-L63 WeakPolarHBondContact O-CB 3.36Å; L60-L63 PolarHBondContact O-N 2.89Å; S61-L63 VanDerWaalsContact C-N 3.26Å; S61-L63 PolarHBondContact O-N 3.19Å; L63-N199 WeakPolarHBondContact CD1-OD1 3.12Å; L63-N199 HydrophobicContact CD2-CB 4.2Å; L63-N199 WeakPolarHBondContact CG-OD1 3.5Å; L63-Y202 HydrophobicContact CB-CD1 4.26Å; L63-Y202 HydrophobicContact CB-CE1 4.12Å; L63-Y202 HydrophobicContact CD1-CD1 3.73Å; L63-Y202 HydrophobicContact CD1-CD2 4.37Å; L63-Y202 HydrophobicContact CD1-CE1 4.27Å; L63-Y202 HydrophobicContact CD1-CG 3.75Å; L63-Y202 HydrophobicContact CD2-CD1 3.71Å; L63-Y202 HydrophobicContact CD2-CE1 4.33Å; L63-Y202 HydrophobicContact CD2-CG 4.4Å; L63-Y202 HydrophobicContact CG-CD1 4.11Å; L63-Y202 HydrophobicContact CG-CE1 4.48Å; L63-L203 HydrophobicContact CD2-CD2 4.33Å; L63-L203 HydrophobicContact CD2-CG 4.17Å; L63-K262 WeakPolarHBondContact O-CE 3.44Å; L63-K262 PolarHBondContact O-NZ 3.03Å; L63-K263 HydrophobicContact CD1-CG 4.26Å; L63-L266 HydrophobicContact CD1-CD1 4.49Å
64	Y	95.9	Very high	93.5	Very high	12 Å²	12	32.5 Å²	32.5	5%	0.047	19%	0.192	C	C	.	.	S	Bend	trans	-93.1	146.6	-176.4	-57.8	-70.9	0	0	0	112.1	S61 E62 E68 F72 Q131 K262 R548 F615	S61-Y64 PolarHBondContact O-N 3.28Å; S61-Y64 VanDerWaalsContact O-N 3.17Å; S61-Y64 VanDerWaalsContact O-O 3.08Å; E62-Y64 VanDerWaalsContact C-N 3.29Å; E62-Y64 PolarHBondContact O-N 2.83Å; Y64-E68 WeakPolarHBondContact CA-OE2 3.44Å; Y64-F72 HydrophobicContact CD1-CE1 4.12Å; Y64-F72 AromaticContact CD1-CZ 3.97Å; Y64-F72 HydrophobicContact CD1-CZ 3.97Å; Y64-F72 HydrophobicContact CD2-CE1 4.15Å; Y64-F72 AromaticContact CD2-CZ 3.87Å; Y64-F72 HydrophobicContact CD2-CZ 3.87Å; Y64-F72 HydrophobicContact CE1-CE1 4.03Å; Y64-F72 HydrophobicContact CE1-CZ 4.35Å; Y64-F72 HydrophobicContact CE2-CE1 4.03Å; Y64-F72 HydrophobicContact CE2-CZ 4.23Å; Y64-F72 HydrophobicContact CG-CE1 4.19Å; Y64-F72 AromaticContact CG-CZ 3.73Å; Y64-F72 HydrophobicContact CG-CZ 3.73Å; Y64-F72 AromaticContact CZ-CE1 3.99Å; Y64-Q131 VanDerWaalsContact CZ-NE2 3.35Å; Y64-Q131 PolarHBondContact OH-NE2 3.43Å; Y64-K262 PolarHBondContact O-NZ 3.23Å; Y64-R548 PolarHBondContact O-NH1 3.04Å; Y64-F615 HydrophobicContact CD2-CB 3.91Å; Y64-F615 HydrophobicContact CD2-CD1 4.19Å; Y64-F615 HydrophobicContact CD2-CG 4.04Å; Y64-F615 HydrophobicContact CE2-CB 4.38Å; Y64-F615 AromaticContact CE2-CD1 3.85Å; Y64-F615 HydrophobicContact CE2-CD1 3.85Å; Y64-F615 HydrophobicContact CE2-CE1 4.28Å; Y64-F615 AromaticContact CE2-CG 4Å; Y64-F615 HydrophobicContact CE2-CG 4Å
65	S	93.9	Very high	93.8	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.021	19%	0.185	C	C	.	.			trans	-104.1	150.1	166.9	-93.4	0	0	0	0	109.7	T67 E68 K262 D545	S65-T67 PolarHBondContact O-N 3.11Å; S65-E68 PolarHBondContact N-OE2 2.62Å; S65-E68 WeakPolarHBondContact O-CB 3.42Å; S65-E68 PolarHBondContact O-N 2.69Å; S65-K262 PolarHBondContact OG-NZ 3.33Å; S65-D545 WeakPolarHBondContact CA-OD2 3.22Å; S65-D545 WeakPolarHBondContact CB-OD2 3.5Å; S65-D545 PolarHBondContact OG-OD1 3.4Å; S65-D545 PolarHBondContact OG-OD2 2.91Å
66	Y	93	Very high	94.1	Very high	10 Å²	10	28.1 Å²	28.1	4%	0.039	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-5.6	-170.8	-55.9	-47.3	0	0	0	113.9	K541 D545 R548 S609 I610 L613 D614	Y66-K541 VanDerWaalsContact CB-CE 3.41Å; Y66-K541 VanDerWaalsContact O-CE 3.27Å; Y66-K541 WeakPolarHBondContact O-CE 3.46Å; Y66-K541 PolarHBondContact O-NZ 3.3Å; Y66-D545 HydrophobicContact CD2-CB 3.8Å; Y66-D545 PolarHBondContact N-OD2 3.16Å; Y66-R548 WeakPolarHBondContact OH-CD 3.5Å; Y66-R548 PolarHBondContact OH-NE 3.16Å; Y66-R548 VanDerWaalsContact OH-NE 3.1Å; Y66-S609 WeakPolarHBondContact OH-CA 3.46Å; Y66-I610 HydrophobicContact CD2-CD1 3.88Å; Y66-I610 HydrophobicContact CE2-CB 4.1Å; Y66-I610 HydrophobicContact CE2-CD1 3.83Å; Y66-I610 HydrophobicContact CE2-CG1 3.98Å; Y66-I610 PolarHBondContact OH-N 3.08Å; Y66-L613 HydrophobicContact CD1-CB 3.63Å; Y66-L613 HydrophobicContact CD1-CD1 4.44Å; Y66-L613 HydrophobicContact CE1-CB 3.75Å; Y66-L613 HydrophobicContact CG-CB 4.31Å; Y66-L613 HydrophobicContact CG-CD1 4.32Å; Y66-D614 WeakPolarHBondContact CE1-OD1 3.28Å; Y66-D614 VanDerWaalsContact CZ-OD1 3.26Å; Y66-D614 PolarHBondContact OH-OD1 2.63Å
67	T	91.4	Very high	94.4	Very high	35 Å²	35	31.9 Å²	31.9	22%	0.215	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-19.8	167.1	47	0	0	0	0	113.2	S65 G69 P70 L188 V527 L542	S65-T67 PolarHBondContact O-N 3.11Å; T67-G69 VanDerWaalsContact C-N 3.29Å; T67-G69 PolarHBondContact O-N 2.86Å; T67-P70 WeakPolarHBondContact O-CD 3.27Å; T67-L188 WeakPolarHBondContact OG1-CD2 3.37Å; T67-V527 WeakPolarHBondContact CB-O 3.49Å; T67-V527 WeakPolarHBondContact CG2-O 3.46Å; T67-V527 PolarHBondContact OG1-O 3.46Å; T67-L542 HydrophobicContact CG2-CD1 4.11Å
68	E	93.2	Very high	94.6	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.019	18%	0.176	C	C	.	.	S	Bend	trans	-80.4	-6.8	175.9	-55	-177.5	94.2	0	0	112.8	Y64 S65 P70 E71 R195 K263	Y64-E68 WeakPolarHBondContact CA-OE2 3.44Å; S65-E68 PolarHBondContact N-OE2 2.62Å; S65-E68 WeakPolarHBondContact O-CB 3.42Å; S65-E68 PolarHBondContact O-N 2.69Å; E68-P70 VanDerWaalsContact C-CD 3.49Å; E68-E71 WeakPolarHBondContact O-CB 3.24Å; E68-E71 PolarHBondContact O-N 3.18Å; E68-R195 IonicContact OE1-CZ 3.87Å; E68-R195 IonicContact OE1-NH1 3.51Å; E68-R195 PolarHBondContact OE1-NH1 3.3Å; E68-K263 WeakPolarHBondContact OE1-CE 3.46Å; E68-K263 IonicContact OE1-NZ 3.31Å; E68-K263 PolarHBondContact OE1-NZ 3.38Å; E68-K263 IonicContact OE2-NZ 2.73Å; E68-K263 PolarHBondContact OE2-NZ 2.9Å
69	G	91.8	Very high	94.9	Very high	32 Å²	32	29.7 Å²	29.7	33%	0.33	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-43.6	-176.4	0	0	0	0	0	116.3	T67 E71 F72	T67-G69 VanDerWaalsContact C-N 3.29Å; T67-G69 PolarHBondContact O-N 2.86Å; G69-E71 PolarHBondContact O-N 2.78Å; G69-E71 VanDerWaalsContact O-N 3.14Å; G69-F72 VanDerWaalsContact O-CD2 3.27Å; G69-F72 WeakPolarHBondContact O-CD2 3.49Å; G69-F72 PolarHBondContact O-N 3.01Å
70	P	92.8	Very high	94.9	Very high	100 Å²	100	31.7 Å²	31.7	65%	0.649	18%	0.176	S	C	*	.	H	α-helix	trans	-60.5	-21.4	175.5	-25	35.9	0	0	0	114.1	T67 E68 F72 A73 L74	T67-P70 WeakPolarHBondContact O-CD 3.27Å; E68-P70 VanDerWaalsContact C-CD 3.49Å; P70-F72 VanDerWaalsContact C-N 3.34Å; P70-F72 PolarHBondContact O-N 2.7Å; P70-A73 PolarHBondContact O-N 3.01Å; P70-L74 PolarHBondContact O-N 3.23Å
71	E	94.9	Very high	94.9	Very high	26 Å²	26	36.6 Å²	36.6	12%	0.121	20%	0.199	C	C	.	.	H	α-helix	trans	-73.9	-22.5	-178.2	-58.9	-166.3	-137.3	0	0	113.2	E68 G69 A73 L74 N75 R124 R195	E68-E71 WeakPolarHBondContact O-CB 3.24Å; E68-E71 PolarHBondContact O-N 3.18Å; G69-E71 PolarHBondContact O-N 2.78Å; G69-E71 VanDerWaalsContact O-N 3.14Å; E71-A73 VanDerWaalsContact C-N 3.31Å; E71-A73 PolarHBondContact O-N 2.88Å; E71-L74 PolarHBondContact O-N 3.34Å; E71-N75 WeakPolarHBondContact O-CB 3.39Å; E71-N75 PolarHBondContact O-N 3.15Å; E71-N75 PolarHBondContact O-ND2 3.3Å; E71-N75 PolarHBondContact O-OD1 2.98Å; E71-R124 IonicContact OE2-CZ 3.64Å; E71-R124 IonicContact OE2-NH1 2.72Å; E71-R124 PolarHBondContact OE2-NH1 3.37Å; E71-R124 IonicContact OE2-NH2 2.63Å; E71-R124 PolarHBondContact OE2-NH2 3.49Å; E71-R195 IonicContact OE1-CZ 2.71Å; E71-R195 IonicContact OE1-NH1 2.85Å; E71-R195 PolarHBondContact OE1-NH1 3.36Å; E71-R195 IonicContact OE1-NH2 2.79Å; E71-R195 PolarHBondContact OE1-NH2 3.05Å; E71-R195 IonicContact OE2-NH1 2.74Å; E71-R195 IonicContact OE2-NH2 3.21Å
72	F	96.2	Very high	94.7	Very high	17 Å²	17	38.3 Å²	38.3	8%	0.075	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-44.4	172.5	-64.6	-61.7	0	0	0	111.2	Y64 G69 P70 N75 R76 Q131 F134 F615 V619	Y64-F72 HydrophobicContact CD1-CE1 4.12Å; Y64-F72 AromaticContact CD1-CZ 3.97Å; Y64-F72 HydrophobicContact CD1-CZ 3.97Å; Y64-F72 HydrophobicContact CD2-CE1 4.15Å; Y64-F72 AromaticContact CD2-CZ 3.87Å; Y64-F72 HydrophobicContact CD2-CZ 3.87Å; Y64-F72 HydrophobicContact CE1-CE1 4.03Å; Y64-F72 HydrophobicContact CE1-CZ 4.35Å; Y64-F72 HydrophobicContact CE2-CE1 4.03Å; Y64-F72 HydrophobicContact CE2-CZ 4.23Å; Y64-F72 HydrophobicContact CG-CE1 4.19Å; Y64-F72 AromaticContact CG-CZ 3.73Å; Y64-F72 HydrophobicContact CG-CZ 3.73Å; Y64-F72 AromaticContact CZ-CE1 3.99Å; G69-F72 VanDerWaalsContact O-CD2 3.27Å; G69-F72 WeakPolarHBondContact O-CD2 3.49Å; G69-F72 PolarHBondContact O-N 3.01Å; P70-F72 VanDerWaalsContact C-N 3.34Å; P70-F72 PolarHBondContact O-N 2.7Å; F72-N75 PolarHBondContact O-N 2.81Å; F72-R76 WeakPolarHBondContact O-CB 3.05Å; F72-R76 PolarHBondContact O-N 3.4Å; F72-R76 VanDerWaalsContact O-N 3.07Å; F72-Q131 VanDerWaalsContact CE1-NE2 3.32Å; F72-F134 HydrophobicContact CB-CZ 3.96Å; F72-F615 HydrophobicContact CD1-CD2 4Å; F72-F615 HydrophobicContact CD1-CE2 4.09Å; F72-F615 AromaticContact CE1-CD2 3.33Å; F72-F615 HydrophobicContact CE1-CD2 3.33Å; F72-F615 AromaticContact CE1-CE2 3.71Å; F72-F615 HydrophobicContact CE1-CE2 3.71Å; F72-F615 HydrophobicContact CE1-CG 4.06Å; F72-F615 HydrophobicContact CE2-CD2 4.32Å; F72-F615 HydrophobicContact CZ-CB 3.95Å; F72-F615 AromaticContact CZ-CD2 3.53Å; F72-F615 HydrophobicContact CZ-CD2 3.53Å; F72-F615 HydrophobicContact CZ-CE2 4.37Å; F72-F615 AromaticContact CZ-CG 3.98Å; F72-F615 HydrophobicContact CZ-CG 3.98Å; F72-V619 HydrophobicContact CB-CG1 3.9Å; F72-V619 HydrophobicContact CD1-CG1 4.17Å; F72-V619 HydrophobicContact CD2-CG1 3.84Å; F72-V619 HydrophobicContact CE2-CG1 4.41Å; F72-V619 HydrophobicContact CG-CG1 3.72Å
73	A	96	Very high	94.6	Very high	67 Å²	67	38.8 Å²	38.8	55%	0.554	21%	0.209	S	C	*	.	H	α-helix	trans	-68.5	-34.8	176.1	0	0	0	0	0	112.4	P70 E71 K77	P70-A73 PolarHBondContact O-N 3.01Å; E71-A73 VanDerWaalsContact C-N 3.31Å; E71-A73 PolarHBondContact O-N 2.88Å; A73-K77 WeakPolarHBondContact O-CB 3.28Å; A73-K77 PolarHBondContact O-N 3.27Å
74	L	96.3	Very high	94.3	Very high	76 Å²	76	46.6 Å²	46.6	40%	0.398	24%	0.238	S	C	.	.	H	α-helix	trans	-68.5	-42.6	175.5	-176.8	59.1	0	0	0	112.1	P70 E71 K77 C78	P70-L74 PolarHBondContact O-N 3.23Å; E71-L74 PolarHBondContact O-N 3.34Å; L74-K77 PolarHBondContact O-N 3.14Å; L74-C78 PolarHBondContact O-N 3.43Å; L74-C78 PolarHBondContact O-SG 3.48Å; L74-C78 VanDerWaalsContact O-SG 3.39Å
75	N	97.6	Very high	93.9	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-49.3	175.7	-64.7	-12.1	0	0	0	110.7	E71 F72 K77 C78 F79 R124 L127 Q131	E71-N75 WeakPolarHBondContact O-CB 3.39Å; E71-N75 PolarHBondContact O-N 3.15Å; E71-N75 PolarHBondContact O-ND2 3.3Å; E71-N75 PolarHBondContact O-OD1 2.98Å; F72-N75 PolarHBondContact O-N 2.81Å; N75-K77 VanDerWaalsContact C-N 3.32Å; N75-K77 PolarHBondContact O-N 3.24Å; N75-C78 PolarHBondContact O-N 3.02Å; N75-F79 PolarHBondContact O-N 2.9Å; N75-R124 WeakPolarHBondContact CB-O 3.46Å; N75-R124 WeakPolarHBondContact OD1-CG 3.5Å; N75-R124 PolarHBondContact OD1-NH1 2.87Å; N75-L127 VanDerWaalsContact ND2-CD2 3.35Å; N75-L127 WeakPolarHBondContact ND2-CD2 3.17Å; N75-Q131 PolarHBondContact ND2-OE1 2.92Å; N75-Q131 VanDerWaalsContact ND2-OE1 3.15Å
76	R	96.6	Very high	93.5	Very high	102 Å²	102	54.5 Å²	54.5	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-53.5	-47.4	173.1	179.3	-172.1	166.5	167.4	1.3	111.6	F72 F79 E80 Y128	F72-R76 WeakPolarHBondContact O-CB 3.05Å; F72-R76 PolarHBondContact O-N 3.4Å; F72-R76 VanDerWaalsContact O-N 3.07Å; R76-F79 WeakPolarHBondContact O-CB 3.48Å; R76-F79 PolarHBondContact O-N 2.89Å; R76-E80 HydrophobicContact CG-CG 4.47Å; R76-E80 IonicContact CZ-OE1 2.77Å; R76-E80 IonicContact NE-OE1 3.8Å; R76-E80 PolarHBondContact NE-OE1 2.94Å; R76-E80 IonicContact NH2-OE1 2.86Å; R76-E80 PolarHBondContact NH2-OE1 3.14Å; R76-E80 PolarHBondContact O-N 3.29Å; R76-Y128 VanDerWaalsContact CA-CD2 3.46Å; R76-Y128 HydrophobicContact CB-CD2 3.66Å; R76-Y128 HydrophobicContact CB-CE2 3.58Å; R76-Y128 HydrophobicContact CB-CG 4.4Å; R76-Y128 HydrophobicContact CG-CD2 4.28Å; R76-Y128 HydrophobicContact CG-CE2 3.74Å
77	K	97	Very high	93.2	Very high	116 Å²	116	55.3 Å²	55.3	50%	0.504	29%	0.293	S	S	.	.	H	α-helix	trans	-60.9	-45.9	179.1	178.6	175.9	170.6	177.2	0	112	A73 L74 N75 F79 E80 E81	A73-K77 WeakPolarHBondContact O-CB 3.28Å; A73-K77 PolarHBondContact O-N 3.27Å; L74-K77 PolarHBondContact O-N 3.14Å; N75-K77 VanDerWaalsContact C-N 3.32Å; N75-K77 PolarHBondContact O-N 3.24Å; K77-F79 VanDerWaalsContact C-N 3.28Å; K77-F79 PolarHBondContact O-N 2.97Å; K77-E80 PolarHBondContact O-N 3.49Å; K77-E81 WeakPolarHBondContact CE-OE1 3.3Å; K77-E81 HydrophobicContact CG-CG 4.42Å; K77-E81 IonicContact NZ-OE1 3.6Å; K77-E81 WeakPolarHBondContact O-CG 3.33Å; K77-E81 PolarHBondContact O-N 3.34Å
78	C	96.6	Very high	92.6	Very high	11 Å²	11	58.1 Å²	58.1	7%	0.074	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-35.6	177.8	-67.4	0	0	0	0	112.6	L74 N75 E82 K121 R124	L74-C78 PolarHBondContact O-N 3.43Å; L74-C78 PolarHBondContact O-SG 3.48Å; L74-C78 VanDerWaalsContact O-SG 3.39Å; N75-C78 PolarHBondContact O-N 3.02Å; C78-E82 PolarHBondContact O-N 2.83Å; C78-K121 WeakPolarHBondContact CB-O 3.44Å; C78-R124 HydrophobicContact CB-CB 4.03Å
79	F	96.6	Very high	92.1	Very high	7 Å²	7	65.9 Å²	65.9	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-66.2	-51.3	171.8	-177.7	-89.5	0	0	0	111.9	N75 R76 K77 E81 E82 F83 W92 H103 A125 Y128 M129	N75-F79 PolarHBondContact O-N 2.9Å; R76-F79 WeakPolarHBondContact O-CB 3.48Å; R76-F79 PolarHBondContact O-N 2.89Å; K77-F79 VanDerWaalsContact C-N 3.28Å; K77-F79 PolarHBondContact O-N 2.97Å; F79-E81 PolarHBondContact O-N 3.07Å; F79-E82 PolarHBondContact O-N 3.01Å; F79-F83 HydrophobicContact CD1-CB 4.19Å; F79-F83 HydrophobicContact CE1-CB 4.04Å; F79-F83 AromaticContact CE1-CD2 3.91Å; F79-F83 HydrophobicContact CE1-CD2 3.91Å; F79-F83 AromaticContact CE1-CG 3.98Å; F79-F83 HydrophobicContact CE1-CG 3.98Å; F79-F83 AromaticContact CZ-CD2 3.93Å; F79-F83 HydrophobicContact CZ-CD2 3.93Å; F79-F83 HydrophobicContact CZ-CG 4.44Å; F79-F83 WeakPolarHBondContact O-CB 3.16Å; F79-F83 PolarHBondContact O-N 3.22Å; F79-W92 HydrophobicContact CZ-CD2 4.12Å; F79-W92 AromaticContact CZ-CE3 3.81Å; F79-W92 HydrophobicContact CZ-CE3 3.81Å; F79-W92 HydrophobicContact CZ-CG 4.47Å; F79-W92 HydrophobicContact CZ-CZ3 4.38Å; F79-H103 AromaticContact CD2-NE2 3.81Å; F79-H103 AromaticContact CE2-CD2 3.97Å; F79-H103 AromaticContact CE2-NE2 3.05Å; F79-H103 WeakPolarHBondContact CE2-NE2 3.43Å; F79-H103 AromaticContact CZ-NE2 3.39Å; F79-H103 WeakPolarHBondContact CZ-NE2 3.4Å; F79-A125 HydrophobicContact CB-CB 4.03Å; F79-A125 HydrophobicContact CD2-CB 4.34Å; F79-Y128 HydrophobicContact CB-CD1 3.5Å; F79-Y128 VanDerWaalsContact CB-CD1 3.5Å; F79-Y128 HydrophobicContact CB-CE1 4.24Å; F79-Y128 HydrophobicContact CB-CG 4.04Å; F79-Y128 AromaticContact CD1-CD1 3.65Å; F79-Y128 HydrophobicContact CD1-CD1 3.65Å; F79-Y128 AromaticContact CD1-CE1 3.64Å; F79-Y128 HydrophobicContact CD1-CE1 3.64Å; F79-Y128 AromaticContact CD2-CD1 3.77Å; F79-Y128 HydrophobicContact CD2-CD1 3.77Å; F79-Y128 HydrophobicContact CD2-CE1 4.48Å; F79-Y128 HydrophobicContact CE1-CD1 4.28Å; F79-Y128 HydrophobicContact CE1-CE1 4.06Å; F79-Y128 HydrophobicContact CE2-CD1 4.36Å; F79-Y128 AromaticContact CG-CD1 3.36Å; F79-Y128 HydrophobicContact CG-CD1 3.36Å; F79-Y128 AromaticContact CG-CE1 3.89Å; F79-Y128 HydrophobicContact CG-CE1 3.89Å; F79-Y128 HydrophobicContact CG-CG 4.34Å; F79-M129 HydrophobicContact CD2-CB 4.48Å; F79-M129 HydrophobicContact CE2-CB 4.15Å; F79-M129 HydrophobicContact CE2-CG 4.03Å; F79-M129 HydrophobicContact CE2-SD 4.28Å
80	E	94.9	Very high	92	Very high	41 Å²	41	69 Å²	69	19%	0.192	36%	0.36	C	S	.	.	H	α-helix	trans	-59.5	-32.4	179.9	-76.5	-171.2	-165.1	0	0	113.2	R76 K77 R84	R76-E80 HydrophobicContact CG-CG 4.47Å; R76-E80 IonicContact CZ-OE1 2.77Å; R76-E80 IonicContact NE-OE1 3.8Å; R76-E80 PolarHBondContact NE-OE1 2.94Å; R76-E80 IonicContact NH2-OE1 2.86Å; R76-E80 PolarHBondContact NH2-OE1 3.14Å; R76-E80 PolarHBondContact O-N 3.29Å; K77-E80 PolarHBondContact O-N 3.49Å; E80-R84 VanDerWaalsContact CD-NH2 3.33Å; E80-R84 VanDerWaalsContact O-CB 3.3Å; E80-R84 WeakPolarHBondContact O-CB 3Å; E80-R84 VanDerWaalsContact O-CG 3.3Å; E80-R84 WeakPolarHBondContact O-CG 3.4Å; E80-R84 PolarHBondContact O-N 3.23Å; E80-R84 VanDerWaalsContact O-N 3.12Å; E80-R84 IonicContact OE1-NH2 2.83Å; E80-R84 IonicContact OE2-CZ 3.99Å; E80-R84 IonicContact OE2-NH1 3.9Å; E80-R84 PolarHBondContact OE2-NH1 3.12Å; E80-R84 IonicContact OE2-NH2 3.01Å; E80-R84 PolarHBondContact OE2-NH2 2.85Å
81	E	92.9	Very high	91.9	Very high	104 Å²	104	68.6 Å²	68.6	49%	0.486	35%	0.348	S	S	.	.	H	α-helix	trans	-68.6	-40.5	177.4	-76.7	177.4	168.9	0	0	113.2	K77 F79	K77-E81 WeakPolarHBondContact CE-OE1 3.3Å; K77-E81 HydrophobicContact CG-CG 4.42Å; K77-E81 IonicContact NZ-OE1 3.6Å; K77-E81 WeakPolarHBondContact O-CG 3.33Å; K77-E81 PolarHBondContact O-N 3.34Å; F79-E81 PolarHBondContact O-N 3.07Å
82	E	90.3	Very high	91.9	Very high	37 Å²	37	67.4 Å²	67.4	17%	0.173	34%	0.343	C	S	.	.	H	α-helix	trans	-82.4	-38.1	176.5	-168.2	-80.5	134.6	0	0	112	C78 F79 A85 H86 H103 R106 L107	C78-E82 PolarHBondContact O-N 2.83Å; F79-E82 PolarHBondContact O-N 3.01Å; E82-A85 WeakPolarHBondContact O-CB 3.48Å; E82-A85 PolarHBondContact O-N 3.24Å; E82-H86 PolarHBondContact O-ND1 3.38Å; E82-H86 IonicContact OE1-CE1 3.11Å; E82-H86 PolarHBondContact OE1-CE1 2.98Å; E82-H86 IonicContact OE1-CG 3.87Å; E82-H86 IonicContact OE1-ND1 2.69Å; E82-H86 PolarHBondContact OE1-ND1 3.33Å; E82-H103 IonicContact OE2-CE1 3.91Å; E82-H103 PolarHBondContact OE2-CE1 3.48Å; E82-H103 IonicContact OE2-ND1 2.7Å; E82-H103 PolarHBondContact OE2-ND1 2.93Å; E82-H103 IonicContact OE2-NE2 2.81Å; E82-R106 IonicContact OE1-NE 3.51Å; E82-L107 HydrophobicContact CG-CD2 4.39Å; E82-L107 WeakPolarHBondContact OE2-CD2 3.48Å
83	F	92.6	Very high	91.7	Very high	12 Å²	12	68.5 Å²	68.5	5%	0.053	35%	0.351	C	S	.	.	H	α-helix	trans	-60.3	-50	178.5	-174.6	-95.2	0	0	0	111.7	F79 A85 H86 V87 K90 W92 L95 H103	F79-F83 HydrophobicContact CD1-CB 4.19Å; F79-F83 HydrophobicContact CE1-CB 4.04Å; F79-F83 AromaticContact CE1-CD2 3.91Å; F79-F83 HydrophobicContact CE1-CD2 3.91Å; F79-F83 AromaticContact CE1-CG 3.98Å; F79-F83 HydrophobicContact CE1-CG 3.98Å; F79-F83 AromaticContact CZ-CD2 3.93Å; F79-F83 HydrophobicContact CZ-CD2 3.93Å; F79-F83 HydrophobicContact CZ-CG 4.44Å; F79-F83 WeakPolarHBondContact O-CB 3.16Å; F79-F83 PolarHBondContact O-N 3.22Å; F83-A85 PolarHBondContact O-N 3.49Å; F83-H86 PolarHBondContact O-N 2.92Å; F83-H86 VanDerWaalsContact O-N 3.08Å; F83-V87 HydrophobicContact CD1-CB 4.23Å; F83-V87 HydrophobicContact CE1-CB 3.85Å; F83-V87 HydrophobicContact CE1-CG1 3.83Å; F83-V87 HydrophobicContact CE2-CB 4.25Å; F83-V87 HydrophobicContact CE2-CG1 4.46Å; F83-V87 HydrophobicContact CE2-CG2 4.13Å; F83-V87 HydrophobicContact CZ-CB 3.86Å; F83-V87 HydrophobicContact CZ-CG1 3.71Å; F83-V87 HydrophobicContact CZ-CG2 4.19Å; F83-V87 PolarHBondContact O-N 3.42Å; F83-K90 WeakPolarHBondContact CE1-O 3.37Å; F83-W92 HydrophobicContact CD2-CE3 4.37Å; F83-W92 AromaticContact CE2-CE3 3.81Å; F83-W92 HydrophobicContact CE2-CE3 3.81Å; F83-W92 HydrophobicContact CE2-CZ3 4.36Å; F83-L95 HydrophobicContact CE2-CD1 3.62Å; F83-L95 HydrophobicContact CZ-CD1 3.82Å; F83-L95 HydrophobicContact CZ-CG 4.43Å; F83-H103 AromaticContact CD2-CE1 3.73Å; F83-H103 AromaticContact CD2-NE2 3.85Å
84	R	90	Very high	91.6	Very high	163 Å²	163	69.4 Å²	69.4	62%	0.615	35%	0.346	S	S	*	.	H	α-helix	trans	-67.1	-17.7	179.1	-71.1	-175.4	-176.2	116.9	9.5	114.2	E80 H86	E80-R84 VanDerWaalsContact CD-NH2 3.33Å; E80-R84 VanDerWaalsContact O-CB 3.3Å; E80-R84 WeakPolarHBondContact O-CB 3Å; E80-R84 VanDerWaalsContact O-CG 3.3Å; E80-R84 WeakPolarHBondContact O-CG 3.4Å; E80-R84 PolarHBondContact O-N 3.23Å; E80-R84 VanDerWaalsContact O-N 3.12Å; E80-R84 IonicContact OE1-NH2 2.83Å; E80-R84 IonicContact OE2-CZ 3.99Å; E80-R84 IonicContact OE2-NH1 3.9Å; E80-R84 PolarHBondContact OE2-NH1 3.12Å; E80-R84 IonicContact OE2-NH2 3.01Å; E80-R84 PolarHBondContact OE2-NH2 2.85Å; R84-H86 PolarHBondContact O-N 3.18Å
85	A	87.4	Confident	91.5	Very high	72 Å²	72	66.3 Å²	66.3	60%	0.595	33%	0.33	S	S	*	.	H	α-helix	trans	-71.6	-20.4	173.8	0	0	0	0	0	112.7	E82 F83	E82-A85 WeakPolarHBondContact O-CB 3.48Å; E82-A85 PolarHBondContact O-N 3.24Å; F83-A85 PolarHBondContact O-N 3.49Å
86	H	86.1	Confident	91.3	Very high	110 Å²	110	70 Å²	70	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-124.4	-18.1	-175.4	-61.5	108.8	0	0	0	114.3	E82 F83 R84 R106	E82-H86 PolarHBondContact O-ND1 3.38Å; E82-H86 IonicContact OE1-CE1 3.11Å; E82-H86 PolarHBondContact OE1-CE1 2.98Å; E82-H86 IonicContact OE1-CG 3.87Å; E82-H86 IonicContact OE1-ND1 2.69Å; E82-H86 PolarHBondContact OE1-ND1 3.33Å; F83-H86 PolarHBondContact O-N 2.92Å; F83-H86 VanDerWaalsContact O-N 3.08Å; R84-H86 PolarHBondContact O-N 3.18Å; H86-R106 PolarHBondContact ND1-NE 2.89Å
87	V	84.9	Confident	91.2	Very high	26 Å²	26	68.2 Å²	68.2	16%	0.158	36%	0.357	C	S	.	.			trans	-133.7	107.8	-178.8	-176.5	0	0	0	0	109.5	F83 K90 L95	F83-V87 HydrophobicContact CD1-CB 4.23Å; F83-V87 HydrophobicContact CE1-CB 3.85Å; F83-V87 HydrophobicContact CE1-CG1 3.83Å; F83-V87 HydrophobicContact CE2-CB 4.25Å; F83-V87 HydrophobicContact CE2-CG1 4.46Å; F83-V87 HydrophobicContact CE2-CG2 4.13Å; F83-V87 HydrophobicContact CZ-CB 3.86Å; F83-V87 HydrophobicContact CZ-CG1 3.71Å; F83-V87 HydrophobicContact CZ-CG2 4.19Å; F83-V87 PolarHBondContact O-N 3.42Å; V87-K90 HydrophobicContact CG1-CB 4Å; V87-L95 HydrophobicContact CG1-CD2 4.1Å
88	S	80.8	Confident	91.1	Very high	94 Å²	94	66 Å²	66	66%	0.657	36%	0.361	S	S	*	.			trans	-84.2	139.4	171.2	54.3	0	0	0	0	111.5	K90	S88-K90 VanDerWaalsContact C-N 3.34Å; S88-K90 PolarHBondContact O-N 3.28Å
89	D	82.6	Confident	91.1	Very high	167 Å²	167	69.2 Å²	69.2	89%	0.893	37%	0.374	S	S	*	.	S	Bend	trans	56.2	34.1	161.4	-49.7	-35.8	0	0	0	117
90	K	89.2	Confident	91	Very high	97 Å²	97	69.5 Å²	69.5	42%	0.422	38%	0.376	S	S	.	.			trans	-133.9	158.8	169.2	-75.1	-164.8	169.2	-158.2	0	112	F83 V87 S88 D94 L95	F83-K90 WeakPolarHBondContact CE1-O 3.37Å; V87-K90 HydrophobicContact CG1-CB 4Å; S88-K90 VanDerWaalsContact C-N 3.34Å; S88-K90 PolarHBondContact O-N 3.28Å; K90-D94 HydrophobicContact CB-CB 4.41Å; K90-D94 HydrophobicContact CD-CB 4.42Å; K90-D94 PolarHBondContact NZ-O 2.76Å; K90-L95 HydrophobicContact CB-CD2 4.19Å; K90-L95 HydrophobicContact CD-CD2 3.52Å
91	K	91.1	Very high	91.1	Very high	93 Å²	93	71.8 Å²	71.8	40%	0.404	38%	0.383	S	S	.	.			trans	-83.9	170.5	165.8	-65.6	170.1	156.3	-95.9	0	111.9	T93 D94 D136	K91-T93 PolarHBondContact O-N 2.97Å; K91-D94 HydrophobicContact CB-CB 4.44Å; K91-D94 VanDerWaalsContact CB-OD2 3.22Å; K91-D94 WeakPolarHBondContact CB-OD2 3.5Å; K91-D94 WeakPolarHBondContact CG-OD2 3.42Å; K91-D94 PolarHBondContact N-OD2 3.48Å; K91-D94 PolarHBondContact O-N 2.85Å; K91-D136 WeakPolarHBondContact CB-OD2 2.79Å; K91-D136 WeakPolarHBondContact CD-OD1 3.3Å; K91-D136 WeakPolarHBondContact CE-OD1 3.39Å; K91-D136 VanDerWaalsContact CG-OD1 3.27Å; K91-D136 WeakPolarHBondContact CG-OD1 3.19Å; K91-D136 IonicContact NZ-OD1 2.72Å; K91-D136 PolarHBondContact NZ-OD1 3.39Å
92	W	94.4	Very high	91.3	Very high	1 Å²	1	69 Å²	69	0%	0.004	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-62.1	-37.5	168.2	177.7	-111.9	0	0	0	111.5	F79 F83 D94 L95 H100 H103 M129 A133 D136 W146 N150 L153	F79-W92 HydrophobicContact CZ-CD2 4.12Å; F79-W92 AromaticContact CZ-CE3 3.81Å; F79-W92 HydrophobicContact CZ-CE3 3.81Å; F79-W92 HydrophobicContact CZ-CG 4.47Å; F79-W92 HydrophobicContact CZ-CZ3 4.38Å; F83-W92 HydrophobicContact CD2-CE3 4.37Å; F83-W92 AromaticContact CE2-CE3 3.81Å; F83-W92 HydrophobicContact CE2-CE3 3.81Å; F83-W92 HydrophobicContact CE2-CZ3 4.36Å; W92-D94 VanDerWaalsContact C-N 3.28Å; W92-D94 PolarHBondContact O-N 3.04Å; W92-L95 HydrophobicContact CE3-CD1 4.01Å; W92-L95 HydrophobicContact CZ3-CD1 4.19Å; W92-H100 AromaticContact CD2-CD2 3.8Å; W92-H100 AromaticContact CD2-NE2 3.79Å; W92-H100 AromaticContact CE2-CD2 3.56Å; W92-H100 AromaticContact CE2-NE2 3.89Å; W92-H100 AromaticContact CE3-CD2 3.81Å; W92-H100 AromaticContact CG-NE2 3.94Å; W92-H100 HydrophobicContact CH2-CB 3.92Å; W92-H100 AromaticContact CH2-CD2 3.46Å; W92-H100 VanDerWaalsContact CH2-CD2 3.46Å; W92-H100 WeakPolarHBondContact CH2-CD2 3.29Å; W92-H100 HydrophobicContact CZ2-CB 4.22Å; W92-H100 AromaticContact CZ2-CD2 3.42Å; W92-H100 VanDerWaalsContact CZ2-CD2 3.42Å; W92-H100 WeakPolarHBondContact CZ2-CD2 3.49Å; W92-H100 AromaticContact CZ3-CD2 3.63Å; W92-H100 PolarHBondContact O-NE2 3.46Å; W92-H103 AromaticContact CH2-CD2 3.81Å; W92-H103 HydrophobicContact CZ3-CB 4.19Å; W92-H103 AromaticContact CZ3-CD2 3.28Å; W92-H103 WeakPolarHBondContact CZ3-CD2 3.31Å; W92-M129 HydrophobicContact CH2-CG 4.44Å; W92-M129 HydrophobicContact CH2-SD 3.56Å; W92-M129 VanDerWaalsContact CH2-SD 3.56Å; W92-M129 HydrophobicContact CZ2-CE 4.42Å; W92-M129 HydrophobicContact CZ2-CG 3.97Å; W92-M129 HydrophobicContact CZ2-SD 3.58Å; W92-M129 VanDerWaalsContact CZ2-SD 3.58Å; W92-M129 HydrophobicContact CZ3-SD 4.36Å; W92-A133 HydrophobicContact CB-CB 4.37Å; W92-A133 HydrophobicContact CG-CB 4.09Å; W92-D136 PolarHBondContact N-OD2 3.25Å; W92-D136 VanDerWaalsContact N-OD2 3.08Å; W92-W146 AromaticContact NE1-CE3 3.85Å; W92-N150 PolarHBondContact NE1-ND2 3.31Å; W92-N150 PolarHBondContact NE1-OD1 3.22Å; W92-L153 HydrophobicContact CH2-CD2 4.21Å; W92-L153 HydrophobicContact CZ2-CD2 4.09Å
93	T	92.8	Very high	91.6	Very high	39 Å²	39	67.3 Å²	67.3	24%	0.239	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-74.5	-14.3	-176.1	59.4	0	0	0	0	114	K91 D136 W146	K91-T93 PolarHBondContact O-N 2.97Å; T93-D136 HydrophobicContact CG2-CB 3.71Å; T93-W146 HydrophobicContact CG2-CD2 4.23Å; T93-W146 HydrophobicContact CG2-CH2 4.38Å; T93-W146 HydrophobicContact CG2-CZ2 3.65Å
94	D	92.5	Very high	91.8	Very high	86 Å²	86	66.7 Å²	66.7	46%	0.46	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-95	6.9	-179.1	-56.3	-32.6	0	0	0	113.7	K90 K91 W92	K90-D94 HydrophobicContact CB-CB 4.41Å; K90-D94 HydrophobicContact CD-CB 4.42Å; K90-D94 PolarHBondContact NZ-O 2.76Å; K91-D94 HydrophobicContact CB-CB 4.44Å; K91-D94 VanDerWaalsContact CB-OD2 3.22Å; K91-D94 WeakPolarHBondContact CB-OD2 3.5Å; K91-D94 WeakPolarHBondContact CG-OD2 3.42Å; K91-D94 PolarHBondContact N-OD2 3.48Å; K91-D94 PolarHBondContact O-N 2.85Å; W92-D94 VanDerWaalsContact C-N 3.28Å; W92-D94 PolarHBondContact O-N 3.04Å
95	L	93.9	Very high	92.1	Very high	11 Å²	11	63 Å²	63	6%	0.058	36%	0.358	C	S	.	.	S	Bend	trans	-95.5	152.4	-178.2	-59.7	-173.2	0	0	0	112.3	F83 V87 K90 W92 Q99 H100	F83-L95 HydrophobicContact CE2-CD1 3.62Å; F83-L95 HydrophobicContact CZ-CD1 3.82Å; F83-L95 HydrophobicContact CZ-CG 4.43Å; V87-L95 HydrophobicContact CG1-CD2 4.1Å; K90-L95 HydrophobicContact CB-CD2 4.19Å; K90-L95 HydrophobicContact CD-CD2 3.52Å; W92-L95 HydrophobicContact CE3-CD1 4.01Å; W92-L95 HydrophobicContact CZ3-CD1 4.19Å; L95-Q99 HydrophobicContact CB-CB 3.96Å; L95-Q99 HydrophobicContact CD1-CB 4.26Å; L95-Q99 HydrophobicContact CD2-CB 4.38Å; L95-Q99 VanDerWaalsContact CD2-OE1 3.3Å; L95-Q99 HydrophobicContact CG-CB 4.44Å; L95-H100 PolarHBondContact O-CE1 3.14Å
96	D	94.2	Very high	92.4	Very high	81 Å²	81	63.1 Å²	63.1	43%	0.433	34%	0.343	S	S	.	.			trans	-81.4	165	168.3	70.9	62.6	0	0	0	112.1	A98 Q99 H100	D96-A98 VanDerWaalsContact C-N 3.25Å; D96-A98 PolarHBondContact O-N 3.38Å; D96-A98 WeakPolarHBondContact OD1-CA 3.32Å; D96-A98 WeakPolarHBondContact OD1-CB 3.42Å; D96-A98 PolarHBondContact OD1-N 3.3Å; D96-Q99 WeakPolarHBondContact O-CB 3.18Å; D96-Q99 PolarHBondContact O-N 2.91Å; D96-Q99 VanDerWaalsContact O-N 3.1Å; D96-Q99 PolarHBondContact OD1-N 3.04Å; D96-Q99 WeakPolarHBondContact OD2-CG 3.35Å; D96-Q99 PolarHBondContact OD2-OE1 3.45Å; D96-H100 PolarHBondContact O-N 3.41Å; D96-H100 PolarHBondContact O-ND1 3.12Å
97	A	94.4	Very high	92.9	Very high	64 Å²	64	58 Å²	58	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-62.8	-26.5	-176.2	0	0	0	0	0	114.3	R101	A97-R101 WeakPolarHBondContact O-CB 3.36Å; A97-R101 PolarHBondContact O-N 3.08Å
98	A	95.6	Very high	93.4	Very high	71 Å²	71	58.1 Å²	58.1	59%	0.587	32%	0.318	S	S	*	.	H	α-helix	trans	-76.7	-37.7	175.1	0	0	0	0	0	110.9	D96 R101 A102	D96-A98 VanDerWaalsContact C-N 3.25Å; D96-A98 PolarHBondContact O-N 3.38Å; D96-A98 WeakPolarHBondContact OD1-CA 3.32Å; D96-A98 WeakPolarHBondContact OD1-CB 3.42Å; D96-A98 PolarHBondContact OD1-N 3.3Å; A98-R101 PolarHBondContact O-N 2.83Å; A98-A102 VanDerWaalsContact O-CB 3.24Å; A98-A102 WeakPolarHBondContact O-CB 3.44Å; A98-A102 PolarHBondContact O-N 1.91Å
99	Q	95.2	Very high	94	Very high	78 Å²	78	58.3 Å²	58.3	36%	0.364	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-42.9	170.9	-68.6	-175.2	-33.6	0	0	111.7	L95 D96 A102 H103	L95-Q99 HydrophobicContact CB-CB 3.96Å; L95-Q99 HydrophobicContact CD1-CB 4.26Å; L95-Q99 HydrophobicContact CD2-CB 4.38Å; L95-Q99 VanDerWaalsContact CD2-OE1 3.3Å; L95-Q99 HydrophobicContact CG-CB 4.44Å; D96-Q99 WeakPolarHBondContact O-CB 3.18Å; D96-Q99 PolarHBondContact O-N 2.91Å; D96-Q99 VanDerWaalsContact O-N 3.1Å; D96-Q99 PolarHBondContact OD1-N 3.04Å; D96-Q99 WeakPolarHBondContact OD2-CG 3.35Å; D96-Q99 PolarHBondContact OD2-OE1 3.45Å; Q99-A102 PolarHBondContact O-N 3.11Å; Q99-H103 PolarHBondContact O-N 2.96Å; Q99-H103 VanDerWaalsContact O-N 3.14Å
100	H	96.3	Very high	94.5	Very high	13 Å²	13	51 Å²	51	6%	0.06	28%	0.276	C	S	.	.	H	α-helix	trans	-57.5	-53.3	172	-68	140.2	0	0	0	111.4	W92 L95 D96 A102 H103 A104 W146 Y149 L153	W92-H100 AromaticContact CD2-CD2 3.8Å; W92-H100 AromaticContact CD2-NE2 3.79Å; W92-H100 AromaticContact CE2-CD2 3.56Å; W92-H100 AromaticContact CE2-NE2 3.89Å; W92-H100 AromaticContact CE3-CD2 3.81Å; W92-H100 AromaticContact CG-NE2 3.94Å; W92-H100 HydrophobicContact CH2-CB 3.92Å; W92-H100 AromaticContact CH2-CD2 3.46Å; W92-H100 VanDerWaalsContact CH2-CD2 3.46Å; W92-H100 WeakPolarHBondContact CH2-CD2 3.29Å; W92-H100 HydrophobicContact CZ2-CB 4.22Å; W92-H100 AromaticContact CZ2-CD2 3.42Å; W92-H100 VanDerWaalsContact CZ2-CD2 3.42Å; W92-H100 WeakPolarHBondContact CZ2-CD2 3.49Å; W92-H100 AromaticContact CZ3-CD2 3.63Å; W92-H100 PolarHBondContact O-NE2 3.46Å; L95-H100 PolarHBondContact O-CE1 3.14Å; D96-H100 PolarHBondContact O-N 3.41Å; D96-H100 PolarHBondContact O-ND1 3.12Å; H100-A102 PolarHBondContact O-N 2.89Å; H100-H103 PolarHBondContact O-N 3.33Å; H100-A104 PolarHBondContact O-N 2.75Å; H100-W146 AromaticContact CE1-CH2 3.55Å; H100-W146 AromaticContact CE1-CZ3 3.7Å; H100-W146 AromaticContact NE2-CH2 3.99Å; H100-W146 AromaticContact NE2-CZ3 3.87Å; H100-Y149 HydrophobicContact CB-CE1 4.45Å; H100-Y149 AromaticContact CG-CE1 3.97Å; H100-Y149 AromaticContact ND1-CE1 3.49Å; H100-Y149 WeakPolarHBondContact ND1-CE1 3.43Å; H100-Y149 AromaticContact ND1-CZ 3.56Å; H100-Y149 PolarHBondContact ND1-OH 3.09Å; H100-L153 HydrophobicContact CB-CD2 3.77Å
101	R	96.9	Very high	94.7	Very high	89 Å²	89	46.6 Å²	46.6	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-61.8	-41.3	-179.9	-173	174.8	173.8	105.7	10.2	112.1	A97 A98 H103 A104 M105 L153 D156 V157	A97-R101 WeakPolarHBondContact O-CB 3.36Å; A97-R101 PolarHBondContact O-N 3.08Å; A98-R101 PolarHBondContact O-N 2.83Å; R101-H103 VanDerWaalsContact C-N 3.32Å; R101-H103 PolarHBondContact O-N 3.31Å; R101-A104 PolarHBondContact O-N 2.93Å; R101-M105 HydrophobicContact CG-CG 4.44Å; R101-M105 HydrophobicContact CG-SD 4.16Å; R101-M105 WeakPolarHBondContact O-CG 3.46Å; R101-M105 PolarHBondContact O-N 3.31Å; R101-L153 HydrophobicContact CB-CD1 4.02Å; R101-L153 HydrophobicContact CG-CD1 4.41Å; R101-D156 IonicContact CZ-OD2 2.69Å; R101-D156 PolarHBondContact NH1-O 3.34Å; R101-D156 IonicContact NH1-OD1 3.51Å; R101-D156 PolarHBondContact NH1-OD1 3.45Å; R101-D156 IonicContact NH1-OD2 2.8Å; R101-D156 PolarHBondContact NH1-OD2 2.98Å; R101-D156 PolarHBondContact NH2-O 2.9Å; R101-D156 VanDerWaalsContact NH2-O 3.15Å; R101-V157 HydrophobicContact CG-CG1 3.88Å
102	A	96.2	Very high	94.4	Very high	45 Å²	45	49.7 Å²	49.7	37%	0.372	27%	0.273	S	S	.	.	H	α-helix	trans	-64.3	-33.2	178.7	0	0	0	0	0	113.4	A98 Q99 H100 R106	A98-A102 VanDerWaalsContact O-CB 3.24Å; A98-A102 WeakPolarHBondContact O-CB 3.44Å; A98-A102 PolarHBondContact O-N 1.91Å; Q99-A102 PolarHBondContact O-N 3.11Å; H100-A102 PolarHBondContact O-N 2.89Å; A102-R106 WeakPolarHBondContact O-CG 3.15Å; A102-R106 PolarHBondContact O-N 3.28Å; A102-R106 PolarHBondContact O-NH1 3.28Å
103	H	96.4	Very high	93.9	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-76.2	-41.6	172.8	174.2	75.2	0	0	0	112	F79 E82 F83 W92 Q99 H100 R101 M105 R106 L107	F79-H103 AromaticContact CD2-NE2 3.81Å; F79-H103 AromaticContact CE2-CD2 3.97Å; F79-H103 AromaticContact CE2-NE2 3.05Å; F79-H103 WeakPolarHBondContact CE2-NE2 3.43Å; F79-H103 AromaticContact CZ-NE2 3.39Å; F79-H103 WeakPolarHBondContact CZ-NE2 3.4Å; E82-H103 IonicContact OE2-CE1 3.91Å; E82-H103 PolarHBondContact OE2-CE1 3.48Å; E82-H103 IonicContact OE2-ND1 2.7Å; E82-H103 PolarHBondContact OE2-ND1 2.93Å; E82-H103 IonicContact OE2-NE2 2.81Å; F83-H103 AromaticContact CD2-CE1 3.73Å; F83-H103 AromaticContact CD2-NE2 3.85Å; W92-H103 AromaticContact CH2-CD2 3.81Å; W92-H103 HydrophobicContact CZ3-CB 4.19Å; W92-H103 AromaticContact CZ3-CD2 3.28Å; W92-H103 WeakPolarHBondContact CZ3-CD2 3.31Å; Q99-H103 PolarHBondContact O-N 2.96Å; Q99-H103 VanDerWaalsContact O-N 3.14Å; H100-H103 PolarHBondContact O-N 3.33Å; R101-H103 VanDerWaalsContact C-N 3.32Å; R101-H103 PolarHBondContact O-N 3.31Å; H103-M105 VanDerWaalsContact C-N 3.27Å; H103-M105 PolarHBondContact O-N 3.31Å; H103-R106 PolarHBondContact O-N 2.98Å; H103-R106 VanDerWaalsContact O-N 3.14Å; H103-L107 PolarHBondContact O-N 3.27Å
104	A	96.8	Very high	93.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.7	-37.1	174.7	0	0	0	0	0	112.3	H100 R101 L107 L108 M129 L153 V157	H100-A104 PolarHBondContact O-N 2.75Å; R101-A104 PolarHBondContact O-N 2.93Å; A104-L107 PolarHBondContact O-N 3.05Å; A104-L108 PolarHBondContact O-N 3.11Å; A104-M129 HydrophobicContact CB-CE 4.21Å; A104-L153 HydrophobicContact CB-CD2 4.03Å; A104-L153 HydrophobicContact CB-CG 4.01Å; A104-V157 HydrophobicContact CB-CG1 4.11Å; A104-V157 HydrophobicContact CB-CG2 4.17Å
105	M	96.3	Very high	93	Very high	86 Å²	86	55.7 Å²	55.7	42%	0.424	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-46.1	171.7	-70	178.4	67.7	0	0	112.3	R101 H103 L107 L108 D109 V157	R101-M105 HydrophobicContact CG-CG 4.44Å; R101-M105 HydrophobicContact CG-SD 4.16Å; R101-M105 WeakPolarHBondContact O-CG 3.46Å; R101-M105 PolarHBondContact O-N 3.31Å; H103-M105 VanDerWaalsContact C-N 3.27Å; H103-M105 PolarHBondContact O-N 3.31Å; M105-L107 VanDerWaalsContact C-N 3.27Å; M105-L107 PolarHBondContact O-N 3.43Å; M105-L108 WeakPolarHBondContact O-CA 3.27Å; M105-L108 WeakPolarHBondContact O-CB 3.29Å; M105-L108 PolarHBondContact O-N 3.21Å; M105-D109 VanDerWaalsContact O-CG 3.24Å; M105-D109 PolarHBondContact O-N 3.24Å; M105-V157 HydrophobicContact CG-CB 4.13Å; M105-V157 HydrophobicContact CG-CG1 3.72Å
106	R	94.7	Very high	92.8	Very high	74 Å²	74	60.8 Å²	60.8	28%	0.279	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-36.5	174.7	-75.6	-167.4	-56.3	-84.3	4.7	113.3	E82 H86 A102 H103 L108 G110	E82-R106 IonicContact OE1-NE 3.51Å; H86-R106 PolarHBondContact ND1-NE 2.89Å; A102-R106 WeakPolarHBondContact O-CG 3.15Å; A102-R106 PolarHBondContact O-N 3.28Å; A102-R106 PolarHBondContact O-NH1 3.28Å; H103-R106 PolarHBondContact O-N 2.98Å; H103-R106 VanDerWaalsContact O-N 3.14Å; R106-L108 VanDerWaalsContact C-N 3.34Å; R106-G110 PolarHBondContact O-N 3.49Å
107	L	95.6	Very high	92.7	Very high	1 Å²	1	63 Å²	63	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-67.5	-34.9	173.7	-71.2	177.5	0	0	0	111.7	E82 H103 A104 M105 G110 L111 V122 A125 I126 M129	E82-L107 HydrophobicContact CG-CD2 4.39Å; E82-L107 WeakPolarHBondContact OE2-CD2 3.48Å; H103-L107 PolarHBondContact O-N 3.27Å; A104-L107 PolarHBondContact O-N 3.05Å; M105-L107 VanDerWaalsContact C-N 3.27Å; M105-L107 PolarHBondContact O-N 3.43Å; L107-G110 PolarHBondContact O-N 3.35Å; L107-L111 PolarHBondContact O-N 3.06Å; L107-V122 HydrophobicContact CB-CG1 4.47Å; L107-V122 HydrophobicContact CD2-CG1 4.2Å; L107-V122 WeakPolarHBondContact O-CG1 3.43Å; L107-A125 HydrophobicContact CD2-CB 3.86Å; L107-I126 HydrophobicContact CB-CD1 4.1Å; L107-I126 HydrophobicContact CB-CG1 3.81Å; L107-I126 HydrophobicContact CD1-CG1 4.09Å; L107-I126 HydrophobicContact CG-CG1 4.42Å; L107-M129 HydrophobicContact CD1-SD 4.3Å
108	L	95.6	Very high	92.6	Very high	29 Å²	29	66.9 Å²	66.9	15%	0.152	34%	0.344	C	S	.	.	H	α-helix	trans	-67.5	-48.5	173.2	-176.3	55.4	0	0	0	111.8	A104 M105 R106 G110 L111 V157 A162	A104-L108 PolarHBondContact O-N 3.11Å; M105-L108 WeakPolarHBondContact O-CA 3.27Å; M105-L108 WeakPolarHBondContact O-CB 3.29Å; M105-L108 PolarHBondContact O-N 3.21Å; R106-L108 VanDerWaalsContact C-N 3.34Å; L108-G110 PolarHBondContact O-N 3.39Å; L108-L111 HydrophobicContact CD1-CD1 4.23Å; L108-L111 WeakPolarHBondContact O-CB 3.29Å; L108-L111 PolarHBondContact O-N 2.72Å; L108-V157 HydrophobicContact CD2-CG2 4.43Å; L108-V157 WeakPolarHBondContact CD2-O 3.44Å; L108-A162 HydrophobicContact CD1-CB 3.65Å
109	D	93.9	Very high	92.5	Very high	99 Å²	99	65.6 Å²	65.6	53%	0.529	32%	0.324	S	S	.	.	H	α-helix	trans	-54.5	-37.1	173.5	-54.2	-26.6	0	0	0	111	M105 L111 E112	M105-D109 VanDerWaalsContact O-CG 3.24Å; M105-D109 PolarHBondContact O-N 3.24Å; D109-L111 VanDerWaalsContact C-N 3.27Å; D109-L111 PolarHBondContact O-N 3.32Å; D109-E112 PolarHBondContact O-N 3.32Å
110	G	92.5	Very high	92.5	Very high	14 Å²	14	63.6 Å²	63.6	14%	0.144	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.4	176.5	0	0	0	0	0	115.2	R106 L107 L108 V113	R106-G110 PolarHBondContact O-N 3.49Å; L107-G110 PolarHBondContact O-N 3.35Å; L108-G110 PolarHBondContact O-N 3.39Å; G110-V113 WeakPolarHBondContact O-CB 3.3Å; G110-V113 WeakPolarHBondContact O-CG2 3.46Å
111	L	92.8	Very high	92.5	Very high	4 Å²	4	67.2 Å²	67.2	2%	0.021	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-27.2	174.6	-72.2	-178.2	0	0	0	112.7	L107 L108 D109 V113 R119 V122 A123 I126 T159 A162 L166	L107-L111 PolarHBondContact O-N 3.06Å; L108-L111 HydrophobicContact CD1-CD1 4.23Å; L108-L111 WeakPolarHBondContact O-CB 3.29Å; L108-L111 PolarHBondContact O-N 2.72Å; D109-L111 VanDerWaalsContact C-N 3.27Å; D109-L111 PolarHBondContact O-N 3.32Å; L111-V113 PolarHBondContact O-N 3.23Å; L111-R119 HydrophobicContact CD2-CG 4.25Å; L111-R119 WeakPolarHBondContact O-CD 3.2Å; L111-R119 VanDerWaalsContact O-CG 3.3Å; L111-R119 WeakPolarHBondContact O-CG 3.47Å; L111-R119 PolarHBondContact O-NE 3.02Å; L111-R119 VanDerWaalsContact O-NE 3.11Å; L111-V122 HydrophobicContact CD2-CB 4.39Å; L111-V122 HydrophobicContact CD2-CG1 3.97Å; L111-V122 HydrophobicContact CG-CG1 4.15Å; L111-A123 HydrophobicContact CD2-CB 4.03Å; L111-I126 HydrophobicContact CD1-CD1 3.62Å; L111-I126 HydrophobicContact CD2-CD1 4.02Å; L111-I126 HydrophobicContact CG-CD1 3.76Å; L111-T159 HydrophobicContact CD1-CG2 4.34Å; L111-A162 HydrophobicContact CD1-CB 4.32Å; L111-L166 HydrophobicContact CB-CD1 4.16Å; L111-L166 HydrophobicContact CD1-CD1 4.2Å; L111-L166 HydrophobicContact CD2-CD1 4Å; L111-L166 HydrophobicContact CG-CD1 4.36Å
112	E	86.1	Confident	92.5	Very high	157 Å²	157	64.2 Å²	64.2	73%	0.734	32%	0.322	S	S	*	.	S	Bend	trans	-72	-11.2	178.7	-56.8	-168.1	166.8	0	0	112.7	D109 I114	D109-E112 PolarHBondContact O-N 3.32Å; E112-I114 PolarHBondContact O-N 3.11Å
113	V	83.4	Confident	92.6	Very high	53 Å²	53	62.3 Å²	62.3	32%	0.321	31%	0.306	S	S	.	.			trans	-59.5	126.7	-176.8	175.8	0	0	0	0	111.8	G110 L111 G115 K118 R119	G110-V113 WeakPolarHBondContact O-CB 3.3Å; G110-V113 WeakPolarHBondContact O-CG2 3.46Å; L111-V113 PolarHBondContact O-N 3.23Å; V113-G115 VanDerWaalsContact C-N 3.28Å; V113-G115 PolarHBondContact O-N 3.38Å; V113-K118 HydrophobicContact CG1-CB 3.91Å; V113-K118 HydrophobicContact CG1-CD 4.01Å; V113-R119 PolarHBondContact O-NE 3.06Å; V113-R119 PolarHBondContact O-NH2 3.15Å
114	I	76.9	Confident	92.7	Very high	164 Å²	164	63 Å²	63	84%	0.841	31%	0.309	S	S	*	.	S	Bend	trans	-57.8	-34.6	-175.7	-58.7	173.2	0	0	0	112.9	E112 R116	E112-I114 PolarHBondContact O-N 3.11Å; I114-R116 PolarHBondContact O-N 3.15Å
115	G	88.8	Confident	92.8	Very high	36 Å²	36	63 Å²	63	37%	0.371	31%	0.309	S	S	.	.			trans	-80.1	111.7	-176.6	0	0	0	0	0	113.8	V113 E117 K118 R119	V113-G115 VanDerWaalsContact C-N 3.28Å; V113-G115 PolarHBondContact O-N 3.38Å; G115-E117 VanDerWaalsContact C-N 3.32Å; G115-E117 PolarHBondContact O-N 3.29Å; G115-E117 VanDerWaalsContact O-N 3.17Å; G115-K118 WeakPolarHBondContact O-CB 3.43Å; G115-K118 PolarHBondContact O-N 3.39Å; G115-R119 PolarHBondContact O-N 3.1Å
116	R	89.7	Confident	92.8	Very high	117 Å²	117	59 Å²	59	44%	0.442	29%	0.289	S	S	.	.	H	α-helix	trans	-45	-48	-179.6	-176.3	-179.4	-179.7	160.5	5	114.2	I114 K118 R119 L120 E170 D193	I114-R116 PolarHBondContact O-N 3.15Å; R116-K118 VanDerWaalsContact C-N 3.34Å; R116-K118 PolarHBondContact O-N 3.01Å; R116-R119 PolarHBondContact O-N 3.4Å; R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 PolarHBondContact O-N 3.13Å; R116-E170 IonicContact CZ-OE1 2.63Å; R116-E170 IonicContact NH1-OE1 2.65Å; R116-E170 IonicContact NH2-OE1 2.91Å; R116-E170 PolarHBondContact NH2-OE1 2.99Å; R116-D193 IonicContact CZ-OD1 3.6Å; R116-D193 IonicContact CZ-OD2 2.9Å; R116-D193 IonicContact NE-OD1 3.25Å; R116-D193 PolarHBondContact NE-OD1 3.39Å; R116-D193 IonicContact NE-OD2 3.13Å; R116-D193 PolarHBondContact NE-OD2 2.63Å; R116-D193 IonicContact NH2-OD1 3.21Å; R116-D193 PolarHBondContact NH2-OD1 2.81Å; R116-D193 IonicContact NH2-OD2 2.76Å; R116-D193 PolarHBondContact NH2-OD2 2.75Å
117	E	92.1	Very high	93	Very high	129 Å²	129	55.5 Å²	55.5	60%	0.603	28%	0.276	S	S	*	.	H	α-helix	trans	-62.2	-39.8	-178.1	-165.4	-152	137.7	0	0	112.5	G115 K121	G115-E117 VanDerWaalsContact C-N 3.32Å; G115-E117 PolarHBondContact O-N 3.29Å; G115-E117 VanDerWaalsContact O-N 3.17Å; E117-K121 WeakPolarHBondContact O-CG 3.3Å; E117-K121 PolarHBondContact O-N 3.4Å; E117-K121 VanDerWaalsContact O-N 3.15Å; E117-K121 WeakPolarHBondContact OE1-CE 3.48Å; E117-K121 IonicContact OE1-NZ 2.75Å; E117-K121 PolarHBondContact OE1-NZ 3.06Å
118	K	92.4	Very high	93.2	Very high	144 Å²	144	55.7 Å²	55.7	63%	0.626	28%	0.277	S	S	*	.	H	α-helix	trans	-66.9	-46.2	175.1	-67.5	-171.9	175.5	-172.2	0	110.5	V113 G115 R116 L120 K121 V122	V113-K118 HydrophobicContact CG1-CB 3.91Å; V113-K118 HydrophobicContact CG1-CD 4.01Å; G115-K118 WeakPolarHBondContact O-CB 3.43Å; G115-K118 PolarHBondContact O-N 3.39Å; R116-K118 VanDerWaalsContact C-N 3.34Å; R116-K118 PolarHBondContact O-N 3.01Å; K118-L120 VanDerWaalsContact C-N 3.31Å; K118-L120 PolarHBondContact O-N 3.17Å; K118-K121 PolarHBondContact O-N 2.98Å; K118-K121 VanDerWaalsContact O-N 3.15Å; K118-V122 WeakPolarHBondContact O-CG2 3.35Å; K118-V122 PolarHBondContact O-N 3.34Å
119	R	95.1	Very high	93.3	Very high	45 Å²	45	54.3 Å²	54.3	17%	0.17	27%	0.27	C	S	.	.	H	α-helix	trans	-58.4	-41.8	177.6	-163.2	-177.9	-54.6	173.8	3.4	112.1	L111 V113 G115 R116 V122 A123 M169	L111-R119 HydrophobicContact CD2-CG 4.25Å; L111-R119 WeakPolarHBondContact O-CD 3.2Å; L111-R119 VanDerWaalsContact O-CG 3.3Å; L111-R119 WeakPolarHBondContact O-CG 3.47Å; L111-R119 PolarHBondContact O-NE 3.02Å; L111-R119 VanDerWaalsContact O-NE 3.11Å; V113-R119 PolarHBondContact O-NE 3.06Å; V113-R119 PolarHBondContact O-NH2 3.15Å; G115-R119 PolarHBondContact O-N 3.1Å; R116-R119 PolarHBondContact O-N 3.4Å; R119-V122 PolarHBondContact O-N 3.25Å; R119-A123 WeakPolarHBondContact O-CB 3.48Å; R119-A123 PolarHBondContact O-N 2.89Å; R119-M169 PolarHBondContact NH1-SD 2.78Å
120	L	95.3	Very high	93.5	Very high	35 Å²	35	49.6 Å²	49.6	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-66.1	-38.1	176.8	-178.3	59.1	0	0	0	112.2	R116 K118 A123 R124 T192 D193 V196	R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 PolarHBondContact O-N 3.13Å; K118-L120 VanDerWaalsContact C-N 3.31Å; K118-L120 PolarHBondContact O-N 3.17Å; L120-A123 PolarHBondContact O-N 2.77Å; L120-R124 WeakPolarHBondContact O-CB 3.37Å; L120-R124 WeakPolarHBondContact O-CG 3.41Å; L120-R124 PolarHBondContact O-N 3.39Å; L120-T192 HydrophobicContact CD1-CG2 4.35Å; L120-T192 HydrophobicContact CD2-CG2 4.11Å; L120-D193 HydrophobicContact CD1-CB 4.47Å; L120-V196 HydrophobicContact CD1-CB 4.42Å; L120-V196 HydrophobicContact CD1-CG2 4.13Å
121	K	96.1	Very high	93.7	Very high	90 Å²	90	49 Å²	49	39%	0.391	24%	0.238	S	C	.	.	H	α-helix	trans	-63.3	-43	173	-71.8	174.5	-175.8	173.7	0	111.7	C78 E117 K118 R124 A125	C78-K121 WeakPolarHBondContact CB-O 3.44Å; E117-K121 WeakPolarHBondContact O-CG 3.3Å; E117-K121 PolarHBondContact O-N 3.4Å; E117-K121 VanDerWaalsContact O-N 3.15Å; E117-K121 WeakPolarHBondContact OE1-CE 3.48Å; E117-K121 IonicContact OE1-NZ 2.75Å; E117-K121 PolarHBondContact OE1-NZ 3.06Å; K118-K121 PolarHBondContact O-N 2.98Å; K118-K121 VanDerWaalsContact O-N 3.15Å; K121-R124 WeakPolarHBondContact O-CB 3.33Å; K121-R124 PolarHBondContact O-N 2.97Å; K121-A125 PolarHBondContact O-N 3.31Å
122	V	96.9	Very high	93.9	Very high	25 Å²	25	48.8 Å²	48.8	15%	0.152	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-45.1	175.5	175.9	0	0	0	0	111.4	L107 L111 K118 R119 R124 A125 I126	L107-V122 HydrophobicContact CB-CG1 4.47Å; L107-V122 HydrophobicContact CD2-CG1 4.2Å; L107-V122 WeakPolarHBondContact O-CG1 3.43Å; L111-V122 HydrophobicContact CD2-CB 4.39Å; L111-V122 HydrophobicContact CD2-CG1 3.97Å; L111-V122 HydrophobicContact CG-CG1 4.15Å; K118-V122 WeakPolarHBondContact O-CG2 3.35Å; K118-V122 PolarHBondContact O-N 3.34Å; R119-V122 PolarHBondContact O-N 3.25Å; V122-R124 VanDerWaalsContact C-N 3.27Å; V122-R124 PolarHBondContact O-N 3.13Å; V122-A125 WeakPolarHBondContact O-CB 3.38Å; V122-A125 PolarHBondContact O-N 3.15Å; V122-I126 HydrophobicContact CG1-CD1 4.16Å; V122-I126 WeakPolarHBondContact O-CG1 3.31Å; V122-I126 PolarHBondContact O-N 2.99Å
123	A	97.8	Very high	94.3	Very high	5 Å²	5	41.3 Å²	41.3	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-36.2	174.8	0	0	0	0	0	112.2	L111 R119 L120 I126 L127 V196	L111-A123 HydrophobicContact CD2-CB 4.03Å; R119-A123 WeakPolarHBondContact O-CB 3.48Å; R119-A123 PolarHBondContact O-N 2.89Å; L120-A123 PolarHBondContact O-N 2.77Å; A123-I126 PolarHBondContact O-N 3.46Å; A123-L127 WeakPolarHBondContact O-CB 3.41Å; A123-L127 PolarHBondContact O-N 3.14Å; A123-V196 HydrophobicContact CB-CG1 3.73Å
124	R	98.1	Very high	94.9	Very high	16 Å²	16	39.4 Å²	39.4	6%	0.06	19%	0.189	C	C	.	.	H	α-helix	trans	-67.1	-36.2	172	-78.7	-169.8	179.7	-76.8	1.2	113.4	E71 N75 C78 L120 K121 V122 L127 Y128 V196	E71-R124 IonicContact OE2-CZ 3.64Å; E71-R124 IonicContact OE2-NH1 2.72Å; E71-R124 PolarHBondContact OE2-NH1 3.37Å; E71-R124 IonicContact OE2-NH2 2.63Å; E71-R124 PolarHBondContact OE2-NH2 3.49Å; N75-R124 WeakPolarHBondContact CB-O 3.46Å; N75-R124 WeakPolarHBondContact OD1-CG 3.5Å; N75-R124 PolarHBondContact OD1-NH1 2.87Å; C78-R124 HydrophobicContact CB-CB 4.03Å; L120-R124 WeakPolarHBondContact O-CB 3.37Å; L120-R124 WeakPolarHBondContact O-CG 3.41Å; L120-R124 PolarHBondContact O-N 3.39Å; K121-R124 WeakPolarHBondContact O-CB 3.33Å; K121-R124 PolarHBondContact O-N 2.97Å; V122-R124 VanDerWaalsContact C-N 3.27Å; V122-R124 PolarHBondContact O-N 3.13Å; R124-L127 PolarHBondContact O-N 3.33Å; R124-Y128 PolarHBondContact O-N 3.43Å; R124-V196 HydrophobicContact CG-CG1 4.39Å; R124-V196 HydrophobicContact CG-CG2 4.02Å
125	A	97.9	Very high	95.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-44.3	172.8	0	0	0	0	0	111.7	F79 L107 K121 V122 L127 Y128 M129	F79-A125 HydrophobicContact CB-CB 4.03Å; F79-A125 HydrophobicContact CD2-CB 4.34Å; L107-A125 HydrophobicContact CD2-CB 3.86Å; K121-A125 PolarHBondContact O-N 3.31Å; V122-A125 WeakPolarHBondContact O-CB 3.38Å; V122-A125 PolarHBondContact O-N 3.15Å; A125-L127 VanDerWaalsContact C-N 3.32Å; A125-L127 PolarHBondContact O-N 3.5Å; A125-Y128 WeakPolarHBondContact O-CB 3.25Å; A125-Y128 PolarHBondContact O-N 3.4Å; A125-M129 PolarHBondContact O-N 3.34Å
126	I	98.3	Very high	95.8	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-60.5	-41.6	173	-67	170.1	0	0	0	110.7	L107 L111 V122 A123 Y128 M129 A130 L154 T159 I200	L107-I126 HydrophobicContact CB-CD1 4.1Å; L107-I126 HydrophobicContact CB-CG1 3.81Å; L107-I126 HydrophobicContact CD1-CG1 4.09Å; L107-I126 HydrophobicContact CG-CG1 4.42Å; L111-I126 HydrophobicContact CD1-CD1 3.62Å; L111-I126 HydrophobicContact CD2-CD1 4.02Å; L111-I126 HydrophobicContact CG-CD1 3.76Å; V122-I126 HydrophobicContact CG1-CD1 4.16Å; V122-I126 WeakPolarHBondContact O-CG1 3.31Å; V122-I126 PolarHBondContact O-N 2.99Å; A123-I126 PolarHBondContact O-N 3.46Å; I126-Y128 PolarHBondContact O-N 3.47Å; I126-M129 PolarHBondContact O-N 3.36Å; I126-A130 WeakPolarHBondContact O-CB 3.39Å; I126-A130 PolarHBondContact O-N 3.31Å; I126-L154 HydrophobicContact CG2-CD1 4.03Å; I126-L154 HydrophobicContact CG2-CD2 3.94Å; I126-T159 HydrophobicContact CD1-CG2 4.28Å; I126-T159 HydrophobicContact CG2-CG2 4.26Å; I126-I200 HydrophobicContact CB-CD1 4.33Å; I126-I200 HydrophobicContact CG2-CD1 3.92Å; I126-I200 HydrophobicContact CG2-CG1 4.37Å; I126-I200 HydrophobicContact CG2-CG2 4.06Å
127	L	98.5	Very high	96	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-39.3	175	179.1	56.3	0	0	0	112.3	N75 A123 R124 A125 M129 A130 Q131 V196 N199 I200 L203	N75-L127 VanDerWaalsContact ND2-CD2 3.35Å; N75-L127 WeakPolarHBondContact ND2-CD2 3.17Å; A123-L127 WeakPolarHBondContact O-CB 3.41Å; A123-L127 PolarHBondContact O-N 3.14Å; R124-L127 PolarHBondContact O-N 3.33Å; A125-L127 VanDerWaalsContact C-N 3.32Å; A125-L127 PolarHBondContact O-N 3.5Å; L127-M129 VanDerWaalsContact C-N 3.34Å; L127-A130 PolarHBondContact O-N 2.9Å; L127-Q131 HydrophobicContact CD1-CG 4.08Å; L127-Q131 HydrophobicContact CG-CG 4.41Å; L127-Q131 VanDerWaalsContact O-CB 3.28Å; L127-Q131 WeakPolarHBondContact O-CB 3.42Å; L127-Q131 WeakPolarHBondContact O-CG 3.35Å; L127-Q131 PolarHBondContact O-N 3.06Å; L127-V196 HydrophobicContact CB-CG1 4.29Å; L127-V196 HydrophobicContact CD2-CB 4.4Å; L127-V196 HydrophobicContact CD2-CG1 4.1Å; L127-V196 HydrophobicContact CD2-CG2 4.29Å; L127-N199 HydrophobicContact CD1-CB 3.72Å; L127-N199 HydrophobicContact CD2-CB 4.1Å; L127-I200 HydrophobicContact CB-CD1 4.19Å; L127-I200 HydrophobicContact CB-CG1 3.76Å; L127-I200 HydrophobicContact CD1-CG1 3.91Å; L127-I200 HydrophobicContact CG-CG1 4.36Å; L127-L203 HydrophobicContact CD1-CD1 3.84Å
128	Y	98.4	Very high	96	Very high	6 Å²	6	27 Å²	27	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-62.6	-40.7	172.5	176.5	-101.9	0	0	0	112.4	R76 F79 R124 A125 I126 Q131 A133 F134 A135	R76-Y128 VanDerWaalsContact CA-CD2 3.46Å; R76-Y128 HydrophobicContact CB-CD2 3.66Å; R76-Y128 HydrophobicContact CB-CE2 3.58Å; R76-Y128 HydrophobicContact CB-CG 4.4Å; R76-Y128 HydrophobicContact CG-CD2 4.28Å; R76-Y128 HydrophobicContact CG-CE2 3.74Å; F79-Y128 HydrophobicContact CB-CD1 3.5Å; F79-Y128 VanDerWaalsContact CB-CD1 3.5Å; F79-Y128 HydrophobicContact CB-CE1 4.24Å; F79-Y128 HydrophobicContact CB-CG 4.04Å; F79-Y128 AromaticContact CD1-CD1 3.65Å; F79-Y128 HydrophobicContact CD1-CD1 3.65Å; F79-Y128 AromaticContact CD1-CE1 3.64Å; F79-Y128 HydrophobicContact CD1-CE1 3.64Å; F79-Y128 AromaticContact CD2-CD1 3.77Å; F79-Y128 HydrophobicContact CD2-CD1 3.77Å; F79-Y128 HydrophobicContact CD2-CE1 4.48Å; F79-Y128 HydrophobicContact CE1-CD1 4.28Å; F79-Y128 HydrophobicContact CE1-CE1 4.06Å; F79-Y128 HydrophobicContact CE2-CD1 4.36Å; F79-Y128 AromaticContact CG-CD1 3.36Å; F79-Y128 HydrophobicContact CG-CD1 3.36Å; F79-Y128 AromaticContact CG-CE1 3.89Å; F79-Y128 HydrophobicContact CG-CE1 3.89Å; F79-Y128 HydrophobicContact CG-CG 4.34Å; R124-Y128 PolarHBondContact O-N 3.43Å; A125-Y128 WeakPolarHBondContact O-CB 3.25Å; A125-Y128 PolarHBondContact O-N 3.4Å; I126-Y128 PolarHBondContact O-N 3.47Å; Y128-Q131 CarbonylContact O-C 3.54Å; Y128-Q131 WeakPolarHBondContact O-CB 3.4Å; Y128-Q131 PolarHBondContact O-N 2.84Å; Y128-A133 HydrophobicContact CE1-CB 3.98Å; Y128-A133 PolarHBondContact O-N 3.38Å; Y128-A133 PolarHBondContact OH-O 2.87Å; Y128-F134 HydrophobicContact CD2-CD1 4.15Å; Y128-F134 AromaticContact CD2-CE1 3.55Å; Y128-F134 HydrophobicContact CD2-CE1 3.55Å; Y128-F134 AromaticContact CD2-CZ 3.79Å; Y128-F134 HydrophobicContact CD2-CZ 3.79Å; Y128-F134 AromaticContact CE2-CD1 3.86Å; Y128-F134 HydrophobicContact CE2-CD1 3.86Å; Y128-F134 HydrophobicContact CE2-CD2 4.21Å; Y128-F134 AromaticContact CE2-CE1 3.55Å; Y128-F134 HydrophobicContact CE2-CE1 3.55Å; Y128-F134 AromaticContact CE2-CE2 3.92Å; Y128-F134 HydrophobicContact CE2-CE2 3.92Å; Y128-F134 HydrophobicContact CE2-CG 4.18Å; Y128-F134 AromaticContact CE2-CZ 3.58Å; Y128-F134 HydrophobicContact CE2-CZ 3.58Å; Y128-A135 WeakPolarHBondContact OH-CB 3.42Å; Y128-A135 PolarHBondContact OH-N 3.5Å; Y128-A135 VanDerWaalsContact OH-N 3.1Å
129	M	97.6	Very high	96.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65	-44.5	176.5	-150.6	-178.3	83.6	0	0	110.9	F79 W92 A104 L107 A125 I126 L127 Q131 G132 N150 L153 L154	F79-M129 HydrophobicContact CD2-CB 4.48Å; F79-M129 HydrophobicContact CE2-CB 4.15Å; F79-M129 HydrophobicContact CE2-CG 4.03Å; F79-M129 HydrophobicContact CE2-SD 4.28Å; W92-M129 HydrophobicContact CH2-CG 4.44Å; W92-M129 HydrophobicContact CH2-SD 3.56Å; W92-M129 VanDerWaalsContact CH2-SD 3.56Å; W92-M129 HydrophobicContact CZ2-CE 4.42Å; W92-M129 HydrophobicContact CZ2-CG 3.97Å; W92-M129 HydrophobicContact CZ2-SD 3.58Å; W92-M129 VanDerWaalsContact CZ2-SD 3.58Å; W92-M129 HydrophobicContact CZ3-SD 4.36Å; A104-M129 HydrophobicContact CB-CE 4.21Å; L107-M129 HydrophobicContact CD1-SD 4.3Å; A125-M129 PolarHBondContact O-N 3.34Å; I126-M129 PolarHBondContact O-N 3.36Å; L127-M129 VanDerWaalsContact C-N 3.34Å; M129-Q131 VanDerWaalsContact C-N 3.28Å; M129-Q131 PolarHBondContact O-N 2.71Å; M129-G132 PolarHBondContact O-N 3.1Å; M129-N150 HydrophobicContact CE-CB 4.32Å; M129-N150 HydrophobicContact CG-CB 4.15Å; M129-N150 VanDerWaalsContact O-CB 3.29Å; M129-N150 WeakPolarHBondContact O-CB 3.5Å; M129-N150 PolarHBondContact O-ND2 3.16Å; M129-L153 HydrophobicContact CE-CD2 4.17Å; M129-L154 HydrophobicContact CE-CD1 4.05Å; M129-L154 HydrophobicContact CE-CD2 3.55Å; M129-L154 HydrophobicContact CE-CG 3.53Å
130	A	98	Very high	96	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.7	-27	173.4	0	0	0	0	0	113.3	I126 L127 G132 M147 I151 L154 I200 L203	I126-A130 WeakPolarHBondContact O-CB 3.39Å; I126-A130 PolarHBondContact O-N 3.31Å; L127-A130 PolarHBondContact O-N 2.9Å; A130-G132 PolarHBondContact O-N 3.19Å; A130-M147 WeakPolarHBondContact O-CG 3.27Å; A130-I151 HydrophobicContact CB-CG1 4.48Å; A130-L154 HydrophobicContact CB-CD1 4.05Å; A130-I200 HydrophobicContact CB-CG2 4.28Å; A130-L203 HydrophobicContact CB-CD1 3.97Å
131	Q	97.6	Very high	96	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	8.3	169.9	-75.3	169.9	-26	0	0	113.1	Y64 F72 N75 L127 Y128 M129 F134 L203 F615	Y64-Q131 VanDerWaalsContact CZ-NE2 3.35Å; Y64-Q131 PolarHBondContact OH-NE2 3.43Å; F72-Q131 VanDerWaalsContact CE1-NE2 3.32Å; N75-Q131 PolarHBondContact ND2-OE1 2.92Å; N75-Q131 VanDerWaalsContact ND2-OE1 3.15Å; L127-Q131 HydrophobicContact CD1-CG 4.08Å; L127-Q131 HydrophobicContact CG-CG 4.41Å; L127-Q131 VanDerWaalsContact O-CB 3.28Å; L127-Q131 WeakPolarHBondContact O-CB 3.42Å; L127-Q131 WeakPolarHBondContact O-CG 3.35Å; L127-Q131 PolarHBondContact O-N 3.06Å; Y128-Q131 CarbonylContact O-C 3.54Å; Y128-Q131 WeakPolarHBondContact O-CB 3.4Å; Y128-Q131 PolarHBondContact O-N 2.84Å; M129-Q131 VanDerWaalsContact C-N 3.28Å; M129-Q131 PolarHBondContact O-N 2.71Å; Q131-F134 HydrophobicContact CB-CD1 4.03Å; Q131-F134 HydrophobicContact CB-CE1 4.09Å; Q131-L203 HydrophobicContact CG-CD1 4.09Å; Q131-F615 HydrophobicContact CB-CE2 4.41Å; Q131-F615 HydrophobicContact CB-CZ 3.99Å; Q131-F615 HydrophobicContact CG-CE2 4.43Å; Q131-F615 HydrophobicContact CG-CZ 4.1Å
132	G	96.1	Very high	95.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	17.9	174.2	0	0	0	0	0	115.1	M129 A130 F134 W146	M129-G132 PolarHBondContact O-N 3.1Å; A130-G132 PolarHBondContact O-N 3.19Å; G132-F134 PolarHBondContact O-N 3.3Å; G132-W146 VanDerWaalsContact O-CB 3.31Å; G132-W146 WeakPolarHBondContact O-CB 3.37Å
133	A	95.4	Very high	95.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.14	C	C	.	.			trans	51.1	40.3	179.4	0	0	0	0	0	113.7	W92 Y128 A135 D136	W92-A133 HydrophobicContact CB-CB 4.37Å; W92-A133 HydrophobicContact CG-CB 4.09Å; Y128-A133 HydrophobicContact CE1-CB 3.98Å; Y128-A133 PolarHBondContact O-N 3.38Å; Y128-A133 PolarHBondContact OH-O 2.87Å; A133-A135 PolarHBondContact O-N 3.03Å; A133-D136 PolarHBondContact O-N 2.8Å; A133-D136 VanDerWaalsContact O-N 3.1Å
134	F	95.4	Very high	95.7	Very high	13 Å²	13	26.7 Å²	26.7	6%	0.057	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-53.9	-21.6	-162.4	55.8	-101.3	0	0	0	117	F72 Y128 Q131 G132 D136 C137 V143 F615 V619	F72-F134 HydrophobicContact CB-CZ 3.96Å; Y128-F134 HydrophobicContact CD2-CD1 4.15Å; Y128-F134 AromaticContact CD2-CE1 3.55Å; Y128-F134 HydrophobicContact CD2-CE1 3.55Å; Y128-F134 AromaticContact CD2-CZ 3.79Å; Y128-F134 HydrophobicContact CD2-CZ 3.79Å; Y128-F134 AromaticContact CE2-CD1 3.86Å; Y128-F134 HydrophobicContact CE2-CD1 3.86Å; Y128-F134 HydrophobicContact CE2-CD2 4.21Å; Y128-F134 AromaticContact CE2-CE1 3.55Å; Y128-F134 HydrophobicContact CE2-CE1 3.55Å; Y128-F134 AromaticContact CE2-CE2 3.92Å; Y128-F134 HydrophobicContact CE2-CE2 3.92Å; Y128-F134 HydrophobicContact CE2-CG 4.18Å; Y128-F134 AromaticContact CE2-CZ 3.58Å; Y128-F134 HydrophobicContact CE2-CZ 3.58Å; Q131-F134 HydrophobicContact CB-CD1 4.03Å; Q131-F134 HydrophobicContact CB-CE1 4.09Å; G132-F134 PolarHBondContact O-N 3.3Å; F134-D136 PolarHBondContact O-N 2.84Å; F134-C137 WeakPolarHBondContact O-CB 3.06Å; F134-C137 PolarHBondContact O-N 3.4Å; F134-C137 VanDerWaalsContact O-N 3.09Å; F134-V143 HydrophobicContact CB-CG1 4.35Å; F134-V143 HydrophobicContact CB-CG2 3.9Å; F134-F615 HydrophobicContact CD1-CE2 4.27Å; F134-V619 HydrophobicContact CB-CG2 3.86Å; F134-V619 HydrophobicContact CD1-CB 4.47Å; F134-V619 HydrophobicContact CD1-CG2 4Å; F134-V619 HydrophobicContact CD2-CB 3.59Å; F134-V619 HydrophobicContact CD2-CG1 4.37Å; F134-V619 HydrophobicContact CD2-CG2 3.76Å; F134-V619 HydrophobicContact CE2-CB 3.77Å; F134-V619 HydrophobicContact CE2-CG1 4.1Å; F134-V619 HydrophobicContact CE2-CG2 4.3Å; F134-V619 HydrophobicContact CG-CB 3.98Å; F134-V619 HydrophobicContact CG-CG2 3.59Å; F134-V619 HydrophobicContact CZ-CB 4.29Å; F134-V619 HydrophobicContact CZ-CG1 4.2Å
135	A	93.3	Very high	95.6	Very high	32 Å²	32	32.6 Å²	32.6	26%	0.264	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-71.1	-15.1	178.9	0	0	0	0	0	114.5	Y128 A133	Y128-A135 WeakPolarHBondContact OH-CB 3.42Å; Y128-A135 PolarHBondContact OH-N 3.5Å; Y128-A135 VanDerWaalsContact OH-N 3.1Å; A133-A135 PolarHBondContact O-N 3.03Å
136	D	91.6	Very high	95.5	Very high	45 Å²	45	34.2 Å²	34.2	24%	0.241	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-94.1	-1.7	171.3	-76.4	-37.4	0	0	0	113	K91 W92 T93 A133 F134	K91-D136 WeakPolarHBondContact CB-OD2 2.79Å; K91-D136 WeakPolarHBondContact CD-OD1 3.3Å; K91-D136 WeakPolarHBondContact CE-OD1 3.39Å; K91-D136 VanDerWaalsContact CG-OD1 3.27Å; K91-D136 WeakPolarHBondContact CG-OD1 3.19Å; K91-D136 IonicContact NZ-OD1 2.72Å; K91-D136 PolarHBondContact NZ-OD1 3.39Å; W92-D136 PolarHBondContact N-OD2 3.25Å; W92-D136 VanDerWaalsContact N-OD2 3.08Å; T93-D136 HydrophobicContact CG2-CB 3.71Å; A133-D136 PolarHBondContact O-N 2.8Å; A133-D136 VanDerWaalsContact O-N 3.1Å; F134-D136 PolarHBondContact O-N 2.84Å
137	C	94	Very high	95.4	Very high	19 Å²	19	34.2 Å²	34.2	13%	0.128	19%	0.187	C	C	.	.			trans	-97.1	152	-179	-61.1	0	0	0	0	112.3	F134 E142 V143	F134-C137 WeakPolarHBondContact O-CB 3.06Å; F134-C137 PolarHBondContact O-N 3.4Å; F134-C137 VanDerWaalsContact O-N 3.09Å; C137-E142 HydrophobicContact CB-CB 3.9Å; C137-V143 HydrophobicContact CB-CG2 3.65Å
138	S	92.1	Very high	95.3	Very high	89 Å²	89	35.3 Å²	35.3	62%	0.622	19%	0.192	S	C	*	.	S	Bend	trans	-108.1	-16.1	177.4	72.2	0	0	0	0	114	E142	S138-E142 WeakPolarHBondContact CA-OE2 3.5Å; S138-E142 WeakPolarHBondContact CB-OE2 3.5Å; S138-E142 PolarHBondContact N-OE2 3.4Å; S138-E142 PolarHBondContact OG-OE2 2.89Å
139	C	94.1	Very high	95.2	Very high	48 Å²	48	36.6 Å²	36.6	32%	0.324	20%	0.197	S	C	.	.	S	Bend	trans	-149.4	161.9	178.9	66.5	0	0	0	0	112.5	A141 E142 V143	C139-A141 PolarHBondContact O-N 3.1Å; C139-E142 PolarHBondContact N-OE2 3.4Å; C139-E142 PolarHBondContact O-N 2.74Å; C139-E142 VanDerWaalsContact O-N 3.13Å; C139-V143 PolarHBondContact O-N 3.02Å
140	E	93.9	Very high	95.2	Very high	58 Å²	58	36.6 Å²	36.6	27%	0.271	20%	0.197	S	C	.	.	H	α-helix	trans	-58.1	-30.4	178.7	-60.5	-171.7	-145.6	0	0	113.5	V143 Q144 P616	E140-V143 WeakPolarHBondContact O-CB 3.25Å; E140-V143 PolarHBondContact O-N 3.2Å; E140-Q144 PolarHBondContact O-N 3.23Å; E140-P616 HydrophobicContact CB-CG 4.05Å; E140-P616 HydrophobicContact CG-CG 3.87Å; E140-P616 WeakPolarHBondContact OE2-CG 3.47Å
141	A	94.1	Very high	95.2	Very high	65 Å²	65	36.6 Å²	36.6	54%	0.537	20%	0.197	S	C	.	.	H	α-helix	trans	-69.4	-33.2	179.1	0	0	0	0	0	112.8	C139 Q144 Y145	C139-A141 PolarHBondContact O-N 3.1Å; A141-Q144 PolarHBondContact O-N 2.79Å; A141-Y145 WeakPolarHBondContact O-CB 3.4Å; A141-Y145 PolarHBondContact O-N 3.44Å
142	E	95.3	Very high	95.2	Very high	77 Å²	77	36.6 Å²	36.6	36%	0.36	20%	0.197	S	C	.	.	H	α-helix	trans	-70.4	-39.8	172	-73.4	171.6	149.7	0	0	110.9	C137 S138 C139 Q144 Y145 W146	C137-E142 HydrophobicContact CB-CB 3.9Å; S138-E142 WeakPolarHBondContact CA-OE2 3.5Å; S138-E142 WeakPolarHBondContact CB-OE2 3.5Å; S138-E142 PolarHBondContact N-OE2 3.4Å; S138-E142 PolarHBondContact OG-OE2 2.89Å; C139-E142 PolarHBondContact N-OE2 3.4Å; C139-E142 PolarHBondContact O-N 2.74Å; C139-E142 VanDerWaalsContact O-N 3.13Å; E142-Q144 VanDerWaalsContact C-N 3.31Å; E142-Q144 PolarHBondContact O-N 2.75Å; E142-Y145 PolarHBondContact O-N 3.22Å; E142-W146 WeakPolarHBondContact O-CB 3.32Å; E142-W146 VanDerWaalsContact O-CD1 3.28Å; E142-W146 PolarHBondContact O-N 3.28Å
143	V	96	Very high	95.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-42.4	172.3	-178.8	0	0	0	0	110.6	F134 C137 C139 E140 M147 P616 V620	F134-V143 HydrophobicContact CB-CG1 4.35Å; F134-V143 HydrophobicContact CB-CG2 3.9Å; C137-V143 HydrophobicContact CB-CG2 3.65Å; C139-V143 PolarHBondContact O-N 3.02Å; E140-V143 WeakPolarHBondContact O-CB 3.25Å; E140-V143 PolarHBondContact O-N 3.2Å; V143-M147 WeakPolarHBondContact O-CB 3.3Å; V143-M147 PolarHBondContact O-N 2.92Å; V143-P616 HydrophobicContact CG1-CB 4.09Å; V143-V620 HydrophobicContact CG2-CG2 3.66Å
144	Q	95.1	Very high	95.4	Very high	90 Å²	90	37.2 Å²	37.2	42%	0.421	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-44.9	176	-171.5	173.5	5.7	0	0	112.4	W56 E140 A141 E142 R148	W56-Q144 HydrophobicContact CD2-CG 4.01Å; W56-Q144 HydrophobicContact CE3-CB 4.44Å; W56-Q144 HydrophobicContact CE3-CG 4.32Å; W56-Q144 HydrophobicContact CH2-CB 3.51Å; W56-Q144 HydrophobicContact CH2-CG 4.04Å; W56-Q144 HydrophobicContact CZ2-CB 3.57Å; W56-Q144 HydrophobicContact CZ2-CG 3.68Å; W56-Q144 HydrophobicContact CZ3-CB 3.96Å; W56-Q144 HydrophobicContact CZ3-CG 4.33Å; E140-Q144 PolarHBondContact O-N 3.23Å; A141-Q144 PolarHBondContact O-N 2.79Å; E142-Q144 VanDerWaalsContact C-N 3.31Å; E142-Q144 PolarHBondContact O-N 2.75Å; Q144-R148 PolarHBondContact O-N 3.39Å
145	Y	94.6	Very high	95.5	Very high	140 Å²	140	37.8 Å²	37.8	55%	0.549	20%	0.204	S	C	.	.	H	α-helix	trans	-62.8	-52.1	177.5	172.5	-94.1	0	0	0	111.9	A141 E142 M147 R148 Y149	A141-Y145 WeakPolarHBondContact O-CB 3.4Å; A141-Y145 PolarHBondContact O-N 3.44Å; E142-Y145 PolarHBondContact O-N 3.22Å; Y145-M147 VanDerWaalsContact C-N 3.33Å; Y145-M147 PolarHBondContact O-N 3.5Å; Y145-R148 PolarHBondContact O-N 3.01Å; Y145-Y149 PolarHBondContact O-N 3.19Å
146	W	96.4	Very high	95.6	Very high	34 Å²	34	40 Å²	40	13%	0.129	21%	0.211	C	C	.	.	H	α-helix	trans	-67.8	-33	-179.6	-77.2	110.1	0	0	0	112.4	W92 T93 H100 G132 E142 Y149 N150	W92-W146 AromaticContact NE1-CE3 3.85Å; T93-W146 HydrophobicContact CG2-CD2 4.23Å; T93-W146 HydrophobicContact CG2-CH2 4.38Å; T93-W146 HydrophobicContact CG2-CZ2 3.65Å; H100-W146 AromaticContact CE1-CH2 3.55Å; H100-W146 AromaticContact CE1-CZ3 3.7Å; H100-W146 AromaticContact NE2-CH2 3.99Å; H100-W146 AromaticContact NE2-CZ3 3.87Å; G132-W146 VanDerWaalsContact O-CB 3.31Å; G132-W146 WeakPolarHBondContact O-CB 3.37Å; E142-W146 WeakPolarHBondContact O-CB 3.32Å; E142-W146 VanDerWaalsContact O-CD1 3.28Å; E142-W146 PolarHBondContact O-N 3.28Å; W146-Y149 AromaticContact CE3-CD1 3.76Å; W146-Y149 HydrophobicContact CE3-CD1 3.76Å; W146-Y149 HydrophobicContact CE3-CE1 4.41Å; W146-Y149 HydrophobicContact CE3-CG 4.44Å; W146-Y149 AromaticContact CZ3-CD1 3.63Å; W146-Y149 HydrophobicContact CZ3-CD1 3.63Å; W146-Y149 AromaticContact CZ3-CE1 3.85Å; W146-Y149 HydrophobicContact CZ3-CE1 3.85Å; W146-Y149 HydrophobicContact CZ3-CG 4.44Å; W146-Y149 PolarHBondContact O-N 3.24Å; W146-N150 WeakPolarHBondContact O-CB 3.27Å; W146-N150 PolarHBondContact O-N 3.01Å; W146-N150 PolarHBondContact O-ND2 2.96Å; W146-N150 PolarHBondContact O-OD1 3.03Å
147	M	96.5	Very high	95.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-50.1	169.5	175.2	173.4	-62.4	0	0	111.3	W56 L60 A130 V143 Y145 N150 I151 L203 T207 F615	W56-M147 HydrophobicContact CZ2-CE 4.31Å; W56-M147 HydrophobicContact CZ2-SD 3.88Å; L60-M147 HydrophobicContact CD1-CE 3.78Å; L60-M147 HydrophobicContact CD1-SD 3.68Å; L60-M147 HydrophobicContact CD2-SD 4.46Å; A130-M147 WeakPolarHBondContact O-CG 3.27Å; V143-M147 WeakPolarHBondContact O-CB 3.3Å; V143-M147 PolarHBondContact O-N 2.92Å; Y145-M147 VanDerWaalsContact C-N 3.33Å; Y145-M147 PolarHBondContact O-N 3.5Å; M147-N150 PolarHBondContact O-N 3.36Å; M147-I151 HydrophobicContact CG-CD1 3.59Å; M147-I151 VanDerWaalsContact O-CB 3.27Å; M147-I151 WeakPolarHBondContact O-CB 2.98Å; M147-I151 WeakPolarHBondContact O-CD1 3.27Å; M147-I151 VanDerWaalsContact O-CG1 3.27Å; M147-I151 WeakPolarHBondContact O-CG1 3.44Å; M147-I151 PolarHBondContact O-N 3.46Å; M147-L203 HydrophobicContact CE-CD2 4.07Å; M147-L203 HydrophobicContact SD-CD2 4.17Å; M147-T207 HydrophobicContact CG-CG2 4.39Å; M147-F615 HydrophobicContact CE-CE1 3.98Å; M147-F615 HydrophobicContact CE-CZ 4.29Å
148	R	96.1	Very high	95.9	Very high	24 Å²	24	39.5 Å²	39.5	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-48.8	178	-169.4	171.9	-160.9	75.3	-1.9	111.7	Q144 Y145 I151 F152 T207 Q210 D215 W219	Q144-R148 PolarHBondContact O-N 3.39Å; Y145-R148 PolarHBondContact O-N 3.01Å; R148-I151 PolarHBondContact O-N 3.25Å; R148-F152 HydrophobicContact CG-CD2 4.03Å; R148-F152 HydrophobicContact CG-CE2 3.94Å; R148-F152 WeakPolarHBondContact O-CD2 3.3Å; R148-F152 PolarHBondContact O-N 3.02Å; R148-F152 VanDerWaalsContact O-N 3.14Å; R148-T207 HydrophobicContact CB-CG2 4.09Å; R148-T207 HydrophobicContact CG-CG2 4.23Å; R148-T207 PolarHBondContact NH1-O 2.97Å; R148-Q210 PolarHBondContact NH2-O 3.07Å; R148-D215 IonicContact CZ-OD1 3.52Å; R148-D215 IonicContact CZ-OD2 3.28Å; R148-D215 IonicContact NE-OD1 3.43Å; R148-D215 PolarHBondContact NE-OD1 3.31Å; R148-D215 IonicContact NE-OD2 3.35Å; R148-D215 VanDerWaalsContact NH2-CG 3.32Å; R148-D215 IonicContact NH2-OD1 3.05Å; R148-D215 PolarHBondContact NH2-OD1 3.29Å; R148-D215 VanDerWaalsContact NH2-OD1 3.14Å; R148-D215 IonicContact NH2-OD2 3.9Å; R148-D215 PolarHBondContact NH2-OD2 3.1Å; R148-W219 HydrophobicContact CG-CZ3 4.07Å
149	Y	96.5	Very high	96.1	Very high	33 Å²	33	35.2 Å²	35.2	13%	0.129	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-50.8	178.4	177.6	-99.9	0	0	0	112.7	H100 Y145 W146 I151 F152 L153 W219	H100-Y149 HydrophobicContact CB-CE1 4.45Å; H100-Y149 AromaticContact CG-CE1 3.97Å; H100-Y149 AromaticContact ND1-CE1 3.49Å; H100-Y149 WeakPolarHBondContact ND1-CE1 3.43Å; H100-Y149 AromaticContact ND1-CZ 3.56Å; H100-Y149 PolarHBondContact ND1-OH 3.09Å; Y145-Y149 PolarHBondContact O-N 3.19Å; W146-Y149 AromaticContact CE3-CD1 3.76Å; W146-Y149 HydrophobicContact CE3-CD1 3.76Å; W146-Y149 HydrophobicContact CE3-CE1 4.41Å; W146-Y149 HydrophobicContact CE3-CG 4.44Å; W146-Y149 AromaticContact CZ3-CD1 3.63Å; W146-Y149 HydrophobicContact CZ3-CD1 3.63Å; W146-Y149 AromaticContact CZ3-CE1 3.85Å; W146-Y149 HydrophobicContact CZ3-CE1 3.85Å; W146-Y149 HydrophobicContact CZ3-CG 4.44Å; W146-Y149 PolarHBondContact O-N 3.24Å; Y149-I151 VanDerWaalsContact C-N 3.28Å; Y149-I151 PolarHBondContact O-N 2.98Å; Y149-F152 PolarHBondContact O-N 3.38Å; Y149-L153 WeakPolarHBondContact O-CB 3.05Å; Y149-L153 PolarHBondContact O-N 3.46Å; Y149-W219 HydrophobicContact CD2-CH2 4.19Å; Y149-W219 AromaticContact CD2-CZ2 3.99Å; Y149-W219 HydrophobicContact CD2-CZ2 3.99Å
150	N	97.7	Very high	96.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-32.5	-178.5	-67.6	-9.1	0	0	0	112	W92 M129 W146 M147 L153 L154	W92-N150 PolarHBondContact NE1-ND2 3.31Å; W92-N150 PolarHBondContact NE1-OD1 3.22Å; M129-N150 HydrophobicContact CE-CB 4.32Å; M129-N150 HydrophobicContact CG-CB 4.15Å; M129-N150 VanDerWaalsContact O-CB 3.29Å; M129-N150 WeakPolarHBondContact O-CB 3.5Å; M129-N150 PolarHBondContact O-ND2 3.16Å; W146-N150 WeakPolarHBondContact O-CB 3.27Å; W146-N150 PolarHBondContact O-N 3.01Å; W146-N150 PolarHBondContact O-ND2 2.96Å; W146-N150 PolarHBondContact O-OD1 3.03Å; M147-N150 PolarHBondContact O-N 3.36Å; N150-L153 WeakPolarHBondContact O-CB 3.37Å; N150-L153 PolarHBondContact O-N 2.97Å; N150-L154 VanDerWaalsContact O-CG 3.29Å; N150-L154 WeakPolarHBondContact O-CG 3.21Å; N150-L154 PolarHBondContact O-N 3.39Å
151	I	97.9	Very high	96.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-73.3	-42.4	178.3	-78	167.4	0	0	0	112.2	A130 M147 R148 Y149 L153 L154 L155 L203 M204 T207 I208	A130-I151 HydrophobicContact CB-CG1 4.48Å; M147-I151 HydrophobicContact CG-CD1 3.59Å; M147-I151 VanDerWaalsContact O-CB 3.27Å; M147-I151 WeakPolarHBondContact O-CB 2.98Å; M147-I151 WeakPolarHBondContact O-CD1 3.27Å; M147-I151 VanDerWaalsContact O-CG1 3.27Å; M147-I151 WeakPolarHBondContact O-CG1 3.44Å; M147-I151 PolarHBondContact O-N 3.46Å; R148-I151 PolarHBondContact O-N 3.25Å; Y149-I151 VanDerWaalsContact C-N 3.28Å; Y149-I151 PolarHBondContact O-N 2.98Å; I151-L153 VanDerWaalsContact C-N 3.28Å; I151-L153 PolarHBondContact O-N 3.3Å; I151-L154 PolarHBondContact O-N 2.98Å; I151-L155 PolarHBondContact O-N 3.37Å; I151-L203 HydrophobicContact CD1-CB 4.07Å; I151-L203 WeakPolarHBondContact CD1-O 3.27Å; I151-M204 HydrophobicContact CG1-CG 4.35Å; I151-M204 HydrophobicContact CG2-CB 4.24Å; I151-M204 HydrophobicContact CG2-CG 4.12Å; I151-T207 HydrophobicContact CD1-CG2 3.99Å; I151-T207 VanDerWaalsContact CD1-OG1 3.29Å; I151-T207 WeakPolarHBondContact CD1-OG1 3.4Å; I151-I208 HydrophobicContact CG2-CD1 3.73Å; I151-I208 HydrophobicContact CG2-CG1 3.72Å
152	F	97.4	Very high	96.1	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-63.4	-36.8	171.4	-82.5	-70.1	0	0	0	111.4	R148 Y149 L155 D156 I208 W219 M222	R148-F152 HydrophobicContact CG-CD2 4.03Å; R148-F152 HydrophobicContact CG-CE2 3.94Å; R148-F152 WeakPolarHBondContact O-CD2 3.3Å; R148-F152 PolarHBondContact O-N 3.02Å; R148-F152 VanDerWaalsContact O-N 3.14Å; Y149-F152 PolarHBondContact O-N 3.38Å; F152-L155 PolarHBondContact O-N 2.84Å; F152-D156 VanDerWaalsContact O-CB 3.24Å; F152-D156 WeakPolarHBondContact O-CB 3.29Å; F152-D156 PolarHBondContact O-N 3.25Å; F152-I208 HydrophobicContact CE1-CG1 4.26Å; F152-I208 HydrophobicContact CE1-CG2 4.42Å; F152-I208 HydrophobicContact CZ-CG1 4.27Å; F152-I208 HydrophobicContact CZ-CG2 4.44Å; F152-W219 HydrophobicContact CB-CD2 4.14Å; F152-W219 HydrophobicContact CB-CG 4.39Å; F152-W219 HydrophobicContact CB-CZ2 3.93Å; F152-W219 HydrophobicContact CD1-CB 4.03Å; F152-W219 AromaticContact CD1-CD1 3.88Å; F152-W219 HydrophobicContact CD1-CD2 4.2Å; F152-W219 AromaticContact CD1-CG 3.8Å; F152-W219 HydrophobicContact CD1-CG 3.8Å; F152-W219 HydrophobicContact CD2-CB 4.45Å; F152-W219 AromaticContact CD2-CD2 3.45Å; F152-W219 HydrophobicContact CD2-CD2 3.45Å; F152-W219 VanDerWaalsContact CD2-CD2 3.45Å; F152-W219 AromaticContact CD2-CE2 3.78Å; F152-W219 AromaticContact CD2-CE3 3.47Å; F152-W219 HydrophobicContact CD2-CE3 3.47Å; F152-W219 VanDerWaalsContact CD2-CE3 3.47Å; F152-W219 AromaticContact CD2-CG 3.93Å; F152-W219 HydrophobicContact CD2-CG 3.93Å; F152-W219 HydrophobicContact CD2-CH2 4.13Å; F152-W219 HydrophobicContact CD2-CZ2 4.11Å; F152-W219 AromaticContact CD2-CZ3 3.83Å; F152-W219 HydrophobicContact CD2-CZ3 3.83Å; F152-W219 HydrophobicContact CE1-CB 3.72Å; F152-W219 HydrophobicContact CE1-CG 4Å; F152-W219 WeakPolarHBondContact CE1-O 3.36Å; F152-W219 HydrophobicContact CE2-CB 4.16Å; F152-W219 AromaticContact CE2-CD2 3.83Å; F152-W219 HydrophobicContact CE2-CD2 3.83Å; F152-W219 AromaticContact CE2-CE3 3.6Å; F152-W219 HydrophobicContact CE2-CE3 3.6Å; F152-W219 HydrophobicContact CE2-CG 4.12Å; F152-W219 HydrophobicContact CE2-CZ3 4.2Å; F152-W219 HydrophobicContact CG-CB 4.4Å; F152-W219 AromaticContact CG-CD1 3.87Å; F152-W219 AromaticContact CG-CD2 3.67Å; F152-W219 HydrophobicContact CG-CD2 3.67Å; F152-W219 AromaticContact CG-CE2 3.72Å; F152-W219 HydrophobicContact CG-CE3 4.19Å; F152-W219 AromaticContact CG-CG 3.78Å; F152-W219 HydrophobicContact CG-CG 3.78Å; F152-W219 HydrophobicContact CG-CZ2 4.27Å; F152-W219 AromaticContact CG-NE1 3.85Å; F152-W219 HydrophobicContact CZ-CB 3.8Å; F152-W219 HydrophobicContact CZ-CD2 4.36Å; F152-W219 HydrophobicContact CZ-CE3 4.4Å; F152-W219 HydrophobicContact CZ-CG 4.16Å; F152-M222 HydrophobicContact CD1-CB 4.44Å; F152-M222 HydrophobicContact CD1-CE 4.5Å; F152-M222 HydrophobicContact CD1-SD 4.21Å; F152-M222 HydrophobicContact CE1-CB 4.38Å
153	L	97.8	Very high	96.2	Very high	13 Å²	13	27.1 Å²	27.1	7%	0.068	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-42.8	173.3	-176.6	65.9	0	0	0	113	W92 H100 R101 A104 M129 Y149 N150 I151 L155 D156 V157	W92-L153 HydrophobicContact CH2-CD2 4.21Å; W92-L153 HydrophobicContact CZ2-CD2 4.09Å; H100-L153 HydrophobicContact CB-CD2 3.77Å; R101-L153 HydrophobicContact CB-CD1 4.02Å; R101-L153 HydrophobicContact CG-CD1 4.41Å; A104-L153 HydrophobicContact CB-CD2 4.03Å; A104-L153 HydrophobicContact CB-CG 4.01Å; M129-L153 HydrophobicContact CE-CD2 4.17Å; Y149-L153 WeakPolarHBondContact O-CB 3.05Å; Y149-L153 PolarHBondContact O-N 3.46Å; N150-L153 WeakPolarHBondContact O-CB 3.37Å; N150-L153 PolarHBondContact O-N 2.97Å; I151-L153 VanDerWaalsContact C-N 3.28Å; I151-L153 PolarHBondContact O-N 3.3Å; L153-L155 VanDerWaalsContact C-N 3.31Å; L153-L155 PolarHBondContact O-N 2.9Å; L153-D156 PolarHBondContact O-N 2.82Å; L153-V157 PolarHBondContact O-N 3.46Å; L153-V157 VanDerWaalsContact O-N 3.11Å
154	L	98	Very high	96.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-34.1	175.7	-74.7	170.2	0	0	0	112.5	I126 M129 A130 N150 I151 G158 T159 M204	I126-L154 HydrophobicContact CG2-CD1 4.03Å; I126-L154 HydrophobicContact CG2-CD2 3.94Å; M129-L154 HydrophobicContact CE-CD1 4.05Å; M129-L154 HydrophobicContact CE-CD2 3.55Å; M129-L154 HydrophobicContact CE-CG 3.53Å; A130-L154 HydrophobicContact CB-CD1 4.05Å; N150-L154 VanDerWaalsContact O-CG 3.29Å; N150-L154 WeakPolarHBondContact O-CG 3.21Å; N150-L154 PolarHBondContact O-N 3.39Å; I151-L154 PolarHBondContact O-N 2.98Å; L154-G158 PolarHBondContact O-N 2.83Å; L154-T159 HydrophobicContact CD2-CG2 4.16Å; L154-T159 WeakPolarHBondContact CD2-OG1 3.26Å; L154-T159 VanDerWaalsContact O-CB 3.3Å; L154-T159 WeakPolarHBondContact O-CB 3.48Å; L154-T159 PolarHBondContact O-N 3.43Å; L154-T159 PolarHBondContact O-OG1 3.29Å; L154-M204 HydrophobicContact CB-CE 4.1Å; L154-M204 HydrophobicContact CB-SD 4.5Å
155	L	96.8	Very high	95.9	Very high	25 Å²	25	29.1 Å²	29.1	13%	0.131	15%	0.15	C	C	.	.	H	α-helix	trans	-69.2	-43.5	172.1	-175.8	65.5	0	0	0	111.4	I151 F152 L153 V157 G158 M204 I208 M222 F226	I151-L155 PolarHBondContact O-N 3.37Å; F152-L155 PolarHBondContact O-N 2.84Å; L153-L155 VanDerWaalsContact C-N 3.31Å; L153-L155 PolarHBondContact O-N 2.9Å; L155-V157 VanDerWaalsContact C-N 3.28Å; L155-V157 PolarHBondContact O-N 2.93Å; L155-G158 PolarHBondContact O-N 3.12Å; L155-M204 HydrophobicContact CB-CE 4.04Å; L155-M204 HydrophobicContact CD1-CE 4.46Å; L155-I208 HydrophobicContact CD2-CD1 3.91Å; L155-M222 HydrophobicContact CB-CE 4.03Å; L155-M222 HydrophobicContact CD2-CB 4.17Å; L155-M222 HydrophobicContact CD2-CE 3.91Å; L155-M222 HydrophobicContact CG-CE 3.89Å; L155-F226 HydrophobicContact CD1-CB 4.28Å; L155-F226 HydrophobicContact CD1-CD2 3.67Å; L155-F226 HydrophobicContact CD1-CE2 4.15Å; L155-F226 HydrophobicContact CD1-CG 4Å; L155-F226 HydrophobicContact CD2-CB 3.89Å; L155-F226 HydrophobicContact CD2-CD1 4.45Å; L155-F226 HydrophobicContact CD2-CG 4.1Å
156	D	96.1	Very high	95.9	Very high	78 Å²	78	23.4 Å²	23.4	42%	0.417	13%	0.129	S	C	.	.	H	α-helix	trans	-65.7	-21.6	-179.2	-176.1	30.2	0	0	0	114.4	R101 F152 L153 M222	R101-D156 IonicContact CZ-OD2 2.69Å; R101-D156 PolarHBondContact NH1-O 3.34Å; R101-D156 IonicContact NH1-OD1 3.51Å; R101-D156 PolarHBondContact NH1-OD1 3.45Å; R101-D156 IonicContact NH1-OD2 2.8Å; R101-D156 PolarHBondContact NH1-OD2 2.98Å; R101-D156 PolarHBondContact NH2-O 2.9Å; R101-D156 VanDerWaalsContact NH2-O 3.15Å; F152-D156 VanDerWaalsContact O-CB 3.24Å; F152-D156 WeakPolarHBondContact O-CB 3.29Å; F152-D156 PolarHBondContact O-N 3.25Å; L153-D156 PolarHBondContact O-N 2.82Å; D156-M222 HydrophobicContact CB-CE 3.64Å
157	V	96.5	Very high	95.8	Very high	20 Å²	20	21.8 Å²	21.8	12%	0.121	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-4.6	169.2	-56.1	0	0	0	0	113.7	R101 A104 M105 L108 L153 L155 T159	R101-V157 HydrophobicContact CG-CG1 3.88Å; A104-V157 HydrophobicContact CB-CG1 4.11Å; A104-V157 HydrophobicContact CB-CG2 4.17Å; M105-V157 HydrophobicContact CG-CB 4.13Å; M105-V157 HydrophobicContact CG-CG1 3.72Å; L108-V157 HydrophobicContact CD2-CG2 4.43Å; L108-V157 WeakPolarHBondContact CD2-O 3.44Å; L153-V157 PolarHBondContact O-N 3.46Å; L153-V157 VanDerWaalsContact O-N 3.11Å; L155-V157 VanDerWaalsContact C-N 3.28Å; L155-V157 PolarHBondContact O-N 2.93Å; V157-T159 WeakPolarHBondContact CG2-OG1 3.22Å
158	G	94.9	Very high	95.7	Very high	33 Å²	33	23.1 Å²	23.1	34%	0.34	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	15.8	177.4	0	0	0	0	0	115.8	L154 L155 F160 S161	L154-G158 PolarHBondContact O-N 2.83Å; L155-G158 PolarHBondContact O-N 3.12Å; G158-F160 PolarHBondContact O-N 2.96Å; G158-F160 VanDerWaalsContact O-N 3.11Å; G158-S161 PolarHBondContact O-N 2.97Å
159	T	96.3	Very high	95.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.2	-29.4	-176.2	-53.4	0	0	0	0	113.4	L111 I126 L154 V157 S161 A162 L163	L111-T159 HydrophobicContact CD1-CG2 4.34Å; I126-T159 HydrophobicContact CD1-CG2 4.28Å; I126-T159 HydrophobicContact CG2-CG2 4.26Å; L154-T159 HydrophobicContact CD2-CG2 4.16Å; L154-T159 WeakPolarHBondContact CD2-OG1 3.26Å; L154-T159 VanDerWaalsContact O-CB 3.3Å; L154-T159 WeakPolarHBondContact O-CB 3.48Å; L154-T159 PolarHBondContact O-N 3.43Å; L154-T159 PolarHBondContact O-OG1 3.29Å; V157-T159 WeakPolarHBondContact CG2-OG1 3.22Å; T159-S161 PolarHBondContact O-N 3.06Å; T159-A162 PolarHBondContact O-N 3.4Å; T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.13Å; T159-L163 WeakPolarHBondContact O-CG 3.28Å; T159-L163 PolarHBondContact O-N 3.44Å
160	F	95.5	Very high	95.3	Very high	5 Å²	5	25.6 Å²	25.6	2%	0.022	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-41.7	-178.1	-168.3	-93.2	0	0	0	113.3	G158 A162 L163 V164 M201 M204 V205 F226 L230 I240	G158-F160 PolarHBondContact O-N 2.96Å; G158-F160 VanDerWaalsContact O-N 3.11Å; F160-A162 PolarHBondContact O-N 2.85Å; F160-L163 WeakPolarHBondContact O-CB 3.47Å; F160-L163 PolarHBondContact O-N 3.41Å; F160-L163 VanDerWaalsContact O-N 3.16Å; F160-V164 HydrophobicContact CD1-CG2 3.88Å; F160-V164 HydrophobicContact CE1-CG2 3.48Å; F160-V164 VanDerWaalsContact CE1-CG2 3.48Å; F160-V164 HydrophobicContact CZ-CG2 4.11Å; F160-V164 WeakPolarHBondContact O-CG2 3.14Å; F160-V164 PolarHBondContact O-N 3.31Å; F160-M201 HydrophobicContact CE1-CE 4.25Å; F160-M201 HydrophobicContact CE2-CB 4.2Å; F160-M201 HydrophobicContact CE2-CE 3.82Å; F160-M201 HydrophobicContact CE2-CG 4.15Å; F160-M201 HydrophobicContact CZ-CE 3.63Å; F160-M204 HydrophobicContact CB-CE 4.05Å; F160-M204 HydrophobicContact CB-SD 4.5Å; F160-M204 HydrophobicContact CD2-CE 4.28Å; F160-M204 HydrophobicContact CD2-SD 4.03Å; F160-V205 HydrophobicContact CE2-CG2 4.47Å; F160-F226 HydrophobicContact CB-CE2 4.26Å; F160-F226 AromaticContact CD1-CE2 3.72Å; F160-F226 HydrophobicContact CD1-CE2 3.72Å; F160-F226 AromaticContact CD2-CE2 3.7Å; F160-F226 HydrophobicContact CD2-CE2 3.7Å; F160-F226 AromaticContact CD2-CZ 3.76Å; F160-F226 HydrophobicContact CD2-CZ 3.76Å; F160-F226 AromaticContact CE1-CE2 3.92Å; F160-F226 HydrophobicContact CE1-CE2 3.92Å; F160-F226 AromaticContact CE2-CE2 3.91Å; F160-F226 HydrophobicContact CE2-CE2 3.91Å; F160-F226 AromaticContact CE2-CZ 3.75Å; F160-F226 HydrophobicContact CE2-CZ 3.75Å; F160-F226 AromaticContact CG-CE2 3.6Å; F160-F226 HydrophobicContact CG-CE2 3.6Å; F160-F226 HydrophobicContact CG-CZ 4.16Å; F160-F226 HydrophobicContact CZ-CE2 4.01Å; F160-F226 HydrophobicContact CZ-CZ 4.14Å; F160-L230 HydrophobicContact CE1-CD2 3.66Å; F160-L230 HydrophobicContact CE2-CD2 4.35Å; F160-L230 HydrophobicContact CZ-CD2 3.43Å; F160-L230 VanDerWaalsContact CZ-CD2 3.43Å; F160-I240 HydrophobicContact CE1-CD1 4.18Å; F160-I240 HydrophobicContact CZ-CD1 3.68Å
161	S	93.4	Very high	95	Very high	49 Å²	49	26.3 Å²	26.3	34%	0.343	15%	0.149	S	C	.	.	H	α-helix	trans	-62.5	-45.5	179.5	-56.5	0	0	0	0	111.6	G158 T159 L163 V164 E165	G158-S161 PolarHBondContact O-N 2.97Å; T159-S161 PolarHBondContact O-N 3.06Å; S161-L163 VanDerWaalsContact C-N 3.29Å; S161-L163 PolarHBondContact O-N 3.4Å; S161-V164 PolarHBondContact O-N 3.22Å; S161-V164 VanDerWaalsContact O-N 3.09Å; S161-E165 PolarHBondContact O-N 3.35Å
162	A	94.4	Very high	94.7	Very high	23 Å²	23	31.6 Å²	31.6	19%	0.19	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-35.7	174.4	0	0	0	0	0	112.5	L108 L111 T159 F160 E165 L166	L108-A162 HydrophobicContact CD1-CB 3.65Å; L111-A162 HydrophobicContact CD1-CB 4.32Å; T159-A162 PolarHBondContact O-N 3.4Å; F160-A162 PolarHBondContact O-N 2.85Å; A162-E165 PolarHBondContact O-N 3.38Å; A162-L166 WeakPolarHBondContact O-CB 3.36Å; A162-L166 VanDerWaalsContact O-CG 3.25Å; A162-L166 WeakPolarHBondContact O-CG 3.37Å; A162-L166 PolarHBondContact O-N 2.96Å
163	L	95.6	Very high	94.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-37.7	173.4	-66.6	169.9	0	0	0	112.3	T159 F160 S161 L167 L197 I200 M201 M204	T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.13Å; T159-L163 WeakPolarHBondContact O-CG 3.28Å; T159-L163 PolarHBondContact O-N 3.44Å; F160-L163 WeakPolarHBondContact O-CB 3.47Å; F160-L163 PolarHBondContact O-N 3.41Å; F160-L163 VanDerWaalsContact O-N 3.16Å; S161-L163 VanDerWaalsContact C-N 3.29Å; S161-L163 PolarHBondContact O-N 3.4Å; L163-L167 WeakPolarHBondContact O-CB 3.5Å; L163-L167 PolarHBondContact O-N 3.29Å; L163-L197 HydrophobicContact CD2-CD2 3.49Å; L163-L197 VanDerWaalsContact CD2-CD2 3.49Å; L163-I200 HydrophobicContact CD1-CB 3.99Å; L163-I200 HydrophobicContact CD1-CG2 3.48Å; L163-I200 VanDerWaalsContact CD1-CG2 3.48Å; L163-I200 HydrophobicContact CD2-CD1 3.84Å; L163-M201 HydrophobicContact CB-CE 4.35Å; L163-M201 HydrophobicContact CB-CG 3.88Å; L163-M201 HydrophobicContact CB-SD 4.01Å; L163-M201 HydrophobicContact CD1-CG 3.97Å; L163-M201 HydrophobicContact CG-CG 4.49Å; L163-M204 HydrophobicContact CD1-SD 4.1Å
164	V	94.4	Very high	93.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.2	-43.2	175.2	179.9	0	0	0	0	111	F160 S161 L167 N168 M201 F235 I240 M243	F160-V164 HydrophobicContact CD1-CG2 3.88Å; F160-V164 HydrophobicContact CE1-CG2 3.48Å; F160-V164 VanDerWaalsContact CE1-CG2 3.48Å; F160-V164 HydrophobicContact CZ-CG2 4.11Å; F160-V164 WeakPolarHBondContact O-CG2 3.14Å; F160-V164 PolarHBondContact O-N 3.31Å; S161-V164 PolarHBondContact O-N 3.22Å; S161-V164 VanDerWaalsContact O-N 3.09Å; V164-L167 PolarHBondContact O-N 3.48Å; V164-N168 PolarHBondContact O-N 2.57Å; V164-N168 PolarHBondContact O-ND2 2.83Å; V164-M201 HydrophobicContact CB-CE 4.39Å; V164-M201 HydrophobicContact CG2-CE 3.51Å; V164-F235 HydrophobicContact CB-CD1 3.91Å; V164-F235 HydrophobicContact CB-CE1 4.04Å; V164-F235 HydrophobicContact CB-CG 4.29Å; V164-F235 HydrophobicContact CG1-CB 3.76Å; V164-F235 HydrophobicContact CG1-CD1 3.59Å; V164-F235 HydrophobicContact CG1-CD2 4.22Å; V164-F235 HydrophobicContact CG1-CE1 4.22Å; V164-F235 HydrophobicContact CG1-CG 3.58Å; V164-F235 HydrophobicContact CG2-CD1 4.33Å; V164-F235 HydrophobicContact CG2-CD2 4.46Å; V164-F235 HydrophobicContact CG2-CE1 4.17Å; V164-F235 HydrophobicContact CG2-CE2 4.3Å; V164-F235 HydrophobicContact CG2-CG 4.47Å; V164-F235 HydrophobicContact CG2-CZ 4.16Å; V164-I240 HydrophobicContact CG2-CD1 4.28Å; V164-M243 HydrophobicContact CG1-SD 4.43Å
165	E	92.1	Very high	93.1	Very high	133 Å²	133	39.9 Å²	39.9	62%	0.621	24%	0.238	S	C	*	.	H	α-helix	trans	-63.1	-46.1	177.1	-70.9	178	-157.6	0	0	112.1	S161 A162 L167 N168 M169	S161-E165 PolarHBondContact O-N 3.35Å; A162-E165 PolarHBondContact O-N 3.38Å; E165-L167 VanDerWaalsContact C-N 3.33Å; E165-L167 PolarHBondContact O-N 3.04Å; E165-N168 PolarHBondContact O-N 2.94Å; E165-M169 PolarHBondContact O-N 3.26Å
166	L	93.8	Very high	92.5	Very high	20 Å²	20	39.6 Å²	39.6	11%	0.105	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-35.2	175.8	-69.6	178.7	0	0	0	112.8	L111 A162 M169 E170 L197	L111-L166 HydrophobicContact CB-CD1 4.16Å; L111-L166 HydrophobicContact CD1-CD1 4.2Å; L111-L166 HydrophobicContact CD2-CD1 4Å; L111-L166 HydrophobicContact CG-CD1 4.36Å; A162-L166 WeakPolarHBondContact O-CB 3.36Å; A162-L166 VanDerWaalsContact O-CG 3.25Å; A162-L166 WeakPolarHBondContact O-CG 3.37Å; A162-L166 PolarHBondContact O-N 2.96Å; L166-M169 HydrophobicContact CD2-CE 4.36Å; L166-M169 PolarHBondContact O-N 3.14Å; L166-E170 PolarHBondContact O-N 2.88Å; L166-L197 HydrophobicContact CB-CD1 3.98Å; L166-L197 HydrophobicContact CB-CD2 3.99Å; L166-L197 HydrophobicContact CD1-CD2 4.23Å
167	L	95	Very high	91.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-41.4	175.1	179.6	56	0	0	0	111.1	L163 V164 E165 E170 I171 L194 L197 L198 M201 M243 M247	L163-L167 WeakPolarHBondContact O-CB 3.5Å; L163-L167 PolarHBondContact O-N 3.29Å; V164-L167 PolarHBondContact O-N 3.48Å; E165-L167 VanDerWaalsContact C-N 3.33Å; E165-L167 PolarHBondContact O-N 3.04Å; L167-E170 PolarHBondContact O-N 3.2Å; L167-I171 HydrophobicContact CD1-CD1 3.95Å; L167-I171 HydrophobicContact CD1-CG1 4.1Å; L167-I171 HydrophobicContact CG-CD1 3.76Å; L167-I171 HydrophobicContact CG-CG1 4.4Å; L167-I171 VanDerWaalsContact O-CB 3.23Å; L167-I171 WeakPolarHBondContact O-CB 3.28Å; L167-I171 WeakPolarHBondContact O-CD1 3.35Å; L167-I171 WeakPolarHBondContact O-CG1 3.33Å; L167-I171 PolarHBondContact O-N 3.44Å; L167-L194 HydrophobicContact CD1-CD2 3.77Å; L167-L197 HydrophobicContact CB-CD1 4.48Å; L167-L198 HydrophobicContact CD1-CD2 4.17Å; L167-L198 HydrophobicContact CD1-CG 4.3Å; L167-L198 HydrophobicContact CD2-CD2 3.79Å; L167-M201 HydrophobicContact CB-SD 4.41Å; L167-M201 HydrophobicContact CD2-CE 4.16Å; L167-M201 HydrophobicContact CD2-SD 3.62Å; L167-M243 HydrophobicContact CD2-CE 3.56Å; L167-M243 HydrophobicContact CG-CE 4.04Å; L167-M247 HydrophobicContact CD1-CE 4.36Å; L167-M247 HydrophobicContact CD1-SD 4.4Å
168	N	92.8	Very high	91.3	Very high	27 Å²	27	39.1 Å²	39.1	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-46.5	171.8	-81.5	-83.7	0	0	0	111.5	V164 E165 E170 I171 D172 N236 M243	V164-N168 PolarHBondContact O-N 2.57Å; V164-N168 PolarHBondContact O-ND2 2.83Å; E165-N168 PolarHBondContact O-N 2.94Å; N168-E170 VanDerWaalsContact C-N 3.33Å; N168-E170 PolarHBondContact O-N 3.45Å; N168-I171 WeakPolarHBondContact O-CB 3.48Å; N168-I171 PolarHBondContact O-N 2.89Å; N168-D172 PolarHBondContact O-N 3.16Å; N168-N236 PolarHBondContact OD1-ND2 2.87Å; N168-M243 PolarHBondContact ND2-SD 2.72Å
169	M	91.4	Very high	90.8	Very high	99 Å²	99	40.4 Å²	40.4	49%	0.488	25%	0.246	S	C	.	.	H	α-helix	trans	-57.1	-43.3	178.2	-173.1	-158.6	70.1	0	0	112.4	R119 E165 L166 N173	R119-M169 PolarHBondContact NH1-SD 2.78Å; E165-M169 PolarHBondContact O-N 3.26Å; L166-M169 HydrophobicContact CD2-CE 4.36Å; L166-M169 PolarHBondContact O-N 3.14Å; M169-N173 PolarHBondContact O-N 2.77Å
170	E	92.7	Very high	90.2	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-80.9	-24.1	179.5	-163.1	68.5	176.9	0	0	112.7	R116 L166 L167 N168 D172 N173 D193 L194	R116-E170 IonicContact CZ-OE1 2.63Å; R116-E170 IonicContact NH1-OE1 2.65Å; R116-E170 IonicContact NH2-OE1 2.91Å; R116-E170 PolarHBondContact NH2-OE1 2.99Å; L166-E170 PolarHBondContact O-N 2.88Å; L167-E170 PolarHBondContact O-N 3.2Å; N168-E170 VanDerWaalsContact C-N 3.33Å; N168-E170 PolarHBondContact O-N 3.45Å; E170-D172 PolarHBondContact O-N 2.63Å; E170-N173 VanDerWaalsContact CD-ND2 3.33Å; E170-N173 WeakPolarHBondContact O-CB 3.35Å; E170-N173 PolarHBondContact O-N 2.92Å; E170-N173 PolarHBondContact OE1-ND2 2.99Å; E170-N173 PolarHBondContact OE2-ND2 3.28Å; E170-D193 HydrophobicContact CG-CB 4.33Å; E170-L194 HydrophobicContact CB-CD2 3.75Å; E170-L194 HydrophobicContact CB-CG 4.39Å; E170-L194 HydrophobicContact CG-CD2 3.63Å; E170-L194 HydrophobicContact CG-CG 3.7Å
171	I	93.2	Very high	89.6	Confident	16 Å²	16	44.5 Å²	44.5	8%	0.082	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-27.4	170.1	-82.7	168.6	0	0	0	112.7	L167 N168 M243 M247 K250 F259	L167-I171 HydrophobicContact CD1-CD1 3.95Å; L167-I171 HydrophobicContact CD1-CG1 4.1Å; L167-I171 HydrophobicContact CG-CD1 3.76Å; L167-I171 HydrophobicContact CG-CG1 4.4Å; L167-I171 VanDerWaalsContact O-CB 3.23Å; L167-I171 WeakPolarHBondContact O-CB 3.28Å; L167-I171 WeakPolarHBondContact O-CD1 3.35Å; L167-I171 WeakPolarHBondContact O-CG1 3.33Å; L167-I171 PolarHBondContact O-N 3.44Å; N168-I171 WeakPolarHBondContact O-CB 3.48Å; N168-I171 PolarHBondContact O-N 2.89Å; I171-M243 HydrophobicContact CD1-CE 4.33Å; I171-M243 HydrophobicContact CD1-CG 4Å; I171-M243 HydrophobicContact CD1-SD 4.12Å; I171-M247 HydrophobicContact CD1-CE 4.19Å; I171-M247 HydrophobicContact CD1-CG 3.57Å; I171-M247 HydrophobicContact CD1-SD 3.57Å; I171-M247 VanDerWaalsContact CD1-SD 3.57Å; I171-M247 HydrophobicContact CG1-CE 3.83Å; I171-M247 HydrophobicContact CG1-CG 3.84Å; I171-M247 HydrophobicContact CG1-SD 3.9Å; I171-K250 HydrophobicContact CG2-CD 4.31Å; I171-K250 PolarHBondContact O-NZ 3.13Å; I171-F259 HydrophobicContact CB-CZ 4.48Å; I171-F259 HydrophobicContact CG1-CZ 4.3Å
172	D	90.3	Very high	89.2	Confident	111 Å²	111	52 Å²	52	59%	0.594	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	14.6	176.4	-73.2	-43.9	0	0	0	113.6	N168 E170 S174 K250	N168-D172 PolarHBondContact O-N 3.16Å; E170-D172 PolarHBondContact O-N 2.63Å; D172-S174 VanDerWaalsContact C-N 3.33Å; D172-S174 PolarHBondContact O-N 2.73Å; D172-K250 IonicContact OD1-NZ 3.1Å; D172-K250 PolarHBondContact OD1-NZ 3.36Å
173	N	90.3	Very high	88.7	Confident	36 Å²	36	55 Å²	55	19%	0.193	30%	0.301	C	S	.	.			trans	-70	85.8	176.1	-170.7	-22.8	0	0	0	112	M169 E170 A175 A176 C177	M169-N173 PolarHBondContact O-N 2.77Å; E170-N173 VanDerWaalsContact CD-ND2 3.33Å; E170-N173 WeakPolarHBondContact O-CB 3.35Å; E170-N173 PolarHBondContact O-N 2.92Å; E170-N173 PolarHBondContact OE1-ND2 2.99Å; E170-N173 PolarHBondContact OE2-ND2 3.28Å; N173-A175 PolarHBondContact O-N 3.41Å; N173-A175 WeakPolarHBondContact OD1-CB 3.42Å; N173-A175 PolarHBondContact OD1-N 3.07Å; N173-A176 HydrophobicContact CB-CB 4.07Å; N173-A176 PolarHBondContact O-N 3.04Å; N173-A176 PolarHBondContact OD1-N 2.98Å; N173-C177 PolarHBondContact O-N 2.77Å
174	S	84.8	Confident	87.8	Confident	87 Å²	87	61.9 Å²	61.9	61%	0.608	35%	0.345	S	S	*	.	H	α-helix	trans	-59.7	-24.7	179.1	63.6	0	0	0	0	113.8	D172 S178	D172-S174 VanDerWaalsContact C-N 3.33Å; D172-S174 PolarHBondContact O-N 2.73Å; S174-S178 VanDerWaalsContact O-CB 3.24Å; S174-S178 WeakPolarHBondContact O-CB 3.32Å; S174-S178 PolarHBondContact O-N 2.85Å; S174-S178 PolarHBondContact O-OG 3.19Å
175	A	84.9	Confident	87.2	Confident	66 Å²	66	64.9 Å²	64.9	55%	0.545	37%	0.371	S	S	.	.	H	α-helix	trans	-75.6	-43.9	176	0	0	0	0	0	111.9	N173 S178 S179	N173-A175 PolarHBondContact O-N 3.41Å; N173-A175 WeakPolarHBondContact OD1-CB 3.42Å; N173-A175 PolarHBondContact OD1-N 3.07Å; A175-S178 PolarHBondContact O-N 3.09Å; A175-S179 WeakPolarHBondContact O-CB 3.42Å; A175-S179 PolarHBondContact O-N 2.99Å
176	A	83.2	Confident	87	Confident	18 Å²	18	59.3 Å²	59.3	15%	0.149	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-45.9	172.9	0	0	0	0	0	111.2	N173 S178 S179 A180	N173-A176 HydrophobicContact CB-CB 4.07Å; N173-A176 PolarHBondContact O-N 3.04Å; N173-A176 PolarHBondContact OD1-N 2.98Å; A176-S178 PolarHBondContact O-N 3.5Å; A176-S179 PolarHBondContact O-N 2.81Å; A176-A180 WeakPolarHBondContact O-CB 3.13Å; A176-A180 PolarHBondContact O-N 3.22Å
177	C	83.6	Confident	86.7	Confident	36 Å²	36	58.9 Å²	58.9	24%	0.243	34%	0.343	C	S	.	.	H	α-helix	trans	-50.9	-55.9	168.6	162	0	0	0	0	112.1	N173 S179 A180 V181 H255	N173-C177 PolarHBondContact O-N 2.77Å; C177-S179 VanDerWaalsContact C-N 3.26Å; C177-S179 PolarHBondContact O-N 3.47Å; C177-A180 PolarHBondContact O-N 2.94Å; C177-V181 WeakPolarHBondContact O-CG2 3.42Å; C177-V181 PolarHBondContact O-N 3.04Å; C177-H255 PolarHBondContact SG-O 3.49Å
178	S	84.1	Confident	86.5	Confident	52 Å²	52	59.8 Å²	59.8	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-30.1	-176.6	-64.5	0	0	0	0	113.5	S174 A175 A176 R182	S174-S178 VanDerWaalsContact O-CB 3.24Å; S174-S178 WeakPolarHBondContact O-CB 3.32Å; S174-S178 PolarHBondContact O-N 2.85Å; S174-S178 PolarHBondContact O-OG 3.19Å; A175-S178 PolarHBondContact O-N 3.09Å; A176-S178 PolarHBondContact O-N 3.5Å; S178-R182 VanDerWaalsContact O-CD 3.25Å; S178-R182 WeakPolarHBondContact O-CD 3.23Å; S178-R182 VanDerWaalsContact O-CG 3.25Å; S178-R182 WeakPolarHBondContact O-CG 3.44Å; S178-R182 PolarHBondContact O-NE 3.47Å
179	S	85.4	Confident	86.2	Confident	60 Å²	60	59.8 Å²	59.8	42%	0.42	35%	0.352	S	S	.	.	H	α-helix	trans	-70.5	-54.1	172.4	-174.5	0	0	0	0	110.8	A175 A176 C177 V181 R182 K183	A175-S179 WeakPolarHBondContact O-CB 3.42Å; A175-S179 PolarHBondContact O-N 2.99Å; A176-S179 PolarHBondContact O-N 2.81Å; C177-S179 VanDerWaalsContact C-N 3.26Å; C177-S179 PolarHBondContact O-N 3.47Å; S179-V181 PolarHBondContact O-N 3.21Å; S179-R182 PolarHBondContact O-N 3.04Å; S179-K183 PolarHBondContact O-N 3.1Å
180	A	83.1	Confident	86.2	Confident	2 Å²	2	56.5 Å²	56.5	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-41.7	-176.5	0	0	0	0	0	113.2	A176 C177 R182 K183 I186 P257 H258	A176-A180 WeakPolarHBondContact O-CB 3.13Å; A176-A180 PolarHBondContact O-N 3.22Å; C177-A180 PolarHBondContact O-N 2.94Å; A180-R182 PolarHBondContact O-N 3.14Å; A180-K183 PolarHBondContact O-N 3.29Å; A180-I186 HydrophobicContact CB-CD1 4.23Å; A180-P257 HydrophobicContact CB-CG 4.18Å; A180-H258 HydrophobicContact CB-CB 3.74Å; A180-H258 WeakPolarHBondContact CB-ND1 3.5Å
181	V	84.1	Confident	86.2	Confident	90 Å²	90	56.2 Å²	56.2	55%	0.545	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.8	178.3	173	0	0	0	0	112.6	C177 S179 P257	C177-V181 WeakPolarHBondContact O-CG2 3.42Å; C177-V181 PolarHBondContact O-N 3.04Å; S179-V181 PolarHBondContact O-N 3.21Å; V181-P257 HydrophobicContact CG2-CG 3.84Å
182	R	84.9	Confident	86.2	Confident	206 Å²	206	56.6 Å²	56.6	78%	0.777	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-16.6	178.5	-66.4	173.5	-170.6	-179.2	3.9	113.7	S178 S179 A180	S178-R182 VanDerWaalsContact O-CD 3.25Å; S178-R182 WeakPolarHBondContact O-CD 3.23Å; S178-R182 VanDerWaalsContact O-CG 3.25Å; S178-R182 WeakPolarHBondContact O-CG 3.44Å; S178-R182 PolarHBondContact O-NE 3.47Å; S179-R182 PolarHBondContact O-N 3.04Å; A180-R182 PolarHBondContact O-N 3.14Å
183	K	83	Confident	86.4	Confident	85 Å²	85	52.5 Å²	52.5	37%	0.37	32%	0.316	S	S	.	.			trans	-77	130.9	180	-79.8	-169.3	171.3	-173.5	0	111.2	S179 A180 A185 D190	S179-K183 PolarHBondContact O-N 3.1Å; A180-K183 PolarHBondContact O-N 3.29Å; K183-A185 WeakPolarHBondContact CB-O 3.4Å; K183-A185 PolarHBondContact O-N 2.97Å; K183-D190 VanDerWaalsContact CD-OD1 3.29Å; K183-D190 WeakPolarHBondContact CD-OD1 3.48Å; K183-D190 VanDerWaalsContact CE-OD1 3.23Å; K183-D190 WeakPolarHBondContact CE-OD1 3.5Å; K183-D190 IonicContact NZ-OD1 3.61Å; K183-D190 PolarHBondContact NZ-OD1 3.04Å; K183-D190 IonicContact NZ-OD2 3.44Å; K183-D190 PolarHBondContact NZ-OD2 3.03Å
184	P	75.9	Confident	86.7	Confident	145 Å²	145	50.8 Å²	50.8	94%	0.942	31%	0.308	S	S	*	.	S	Bend	trans	-64	-26.9	175.6	-23.7	34.4	0	0	0	114.3
185	A	82.2	Confident	87.3	Confident	64 Å²	64	46.8 Å²	46.8	53%	0.529	28%	0.279	S	S	.	.	S	Bend	trans	-137.3	136.4	172.6	0	0	0	0	0	108.8	K183	K183-A185 WeakPolarHBondContact CB-O 3.4Å; K183-A185 PolarHBondContact O-N 2.97Å
186	I	87.6	Confident	87.9	Confident	16 Å²	16	43.7 Å²	43.7	8%	0.082	25%	0.253	C	S	.	.			trans	-107.4	138.4	178.5	-55.6	172.3	0	0	0	107.8	A180 D190 P257 H258 A525	A180-I186 HydrophobicContact CB-CD1 4.23Å; I186-D190 HydrophobicContact CG2-CB 3.73Å; I186-P257 HydrophobicContact CD1-CB 3.68Å; I186-P257 HydrophobicContact CD1-CG 3.75Å; I186-H258 HydrophobicContact CG2-CB 3.95Å; I186-A525 HydrophobicContact CB-CB 4.25Å; I186-A525 HydrophobicContact CG2-CB 3.87Å
187	S	89.1	Confident	88.6	Confident	10 Å²	10	43.3 Å²	43.3	7%	0.07	25%	0.249	C	C	.	.			trans	-125.5	171.5	-171.1	67.1	0	0	0	0	112.1	A189 D190 A525 L528	S187-A189 PolarHBondContact O-N 3.33Å; S187-A189 VanDerWaalsContact O-N 3.15Å; S187-A189 PolarHBondContact OG-N 2.96Å; S187-D190 PolarHBondContact N-OD2 3.23Å; S187-D190 WeakPolarHBondContact O-CB 3.47Å; S187-D190 PolarHBondContact O-N 3.39Å; S187-D190 VanDerWaalsContact O-N 3.08Å; S187-D190 PolarHBondContact OG-OD2 3.4Å; S187-A525 CarbonylContact C-O 3.53Å; S187-L528 WeakPolarHBondContact CA-O 3.3Å
188	L	89.4	Confident	89.3	Confident	19 Å²	19	41.6 Å²	41.6	10%	0.099	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-60.3	-23.8	175.9	64.3	89.5	0	0	0	113.1	T67 D190 S191 R195 A525 L528	T67-L188 WeakPolarHBondContact OG1-CD2 3.37Å; L188-D190 VanDerWaalsContact C-N 3.34Å; L188-S191 PolarHBondContact O-N 3.15Å; L188-S191 PolarHBondContact O-OG 3.43Å; L188-R195 VanDerWaalsContact O-CZ 3.25Å; L188-R195 PolarHBondContact O-NE 2.81Å; L188-R195 PolarHBondContact O-NH2 3.36Å; L188-A525 WeakPolarHBondContact CA-O 3.33Å; L188-A525 PolarHBondContact N-O 3.41Å; L188-L528 PolarHBondContact N-O 3.42Å
189	A	87.8	Confident	90	Very high	27 Å²	27	39.3 Å²	39.3	22%	0.223	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-68.4	-32.5	176.3	0	0	0	0	0	112.7	S187 S191 T192 E530	S187-A189 PolarHBondContact O-N 3.33Å; S187-A189 VanDerWaalsContact O-N 3.15Å; S187-A189 PolarHBondContact OG-N 2.96Å; A189-S191 PolarHBondContact O-N 3.44Å; A189-T192 WeakPolarHBondContact CA-OG1 3.18Å; A189-T192 PolarHBondContact O-N 3.5Å; A189-T192 PolarHBondContact O-OG1 3.35Å; A189-E530 HydrophobicContact CB-CG 3.5Å; A189-E530 WeakPolarHBondContact CB-OE1 3.24Å
190	D	89.9	Confident	90.6	Very high	31 Å²	31	36.4 Å²	36.4	17%	0.166	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-67.4	-4.5	-179.8	-65.5	-71.3	0	0	0	114.3	K183 I186 S187 L188 H258	K183-D190 VanDerWaalsContact CD-OD1 3.29Å; K183-D190 WeakPolarHBondContact CD-OD1 3.48Å; K183-D190 VanDerWaalsContact CE-OD1 3.23Å; K183-D190 WeakPolarHBondContact CE-OD1 3.5Å; K183-D190 IonicContact NZ-OD1 3.61Å; K183-D190 PolarHBondContact NZ-OD1 3.04Å; K183-D190 IonicContact NZ-OD2 3.44Å; K183-D190 PolarHBondContact NZ-OD2 3.03Å; I186-D190 HydrophobicContact CG2-CB 3.73Å; S187-D190 PolarHBondContact N-OD2 3.23Å; S187-D190 WeakPolarHBondContact O-CB 3.47Å; S187-D190 PolarHBondContact O-N 3.39Å; S187-D190 VanDerWaalsContact O-N 3.08Å; S187-D190 PolarHBondContact OG-OD2 3.4Å; L188-D190 VanDerWaalsContact C-N 3.34Å; D190-H258 HydrophobicContact CB-CB 4.2Å
191	S	93.3	Very high	91.3	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.028	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-131.5	12.4	-176.3	59.2	0	0	0	0	113.6	L188 A189 D193 L194 R195 H258	L188-S191 PolarHBondContact O-N 3.15Å; L188-S191 PolarHBondContact O-OG 3.43Å; A189-S191 PolarHBondContact O-N 3.44Å; S191-D193 PolarHBondContact O-N 3.2Å; S191-L194 WeakPolarHBondContact O-CB 3.32Å; S191-L194 PolarHBondContact O-N 3.23Å; S191-L194 VanDerWaalsContact O-N 3.09Å; S191-R195 WeakPolarHBondContact O-CG 3.19Å; S191-R195 PolarHBondContact O-N 3.44Å; S191-R195 WeakPolarHBondContact OG-CD 3.43Å; S191-R195 PolarHBondContact OG-NE 3.21Å; S191-H258 VanDerWaalsContact CB-O 3.24Å; S191-H258 WeakPolarHBondContact CB-O 3.47Å
192	T	94.1	Very high	92	Very high	24 Å²	24	32 Å²	32	15%	0.147	17%	0.174	C	C	.	.	H	α-helix	trans	-51.4	-51.1	-167.2	-59.7	0	0	0	0	114	L120 A189 R195 V196	L120-T192 HydrophobicContact CD1-CG2 4.35Å; L120-T192 HydrophobicContact CD2-CG2 4.11Å; A189-T192 WeakPolarHBondContact CA-OG1 3.18Å; A189-T192 PolarHBondContact O-N 3.5Å; A189-T192 PolarHBondContact O-OG1 3.35Å; T192-R195 PolarHBondContact O-N 2.91Å; T192-V196 WeakPolarHBondContact O-CG2 3.36Å; T192-V196 PolarHBondContact O-N 3.01Å
193	D	94.3	Very high	92.6	Very high	24 Å²	24	22.2 Å²	22.2	13%	0.128	14%	0.137	C	C	.	.	H	α-helix	trans	-62.5	-45.2	179.9	-51.2	-128.1	0	0	0	111.2	R116 L120 E170 S191 R195 V196 L197	R116-D193 IonicContact CZ-OD1 3.6Å; R116-D193 IonicContact CZ-OD2 2.9Å; R116-D193 IonicContact NE-OD1 3.25Å; R116-D193 PolarHBondContact NE-OD1 3.39Å; R116-D193 IonicContact NE-OD2 3.13Å; R116-D193 PolarHBondContact NE-OD2 2.63Å; R116-D193 IonicContact NH2-OD1 3.21Å; R116-D193 PolarHBondContact NH2-OD1 2.81Å; R116-D193 IonicContact NH2-OD2 2.76Å; R116-D193 PolarHBondContact NH2-OD2 2.75Å; L120-D193 HydrophobicContact CD1-CB 4.47Å; E170-D193 HydrophobicContact CG-CB 4.33Å; S191-D193 PolarHBondContact O-N 3.2Å; D193-R195 PolarHBondContact O-N 3.18Å; D193-V196 PolarHBondContact O-N 3.48Å; D193-L197 VanDerWaalsContact O-CG 3.32Å; D193-L197 WeakPolarHBondContact O-CG 3.32Å; D193-L197 PolarHBondContact O-N 2.99Å
194	L	96.2	Very high	93.3	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-60.1	-43.5	174.7	-67.4	171.9	0	0	0	112.1	L167 E170 S191 L197 L198 M247 F259 P260	L167-L194 HydrophobicContact CD1-CD2 3.77Å; E170-L194 HydrophobicContact CB-CD2 3.75Å; E170-L194 HydrophobicContact CB-CG 4.39Å; E170-L194 HydrophobicContact CG-CD2 3.63Å; E170-L194 HydrophobicContact CG-CG 3.7Å; S191-L194 WeakPolarHBondContact O-CB 3.32Å; S191-L194 PolarHBondContact O-N 3.23Å; S191-L194 VanDerWaalsContact O-N 3.09Å; L194-L197 PolarHBondContact O-N 3.09Å; L194-L198 HydrophobicContact CB-CD1 4.46Å; L194-L198 VanDerWaalsContact O-CB 3.25Å; L194-L198 WeakPolarHBondContact O-CB 3.37Å; L194-L198 WeakPolarHBondContact O-CD1 3.32Å; L194-L198 WeakPolarHBondContact O-CG 3.34Å; L194-L198 PolarHBondContact O-N 2.71Å; L194-M247 HydrophobicContact CD2-CE 4.39Å; L194-F259 HydrophobicContact CD1-CD1 3.44Å; L194-F259 VanDerWaalsContact CD1-CD1 3.44Å; L194-F259 HydrophobicContact CD1-CE1 3.73Å; L194-F259 HydrophobicContact CD1-CG 4.43Å; L194-P260 HydrophobicContact CB-CG 4.12Å
195	R	96.5	Very high	94.4	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.008	8%	0.075	C	C	.	.	H	α-helix	trans	-63.4	-43.4	178.8	-69.3	-169.9	-61.2	108.1	-0	111.1	E68 E71 L188 S191 T192 D193 N199 P260 K263 D526	E68-R195 IonicContact OE1-CZ 3.87Å; E68-R195 IonicContact OE1-NH1 3.51Å; E68-R195 PolarHBondContact OE1-NH1 3.3Å; E71-R195 IonicContact OE1-CZ 2.71Å; E71-R195 IonicContact OE1-NH1 2.85Å; E71-R195 PolarHBondContact OE1-NH1 3.36Å; E71-R195 IonicContact OE1-NH2 2.79Å; E71-R195 PolarHBondContact OE1-NH2 3.05Å; E71-R195 IonicContact OE2-NH1 2.74Å; E71-R195 IonicContact OE2-NH2 3.21Å; L188-R195 VanDerWaalsContact O-CZ 3.25Å; L188-R195 PolarHBondContact O-NE 2.81Å; L188-R195 PolarHBondContact O-NH2 3.36Å; S191-R195 WeakPolarHBondContact O-CG 3.19Å; S191-R195 PolarHBondContact O-N 3.44Å; S191-R195 WeakPolarHBondContact OG-CD 3.43Å; S191-R195 PolarHBondContact OG-NE 3.21Å; T192-R195 PolarHBondContact O-N 2.91Å; D193-R195 PolarHBondContact O-N 3.18Å; R195-N199 WeakPolarHBondContact O-CB 3.26Å; R195-N199 PolarHBondContact O-N 2.9Å; R195-N199 PolarHBondContact O-ND2 3.2Å; R195-N199 VanDerWaalsContact O-ND2 3.14Å; R195-N199 PolarHBondContact O-OD1 2.88Å; R195-P260 HydrophobicContact CG-CB 3.69Å; R195-P260 HydrophobicContact CG-CG 3.85Å; R195-K263 HydrophobicContact CB-CD 4.16Å; R195-K263 HydrophobicContact CG-CD 4.02Å; R195-D526 WeakPolarHBondContact CD-OD1 3.27Å
196	V	97.8	Very high	95	Very high	1 Å²	1	8.3 Å²	8.3	1%	0.006	5%	0.05	C	C	.	.	H	α-helix	trans	-62.4	-50.3	176.9	173	0	0	0	0	110.9	L120 A123 R124 L127 T192 D193 N199 I200	L120-V196 HydrophobicContact CD1-CB 4.42Å; L120-V196 HydrophobicContact CD1-CG2 4.13Å; A123-V196 HydrophobicContact CB-CG1 3.73Å; R124-V196 HydrophobicContact CG-CG1 4.39Å; R124-V196 HydrophobicContact CG-CG2 4.02Å; L127-V196 HydrophobicContact CB-CG1 4.29Å; L127-V196 HydrophobicContact CD2-CB 4.4Å; L127-V196 HydrophobicContact CD2-CG1 4.1Å; L127-V196 HydrophobicContact CD2-CG2 4.29Å; T192-V196 WeakPolarHBondContact O-CG2 3.36Å; T192-V196 PolarHBondContact O-N 3.01Å; D193-V196 PolarHBondContact O-N 3.48Å; V196-N199 PolarHBondContact O-N 3.34Å; V196-I200 HydrophobicContact CG1-CD1 4.19Å; V196-I200 WeakPolarHBondContact O-CG1 3.44Å; V196-I200 PolarHBondContact O-N 3.21Å
197	L	97.9	Very high	95.4	Very high	10 Å²	10	7.8 Å²	7.8	5%	0.052	5%	0.047	C	C	.	.	H	α-helix	trans	-59.8	-52.2	179.1	-66.9	171.2	0	0	0	112.1	L163 L166 L167 D193 L194 N199 I200 M201	L163-L197 HydrophobicContact CD2-CD2 3.49Å; L163-L197 VanDerWaalsContact CD2-CD2 3.49Å; L166-L197 HydrophobicContact CB-CD1 3.98Å; L166-L197 HydrophobicContact CB-CD2 3.99Å; L166-L197 HydrophobicContact CD1-CD2 4.23Å; L167-L197 HydrophobicContact CB-CD1 4.48Å; D193-L197 VanDerWaalsContact O-CG 3.32Å; D193-L197 WeakPolarHBondContact O-CG 3.32Å; D193-L197 PolarHBondContact O-N 2.99Å; L194-L197 PolarHBondContact O-N 3.09Å; L197-N199 VanDerWaalsContact C-N 3.3Å; L197-N199 PolarHBondContact O-N 3.46Å; L197-I200 PolarHBondContact O-N 3.28Å; L197-M201 WeakPolarHBondContact O-CG 3.25Å; L197-M201 PolarHBondContact O-N 3.27Å
198	L	98.3	Very high	95.7	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-63.9	-32.9	-178.9	-69.4	166.5	0	0	0	112.6	L167 L194 Y202 L244 M247 P260 K263 V264 L267	L167-L198 HydrophobicContact CD1-CD2 4.17Å; L167-L198 HydrophobicContact CD1-CG 4.3Å; L167-L198 HydrophobicContact CD2-CD2 3.79Å; L194-L198 HydrophobicContact CB-CD1 4.46Å; L194-L198 VanDerWaalsContact O-CB 3.25Å; L194-L198 WeakPolarHBondContact O-CB 3.37Å; L194-L198 WeakPolarHBondContact O-CD1 3.32Å; L194-L198 WeakPolarHBondContact O-CG 3.34Å; L194-L198 PolarHBondContact O-N 2.71Å; L198-Y202 VanDerWaalsContact O-CB 3.32Å; L198-Y202 WeakPolarHBondContact O-CB 3.26Å; L198-Y202 PolarHBondContact O-N 2.73Å; L198-L244 HydrophobicContact CD2-CD2 4.22Å; L198-M247 HydrophobicContact CD1-CE 4.46Å; L198-P260 HydrophobicContact CD1-CG 3.66Å; L198-K263 HydrophobicContact CB-CB 4.17Å; L198-K263 HydrophobicContact CD1-CB 4.31Å; L198-V264 HydrophobicContact CD1-CG2 3.73Å; L198-L267 HydrophobicContact CD2-CD2 3.63Å
199	N	98.3	Very high	95.9	Very high	4 Å²	4	8 Å²	8	2%	0.021	5%	0.046	C	C	.	.	H	α-helix	trans	-64.5	-45.7	174.1	-75.3	-17.2	0	0	0	111.5	L63 L127 R195 V196 L197 Y202 L203 K263	L63-N199 WeakPolarHBondContact CD1-OD1 3.12Å; L63-N199 HydrophobicContact CD2-CB 4.2Å; L63-N199 WeakPolarHBondContact CG-OD1 3.5Å; L127-N199 HydrophobicContact CD1-CB 3.72Å; L127-N199 HydrophobicContact CD2-CB 4.1Å; R195-N199 WeakPolarHBondContact O-CB 3.26Å; R195-N199 PolarHBondContact O-N 2.9Å; R195-N199 PolarHBondContact O-ND2 3.2Å; R195-N199 VanDerWaalsContact O-ND2 3.14Å; R195-N199 PolarHBondContact O-OD1 2.88Å; V196-N199 PolarHBondContact O-N 3.34Å; L197-N199 VanDerWaalsContact C-N 3.3Å; L197-N199 PolarHBondContact O-N 3.46Å; N199-Y202 PolarHBondContact O-N 3.31Å; N199-L203 WeakPolarHBondContact O-CB 3.06Å; N199-L203 VanDerWaalsContact O-CG 3.26Å; N199-L203 WeakPolarHBondContact O-CG 3.27Å; N199-L203 PolarHBondContact O-N 3.05Å; N199-K263 VanDerWaalsContact OD1-CD 3.26Å; N199-K263 WeakPolarHBondContact OD1-CD 3.41Å; N199-K263 WeakPolarHBondContact OD1-CE 3.49Å
200	I	98.6	Very high	96	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62	-48.7	177.4	-56.1	156.8	0	0	0	109.9	I126 L127 A130 L163 V196 L197 Y202 L203 M204	I126-I200 HydrophobicContact CB-CD1 4.33Å; I126-I200 HydrophobicContact CG2-CD1 3.92Å; I126-I200 HydrophobicContact CG2-CG1 4.37Å; I126-I200 HydrophobicContact CG2-CG2 4.06Å; L127-I200 HydrophobicContact CB-CD1 4.19Å; L127-I200 HydrophobicContact CB-CG1 3.76Å; L127-I200 HydrophobicContact CD1-CG1 3.91Å; L127-I200 HydrophobicContact CG-CG1 4.36Å; A130-I200 HydrophobicContact CB-CG2 4.28Å; L163-I200 HydrophobicContact CD1-CB 3.99Å; L163-I200 HydrophobicContact CD1-CG2 3.48Å; L163-I200 VanDerWaalsContact CD1-CG2 3.48Å; L163-I200 HydrophobicContact CD2-CD1 3.84Å; V196-I200 HydrophobicContact CG1-CD1 4.19Å; V196-I200 WeakPolarHBondContact O-CG1 3.44Å; V196-I200 PolarHBondContact O-N 3.21Å; L197-I200 PolarHBondContact O-N 3.28Å; I200-Y202 VanDerWaalsContact C-N 3.34Å; I200-Y202 PolarHBondContact O-N 2.76Å; I200-L203 PolarHBondContact O-N 2.72Å; I200-M204 HydrophobicContact CG2-CG 4.41Å; I200-M204 HydrophobicContact CG2-SD 4.16Å; I200-M204 WeakPolarHBondContact O-CG 3.2Å; I200-M204 PolarHBondContact O-N 3.1Å
201	M	98.4	Very high	95.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.9	-38.7	-178.3	-63.7	175.8	89.1	0	0	112.3	F160 L163 V164 L167 L197 V205 I240 L267	F160-M201 HydrophobicContact CE1-CE 4.25Å; F160-M201 HydrophobicContact CE2-CB 4.2Å; F160-M201 HydrophobicContact CE2-CE 3.82Å; F160-M201 HydrophobicContact CE2-CG 4.15Å; F160-M201 HydrophobicContact CZ-CE 3.63Å; L163-M201 HydrophobicContact CB-CE 4.35Å; L163-M201 HydrophobicContact CB-CG 3.88Å; L163-M201 HydrophobicContact CB-SD 4.01Å; L163-M201 HydrophobicContact CD1-CG 3.97Å; L163-M201 HydrophobicContact CG-CG 4.49Å; V164-M201 HydrophobicContact CB-CE 4.39Å; V164-M201 HydrophobicContact CG2-CE 3.51Å; L167-M201 HydrophobicContact CB-SD 4.41Å; L167-M201 HydrophobicContact CD2-CE 4.16Å; L167-M201 HydrophobicContact CD2-SD 3.62Å; L197-M201 WeakPolarHBondContact O-CG 3.25Å; L197-M201 PolarHBondContact O-N 3.27Å; M201-V205 WeakPolarHBondContact O-CG2 3.41Å; M201-V205 PolarHBondContact O-N 2.61Å; M201-I240 HydrophobicContact CE-CD1 3.62Å; M201-L267 HydrophobicContact CB-CD1 4.26Å; M201-L267 HydrophobicContact CB-CD2 3.85Å
202	Y	98.5	Very high	95.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.7	-46.6	173.8	179.2	-88.2	0	0	0	112.1	E59 L63 L198 N199 I200 M204 V205 E206 L266 K270	E59-Y202 PolarHBondContact O-OH 2.92Å; L63-Y202 HydrophobicContact CB-CD1 4.26Å; L63-Y202 HydrophobicContact CB-CE1 4.12Å; L63-Y202 HydrophobicContact CD1-CD1 3.73Å; L63-Y202 HydrophobicContact CD1-CD2 4.37Å; L63-Y202 HydrophobicContact CD1-CE1 4.27Å; L63-Y202 HydrophobicContact CD1-CG 3.75Å; L63-Y202 HydrophobicContact CD2-CD1 3.71Å; L63-Y202 HydrophobicContact CD2-CE1 4.33Å; L63-Y202 HydrophobicContact CD2-CG 4.4Å; L63-Y202 HydrophobicContact CG-CD1 4.11Å; L63-Y202 HydrophobicContact CG-CE1 4.48Å; L198-Y202 VanDerWaalsContact O-CB 3.32Å; L198-Y202 WeakPolarHBondContact O-CB 3.26Å; L198-Y202 PolarHBondContact O-N 2.73Å; N199-Y202 PolarHBondContact O-N 3.31Å; I200-Y202 VanDerWaalsContact C-N 3.34Å; I200-Y202 PolarHBondContact O-N 2.76Å; Y202-M204 VanDerWaalsContact C-N 3.29Å; Y202-M204 PolarHBondContact O-N 3.43Å; Y202-V205 PolarHBondContact O-N 2.81Å; Y202-E206 HydrophobicContact CD1-CB 4.48Å; Y202-E206 HydrophobicContact CE1-CB 4.26Å; Y202-E206 WeakPolarHBondContact O-CB 3.18Å; Y202-E206 PolarHBondContact O-N 3.37Å; Y202-L266 HydrophobicContact CD2-CB 3.92Å; Y202-L266 HydrophobicContact CE2-CB 3.65Å; Y202-L266 HydrophobicContact CE2-CD2 4.38Å; Y202-L266 HydrophobicContact CE2-CG 4.4Å; Y202-K270 HydrophobicContact CD2-CG 4.07Å; Y202-K270 HydrophobicContact CE2-CD 4.41Å; Y202-K270 HydrophobicContact CE2-CG 3.49Å; Y202-K270 VanDerWaalsContact CE2-CG 3.49Å; Y202-K270 WeakPolarHBondContact OH-CE 3.33Å
203	L	98.3	Very high	94.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.3	-45.1	177.3	-72.5	169.7	0	0	0	110.9	L60 L63 L127 A130 Q131 M147 I151 N199 I200 T207	L60-L203 HydrophobicContact CD2-CD2 3.6Å; L63-L203 HydrophobicContact CD2-CD2 4.33Å; L63-L203 HydrophobicContact CD2-CG 4.17Å; L127-L203 HydrophobicContact CD1-CD1 3.84Å; A130-L203 HydrophobicContact CB-CD1 3.97Å; Q131-L203 HydrophobicContact CG-CD1 4.09Å; M147-L203 HydrophobicContact CE-CD2 4.07Å; M147-L203 HydrophobicContact SD-CD2 4.17Å; I151-L203 HydrophobicContact CD1-CB 4.07Å; I151-L203 WeakPolarHBondContact CD1-O 3.27Å; N199-L203 WeakPolarHBondContact O-CB 3.06Å; N199-L203 VanDerWaalsContact O-CG 3.26Å; N199-L203 WeakPolarHBondContact O-CG 3.27Å; N199-L203 PolarHBondContact O-N 3.05Å; I200-L203 PolarHBondContact O-N 2.72Å; L203-T207 WeakPolarHBondContact O-CB 3.48Å; L203-T207 PolarHBondContact O-N 2.9Å; L203-T207 PolarHBondContact O-OG1 3.18Å
204	M	98.1	Very high	94.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-53.2	176.8	-67.9	-176.8	76.4	0	0	112	I151 L154 L155 F160 L163 I200 Y202 I208	I151-M204 HydrophobicContact CG1-CG 4.35Å; I151-M204 HydrophobicContact CG2-CB 4.24Å; I151-M204 HydrophobicContact CG2-CG 4.12Å; L154-M204 HydrophobicContact CB-CE 4.1Å; L154-M204 HydrophobicContact CB-SD 4.5Å; L155-M204 HydrophobicContact CB-CE 4.04Å; L155-M204 HydrophobicContact CD1-CE 4.46Å; F160-M204 HydrophobicContact CB-CE 4.05Å; F160-M204 HydrophobicContact CB-SD 4.5Å; F160-M204 HydrophobicContact CD2-CE 4.28Å; F160-M204 HydrophobicContact CD2-SD 4.03Å; L163-M204 HydrophobicContact CD1-SD 4.1Å; I200-M204 HydrophobicContact CG2-CG 4.41Å; I200-M204 HydrophobicContact CG2-SD 4.16Å; I200-M204 WeakPolarHBondContact O-CG 3.2Å; I200-M204 PolarHBondContact O-N 3.1Å; Y202-M204 VanDerWaalsContact C-N 3.29Å; Y202-M204 PolarHBondContact O-N 3.43Å; M204-I208 WeakPolarHBondContact O-CB 3.22Å; M204-I208 WeakPolarHBondContact O-CD1 3.44Å; M204-I208 VanDerWaalsContact O-CG1 3.3Å; M204-I208 WeakPolarHBondContact O-CG1 3.31Å; M204-I208 PolarHBondContact O-N 2.97Å
205	V	97.4	Very high	94.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-48.6	-178.9	174.9	0	0	0	0	111.6	F160 M201 Y202 Q209 F226 L230 L267 K270 F274	F160-V205 HydrophobicContact CE2-CG2 4.47Å; M201-V205 WeakPolarHBondContact O-CG2 3.41Å; M201-V205 PolarHBondContact O-N 2.61Å; Y202-V205 PolarHBondContact O-N 2.81Å; V205-Q209 WeakPolarHBondContact O-CB 3.49Å; V205-Q209 PolarHBondContact O-N 3.24Å; V205-F226 HydrophobicContact CG2-CE1 4.26Å; V205-F226 HydrophobicContact CG2-CZ 4.07Å; V205-L230 HydrophobicContact CG2-CD1 4.19Å; V205-L230 HydrophobicContact CG2-CD2 4.43Å; V205-L267 HydrophobicContact CB-CD1 4.35Å; V205-L267 HydrophobicContact CG2-CD1 4.02Å; V205-K270 HydrophobicContact CG1-CB 3.8Å; V205-F274 HydrophobicContact CG1-CB 4.4Å; V205-F274 HydrophobicContact CG1-CD1 4.3Å
206	E	96.1	Very high	94	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-48.3	179.5	178.3	59	-152.5	0	0	111.6	Y202 I208 Q209 Q210 K270	Y202-E206 HydrophobicContact CD1-CB 4.48Å; Y202-E206 HydrophobicContact CE1-CB 4.26Å; Y202-E206 WeakPolarHBondContact O-CB 3.18Å; Y202-E206 PolarHBondContact O-N 3.37Å; E206-I208 PolarHBondContact O-N 3.05Å; E206-Q209 PolarHBondContact O-N 3.38Å; E206-Q210 WeakPolarHBondContact O-CG 3.13Å; E206-Q210 PolarHBondContact O-N 2.92Å; E206-Q210 PolarHBondContact OE1-NE2 2.72Å; E206-K270 IonicContact OE1-NZ 3.68Å; E206-K270 VanDerWaalsContact OE2-CD 3.22Å; E206-K270 WeakPolarHBondContact OE2-CD 3.21Å; E206-K270 VanDerWaalsContact OE2-CE 3.23Å; E206-K270 WeakPolarHBondContact OE2-CE 3.49Å; E206-K270 IonicContact OE2-NZ 3.53Å; E206-K270 PolarHBondContact OE2-NZ 2.69Å
207	T	95.6	Very high	93.8	Very high	6 Å²	6	34.5 Å²	34.5	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-69.3	-38.9	-174.2	-53.6	0	0	0	0	111.8	M147 R148 I151 L203	M147-T207 HydrophobicContact CG-CG2 4.39Å; R148-T207 HydrophobicContact CB-CG2 4.09Å; R148-T207 HydrophobicContact CG-CG2 4.23Å; R148-T207 PolarHBondContact NH1-O 2.97Å; I151-T207 HydrophobicContact CD1-CG2 3.99Å; I151-T207 VanDerWaalsContact CD1-OG1 3.29Å; I151-T207 WeakPolarHBondContact CD1-OG1 3.4Å; L203-T207 WeakPolarHBondContact O-CB 3.48Å; L203-T207 PolarHBondContact O-N 2.9Å; L203-T207 PolarHBondContact O-OG1 3.18Å
208	I	95.9	Very high	93.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-74.1	-31	176.8	-62.7	161.9	0	0	0	111	I151 F152 L155 M204 E206 Q210 K223 F226 F274	I151-I208 HydrophobicContact CG2-CD1 3.73Å; I151-I208 HydrophobicContact CG2-CG1 3.72Å; F152-I208 HydrophobicContact CE1-CG1 4.26Å; F152-I208 HydrophobicContact CE1-CG2 4.42Å; F152-I208 HydrophobicContact CZ-CG1 4.27Å; F152-I208 HydrophobicContact CZ-CG2 4.44Å; L155-I208 HydrophobicContact CD2-CD1 3.91Å; M204-I208 WeakPolarHBondContact O-CB 3.22Å; M204-I208 WeakPolarHBondContact O-CD1 3.44Å; M204-I208 VanDerWaalsContact O-CG1 3.3Å; M204-I208 WeakPolarHBondContact O-CG1 3.31Å; M204-I208 PolarHBondContact O-N 2.97Å; E206-I208 PolarHBondContact O-N 3.05Å; I208-Q210 VanDerWaalsContact C-N 3.32Å; I208-Q210 PolarHBondContact O-N 3.18Å; I208-K223 HydrophobicContact CG2-CB 4Å; I208-K223 HydrophobicContact CG2-CD 4.5Å; I208-K223 HydrophobicContact CG2-CG 3.86Å; I208-K223 VanDerWaalsContact O-CD 3.3Å; I208-K223 WeakPolarHBondContact O-CD 3.44Å; I208-K223 WeakPolarHBondContact O-CE 3.39Å; I208-K223 PolarHBondContact O-NZ 3.2Å; I208-F226 HydrophobicContact CB-CD1 4.25Å; I208-F226 HydrophobicContact CB-CE1 4.37Å; I208-F226 HydrophobicContact CD1-CD1 3.66Å; I208-F226 HydrophobicContact CD1-CE1 3.6Å; I208-F226 HydrophobicContact CD1-CZ 4.48Å; I208-F226 HydrophobicContact CG2-CD1 3.92Å; I208-F274 HydrophobicContact CG2-CE1 4.44Å; I208-F274 HydrophobicContact CG2-CZ 4.01Å
209	Q	93.6	Very high	93.5	Very high	32 Å²	32	41.6 Å²	41.6	15%	0.15	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-39.8	174.3	-174.7	-169.1	-55.1	0	0	111.8	V205 E206 K223 F274	V205-Q209 WeakPolarHBondContact O-CB 3.49Å; V205-Q209 PolarHBondContact O-N 3.24Å; E206-Q209 PolarHBondContact O-N 3.38Å; Q209-K223 PolarHBondContact O-NZ 3.42Å; Q209-F274 HydrophobicContact CB-CB 4.24Å; Q209-F274 HydrophobicContact CB-CD2 4Å; Q209-F274 HydrophobicContact CB-CG 4.12Å; Q209-F274 HydrophobicContact CG-CB 3.98Å; Q209-F274 HydrophobicContact CG-CD2 3.9Å; Q209-F274 HydrophobicContact CG-CG 4.18Å
210	Q	89.3	Confident	93.3	Very high	64 Å²	64	45.9 Å²	45.9	30%	0.299	25%	0.25	S	S	.	.	S	Bend	trans	-63.2	135.6	178.6	-61.5	-61.5	-19.5	0	0	111.7	R148 E206 I208 K223	R148-Q210 PolarHBondContact NH2-O 3.07Å; E206-Q210 WeakPolarHBondContact O-CG 3.13Å; E206-Q210 PolarHBondContact O-N 2.92Å; E206-Q210 PolarHBondContact OE1-NE2 2.72Å; I208-Q210 VanDerWaalsContact C-N 3.32Å; I208-Q210 PolarHBondContact O-N 3.18Å; Q210-K223 PolarHBondContact O-NZ 3.14Å; Q210-K223 VanDerWaalsContact O-NZ 3.1Å
211	D	83.8	Confident	93.1	Very high	123 Å²	123	51.5 Å²	51.5	66%	0.658	28%	0.279	S	S	*	.			trans	-88.9	123.1	175.4	-70.8	-47.3	0	0	0	110.5	K223	D211-K223 IonicContact OD1-NZ 2.8Å; D211-K223 PolarHBondContact OD1-NZ 2.93Å
212	D	86.1	Confident	93	Very high	65 Å²	65	53.3 Å²	53.3	35%	0.348	29%	0.288	S	S	.	.			trans	-112.6	122.9	170.2	-168.7	-26.8	0	0	0	109.9	A214 D215	D212-A214 PolarHBondContact O-N 3.27Å; D212-A214 VanDerWaalsContact O-N 3.16Å; D212-A214 WeakPolarHBondContact OD1-CB 3.43Å; D212-A214 PolarHBondContact OD1-N 2.67Å; D212-D215 PolarHBondContact N-OD2 2.79Å; D212-D215 VanDerWaalsContact O-CB 3.25Å; D212-D215 WeakPolarHBondContact O-CB 3.34Å; D212-D215 PolarHBondContact O-N 3.44Å
213	P	84.3	Confident	92.8	Very high	125 Å²	125	53.7 Å²	53.7	81%	0.812	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-31.5	172.5	-27.5	36.3	0	0	0	113.9	D215	P213-D215 VanDerWaalsContact C-N 3.31Å; P213-D215 PolarHBondContact O-N 3.18Å
214	A	87.3	Confident	92.7	Very high	86 Å²	86	58.3 Å²	58.3	71%	0.711	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-6.8	179.1	0	0	0	0	0	114.4	D212 K216	D212-A214 PolarHBondContact O-N 3.27Å; D212-A214 VanDerWaalsContact O-N 3.16Å; D212-A214 WeakPolarHBondContact OD1-CB 3.43Å; D212-A214 PolarHBondContact OD1-N 2.67Å; A214-K216 PolarHBondContact O-N 3.26Å
215	D	90	Very high	92.5	Very high	10 Å²	10	61.6 Å²	61.6	5%	0.053	33%	0.331	C	S	.	.			trans	-56.5	132.2	178.7	-82	-28.8	0	0	0	112.1	R148 D212 P213 K220	R148-D215 IonicContact CZ-OD1 3.52Å; R148-D215 IonicContact CZ-OD2 3.28Å; R148-D215 IonicContact NE-OD1 3.43Å; R148-D215 PolarHBondContact NE-OD1 3.31Å; R148-D215 IonicContact NE-OD2 3.35Å; R148-D215 VanDerWaalsContact NH2-CG 3.32Å; R148-D215 IonicContact NH2-OD1 3.05Å; R148-D215 PolarHBondContact NH2-OD1 3.29Å; R148-D215 VanDerWaalsContact NH2-OD1 3.14Å; R148-D215 IonicContact NH2-OD2 3.9Å; R148-D215 PolarHBondContact NH2-OD2 3.1Å; D212-D215 PolarHBondContact N-OD2 2.79Å; D212-D215 VanDerWaalsContact O-CB 3.25Å; D212-D215 WeakPolarHBondContact O-CB 3.34Å; D212-D215 PolarHBondContact O-N 3.44Å; P213-D215 VanDerWaalsContact C-N 3.31Å; P213-D215 PolarHBondContact O-N 3.18Å; D215-K220 HydrophobicContact CB-CD 4.4Å; D215-K220 VanDerWaalsContact CB-CE 3.48Å; D215-K220 HydrophobicContact CB-CG 4.14Å; D215-K220 WeakPolarHBondContact O-CE 3.21Å; D215-K220 PolarHBondContact O-NZ 2.88Å
216	K	91.6	Very high	92.5	Very high	104 Å²	104	61.7 Å²	61.7	45%	0.452	33%	0.332	S	S	.	.			trans	-57.6	152.2	172.5	-64	-177.6	-178.1	-179.3	0	111.4	A214 E218 W219 K220	A214-K216 PolarHBondContact O-N 3.26Å; K216-E218 HydrophobicContact CB-CB 4.47Å; K216-E218 PolarHBondContact O-N 3.31Å; K216-W219 HydrophobicContact CB-CB 4.38Å; K216-W219 HydrophobicContact CB-CG 4.22Å; K216-W219 PolarHBondContact O-N 3.17Å; K216-W219 VanDerWaalsContact O-N 3.15Å; K216-K220 PolarHBondContact O-N 3.4Å; K216-K220 VanDerWaalsContact O-N 3.13Å
217	P	93.5	Very high	92.5	Very high	95 Å²	95	64.6 Å²	64.6	62%	0.617	34%	0.343	S	S	*	.	H	α-helix	trans	-59.1	-36.1	174.1	24.9	-34	0	0	0	112.1	K220 I221	P217-K220 PolarHBondContact O-N 3.04Å; P217-I221 WeakPolarHBondContact O-CG1 3.34Å; P217-I221 PolarHBondContact O-N 2.83Å
218	E	93.3	Very high	92.4	Very high	119 Å²	119	67.3 Å²	67.3	56%	0.556	37%	0.366	S	S	*	.	H	α-helix	trans	-55.5	-51.3	173.1	-63.7	156.9	169.9	0	0	111.4	K216 K220 I221 M222	K216-E218 HydrophobicContact CB-CB 4.47Å; K216-E218 PolarHBondContact O-N 3.31Å; E218-K220 VanDerWaalsContact C-N 3.29Å; E218-K220 PolarHBondContact O-N 3.28Å; E218-I221 PolarHBondContact O-N 2.87Å; E218-I221 VanDerWaalsContact O-N 3.13Å; E218-M222 WeakPolarHBondContact O-CG 3.06Å; E218-M222 PolarHBondContact O-N 2.91Å
219	W	94.8	Very high	92.3	Very high	39 Å²	39	70.6 Å²	70.6	15%	0.148	38%	0.381	C	S	.	.	H	α-helix	trans	-64	-32.1	179.3	-71.1	1.2	0	0	0	112.8	R148 Y149 F152 K216 M222 K223	R148-W219 HydrophobicContact CG-CZ3 4.07Å; Y149-W219 HydrophobicContact CD2-CH2 4.19Å; Y149-W219 AromaticContact CD2-CZ2 3.99Å; Y149-W219 HydrophobicContact CD2-CZ2 3.99Å; F152-W219 HydrophobicContact CB-CD2 4.14Å; F152-W219 HydrophobicContact CB-CG 4.39Å; F152-W219 HydrophobicContact CB-CZ2 3.93Å; F152-W219 HydrophobicContact CD1-CB 4.03Å; F152-W219 AromaticContact CD1-CD1 3.88Å; F152-W219 HydrophobicContact CD1-CD2 4.2Å; F152-W219 AromaticContact CD1-CG 3.8Å; F152-W219 HydrophobicContact CD1-CG 3.8Å; F152-W219 HydrophobicContact CD2-CB 4.45Å; F152-W219 AromaticContact CD2-CD2 3.45Å; F152-W219 HydrophobicContact CD2-CD2 3.45Å; F152-W219 VanDerWaalsContact CD2-CD2 3.45Å; F152-W219 AromaticContact CD2-CE2 3.78Å; F152-W219 AromaticContact CD2-CE3 3.47Å; F152-W219 HydrophobicContact CD2-CE3 3.47Å; F152-W219 VanDerWaalsContact CD2-CE3 3.47Å; F152-W219 AromaticContact CD2-CG 3.93Å; F152-W219 HydrophobicContact CD2-CG 3.93Å; F152-W219 HydrophobicContact CD2-CH2 4.13Å; F152-W219 HydrophobicContact CD2-CZ2 4.11Å; F152-W219 AromaticContact CD2-CZ3 3.83Å; F152-W219 HydrophobicContact CD2-CZ3 3.83Å; F152-W219 HydrophobicContact CE1-CB 3.72Å; F152-W219 HydrophobicContact CE1-CG 4Å; F152-W219 WeakPolarHBondContact CE1-O 3.36Å; F152-W219 HydrophobicContact CE2-CB 4.16Å; F152-W219 AromaticContact CE2-CD2 3.83Å; F152-W219 HydrophobicContact CE2-CD2 3.83Å; F152-W219 AromaticContact CE2-CE3 3.6Å; F152-W219 HydrophobicContact CE2-CE3 3.6Å; F152-W219 HydrophobicContact CE2-CG 4.12Å; F152-W219 HydrophobicContact CE2-CZ3 4.2Å; F152-W219 HydrophobicContact CG-CB 4.4Å; F152-W219 AromaticContact CG-CD1 3.87Å; F152-W219 AromaticContact CG-CD2 3.67Å; F152-W219 HydrophobicContact CG-CD2 3.67Å; F152-W219 AromaticContact CG-CE2 3.72Å; F152-W219 HydrophobicContact CG-CE3 4.19Å; F152-W219 AromaticContact CG-CG 3.78Å; F152-W219 HydrophobicContact CG-CG 3.78Å; F152-W219 HydrophobicContact CG-CZ2 4.27Å; F152-W219 AromaticContact CG-NE1 3.85Å; F152-W219 HydrophobicContact CZ-CB 3.8Å; F152-W219 HydrophobicContact CZ-CD2 4.36Å; F152-W219 HydrophobicContact CZ-CE3 4.4Å; F152-W219 HydrophobicContact CZ-CG 4.16Å; K216-W219 HydrophobicContact CB-CB 4.38Å; K216-W219 HydrophobicContact CB-CG 4.22Å; K216-W219 PolarHBondContact O-N 3.17Å; K216-W219 VanDerWaalsContact O-N 3.15Å; W219-M222 PolarHBondContact O-N 3.11Å; W219-K223 VanDerWaalsContact O-CB 3.29Å; W219-K223 WeakPolarHBondContact O-CB 3.45Å; W219-K223 PolarHBondContact O-N 3.13Å
220	K	94.1	Very high	92.3	Very high	95 Å²	95	69.1 Å²	69.1	41%	0.413	37%	0.374	S	S	.	.	H	α-helix	trans	-68.9	-37.2	173.8	-69.3	170	178	150.5	0	112.1	D215 K216 P217 E218 E224	D215-K220 HydrophobicContact CB-CD 4.4Å; D215-K220 VanDerWaalsContact CB-CE 3.48Å; D215-K220 HydrophobicContact CB-CG 4.14Å; D215-K220 WeakPolarHBondContact O-CE 3.21Å; D215-K220 PolarHBondContact O-NZ 2.88Å; K216-K220 PolarHBondContact O-N 3.4Å; K216-K220 VanDerWaalsContact O-N 3.13Å; P217-K220 PolarHBondContact O-N 3.04Å; E218-K220 VanDerWaalsContact C-N 3.29Å; E218-K220 PolarHBondContact O-N 3.28Å; K220-E224 PolarHBondContact O-N 3.07Å
221	I	95.2	Very high	92.3	Very high	117 Å²	117	66.4 Å²	66.4	60%	0.6	36%	0.364	S	S	*	.	H	α-helix	trans	-68.2	-46.2	172.9	-65.1	163.9	0	0	0	110.4	P217 E218 K223 E224 T225	P217-I221 WeakPolarHBondContact O-CG1 3.34Å; P217-I221 PolarHBondContact O-N 2.83Å; E218-I221 PolarHBondContact O-N 2.87Å; E218-I221 VanDerWaalsContact O-N 3.13Å; I221-K223 VanDerWaalsContact C-N 3.29Å; I221-K223 PolarHBondContact O-N 2.75Å; I221-E224 PolarHBondContact O-N 2.97Å; I221-T225 WeakPolarHBondContact O-CB 3.29Å; I221-T225 PolarHBondContact O-N 3.03Å; I221-T225 PolarHBondContact O-OG1 2.63Å
222	M	95.5	Very high	92.5	Very high	38 Å²	38	61.8 Å²	61.8	19%	0.187	34%	0.341	C	S	.	.	H	α-helix	trans	-58.4	-40.3	175.3	-68.3	177.7	80.3	0	0	112.1	F152 L155 D156 E218 W219 T225 F226	F152-M222 HydrophobicContact CD1-CB 4.44Å; F152-M222 HydrophobicContact CD1-CE 4.5Å; F152-M222 HydrophobicContact CD1-SD 4.21Å; F152-M222 HydrophobicContact CE1-CB 4.38Å; L155-M222 HydrophobicContact CB-CE 4.03Å; L155-M222 HydrophobicContact CD2-CB 4.17Å; L155-M222 HydrophobicContact CD2-CE 3.91Å; L155-M222 HydrophobicContact CG-CE 3.89Å; D156-M222 HydrophobicContact CB-CE 3.64Å; E218-M222 WeakPolarHBondContact O-CG 3.06Å; E218-M222 PolarHBondContact O-N 2.91Å; W219-M222 PolarHBondContact O-N 3.11Å; M222-T225 PolarHBondContact O-N 3.07Å; M222-F226 VanDerWaalsContact O-CB 3.27Å; M222-F226 WeakPolarHBondContact O-CB 3.22Å; M222-F226 PolarHBondContact O-N 3.06Å
223	K	95.9	Very high	92.4	Very high	9 Å²	9	61.7 Å²	61.7	4%	0.039	34%	0.344	C	S	.	.	H	α-helix	trans	-58.7	-52.5	177.5	175.9	170.7	-175.3	162.7	0	112.3	I208 Q209 Q210 D211 W219 I221 R227 F274	I208-K223 HydrophobicContact CG2-CB 4Å; I208-K223 HydrophobicContact CG2-CD 4.5Å; I208-K223 HydrophobicContact CG2-CG 3.86Å; I208-K223 VanDerWaalsContact O-CD 3.3Å; I208-K223 WeakPolarHBondContact O-CD 3.44Å; I208-K223 WeakPolarHBondContact O-CE 3.39Å; I208-K223 PolarHBondContact O-NZ 3.2Å; Q209-K223 PolarHBondContact O-NZ 3.42Å; Q210-K223 PolarHBondContact O-NZ 3.14Å; Q210-K223 VanDerWaalsContact O-NZ 3.1Å; D211-K223 IonicContact OD1-NZ 2.8Å; D211-K223 PolarHBondContact OD1-NZ 2.93Å; W219-K223 VanDerWaalsContact O-CB 3.29Å; W219-K223 WeakPolarHBondContact O-CB 3.45Å; W219-K223 PolarHBondContact O-N 3.13Å; I221-K223 VanDerWaalsContact C-N 3.29Å; I221-K223 PolarHBondContact O-N 2.75Å; K223-R227 VanDerWaalsContact O-CB 3.27Å; K223-R227 WeakPolarHBondContact O-CB 3.2Å; K223-R227 PolarHBondContact O-N 2.84Å; K223-F274 HydrophobicContact CG-CE2 4.12Å; K223-F274 HydrophobicContact CG-CZ 4.04Å
224	E	94.9	Very high	92.1	Very high	97 Å²	97	61 Å²	61	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-72	-29.3	179.4	-63.9	-57.2	136.7	0	0	112.4	K220 I221 R227 A228	K220-E224 PolarHBondContact O-N 3.07Å; I221-E224 PolarHBondContact O-N 2.97Å; E224-R227 PolarHBondContact O-N 2.84Å; E224-R227 IonicContact OE1-NH1 3.27Å; E224-R227 VanDerWaalsContact OE2-CD 3.27Å; E224-R227 WeakPolarHBondContact OE2-CD 3.43Å; E224-R227 IonicContact OE2-CZ 2.71Å; E224-R227 IonicContact OE2-NH1 2.83Å; E224-R227 PolarHBondContact OE2-NH1 2.88Å; E224-A228 WeakPolarHBondContact O-CB 3.42Å; E224-A228 PolarHBondContact O-N 3.02Å
225	T	95.4	Very high	91.3	Very high	69 Å²	69	58.5 Å²	58.5	42%	0.423	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-54.3	172	-53.6	0	0	0	0	110.7	I221 M222 R227 A228 E229	I221-T225 WeakPolarHBondContact O-CB 3.29Å; I221-T225 PolarHBondContact O-N 3.03Å; I221-T225 PolarHBondContact O-OG1 2.63Å; M222-T225 PolarHBondContact O-N 3.07Å; T225-R227 VanDerWaalsContact C-N 3.27Å; T225-R227 PolarHBondContact O-N 3.01Å; T225-A228 WeakPolarHBondContact O-CB 3.24Å; T225-A228 PolarHBondContact O-N 3.14Å; T225-E229 WeakPolarHBondContact O-CG 3.44Å; T225-E229 PolarHBondContact O-N 3.48Å
226	F	96.4	Very high	90.3	Very high	1 Å²	1	63.7 Å²	63.7	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-36.4	177.1	180	-128.6	0	0	0	112.4	L155 F160 V205 I208 M222 E229 L230 F274	L155-F226 HydrophobicContact CD1-CB 4.28Å; L155-F226 HydrophobicContact CD1-CD2 3.67Å; L155-F226 HydrophobicContact CD1-CE2 4.15Å; L155-F226 HydrophobicContact CD1-CG 4Å; L155-F226 HydrophobicContact CD2-CB 3.89Å; L155-F226 HydrophobicContact CD2-CD1 4.45Å; L155-F226 HydrophobicContact CD2-CG 4.1Å; F160-F226 HydrophobicContact CB-CE2 4.26Å; F160-F226 AromaticContact CD1-CE2 3.72Å; F160-F226 HydrophobicContact CD1-CE2 3.72Å; F160-F226 AromaticContact CD2-CE2 3.7Å; F160-F226 HydrophobicContact CD2-CE2 3.7Å; F160-F226 AromaticContact CD2-CZ 3.76Å; F160-F226 HydrophobicContact CD2-CZ 3.76Å; F160-F226 AromaticContact CE1-CE2 3.92Å; F160-F226 HydrophobicContact CE1-CE2 3.92Å; F160-F226 AromaticContact CE2-CE2 3.91Å; F160-F226 HydrophobicContact CE2-CE2 3.91Å; F160-F226 AromaticContact CE2-CZ 3.75Å; F160-F226 HydrophobicContact CE2-CZ 3.75Å; F160-F226 AromaticContact CG-CE2 3.6Å; F160-F226 HydrophobicContact CG-CE2 3.6Å; F160-F226 HydrophobicContact CG-CZ 4.16Å; F160-F226 HydrophobicContact CZ-CE2 4.01Å; F160-F226 HydrophobicContact CZ-CZ 4.14Å; V205-F226 HydrophobicContact CG2-CE1 4.26Å; V205-F226 HydrophobicContact CG2-CZ 4.07Å; I208-F226 HydrophobicContact CB-CD1 4.25Å; I208-F226 HydrophobicContact CB-CE1 4.37Å; I208-F226 HydrophobicContact CD1-CD1 3.66Å; I208-F226 HydrophobicContact CD1-CE1 3.6Å; I208-F226 HydrophobicContact CD1-CZ 4.48Å; I208-F226 HydrophobicContact CG2-CD1 3.92Å; M222-F226 VanDerWaalsContact O-CB 3.27Å; M222-F226 WeakPolarHBondContact O-CB 3.22Å; M222-F226 PolarHBondContact O-N 3.06Å; F226-E229 PolarHBondContact O-N 3.47Å; F226-L230 HydrophobicContact CD1-CD1 4Å; F226-L230 HydrophobicContact CD2-CD1 4.29Å; F226-L230 HydrophobicContact CD2-CG 4.16Å; F226-L230 HydrophobicContact CE1-CD1 3.72Å; F226-L230 HydrophobicContact CE1-CG 4.5Å; F226-L230 HydrophobicContact CE2-CD1 4Å; F226-L230 HydrophobicContact CE2-CD2 3.94Å; F226-L230 HydrophobicContact CE2-CG 3.88Å; F226-L230 HydrophobicContact CG-CD1 4.28Å; F226-L230 HydrophobicContact CZ-CD1 3.73Å; F226-L230 HydrophobicContact CZ-CD2 4.05Å; F226-L230 HydrophobicContact CZ-CG 4.08Å; F226-L230 WeakPolarHBondContact O-CB 3.39Å; F226-L230 WeakPolarHBondContact O-CG 3.29Å; F226-L230 PolarHBondContact O-N 2.92Å; F226-F274 AromaticContact CD1-CE1 3.76Å; F226-F274 HydrophobicContact CD1-CE1 3.76Å; F226-F274 HydrophobicContact CD1-CZ 4.43Å; F226-F274 HydrophobicContact CE1-CE1 4.17Å
227	R	96	Very high	89.7	Confident	62 Å²	62	65.8 Å²	65.8	23%	0.234	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-41.5	173.9	-167.6	-175.5	178.3	-154.8	-6.8	112.6	K223 E224 T225 G231 F274 T275	K223-R227 VanDerWaalsContact O-CB 3.27Å; K223-R227 WeakPolarHBondContact O-CB 3.2Å; K223-R227 PolarHBondContact O-N 2.84Å; E224-R227 PolarHBondContact O-N 2.84Å; E224-R227 IonicContact OE1-NH1 3.27Å; E224-R227 VanDerWaalsContact OE2-CD 3.27Å; E224-R227 WeakPolarHBondContact OE2-CD 3.43Å; E224-R227 IonicContact OE2-CZ 2.71Å; E224-R227 IonicContact OE2-NH1 2.83Å; E224-R227 PolarHBondContact OE2-NH1 2.88Å; T225-R227 VanDerWaalsContact C-N 3.27Å; T225-R227 PolarHBondContact O-N 3.01Å; R227-G231 PolarHBondContact O-N 2.85Å; R227-F274 HydrophobicContact CB-CE1 3.9Å; R227-F274 HydrophobicContact CB-CE2 3.96Å; R227-F274 HydrophobicContact CB-CZ 3.54Å; R227-F274 HydrophobicContact CG-CD1 4.45Å; R227-F274 HydrophobicContact CG-CD2 4.12Å; R227-F274 HydrophobicContact CG-CE1 4.2Å; R227-F274 HydrophobicContact CG-CE2 3.85Å; R227-F274 HydrophobicContact CG-CG 4.41Å; R227-F274 HydrophobicContact CG-CZ 3.9Å; R227-F274 PolarHBondContact NE-O 3.35Å; R227-T275 PolarHBondContact NH2-O 2.95Å
228	A	93.4	Very high	89.3	Confident	64 Å²	64	65.4 Å²	65.4	53%	0.529	34%	0.34	S	S	.	.	H	α-helix	trans	-66.9	-45.6	175.1	0	0	0	0	0	111	E224 T225 L230 G231 S232	E224-A228 WeakPolarHBondContact O-CB 3.42Å; E224-A228 PolarHBondContact O-N 3.02Å; T225-A228 WeakPolarHBondContact O-CB 3.24Å; T225-A228 PolarHBondContact O-N 3.14Å; A228-L230 PolarHBondContact O-N 2.91Å; A228-G231 PolarHBondContact O-N 3.11Å; A228-G231 VanDerWaalsContact O-N 3.14Å; A228-S232 VanDerWaalsContact O-CB 3.26Å; A228-S232 WeakPolarHBondContact O-CB 3.23Å; A228-S232 PolarHBondContact O-N 2.99Å; A228-S232 VanDerWaalsContact O-N 3.1Å; A228-S232 PolarHBondContact O-OG 2.97Å
229	E	93.1	Very high	89.2	Confident	68 Å²	68	60 Å²	60	32%	0.318	32%	0.316	S	S	.	.	H	α-helix	trans	-54.4	-53.4	176.3	-70.6	169.7	174.6	0	0	111.7	T225 F226 G231 S232 L234	T225-E229 WeakPolarHBondContact O-CG 3.44Å; T225-E229 PolarHBondContact O-N 3.48Å; F226-E229 PolarHBondContact O-N 3.47Å; E229-G231 PolarHBondContact O-N 3.39Å; E229-S232 WeakPolarHBondContact CA-OG 3.36Å; E229-S232 PolarHBondContact O-N 2.99Å; E229-S232 PolarHBondContact O-OG 3.47Å; E229-L234 HydrophobicContact CB-CD1 3.99Å; E229-L234 HydrophobicContact CG-CD1 3.85Å
230	L	93.7	Very high	89.2	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-31.4	177.8	-69.7	168.5	0	0	0	113.9	F160 V205 F226 A228 I240 F274 T275	F160-L230 HydrophobicContact CE1-CD2 3.66Å; F160-L230 HydrophobicContact CE2-CD2 4.35Å; F160-L230 HydrophobicContact CZ-CD2 3.43Å; F160-L230 VanDerWaalsContact CZ-CD2 3.43Å; V205-L230 HydrophobicContact CG2-CD1 4.19Å; V205-L230 HydrophobicContact CG2-CD2 4.43Å; F226-L230 HydrophobicContact CD1-CD1 4Å; F226-L230 HydrophobicContact CD2-CD1 4.29Å; F226-L230 HydrophobicContact CD2-CG 4.16Å; F226-L230 HydrophobicContact CE1-CD1 3.72Å; F226-L230 HydrophobicContact CE1-CG 4.5Å; F226-L230 HydrophobicContact CE2-CD1 4Å; F226-L230 HydrophobicContact CE2-CD2 3.94Å; F226-L230 HydrophobicContact CE2-CG 3.88Å; F226-L230 HydrophobicContact CG-CD1 4.28Å; F226-L230 HydrophobicContact CZ-CD1 3.73Å; F226-L230 HydrophobicContact CZ-CD2 4.05Å; F226-L230 HydrophobicContact CZ-CG 4.08Å; F226-L230 WeakPolarHBondContact O-CB 3.39Å; F226-L230 WeakPolarHBondContact O-CG 3.29Å; F226-L230 PolarHBondContact O-N 2.92Å; A228-L230 PolarHBondContact O-N 2.91Å; L230-I240 HydrophobicContact CB-CG2 4.43Å; L230-I240 HydrophobicContact CD2-CD1 4.4Å; L230-I240 HydrophobicContact CD2-CG2 3.85Å; L230-F274 HydrophobicContact CD1-CD1 3.53Å; L230-F274 HydrophobicContact CD1-CE1 3.66Å; L230-T275 HydrophobicContact CB-CG2 3.64Å
231	G	90.3	Very high	89.2	Confident	8 Å²	8	53.9 Å²	53.9	8%	0.082	29%	0.29	C	S	.	.	H	α-helix	trans	-84.1	-9.6	178.6	0	0	0	0	0	114.2	R227 A228 E229	R227-G231 PolarHBondContact O-N 2.85Å; A228-G231 PolarHBondContact O-N 3.11Å; A228-G231 VanDerWaalsContact O-N 3.14Å; E229-G231 PolarHBondContact O-N 3.39Å
232	S	87.9	Confident	89.3	Confident	25 Å²	25	48.3 Å²	48.3	18%	0.175	26%	0.262	C	S	.	.	S	Bend	trans	-107.8	156.3	-170.2	72.6	0	0	0	0	112.9	A228 E229 L234 P239	A228-S232 VanDerWaalsContact O-CB 3.26Å; A228-S232 WeakPolarHBondContact O-CB 3.23Å; A228-S232 PolarHBondContact O-N 2.99Å; A228-S232 VanDerWaalsContact O-N 3.1Å; A228-S232 PolarHBondContact O-OG 2.97Å; E229-S232 WeakPolarHBondContact CA-OG 3.36Å; E229-S232 PolarHBondContact O-N 2.99Å; E229-S232 PolarHBondContact O-OG 3.47Å; S232-L234 PolarHBondContact O-N 2.74Å; S232-L234 VanDerWaalsContact OG-CD1 3.3Å; S232-L234 WeakPolarHBondContact OG-CD1 3.34Å; S232-L234 VanDerWaalsContact OG-CG 3.3Å; S232-L234 WeakPolarHBondContact OG-CG 3.25Å; S232-P239 WeakPolarHBondContact O-CA 3.36Å
233	P	83.2	Confident	89.3	Confident	63 Å²	63	47.7 Å²	47.7	41%	0.409	26%	0.258	S	S	.	.	S	Bend	trans	-79.3	37.7	-177.3	33.6	-37.1	0	0	0	114.3	F235 N237	P233-F235 VanDerWaalsContact C-N 3.3Å; P233-F235 PolarHBondContact O-N 3.14Å; P233-N237 VanDerWaalsContact CB-C 3.46Å; P233-N237 VanDerWaalsContact CB-O 3.28Å; P233-N237 WeakPolarHBondContact CB-O 3.25Å; P233-N237 VanDerWaalsContact O-CA 3.31Å; P233-N237 WeakPolarHBondContact O-CA 3.33Å
234	L	77.8	Confident	89.3	Confident	112 Å²	112	47.2 Å²	47.2	59%	0.586	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.7	-176.8	-74.7	168.8	0	0	0	113.9	E229 S232	E229-L234 HydrophobicContact CB-CD1 3.99Å; E229-L234 HydrophobicContact CG-CD1 3.85Å; S232-L234 PolarHBondContact O-N 2.74Å; S232-L234 VanDerWaalsContact OG-CD1 3.3Å; S232-L234 WeakPolarHBondContact OG-CD1 3.34Å; S232-L234 VanDerWaalsContact OG-CG 3.3Å; S232-L234 WeakPolarHBondContact OG-CG 3.25Å
235	F	72	Confident	89.5	Confident	32 Å²	32	42.6 Å²	42.6	14%	0.14	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-108.5	113.9	-174.3	-54.3	-77.6	0	0	0	109.6	V164 P233 N237 E238	V164-F235 HydrophobicContact CB-CD1 3.91Å; V164-F235 HydrophobicContact CB-CE1 4.04Å; V164-F235 HydrophobicContact CB-CG 4.29Å; V164-F235 HydrophobicContact CG1-CB 3.76Å; V164-F235 HydrophobicContact CG1-CD1 3.59Å; V164-F235 HydrophobicContact CG1-CD2 4.22Å; V164-F235 HydrophobicContact CG1-CE1 4.22Å; V164-F235 HydrophobicContact CG1-CG 3.58Å; V164-F235 HydrophobicContact CG2-CD1 4.33Å; V164-F235 HydrophobicContact CG2-CD2 4.46Å; V164-F235 HydrophobicContact CG2-CE1 4.17Å; V164-F235 HydrophobicContact CG2-CE2 4.3Å; V164-F235 HydrophobicContact CG2-CG 4.47Å; V164-F235 HydrophobicContact CG2-CZ 4.16Å; P233-F235 VanDerWaalsContact C-N 3.3Å; P233-F235 PolarHBondContact O-N 3.14Å; F235-N237 PolarHBondContact O-N 3.29Å; F235-N237 VanDerWaalsContact O-N 3.12Å; F235-E238 PolarHBondContact O-N 3.48Å
236	N	68.2	Low	89.5	Confident	120 Å²	120	40.3 Å²	40.3	64%	0.642	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	30.6	-178.3	-67.6	-24.7	0	0	0	115.1	N168 E238	N168-N236 PolarHBondContact OD1-ND2 2.87Å; N236-E238 PolarHBondContact O-N 3.14Å
237	N	79	Confident	89.6	Confident	148 Å²	148	40.3 Å²	40.3	79%	0.791	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	15.5	-175.3	-56.3	-50.1	0	0	0	115.6	P233 F235	P233-N237 VanDerWaalsContact CB-C 3.46Å; P233-N237 VanDerWaalsContact CB-O 3.28Å; P233-N237 WeakPolarHBondContact CB-O 3.25Å; P233-N237 VanDerWaalsContact O-CA 3.31Å; P233-N237 WeakPolarHBondContact O-CA 3.33Å; F235-N237 PolarHBondContact O-N 3.29Å; F235-N237 VanDerWaalsContact O-N 3.12Å
238	E	85.2	Confident	89.6	Confident	86 Å²	86	37.4 Å²	37.4	40%	0.402	21%	0.214	S	C	.	.	B	Isolated β-bridge	trans	-133.4	143	179.5	-66.3	-171.7	170.4	0	0	112.2	F235 N236 V242	F235-E238 PolarHBondContact O-N 3.48Å; N236-E238 PolarHBondContact O-N 3.14Å; E238-V242 HydrophobicContact CB-CB 4.14Å; E238-V242 HydrophobicContact CB-CG1 4.48Å; E238-V242 HydrophobicContact CG-CG1 4.49Å; E238-V242 WeakPolarHBondContact OE2-CG1 3.29Å
239	P	91.3	Very high	89.8	Confident	7 Å²	7	35.9 Å²	35.9	5%	0.045	20%	0.198	C	C	.	.			trans	-61.4	146.8	170.2	-23.1	33.4	0	0	0	111.9	S232 S241 V242	S232-P239 WeakPolarHBondContact O-CA 3.36Å; P239-S241 PolarHBondContact O-N 2.88Å; P239-V242 HydrophobicContact CB-CG2 4.34Å; P239-V242 HydrophobicContact CG-CG2 4.4Å; P239-V242 WeakPolarHBondContact O-CB 3.39Å; P239-V242 PolarHBondContact O-N 2.81Å
240	I	93.8	Very high	89.8	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.015	20%	0.196	C	C	.	.	H	α-helix	trans	-53.2	-32.8	-175.4	-167.5	176.7	0	0	0	113.8	F160 V164 M201 L230 V242 M243 L244	F160-I240 HydrophobicContact CE1-CD1 4.18Å; F160-I240 HydrophobicContact CZ-CD1 3.68Å; V164-I240 HydrophobicContact CG2-CD1 4.28Å; M201-I240 HydrophobicContact CE-CD1 3.62Å; L230-I240 HydrophobicContact CB-CG2 4.43Å; L230-I240 HydrophobicContact CD2-CD1 4.4Å; L230-I240 HydrophobicContact CD2-CG2 3.85Å; I240-V242 VanDerWaalsContact C-N 3.25Å; I240-V242 PolarHBondContact O-N 3.32Å; I240-M243 HydrophobicContact CD1-CE 4.44Å; I240-M243 HydrophobicContact CG1-CE 3.79Å; I240-M243 PolarHBondContact O-N 3.31Å; I240-L244 HydrophobicContact CG1-CD1 4.16Å; I240-L244 HydrophobicContact CG1-CG 4.46Å; I240-L244 WeakPolarHBondContact O-CG 3.38Å; I240-L244 PolarHBondContact O-N 2.8Å
241	S	95.7	Very high	89.9	Confident	2 Å²	2	36 Å²	36	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-32	176	-63.8	0	0	0	0	112.8	P239 F245 L268	P239-S241 PolarHBondContact O-N 2.88Å; S241-F245 WeakPolarHBondContact O-CB 3.47Å; S241-F245 WeakPolarHBondContact O-CD2 3.36Å; S241-F245 PolarHBondContact O-N 3.45Å; S241-L268 WeakPolarHBondContact O-CD1 3.39Å
242	V	95.9	Very high	90	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-73.6	-43.5	177.4	-167.4	0	0	0	0	110.8	E238 P239 I240 L244 F245 G246 L488 I492	E238-V242 HydrophobicContact CB-CB 4.14Å; E238-V242 HydrophobicContact CB-CG1 4.48Å; E238-V242 HydrophobicContact CG-CG1 4.49Å; E238-V242 WeakPolarHBondContact OE2-CG1 3.29Å; P239-V242 HydrophobicContact CB-CG2 4.34Å; P239-V242 HydrophobicContact CG-CG2 4.4Å; P239-V242 WeakPolarHBondContact O-CB 3.39Å; P239-V242 PolarHBondContact O-N 2.81Å; I240-V242 VanDerWaalsContact C-N 3.25Å; I240-V242 PolarHBondContact O-N 3.32Å; V242-L244 VanDerWaalsContact C-N 3.31Å; V242-L244 PolarHBondContact O-N 2.97Å; V242-F245 CarbonylContact O-C 3.59Å; V242-F245 WeakPolarHBondContact O-CA 3.44Å; V242-F245 VanDerWaalsContact O-CB 3.31Å; V242-F245 WeakPolarHBondContact O-CB 3.03Å; V242-F245 PolarHBondContact O-N 3.37Å; V242-F245 VanDerWaalsContact O-N 3.11Å; V242-G246 PolarHBondContact O-N 3.02Å; V242-L488 HydrophobicContact CG2-CD1 4.07Å; V242-I492 HydrophobicContact CG1-CG2 4.32Å; V242-I492 HydrophobicContact CG2-CG2 4.02Å
243	M	95.4	Very high	90.2	Very high	24 Å²	24	37.9 Å²	37.9	12%	0.118	21%	0.21	C	C	.	.	H	α-helix	trans	-56.6	-44	172.2	-178.8	-168.3	75.9	0	0	111.8	V164 L167 N168 I171 I240 G246 M247	V164-M243 HydrophobicContact CG1-SD 4.43Å; L167-M243 HydrophobicContact CD2-CE 3.56Å; L167-M243 HydrophobicContact CG-CE 4.04Å; N168-M243 PolarHBondContact ND2-SD 2.72Å; I171-M243 HydrophobicContact CD1-CE 4.33Å; I171-M243 HydrophobicContact CD1-CG 4Å; I171-M243 HydrophobicContact CD1-SD 4.12Å; I240-M243 HydrophobicContact CD1-CE 4.44Å; I240-M243 HydrophobicContact CG1-CE 3.79Å; I240-M243 PolarHBondContact O-N 3.31Å; M243-G246 WeakPolarHBondContact O-CA 3.43Å; M243-G246 PolarHBondContact O-N 3.11Å; M243-G246 VanDerWaalsContact O-N 3.1Å; M243-M247 PolarHBondContact O-N 3.25Å
244	L	97.7	Very high	90.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-36.8	175.8	-67.9	166.9	0	0	0	112.2	L198 I240 V242 G246 M247 V248 V264 L267 L268	L198-L244 HydrophobicContact CD2-CD2 4.22Å; I240-L244 HydrophobicContact CG1-CD1 4.16Å; I240-L244 HydrophobicContact CG1-CG 4.46Å; I240-L244 WeakPolarHBondContact O-CG 3.38Å; I240-L244 PolarHBondContact O-N 2.8Å; V242-L244 VanDerWaalsContact C-N 3.31Å; V242-L244 PolarHBondContact O-N 2.97Å; L244-G246 VanDerWaalsContact C-N 3.3Å; L244-G246 PolarHBondContact O-N 2.85Å; L244-M247 HydrophobicContact CD2-SD 3.95Å; L244-M247 WeakPolarHBondContact O-CB 3.23Å; L244-M247 PolarHBondContact O-N 2.76Å; L244-V248 WeakPolarHBondContact O-CG2 3.22Å; L244-V248 PolarHBondContact O-N 2.91Å; L244-V248 VanDerWaalsContact O-N 3.14Å; L244-V264 HydrophobicContact CD2-CG1 4.28Å; L244-L267 HydrophobicContact CD1-CB 4.43Å; L244-L267 HydrophobicContact CD1-CD2 4.05Å; L244-L267 HydrophobicContact CD1-CG 3.81Å; L244-L267 HydrophobicContact CD2-CD2 4.06Å; L244-L268 HydrophobicContact CB-CB 4.14Å; L244-L268 HydrophobicContact CB-CD1 4.02Å; L244-L268 HydrophobicContact CB-CG 4.49Å; L244-L268 HydrophobicContact CD1-CB 4.32Å
245	F	97.9	Very high	90.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-39	167.3	-90.4	-58.7	0	0	0	112.1	S241 V242 M247 V248 T249 L268 I272 I492 Y499 L503 I560 L564	S241-F245 WeakPolarHBondContact O-CB 3.47Å; S241-F245 WeakPolarHBondContact O-CD2 3.36Å; S241-F245 PolarHBondContact O-N 3.45Å; V242-F245 CarbonylContact O-C 3.59Å; V242-F245 WeakPolarHBondContact O-CA 3.44Å; V242-F245 VanDerWaalsContact O-CB 3.31Å; V242-F245 WeakPolarHBondContact O-CB 3.03Å; V242-F245 PolarHBondContact O-N 3.37Å; V242-F245 VanDerWaalsContact O-N 3.11Å; F245-M247 PolarHBondContact O-N 2.84Å; F245-V248 WeakPolarHBondContact O-CB 3.48Å; F245-V248 PolarHBondContact O-N 2.72Å; F245-T249 PolarHBondContact O-N 3Å; F245-T249 VanDerWaalsContact O-N 3.09Å; F245-T249 PolarHBondContact O-OG1 3.33Å; F245-T249 VanDerWaalsContact O-OG1 3.12Å; F245-L268 HydrophobicContact CD1-CD2 3.92Å; F245-L268 HydrophobicContact CD2-CD1 3.93Å; F245-L268 HydrophobicContact CD2-CD2 4.41Å; F245-L268 HydrophobicContact CE1-CD2 3.84Å; F245-L268 HydrophobicContact CE2-CD1 3.88Å; F245-L268 HydrophobicContact CE2-CD2 4.34Å; F245-L268 HydrophobicContact CG-CD1 4.41Å; F245-L268 HydrophobicContact CG-CD2 4.19Å; F245-L268 HydrophobicContact CZ-CD1 4.32Å; F245-L268 HydrophobicContact CZ-CD2 4.04Å; F245-I272 HydrophobicContact CE2-CD1 3.99Å; F245-I272 HydrophobicContact CZ-CD1 4.22Å; F245-I492 HydrophobicContact CD2-CG2 3.76Å; F245-I492 HydrophobicContact CE2-CG2 4.18Å; F245-Y499 VanDerWaalsContact C-CE1 3.47Å; F245-Y499 HydrophobicContact CB-CD1 3.68Å; F245-Y499 HydrophobicContact CB-CD2 4.28Å; F245-Y499 HydrophobicContact CB-CE1 3.65Å; F245-Y499 HydrophobicContact CB-CE2 4.25Å; F245-Y499 HydrophobicContact CB-CG 4.03Å; F245-Y499 HydrophobicContact CD1-CD1 4.1Å; F245-Y499 AromaticContact CD1-CG 3.91Å; F245-Y499 HydrophobicContact CD1-CG 3.91Å; F245-Y499 HydrophobicContact CG-CD1 4.23Å; F245-Y499 HydrophobicContact CG-CD2 4.39Å; F245-Y499 HydrophobicContact CG-CG 4.14Å; F245-Y499 WeakPolarHBondContact O-CD1 3.41Å; F245-Y499 WeakPolarHBondContact O-CE1 3.18Å; F245-L503 HydrophobicContact CE1-CD1 3.98Å; F245-L503 HydrophobicContact CE1-CG 4.4Å; F245-I560 HydrophobicContact CZ-CG2 4Å; F245-L564 HydrophobicContact CE2-CD1 4.18Å; F245-L564 HydrophobicContact CZ-CD1 3.75Å
246	G	96.3	Very high	91.8	Very high	21 Å²	21	36.3 Å²	36.3	22%	0.216	21%	0.206	C	C	.	.	H	α-helix	trans	-55.4	-46.9	170.9	0	0	0	0	0	112.6	V242 M243 L244 V248 T249 K250	V242-G246 PolarHBondContact O-N 3.02Å; M243-G246 WeakPolarHBondContact O-CA 3.43Å; M243-G246 PolarHBondContact O-N 3.11Å; M243-G246 VanDerWaalsContact O-N 3.1Å; L244-G246 VanDerWaalsContact C-N 3.3Å; L244-G246 PolarHBondContact O-N 2.85Å; G246-V248 PolarHBondContact O-N 2.83Å; G246-T249 WeakPolarHBondContact CA-OG1 3.12Å; G246-T249 PolarHBondContact O-N 3.48Å; G246-T249 PolarHBondContact O-OG1 3.08Å; G246-K250 PolarHBondContact O-N 3.38Å
247	M	97.1	Very high	92.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-44.7	174.2	-64.1	-173.6	80	0	0	112.3	L167 I171 L194 L198 M243 L244 F245 T249 K250 F251 F259 V264	L167-M247 HydrophobicContact CD1-CE 4.36Å; L167-M247 HydrophobicContact CD1-SD 4.4Å; I171-M247 HydrophobicContact CD1-CE 4.19Å; I171-M247 HydrophobicContact CD1-CG 3.57Å; I171-M247 HydrophobicContact CD1-SD 3.57Å; I171-M247 VanDerWaalsContact CD1-SD 3.57Å; I171-M247 HydrophobicContact CG1-CE 3.83Å; I171-M247 HydrophobicContact CG1-CG 3.84Å; I171-M247 HydrophobicContact CG1-SD 3.9Å; L194-M247 HydrophobicContact CD2-CE 4.39Å; L198-M247 HydrophobicContact CD1-CE 4.46Å; M243-M247 PolarHBondContact O-N 3.25Å; L244-M247 HydrophobicContact CD2-SD 3.95Å; L244-M247 WeakPolarHBondContact O-CB 3.23Å; L244-M247 PolarHBondContact O-N 2.76Å; F245-M247 PolarHBondContact O-N 2.84Å; M247-T249 VanDerWaalsContact C-N 3.29Å; M247-T249 PolarHBondContact O-N 3.1Å; M247-K250 PolarHBondContact O-N 2.98Å; M247-F251 WeakPolarHBondContact O-CB 3.16Å; M247-F251 PolarHBondContact O-N 3.37Å; M247-F259 HydrophobicContact CB-CD2 3.9Å; M247-F259 HydrophobicContact CB-CE2 3.96Å; M247-F259 HydrophobicContact CE-CD1 4.32Å; M247-F259 HydrophobicContact CE-CD2 3.74Å; M247-F259 HydrophobicContact CE-CE1 4.43Å; M247-F259 HydrophobicContact CE-CE2 3.89Å; M247-F259 HydrophobicContact CE-CG 3.97Å; M247-F259 HydrophobicContact CE-CZ 4.23Å; M247-F259 HydrophobicContact CG-CD2 4.31Å; M247-F259 HydrophobicContact CG-CE2 4.02Å; M247-V264 HydrophobicContact CB-CG1 3.9Å; M247-V264 HydrophobicContact CE-CG2 3.7Å; M247-V264 HydrophobicContact SD-CG1 4.15Å; M247-V264 HydrophobicContact SD-CG2 3.92Å
248	V	97.6	Very high	93.5	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.9	-41.5	177.2	172.7	0	0	0	0	110.8	L244 F245 G246 C252 M261 V264 L265 L268 A502 L503 I506	L244-V248 WeakPolarHBondContact O-CG2 3.22Å; L244-V248 PolarHBondContact O-N 2.91Å; L244-V248 VanDerWaalsContact O-N 3.14Å; F245-V248 WeakPolarHBondContact O-CB 3.48Å; F245-V248 PolarHBondContact O-N 2.72Å; G246-V248 PolarHBondContact O-N 2.83Å; V248-C252 WeakPolarHBondContact O-CB 3.36Å; V248-C252 PolarHBondContact O-N 3.5Å; V248-M261 HydrophobicContact CG2-CE 4.47Å; V248-M261 HydrophobicContact CG2-SD 3.84Å; V248-V264 HydrophobicContact CG2-CG1 4.06Å; V248-L265 HydrophobicContact CG2-CD2 3.98Å; V248-L268 HydrophobicContact CG2-CD2 4.3Å; V248-A502 HydrophobicContact CG1-CB 3.75Å; V248-L503 HydrophobicContact CG1-CD2 4.24Å; V248-I506 HydrophobicContact CG1-CD1 3.84Å
249	T	95.9	Very high	94	Very high	33 Å²	33	21.1 Å²	21.1	20%	0.202	13%	0.129	C	C	.	.	H	α-helix	trans	-73.3	-38.4	174.6	35.1	0	0	0	0	114.8	F245 G246 M247 F251 C252 S253 Q498 Y499 A502	F245-T249 PolarHBondContact O-N 3Å; F245-T249 VanDerWaalsContact O-N 3.09Å; F245-T249 PolarHBondContact O-OG1 3.33Å; F245-T249 VanDerWaalsContact O-OG1 3.12Å; G246-T249 WeakPolarHBondContact CA-OG1 3.12Å; G246-T249 PolarHBondContact O-N 3.48Å; G246-T249 PolarHBondContact O-OG1 3.08Å; M247-T249 VanDerWaalsContact C-N 3.29Å; M247-T249 PolarHBondContact O-N 3.1Å; T249-F251 VanDerWaalsContact C-N 3.31Å; T249-F251 PolarHBondContact O-N 3.14Å; T249-C252 PolarHBondContact O-N 3.04Å; T249-S253 WeakPolarHBondContact O-CB 3.09Å; T249-S253 PolarHBondContact O-N 3.48Å; T249-S253 VanDerWaalsContact O-N 3.1Å; T249-S253 PolarHBondContact O-OG 2.77Å; T249-Q498 HydrophobicContact CG2-CB 3.96Å; T249-Y499 HydrophobicContact CG2-CD1 3.59Å; T249-Y499 HydrophobicContact CG2-CE1 3.98Å; T249-A502 HydrophobicContact CG2-CB 4.04Å
250	K	94.6	Very high	94.2	Very high	63 Å²	63	20.8 Å²	20.8	27%	0.274	13%	0.127	S	C	.	.	H	α-helix	trans	-59.5	-41.8	174.3	-82	-179.1	166.3	-179.1	0	111.1	I171 D172 G246 M247 S253 H255 A256 F259	I171-K250 HydrophobicContact CG2-CD 4.31Å; I171-K250 PolarHBondContact O-NZ 3.13Å; D172-K250 IonicContact OD1-NZ 3.1Å; D172-K250 PolarHBondContact OD1-NZ 3.36Å; G246-K250 PolarHBondContact O-N 3.38Å; M247-K250 PolarHBondContact O-N 2.98Å; K250-S253 PolarHBondContact O-OG 3.41Å; K250-H255 PolarHBondContact O-N 3.15Å; K250-H255 VanDerWaalsContact O-N 3.11Å; K250-A256 HydrophobicContact CB-CB 4Å; K250-A256 PolarHBondContact O-N 3.47Å; K250-A256 VanDerWaalsContact O-N 3.13Å; K250-F259 HydrophobicContact CB-CE2 3.95Å; K250-F259 HydrophobicContact CD-CE2 4.13Å; K250-F259 HydrophobicContact CD-CZ 4.39Å
251	F	94.4	Very high	94.3	Very high	7 Å²	7	20.8 Å²	20.8	3%	0.031	13%	0.127	C	C	.	.	H	α-helix	trans	-66.4	-52.6	173.5	176.8	-93.7	0	0	0	112.4	M247 T249 S253 G254 A256 F259 M261 I506 I521 N522 I523	M247-F251 WeakPolarHBondContact O-CB 3.16Å; M247-F251 PolarHBondContact O-N 3.37Å; T249-F251 VanDerWaalsContact C-N 3.31Å; T249-F251 PolarHBondContact O-N 3.14Å; F251-S253 PolarHBondContact O-N 2.66Å; F251-S253 VanDerWaalsContact O-N 3.09Å; F251-G254 PolarHBondContact O-N 3.19Å; F251-A256 WeakPolarHBondContact CD2-O 3.3Å; F251-F259 HydrophobicContact CB-CB 4.49Å; F251-F259 HydrophobicContact CD2-CB 4.25Å; F251-M261 HydrophobicContact CB-CE 3.48Å; F251-M261 VanDerWaalsContact CB-CE 3.48Å; F251-M261 HydrophobicContact CD1-CE 3.88Å; F251-M261 HydrophobicContact CD1-CG 4.31Å; F251-M261 HydrophobicContact CD2-CE 4.15Å; F251-M261 HydrophobicContact CE1-CB 4.45Å; F251-M261 HydrophobicContact CE1-CG 4.28Å; F251-M261 HydrophobicContact CG-CE 3.59Å; F251-M261 HydrophobicContact CZ-CB 4.39Å; F251-I506 HydrophobicContact CD1-CD1 4.44Å; F251-I506 HydrophobicContact CE1-CG1 4.38Å; F251-I521 HydrophobicContact CE1-CB 4.29Å; F251-I521 HydrophobicContact CE1-CD1 4.2Å; F251-N522 WeakPolarHBondContact CZ-O 3.35Å; F251-I523 HydrophobicContact CE1-CG2 4.27Å; F251-I523 HydrophobicContact CZ-CG2 4.3Å
252	C	93.4	Very high	94.4	Very high	9 Å²	9	20.7 Å²	20.7	6%	0.061	13%	0.126	C	C	.	.	H	α-helix	trans	-70	-5.1	-176.5	-80.1	0	0	0	0	116.4	V248 T249 A502 K505 I506	V248-C252 WeakPolarHBondContact O-CB 3.36Å; V248-C252 PolarHBondContact O-N 3.5Å; T249-C252 PolarHBondContact O-N 3.04Å; C252-A502 HydrophobicContact CB-CB 3.67Å; C252-A502 PolarHBondContact SG-O 2.89Å; C252-K505 HydrophobicContact CB-CD 4.29Å; C252-K505 PolarHBondContact O-NZ 3.01Å; C252-K505 VanDerWaalsContact O-NZ 3.13Å; C252-I506 WeakPolarHBondContact SG-CG1 3.37Å
253	S	91.3	Very high	94.5	Very high	65 Å²	65	20.7 Å²	20.7	46%	0.455	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-1.7	171.1	55.5	0	0	0	0	113.3	T249 K250 F251 H255	T249-S253 WeakPolarHBondContact O-CB 3.09Å; T249-S253 PolarHBondContact O-N 3.48Å; T249-S253 VanDerWaalsContact O-N 3.1Å; T249-S253 PolarHBondContact O-OG 2.77Å; K250-S253 PolarHBondContact O-OG 3.41Å; F251-S253 PolarHBondContact O-N 2.66Å; F251-S253 VanDerWaalsContact O-N 3.09Å; S253-H255 VanDerWaalsContact C-N 3.33Å; S253-H255 WeakPolarHBondContact CB-ND1 3.45Å; S253-H255 PolarHBondContact OG-ND1 3.16Å
254	G	87.4	Confident	94.6	Very high	42 Å²	42	19.6 Å²	19.6	43%	0.433	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	-1.1	179	0	0	0	0	0	115.1	F251 A256	F251-G254 PolarHBondContact O-N 3.19Å; G254-A256 VanDerWaalsContact C-N 3.34Å
255	H	88.4	Confident	94.7	Very high	128 Å²	128	19.6 Å²	19.6	59%	0.593	12%	0.121	S	C	*	.	S	Bend	trans	-76.6	-18.6	179.7	-62.5	98.6	0	0	0	113.5	C177 K250 S253	C177-H255 PolarHBondContact SG-O 3.49Å; K250-H255 PolarHBondContact O-N 3.15Å; K250-H255 VanDerWaalsContact O-N 3.11Å; S253-H255 VanDerWaalsContact C-N 3.33Å; S253-H255 WeakPolarHBondContact CB-ND1 3.45Å; S253-H255 PolarHBondContact OG-ND1 3.16Å
256	A	91.6	Very high	94.7	Very high	4 Å²	4	19.6 Å²	19.6	3%	0.033	12%	0.121	C	C	.	.			trans	-141.6	64.8	178.3	0	0	0	0	0	112.4	K250 F251 G254 H258 F259	K250-A256 HydrophobicContact CB-CB 4Å; K250-A256 PolarHBondContact O-N 3.47Å; K250-A256 VanDerWaalsContact O-N 3.13Å; F251-A256 WeakPolarHBondContact CD2-O 3.3Å; G254-A256 VanDerWaalsContact C-N 3.34Å; A256-H258 PolarHBondContact O-N 2.99Å; A256-H258 VanDerWaalsContact O-N 3.15Å; A256-F259 HydrophobicContact CB-CD1 3.75Å; A256-F259 HydrophobicContact CB-CD2 3.6Å; A256-F259 HydrophobicContact CB-CE1 3.65Å; A256-F259 HydrophobicContact CB-CE2 3.49Å; A256-F259 VanDerWaalsContact CB-CE2 3.49Å; A256-F259 HydrophobicContact CB-CG 3.74Å; A256-F259 HydrophobicContact CB-CZ 3.52Å; A256-F259 PolarHBondContact O-N 3.22Å
257	P	91.2	Very high	94.8	Very high	28 Å²	28	18.6 Å²	18.6	18%	0.182	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-6.2	-170.7	32.3	-37.2	0	0	0	114.2	A180 V181 I186	A180-P257 HydrophobicContact CB-CG 4.18Å; V181-P257 HydrophobicContact CG2-CG 3.84Å; I186-P257 HydrophobicContact CD1-CB 3.68Å; I186-P257 HydrophobicContact CD1-CG 3.75Å
258	H	92.4	Very high	94.9	Very high	3 Å²	3	18.6 Å²	18.6	1%	0.014	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-8.9	175.5	62.2	-84.4	0	0	0	113.7	A180 I186 D190 S191 A256	A180-H258 HydrophobicContact CB-CB 3.74Å; A180-H258 WeakPolarHBondContact CB-ND1 3.5Å; I186-H258 HydrophobicContact CG2-CB 3.95Å; D190-H258 HydrophobicContact CB-CB 4.2Å; S191-H258 VanDerWaalsContact CB-O 3.24Å; S191-H258 WeakPolarHBondContact CB-O 3.47Å; A256-H258 PolarHBondContact O-N 2.99Å; A256-H258 VanDerWaalsContact O-N 3.15Å
259	F	95.4	Very high	94.9	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.018	11%	0.111	C	C	.	.	S	Bend	trans	-59.6	130.1	-177.3	-77.4	0.1	0	0	0	111.7	I171 L194 M247 K250 F251 A256 M261	I171-F259 HydrophobicContact CB-CZ 4.48Å; I171-F259 HydrophobicContact CG1-CZ 4.3Å; L194-F259 HydrophobicContact CD1-CD1 3.44Å; L194-F259 VanDerWaalsContact CD1-CD1 3.44Å; L194-F259 HydrophobicContact CD1-CE1 3.73Å; L194-F259 HydrophobicContact CD1-CG 4.43Å; M247-F259 HydrophobicContact CB-CD2 3.9Å; M247-F259 HydrophobicContact CB-CE2 3.96Å; M247-F259 HydrophobicContact CE-CD1 4.32Å; M247-F259 HydrophobicContact CE-CD2 3.74Å; M247-F259 HydrophobicContact CE-CE1 4.43Å; M247-F259 HydrophobicContact CE-CE2 3.89Å; M247-F259 HydrophobicContact CE-CG 3.97Å; M247-F259 HydrophobicContact CE-CZ 4.23Å; M247-F259 HydrophobicContact CG-CD2 4.31Å; M247-F259 HydrophobicContact CG-CE2 4.02Å; K250-F259 HydrophobicContact CB-CE2 3.95Å; K250-F259 HydrophobicContact CD-CE2 4.13Å; K250-F259 HydrophobicContact CD-CZ 4.39Å; F251-F259 HydrophobicContact CB-CB 4.49Å; F251-F259 HydrophobicContact CD2-CB 4.25Å; A256-F259 HydrophobicContact CB-CD1 3.75Å; A256-F259 HydrophobicContact CB-CD2 3.6Å; A256-F259 HydrophobicContact CB-CE1 3.65Å; A256-F259 HydrophobicContact CB-CE2 3.49Å; A256-F259 VanDerWaalsContact CB-CE2 3.49Å; A256-F259 HydrophobicContact CB-CG 3.74Å; A256-F259 HydrophobicContact CB-CZ 3.52Å; A256-F259 PolarHBondContact O-N 3.22Å; F259-M261 VanDerWaalsContact C-N 3.32Å; F259-M261 HydrophobicContact CB-CE 4.33Å; F259-M261 PolarHBondContact O-N 2.95Å
260	P	95.8	Very high	95	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.101	C	C	.	.			trans	-77.3	80.9	-172.5	31.3	-35.6	0	0	0	111.2	L194 R195 L198 K262 K263 V264 D526	L194-P260 HydrophobicContact CB-CG 4.12Å; R195-P260 HydrophobicContact CG-CB 3.69Å; R195-P260 HydrophobicContact CG-CG 3.85Å; L198-P260 HydrophobicContact CD1-CG 3.66Å; P260-K262 VanDerWaalsContact C-N 3.31Å; P260-K262 PolarHBondContact O-N 3.28Å; P260-K262 VanDerWaalsContact O-N 3.16Å; P260-K263 HydrophobicContact CB-CD 4.28Å; P260-K263 PolarHBondContact O-N 3.45Å; P260-V264 PolarHBondContact O-N 2.79Å; P260-V264 VanDerWaalsContact O-N 3.13Å; P260-D526 HydrophobicContact CB-CB 3.96Å; P260-D526 WeakPolarHBondContact CB-OD1 3.4Å
261	M	95.9	Very high	95.1	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-64.9	-27.7	-159.2	-168.4	48.1	52.7	0	0	114.6	V248 F251 F259 V264 L265 I506	V248-M261 HydrophobicContact CG2-CE 4.47Å; V248-M261 HydrophobicContact CG2-SD 3.84Å; F251-M261 HydrophobicContact CB-CE 3.48Å; F251-M261 VanDerWaalsContact CB-CE 3.48Å; F251-M261 HydrophobicContact CD1-CE 3.88Å; F251-M261 HydrophobicContact CD1-CG 4.31Å; F251-M261 HydrophobicContact CD2-CE 4.15Å; F251-M261 HydrophobicContact CE1-CB 4.45Å; F251-M261 HydrophobicContact CE1-CG 4.28Å; F251-M261 HydrophobicContact CG-CE 3.59Å; F251-M261 HydrophobicContact CZ-CB 4.39Å; F259-M261 VanDerWaalsContact C-N 3.32Å; F259-M261 HydrophobicContact CB-CE 4.33Å; F259-M261 PolarHBondContact O-N 2.95Å; M261-V264 HydrophobicContact CE-CB 4.37Å; M261-V264 HydrophobicContact CE-CG1 4.39Å; M261-V264 HydrophobicContact SD-CB 4.1Å; M261-V264 HydrophobicContact SD-CG1 4.19Å; M261-L265 HydrophobicContact CG-CD1 3.84Å; M261-L265 HydrophobicContact CG-CG 4.21Å; M261-L265 WeakPolarHBondContact O-CB 3.36Å; M261-L265 WeakPolarHBondContact O-CD1 3.45Å; M261-L265 VanDerWaalsContact O-CG 3.23Å; M261-L265 WeakPolarHBondContact O-CG 3.45Å; M261-L265 PolarHBondContact O-N 3.27Å; M261-L265 HydrophobicContact SD-CD1 4.1Å; M261-L265 HydrophobicContact SD-CD2 4.4Å; M261-L265 HydrophobicContact SD-CG 3.84Å; M261-I506 HydrophobicContact CG-CD1 3.77Å; M261-I506 HydrophobicContact CG-CG1 4.5Å; M261-I506 HydrophobicContact CG-CG2 4.44Å; M261-I506 HydrophobicContact SD-CD1 3.85Å
262	K	97	Very high	95.3	Very high	1 Å²	1	13.8 Å²	13.8	0%	0.004	9%	0.086	C	C	.	.	H	α-helix	trans	-57.8	-50.9	169.3	177.3	-171.5	67.7	162.6	0	111.1	E62 L63 Y64 S65 P260 L265 L266 D526 H549 I552 I553	E62-K262 WeakPolarHBondContact O-CD 3.43Å; E62-K262 WeakPolarHBondContact O-CE 3.41Å; E62-K262 PolarHBondContact O-NZ 3.46Å; L63-K262 WeakPolarHBondContact O-CE 3.44Å; L63-K262 PolarHBondContact O-NZ 3.03Å; Y64-K262 PolarHBondContact O-NZ 3.23Å; S65-K262 PolarHBondContact OG-NZ 3.33Å; P260-K262 VanDerWaalsContact C-N 3.31Å; P260-K262 PolarHBondContact O-N 3.28Å; P260-K262 VanDerWaalsContact O-N 3.16Å; K262-L265 PolarHBondContact O-N 3.34Å; K262-L266 HydrophobicContact CD-CD1 4.49Å; K262-L266 HydrophobicContact CG-CD1 3.95Å; K262-L266 HydrophobicContact CG-CG 4.42Å; K262-L266 VanDerWaalsContact O-CB 3.31Å; K262-L266 WeakPolarHBondContact O-CB 3.45Å; K262-L266 WeakPolarHBondContact O-CG 3.22Å; K262-L266 PolarHBondContact O-N 3.12Å; K262-D526 WeakPolarHBondContact CE-OD2 3.38Å; K262-H549 WeakPolarHBondContact CB-CE1 3.47Å; K262-I552 HydrophobicContact CD-CB 4.39Å; K262-I552 HydrophobicContact CD-CD1 4.15Å; K262-I552 HydrophobicContact CD-CG2 4.02Å; K262-I552 HydrophobicContact CG-CB 4.46Å; K262-I552 HydrophobicContact CG-CG2 3.8Å; K262-I553 HydrophobicContact CB-CD1 4.47Å; K262-I553 HydrophobicContact CB-CG1 4.23Å
263	K	97.7	Very high	95.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.3	-40.9	-177.7	-61.7	178.1	173.2	69.8	0	111.7	L63 E68 R195 L198 N199 P260 L266 L267 D526	L63-K263 HydrophobicContact CD1-CG 4.26Å; E68-K263 WeakPolarHBondContact OE1-CE 3.46Å; E68-K263 IonicContact OE1-NZ 3.31Å; E68-K263 PolarHBondContact OE1-NZ 3.38Å; E68-K263 IonicContact OE2-NZ 2.73Å; E68-K263 PolarHBondContact OE2-NZ 2.9Å; R195-K263 HydrophobicContact CB-CD 4.16Å; R195-K263 HydrophobicContact CG-CD 4.02Å; L198-K263 HydrophobicContact CB-CB 4.17Å; L198-K263 HydrophobicContact CD1-CB 4.31Å; N199-K263 VanDerWaalsContact OD1-CD 3.26Å; N199-K263 WeakPolarHBondContact OD1-CD 3.41Å; N199-K263 WeakPolarHBondContact OD1-CE 3.49Å; P260-K263 HydrophobicContact CB-CD 4.28Å; P260-K263 PolarHBondContact O-N 3.45Å; K263-L266 PolarHBondContact O-N 3.14Å; K263-L267 WeakPolarHBondContact O-CB 3.47Å; K263-L267 PolarHBondContact O-N 3.38Å; K263-D526 IonicContact NZ-OD1 3.46Å; K263-D526 PolarHBondContact NZ-OD1 3.35Å; K263-D526 IonicContact NZ-OD2 2.72Å; K263-D526 PolarHBondContact NZ-OD2 3.25Å
264	V	98.4	Very high	95.8	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.7	-47.6	173.6	177.8	0	0	0	0	111.4	L198 L244 M247 V248 P260 M261 L268	L198-V264 HydrophobicContact CD1-CG2 3.73Å; L244-V264 HydrophobicContact CD2-CG1 4.28Å; M247-V264 HydrophobicContact CB-CG1 3.9Å; M247-V264 HydrophobicContact CE-CG2 3.7Å; M247-V264 HydrophobicContact SD-CG1 4.15Å; M247-V264 HydrophobicContact SD-CG2 3.92Å; V248-V264 HydrophobicContact CG2-CG1 4.06Å; P260-V264 PolarHBondContact O-N 2.79Å; P260-V264 VanDerWaalsContact O-N 3.13Å; M261-V264 HydrophobicContact CE-CB 4.37Å; M261-V264 HydrophobicContact CE-CG1 4.39Å; M261-V264 HydrophobicContact SD-CB 4.1Å; M261-V264 HydrophobicContact SD-CG1 4.19Å; V264-L268 WeakPolarHBondContact O-CB 3.43Å; V264-L268 PolarHBondContact O-N 2.99Å
265	L	98.6	Very high	96.2	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-71.1	-35.8	-179.5	-71.4	168.8	0	0	0	113	V248 M261 K262 W269 L503 I506 I553 A556 I557 I560	V248-L265 HydrophobicContact CG2-CD2 3.98Å; M261-L265 HydrophobicContact CG-CD1 3.84Å; M261-L265 HydrophobicContact CG-CG 4.21Å; M261-L265 WeakPolarHBondContact O-CB 3.36Å; M261-L265 WeakPolarHBondContact O-CD1 3.45Å; M261-L265 VanDerWaalsContact O-CG 3.23Å; M261-L265 WeakPolarHBondContact O-CG 3.45Å; M261-L265 PolarHBondContact O-N 3.27Å; M261-L265 HydrophobicContact SD-CD1 4.1Å; M261-L265 HydrophobicContact SD-CD2 4.4Å; M261-L265 HydrophobicContact SD-CG 3.84Å; K262-L265 PolarHBondContact O-N 3.34Å; L265-W269 VanDerWaalsContact O-CB 3.31Å; L265-W269 WeakPolarHBondContact O-CB 3.49Å; L265-W269 PolarHBondContact O-N 3.47Å; L265-L503 HydrophobicContact CD2-CD2 3.69Å; L265-I506 HydrophobicContact CD1-CD1 4.46Å; L265-I506 HydrophobicContact CD1-CG2 4.06Å; L265-I553 HydrophobicContact CD1-CG1 4.31Å; L265-I553 HydrophobicContact CD1-CG2 4.09Å; L265-A556 HydrophobicContact CB-CB 4.05Å; L265-I557 HydrophobicContact CD1-CD1 3.85Å; L265-I557 HydrophobicContact CD1-CG1 3.82Å; L265-I557 HydrophobicContact CD2-CG1 4.02Å; L265-I557 HydrophobicContact CG-CG1 4.5Å; L265-I560 HydrophobicContact CD2-CD1 4.18Å
266	L	98.4	Very high	96.5	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-62.5	-52.4	173	-81.3	177.9	0	0	0	110.7	L63 Y202 K262 K263 L268 W269 K270 I552	L63-L266 HydrophobicContact CD1-CD1 4.49Å; Y202-L266 HydrophobicContact CD2-CB 3.92Å; Y202-L266 HydrophobicContact CE2-CB 3.65Å; Y202-L266 HydrophobicContact CE2-CD2 4.38Å; Y202-L266 HydrophobicContact CE2-CG 4.4Å; K262-L266 HydrophobicContact CD-CD1 4.49Å; K262-L266 HydrophobicContact CG-CD1 3.95Å; K262-L266 HydrophobicContact CG-CG 4.42Å; K262-L266 VanDerWaalsContact O-CB 3.31Å; K262-L266 WeakPolarHBondContact O-CB 3.45Å; K262-L266 WeakPolarHBondContact O-CG 3.22Å; K262-L266 PolarHBondContact O-N 3.12Å; K263-L266 PolarHBondContact O-N 3.14Å; L266-L268 PolarHBondContact O-N 3.43Å; L266-W269 HydrophobicContact CD2-CE3 4.1Å; L266-W269 HydrophobicContact CD2-CZ3 4.27Å; L266-W269 PolarHBondContact O-N 2.8Å; L266-K270 WeakPolarHBondContact O-CG 3.26Å; L266-K270 PolarHBondContact O-N 3.06Å; L266-I552 HydrophobicContact CD1-CG2 4Å; L266-I552 HydrophobicContact CD2-CG2 3.91Å; L266-I552 HydrophobicContact CG-CG2 4.08Å
267	L	98.5	Very high	96.7	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-61.2	-44.2	177.3	-179.6	60	0	0	0	111.8	L198 M201 V205 L244 K263 W269 K270 S271	L198-L267 HydrophobicContact CD2-CD2 3.63Å; M201-L267 HydrophobicContact CB-CD1 4.26Å; M201-L267 HydrophobicContact CB-CD2 3.85Å; V205-L267 HydrophobicContact CB-CD1 4.35Å; V205-L267 HydrophobicContact CG2-CD1 4.02Å; L244-L267 HydrophobicContact CD1-CB 4.43Å; L244-L267 HydrophobicContact CD1-CD2 4.05Å; L244-L267 HydrophobicContact CD1-CG 3.81Å; L244-L267 HydrophobicContact CD2-CD2 4.06Å; K263-L267 WeakPolarHBondContact O-CB 3.47Å; K263-L267 PolarHBondContact O-N 3.38Å; L267-W269 VanDerWaalsContact C-N 3.3Å; L267-W269 PolarHBondContact O-N 3.01Å; L267-K270 PolarHBondContact O-N 2.81Å; L267-S271 WeakPolarHBondContact O-CB 3.21Å; L267-S271 PolarHBondContact O-N 2.88Å; L267-S271 PolarHBondContact O-OG 3.38Å; L267-S271 VanDerWaalsContact O-OG 3.06Å
268	L	98.7	Very high	96.8	Very high	0 Å²	0	2.5 Å²	2.5	0%	0	2%	0.015	C	C	.	.	H	α-helix	trans	-58.1	-42	175.6	176.5	57.3	0	0	0	112.1	S241 L244 F245 V248 V264 L266 I272 I560	S241-L268 WeakPolarHBondContact O-CD1 3.39Å; L244-L268 HydrophobicContact CB-CB 4.14Å; L244-L268 HydrophobicContact CB-CD1 4.02Å; L244-L268 HydrophobicContact CB-CG 4.49Å; L244-L268 HydrophobicContact CD1-CB 4.32Å; F245-L268 HydrophobicContact CD1-CD2 3.92Å; F245-L268 HydrophobicContact CD2-CD1 3.93Å; F245-L268 HydrophobicContact CD2-CD2 4.41Å; F245-L268 HydrophobicContact CE1-CD2 3.84Å; F245-L268 HydrophobicContact CE2-CD1 3.88Å; F245-L268 HydrophobicContact CE2-CD2 4.34Å; F245-L268 HydrophobicContact CG-CD1 4.41Å; F245-L268 HydrophobicContact CG-CD2 4.19Å; F245-L268 HydrophobicContact CZ-CD1 4.32Å; F245-L268 HydrophobicContact CZ-CD2 4.04Å; V248-L268 HydrophobicContact CG2-CD2 4.3Å; V264-L268 WeakPolarHBondContact O-CB 3.43Å; V264-L268 PolarHBondContact O-N 2.99Å; L266-L268 PolarHBondContact O-N 3.43Å; L268-I272 HydrophobicContact CD1-CD1 3.67Å; L268-I272 HydrophobicContact CD1-CG1 4.2Å; L268-I272 HydrophobicContact CG-CD1 4.05Å; L268-I272 WeakPolarHBondContact O-CB 3.32Å; L268-I272 WeakPolarHBondContact O-CD1 3.19Å; L268-I272 VanDerWaalsContact O-CG1 3.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.31Å; L268-I272 PolarHBondContact O-N 3.47Å; L268-I272 VanDerWaalsContact O-N 3.09Å; L268-I560 HydrophobicContact CB-CD1 4.34Å; L268-I560 HydrophobicContact CD2-CD1 4.02Å; L268-I560 HydrophobicContact CG-CD1 3.98Å
269	W	98.4	Very high	96.8	Very high	2 Å²	2	2.9 Å²	2.9	1%	0.008	2%	0.017	C	C	.	.	H	α-helix	trans	-64	-48.9	176.5	173.7	28.7	0	0	0	112	D52 L265 L266 L267 I272 L273 K555 A556 A559 I560 F645	D52-W269 VanDerWaalsContact O-CZ2 3.27Å; D52-W269 WeakPolarHBondContact O-CZ2 3.33Å; L265-W269 VanDerWaalsContact O-CB 3.31Å; L265-W269 WeakPolarHBondContact O-CB 3.49Å; L265-W269 PolarHBondContact O-N 3.47Å; L266-W269 HydrophobicContact CD2-CE3 4.1Å; L266-W269 HydrophobicContact CD2-CZ3 4.27Å; L266-W269 PolarHBondContact O-N 2.8Å; L267-W269 VanDerWaalsContact C-N 3.3Å; L267-W269 PolarHBondContact O-N 3.01Å; W269-I272 PolarHBondContact O-N 2.97Å; W269-L273 VanDerWaalsContact O-CB 3.29Å; W269-L273 WeakPolarHBondContact O-CB 3.35Å; W269-L273 PolarHBondContact O-N 2.83Å; W269-K555 HydrophobicContact CH2-CD 4.44Å; W269-K555 HydrophobicContact CH2-CG 4.25Å; W269-K555 HydrophobicContact CZ3-CD 4.4Å; W269-K555 VanDerWaalsContact CZ3-CE 3.46Å; W269-K555 HydrophobicContact CZ3-CG 4.18Å; W269-A556 HydrophobicContact CE3-CB 4.33Å; W269-A559 HydrophobicContact CD2-CB 4.02Å; W269-A559 VanDerWaalsContact CE2-CB 3.45Å; W269-A559 HydrophobicContact CG-CB 4.14Å; W269-A559 HydrophobicContact CZ2-CB 3.93Å; W269-A559 VanDerWaalsContact NE1-CB 3.25Å; W269-I560 HydrophobicContact CB-CD1 4.05Å; W269-I560 HydrophobicContact CB-CG1 3.73Å; W269-I560 HydrophobicContact CG-CG1 4.33Å; W269-F645 HydrophobicContact CH2-CE1 4.48Å; W269-F645 HydrophobicContact CZ2-CE1 4.25Å; W269-F645 HydrophobicContact CZ2-CZ 4.04Å
270	K	97.8	Very high	96.6	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-66.8	-41.4	180	-57.6	-55.1	-179.2	136	0	112.2	E59 Y202 V205 E206 L266 L267 I272 L273 F274	E59-K270 WeakPolarHBondContact OE2-CE 3.06Å; E59-K270 IonicContact OE2-NZ 3.41Å; E59-K270 PolarHBondContact OE2-NZ 2.66Å; Y202-K270 HydrophobicContact CD2-CG 4.07Å; Y202-K270 HydrophobicContact CE2-CD 4.41Å; Y202-K270 HydrophobicContact CE2-CG 3.49Å; Y202-K270 VanDerWaalsContact CE2-CG 3.49Å; Y202-K270 WeakPolarHBondContact OH-CE 3.33Å; V205-K270 HydrophobicContact CG1-CB 3.8Å; E206-K270 IonicContact OE1-NZ 3.68Å; E206-K270 VanDerWaalsContact OE2-CD 3.22Å; E206-K270 WeakPolarHBondContact OE2-CD 3.21Å; E206-K270 VanDerWaalsContact OE2-CE 3.23Å; E206-K270 WeakPolarHBondContact OE2-CE 3.49Å; E206-K270 IonicContact OE2-NZ 3.53Å; E206-K270 PolarHBondContact OE2-NZ 2.69Å; L266-K270 WeakPolarHBondContact O-CG 3.26Å; L266-K270 PolarHBondContact O-N 3.06Å; L267-K270 PolarHBondContact O-N 2.81Å; K270-I272 PolarHBondContact O-N 3.43Å; K270-L273 PolarHBondContact O-N 3.18Å; K270-L273 VanDerWaalsContact O-N 3.14Å; K270-F274 WeakPolarHBondContact O-CB 3.46Å; K270-F274 PolarHBondContact O-N 3.25Å
271	S	97.4	Very high	96.4	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-57.9	-44.8	173.8	-65.7	0	0	0	0	112.1	L267 T275	L267-S271 WeakPolarHBondContact O-CB 3.21Å; L267-S271 PolarHBondContact O-N 2.88Å; L267-S271 PolarHBondContact O-OG 3.38Å; L267-S271 VanDerWaalsContact O-OG 3.06Å; S271-T275 WeakPolarHBondContact O-CB 3.33Å; S271-T275 WeakPolarHBondContact O-CG2 3.35Å; S271-T275 PolarHBondContact O-N 3.3Å; S271-T275 PolarHBondContact O-OG1 3.35Å
272	I	97.8	Very high	96.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-65.4	-41.9	174.5	-70.2	169	0	0	0	111.5	F245 L268 W269 K270 T275 L276 L488 I560 L563 L564	F245-I272 HydrophobicContact CE2-CD1 3.99Å; F245-I272 HydrophobicContact CZ-CD1 4.22Å; L268-I272 HydrophobicContact CD1-CD1 3.67Å; L268-I272 HydrophobicContact CD1-CG1 4.2Å; L268-I272 HydrophobicContact CG-CD1 4.05Å; L268-I272 WeakPolarHBondContact O-CB 3.32Å; L268-I272 WeakPolarHBondContact O-CD1 3.19Å; L268-I272 VanDerWaalsContact O-CG1 3.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.31Å; L268-I272 PolarHBondContact O-N 3.47Å; L268-I272 VanDerWaalsContact O-N 3.09Å; W269-I272 PolarHBondContact O-N 2.97Å; K270-I272 PolarHBondContact O-N 3.43Å; I272-T275 PolarHBondContact O-OG1 3Å; I272-L276 WeakPolarHBondContact O-CB 3.27Å; I272-L276 PolarHBondContact O-N 2.7Å; I272-L488 HydrophobicContact CG1-CD2 4.12Å; I272-I560 HydrophobicContact CD1-CG2 4.02Å; I272-L563 HydrophobicContact CG2-CB 4.17Å; I272-L563 HydrophobicContact CG2-CD1 4.41Å; I272-L564 HydrophobicContact CD1-CD1 4.4Å; I272-L564 HydrophobicContact CD1-CD2 4.24Å; I272-L564 HydrophobicContact CD1-CG 4.43Å; I272-L564 HydrophobicContact CG2-CD2 4.1Å
273	L	97.2	Very high	96.1	Very high	3 Å²	3	12.4 Å²	12.4	2%	0.016	6%	0.062	C	C	.	.	H	α-helix	trans	-67.7	-40.2	-177.8	179.1	60.3	0	0	0	112.4	D52 T53 W269 K270 G277 L563	D52-L273 HydrophobicContact CB-CD1 3.98Å; D52-L273 HydrophobicContact CB-CD2 4.26Å; T53-L273 HydrophobicContact CG2-CD2 3.74Å; W269-L273 VanDerWaalsContact O-CB 3.29Å; W269-L273 WeakPolarHBondContact O-CB 3.35Å; W269-L273 PolarHBondContact O-N 2.83Å; K270-L273 PolarHBondContact O-N 3.18Å; K270-L273 VanDerWaalsContact O-N 3.14Å; L273-G277 CarbonylContact O-C 3.22Å; L273-G277 VanDerWaalsContact O-C 3.29Å; L273-G277 WeakPolarHBondContact O-CA 3.39Å; L273-G277 PolarHBondContact O-N 3.23Å; L273-L563 HydrophobicContact CB-CD1 4.22Å; L273-L563 HydrophobicContact CD1-CD1 4.19Å; L273-L563 HydrophobicContact CD1-CD2 4.05Å
274	F	96.9	Very high	95.9	Very high	9 Å²	9	16 Å²	16	4%	0.039	9%	0.086	C	C	.	.	H	α-helix	trans	-74.5	-45.6	178.7	-179.9	-141	0	0	0	112.1	V205 I208 Q209 K223 F226 R227 L230 K270	V205-F274 HydrophobicContact CG1-CB 4.4Å; V205-F274 HydrophobicContact CG1-CD1 4.3Å; I208-F274 HydrophobicContact CG2-CE1 4.44Å; I208-F274 HydrophobicContact CG2-CZ 4.01Å; Q209-F274 HydrophobicContact CB-CB 4.24Å; Q209-F274 HydrophobicContact CB-CD2 4Å; Q209-F274 HydrophobicContact CB-CG 4.12Å; Q209-F274 HydrophobicContact CG-CB 3.98Å; Q209-F274 HydrophobicContact CG-CD2 3.9Å; Q209-F274 HydrophobicContact CG-CG 4.18Å; K223-F274 HydrophobicContact CG-CE2 4.12Å; K223-F274 HydrophobicContact CG-CZ 4.04Å; F226-F274 AromaticContact CD1-CE1 3.76Å; F226-F274 HydrophobicContact CD1-CE1 3.76Å; F226-F274 HydrophobicContact CD1-CZ 4.43Å; F226-F274 HydrophobicContact CE1-CE1 4.17Å; R227-F274 HydrophobicContact CB-CE1 3.9Å; R227-F274 HydrophobicContact CB-CE2 3.96Å; R227-F274 HydrophobicContact CB-CZ 3.54Å; R227-F274 HydrophobicContact CG-CD1 4.45Å; R227-F274 HydrophobicContact CG-CD2 4.12Å; R227-F274 HydrophobicContact CG-CE1 4.2Å; R227-F274 HydrophobicContact CG-CE2 3.85Å; R227-F274 HydrophobicContact CG-CG 4.41Å; R227-F274 HydrophobicContact CG-CZ 3.9Å; R227-F274 PolarHBondContact NE-O 3.35Å; L230-F274 HydrophobicContact CD1-CD1 3.53Å; L230-F274 HydrophobicContact CD1-CE1 3.66Å; K270-F274 WeakPolarHBondContact O-CB 3.46Å; K270-F274 PolarHBondContact O-N 3.25Å
275	T	96.1	Very high	95.6	Very high	10 Å²	10	19.8 Å²	19.8	6%	0.061	11%	0.106	C	C	.	.	H	α-helix	trans	-67.1	-61.5	179.5	52.9	0	0	0	0	111.7	R227 L230 S271 I272	R227-T275 PolarHBondContact NH2-O 2.95Å; L230-T275 HydrophobicContact CB-CG2 3.64Å; S271-T275 WeakPolarHBondContact O-CB 3.33Å; S271-T275 WeakPolarHBondContact O-CG2 3.35Å; S271-T275 PolarHBondContact O-N 3.3Å; S271-T275 PolarHBondContact O-OG1 3.35Å; I272-T275 PolarHBondContact O-OG1 3Å
276	L	95.9	Very high	95.4	Very high	8 Å²	8	22.3 Å²	22.3	4%	0.042	12%	0.117	C	C	.	.	H	α-helix	trans	-79	-22.9	-175.6	-75.5	64.1	0	0	0	113.1	I272 A484 T485 L488 L564 H567	I272-L276 WeakPolarHBondContact O-CB 3.27Å; I272-L276 PolarHBondContact O-N 2.7Å; L276-A484 HydrophobicContact CD1-CB 4.35Å; L276-T485 HydrophobicContact CD2-CG2 4.19Å; L276-T485 WeakPolarHBondContact CG-OG1 3.33Å; L276-L488 HydrophobicContact CD1-CB 4.4Å; L276-L488 HydrophobicContact CD1-CD2 3.75Å; L276-L488 HydrophobicContact CD2-CD2 3.88Å; L276-L564 HydrophobicContact CD2-CD2 4.41Å; L276-H567 HydrophobicContact CD2-CB 3.79Å; L276-H567 PolarHBondContact O-CE1 3.31Å; L276-H567 PolarHBondContact O-NE2 2.89Å
277	G	95.1	Very high	95.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.			trans	97.4	161	174.7	0	0	0	0	0	115.7	L273 H567	L273-G277 CarbonylContact O-C 3.22Å; L273-G277 VanDerWaalsContact O-C 3.29Å; L273-G277 WeakPolarHBondContact O-CA 3.39Å; L273-G277 PolarHBondContact O-N 3.23Å; G277-H567 PolarHBondContact O-CE1 2.67Å; G277-H567 PolarHBondContact O-NE2 3.14Å
278	G	94	Very high	95	Very high	9 Å²	9	27.4 Å²	27.4	9%	0.093	15%	0.15	C	C	.	.			trans	-76.6	-179.3	179.7	0	0	0	0	0	114.5	E280 Q281 L282	G278-E280 PolarHBondContact O-N 3.38Å; G278-Q281 PolarHBondContact O-N 3.09Å; G278-L282 VanDerWaalsContact O-CB 3.31Å; G278-L282 WeakPolarHBondContact O-CB 3.21Å; G278-L282 PolarHBondContact O-N 3.01Å
279	F	91.8	Very high	94.7	Very high	12 Å²	12	29.3 Å²	29.3	5%	0.053	16%	0.158	C	C	.	.	H	α-helix	trans	-72	-29.5	-173.8	-59.9	-31.1	0	0	0	114.9	Y50 D52 Q283 I303 L562 L563 K566 R652	Y50-F279 AromaticContact CE1-CD2 3.81Å; Y50-F279 HydrophobicContact CE1-CD2 3.81Å; Y50-F279 AromaticContact CE1-CE2 3.59Å; Y50-F279 HydrophobicContact CE1-CE2 3.59Å; Y50-F279 AromaticContact CZ-CE2 3.84Å; Y50-F279 VanDerWaalsContact OH-CE2 3.22Å; Y50-F279 WeakPolarHBondContact OH-CE2 3.45Å; D52-F279 WeakPolarHBondContact OD1-CD1 3.41Å; D52-F279 WeakPolarHBondContact OD1-CD2 3.34Å; D52-F279 WeakPolarHBondContact OD1-CE2 3.45Å; D52-F279 WeakPolarHBondContact OD1-CG 3.46Å; D52-F279 WeakPolarHBondContact OD1-CZ 3.33Å; D52-F279 PolarHBondContact OD1-N 2.89Å; D52-F279 WeakPolarHBondContact OD2-CB 3.37Å; D52-F279 WeakPolarHBondContact OD2-CD2 3.24Å; D52-F279 WeakPolarHBondContact OD2-CG 3.39Å; D52-F279 PolarHBondContact OD2-N 3.4Å; F279-Q283 WeakPolarHBondContact O-CB 3.3Å; F279-Q283 PolarHBondContact O-N 3.21Å; F279-Q283 VanDerWaalsContact O-N 3.13Å; F279-I303 HydrophobicContact CB-CD1 4.46Å; F279-L562 HydrophobicContact CZ-CD2 3.98Å; F279-L562 HydrophobicContact CZ-CG 4.23Å; F279-L563 HydrophobicContact CD1-CD2 4.04Å; F279-L563 HydrophobicContact CE1-CD2 3.5Å; F279-L563 HydrophobicContact CE1-CG 4Å; F279-L563 HydrophobicContact CZ-CD2 4.28Å; F279-L563 HydrophobicContact CZ-CG 4.44Å; F279-K566 HydrophobicContact CD1-CD 3.58Å; F279-K566 HydrophobicContact CE1-CD 3.42Å; F279-K566 VanDerWaalsContact CE1-CD 3.42Å; F279-K566 HydrophobicContact CZ-CD 4.34Å; F279-R652 VanDerWaalsContact CE2-NH1 3.32Å
280	E	90.8	Very high	94.5	Very high	75 Å²	75	29.6 Å²	29.6	35%	0.35	16%	0.159	S	C	.	.	H	α-helix	trans	-70.3	-47.9	172.6	-57.5	-70.7	-176.5	0	0	110	G278 L282 Q283 S284 I303 R307	G278-E280 PolarHBondContact O-N 3.38Å; E280-L282 PolarHBondContact O-N 3.29Å; E280-Q283 WeakPolarHBondContact O-CA 3.43Å; E280-Q283 WeakPolarHBondContact O-CB 3.35Å; E280-Q283 PolarHBondContact O-N 3.46Å; E280-S284 PolarHBondContact O-N 3.17Å; E280-S284 PolarHBondContact O-OG 2.73Å; E280-I303 WeakPolarHBondContact OE2-CD1 3.27Å; E280-R307 IonicContact OE1-CZ 2.87Å; E280-R307 IonicContact OE1-NH1 3.62Å; E280-R307 PolarHBondContact OE1-NH1 2.96Å; E280-R307 IonicContact OE1-NH2 3.76Å; E280-R307 PolarHBondContact OE1-NH2 2.83Å
281	Q	92.4	Very high	94.4	Very high	88 Å²	88	35.4 Å²	35.4	41%	0.411	19%	0.186	S	C	.	.	H	α-helix	trans	-57.7	-48.1	175.7	-67.1	172.3	-11.1	0	0	111.8	G278 Q283 S284 I285	G278-Q281 PolarHBondContact O-N 3.09Å; Q281-Q283 VanDerWaalsContact C-N 3.26Å; Q281-Q283 PolarHBondContact O-N 3.38Å; Q281-S284 WeakPolarHBondContact O-CA 3.42Å; Q281-S284 WeakPolarHBondContact O-CB 3.47Å; Q281-S284 PolarHBondContact O-N 3.24Å; Q281-I285 WeakPolarHBondContact O-CG1 3.23Å; Q281-I285 PolarHBondContact O-N 2.98Å
282	L	93.5	Very high	94.2	Very high	16 Å²	16	41.6 Å²	41.6	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-56.6	-37.7	172.6	169.3	68.4	0	0	0	112.8	G278 E280 S284 K286 K566 L570	G278-L282 VanDerWaalsContact O-CB 3.31Å; G278-L282 WeakPolarHBondContact O-CB 3.21Å; G278-L282 PolarHBondContact O-N 3.01Å; E280-L282 PolarHBondContact O-N 3.29Å; L282-S284 VanDerWaalsContact C-N 3.33Å; L282-K286 WeakPolarHBondContact O-CB 3.19Å; L282-K286 PolarHBondContact O-N 3.07Å; L282-K566 HydrophobicContact CD2-CB 3.63Å; L282-K566 HydrophobicContact CD2-CD 3.73Å; L282-K566 HydrophobicContact CD2-CG 3.98Å; L282-L570 HydrophobicContact CD1-CB 4.07Å; L282-L570 HydrophobicContact CD1-CD2 3.51Å; L282-L570 HydrophobicContact CD1-CG 4.45Å
283	Q	92.2	Very high	94	Very high	28 Å²	28	45.1 Å²	45.1	13%	0.131	23%	0.233	C	C	.	.	H	α-helix	trans	-69.7	-32.3	178	171.2	53	37	0	0	111.1	F279 E280 Q281 V287 I303	F279-Q283 WeakPolarHBondContact O-CB 3.3Å; F279-Q283 PolarHBondContact O-N 3.21Å; F279-Q283 VanDerWaalsContact O-N 3.13Å; E280-Q283 WeakPolarHBondContact O-CA 3.43Å; E280-Q283 WeakPolarHBondContact O-CB 3.35Å; E280-Q283 PolarHBondContact O-N 3.46Å; Q281-Q283 VanDerWaalsContact C-N 3.26Å; Q281-Q283 PolarHBondContact O-N 3.38Å; Q283-V287 WeakPolarHBondContact O-CG2 3.45Å; Q283-V287 PolarHBondContact O-N 2.76Å; Q283-I303 HydrophobicContact CB-CD1 4.22Å
284	S	93.3	Very high	93.8	Very high	74 Å²	74	48.1 Å²	48.1	52%	0.517	27%	0.266	S	S	.	.	H	α-helix	trans	-69.7	-47.7	170.4	-56.9	0	0	0	0	113.1	E280 Q281 L282 K286 V287 C288	E280-S284 PolarHBondContact O-N 3.17Å; E280-S284 PolarHBondContact O-OG 2.73Å; Q281-S284 WeakPolarHBondContact O-CA 3.42Å; Q281-S284 WeakPolarHBondContact O-CB 3.47Å; Q281-S284 PolarHBondContact O-N 3.24Å; L282-S284 VanDerWaalsContact C-N 3.33Å; S284-K286 PolarHBondContact O-N 3.22Å; S284-V287 WeakPolarHBondContact O-CA 3.47Å; S284-V287 WeakPolarHBondContact O-CB 3.47Å; S284-V287 PolarHBondContact O-N 3.35Å; S284-C288 PolarHBondContact O-N 2.83Å; S284-C288 VanDerWaalsContact O-N 3.15Å; S284-C288 PolarHBondContact O-SG 2.88Å; S284-C288 VanDerWaalsContact O-SG 3.35Å
285	I	93.5	Very high	93.7	Very high	81 Å²	81	48.6 Å²	48.6	42%	0.415	27%	0.268	S	S	.	.	H	α-helix	trans	-57.1	-36.4	174.6	-59.7	163.7	0	0	0	110	Q281 V287 C288 K289 L570	Q281-I285 WeakPolarHBondContact O-CG1 3.23Å; Q281-I285 PolarHBondContact O-N 2.98Å; I285-V287 VanDerWaalsContact C-N 3.28Å; I285-V287 PolarHBondContact O-N 3.06Å; I285-C288 PolarHBondContact O-N 3.49Å; I285-K289 WeakPolarHBondContact O-CB 3.48Å; I285-K289 PolarHBondContact O-N 2.75Å; I285-L570 HydrophobicContact CB-CD2 4.05Å; I285-L570 HydrophobicContact CG2-CD2 3.75Å
286	K	93.6	Very high	93.4	Very high	53 Å²	53	52.3 Å²	52.3	23%	0.23	29%	0.293	C	S	.	.	H	α-helix	trans	-72.8	-11.7	175.4	-174.9	169.7	131.5	-67.3	0	114.8	L282 S284 R290 L570	L282-K286 WeakPolarHBondContact O-CB 3.19Å; L282-K286 PolarHBondContact O-N 3.07Å; S284-K286 PolarHBondContact O-N 3.22Å; K286-R290 WeakPolarHBondContact O-CD 3.49Å; K286-R290 VanDerWaalsContact O-CG 3.31Å; K286-R290 WeakPolarHBondContact O-CG 3.44Å; K286-L570 HydrophobicContact CB-CD1 3.86Å; K286-L570 HydrophobicContact CB-CD2 3.8Å; K286-L570 HydrophobicContact CD-CD1 4.3Å; K286-L570 HydrophobicContact CG-CD1 3.81Å
287	V	94	Very high	92.9	Very high	48 Å²	48	56.9 Å²	56.9	29%	0.291	32%	0.323	S	S	.	.	H	α-helix	trans	-85	-50.5	168.5	170.6	0	0	0	0	109.1	Q283 S284 I285 K289 R290 E291 L298	Q283-V287 WeakPolarHBondContact O-CG2 3.45Å; Q283-V287 PolarHBondContact O-N 2.76Å; S284-V287 WeakPolarHBondContact O-CA 3.47Å; S284-V287 WeakPolarHBondContact O-CB 3.47Å; S284-V287 PolarHBondContact O-N 3.35Å; I285-V287 VanDerWaalsContact C-N 3.28Å; I285-V287 PolarHBondContact O-N 3.06Å; V287-K289 PolarHBondContact O-N 2.72Å; V287-R290 WeakPolarHBondContact O-CA 3.4Å; V287-R290 WeakPolarHBondContact O-CB 3.2Å; V287-R290 PolarHBondContact O-N 2.87Å; V287-E291 VanDerWaalsContact CG1-OE1 3.24Å; V287-E291 WeakPolarHBondContact CG1-OE1 3.38Å; V287-E291 PolarHBondContact O-N 3.06Å; V287-E291 VanDerWaalsContact O-N 3.12Å; V287-L298 HydrophobicContact CG2-CD1 4.31Å
288	C	93.9	Very high	92.3	Very high	59 Å²	59	58.6 Å²	58.6	40%	0.399	33%	0.332	S	S	.	.	H	α-helix	trans	-53.3	-52.6	175.5	-48.9	0	0	0	0	111.2	S284 I285 R290 E291 E292	S284-C288 PolarHBondContact O-N 2.83Å; S284-C288 VanDerWaalsContact O-N 3.15Å; S284-C288 PolarHBondContact O-SG 2.88Å; S284-C288 VanDerWaalsContact O-SG 3.35Å; I285-C288 PolarHBondContact O-N 3.49Å; C288-R290 PolarHBondContact O-N 2.81Å; C288-E291 WeakPolarHBondContact O-CA 3.45Å; C288-E291 PolarHBondContact O-N 3.37Å; C288-E292 WeakPolarHBondContact CB-OE1 3.4Å; C288-E292 WeakPolarHBondContact O-CG 3.42Å; C288-E292 PolarHBondContact O-N 2.94Å
289	K	93.4	Very high	91.5	Very high	40 Å²	40	62.2 Å²	62.2	17%	0.174	35%	0.353	C	S	.	.	H	α-helix	trans	-67.9	4.5	176.9	-159.7	162.1	-168.5	169.9	0	115.4	I285 V287 E292 L293 L570 N571	I285-K289 WeakPolarHBondContact O-CB 3.48Å; I285-K289 PolarHBondContact O-N 2.75Å; V287-K289 PolarHBondContact O-N 2.72Å; K289-E292 WeakPolarHBondContact CA-OE2 3.41Å; K289-E292 PolarHBondContact N-OE1 3.47Å; K289-L293 WeakPolarHBondContact O-CD1 3.37Å; K289-L570 HydrophobicContact CB-CD1 4.49Å; K289-L570 HydrophobicContact CD-CD1 4.37Å; K289-L570 HydrophobicContact CD-CG 4.41Å; K289-N571 PolarHBondContact NZ-O 3.49Å
290	R	94.5	Very high	91.1	Very high	8 Å²	8	63.4 Å²	63.4	3%	0.03	36%	0.359	C	S	.	.	H	α-helix	trans	-101.7	-39.9	163.6	-75.3	-179	69.2	75.7	-3.4	111.5	K286 V287 C288 L293 G294 L295 P296 I455 V457	K286-R290 WeakPolarHBondContact O-CD 3.49Å; K286-R290 VanDerWaalsContact O-CG 3.31Å; K286-R290 WeakPolarHBondContact O-CG 3.44Å; V287-R290 WeakPolarHBondContact O-CA 3.4Å; V287-R290 WeakPolarHBondContact O-CB 3.2Å; V287-R290 PolarHBondContact O-N 2.87Å; C288-R290 PolarHBondContact O-N 2.81Å; R290-L293 CarbonylContact O-C 3.59Å; R290-L293 PolarHBondContact O-N 2.86Å; R290-G294 PolarHBondContact O-N 2.96Å; R290-L295 HydrophobicContact CB-CB 4.09Å; R290-L295 HydrophobicContact CG-CB 4.4Å; R290-L295 HydrophobicContact CG-CD1 4.38Å; R290-L295 WeakPolarHBondContact O-CB 3.39Å; R290-L295 PolarHBondContact O-N 3.34Å; R290-P296 VanDerWaalsContact CZ-O 3.26Å; R290-P296 PolarHBondContact NE-O 2.69Å; R290-P296 PolarHBondContact NH2-O 2.8Å; R290-I455 PolarHBondContact NH1-O 2.73Å; R290-I455 PolarHBondContact NH2-O 3.01Å; R290-V457 HydrophobicContact CG-CG2 3.97Å
291	E	94.8	Very high	90.7	Very high	123 Å²	123	61.3 Å²	61.3	58%	0.575	35%	0.351	S	S	*	.	H	α-helix	trans	-65.2	-43.6	177.4	-68.5	162.1	179.4	0	0	110.5	V287 C288 L293 G294	V287-E291 VanDerWaalsContact CG1-OE1 3.24Å; V287-E291 WeakPolarHBondContact CG1-OE1 3.38Å; V287-E291 PolarHBondContact O-N 3.06Å; V287-E291 VanDerWaalsContact O-N 3.12Å; C288-E291 WeakPolarHBondContact O-CA 3.45Å; C288-E291 PolarHBondContact O-N 3.37Å; E291-L293 VanDerWaalsContact C-N 3.25Å; E291-L293 PolarHBondContact O-N 2.96Å; E291-G294 PolarHBondContact O-N 2.92Å
292	E	93.5	Very high	90.2	Very high	130 Å²	130	59.4 Å²	59.4	61%	0.607	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-39	168.9	-68.4	152.6	-141.2	0	0	113.1	C288 K289 G294	C288-E292 WeakPolarHBondContact CB-OE1 3.4Å; C288-E292 WeakPolarHBondContact O-CG 3.42Å; C288-E292 PolarHBondContact O-N 2.94Å; K289-E292 WeakPolarHBondContact CA-OE2 3.41Å; K289-E292 PolarHBondContact N-OE1 3.47Å; E292-G294 VanDerWaalsContact C-N 3.32Å
293	L	93.3	Very high	89.5	Confident	73 Å²	73	59.9 Å²	59.9	38%	0.382	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	11.4	-179.9	-64.8	179.8	0	0	0	113.2	K289 R290 E291 L295 V457 V460	K289-L293 WeakPolarHBondContact O-CD1 3.37Å; R290-L293 CarbonylContact O-C 3.59Å; R290-L293 PolarHBondContact O-N 2.86Å; E291-L293 VanDerWaalsContact C-N 3.25Å; E291-L293 PolarHBondContact O-N 2.96Å; L293-L295 HydrophobicContact CB-CD1 4.19Å; L293-L295 HydrophobicContact CB-CG 3.94Å; L293-L295 HydrophobicContact CD1-CD1 4.48Å; L293-L295 PolarHBondContact O-N 3.01Å; L293-L295 VanDerWaalsContact O-N 3.09Å; L293-V457 HydrophobicContact CD1-CB 4.49Å; L293-V457 HydrophobicContact CD1-CG1 3.93Å; L293-V457 HydrophobicContact CD1-CG2 4.33Å; L293-V460 HydrophobicContact CD1-CG1 4.34Å; L293-V460 HydrophobicContact CD2-CG1 4.48Å
294	G	94.1	Very high	88.9	Confident	67 Å²	67	67.7 Å²	67.7	69%	0.691	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	16.1	-178.5	0	0	0	0	0	114.8	R290 E291 E292	R290-G294 PolarHBondContact O-N 2.96Å; E291-G294 PolarHBondContact O-N 2.92Å; E292-G294 VanDerWaalsContact C-N 3.32Å
295	L	93.4	Very high	88.4	Confident	19 Å²	19	65.4 Å²	65.4	10%	0.099	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-84.5	137.9	-175.5	-60.6	-178.6	0	0	0	111	R290 L293 I455 V457 V460	R290-L295 HydrophobicContact CB-CB 4.09Å; R290-L295 HydrophobicContact CG-CB 4.4Å; R290-L295 HydrophobicContact CG-CD1 4.38Å; R290-L295 WeakPolarHBondContact O-CB 3.39Å; R290-L295 PolarHBondContact O-N 3.34Å; L293-L295 HydrophobicContact CB-CD1 4.19Å; L293-L295 HydrophobicContact CB-CG 3.94Å; L293-L295 HydrophobicContact CD1-CD1 4.48Å; L293-L295 PolarHBondContact O-N 3.01Å; L293-L295 VanDerWaalsContact O-N 3.09Å; L295-I455 HydrophobicContact CD2-CB 4.12Å; L295-I455 HydrophobicContact CD2-CD1 4.43Å; L295-I455 HydrophobicContact CD2-CG2 3.92Å; L295-V457 HydrophobicContact CD1-CG2 4.4Å; L295-V460 HydrophobicContact CD1-CG2 4.07Å; L295-V460 HydrophobicContact CD2-CG2 4.16Å
296	P	89.4	Confident	87.9	Confident	88 Å²	88	62 Å²	62	57%	0.571	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-53.1	149.8	177.9	-29.1	35	0	0	0	113.8	R290	R290-P296 VanDerWaalsContact CZ-O 3.26Å; R290-P296 PolarHBondContact NE-O 2.69Å; R290-P296 PolarHBondContact NH2-O 2.8Å
297	P	86.7	Confident	87.2	Confident	104 Å²	104	65 Å²	65	68%	0.675	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-58.1	159.1	178.2	24.3	-34.5	0	0	0	112
298	L	82.3	Confident	86.3	Confident	36 Å²	36	65 Å²	65	19%	0.188	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-72.8	126.6	178.8	-66.7	166.3	0	0	0	109.4	V287 E300 Y454	V287-L298 HydrophobicContact CG2-CD1 4.31Å; L298-E300 PolarHBondContact O-N 2.81Å; L298-E300 VanDerWaalsContact O-N 3.14Å; L298-Y454 HydrophobicContact CD2-CE2 3.88Å
299	P	76.7	Confident	85.7	Confident	84 Å²	84	63.4 Å²	63.4	55%	0.545	34%	0.342	S	S	.	.	S	Bend	trans	-68.7	-16.1	-173.7	27.4	-36.3	0	0	0	113.7
300	E	83.1	Confident	84.9	Confident	38 Å²	38	71.2 Å²	71.2	18%	0.178	37%	0.37	C	S	.	.	S	Bend	trans	-160	135	-179.3	62.1	-152.8	165.3	0	0	109.8	L298 S302 V305 W403 A404 R723	L298-E300 PolarHBondContact O-N 2.81Å; L298-E300 VanDerWaalsContact O-N 3.14Å; E300-S302 PolarHBondContact O-N 3.23Å; E300-V305 HydrophobicContact CB-CG2 4.22Å; E300-W403 HydrophobicContact CG-CE3 4.37Å; E300-W403 VanDerWaalsContact OE2-CA 3.29Å; E300-W403 WeakPolarHBondContact OE2-CA 3.47Å; E300-A404 PolarHBondContact OE1-N 3.21Å; E300-A404 VanDerWaalsContact OE1-N 3.16Å; E300-A404 PolarHBondContact OE2-N 2.8Å; E300-R723 IonicContact OE1-CZ 3.74Å; E300-R723 IonicContact OE1-NE 3.56Å; E300-R723 PolarHBondContact OE1-NE 3.18Å; E300-R723 IonicContact OE1-NH2 3.94Å; E300-R723 PolarHBondContact OE1-NH2 3.39Å
301	D	83.1	Confident	84	Confident	31 Å²	31	71.7 Å²	71.7	17%	0.166	38%	0.375	C	S	.	.			trans	-76	121.6	169	168.9	35.8	0	0	0	110.2	I303 R304 V305	D301-I303 VanDerWaalsContact C-N 3.27Å; D301-I303 PolarHBondContact O-N 2.86Å; D301-I303 PolarHBondContact OD1-N 3.47Å; D301-I303 PolarHBondContact OD2-N 2.83Å; D301-R304 HydrophobicContact CB-CB 4.39Å; D301-R304 WeakPolarHBondContact OD2-CB 3.5Å; D301-R304 WeakPolarHBondContact OD2-CG 3.48Å; D301-R304 PolarHBondContact OD2-N 3.18Å; D301-R304 IonicContact OD2-NE 2.74Å; D301-V305 WeakPolarHBondContact O-CB 3.42Å; D301-V305 VanDerWaalsContact O-CG2 3.23Å; D301-V305 WeakPolarHBondContact O-CG2 3.24Å; D301-V305 PolarHBondContact O-N 3.07Å
302	S	80.9	Confident	82.8	Confident	48 Å²	48	66.4 Å²	66.4	34%	0.336	35%	0.353	S	S	.	.	H	α-helix	trans	-68.8	-17.4	177.9	58.2	0	0	0	0	115	E300 I306	E300-S302 PolarHBondContact O-N 3.23Å; S302-I306 WeakPolarHBondContact O-CB 3.48Å; S302-I306 WeakPolarHBondContact O-CD1 3.49Å; S302-I306 WeakPolarHBondContact O-CG1 3.37Å; S302-I306 PolarHBondContact O-N 3.39Å
303	I	79.8	Confident	81.6	Confident	25 Å²	25	65.6 Å²	65.6	13%	0.128	36%	0.362	C	S	.	.	H	α-helix	trans	-79.3	-56.6	176.9	-52.7	178.5	0	0	0	109.2	F279 E280 Q283 D301 V305 I306 R307	F279-I303 HydrophobicContact CB-CD1 4.46Å; E280-I303 WeakPolarHBondContact OE2-CD1 3.27Å; Q283-I303 HydrophobicContact CB-CD1 4.22Å; D301-I303 VanDerWaalsContact C-N 3.27Å; D301-I303 PolarHBondContact O-N 2.86Å; D301-I303 PolarHBondContact OD1-N 3.47Å; D301-I303 PolarHBondContact OD2-N 2.83Å; I303-V305 PolarHBondContact O-N 3.49Å; I303-I306 PolarHBondContact O-N 3.44Å; I303-R307 VanDerWaalsContact CG2-NH1 3.31Å; I303-R307 PolarHBondContact O-N 2.92Å
304	R	80.4	Confident	80.1	Confident	192 Å²	192	63.2 Å²	63.2	73%	0.725	35%	0.351	S	S	*	.	H	α-helix	trans	-53.2	-47.3	174.2	-71.5	167.9	-167.2	-139.9	1.1	112.7	D301 I306 R307 S308	D301-R304 HydrophobicContact CB-CB 4.39Å; D301-R304 WeakPolarHBondContact OD2-CB 3.5Å; D301-R304 WeakPolarHBondContact OD2-CG 3.48Å; D301-R304 PolarHBondContact OD2-N 3.18Å; D301-R304 IonicContact OD2-NE 2.74Å; R304-I306 VanDerWaalsContact C-N 3.27Å; R304-I306 PolarHBondContact O-N 2.97Å; R304-R307 PolarHBondContact O-N 2.87Å; R304-S308 WeakPolarHBondContact O-CB 3.44Å; R304-S308 PolarHBondContact O-N 3.32Å
305	V	82.8	Confident	78.4	Confident	26 Å²	26	60.7 Å²	60.7	16%	0.158	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-37.5	177.7	167	0	0	0	0	111.8	E300 D301 I303 S308 M309 P402 W403	E300-V305 HydrophobicContact CB-CG2 4.22Å; D301-V305 WeakPolarHBondContact O-CB 3.42Å; D301-V305 VanDerWaalsContact O-CG2 3.23Å; D301-V305 WeakPolarHBondContact O-CG2 3.24Å; D301-V305 PolarHBondContact O-N 3.07Å; I303-V305 PolarHBondContact O-N 3.49Å; V305-S308 PolarHBondContact O-OG 2.83Å; V305-M309 HydrophobicContact CG1-CE 3.64Å; V305-P402 VanDerWaalsContact CG1-O 3.23Å; V305-P402 WeakPolarHBondContact CG1-O 3.44Å; V305-W403 HydrophobicContact CB-CH2 4.26Å; V305-W403 HydrophobicContact CB-CZ3 4.02Å; V305-W403 HydrophobicContact CG1-CD2 4.12Å; V305-W403 HydrophobicContact CG1-CE3 3.77Å; V305-W403 HydrophobicContact CG1-CH2 3.64Å; V305-W403 HydrophobicContact CG1-CZ2 3.98Å; V305-W403 HydrophobicContact CG1-CZ3 3.52Å
306	I	82.3	Confident	76.5	Confident	9 Å²	9	60.6 Å²	60.6	5%	0.046	32%	0.324	C	S	.	.	H	α-helix	trans	-75.2	-42.9	177.6	-65.7	171.5	0	0	0	111.9	S302 I303 R304 S308 M309 W403 M687 L690	S302-I306 WeakPolarHBondContact O-CB 3.48Å; S302-I306 WeakPolarHBondContact O-CD1 3.49Å; S302-I306 WeakPolarHBondContact O-CG1 3.37Å; S302-I306 PolarHBondContact O-N 3.39Å; I303-I306 PolarHBondContact O-N 3.44Å; R304-I306 VanDerWaalsContact C-N 3.27Å; R304-I306 PolarHBondContact O-N 2.97Å; I306-S308 PolarHBondContact O-N 3.16Å; I306-M309 PolarHBondContact O-N 3.12Å; I306-M309 VanDerWaalsContact O-N 3.1Å; I306-W403 HydrophobicContact CD1-CH2 4.39Å; I306-W403 HydrophobicContact CG1-CH2 4.02Å; I306-W403 HydrophobicContact CG1-CZ2 4.29Å; I306-M687 HydrophobicContact CB-CE 4.47Å; I306-M687 HydrophobicContact CG2-CB 3.68Å; I306-M687 HydrophobicContact CG2-CE 3.64Å; I306-M687 HydrophobicContact CG2-CG 3.8Å; I306-M687 HydrophobicContact CG2-SD 4.48Å; I306-L690 HydrophobicContact CD1-CD2 3.52Å; I306-L690 HydrophobicContact CG1-CD2 3.5Å; I306-L690 VanDerWaalsContact CG1-CD2 3.5Å; I306-L690 HydrophobicContact CG2-CD2 4.45Å
307	R	77.9	Confident	74.8	Confident	118 Å²	118	57.3 Å²	57.3	45%	0.445	30%	0.303	S	S	.	.	H	α-helix	trans	-54.1	-36.6	173.5	-76.1	-168.8	176.8	102.7	2.3	111.3	E49 E280 I303 R304 M309	E49-R307 IonicContact OE1-CZ 3.21Å; E49-R307 IonicContact OE1-NE 2.72Å; E49-R307 PolarHBondContact OE1-NE 3.14Å; E49-R307 IonicContact OE1-NH2 2.76Å; E49-R307 PolarHBondContact OE1-NH2 3.13Å; E280-R307 IonicContact OE1-CZ 2.87Å; E280-R307 IonicContact OE1-NH1 3.62Å; E280-R307 PolarHBondContact OE1-NH1 2.96Å; E280-R307 IonicContact OE1-NH2 3.76Å; E280-R307 PolarHBondContact OE1-NH2 2.83Å; I303-R307 VanDerWaalsContact CG2-NH1 3.31Å; I303-R307 PolarHBondContact O-N 2.92Å; R304-R307 PolarHBondContact O-N 2.87Å; R307-M309 PolarHBondContact O-N 3.27Å
308	S	76.7	Confident	73.1	Confident	48 Å²	48	55.8 Å²	55.8	34%	0.336	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-15.9	-179.6	79.8	0	0	0	0	115.5	R304 V305 I306 F397	R304-S308 WeakPolarHBondContact O-CB 3.44Å; R304-S308 PolarHBondContact O-N 3.32Å; V305-S308 PolarHBondContact O-OG 2.83Å; I306-S308 PolarHBondContact O-N 3.16Å; S308-F397 WeakPolarHBondContact O-CZ 3.49Å
309	M	80.6	Confident	71.5	Confident	24 Å²	24	57.7 Å²	57.7	12%	0.118	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-82.3	128.5	-175	-85.2	-168.6	-117.7	0	0	112.7	V305 I306 R307 P402 W403 A686 L690 K721	V305-M309 HydrophobicContact CG1-CE 3.64Å; I306-M309 PolarHBondContact O-N 3.12Å; I306-M309 VanDerWaalsContact O-N 3.1Å; R307-M309 PolarHBondContact O-N 3.27Å; M309-P402 HydrophobicContact CE-CB 4.18Å; M309-P402 HydrophobicContact CE-CG 4.22Å; M309-P402 HydrophobicContact CG-CB 4.5Å; M309-P402 HydrophobicContact SD-CB 4.42Å; M309-P402 HydrophobicContact SD-CG 4.14Å; M309-W403 HydrophobicContact CE-CH2 4.27Å; M309-W403 HydrophobicContact CE-CZ2 3.45Å; M309-W403 VanDerWaalsContact CE-CZ2 3.45Å; M309-A686 HydrophobicContact CB-CB 4.18Å; M309-A686 WeakPolarHBondContact O-CB 3.43Å; M309-L690 HydrophobicContact CE-CD2 4.4Å; M309-K721 HydrophobicContact SD-CD 4.15Å
310	R	75.8	Confident	70.5	Confident	205 Å²	205	56.8 Å²	56.8	77%	0.774	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-67	160.4	160.9	-64.3	-171.3	-178.7	-167.6	-2.4	111.7	K721	R310-K721 PolarHBondContact O-NZ 2.81Å
311	A	76.6	Confident	69.5	Low	17 Å²	17	58.7 Å²	58.7	14%	0.14	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-57.9	169.3	168	0	0	0	0	0	112.4	K684 K721	A311-K684 HydrophobicContact CB-CB 4.23Å; A311-K721 PolarHBondContact O-NZ 3.31Å
312	A	70.4	Confident	68.6	Low	13 Å²	13	61.6 Å²	61.6	11%	0.107	33%	0.332	C	S	.	.			trans	-106.1	144.2	164.3	0	0	0	0	0	109.1	Q689 A717	A312-Q689 PolarHBondContact O-NE2 3.04Å; A312-Q689 PolarHBondContact O-OE1 3.26Å; A312-A717 HydrophobicContact CB-CB 4.34Å
313	S	68	Low	67.6	Low	112 Å²	112	63.8 Å²	63.8	78%	0.783	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-56.7	132	174.5	-41.2	0	0	0	0	110.1
314	P	60.1	Low	66.6	Low	24 Å²	24	67.9 Å²	67.9	16%	0.156	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-62.9	148.3	-174.9	25	-34.3	0	0	0	111.5
315	P	59.5	Low	65.5	Low	14 Å²	14	65.6 Å²	65.6	9%	0.091	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-66.8	142	176.4	30.1	-35.6	0	0	0	110.1	S317 K678 L681	P315-S317 PolarHBondContact O-N 3.36Å; P315-K678 HydrophobicContact CB-CG 4.31Å; P315-K678 HydrophobicContact CG-CG 3.78Å; P315-L681 HydrophobicContact CG-CB 3.99Å; P315-L681 HydrophobicContact CG-CD1 4.02Å
316	A	54	Low	64.5	Low	16 Å²	16	70 Å²	70	13%	0.132	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-52.1	129	178.5	0	0	0	0	0	110.9	D320 L321	A316-D320 WeakPolarHBondContact CA-OD2 3.37Å; A316-D320 HydrophobicContact CB-CB 4.32Å; A316-L321 HydrophobicContact CB-CD2 4.08Å; A316-L321 HydrophobicContact CB-CG 4.06Å
317	S	53.3	Low	63.2	Low	20 Å²	20	74.7 Å²	74.7	14%	0.14	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-81.5	172.1	-178.7	106.7	0	0	0	0	111.4	P315 S319 D320 L321	P315-S317 PolarHBondContact O-N 3.36Å; S317-S319 VanDerWaalsContact C-N 3.33Å; S317-S319 PolarHBondContact O-N 3.19Å; S317-S319 PolarHBondContact OG-OG 2.91Å; S317-D320 VanDerWaalsContact CB-OD1 3.27Å; S317-D320 WeakPolarHBondContact CB-OD1 3.48Å; S317-D320 VanDerWaalsContact N-CG 3.26Å; S317-D320 PolarHBondContact N-OD2 2.85Å; S317-D320 PolarHBondContact O-N 3.46Å; S317-D320 PolarHBondContact OG-OD1 2.87Å; S317-L321 WeakPolarHBondContact O-CB 3.47Å; S317-L321 VanDerWaalsContact O-CG 3.28Å; S317-L321 WeakPolarHBondContact O-CG 3.48Å; S317-L321 PolarHBondContact O-N 3.12Å
318	A	50.9	Low	62	Low	72 Å²	72	77.5 Å²	77.5	60%	0.595	40%	0.402	S	S	*	.	H	α-helix	trans	-62.7	-39.6	-177.1	0	0	0	0	0	112.1	L321 I322	A318-L321 PolarHBondContact O-N 3.2Å; A318-I322 WeakPolarHBondContact O-CB 3.31Å; A318-I322 WeakPolarHBondContact O-CD1 3.34Å; A318-I322 VanDerWaalsContact O-CG1 3.24Å; A318-I322 WeakPolarHBondContact O-CG1 3.42Å; A318-I322 PolarHBondContact O-N 2.88Å
319	S	48.8	Very low	60.9	Low	76 Å²	76	77.7 Å²	77.7	53%	0.531	41%	0.407	S	S	.	.	H	α-helix	trans	-65.2	-44.3	174	45.5	0	0	0	0	111.6	S317 L321 I322 E323	S317-S319 VanDerWaalsContact C-N 3.33Å; S317-S319 PolarHBondContact O-N 3.19Å; S317-S319 PolarHBondContact OG-OG 2.91Å; S319-L321 VanDerWaalsContact C-N 3.25Å; S319-L321 PolarHBondContact O-N 3.09Å; S319-I322 PolarHBondContact O-N 3.2Å; S319-E323 WeakPolarHBondContact O-CB 3.35Å; S319-E323 PolarHBondContact O-N 3.45Å
320	D	54.8	Low	59.5	Low	65 Å²	65	86.3 Å²	86.3	35%	0.348	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-34.8	179.4	-27	-4.3	0	0	0	111.1	A316 S317 Q324	A316-D320 WeakPolarHBondContact CA-OD2 3.37Å; A316-D320 HydrophobicContact CB-CB 4.32Å; S317-D320 VanDerWaalsContact CB-OD1 3.27Å; S317-D320 WeakPolarHBondContact CB-OD1 3.48Å; S317-D320 VanDerWaalsContact N-CG 3.26Å; S317-D320 PolarHBondContact N-OD2 2.85Å; S317-D320 PolarHBondContact O-N 3.46Å; S317-D320 PolarHBondContact OG-OD1 2.87Å; D320-Q324 VanDerWaalsContact O-CB 3.3Å; D320-Q324 WeakPolarHBondContact O-CB 3.46Å; D320-Q324 VanDerWaalsContact O-CG 3.31Å; D320-Q324 WeakPolarHBondContact O-CG 3.5Å; D320-Q324 PolarHBondContact O-N 3.2Å
321	L	62.1	Low	58.2	Low	77 Å²	77	85.7 Å²	85.7	40%	0.403	44%	0.435	S	S	.	.	H	α-helix	trans	-73.1	-41.6	176.1	-72.1	167.8	0	0	0	111.9	A316 S317 A318 S319 E323 Q324 Q325	A316-L321 HydrophobicContact CB-CD2 4.08Å; A316-L321 HydrophobicContact CB-CG 4.06Å; S317-L321 WeakPolarHBondContact O-CB 3.47Å; S317-L321 VanDerWaalsContact O-CG 3.28Å; S317-L321 WeakPolarHBondContact O-CG 3.48Å; S317-L321 PolarHBondContact O-N 3.12Å; A318-L321 PolarHBondContact O-N 3.2Å; S319-L321 VanDerWaalsContact C-N 3.25Å; S319-L321 PolarHBondContact O-N 3.09Å; L321-E323 VanDerWaalsContact C-N 3.35Å; L321-Q324 PolarHBondContact O-N 2.97Å; L321-Q325 VanDerWaalsContact O-CB 3.29Å; L321-Q325 WeakPolarHBondContact O-CB 3.33Å; L321-Q325 PolarHBondContact O-N 3.37Å
322	I	64	Low	56.7	Low	93 Å²	93	90.6 Å²	90.6	48%	0.477	46%	0.455	S	S	.	.	H	α-helix	trans	-63	-43.1	172.6	-70.1	163	0	0	0	110.2	A318 S319 Q325 Q326	A318-I322 WeakPolarHBondContact O-CB 3.31Å; A318-I322 WeakPolarHBondContact O-CD1 3.34Å; A318-I322 VanDerWaalsContact O-CG1 3.24Å; A318-I322 WeakPolarHBondContact O-CG1 3.42Å; A318-I322 PolarHBondContact O-N 2.88Å; S319-I322 PolarHBondContact O-N 3.2Å; I322-Q325 CarbonylContact O-C 3.49Å; I322-Q325 PolarHBondContact O-N 3.26Å; I322-Q325 VanDerWaalsContact O-N 3.16Å; I322-Q326 HydrophobicContact CG2-CG 4.48Å; I322-Q326 WeakPolarHBondContact O-CB 3.21Å; I322-Q326 WeakPolarHBondContact O-CG 3.46Å; I322-Q326 PolarHBondContact O-N 2.95Å
323	E	59.8	Low	55.4	Low	94 Å²	94	97.8 Å²	97.8	44%	0.439	49%	0.487	S	S	.	.	H	α-helix	trans	-68.2	-38.4	178.1	-157.5	-149.8	-169.5	0	0	111.4	S319 L321 Q325 Q326 K327	S319-E323 WeakPolarHBondContact O-CB 3.35Å; S319-E323 PolarHBondContact O-N 3.45Å; L321-E323 VanDerWaalsContact C-N 3.35Å; E323-Q325 VanDerWaalsContact C-N 3.32Å; E323-Q325 PolarHBondContact O-N 3.23Å; E323-Q326 PolarHBondContact O-N 3.03Å; E323-K327 VanDerWaalsContact CD-CE 3.48Å; E323-K327 HydrophobicContact CG-CD 4.31Å; E323-K327 WeakPolarHBondContact O-CB 3.4Å; E323-K327 VanDerWaalsContact O-CG 3.25Å; E323-K327 WeakPolarHBondContact O-CG 3.47Å; E323-K327 PolarHBondContact O-N 3.1Å; E323-K327 WeakPolarHBondContact OE1-CE 3.31Å; E323-K327 IonicContact OE1-NZ 3.01Å; E323-K327 PolarHBondContact OE1-NZ 3.38Å; E323-K327 IonicContact OE2-NZ 2.81Å; E323-K327 PolarHBondContact OE2-NZ 2.73Å
324	Q	58.9	Low	54.3	Low	110 Å²	110	101 Å²	101	51%	0.514	49%	0.487	S	S	.	.	H	α-helix	trans	-64.5	-34.2	169.4	-81.5	-166.4	-21	0	0	112.7	D320 L321 R328	D320-Q324 VanDerWaalsContact O-CB 3.3Å; D320-Q324 WeakPolarHBondContact O-CB 3.46Å; D320-Q324 VanDerWaalsContact O-CG 3.31Å; D320-Q324 WeakPolarHBondContact O-CG 3.5Å; D320-Q324 PolarHBondContact O-N 3.2Å; L321-Q324 PolarHBondContact O-N 2.97Å; Q324-R328 WeakPolarHBondContact O-CB 3.42Å; Q324-R328 WeakPolarHBondContact O-CG 3.19Å; Q324-R328 PolarHBondContact O-N 3.44Å
325	Q	58.6	Low	53.3	Low	144 Å²	144	103 Å²	103	67%	0.673	51%	0.505	S	S	*	.	H	α-helix	trans	-73.2	-38.9	176.7	-168.7	167.9	-2.9	0	0	111.6	L321 I322 E323 R328 A329	L321-Q325 VanDerWaalsContact O-CB 3.29Å; L321-Q325 WeakPolarHBondContact O-CB 3.33Å; L321-Q325 PolarHBondContact O-N 3.37Å; I322-Q325 CarbonylContact O-C 3.49Å; I322-Q325 PolarHBondContact O-N 3.26Å; I322-Q325 VanDerWaalsContact O-N 3.16Å; E323-Q325 VanDerWaalsContact C-N 3.32Å; E323-Q325 PolarHBondContact O-N 3.23Å; Q325-R328 WeakPolarHBondContact O-CB 3.28Å; Q325-R328 PolarHBondContact O-N 3.14Å; Q325-A329 PolarHBondContact O-N 3.14Å
326	Q	61.3	Low	52.3	Low	119 Å²	119	109.8 Å²	109.8	56%	0.556	54%	0.54	S	S	*	.	H	α-helix	trans	-67.7	-39	170.8	-72	176.5	-8.4	0	0	112.2	I322 E323 R328 A329 R330	I322-Q326 HydrophobicContact CG2-CG 4.48Å; I322-Q326 WeakPolarHBondContact O-CB 3.21Å; I322-Q326 WeakPolarHBondContact O-CG 3.46Å; I322-Q326 PolarHBondContact O-N 2.95Å; E323-Q326 PolarHBondContact O-N 3.03Å; Q326-R328 VanDerWaalsContact C-N 3.28Å; Q326-R328 PolarHBondContact O-N 2.89Å; Q326-A329 PolarHBondContact O-N 3.15Å; Q326-R330 WeakPolarHBondContact O-CB 3.37Å; Q326-R330 WeakPolarHBondContact O-CG 3.16Å; Q326-R330 PolarHBondContact O-N 2.81Å
327	K	54.5	Low	51.9	Low	108 Å²	108	115.9 Å²	115.9	47%	0.47	57%	0.568	S	S	.	*	H	α-helix	trans	-69.5	-23	172.1	-75.1	170.9	177.6	166.9	0	112.5	E323 R331	E323-K327 VanDerWaalsContact CD-CE 3.48Å; E323-K327 HydrophobicContact CG-CD 4.31Å; E323-K327 WeakPolarHBondContact O-CB 3.4Å; E323-K327 VanDerWaalsContact O-CG 3.25Å; E323-K327 WeakPolarHBondContact O-CG 3.47Å; E323-K327 PolarHBondContact O-N 3.1Å; E323-K327 WeakPolarHBondContact OE1-CE 3.31Å; E323-K327 IonicContact OE1-NZ 3.01Å; E323-K327 PolarHBondContact OE1-NZ 3.38Å; E323-K327 IonicContact OE2-NZ 2.81Å; E323-K327 PolarHBondContact OE2-NZ 2.73Å; K327-R331 WeakPolarHBondContact O-CB 3.37Å; K327-R331 WeakPolarHBondContact O-CD 3.35Å; K327-R331 WeakPolarHBondContact O-CG 3.41Å; K327-R331 PolarHBondContact O-N 2.88Å
328	R	54.1	Low	51.3	Low	177 Å²	177	123.8 Å²	123.8	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-76.3	-50.9	167.8	-89.2	-174.9	168.7	-178.9	-6.6	111.9	Q324 Q325 Q326 R330 R331 E332	Q324-R328 WeakPolarHBondContact O-CB 3.42Å; Q324-R328 WeakPolarHBondContact O-CG 3.19Å; Q324-R328 PolarHBondContact O-N 3.44Å; Q325-R328 WeakPolarHBondContact O-CB 3.28Å; Q325-R328 PolarHBondContact O-N 3.14Å; Q326-R328 VanDerWaalsContact C-N 3.28Å; Q326-R328 PolarHBondContact O-N 2.89Å; R328-R330 VanDerWaalsContact C-N 3.29Å; R328-R330 PolarHBondContact O-N 3.11Å; R328-R331 CarbonylContact O-C 3.06Å; R328-R331 WeakPolarHBondContact O-CA 3.27Å; R328-R331 WeakPolarHBondContact O-CB 3.24Å; R328-R331 PolarHBondContact O-N 3.26Å; R328-E332 WeakPolarHBondContact O-CG 3.47Å; R328-E332 PolarHBondContact O-N 3.13Å
329	A	52.2	Low	50.6	Low	51 Å²	51	129.5 Å²	129.5	42%	0.421	62%	0.615	S	S	.	*	H	α-helix	trans	-55.2	-43.6	174.6	0	0	0	0	0	112	Q325 Q326 R331 E332 H333	Q325-A329 PolarHBondContact O-N 3.14Å; Q326-A329 PolarHBondContact O-N 3.15Å; A329-R331 VanDerWaalsContact C-N 3.26Å; A329-R331 PolarHBondContact O-N 3.29Å; A329-E332 WeakPolarHBondContact CA-OE2 3.48Å; A329-E332 PolarHBondContact O-N 3.32Å; A329-H333 VanDerWaalsContact O-CB 3.3Å; A329-H333 WeakPolarHBondContact O-CB 3.05Å; A329-H333 PolarHBondContact O-N 3.29Å
330	R	51.5	Low	49.7	Very low	205 Å²	205	133.2 Å²	133.2	77%	0.774	63%	0.629	S	S	*	*	H	α-helix	trans	-67.4	-17.9	172.9	-77.6	-175.8	170.6	-175.7	-2.1	114.8	Q326 R328	Q326-R330 WeakPolarHBondContact O-CB 3.37Å; Q326-R330 WeakPolarHBondContact O-CG 3.16Å; Q326-R330 PolarHBondContact O-N 2.81Å; R328-R330 VanDerWaalsContact C-N 3.29Å; R328-R330 PolarHBondContact O-N 3.11Å
331	R	49.2	Very low	48.5	Very low	192 Å²	192	136.8 Å²	136.8	73%	0.725	65%	0.648	S	S	*	*	H	α-helix	trans	-89.8	-39.8	172.5	-80.8	174.4	178.5	-159.7	-1.8	111.6	K327 R328 A329 H333 K334 A335	K327-R331 WeakPolarHBondContact O-CB 3.37Å; K327-R331 WeakPolarHBondContact O-CD 3.35Å; K327-R331 WeakPolarHBondContact O-CG 3.41Å; K327-R331 PolarHBondContact O-N 2.88Å; R328-R331 CarbonylContact O-C 3.06Å; R328-R331 WeakPolarHBondContact O-CA 3.27Å; R328-R331 WeakPolarHBondContact O-CB 3.24Å; R328-R331 PolarHBondContact O-N 3.26Å; A329-R331 VanDerWaalsContact C-N 3.26Å; A329-R331 PolarHBondContact O-N 3.29Å; R331-H333 VanDerWaalsContact C-N 3.34Å; R331-K334 CarbonylContact O-C 3.36Å; R331-K334 WeakPolarHBondContact O-CA 3.36Å; R331-K334 PolarHBondContact O-N 3.12Å; R331-A335 VanDerWaalsContact O-CB 3.26Å; R331-A335 WeakPolarHBondContact O-CB 3.17Å; R331-A335 PolarHBondContact O-N 2.93Å
332	E	44.8	Very low	47.1	Very low	120 Å²	120	140.3 Å²	140.3	56%	0.561	67%	0.666	S	S	*	*	H	α-helix	trans	-59	-47.4	172.3	-73	145.5	-162.1	0	0	109.8	R328 A329 K334 A335 L336	R328-E332 WeakPolarHBondContact O-CG 3.47Å; R328-E332 PolarHBondContact O-N 3.13Å; A329-E332 WeakPolarHBondContact CA-OE2 3.48Å; A329-E332 PolarHBondContact O-N 3.32Å; E332-K334 PolarHBondContact O-N 2.89Å; E332-A335 PolarHBondContact O-N 3.38Å; E332-A335 VanDerWaalsContact O-N 3.08Å; E332-L336 PolarHBondContact O-N 3.03Å; E332-L336 VanDerWaalsContact O-N 3.13Å
333	H	44	Very low	45.5	Very low	165 Å²	165	144.3 Å²	144.3	76%	0.764	69%	0.689	S	S	*	*	H	α-helix	trans	-67.7	-2.9	173.1	-144.8	63.5	0	0	0	114.8	A329 R331	A329-H333 VanDerWaalsContact O-CB 3.3Å; A329-H333 WeakPolarHBondContact O-CB 3.05Å; A329-H333 PolarHBondContact O-N 3.29Å; R331-H333 VanDerWaalsContact C-N 3.34Å
334	K	42.9	Very low	44.2	Very low	180 Å²	180	143.5 Å²	143.5	78%	0.783	70%	0.698	S	S	*	*	H	α-helix	trans	-119	-3.6	172.3	-136.6	-175.9	-173.6	-170.6	0	113.6	R331 E332	R331-K334 CarbonylContact O-C 3.36Å; R331-K334 WeakPolarHBondContact O-CA 3.36Å; R331-K334 PolarHBondContact O-N 3.12Å; E332-K334 PolarHBondContact O-N 2.89Å
335	A	39.2	Very low	42.7	Very low	66 Å²	66	148.6 Å²	148.6	55%	0.545	72%	0.719	S	S	.	*	H	α-helix	trans	-100.9	-19	176	0	0	0	0	0	111.7	R331 E332 I337 K338	R331-A335 VanDerWaalsContact O-CB 3.26Å; R331-A335 WeakPolarHBondContact O-CB 3.17Å; R331-A335 PolarHBondContact O-N 2.93Å; E332-A335 PolarHBondContact O-N 3.38Å; E332-A335 VanDerWaalsContact O-N 3.08Å; A335-I337 PolarHBondContact O-N 3.15Å; A335-K338 PolarHBondContact O-N 3.43Å
336	L	40	Very low	41.4	Very low	156 Å²	156	149.6 Å²	149.6	82%	0.817	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	10.9	174.9	-137	77.4	0	0	0	114.8	E332	E332-L336 PolarHBondContact O-N 3.03Å; E332-L336 VanDerWaalsContact O-N 3.13Å
337	I	44.1	Very low	40.2	Very low	143 Å²	143	152.6 Å²	152.6	73%	0.733	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	39.8	178.8	-38	-179.9	0	0	0	110.8	A335	A335-I337 PolarHBondContact O-N 3.15Å
338	K	41	Very low	39.1	Very low	187 Å²	187	156.9 Å²	156.9	81%	0.813	76%	0.761	S	S	*	*	S	Bend	trans	170.3	107.2	147.8	-98.9	167.4	-179.3	178.1	0	110.6	A335	A335-K338 PolarHBondContact O-N 3.43Å
339	Q	36.1	Very low	38.3	Very low	192 Å²	192	154.6 Å²	154.6	90%	0.897	76%	0.762	S	S	*	*				169.4	91.7	118.9	-91.7	-171.1	-95.5	0	0	110.5
340	D	30.3	Very low	37.3	Very low	154 Å²	154	157.3 Å²	157.3	82%	0.824	78%	0.776	S	S	*	*			trans	-77.3	120.3	148.8	-76	-64.1	0	0	0	108.6
341	N	29.8	Very low	36.6	Very low	140 Å²	140	157.2 Å²	157.2	75%	0.749	78%	0.777	S	S	*	*				168.5	145	125.3	-97.7	-75	0	0	0	112.9
342	L	33.8	Very low	35.9	Very low	150 Å²	150	157.7 Å²	157.7	79%	0.785	78%	0.784	S	S	*	*			trans	58.2	67.4	166.1	-80.1	77.4	0	0	0	117
343	D	30.4	Very low	35.3	Very low	178 Å²	178	156.9 Å²	156.9	95%	0.952	80%	0.798	S	S	*	*			trans	-86.3	111.3	138.4	-109.4	-29.6	0	0	0	108.1
344	A	31.6	Very low	34.5	Very low	76 Å²	76	156.3 Å²	156.3	63%	0.628	80%	0.8	S	S	*	*			trans	-122.8	139.1	174	0	0	0	0	0	109.4
345	F	28.4	Very low	34	Very low	218 Å²	218	154.5 Å²	154.5	96%	0.956	80%	0.8	S	S	*	*			trans	64.5	79.1	-170.6	-67.8	-92.9	0	0	0	115.4
346	N	31.3	Very low	33.5	Very low	165 Å²	165	154.9 Å²	154.9	88%	0.882	80%	0.798	S	S	*	*			trans	-115.4	139	135.8	-166.7	24.7	0	0	0	108.8
347	E	34.1	Very low	33.2	Very low	182 Å²	182	157 Å²	157	85%	0.85	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-87.7	149.8	-169.4	-159.7	166.6	-165.4	0	0	111.6
348	K	32.5	Very low	32.5	Very low	198 Å²	198	158 Å²	158	86%	0.861	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-75.1	133.5	-166.7	-72.5	-177.1	173.4	-176.4	0	113.5
349	D	36.1	Very low	32	Very low	128 Å²	128	156 Å²	156	68%	0.684	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.3	122.3	154	-175.5	-21.8	0	0	0	108.6	Y351	D349-Y351 VanDerWaalsContact C-N 3.26Å; D349-Y351 PolarHBondContact O-N 2.87Å; D349-Y351 PolarHBondContact OD1-N 3.21Å
350	P	32.8	Very low	31.9	Very low	109 Å²	109	155.8 Å²	155.8	71%	0.708	79%	0.794	S	S	*	*	S	Bend	trans	-72	-5.6	-173.8	-20.6	33.8	0	0	0	116.5
351	Y	36.3	Very low	31.8	Very low	203 Å²	203	155.8 Å²	155.8	80%	0.796	79%	0.794	S	S	*	*			trans	-116.9	42.3	-160.6	-75.1	-75.2	0	0	0	116.7	D349	D349-Y351 VanDerWaalsContact C-N 3.26Å; D349-Y351 PolarHBondContact O-N 2.87Å; D349-Y351 PolarHBondContact OD1-N 3.21Å
352	K	34.8	Very low	31.9	Very low	201 Å²	201	155.4 Å²	155.4	87%	0.874	79%	0.792	S	S	*	*			trans	-132.1	133.9	160.8	-72.3	-164.5	174	-172.2	0	112.8
353	A	31.5	Very low	31.7	Very low	104 Å²	104	154.5 Å²	154.5	86%	0.86	79%	0.788	S	S	*	*			trans	-85.7	163.6	176.3	0	0	0	0	0	111.6
354	D	28.4	Very low	31.8	Very low	152 Å²	152	152.2 Å²	152.2	81%	0.813	78%	0.776	S	S	*	*			trans	-75.3	143.4	-176.8	-164.7	12.8	0	0	0	112.7
355	D	31.9	Very low	31.7	Very low	143 Å²	143	155.2 Å²	155.2	77%	0.765	78%	0.781	S	S	*	*			trans	-160.8	168.3	142.6	-144.7	-24.2	0	0	0	110.1
356	S	28.4	Very low	31.8	Very low	74 Å²	74	152.2 Å²	152.2	52%	0.517	78%	0.775	S	S	.	*			trans	-134.8	174.4	-132	55.7	0	0	0	0	115.3
357	R	33	Very low	31.7	Very low	201 Å²	201	150.4 Å²	150.4	76%	0.758	77%	0.766	S	S	*	*			trans	105.5	127.3	174.9	-60.1	145.6	-153.7	-137.8	0.7	113.8
358	E	30.4	Very low	31.5	Very low	163 Å²	163	147.9 Å²	147.9	76%	0.762	76%	0.758	S	S	*	*				67	129.9	51.1	-56.6	163.7	172.7	0	0	111.5
359	D	30.4	Very low	31.3	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	76%	0.758	S	S	*	*			cis	-149.2	-160.4	-18.9	-88.5	-36.4	0	0	0	105.3
360	E	32.8	Very low	31.2	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	77%	0.767	S	S	*	*			cis	-148.3	172.8	15.6	-61.6	169.6	92.3	0	0	109.7
361	D	29.5	Very low	31	Very low	154 Å²	154	149.9 Å²	149.9	82%	0.824	78%	0.775	S	S	*	*			trans	-71.9	-169.7	171.1	-54.6	-72.2	0	0	0	112.1
362	D	30.7	Very low	31	Very low	132 Å²	132	145.1 Å²	145.1	71%	0.706	77%	0.769	S	S	*	*			cis	-167.9	-174.2	16.7	-150.5	-17.9	0	0	0	111.4
363	N	30.8	Very low	30.6	Very low	130 Å²	130	144.9 Å²	144.9	70%	0.695	77%	0.771	S	S	*	*			trans	74.4	147.4	159.2	-64.6	-45.6	0	0	0	120.2
364	D	31.6	Very low	30.2	Very low	130 Å²	130	146 Å²	146	70%	0.695	77%	0.767	S	S	*	*			cis	-165.3	168.1	-27.8	-152.9	-5	0	0	0	109.7
365	D	30.4	Very low	30.1	Very low	139 Å²	139	148.4 Å²	148.4	74%	0.743	77%	0.771	S	S	*	*			trans	38	140.4	161.8	-85	-26.6	0	0	0	121.3
366	N	30.9	Very low	30	Very low	155 Å²	155	147.3 Å²	147.3	83%	0.829	77%	0.771	S	S	*	*				-168.1	179.4	56.6	-167.1	11.6	0	0	0	112.8
367	D	29.1	Very low	30.1	Very low	128 Å²	128	152 Å²	152	68%	0.684	79%	0.79	S	S	*	*			trans	-79.8	174.4	-159.2	-163.1	21.3	0	0	0	118.8
368	N	30	Very low	30	Very low	128 Å²	128	151.6 Å²	151.6	68%	0.684	80%	0.797	S	S	*	*			trans	-57.2	156.5	-178	-70.5	-89.2	0	0	0	116.7
369	S	28.2	Very low	30	Very low	125 Å²	125	155.1 Å²	155.1	87%	0.874	80%	0.803	S	S	*	*				-162.4	147.8	122.4	-83.7	0	0	0	0	112.5
370	L	33.2	Very low	29.9	Very low	165 Å²	165	156 Å²	156	86%	0.864	81%	0.807	S	S	*	*			trans	-106.2	144	174.6	-81.2	147.8	0	0	0	110
371	E	28.6	Very low	29.7	Very low	188 Å²	188	156.1 Å²	156.1	88%	0.879	81%	0.808	S	S	*	*			trans	-159	155.5	146.4	-99.3	-70.8	105.7	0	0	107.7
372	P	35.4	Very low	29.8	Very low	103 Å²	103	155.4 Å²	155.4	67%	0.669	81%	0.809	S	S	*	*			trans	-114.6	139.7	-167.9	37.8	-26.6	0	0	0	114.9
373	E	26.5	Very low	29.9	Very low	196 Å²	196	157 Å²	157	92%	0.916	81%	0.814	S	S	*	*			trans	-116	151.9	169.3	-77.3	-144.8	137.3	0	0	115.1
374	T	25	Very low	30	Very low	127 Å²	127	155.8 Å²	155.8	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-77.4	147.6	-164.8	47.9	0	0	0	0	115.7
375	F	24.6	Very low	30.1	Very low	203 Å²	203	155.1 Å²	155.1	89%	0.89	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.2	131.9	162.1	-75.9	-93.7	0	0	0	111.8
376	P	30.8	Very low	30.2	Very low	119 Å²	119	154.2 Å²	154.2	77%	0.773	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73.7	147.9	161.1	-13.9	30.2	0	0	0	111.7
377	L	30.3	Very low	30.3	Very low	174 Å²	174	153.5 Å²	153.5	91%	0.911	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-91.8	119.1	169.8	-73.9	161.9	0	0	0	109.8
378	E	31.9	Very low	30.4	Very low	192 Å²	192	153.3 Å²	153.3	90%	0.897	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.2	155.8	166.8	-68.3	-170.4	139.1	0	0	111.1
379	R	29.5	Very low	30.5	Very low	237 Å²	237	155 Å²	155	89%	0.894	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-91.2	153.2	-173.1	-68.5	176	172.6	171.1	-3.1	112	E381	R379-E381 PolarHBondContact O-N 3.35Å
380	D	27.8	Very low	30.5	Very low	163 Å²	163	154.3 Å²	154.3	87%	0.872	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.7	162.7	-71.7	-62.8	0	0	0	110.8
381	E	29.6	Very low	30.3	Very low	190 Å²	190	152.7 Å²	152.7	89%	0.888	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-98	122.5	155.9	-71.3	-158.7	149.8	0	0	109.4	R379 M383	R379-E381 PolarHBondContact O-N 3.35Å; E381-M383 PolarHBondContact O-N 3.06Å
382	V	31.6	Very low	30.4	Very low	139 Å²	139	148.5 Å²	148.5	84%	0.842	81%	0.805	S	S	*	*			trans	-80.2	113.4	-173.1	179.5	0	0	0	0	110.2
383	M	31.8	Very low	30.1	Very low	166 Å²	166	152.1 Å²	152.1	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.3	140.5	170.6	-75.9	-173.6	65.1	0	0	111.6	E381	E381-M383 PolarHBondContact O-N 3.06Å
384	P	34	Very low	30.4	Very low	105 Å²	105	154 Å²	154	68%	0.682	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.8	151.9	170.1	29.4	-34.8	0	0	0	111.1
385	P	33.7	Very low	30.9	Very low	115 Å²	115	153.3 Å²	153.3	75%	0.747	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.9	145.3	-179.6	28.2	-35	0	0	0	111.7
386	P	31.5	Very low	31.1	Very low	121 Å²	121	148.8 Å²	148.8	79%	0.786	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.4	137.6	178.8	28.6	-34.6	0	0	0	111.5
387	I	33.6	Very low	31.7	Very low	140 Å²	140	149.5 Å²	149.5	72%	0.718	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.9	129.6	174	-59.4	173.4	0	0	0	108.9	H389	I387-H389 PolarHBondContact O-CD2 3Å; I387-H389 PolarHBondContact O-N 3.18Å
388	P	31.5	Very low	32.2	Very low	123 Å²	123	146.5 Å²	146.5	80%	0.799	78%	0.783	S	S	*	*			trans	-74.5	97.4	-179.4	29.4	-34.1	0	0	0	111.1
389	H	31.3	Very low	33	Very low	164 Å²	164	147.9 Å²	147.9	76%	0.759	79%	0.786	S	S	*	*			trans	-64.3	145.1	165	-66.7	-89.5	0	0	0	110.6	I387	I387-H389 PolarHBondContact O-CD2 3Å; I387-H389 PolarHBondContact O-N 3.18Å
390	P	29.4	Very low	34.7	Very low	110 Å²	110	139.7 Å²	139.7	71%	0.714	78%	0.775	S	S	*	*			trans	-62.2	152.4	176.5	26.5	-34.7	0	0	0	111.7	S392	P390-S392 PolarHBondContact O-N 3.2Å
391	P	28.7	Very low	37.2	Very low	131 Å²	131	135.4 Å²	135.4	85%	0.851	75%	0.752	S	S	*	*			trans	-73.2	88.8	-176.1	30.5	-35.4	0	0	0	111.5	E393	P391-E393 PolarHBondContact O-N 2.91Å
392	S	30.5	Very low	39.6	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	72%	0.721	S	S	*	*			trans	-53.3	128.5	161.3	174.1	0	0	0	0	109.7	P390 R394	P390-S392 PolarHBondContact O-N 3.2Å; S392-R394 PolarHBondContact O-N 2.9Å
393	E	29.6	Very low	42.3	Very low	179 Å²	179	122.5 Å²	122.5	84%	0.836	69%	0.685	S	S	*	*			trans	-60	100.1	179.6	-68.1	-168	129.6	0	0	110.7	P391 V395	P391-E393 PolarHBondContact O-N 2.91Å; E393-V395 PolarHBondContact O-N 3.38Å
394	R	32.3	Very low	44.8	Very low	236 Å²	236	116.1 Å²	116.1	89%	0.891	66%	0.658	S	S	*	*			trans	-75.5	78.1	177.4	-69	-172.8	-179.8	-180	2.4	110.4	S392 S396	S392-R394 PolarHBondContact O-N 2.9Å; R394-S396 PolarHBondContact O-N 3Å
395	V	34	Very low	47.2	Very low	111 Å²	111	113 Å²	113	67%	0.673	64%	0.638	S	S	*	*			trans	-47.9	115.1	169.6	-179.1	0	0	0	0	108.9	E393 F397	E393-V395 PolarHBondContact O-N 3.38Å; V395-F397 PolarHBondContact O-N 3.32Å; V395-F397 VanDerWaalsContact O-N 3.12Å
396	S	29.7	Very low	49.9	Very low	109 Å²	109	108.8 Å²	108.8	76%	0.762	61%	0.608	S	S	*	*			trans	-74.1	104.6	-173.4	57.2	0	0	0	0	110.7	R394	R394-S396 PolarHBondContact O-N 3Å
397	F	43.5	Very low	52.6	Low	134 Å²	134	103.1 Å²	103.1	59%	0.588	57%	0.571	S	S	*	*			trans	-59.6	133.2	173.5	-64.9	-82.2	0	0	0	111	S308 V395	S308-F397 WeakPolarHBondContact O-CZ 3.49Å; V395-F397 PolarHBondContact O-N 3.32Å; V395-F397 VanDerWaalsContact O-N 3.12Å
398	P	41.8	Very low	55.1	Low	110 Å²	110	99.8 Å²	99.8	71%	0.714	55%	0.549	S	S	*	.			trans	-63.3	155.2	165.8	28.9	-34.1	0	0	0	110.1	G400	P398-G400 VanDerWaalsContact C-N 3.33Å; P398-G400 PolarHBondContact O-N 2.9Å
399	K	47	Very low	57.8	Low	222 Å²	222	97.4 Å²	97.4	97%	0.965	53%	0.528	S	S	*	.	S	Bend	trans	-70	83.7	178.3	-66.6	176	-178.6	171.5	0	110.7
400	G	65.6	Low	60.4	Low	64 Å²	64	95.2 Å²	95.2	66%	0.66	52%	0.516	S	S	*	.	S	Bend	trans	-172.8	-170.5	-177.6	0	0	0	0	0	114.5	P398	P398-G400 VanDerWaalsContact C-N 3.33Å; P398-G400 PolarHBondContact O-N 2.9Å
401	L	80.8	Confident	63.1	Low	74 Å²	74	90.8 Å²	90.8	39%	0.387	49%	0.486	S	S	.	.			trans	-75.7	152.9	170.4	-70.5	176.4	0	0	0	110.6	W403 Y719	L401-W403 PolarHBondContact O-N 3.3Å; L401-Y719 HydrophobicContact CD2-CE1 4.39Å
402	P	80.8	Confident	66	Low	38 Å²	38	84.6 Å²	84.6	25%	0.247	45%	0.446	C	S	.	.	S	Bend	trans	-76.6	18.8	-175.7	34.2	-38.5	0	0	0	114.1	V305 M309 Q720	V305-P402 VanDerWaalsContact CG1-O 3.23Å; V305-P402 WeakPolarHBondContact CG1-O 3.44Å; M309-P402 HydrophobicContact CE-CB 4.18Å; M309-P402 HydrophobicContact CE-CG 4.22Å; M309-P402 HydrophobicContact CG-CB 4.5Å; M309-P402 HydrophobicContact SD-CB 4.42Å; M309-P402 HydrophobicContact SD-CG 4.14Å; P402-Q720 VanDerWaalsContact CD-O 3.25Å; P402-Q720 WeakPolarHBondContact CD-O 3.39Å; P402-Q720 WeakPolarHBondContact CG-O 3.4Å
403	W	86.3	Confident	68.8	Low	20 Å²	20	81.5 Å²	81.5	8%	0.076	42%	0.42	C	S	.	.	S	Bend	trans	-149.4	133.3	-179.8	-57.7	107.2	0	0	0	112	E300 V305 I306 M309 L401 L690 K721 R723	E300-W403 HydrophobicContact CG-CE3 4.37Å; E300-W403 VanDerWaalsContact OE2-CA 3.29Å; E300-W403 WeakPolarHBondContact OE2-CA 3.47Å; V305-W403 HydrophobicContact CB-CH2 4.26Å; V305-W403 HydrophobicContact CB-CZ3 4.02Å; V305-W403 HydrophobicContact CG1-CD2 4.12Å; V305-W403 HydrophobicContact CG1-CE3 3.77Å; V305-W403 HydrophobicContact CG1-CH2 3.64Å; V305-W403 HydrophobicContact CG1-CZ2 3.98Å; V305-W403 HydrophobicContact CG1-CZ3 3.52Å; I306-W403 HydrophobicContact CD1-CH2 4.39Å; I306-W403 HydrophobicContact CG1-CH2 4.02Å; I306-W403 HydrophobicContact CG1-CZ2 4.29Å; M309-W403 HydrophobicContact CE-CH2 4.27Å; M309-W403 HydrophobicContact CE-CZ2 3.45Å; M309-W403 VanDerWaalsContact CE-CZ2 3.45Å; L401-W403 PolarHBondContact O-N 3.3Å; W403-L690 HydrophobicContact CZ2-CD1 4.4Å; W403-L690 HydrophobicContact CZ2-CD2 3.95Å; W403-K721 PolarHBondContact NE1-O 3.01Å; W403-R723 HydrophobicContact CB-CB 3.64Å; W403-R723 HydrophobicContact CB-CG 3.67Å; W403-R723 HydrophobicContact CD2-CB 4.07Å; W403-R723 VanDerWaalsContact CE3-NH2 3.25Å; W403-R723 HydrophobicContact CG-CB 3.6Å; W403-R723 HydrophobicContact CG-CG 4.18Å
404	A	84.3	Confident	71.6	Confident	32 Å²	32	76.7 Å²	76.7	26%	0.264	40%	0.401	S	S	.	.			trans	-65.2	136.3	164	0	0	0	0	0	110.9	E300 R723	E300-A404 PolarHBondContact OE1-N 3.21Å; E300-A404 VanDerWaalsContact OE1-N 3.16Å; E300-A404 PolarHBondContact OE2-N 2.8Å; A404-R723 WeakPolarHBondContact O-CD 3.28Å; A404-R723 WeakPolarHBondContact O-CG 3.32Å; A404-R723 PolarHBondContact O-NE 3.13Å
405	P	86.4	Confident	74.3	Confident	39 Å²	39	68.1 Å²	68.1	25%	0.253	37%	0.37	S	S	.	.			trans	-70.2	158.2	176.7	29.8	-33	0	0	0	111.2	H724 L726	P405-H724 WeakPolarHBondContact CA-O 3.42Å; P405-L726 HydrophobicContact CB-CD2 3.97Å; P405-L726 HydrophobicContact CB-CG 4.33Å; P405-L726 HydrophobicContact CG-CD2 4.04Å
406	K	89.4	Confident	76.9	Confident	27 Å²	27	62.8 Å²	62.8	12%	0.117	34%	0.338	C	S	.	.			trans	-134.4	147.1	-178.7	-70.1	-172.5	173.3	-148.5	0	112.9	Y454 H724 R725	K406-Y454 HydrophobicContact CD-CD1 3.85Å; K406-Y454 HydrophobicContact CD-CD2 4.24Å; K406-Y454 HydrophobicContact CD-CG 3.69Å; K406-Y454 HydrophobicContact CG-CG 4.42Å; K406-H724 PolarHBondContact N-O 3.45Å; K406-R725 WeakPolarHBondContact O-CA 3.48Å; K406-R725 WeakPolarHBondContact O-CB 3.33Å; K406-R725 WeakPolarHBondContact O-CG 3.49Å
407	V	88.6	Confident	79.7	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-130.6	140.6	-179	-177.5	0	0	0	0	108.7	D411 I412 L449 H452 K453 Y454 L726	V407-D411 HydrophobicContact CG1-CB 3.84Å; V407-I412 HydrophobicContact CG1-CD1 4.18Å; V407-I412 HydrophobicContact CG1-CG1 3.66Å; V407-L449 HydrophobicContact CG1-CB 4.24Å; V407-L449 HydrophobicContact CG1-CD2 3.95Å; V407-L449 HydrophobicContact CG2-CD2 3.86Å; V407-H452 HydrophobicContact CG2-CB 3.87Å; V407-H452 PolarHBondContact N-O 2.95Å; V407-K453 WeakPolarHBondContact O-CA 3.36Å; V407-Y454 PolarHBondContact O-N 3.02Å; V407-L726 HydrophobicContact CG2-CB 4.21Å; V407-L726 HydrophobicContact CG2-CD1 3.91Å; V407-L726 HydrophobicContact CG2-CG 4.06Å
408	R	86.3	Confident	81.9	Confident	69 Å²	69	58.2 Å²	58.2	26%	0.26	32%	0.315	S	S	.	.			trans	-92.7	163.5	168.4	-66.1	178.6	-64.1	-172.5	1	111.8	K410 D411 I412	R408-K410 VanDerWaalsContact C-N 3.34Å; R408-K410 PolarHBondContact O-N 3.48Å; R408-D411 HydrophobicContact CB-CB 4.32Å; R408-D411 IonicContact CZ-OD1 2.69Å; R408-D411 PolarHBondContact N-OD2 2.9Å; R408-D411 IonicContact NE-OD1 3.99Å; R408-D411 PolarHBondContact NE-OD1 2.6Å; R408-D411 IonicContact NE-OD2 2.71Å; R408-D411 IonicContact NH2-OD1 3.61Å; R408-D411 PolarHBondContact NH2-OD1 2.98Å; R408-D411 WeakPolarHBondContact O-CB 3.31Å; R408-D411 PolarHBondContact O-N 2.82Å; R408-I412 PolarHBondContact O-N 3.45Å
409	E	87.3	Confident	84.1	Confident	73 Å²	73	53.6 Å²	53.6	34%	0.341	29%	0.285	S	S	.	.	H	α-helix	trans	-37.8	-62.2	158.9	-153.2	76.3	-95.1	0	0	111.9	D411 I412 E413 K453	E409-D411 PolarHBondContact O-N 3.43Å; E409-D411 VanDerWaalsContact O-N 3.14Å; E409-I412 WeakPolarHBondContact O-CA 3.22Å; E409-I412 VanDerWaalsContact O-CB 3.28Å; E409-I412 WeakPolarHBondContact O-CB 3.3Å; E409-I412 PolarHBondContact O-N 2.72Å; E409-E413 PolarHBondContact O-N 2.79Å; E409-K453 VanDerWaalsContact CD-CE 3.5Å; E409-K453 VanDerWaalsContact OE1-CE 3.23Å; E409-K453 WeakPolarHBondContact OE1-CE 3.41Å; E409-K453 IonicContact OE1-NZ 3.79Å; E409-K453 PolarHBondContact OE1-NZ 2.87Å; E409-K453 WeakPolarHBondContact OE2-CE 3.43Å; E409-K453 IonicContact OE2-NZ 2.7Å; E409-K453 PolarHBondContact OE2-NZ 3.37Å
410	K	86.1	Confident	86.2	Confident	118 Å²	118	43.2 Å²	43.2	51%	0.513	24%	0.24	S	C	.	.	H	α-helix	trans	-64.5	-20.6	-179.2	-168.4	156.3	-172.4	155.4	0	115.7	R408 I412 E413 N414	R408-K410 VanDerWaalsContact C-N 3.34Å; R408-K410 PolarHBondContact O-N 3.48Å; K410-I412 VanDerWaalsContact C-N 3.28Å; K410-E413 WeakPolarHBondContact CA-OE2 3.44Å; K410-E413 WeakPolarHBondContact CB-OE2 3.49Å; K410-N414 WeakPolarHBondContact CG-OD1 3.18Å; K410-N414 WeakPolarHBondContact O-CB 3.46Å; K410-N414 PolarHBondContact O-N 2.59Å; K410-N414 PolarHBondContact O-OD1 3.36Å
411	D	86.7	Confident	87.3	Confident	18 Å²	18	43.6 Å²	43.6	10%	0.096	23%	0.232	C	C	.	.	H	α-helix	trans	-77.3	-20.9	173.4	-53	-16.5	0	0	0	110.8	V407 R408 E409 R725 N727	V407-D411 HydrophobicContact CG1-CB 3.84Å; R408-D411 HydrophobicContact CB-CB 4.32Å; R408-D411 IonicContact CZ-OD1 2.69Å; R408-D411 PolarHBondContact N-OD2 2.9Å; R408-D411 IonicContact NE-OD1 3.99Å; R408-D411 PolarHBondContact NE-OD1 2.6Å; R408-D411 IonicContact NE-OD2 2.71Å; R408-D411 IonicContact NH2-OD1 3.61Å; R408-D411 PolarHBondContact NH2-OD1 2.98Å; R408-D411 WeakPolarHBondContact O-CB 3.31Å; R408-D411 PolarHBondContact O-N 2.82Å; E409-D411 PolarHBondContact O-N 3.43Å; E409-D411 VanDerWaalsContact O-N 3.14Å; D411-R725 IonicContact OD1-NH1 2.66Å; D411-R725 IonicContact OD2-CZ 3.52Å; D411-R725 IonicContact OD2-NE 3.38Å; D411-R725 IonicContact OD2-NH1 3.74Å; D411-R725 PolarHBondContact OD2-NH1 2.93Å; D411-N727 PolarHBondContact O-ND2 3.5Å
412	I	89.3	Confident	87.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-86.6	-46.9	172.2	-56.7	169.2	0	0	0	110.4	V407 R408 E409 K410 F415 L416 L449 K450 K453	V407-I412 HydrophobicContact CG1-CD1 4.18Å; V407-I412 HydrophobicContact CG1-CG1 3.66Å; R408-I412 PolarHBondContact O-N 3.45Å; E409-I412 WeakPolarHBondContact O-CA 3.22Å; E409-I412 VanDerWaalsContact O-CB 3.28Å; E409-I412 WeakPolarHBondContact O-CB 3.3Å; E409-I412 PolarHBondContact O-N 2.72Å; K410-I412 VanDerWaalsContact C-N 3.28Å; I412-F415 PolarHBondContact O-N 2.77Å; I412-F415 VanDerWaalsContact O-N 3.17Å; I412-L416 HydrophobicContact CG2-CD1 4.15Å; I412-L416 PolarHBondContact O-N 2.86Å; I412-L449 HydrophobicContact CG1-CB 4.08Å; I412-K450 HydrophobicContact CD1-CG 4.03Å; I412-K453 HydrophobicContact CD1-CB 4.32Å; I412-K453 HydrophobicContact CD1-CD 4.25Å; I412-K453 HydrophobicContact CD1-CG 4.36Å
413	E	88.8	Confident	88.2	Confident	37 Å²	37	51.1 Å²	51.1	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-52.4	-57.7	176.6	-64.6	172.8	142.9	0	0	110.8	E409 K410 F415 L416 E417 T432	E409-E413 PolarHBondContact O-N 2.79Å; K410-E413 WeakPolarHBondContact CA-OE2 3.44Å; K410-E413 WeakPolarHBondContact CB-OE2 3.49Å; E413-F415 PolarHBondContact O-N 3.06Å; E413-F415 VanDerWaalsContact O-N 3.16Å; E413-L416 CarbonylContact O-C 3.51Å; E413-L416 PolarHBondContact O-N 2.81Å; E413-E417 PolarHBondContact O-N 3.27Å; E413-T432 HydrophobicContact CG-CG2 3.83Å
414	N	88.1	Confident	88.3	Confident	78 Å²	78	54 Å²	54	42%	0.417	27%	0.274	S	S	.	.	H	α-helix	trans	-56.2	-36.3	179.6	-72	19.6	0	0	0	112.7	K410 S418	K410-N414 WeakPolarHBondContact CG-OD1 3.18Å; K410-N414 WeakPolarHBondContact O-CB 3.46Å; K410-N414 PolarHBondContact O-N 2.59Å; K410-N414 PolarHBondContact O-OD1 3.36Å; N414-S418 VanDerWaalsContact O-CB 3.26Å; N414-S418 WeakPolarHBondContact O-CB 3.27Å; N414-S418 PolarHBondContact O-N 2.84Å; N414-S418 PolarHBondContact O-OG 3.35Å
415	F	89.2	Confident	88.3	Confident	55 Å²	55	55.6 Å²	55.6	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-39.5	178.8	178.4	-95.3	0	0	0	111.4	I412 E413 S419 I442 I446 L449	I412-F415 PolarHBondContact O-N 2.77Å; I412-F415 VanDerWaalsContact O-N 3.17Å; E413-F415 PolarHBondContact O-N 3.06Å; E413-F415 VanDerWaalsContact O-N 3.16Å; F415-S419 VanDerWaalsContact O-CB 3.29Å; F415-S419 WeakPolarHBondContact O-CB 3.48Å; F415-S419 PolarHBondContact O-N 2.54Å; F415-S419 PolarHBondContact O-OG 2.89Å; F415-I442 HydrophobicContact CE1-CG2 3.71Å; F415-I442 HydrophobicContact CZ-CG2 4.18Å; F415-I446 HydrophobicContact CD1-CG1 4.07Å; F415-I446 HydrophobicContact CE1-CG1 3.93Å; F415-L449 HydrophobicContact CB-CD1 4.17Å; F415-L449 HydrophobicContact CD1-CD1 3.66Å; F415-L449 HydrophobicContact CD2-CD1 4.41Å; F415-L449 HydrophobicContact CE1-CD1 4.14Å; F415-L449 HydrophobicContact CG-CD1 3.82Å
416	L	89.3	Confident	88	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-69.5	-46.7	175.6	-96.3	168.7	0	0	0	112.1	I412 E413 S418 S419 R420 T432 L438 I446	I412-L416 HydrophobicContact CG2-CD1 4.15Å; I412-L416 PolarHBondContact O-N 2.86Å; E413-L416 CarbonylContact O-C 3.51Å; E413-L416 PolarHBondContact O-N 2.81Å; L416-S418 PolarHBondContact O-N 3.13Å; L416-S419 PolarHBondContact O-N 3.28Å; L416-S419 VanDerWaalsContact O-N 3.15Å; L416-R420 WeakPolarHBondContact O-CB 3.49Å; L416-R420 WeakPolarHBondContact O-CG 3.45Å; L416-R420 PolarHBondContact O-N 3.4Å; L416-T432 VanDerWaalsContact CD1-C 3.44Å; L416-T432 VanDerWaalsContact CD1-O 3.24Å; L416-T432 WeakPolarHBondContact CD1-O 3.41Å; L416-L438 HydrophobicContact CD2-CD1 3.62Å; L416-I446 HydrophobicContact CD1-CD1 4.34Å; L416-I446 HydrophobicContact CD2-CD1 3.42Å; L416-I446 VanDerWaalsContact CD2-CD1 3.42Å; L416-I446 HydrophobicContact CD2-CG1 4.38Å; L416-I446 HydrophobicContact CG-CD1 3.84Å; L416-I446 HydrophobicContact CG-CG1 4.28Å
417	E	88.9	Confident	87.4	Confident	66 Å²	66	62.8 Å²	62.8	31%	0.308	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-47.6	175	-71.1	-178.1	159.7	0	0	111.5	E413 S419 R420 S421 T427	E413-E417 PolarHBondContact O-N 3.27Å; E417-S419 VanDerWaalsContact C-N 3.26Å; E417-S419 PolarHBondContact O-N 3.2Å; E417-R420 PolarHBondContact O-N 3.47Å; E417-S421 WeakPolarHBondContact O-CB 3.08Å; E417-S421 PolarHBondContact O-N 3.21Å; E417-T427 HydrophobicContact CB-CG2 4.13Å; E417-T427 HydrophobicContact CG-CG2 4.44Å
418	S	88.4	Confident	86.7	Confident	81 Å²	81	65.7 Å²	65.7	57%	0.566	34%	0.338	S	S	*	.	H	α-helix	trans	-59.5	-37.5	175.2	-59.3	0	0	0	0	112.3	N414 L416 K422	N414-S418 VanDerWaalsContact O-CB 3.26Å; N414-S418 WeakPolarHBondContact O-CB 3.27Å; N414-S418 PolarHBondContact O-N 2.84Å; N414-S418 PolarHBondContact O-OG 3.35Å; L416-S418 PolarHBondContact O-N 3.13Å; S418-K422 VanDerWaalsContact O-CB 3.24Å; S418-K422 WeakPolarHBondContact O-CB 3.44Å; S418-K422 PolarHBondContact O-N 3.1Å; S418-K422 VanDerWaalsContact O-N 3.13Å
419	S	89.1	Confident	86.1	Confident	12 Å²	12	65 Å²	65	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-72.5	-47.3	178.2	-62.1	0	0	0	0	112.2	F415 L416 E417 K422 F423	F415-S419 VanDerWaalsContact O-CB 3.29Å; F415-S419 WeakPolarHBondContact O-CB 3.48Å; F415-S419 PolarHBondContact O-N 2.54Å; F415-S419 PolarHBondContact O-OG 2.89Å; L416-S419 PolarHBondContact O-N 3.28Å; L416-S419 VanDerWaalsContact O-N 3.15Å; E417-S419 VanDerWaalsContact C-N 3.26Å; E417-S419 PolarHBondContact O-N 3.2Å; S419-K422 PolarHBondContact O-N 3.13Å; S419-F423 WeakPolarHBondContact O-CB 3.2Å; S419-F423 WeakPolarHBondContact O-CD2 3.03Å; S419-F423 PolarHBondContact O-N 2.89Å
420	R	90.4	Very high	85.5	Confident	5 Å²	5	66.3 Å²	66.3	2%	0.019	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-43.9	179	-65.1	167.4	177.6	148.2	4.8	110.8	L416 E417 K422 F423 I424 G425 Y426 L428 D431 T434 L438	L416-R420 WeakPolarHBondContact O-CB 3.49Å; L416-R420 WeakPolarHBondContact O-CG 3.45Å; L416-R420 PolarHBondContact O-N 3.4Å; E417-R420 PolarHBondContact O-N 3.47Å; R420-K422 PolarHBondContact O-N 3.01Å; R420-F423 PolarHBondContact O-N 2.87Å; R420-I424 HydrophobicContact CB-CD1 4.44Å; R420-I424 HydrophobicContact CG-CD1 4.35Å; R420-I424 CarbonylContact O-C 3.59Å; R420-I424 VanDerWaalsContact O-CA 3.29Å; R420-I424 WeakPolarHBondContact O-CA 3.37Å; R420-I424 VanDerWaalsContact O-CB 3.27Å; R420-I424 WeakPolarHBondContact O-CB 3Å; R420-I424 PolarHBondContact O-N 3.38Å; R420-G425 PolarHBondContact O-N 3Å; R420-Y426 CarbonylContact C-O 3.53Å; R420-Y426 WeakPolarHBondContact CB-O 3.31Å; R420-L428 PolarHBondContact NH1-O 3.02Å; R420-L428 VanDerWaalsContact NH1-O 3.14Å; R420-D431 IonicContact CZ-OD2 2.83Å; R420-D431 PolarHBondContact NH1-O 3.48Å; R420-D431 IonicContact NH1-OD2 3.2Å; R420-D431 PolarHBondContact NH2-O 2.95Å; R420-D431 IonicContact NH2-OD2 3.9Å; R420-D431 PolarHBondContact NH2-OD2 2.97Å; R420-T434 PolarHBondContact NE-O 3.1Å; R420-T434 PolarHBondContact NH2-O 3.04Å; R420-L438 HydrophobicContact CG-CD1 4.3Å; R420-L438 HydrophobicContact CG-CD2 4.24Å
421	S	89.4	Confident	85.3	Confident	71 Å²	71	62.7 Å²	62.7	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-56.1	-48.8	172.1	-179.8	0	0	0	0	111.5	E417 G425	E417-S421 WeakPolarHBondContact O-CB 3.08Å; E417-S421 PolarHBondContact O-N 3.21Å; S421-G425 WeakPolarHBondContact O-CA 3.24Å; S421-G425 PolarHBondContact O-N 3.41Å; S421-G425 VanDerWaalsContact O-N 3.16Å
422	K	90.3	Very high	85.2	Confident	162 Å²	162	62.6 Å²	62.6	70%	0.704	36%	0.356	S	S	*	.	H	α-helix	trans	-67.4	-37	-179.1	-179.2	173	178.3	176	0	115.1	S418 S419 R420	S418-K422 VanDerWaalsContact O-CB 3.24Å; S418-K422 WeakPolarHBondContact O-CB 3.44Å; S418-K422 PolarHBondContact O-N 3.1Å; S418-K422 VanDerWaalsContact O-N 3.13Å; S419-K422 PolarHBondContact O-N 3.13Å; R420-K422 PolarHBondContact O-N 3.01Å
423	F	89.6	Confident	85	Confident	108 Å²	108	67.9 Å²	67.9	47%	0.474	39%	0.385	S	S	.	.	H	α-helix	trans	-108.1	-18.2	-170.9	-73.5	-79.3	0	0	0	114.9	S419 R420 L438 P439 I442	S419-F423 WeakPolarHBondContact O-CB 3.2Å; S419-F423 WeakPolarHBondContact O-CD2 3.03Å; S419-F423 PolarHBondContact O-N 2.89Å; R420-F423 PolarHBondContact O-N 2.87Å; F423-L438 HydrophobicContact CB-CD2 4.24Å; F423-P439 HydrophobicContact CD1-CG 3.93Å; F423-P439 HydrophobicContact CE1-CG 3.85Å; F423-P439 HydrophobicContact CG-CG 4.38Å; F423-P439 HydrophobicContact CZ-CG 4.24Å; F423-I442 HydrophobicContact CD2-CD1 3.69Å; F423-I442 HydrophobicContact CE2-CD1 3.52Å; F423-I442 HydrophobicContact CZ-CD1 4.35Å
424	I	87.8	Confident	84.9	Confident	82 Å²	82	68.6 Å²	68.6	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-125.6	-22	-174.5	-51.2	172.9	0	0	0	111.1	R420 Y426 V436 L438	R420-I424 HydrophobicContact CB-CD1 4.44Å; R420-I424 HydrophobicContact CG-CD1 4.35Å; R420-I424 CarbonylContact O-C 3.59Å; R420-I424 VanDerWaalsContact O-CA 3.29Å; R420-I424 WeakPolarHBondContact O-CA 3.37Å; R420-I424 VanDerWaalsContact O-CB 3.27Å; R420-I424 WeakPolarHBondContact O-CB 3Å; R420-I424 PolarHBondContact O-N 3.38Å; I424-Y426 VanDerWaalsContact C-N 3.25Å; I424-Y426 PolarHBondContact O-N 2.85Å; I424-V436 VanDerWaalsContact CD1-O 3.28Å; I424-V436 WeakPolarHBondContact CD1-O 3.07Å; I424-L438 HydrophobicContact CD1-CD2 3.79Å; I424-L438 HydrophobicContact CD1-CG 4.25Å; I424-L438 HydrophobicContact CG1-CD2 4.26Å
425	G	84.8	Confident	84.8	Confident	65 Å²	65	67 Å²	67	67%	0.67	38%	0.384	S	S	*	.	S	Bend	trans	76.1	9	-178.5	0	0	0	0	0	114.5	R420 S421	R420-G425 PolarHBondContact O-N 3Å; S421-G425 WeakPolarHBondContact O-CA 3.24Å; S421-G425 PolarHBondContact O-N 3.41Å; S421-G425 VanDerWaalsContact O-N 3.16Å
426	Y	81.1	Confident	84.6	Confident	152 Å²	152	70 Å²	70	60%	0.596	41%	0.407	S	S	*	.			trans	-137.8	151.9	-176.7	-177.6	-105.2	0	0	0	110.6	R420 I424 L428	R420-Y426 CarbonylContact C-O 3.53Å; R420-Y426 WeakPolarHBondContact CB-O 3.31Å; I424-Y426 VanDerWaalsContact C-N 3.25Å; I424-Y426 PolarHBondContact O-N 2.85Å; Y426-L428 HydrophobicContact CE1-CD2 3.8Å; Y426-L428 HydrophobicContact CE1-CG 4.04Å
427	T	75.9	Confident	84.4	Confident	65 Å²	65	72.9 Å²	72.9	40%	0.399	44%	0.437	S	S	.	.			trans	-128.5	126.7	179.2	46.7	0	0	0	0	111.7	E417	E417-T427 HydrophobicContact CB-CG2 4.13Å; E417-T427 HydrophobicContact CG-CG2 4.44Å
428	L	74.2	Confident	84.5	Confident	62 Å²	62	70.2 Å²	70.2	33%	0.325	43%	0.425	S	S	.	.			trans	-90.2	111.3	165.7	-67.8	165.3	0	0	0	107.8	R420 Y426 D431 T434	R420-L428 PolarHBondContact NH1-O 3.02Å; R420-L428 VanDerWaalsContact NH1-O 3.14Å; Y426-L428 HydrophobicContact CE1-CD2 3.8Å; Y426-L428 HydrophobicContact CE1-CG 4.04Å; L428-D431 HydrophobicContact CB-CB 3.86Å; L428-T434 HydrophobicContact CD1-CG2 3.82Å
429	G	73.7	Confident	84.7	Confident	55 Å²	55	68.8 Å²	68.8	57%	0.567	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	143.2	176.4	0	0	0	0	0	111.7	D431	G429-D431 PolarHBondContact O-N 3.5Å
430	S	73.9	Confident	84.8	Confident	101 Å²	101	77.8 Å²	77.8	71%	0.706	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	7.3	-179.2	-61.3	0	0	0	0	116.8
431	D	83.5	Confident	84.9	Confident	41 Å²	41	81.5 Å²	81.5	22%	0.219	47%	0.47	C	S	.	.			trans	-88.4	121.4	171.8	177.2	132.3	0	0	0	110.4	R420 L428 G429 D433 T434	R420-D431 IonicContact CZ-OD2 2.83Å; R420-D431 PolarHBondContact NH1-O 3.48Å; R420-D431 IonicContact NH1-OD2 3.2Å; R420-D431 PolarHBondContact NH2-O 2.95Å; R420-D431 IonicContact NH2-OD2 3.9Å; R420-D431 PolarHBondContact NH2-OD2 2.97Å; L428-D431 HydrophobicContact CB-CB 3.86Å; G429-D431 PolarHBondContact O-N 3.5Å; D431-D433 PolarHBondContact OD2-N 2.94Å; D431-T434 WeakPolarHBondContact OD1-CB 3.35Å; D431-T434 PolarHBondContact OD1-OG1 3.25Å; D431-T434 WeakPolarHBondContact OD2-CB 3.33Å; D431-T434 PolarHBondContact OD2-N 2.85Å
432	T	84.1	Confident	85	Confident	16 Å²	16	78.9 Å²	78.9	10%	0.098	45%	0.45	C	S	.	.	S	Bend	trans	-104.7	1.8	174.5	80.9	0	0	0	0	114.9	E413 L416 K450	E413-T432 HydrophobicContact CG-CG2 3.83Å; L416-T432 VanDerWaalsContact CD1-C 3.44Å; L416-T432 VanDerWaalsContact CD1-O 3.24Å; L416-T432 WeakPolarHBondContact CD1-O 3.41Å; T432-K450 WeakPolarHBondContact O-CE 3.46Å; T432-K450 PolarHBondContact O-NZ 3.2Å
433	D	85.3	Confident	85.1	Confident	111 Å²	111	74.4 Å²	74.4	59%	0.594	43%	0.432	S	S	*	.	S	Bend	trans	-119.7	-30.7	-165.3	-73.3	-72.8	0	0	0	114.6	D431 V435 K450	D431-D433 PolarHBondContact OD2-N 2.94Å; D433-V435 PolarHBondContact O-N 3.4Å; D433-K450 VanDerWaalsContact CG-NZ 3.31Å; D433-K450 IonicContact OD1-NZ 2.72Å; D433-K450 PolarHBondContact OD1-NZ 2.96Å; D433-K450 IonicContact OD2-NZ 2.87Å
434	T	85.1	Confident	85.2	Confident	53 Å²	53	75.3 Å²	75.3	33%	0.325	44%	0.438	S	S	.	.			trans	-73	98.1	-177.4	-63.1	0	0	0	0	111.2	R420 L428 D431 V436	R420-T434 PolarHBondContact NE-O 3.1Å; R420-T434 PolarHBondContact NH2-O 3.04Å; L428-T434 HydrophobicContact CD1-CG2 3.82Å; D431-T434 WeakPolarHBondContact OD1-CB 3.35Å; D431-T434 PolarHBondContact OD1-OG1 3.25Å; D431-T434 WeakPolarHBondContact OD2-CB 3.33Å; D431-T434 PolarHBondContact OD2-N 2.85Å; T434-V436 HydrophobicContact CG2-CB 4.36Å; T434-V436 HydrophobicContact CG2-CG2 4.36Å
435	V	86.9	Confident	85.3	Confident	43 Å²	43	73.7 Å²	73.7	26%	0.261	43%	0.433	S	S	.	.			trans	-101.3	8	177.9	-56.8	0	0	0	0	114.4	D433 L438 H443 I446	D433-V435 PolarHBondContact O-N 3.4Å; V435-L438 WeakPolarHBondContact O-CB 3.29Å; V435-L438 PolarHBondContact O-N 2.82Å; V435-H443 PolarHBondContact O-NE2 3.21Å; V435-I446 HydrophobicContact CG1-CD1 3.57Å
436	V	86.1	Confident	85.6	Confident	119 Å²	119	70.9 Å²	70.9	72%	0.721	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	137.6	176.7	-178.5	0	0	0	0	110.1	I424 T434 L438	I424-V436 VanDerWaalsContact CD1-O 3.28Å; I424-V436 WeakPolarHBondContact CD1-O 3.07Å; T434-V436 HydrophobicContact CG2-CB 4.36Å; T434-V436 HydrophobicContact CG2-CG2 4.36Å; V436-L438 PolarHBondContact O-N 3.1Å
437	G	84.6	Confident	86	Confident	60 Å²	60	71.3 Å²	71.3	62%	0.619	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-12.5	-177.7	0	0	0	0	0	115.7
438	L	90.4	Very high	86.7	Confident	10 Å²	10	71.3 Å²	71.3	5%	0.052	41%	0.408	C	S	.	.	S	Bend	trans	-85.1	143.6	179.5	-57.9	179.2	0	0	0	112.2	L416 R420 F423 I424 V435 V436 I442 H443 I446	L416-L438 HydrophobicContact CD2-CD1 3.62Å; R420-L438 HydrophobicContact CG-CD1 4.3Å; R420-L438 HydrophobicContact CG-CD2 4.24Å; F423-L438 HydrophobicContact CB-CD2 4.24Å; I424-L438 HydrophobicContact CD1-CD2 3.79Å; I424-L438 HydrophobicContact CD1-CG 4.25Å; I424-L438 HydrophobicContact CG1-CD2 4.26Å; V435-L438 WeakPolarHBondContact O-CB 3.29Å; V435-L438 PolarHBondContact O-N 2.82Å; V436-L438 PolarHBondContact O-N 3.1Å; L438-I442 HydrophobicContact CB-CB 4.34Å; L438-I442 HydrophobicContact CB-CD1 4.5Å; L438-I442 HydrophobicContact CB-CG2 4.48Å; L438-I442 HydrophobicContact CD1-CG2 4.12Å; L438-H443 PolarHBondContact O-CE1 3.21Å; L438-H443 PolarHBondContact O-NE2 3.28Å; L438-I446 HydrophobicContact CD1-CD1 4.42Å
439	P	93.2	Very high	87.4	Confident	51 Å²	51	68.7 Å²	68.7	33%	0.331	39%	0.394	S	S	.	.			trans	-61	149.1	173	-27.3	35.2	0	0	0	114.7	F423 P441 I442 H443	F423-P439 HydrophobicContact CD1-CG 3.93Å; F423-P439 HydrophobicContact CE1-CG 3.85Å; F423-P439 HydrophobicContact CG-CG 4.38Å; F423-P439 HydrophobicContact CZ-CG 4.24Å; P439-P441 VanDerWaalsContact C-CD 3.46Å; P439-I442 HydrophobicContact CB-CG1 4.48Å; P439-I442 HydrophobicContact CG-CD1 4.46Å; P439-I442 WeakPolarHBondContact O-CA 3.44Å; P439-I442 WeakPolarHBondContact O-CB 3.3Å; P439-I442 PolarHBondContact O-N 2.91Å; P439-H443 PolarHBondContact O-N 2.94Å
440	R	90.8	Very high	88.2	Confident	202 Å²	202	69.1 Å²	69.1	76%	0.762	38%	0.38	S	S	*	.	H	α-helix	trans	-49.2	-41.4	-179.5	-67.5	-176.3	-178.9	-179.4	0.5	115.5	I442 H443 E444	R440-I442 PolarHBondContact O-N 2.91Å; R440-H443 WeakPolarHBondContact O-CA 3.43Å; R440-H443 VanDerWaalsContact O-CB 3.32Å; R440-H443 WeakPolarHBondContact O-CB 3.03Å; R440-H443 PolarHBondContact O-N 2.88Å; R440-E444 PolarHBondContact O-N 3.23Å
441	P	93.3	Very high	88.9	Confident	83 Å²	83	71.5 Å²	71.5	54%	0.539	38%	0.38	S	S	.	.	H	α-helix	trans	-60.8	-26.1	176.8	-25.8	36.4	0	0	0	113.8	P439 S445	P439-P441 VanDerWaalsContact C-CD 3.46Å; P441-S445 WeakPolarHBondContact O-CB 3.35Å; P441-S445 PolarHBondContact O-N 3.05Å; P441-S445 PolarHBondContact O-OG 3.38Å
442	I	91.1	Very high	89.1	Confident	15 Å²	15	72 Å²	72	8%	0.077	38%	0.381	C	S	.	.	H	α-helix	trans	-75.2	-36.8	174.6	-47.7	-168.9	0	0	0	110.2	F415 F423 L438 P439 R440 S445 I446	F415-I442 HydrophobicContact CE1-CG2 3.71Å; F415-I442 HydrophobicContact CZ-CG2 4.18Å; F423-I442 HydrophobicContact CD2-CD1 3.69Å; F423-I442 HydrophobicContact CE2-CD1 3.52Å; F423-I442 HydrophobicContact CZ-CD1 4.35Å; L438-I442 HydrophobicContact CB-CB 4.34Å; L438-I442 HydrophobicContact CB-CD1 4.5Å; L438-I442 HydrophobicContact CB-CG2 4.48Å; L438-I442 HydrophobicContact CD1-CG2 4.12Å; P439-I442 HydrophobicContact CB-CG1 4.48Å; P439-I442 HydrophobicContact CG-CD1 4.46Å; P439-I442 WeakPolarHBondContact O-CA 3.44Å; P439-I442 WeakPolarHBondContact O-CB 3.3Å; P439-I442 PolarHBondContact O-N 2.91Å; R440-I442 PolarHBondContact O-N 2.91Å; I442-S445 WeakPolarHBondContact O-CB 3.46Å; I442-S445 PolarHBondContact O-N 3.02Å; I442-I446 HydrophobicContact CG2-CD1 3.91Å; I442-I446 HydrophobicContact CG2-CG1 4.42Å; I442-I446 WeakPolarHBondContact O-CD1 3.41Å; I442-I446 VanDerWaalsContact O-CG1 3.23Å; I442-I446 WeakPolarHBondContact O-CG1 3.44Å; I442-I446 PolarHBondContact O-N 3.28Å
443	H	91.7	Very high	89.4	Confident	69 Å²	69	74.9 Å²	74.9	32%	0.319	39%	0.392	S	S	.	.	H	α-helix	trans	-60.7	-45.1	172.5	-55.6	173.3	0	0	0	111.3	V435 L438 P439 R440 I446 K447	V435-H443 PolarHBondContact O-NE2 3.21Å; L438-H443 PolarHBondContact O-CE1 3.21Å; L438-H443 PolarHBondContact O-NE2 3.28Å; P439-H443 PolarHBondContact O-N 2.94Å; R440-H443 WeakPolarHBondContact O-CA 3.43Å; R440-H443 VanDerWaalsContact O-CB 3.32Å; R440-H443 WeakPolarHBondContact O-CB 3.03Å; R440-H443 PolarHBondContact O-N 2.88Å; H443-I446 PolarHBondContact O-N 3.3Å; H443-K447 WeakPolarHBondContact O-CB 3.16Å; H443-K447 PolarHBondContact O-N 3.18Å
444	E	90.9	Very high	89.6	Confident	127 Å²	127	72.3 Å²	72.3	59%	0.593	38%	0.375	S	S	*	.	H	α-helix	trans	-64.3	-39.6	175.7	-68.8	173.3	-176.9	0	0	112	R440 K447 T448	R440-E444 PolarHBondContact O-N 3.23Å; E444-K447 PolarHBondContact O-N 2.95Å; E444-T448 WeakPolarHBondContact O-CB 3.36Å; E444-T448 PolarHBondContact O-N 3.38Å; E444-T448 PolarHBondContact O-OG1 3.38Å
445	S	90.4	Very high	89.9	Confident	47 Å²	47	72.4 Å²	72.4	33%	0.329	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-48.1	174.1	-60.8	0	0	0	0	111.4	P441 I442 K447 T448 L449	P441-S445 WeakPolarHBondContact O-CB 3.35Å; P441-S445 PolarHBondContact O-N 3.05Å; P441-S445 PolarHBondContact O-OG 3.38Å; I442-S445 WeakPolarHBondContact O-CB 3.46Å; I442-S445 PolarHBondContact O-N 3.02Å; S445-K447 PolarHBondContact O-N 3.34Å; S445-T448 WeakPolarHBondContact O-CB 3.5Å; S445-T448 PolarHBondContact O-N 3.14Å; S445-L449 VanDerWaalsContact O-CG 3.31Å; S445-L449 WeakPolarHBondContact O-CG 3.17Å; S445-L449 PolarHBondContact O-N 3.25Å
446	I	90.5	Very high	90.1	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-41.9	178.4	-66.9	159.9	0	0	0	111.1	F415 L416 V435 L438 I442 H443 T448 L449 K450	F415-I446 HydrophobicContact CD1-CG1 4.07Å; F415-I446 HydrophobicContact CE1-CG1 3.93Å; L416-I446 HydrophobicContact CD1-CD1 4.34Å; L416-I446 HydrophobicContact CD2-CD1 3.42Å; L416-I446 VanDerWaalsContact CD2-CD1 3.42Å; L416-I446 HydrophobicContact CD2-CG1 4.38Å; L416-I446 HydrophobicContact CG-CD1 3.84Å; L416-I446 HydrophobicContact CG-CG1 4.28Å; V435-I446 HydrophobicContact CG1-CD1 3.57Å; L438-I446 HydrophobicContact CD1-CD1 4.42Å; I442-I446 HydrophobicContact CG2-CD1 3.91Å; I442-I446 HydrophobicContact CG2-CG1 4.42Å; I442-I446 WeakPolarHBondContact O-CD1 3.41Å; I442-I446 VanDerWaalsContact O-CG1 3.23Å; I442-I446 WeakPolarHBondContact O-CG1 3.44Å; I442-I446 PolarHBondContact O-N 3.28Å; H443-I446 PolarHBondContact O-N 3.3Å; I446-T448 VanDerWaalsContact C-N 3.3Å; I446-T448 PolarHBondContact O-N 2.9Å; I446-L449 PolarHBondContact O-N 2.74Å; I446-K450 HydrophobicContact CG2-CD 4.11Å; I446-K450 HydrophobicContact CG2-CG 4.38Å; I446-K450 WeakPolarHBondContact O-CB 3.48Å; I446-K450 WeakPolarHBondContact O-CG 3.47Å; I446-K450 PolarHBondContact O-N 3.39Å
447	K	90.7	Very high	90.5	Very high	162 Å²	162	66.2 Å²	66.2	70%	0.704	34%	0.337	S	S	*	.	H	α-helix	trans	-57.5	-44.2	173.8	-174.7	179.4	-179.9	-179.1	0	111.3	H443 E444 S445 K450 Q451	H443-K447 WeakPolarHBondContact O-CB 3.16Å; H443-K447 PolarHBondContact O-N 3.18Å; E444-K447 PolarHBondContact O-N 2.95Å; S445-K447 PolarHBondContact O-N 3.34Å; K447-K450 PolarHBondContact O-N 3.06Å; K447-Q451 WeakPolarHBondContact O-CB 3.28Å; K447-Q451 PolarHBondContact O-N 3.42Å
448	T	89.6	Confident	90.9	Very high	64 Å²	64	64 Å²	64	39%	0.393	31%	0.312	S	S	.	.	H	α-helix	trans	-67.8	-39.7	177.9	-53.5	0	0	0	0	112.2	E444 S445 I446 H452 L726	E444-T448 WeakPolarHBondContact O-CB 3.36Å; E444-T448 PolarHBondContact O-N 3.38Å; E444-T448 PolarHBondContact O-OG1 3.38Å; S445-T448 WeakPolarHBondContact O-CB 3.5Å; S445-T448 PolarHBondContact O-N 3.14Å; I446-T448 VanDerWaalsContact C-N 3.3Å; I446-T448 PolarHBondContact O-N 2.9Å; T448-H452 PolarHBondContact O-N 3.41Å; T448-H452 PolarHBondContact O-ND1 3.38Å; T448-L726 HydrophobicContact CG2-CD1 4.18Å
449	L	89.8	Confident	91.1	Very high	7 Å²	7	66.7 Å²	66.7	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-64.8	-45.5	175.1	-71.3	171.8	0	0	0	111.3	V407 I412 F415 S445 I446 H452 K453 L726	V407-L449 HydrophobicContact CG1-CB 4.24Å; V407-L449 HydrophobicContact CG1-CD2 3.95Å; V407-L449 HydrophobicContact CG2-CD2 3.86Å; I412-L449 HydrophobicContact CG1-CB 4.08Å; F415-L449 HydrophobicContact CB-CD1 4.17Å; F415-L449 HydrophobicContact CD1-CD1 3.66Å; F415-L449 HydrophobicContact CD2-CD1 4.41Å; F415-L449 HydrophobicContact CE1-CD1 4.14Å; F415-L449 HydrophobicContact CG-CD1 3.82Å; S445-L449 VanDerWaalsContact O-CG 3.31Å; S445-L449 WeakPolarHBondContact O-CG 3.17Å; S445-L449 PolarHBondContact O-N 3.25Å; I446-L449 PolarHBondContact O-N 2.74Å; L449-H452 CarbonylContact O-C 3.6Å; L449-H452 PolarHBondContact O-N 2.76Å; L449-H452 VanDerWaalsContact O-N 3.11Å; L449-K453 PolarHBondContact O-N 2.94Å; L449-K453 VanDerWaalsContact O-N 3.1Å; L449-L726 HydrophobicContact CD2-CB 3.96Å; L449-L726 HydrophobicContact CD2-CD1 4.07Å
450	K	89.8	Confident	91.1	Very high	64 Å²	64	66.5 Å²	66.5	28%	0.278	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-39.4	177	-77	-176	176.1	178.5	0	112.6	I412 T432 D433 I446 K447 H452 K453	I412-K450 HydrophobicContact CD1-CG 4.03Å; T432-K450 WeakPolarHBondContact O-CE 3.46Å; T432-K450 PolarHBondContact O-NZ 3.2Å; D433-K450 VanDerWaalsContact CG-NZ 3.31Å; D433-K450 IonicContact OD1-NZ 2.72Å; D433-K450 PolarHBondContact OD1-NZ 2.96Å; D433-K450 IonicContact OD2-NZ 2.87Å; I446-K450 HydrophobicContact CG2-CD 4.11Å; I446-K450 HydrophobicContact CG2-CG 4.38Å; I446-K450 WeakPolarHBondContact O-CB 3.48Å; I446-K450 WeakPolarHBondContact O-CG 3.47Å; I446-K450 PolarHBondContact O-N 3.39Å; K447-K450 PolarHBondContact O-N 3.06Å; K450-H452 PolarHBondContact O-N 3.06Å; K450-H452 VanDerWaalsContact O-N 3.16Å; K450-K453 VanDerWaalsContact O-CB 3.24Å; K450-K453 WeakPolarHBondContact O-CB 3.4Å; K450-K453 PolarHBondContact O-N 3.38Å
451	Q	88.5	Confident	91.3	Very high	151 Å²	151	57.8 Å²	57.8	71%	0.706	29%	0.29	S	S	*	.	H	α-helix	trans	-57.9	-27.7	173.1	-174.8	178.3	4.7	0	0	112.9	K447	K447-Q451 WeakPolarHBondContact O-CB 3.28Å; K447-Q451 PolarHBondContact O-N 3.42Å
452	H	88.4	Confident	91.3	Very high	52 Å²	52	57.3 Å²	57.3	24%	0.241	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	12.9	178.5	-62.2	90.8	0	0	0	113.4	V407 T448 L449 K450 Y454 L726	V407-H452 HydrophobicContact CG2-CB 3.87Å; V407-H452 PolarHBondContact N-O 2.95Å; T448-H452 PolarHBondContact O-N 3.41Å; T448-H452 PolarHBondContact O-ND1 3.38Å; L449-H452 CarbonylContact O-C 3.6Å; L449-H452 PolarHBondContact O-N 2.76Å; L449-H452 VanDerWaalsContact O-N 3.11Å; K450-H452 PolarHBondContact O-N 3.06Å; K450-H452 VanDerWaalsContact O-N 3.16Å; H452-Y454 PolarHBondContact O-N 3.41Å; H452-L726 HydrophobicContact CB-CD1 4.3Å
453	K	89.6	Confident	91.4	Very high	76 Å²	76	59.2 Å²	59.2	33%	0.33	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-63	119.1	175.4	-177.4	177.9	172.5	176.7	0	109.2	V407 E409 I412 L449 K450 I455	V407-K453 WeakPolarHBondContact O-CA 3.36Å; E409-K453 VanDerWaalsContact CD-CE 3.5Å; E409-K453 VanDerWaalsContact OE1-CE 3.23Å; E409-K453 WeakPolarHBondContact OE1-CE 3.41Å; E409-K453 IonicContact OE1-NZ 3.79Å; E409-K453 PolarHBondContact OE1-NZ 2.87Å; E409-K453 WeakPolarHBondContact OE2-CE 3.43Å; E409-K453 IonicContact OE2-NZ 2.7Å; E409-K453 PolarHBondContact OE2-NZ 3.37Å; I412-K453 HydrophobicContact CD1-CB 4.32Å; I412-K453 HydrophobicContact CD1-CD 4.25Å; I412-K453 HydrophobicContact CD1-CG 4.36Å; L449-K453 PolarHBondContact O-N 2.94Å; L449-K453 VanDerWaalsContact O-N 3.1Å; K450-K453 VanDerWaalsContact O-CB 3.24Å; K450-K453 WeakPolarHBondContact O-CB 3.4Å; K450-K453 PolarHBondContact O-N 3.38Å; K453-I455 HydrophobicContact CG-CG1 4.47Å
454	Y	89.8	Confident	91.3	Very high	57 Å²	57	59.8 Å²	59.8	22%	0.224	30%	0.301	C	S	.	.			trans	-118.2	105	176.9	171	-99.8	0	0	0	110	L298 K406 V407 H452	L298-Y454 HydrophobicContact CD2-CE2 3.88Å; K406-Y454 HydrophobicContact CD-CD1 3.85Å; K406-Y454 HydrophobicContact CD-CD2 4.24Å; K406-Y454 HydrophobicContact CD-CG 3.69Å; K406-Y454 HydrophobicContact CG-CG 4.42Å; V407-Y454 PolarHBondContact O-N 3.02Å; H452-Y454 PolarHBondContact O-N 3.41Å
455	I	91.1	Very high	91.3	Very high	55 Å²	55	53.9 Å²	53.9	28%	0.282	27%	0.274	S	S	.	.			trans	-84.4	129.8	168.4	-52.9	173.8	0	0	0	108.5	R290 L295 K453 V460	R290-I455 PolarHBondContact NH1-O 2.73Å; R290-I455 PolarHBondContact NH2-O 3.01Å; L295-I455 HydrophobicContact CD2-CB 4.12Å; L295-I455 HydrophobicContact CD2-CD1 4.43Å; L295-I455 HydrophobicContact CD2-CG2 3.92Å; K453-I455 HydrophobicContact CG-CG1 4.47Å; I455-V460 HydrophobicContact CG2-CG2 3.75Å
456	S	91.8	Very high	91.3	Very high	23 Å²	23	56.2 Å²	56.2	16%	0.161	28%	0.279	C	S	.	.			trans	-99.7	154.2	171.3	72.9	0	0	0	0	112.5	A458 E459 V460	S456-A458 PolarHBondContact O-N 3.44Å; S456-A458 VanDerWaalsContact O-N 3.14Å; S456-E459 WeakPolarHBondContact CA-OE2 3.41Å; S456-E459 WeakPolarHBondContact CB-OE2 3.23Å; S456-E459 PolarHBondContact N-OE2 3.03Å; S456-E459 PolarHBondContact O-N 3.27Å; S456-E459 PolarHBondContact OG-OE2 3.02Å; S456-V460 PolarHBondContact O-N 3.39Å
457	V	94.4	Very high	91.2	Very high	10 Å²	10	61.1 Å²	61.1	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-52	-36.4	174.8	179.5	0	0	0	0	111.4	R290 L293 L295 E459 V460 Q461	R290-V457 HydrophobicContact CG-CG2 3.97Å; L293-V457 HydrophobicContact CD1-CB 4.49Å; L293-V457 HydrophobicContact CD1-CG1 3.93Å; L293-V457 HydrophobicContact CD1-CG2 4.33Å; L295-V457 HydrophobicContact CD1-CG2 4.4Å; V457-E459 PolarHBondContact O-N 2.98Å; V457-V460 PolarHBondContact O-N 3.08Å; V457-Q461 HydrophobicContact CG1-CG 4.37Å; V457-Q461 WeakPolarHBondContact O-CB 3.16Å; V457-Q461 VanDerWaalsContact O-CG 3.23Å; V457-Q461 WeakPolarHBondContact O-CG 3.17Å; V457-Q461 PolarHBondContact O-N 3.33Å
458	A	94.1	Very high	90.9	Very high	13 Å²	13	54.4 Å²	54.4	11%	0.107	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-29.4	177.5	0	0	0	0	0	114.4	S456 M462 V573	S456-A458 PolarHBondContact O-N 3.44Å; S456-A458 VanDerWaalsContact O-N 3.14Å; A458-M462 VanDerWaalsContact O-CG 3.32Å; A458-M462 WeakPolarHBondContact O-CG 3.44Å; A458-M462 PolarHBondContact O-N 3.09Å; A458-M462 VanDerWaalsContact O-N 3.1Å; A458-V573 HydrophobicContact CB-CB 3.97Å; A458-V573 HydrophobicContact CB-CG2 3.74Å
459	E	92.8	Very high	90.5	Very high	66 Å²	66	54.9 Å²	54.9	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-77.3	-36.7	175.5	-74.4	148.2	146.9	0	0	110.7	S456 V457 A463	S456-E459 WeakPolarHBondContact CA-OE2 3.41Å; S456-E459 WeakPolarHBondContact CB-OE2 3.23Å; S456-E459 PolarHBondContact N-OE2 3.03Å; S456-E459 PolarHBondContact O-N 3.27Å; S456-E459 PolarHBondContact OG-OE2 3.02Å; V457-E459 PolarHBondContact O-N 2.98Å; E459-A463 PolarHBondContact O-N 3.13Å; E459-A463 VanDerWaalsContact O-N 3.08Å
460	V	94.7	Very high	90.3	Very high	48 Å²	48	61.4 Å²	61.4	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-43.7	171.4	-178.4	0	0	0	0	111.2	L293 L295 I455 S456 V457 A463 K464	L293-V460 HydrophobicContact CD1-CG1 4.34Å; L293-V460 HydrophobicContact CD2-CG1 4.48Å; L295-V460 HydrophobicContact CD1-CG2 4.07Å; L295-V460 HydrophobicContact CD2-CG2 4.16Å; I455-V460 HydrophobicContact CG2-CG2 3.75Å; S456-V460 PolarHBondContact O-N 3.39Å; V457-V460 PolarHBondContact O-N 3.08Å; V460-A463 PolarHBondContact O-N 2.96Å; V460-K464 PolarHBondContact O-N 2.91Å
461	Q	94.7	Very high	89.9	Confident	19 Å²	19	60.9 Å²	60.9	9%	0.089	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-47.6	176.2	-78.3	172.9	-13.9	0	0	112.5	V457 A463 K464 E465 L570 N571 H572 V573	V457-Q461 HydrophobicContact CG1-CG 4.37Å; V457-Q461 WeakPolarHBondContact O-CB 3.16Å; V457-Q461 VanDerWaalsContact O-CG 3.23Å; V457-Q461 WeakPolarHBondContact O-CG 3.17Å; V457-Q461 PolarHBondContact O-N 3.33Å; Q461-A463 VanDerWaalsContact C-N 3.31Å; Q461-A463 PolarHBondContact O-N 3.09Å; Q461-K464 PolarHBondContact O-N 2.84Å; Q461-E465 WeakPolarHBondContact O-CG 3.27Å; Q461-E465 PolarHBondContact O-N 3.3Å; Q461-E465 VanDerWaalsContact O-N 3.09Å; Q461-L570 PolarHBondContact NE2-O 3.46Å; Q461-N571 PolarHBondContact NE2-O 2.93Å; Q461-H572 WeakPolarHBondContact CB-NE2 3.38Å; Q461-V573 HydrophobicContact CB-CB 4.33Å; Q461-V573 HydrophobicContact CB-CG1 3.68Å
462	M	93.6	Very high	89	Confident	73 Å²	73	56.5 Å²	56.5	36%	0.36	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-42.9	173.5	-78.6	162.3	45.1	0	0	112.2	A458 K464 E465 E466 V573	A458-M462 VanDerWaalsContact O-CG 3.32Å; A458-M462 WeakPolarHBondContact O-CG 3.44Å; A458-M462 PolarHBondContact O-N 3.09Å; A458-M462 VanDerWaalsContact O-N 3.1Å; M462-K464 PolarHBondContact O-N 3.42Å; M462-E465 PolarHBondContact O-N 3.43Å; M462-E466 PolarHBondContact O-N 2.77Å; M462-V573 HydrophobicContact CG-CG1 4.02Å; M462-V573 HydrophobicContact CG-CG2 4.48Å; M462-V573 HydrophobicContact SD-CG2 4.43Å
463	A	92.4	Very high	88.1	Confident	54 Å²	54	60.1 Å²	60.1	45%	0.446	31%	0.306	S	S	.	.	H	α-helix	trans	-63	-41.1	178.4	0	0	0	0	0	112.5	E459 V460 Q461 E465 E466 E467	E459-A463 PolarHBondContact O-N 3.13Å; E459-A463 VanDerWaalsContact O-N 3.08Å; V460-A463 PolarHBondContact O-N 2.96Å; Q461-A463 VanDerWaalsContact C-N 3.31Å; Q461-A463 PolarHBondContact O-N 3.09Å; A463-E465 PolarHBondContact O-N 2.81Å; A463-E466 PolarHBondContact O-N 2.74Å; A463-E467 PolarHBondContact O-N 3.01Å
464	K	90.4	Very high	87	Confident	81 Å²	81	61.2 Å²	61.2	35%	0.352	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-40.6	175.3	-161.8	-168.8	-178.4	-160.7	0	112	V460 Q461 M462 E467 Y468 E478	V460-K464 PolarHBondContact O-N 2.91Å; Q461-K464 PolarHBondContact O-N 2.84Å; M462-K464 PolarHBondContact O-N 3.42Å; K464-E467 WeakPolarHBondContact O-CB 3.22Å; K464-E467 PolarHBondContact O-N 3.05Å; K464-Y468 HydrophobicContact CD-CE2 3.82Å; K464-Y468 WeakPolarHBondContact CE-OH 3.35Å; K464-Y468 HydrophobicContact CG-CD2 4.19Å; K464-Y468 HydrophobicContact CG-CE2 3.8Å; K464-Y468 PolarHBondContact NZ-OH 2.94Å; K464-Y468 VanDerWaalsContact O-CD2 3.24Å; K464-Y468 WeakPolarHBondContact O-CD2 3.24Å; K464-Y468 PolarHBondContact O-N 2.92Å; K464-E478 IonicContact NZ-OE1 3.3Å; K464-E478 PolarHBondContact NZ-OE1 3.49Å
465	E	90.6	Very high	85.6	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.019	33%	0.331	C	S	.	.	H	α-helix	trans	-70.1	-30.1	176	-64.5	-63.8	161.3	0	0	113.3	Q461 M462 A463 Q469 H572 Y574 F757 R760	Q461-E465 WeakPolarHBondContact O-CG 3.27Å; Q461-E465 PolarHBondContact O-N 3.3Å; Q461-E465 VanDerWaalsContact O-N 3.09Å; M462-E465 PolarHBondContact O-N 3.43Å; A463-E465 PolarHBondContact O-N 2.81Å; E465-Q469 VanDerWaalsContact O-CG 3.31Å; E465-Q469 WeakPolarHBondContact O-CG 3.49Å; E465-Q469 PolarHBondContact O-N 2.71Å; E465-Q469 PolarHBondContact O-NE2 2.83Å; E465-H572 IonicContact OE1-CE1 3.57Å; E465-H572 PolarHBondContact OE1-CE1 3.41Å; E465-H572 VanDerWaalsContact OE1-CE1 3.28Å; E465-H572 IonicContact OE1-NE2 2.92Å; E465-Y574 HydrophobicContact CB-CE2 3.76Å; E465-Y574 HydrophobicContact CG-CD2 3.95Å; E465-Y574 HydrophobicContact CG-CE2 3.69Å; E465-F757 WeakPolarHBondContact OE1-CD2 3.46Å; E465-R760 VanDerWaalsContact CD-NH2 3.26Å; E465-R760 IonicContact OE1-CZ 3.36Å; E465-R760 IonicContact OE1-NH2 3.87Å; E465-R760 PolarHBondContact OE1-NH2 3.15Å; E465-R760 IonicContact OE2-CZ 3.86Å; E465-R760 IonicContact OE2-NE 3.16Å; E465-R760 PolarHBondContact OE2-NE 2.82Å; E465-R760 IonicContact OE2-NH2 2.77Å; E465-R760 PolarHBondContact OE2-NH2 3.32Å
466	E	89.9	Confident	84.3	Confident	95 Å²	95	61.5 Å²	61.5	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-69.9	-33.7	169.1	-72.8	-174.1	-153	0	0	112.4	M462 A463 Q469 K470	M462-E466 PolarHBondContact O-N 2.77Å; A463-E466 PolarHBondContact O-N 2.74Å; E466-Q469 PolarHBondContact O-N 3.35Å; E466-K470 VanDerWaalsContact O-CD 3.24Å; E466-K470 WeakPolarHBondContact O-CD 3.48Å; E466-K470 WeakPolarHBondContact O-CE 3.32Å; E466-K470 WeakPolarHBondContact O-CG 3.48Å; E466-K470 PolarHBondContact O-N 3.25Å; E466-K470 IonicContact OE2-NZ 2.69Å; E466-K470 PolarHBondContact OE2-NZ 2.76Å
467	E	88.8	Confident	83.1	Confident	110 Å²	110	69.3 Å²	69.3	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-68.7	-46.3	176.1	-176.4	169.4	-148.1	0	0	111.7	A463 K464 Q469 K470 T471	A463-E467 PolarHBondContact O-N 3.01Å; K464-E467 WeakPolarHBondContact O-CB 3.22Å; K464-E467 PolarHBondContact O-N 3.05Å; E467-Q469 PolarHBondContact O-N 3.14Å; E467-K470 PolarHBondContact O-N 3.44Å; E467-T471 PolarHBondContact O-N 2.56Å; E467-T471 PolarHBondContact O-OG1 3.43Å
468	Y	84.7	Confident	82.2	Confident	21 Å²	21	70.5 Å²	70.5	8%	0.082	38%	0.383	C	S	.	.	H	α-helix	trans	-54.9	-38.6	169.9	-77.9	-56	0	0	0	112.3	K464 P472 V475 E478	K464-Y468 HydrophobicContact CD-CE2 3.82Å; K464-Y468 WeakPolarHBondContact CE-OH 3.35Å; K464-Y468 HydrophobicContact CG-CD2 4.19Å; K464-Y468 HydrophobicContact CG-CE2 3.8Å; K464-Y468 PolarHBondContact NZ-OH 2.94Å; K464-Y468 VanDerWaalsContact O-CD2 3.24Å; K464-Y468 WeakPolarHBondContact O-CD2 3.24Å; K464-Y468 PolarHBondContact O-N 2.92Å; Y468-P472 WeakPolarHBondContact O-CA 3.3Å; Y468-V475 HydrophobicContact CD1-CB 3.96Å; Y468-V475 HydrophobicContact CD1-CG1 3.98Å; Y468-V475 HydrophobicContact CD1-CG2 4.33Å; Y468-V475 HydrophobicContact CE1-CB 3.78Å; Y468-V475 HydrophobicContact CE1-CG1 3.4Å; Y468-V475 VanDerWaalsContact CE1-CG1 3.4Å; Y468-E478 WeakPolarHBondContact OH-CB 3.39Å; Y468-E478 VanDerWaalsContact OH-CG 3.3Å; Y468-E478 WeakPolarHBondContact OH-CG 3.46Å
469	Q	81.8	Confident	81.4	Confident	74 Å²	74	79.1 Å²	79.1	35%	0.346	42%	0.421	S	S	.	.	H	α-helix	trans	-74	-24.5	176.6	-76.3	170.8	84.1	0	0	113.9	E465 E466 E467 R756	E465-Q469 VanDerWaalsContact O-CG 3.31Å; E465-Q469 WeakPolarHBondContact O-CG 3.49Å; E465-Q469 PolarHBondContact O-N 2.71Å; E465-Q469 PolarHBondContact O-NE2 2.83Å; E466-Q469 PolarHBondContact O-N 3.35Å; E467-Q469 PolarHBondContact O-N 3.14Å; Q469-R756 VanDerWaalsContact OE1-CD 3.27Å
470	K	84.5	Confident	80.9	Confident	144 Å²	144	77.7 Å²	77.7	63%	0.626	42%	0.416	S	S	*	.	H	α-helix	trans	-85	-29.7	176.8	-70.8	157.7	-164.3	163.4	0	112.3	E466 E467	E466-K470 VanDerWaalsContact O-CD 3.24Å; E466-K470 WeakPolarHBondContact O-CD 3.48Å; E466-K470 WeakPolarHBondContact O-CE 3.32Å; E466-K470 WeakPolarHBondContact O-CG 3.48Å; E466-K470 PolarHBondContact O-N 3.25Å; E466-K470 IonicContact OE2-NZ 2.69Å; E466-K470 PolarHBondContact OE2-NZ 2.76Å; E467-K470 PolarHBondContact O-N 3.44Å
471	T	80.8	Confident	80.5	Confident	53 Å²	53	81.9 Å²	81.9	33%	0.325	43%	0.433	S	S	.	.			trans	-137.8	50.6	-169.6	55.1	0	0	0	0	113.9	E467 L473 S474 V475	E467-T471 PolarHBondContact O-N 2.56Å; E467-T471 PolarHBondContact O-OG1 3.43Å; T471-L473 PolarHBondContact O-N 3.45Å; T471-L473 VanDerWaalsContact O-N 3.07Å; T471-S474 PolarHBondContact O-N 3.22Å; T471-V475 WeakPolarHBondContact OG1-CG2 3.2Å
472	P	71.1	Confident	80.2	Confident	59 Å²	59	86.3 Å²	86.3	38%	0.383	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.6	-168.6	24.5	-35.6	0	0	0	114.9	Y468 F771	Y468-P472 WeakPolarHBondContact O-CA 3.3Å; P472-F771 HydrophobicContact CB-CD2 4.44Å; P472-F771 HydrophobicContact CB-CE1 4.07Å; P472-F771 HydrophobicContact CB-CE2 3.77Å; P472-F771 HydrophobicContact CB-CZ 3.57Å; P472-F771 HydrophobicContact CG-CE1 3.69Å; P472-F771 HydrophobicContact CG-CE2 4.24Å; P472-F771 HydrophobicContact CG-CZ 3.51Å
473	L	68.1	Low	80.1	Confident	128 Å²	128	84.3 Å²	84.3	67%	0.67	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.7	178.8	-65.7	173.4	0	0	0	114.1	T471 F771	T471-L473 PolarHBondContact O-N 3.45Å; T471-L473 VanDerWaalsContact O-N 3.07Å; L473-F771 HydrophobicContact CD2-CB 3.74Å; L473-F771 HydrophobicContact CD2-CD1 3.83Å; L473-F771 HydrophobicContact CD2-CG 3.99Å; L473-F771 HydrophobicContact CG-CD1 4.13Å
474	S	66.1	Low	80.2	Confident	99 Å²	99	83.3 Å²	83.3	69%	0.692	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-19.1	-166.3	-50.7	0	0	0	0	114.7	T471	T471-S474 PolarHBondContact O-N 3.22Å
475	V	61.5	Low	80.4	Confident	63 Å²	63	80.2 Å²	80.2	38%	0.382	43%	0.428	S	S	.	.	S	Bend	trans	-95.8	-13	-173.4	-166.5	0	0	0	0	112.7	Y468 T471	Y468-V475 HydrophobicContact CD1-CB 3.96Å; Y468-V475 HydrophobicContact CD1-CG1 3.98Å; Y468-V475 HydrophobicContact CD1-CG2 4.33Å; Y468-V475 HydrophobicContact CE1-CB 3.78Å; Y468-V475 HydrophobicContact CE1-CG1 3.4Å; Y468-V475 VanDerWaalsContact CE1-CG1 3.4Å; T471-V475 WeakPolarHBondContact OG1-CG2 3.2Å
476	G	64.4	Low	80.6	Confident	55 Å²	55	80.2 Å²	80.2	57%	0.567	43%	0.427	S	S	*	.			trans	74.2	-170.1	-177.7	0	0	0	0	0	113.8
477	E	66.2	Low	80.8	Confident	186 Å²	186	77.7 Å²	77.7	87%	0.869	42%	0.417	S	S	*	.	S	Bend	trans	-68.5	144.6	171.3	-65.7	-168.3	155.9	0	0	110.6	E479	E477-E479 PolarHBondContact O-N 2.97Å
478	E	75.9	Confident	81.2	Confident	36 Å²	36	72.6 Å²	72.6	17%	0.168	39%	0.393	C	S	.	.			trans	-81.3	115.4	178.1	-178.8	168.7	-146.9	0	0	110.2	K464 Y468 V480 R760 R761	K464-E478 IonicContact NZ-OE1 3.3Å; K464-E478 PolarHBondContact NZ-OE1 3.49Å; Y468-E478 WeakPolarHBondContact OH-CB 3.39Å; Y468-E478 VanDerWaalsContact OH-CG 3.3Å; Y468-E478 WeakPolarHBondContact OH-CG 3.46Å; E478-V480 HydrophobicContact CG-CG2 4.09Å; E478-V480 PolarHBondContact O-N 3.24Å; E478-V480 VanDerWaalsContact O-N 3.13Å; E478-R760 IonicContact OE2-CZ 2.72Å; E478-R760 VanDerWaalsContact OE2-CZ 3.3Å; E478-R760 IonicContact OE2-NH1 2.92Å; E478-R760 PolarHBondContact OE2-NH1 3.4Å; E478-R760 IonicContact OE2-NH2 3.14Å; E478-R760 PolarHBondContact OE2-NH2 2.89Å; E478-R761 IonicContact OE1-NH1 2.78Å; E478-R761 PolarHBondContact OE1-NH1 3.25Å; E478-R761 IonicContact OE2-CZ 3.2Å; E478-R761 IonicContact OE2-NH1 2.59Å; E478-R761 PolarHBondContact OE2-NH1 3.02Å
479	E	76.3	Confident	81.7	Confident	194 Å²	194	71.6 Å²	71.6	91%	0.907	39%	0.389	S	S	*	.			trans	-62	115.7	166.3	-70.3	-170.6	167.8	0	0	109.8	E477	E477-E479 PolarHBondContact O-N 2.97Å
480	V	83.6	Confident	82.3	Confident	35 Å²	35	71.2 Å²	71.2	21%	0.212	39%	0.387	C	S	.	.			trans	-109.6	117.2	-179.1	172.2	0	0	0	0	110	E478 M482 E486 R761	E478-V480 HydrophobicContact CG-CG2 4.09Å; E478-V480 PolarHBondContact O-N 3.24Å; E478-V480 VanDerWaalsContact O-N 3.13Å; V480-M482 HydrophobicContact CB-CE 3.95Å; V480-M482 HydrophobicContact CG1-CE 3.76Å; V480-M482 HydrophobicContact CG1-SD 4.02Å; V480-M482 PolarHBondContact O-N 3.39Å; V480-M482 VanDerWaalsContact O-N 3.14Å; V480-E486 HydrophobicContact CG1-CG 3.78Å; V480-E486 WeakPolarHBondContact CG1-OE1 3.27Å; V480-R761 VanDerWaalsContact CG2-CZ 3.43Å
481	E	84.9	Confident	82.7	Confident	137 Å²	137	65.2 Å²	65.2	64%	0.64	37%	0.366	S	S	*	.			trans	-64	110.7	167.3	-171.6	-160.8	168.3	0	0	109.9	C483	E481-C483 HydrophobicContact CG-CB 4.47Å; E481-C483 PolarHBondContact O-N 3.48Å
482	M	88.8	Confident	83.5	Confident	111 Å²	111	62.7 Å²	62.7	55%	0.547	35%	0.351	S	S	.	.			trans	-77.6	54.6	-179.5	-65.3	-62.8	170.7	0	0	112.4	V480 E486 L487	V480-M482 HydrophobicContact CB-CE 3.95Å; V480-M482 HydrophobicContact CG1-CE 3.76Å; V480-M482 HydrophobicContact CG1-SD 4.02Å; V480-M482 PolarHBondContact O-N 3.39Å; V480-M482 VanDerWaalsContact O-N 3.14Å; M482-E486 HydrophobicContact SD-CG 4.17Å; M482-L487 HydrophobicContact CB-CD2 4.4Å
483	C	91.9	Very high	84.6	Confident	32 Å²	32	61.1 Å²	61.1	22%	0.216	34%	0.339	C	S	.	.			trans	-67.8	161.3	174.7	73.4	0	0	0	0	111.6	E481 T485 E486 L487	E481-C483 HydrophobicContact CG-CB 4.47Å; E481-C483 PolarHBondContact O-N 3.48Å; C483-T485 PolarHBondContact O-N 3.24Å; C483-E486 WeakPolarHBondContact O-CB 3.29Å; C483-E486 PolarHBondContact O-N 3.08Å; C483-L487 PolarHBondContact O-N 3.1Å
484	A	93.4	Very high	85.8	Confident	32 Å²	32	59.9 Å²	59.9	26%	0.264	34%	0.339	S	S	.	.	H	α-helix	trans	-57.3	-23.4	179.7	0	0	0	0	0	114.3	L276 L488	L276-A484 HydrophobicContact CD1-CB 4.35Å; A484-L488 VanDerWaalsContact O-CB 3.27Å; A484-L488 WeakPolarHBondContact O-CB 3.02Å; A484-L488 PolarHBondContact O-N 3.09Å; A484-L488 VanDerWaalsContact O-N 3.14Å
485	T	95.6	Very high	87.2	Confident	17 Å²	17	57 Å²	57	10%	0.104	32%	0.319	C	S	.	.	H	α-helix	trans	-74.7	-35.7	173.4	-57.7	0	0	0	0	112.2	L276 C483 Y489 H567 F568 N571	L276-T485 HydrophobicContact CD2-CG2 4.19Å; L276-T485 WeakPolarHBondContact CG-OG1 3.33Å; C483-T485 PolarHBondContact O-N 3.24Å; T485-Y489 WeakPolarHBondContact O-CB 3.24Å; T485-Y489 PolarHBondContact O-N 3.36Å; T485-H567 HydrophobicContact CG2-CB 3.92Å; T485-F568 HydrophobicContact CG2-CD1 3.66Å; T485-F568 HydrophobicContact CG2-CE1 4.08Å; T485-N571 HydrophobicContact CG2-CB 3.55Å
486	E	94.9	Very high	88.9	Confident	3 Å²	3	54 Å²	54	1%	0.014	30%	0.301	C	S	.	.	H	α-helix	trans	-70.3	-48.9	176.7	-167.3	73.2	173.7	0	0	110.5	V480 M482 C483 L488 Y489 Q490 N571 Q575 R761 Y762	V480-E486 HydrophobicContact CG1-CG 3.78Å; V480-E486 WeakPolarHBondContact CG1-OE1 3.27Å; M482-E486 HydrophobicContact SD-CG 4.17Å; C483-E486 WeakPolarHBondContact O-CB 3.29Å; C483-E486 PolarHBondContact O-N 3.08Å; E486-L488 VanDerWaalsContact C-N 3.32Å; E486-L488 PolarHBondContact O-N 2.67Å; E486-Y489 PolarHBondContact O-N 3.19Å; E486-Y489 VanDerWaalsContact O-N 3.11Å; E486-Q490 WeakPolarHBondContact O-CB 3.43Å; E486-Q490 PolarHBondContact O-N 3.33Å; E486-N571 PolarHBondContact OE2-ND2 3.04Å; E486-Q575 PolarHBondContact OE2-NE2 3.22Å; E486-R761 VanDerWaalsContact CD-NH2 3.33Å; E486-R761 IonicContact OE1-CZ 3.82Å; E486-R761 IonicContact OE1-NE 2.71Å; E486-R761 PolarHBondContact OE1-NE 3Å; E486-R761 IonicContact OE1-NH2 2.75Å; E486-R761 PolarHBondContact OE1-NH2 3.35Å; E486-R761 IonicContact OE2-NH2 3.2Å; E486-R761 PolarHBondContact OE2-NH2 2.86Å; E486-Y762 WeakPolarHBondContact OE1-CE1 3.43Å; E486-Y762 PolarHBondContact OE1-OH 3.45Å
487	L	93.9	Very high	90.4	Very high	42 Å²	42	53 Å²	53	22%	0.22	28%	0.283	C	S	.	.	H	α-helix	trans	-57.5	-44.5	176.9	-63.9	175.8	0	0	0	111.5	M482 C483 G491	M482-L487 HydrophobicContact CB-CD2 4.4Å; C483-L487 PolarHBondContact O-N 3.1Å; L487-G491 PolarHBondContact O-N 3.3Å
488	L	96.1	Very high	91.9	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-40.7	175.6	-176.8	60.3	0	0	0	112.2	V242 I272 L276 A484 E486 I492 L564	V242-L488 HydrophobicContact CG2-CD1 4.07Å; I272-L488 HydrophobicContact CG1-CD2 4.12Å; L276-L488 HydrophobicContact CD1-CB 4.4Å; L276-L488 HydrophobicContact CD1-CD2 3.75Å; L276-L488 HydrophobicContact CD2-CD2 3.88Å; A484-L488 VanDerWaalsContact O-CB 3.27Å; A484-L488 WeakPolarHBondContact O-CB 3.02Å; A484-L488 PolarHBondContact O-N 3.09Å; A484-L488 VanDerWaalsContact O-N 3.14Å; E486-L488 VanDerWaalsContact C-N 3.32Å; E486-L488 PolarHBondContact O-N 2.67Å; L488-I492 HydrophobicContact CD1-CG2 4Å; L488-I492 WeakPolarHBondContact O-CG1 3.34Å; L488-I492 PolarHBondContact O-N 3.33Å; L488-L564 HydrophobicContact CD2-CD2 3.74Å
489	Y	96.6	Very high	92.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-48.5	176.5	-176	-95.7	0	0	0	111.3	T485 E486 G491 I492 L493 F568 Q575 Y578 N758 Y762	T485-Y489 WeakPolarHBondContact O-CB 3.24Å; T485-Y489 PolarHBondContact O-N 3.36Å; E486-Y489 PolarHBondContact O-N 3.19Å; E486-Y489 VanDerWaalsContact O-N 3.11Å; Y489-G491 VanDerWaalsContact C-N 3.35Å; Y489-G491 PolarHBondContact O-N 3.15Å; Y489-I492 PolarHBondContact O-N 3.08Å; Y489-L493 HydrophobicContact CE1-CB 4.36Å; Y489-L493 HydrophobicContact CE1-CD1 3.98Å; Y489-L493 HydrophobicContact CE1-CD2 4.16Å; Y489-L493 HydrophobicContact CE1-CG 4.4Å; Y489-L493 VanDerWaalsContact O-CB 3.27Å; Y489-L493 WeakPolarHBondContact O-CB 3.48Å; Y489-L493 PolarHBondContact O-N 2.86Å; Y489-F568 AromaticContact CD2-CD1 3.98Å; Y489-F568 HydrophobicContact CD2-CD1 3.98Å; Y489-F568 HydrophobicContact CD2-CD2 4.22Å; Y489-F568 AromaticContact CD2-CE1 3.9Å; Y489-F568 HydrophobicContact CD2-CE1 3.9Å; Y489-F568 HydrophobicContact CD2-CE2 4.12Å; Y489-F568 HydrophobicContact CD2-CG 4.17Å; Y489-F568 AromaticContact CD2-CZ 3.96Å; Y489-F568 HydrophobicContact CD2-CZ 3.96Å; Y489-F568 HydrophobicContact CG-CD1 4.49Å; Y489-F568 HydrophobicContact CG-CE1 4.29Å; Y489-Q575 HydrophobicContact CD1-CG 3.77Å; Y489-Q575 HydrophobicContact CD2-CB 3.64Å; Y489-Q575 HydrophobicContact CD2-CG 3.73Å; Y489-Q575 HydrophobicContact CE1-CB 4.41Å; Y489-Q575 HydrophobicContact CE1-CG 3.73Å; Y489-Q575 HydrophobicContact CE2-CB 3.44Å; Y489-Q575 VanDerWaalsContact CE2-CB 3.44Å; Y489-Q575 HydrophobicContact CE2-CG 3.69Å; Y489-Q575 HydrophobicContact CG-CB 4.2Å; Y489-Q575 HydrophobicContact CG-CG 3.76Å; Y489-Y578 VanDerWaalsContact OH-CD1 3.3Å; Y489-Y578 WeakPolarHBondContact OH-CD1 3.46Å; Y489-N758 PolarHBondContact OH-ND2 3.4Å; Y489-N758 PolarHBondContact OH-OD1 3.44Å; Y489-N758 VanDerWaalsContact OH-OD1 3.14Å; Y489-Y762 AromaticContact CD1-CE1 3.95Å; Y489-Y762 HydrophobicContact CD1-CE1 3.95Å; Y489-Y762 HydrophobicContact CD1-CE2 4.1Å; Y489-Y762 AromaticContact CD1-CZ 3.62Å; Y489-Y762 HydrophobicContact CE1-CD2 4.26Å; Y489-Y762 HydrophobicContact CE1-CE1 4.3Å; Y489-Y762 AromaticContact CE1-CE2 3.6Å; Y489-Y762 HydrophobicContact CE1-CE2 3.6Å; Y489-Y762 AromaticContact CE1-CZ 3.61Å
490	Q	93.8	Very high	94	Very high	66 Å²	66	38.4 Å²	38.4	31%	0.308	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-43.8	-179.9	-172.9	177.6	34.1	0	0	111.6	E486 Y762	E486-Q490 WeakPolarHBondContact O-CB 3.43Å; E486-Q490 PolarHBondContact O-N 3.33Å; Q490-Y762 HydrophobicContact CB-CD1 4.36Å; Q490-Y762 HydrophobicContact CG-CD1 4.22Å
491	G	93.6	Very high	94.6	Very high	17 Å²	17	40.5 Å²	40.5	18%	0.175	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-43.3	176.6	0	0	0	0	0	113.4	L487 Y489 P494	L487-G491 PolarHBondContact O-N 3.3Å; Y489-G491 VanDerWaalsContact C-N 3.35Å; Y489-G491 PolarHBondContact O-N 3.15Å; G491-P494 WeakPolarHBondContact O-CD 3.25Å
492	I	95.9	Very high	95.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-82.3	-16.5	179.7	74.2	179.5	0	0	0	114.5	V242 F245 L488 Y489 P494 S495 L496 Y499 F568	V242-I492 HydrophobicContact CG1-CG2 4.32Å; V242-I492 HydrophobicContact CG2-CG2 4.02Å; F245-I492 HydrophobicContact CD2-CG2 3.76Å; F245-I492 HydrophobicContact CE2-CG2 4.18Å; L488-I492 HydrophobicContact CD1-CG2 4Å; L488-I492 WeakPolarHBondContact O-CG1 3.34Å; L488-I492 PolarHBondContact O-N 3.33Å; Y489-I492 PolarHBondContact O-N 3.08Å; I492-P494 VanDerWaalsContact C-CD 3.46Å; I492-S495 CarbonylContact O-C 3.6Å; I492-S495 PolarHBondContact O-N 3.36Å; I492-L496 HydrophobicContact CD1-CD1 3.5Å; I492-L496 VanDerWaalsContact CD1-CD1 3.5Å; I492-L496 HydrophobicContact CG1-CD1 3.89Å; I492-L496 WeakPolarHBondContact O-CA 3.17Å; I492-L496 PolarHBondContact O-N 2.97Å; I492-Y499 HydrophobicContact CB-CD2 3.97Å; I492-Y499 HydrophobicContact CB-CE2 3.88Å; I492-Y499 HydrophobicContact CG2-CD2 4.44Å; I492-Y499 HydrophobicContact CG2-CE2 4.25Å; I492-F568 HydrophobicContact CD1-CE2 3.91Å; I492-F568 HydrophobicContact CD1-CZ 3.63Å; I492-F568 HydrophobicContact CG1-CZ 4.47Å
493	L	95.1	Very high	95.6	Very high	26 Å²	26	28.9 Å²	28.9	14%	0.136	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-49.8	-47.2	-173.9	173.1	61.6	0	0	0	113.9	Y489 S495 L496 Y578 Y762	Y489-L493 HydrophobicContact CE1-CB 4.36Å; Y489-L493 HydrophobicContact CE1-CD1 3.98Å; Y489-L493 HydrophobicContact CE1-CD2 4.16Å; Y489-L493 HydrophobicContact CE1-CG 4.4Å; Y489-L493 VanDerWaalsContact O-CB 3.27Å; Y489-L493 WeakPolarHBondContact O-CB 3.48Å; Y489-L493 PolarHBondContact O-N 2.86Å; L493-S495 PolarHBondContact O-N 2.76Å; L493-L496 PolarHBondContact O-N 3.1Å; L493-Y578 HydrophobicContact CD1-CD1 4.04Å; L493-Y578 HydrophobicContact CD1-CE1 3.55Å; L493-Y762 HydrophobicContact CD2-CD1 4.39Å; L493-Y762 HydrophobicContact CD2-CD2 3.5Å; L493-Y762 HydrophobicContact CD2-CE2 4.31Å; L493-Y762 HydrophobicContact CD2-CG 3.56Å
494	P	93.8	Very high	95.9	Very high	103 Å²	103	27.7 Å²	27.7	67%	0.669	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-64	-24.4	-175.7	-23.3	35.4	0	0	0	114.8	G491 I492	G491-P494 WeakPolarHBondContact O-CD 3.25Å; I492-P494 VanDerWaalsContact C-CD 3.46Å
495	S	95.9	Very high	96	Very high	39 Å²	39	30.1 Å²	30.1	27%	0.273	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-126.7	14.7	-177	-77.3	0	0	0	0	113.5	I492 L493 P497 Q498 Y499	I492-S495 CarbonylContact O-C 3.6Å; I492-S495 PolarHBondContact O-N 3.36Å; L493-S495 PolarHBondContact O-N 2.76Å; S495-P497 VanDerWaalsContact C-CD 3.42Å; S495-Q498 WeakPolarHBondContact O-CA 3.49Å; S495-Q498 WeakPolarHBondContact O-CB 3.24Å; S495-Q498 PolarHBondContact O-N 3.32Å; S495-Q498 PolarHBondContact O-OE1 2.85Å; S495-Y499 VanDerWaalsContact C-CD2 3.47Å; S495-Y499 VanDerWaalsContact CB-CE2 3.5Å; S495-Y499 VanDerWaalsContact CB-CZ 3.48Å; S495-Y499 WeakPolarHBondContact O-CD2 3.42Å; S495-Y499 PolarHBondContact O-N 2.96Å
496	L	96.3	Very high	96	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-52.6	-43.7	179.9	-173.9	72.6	0	0	0	113.7	I492 L493 Q498 Y499 M500 Y578 M579	I492-L496 HydrophobicContact CD1-CD1 3.5Å; I492-L496 VanDerWaalsContact CD1-CD1 3.5Å; I492-L496 HydrophobicContact CG1-CD1 3.89Å; I492-L496 WeakPolarHBondContact O-CA 3.17Å; I492-L496 PolarHBondContact O-N 2.97Å; L493-L496 PolarHBondContact O-N 3.1Å; L496-Q498 VanDerWaalsContact C-N 3.3Å; L496-Q498 PolarHBondContact O-N 3.4Å; L496-Y499 PolarHBondContact O-N 3.36Å; L496-M500 HydrophobicContact CD1-CE 3.94Å; L496-M500 HydrophobicContact CD1-CG 4.29Å; L496-M500 HydrophobicContact CG-CG 4.29Å; L496-M500 WeakPolarHBondContact O-CB 3.17Å; L496-M500 VanDerWaalsContact O-CG 3.28Å; L496-M500 WeakPolarHBondContact O-CG 3.15Å; L496-M500 PolarHBondContact O-N 3.05Å; L496-Y578 HydrophobicContact CB-CE1 4.26Å; L496-Y578 HydrophobicContact CD2-CD1 3.34Å; L496-Y578 HydrophobicContact CD2-CE1 3.69Å; L496-Y578 HydrophobicContact CD2-CG 4.34Å; L496-M579 HydrophobicContact CD1-CG 4.47Å; L496-M579 HydrophobicContact CD2-CB 4.1Å
497	P	96.4	Very high	96	Very high	32 Å²	32	29.3 Å²	29.3	21%	0.208	16%	0.16	C	C	.	.	H	α-helix	trans	-57.2	-43.9	175.9	-20.1	29.5	0	0	0	112.2	S495 M500 I501	S495-P497 VanDerWaalsContact C-CD 3.42Å; P497-M500 PolarHBondContact O-N 3.41Å; P497-I501 WeakPolarHBondContact O-CB 3.3Å; P497-I501 WeakPolarHBondContact O-CD1 3.2Å; P497-I501 VanDerWaalsContact O-CG1 3.23Å; P497-I501 WeakPolarHBondContact O-CG1 3.31Å; P497-I501 PolarHBondContact O-N 3Å
498	Q	97.2	Very high	96	Very high	93 Å²	93	30.5 Å²	30.5	44%	0.435	17%	0.166	S	C	.	.	H	α-helix	trans	-66.9	-44.4	-178.9	-65.4	82.3	-24.5	0	0	110.9	T249 S495 L496 I501 A502	T249-Q498 HydrophobicContact CG2-CB 3.96Å; S495-Q498 WeakPolarHBondContact O-CA 3.49Å; S495-Q498 WeakPolarHBondContact O-CB 3.24Å; S495-Q498 PolarHBondContact O-N 3.32Å; S495-Q498 PolarHBondContact O-OE1 2.85Å; L496-Q498 VanDerWaalsContact C-N 3.3Å; L496-Q498 PolarHBondContact O-N 3.4Å; Q498-I501 PolarHBondContact O-N 2.9Å; Q498-A502 VanDerWaalsContact O-CB 3.28Å; Q498-A502 WeakPolarHBondContact O-CB 3.23Å; Q498-A502 PolarHBondContact O-N 2.68Å
499	Y	97.9	Very high	95.9	Very high	18 Å²	18	30.4 Å²	30.4	7%	0.071	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-43.2	174.7	-57.6	-43.1	0	0	0	112	F245 T249 I492 S495 L496 A502 L503	F245-Y499 VanDerWaalsContact C-CE1 3.47Å; F245-Y499 HydrophobicContact CB-CD1 3.68Å; F245-Y499 HydrophobicContact CB-CD2 4.28Å; F245-Y499 HydrophobicContact CB-CE1 3.65Å; F245-Y499 HydrophobicContact CB-CE2 4.25Å; F245-Y499 HydrophobicContact CB-CG 4.03Å; F245-Y499 HydrophobicContact CD1-CD1 4.1Å; F245-Y499 AromaticContact CD1-CG 3.91Å; F245-Y499 HydrophobicContact CD1-CG 3.91Å; F245-Y499 HydrophobicContact CG-CD1 4.23Å; F245-Y499 HydrophobicContact CG-CD2 4.39Å; F245-Y499 HydrophobicContact CG-CG 4.14Å; F245-Y499 WeakPolarHBondContact O-CD1 3.41Å; F245-Y499 WeakPolarHBondContact O-CE1 3.18Å; T249-Y499 HydrophobicContact CG2-CD1 3.59Å; T249-Y499 HydrophobicContact CG2-CE1 3.98Å; I492-Y499 HydrophobicContact CB-CD2 3.97Å; I492-Y499 HydrophobicContact CB-CE2 3.88Å; I492-Y499 HydrophobicContact CG2-CD2 4.44Å; I492-Y499 HydrophobicContact CG2-CE2 4.25Å; S495-Y499 VanDerWaalsContact C-CD2 3.47Å; S495-Y499 VanDerWaalsContact CB-CE2 3.5Å; S495-Y499 VanDerWaalsContact CB-CZ 3.48Å; S495-Y499 WeakPolarHBondContact O-CD2 3.42Å; S495-Y499 PolarHBondContact O-N 2.96Å; L496-Y499 PolarHBondContact O-N 3.36Å; Y499-A502 PolarHBondContact O-N 3.25Å; Y499-L503 WeakPolarHBondContact O-CG 3.48Å; Y499-L503 PolarHBondContact O-N 2.91Å
500	M	98	Very high	95.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.6	-42.6	177.2	-68.1	-53.3	97.9	0	0	111.7	L496 P497 L503 L504 L561 M579 H582 L583	L496-M500 HydrophobicContact CD1-CE 3.94Å; L496-M500 HydrophobicContact CD1-CG 4.29Å; L496-M500 HydrophobicContact CG-CG 4.29Å; L496-M500 WeakPolarHBondContact O-CB 3.17Å; L496-M500 VanDerWaalsContact O-CG 3.28Å; L496-M500 WeakPolarHBondContact O-CG 3.15Å; L496-M500 PolarHBondContact O-N 3.05Å; P497-M500 PolarHBondContact O-N 3.41Å; M500-L503 HydrophobicContact CE-CD1 4.04Å; M500-L504 WeakPolarHBondContact O-CB 3.35Å; M500-L504 WeakPolarHBondContact O-CD1 3.43Å; M500-L504 VanDerWaalsContact O-CG 3.22Å; M500-L504 WeakPolarHBondContact O-CG 3.48Å; M500-L504 PolarHBondContact O-N 3.21Å; M500-L504 VanDerWaalsContact O-N 3.15Å; M500-L561 HydrophobicContact CE-CD2 4.27Å; M500-L561 HydrophobicContact SD-CD2 3.76Å; M500-M579 HydrophobicContact CE-CE 3.9Å; M500-M579 HydrophobicContact CG-CG 4.42Å; M500-M579 HydrophobicContact SD-CE 3.41Å; M500-M579 WeakPolarHBondContact SD-CE 3.17Å; M500-M579 HydrophobicContact SD-CG 3.78Å; M500-M579 HydrophobicContact SD-SD 4.48Å; M500-H582 HydrophobicContact CB-CB 4.49Å; M500-H582 HydrophobicContact CG-CB 4.4Å; M500-L583 HydrophobicContact CB-CD2 4.05Å; M500-L583 HydrophobicContact CB-CG 4.48Å; M500-L583 HydrophobicContact CG-CD2 4.17Å; M500-L583 HydrophobicContact CG-CG 4.23Å; M500-L583 HydrophobicContact SD-CD1 4.34Å; M500-L583 HydrophobicContact SD-CD2 3.68Å; M500-L583 HydrophobicContact SD-CG 3.89Å
501	I	96.9	Very high	95.5	Very high	79 Å²	79	27.4 Å²	27.4	41%	0.405	15%	0.152	S	C	.	.	H	α-helix	trans	-63	-42.9	174.7	-71.2	163.6	0	0	0	111.2	P497 Q498 L504 K505 A586	P497-I501 WeakPolarHBondContact O-CB 3.3Å; P497-I501 WeakPolarHBondContact O-CD1 3.2Å; P497-I501 VanDerWaalsContact O-CG1 3.23Å; P497-I501 WeakPolarHBondContact O-CG1 3.31Å; P497-I501 PolarHBondContact O-N 3Å; Q498-I501 PolarHBondContact O-N 2.9Å; I501-L504 PolarHBondContact O-N 3.05Å; I501-K505 HydrophobicContact CG2-CD 4.32Å; I501-K505 HydrophobicContact CG2-CG 4.47Å; I501-K505 WeakPolarHBondContact O-CG 3.26Å; I501-K505 PolarHBondContact O-N 2.88Å; I501-A586 HydrophobicContact CG1-CB 3.71Å
502	A	97.1	Very high	94.9	Very high	3 Å²	3	29.6 Å²	29.6	3%	0.025	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-47.1	-178.8	0	0	0	0	0	112.2	V248 T249 C252 Q498 Y499 L504 K505 I506	V248-A502 HydrophobicContact CG1-CB 3.75Å; T249-A502 HydrophobicContact CG2-CB 4.04Å; C252-A502 HydrophobicContact CB-CB 3.67Å; C252-A502 PolarHBondContact SG-O 2.89Å; Q498-A502 VanDerWaalsContact O-CB 3.28Å; Q498-A502 WeakPolarHBondContact O-CB 3.23Å; Q498-A502 PolarHBondContact O-N 2.68Å; Y499-A502 PolarHBondContact O-N 3.25Å; A502-L504 VanDerWaalsContact C-N 3.31Å; A502-L504 PolarHBondContact O-N 3.28Å; A502-K505 WeakPolarHBondContact O-CB 3.4Å; A502-K505 PolarHBondContact O-N 3.43Å; A502-I506 WeakPolarHBondContact O-CG1 3.2Å; A502-I506 PolarHBondContact O-N 3.06Å; A502-I506 VanDerWaalsContact O-N 3.08Å
503	L	98.2	Very high	94	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.5	-43.5	173	-73.1	-178.1	0	0	0	112	F245 V248 L265 Y499 M500 I506 L507 I557 I560 L561	F245-L503 HydrophobicContact CE1-CD1 3.98Å; F245-L503 HydrophobicContact CE1-CG 4.4Å; V248-L503 HydrophobicContact CG1-CD2 4.24Å; L265-L503 HydrophobicContact CD2-CD2 3.69Å; Y499-L503 WeakPolarHBondContact O-CG 3.48Å; Y499-L503 PolarHBondContact O-N 2.91Å; M500-L503 HydrophobicContact CE-CD1 4.04Å; L503-I506 PolarHBondContact O-N 2.85Å; L503-L507 WeakPolarHBondContact O-CB 3.4Å; L503-L507 PolarHBondContact O-N 3.26Å; L503-I557 HydrophobicContact CB-CG2 4.11Å; L503-I557 HydrophobicContact CD2-CG1 4.18Å; L503-I557 HydrophobicContact CD2-CG2 4.34Å; L503-I560 HydrophobicContact CD1-CG2 4.09Å; L503-L561 HydrophobicContact CD1-CD2 3.55Å; L503-L561 HydrophobicContact CD1-CG 4.06Å
504	L	96.9	Very high	93.1	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-71.3	-31.9	-179.8	-66.1	170.4	0	0	0	113	M500 I501 A502 L507 L508 L561 L583 A586 C588 L591	M500-L504 WeakPolarHBondContact O-CB 3.35Å; M500-L504 WeakPolarHBondContact O-CD1 3.43Å; M500-L504 VanDerWaalsContact O-CG 3.22Å; M500-L504 WeakPolarHBondContact O-CG 3.48Å; M500-L504 PolarHBondContact O-N 3.21Å; M500-L504 VanDerWaalsContact O-N 3.15Å; I501-L504 PolarHBondContact O-N 3.05Å; A502-L504 VanDerWaalsContact C-N 3.31Å; A502-L504 PolarHBondContact O-N 3.28Å; L504-L507 HydrophobicContact CD2-CD2 4.22Å; L504-L508 WeakPolarHBondContact O-CB 3.49Å; L504-L508 PolarHBondContact O-N 3.48Å; L504-L561 HydrophobicContact CD2-CD1 4.34Å; L504-L583 HydrophobicContact CD1-CD2 3.75Å; L504-L583 HydrophobicContact CD2-CD2 4.25Å; L504-L583 HydrophobicContact CG-CD2 4.12Å; L504-A586 HydrophobicContact CD1-CB 3.53Å; L504-C588 HydrophobicContact CD1-CB 3.87Å; L504-C588 HydrophobicContact CD2-CB 3.87Å; L504-L591 HydrophobicContact CB-CD2 4.13Å; L504-L591 HydrophobicContact CD2-CD2 3.91Å; L504-L591 WeakPolarHBondContact O-CD2 3.24Å
505	K	95.3	Very high	91.7	Very high	83 Å²	83	34.1 Å²	34.1	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-61.3	-47.8	170.1	-79.7	176.7	170.1	-175.8	0	111.4	C252 I501 A502 L508 A509 I521	C252-K505 HydrophobicContact CB-CD 4.29Å; C252-K505 PolarHBondContact O-NZ 3.01Å; C252-K505 VanDerWaalsContact O-NZ 3.13Å; I501-K505 HydrophobicContact CG2-CD 4.32Å; I501-K505 HydrophobicContact CG2-CG 4.47Å; I501-K505 WeakPolarHBondContact O-CG 3.26Å; I501-K505 PolarHBondContact O-N 2.88Å; A502-K505 WeakPolarHBondContact O-CB 3.4Å; A502-K505 PolarHBondContact O-N 3.43Å; K505-L508 WeakPolarHBondContact O-CB 3.47Å; K505-L508 PolarHBondContact O-N 3.42Å; K505-A509 PolarHBondContact O-N 3.13Å; K505-A509 VanDerWaalsContact O-N 3.11Å; K505-I521 HydrophobicContact CB-CD1 4.07Å
506	I	96	Very high	89.8	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-43.5	179.4	-60.3	162	0	0	0	110.2	V248 F251 C252 M261 L265 A502 L503 L508 A509 A510 I521 I523 I553 I557	V248-I506 HydrophobicContact CG1-CD1 3.84Å; F251-I506 HydrophobicContact CD1-CD1 4.44Å; F251-I506 HydrophobicContact CE1-CG1 4.38Å; C252-I506 WeakPolarHBondContact SG-CG1 3.37Å; M261-I506 HydrophobicContact CG-CD1 3.77Å; M261-I506 HydrophobicContact CG-CG1 4.5Å; M261-I506 HydrophobicContact CG-CG2 4.44Å; M261-I506 HydrophobicContact SD-CD1 3.85Å; L265-I506 HydrophobicContact CD1-CD1 4.46Å; L265-I506 HydrophobicContact CD1-CG2 4.06Å; A502-I506 WeakPolarHBondContact O-CG1 3.2Å; A502-I506 PolarHBondContact O-N 3.06Å; A502-I506 VanDerWaalsContact O-N 3.08Å; L503-I506 PolarHBondContact O-N 2.85Å; I506-L508 PolarHBondContact O-N 2.98Å; I506-A509 PolarHBondContact O-N 3.04Å; I506-A509 VanDerWaalsContact O-N 3.16Å; I506-A510 WeakPolarHBondContact O-CB 3.26Å; I506-A510 PolarHBondContact O-N 2.92Å; I506-I521 HydrophobicContact CB-CD1 4.43Å; I506-I521 HydrophobicContact CG1-CD1 3.83Å; I506-I523 HydrophobicContact CG2-CG2 4.12Å; I506-I553 HydrophobicContact CG2-CG2 3.51Å; I506-I557 HydrophobicContact CB-CD1 3.79Å; I506-I557 HydrophobicContact CG2-CD1 3.63Å
507	L	95.9	Very high	87.5	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-33.2	175.5	-175.7	64.2	0	0	0	112.7	L503 L504 A511 V554 I557 L591 L650	L503-L507 WeakPolarHBondContact O-CB 3.4Å; L503-L507 PolarHBondContact O-N 3.26Å; L504-L507 HydrophobicContact CD2-CD2 4.22Å; L507-A511 WeakPolarHBondContact O-CB 3.45Å; L507-A511 PolarHBondContact O-N 2.88Å; L507-A511 VanDerWaalsContact O-N 3.07Å; L507-V554 HydrophobicContact CD1-CB 4.33Å; L507-V554 HydrophobicContact CD1-CG1 4.03Å; L507-V554 HydrophobicContact CD1-CG2 4.1Å; L507-I557 HydrophobicContact CB-CD1 4.19Å; L507-I557 HydrophobicContact CB-CG2 4.22Å; L507-I557 HydrophobicContact CD1-CG2 4.47Å; L507-I557 HydrophobicContact CD2-CG2 4.38Å; L507-L591 HydrophobicContact CB-CD2 4.2Å; L507-L591 HydrophobicContact CD2-CD2 3.95Å; L507-L591 HydrophobicContact CG-CD2 4.13Å; L507-L650 HydrophobicContact CD2-CD2 4.03Å
508	L	94.1	Very high	85.3	Confident	66 Å²	66	49.8 Å²	49.8	35%	0.346	26%	0.264	S	S	.	.	H	α-helix	trans	-70.6	-43.8	173.8	173.1	59.3	0	0	0	112.6	L504 K505 I506 A510 A511 S514 L591 K594	L504-L508 WeakPolarHBondContact O-CB 3.49Å; L504-L508 PolarHBondContact O-N 3.48Å; K505-L508 WeakPolarHBondContact O-CB 3.47Å; K505-L508 PolarHBondContact O-N 3.42Å; I506-L508 PolarHBondContact O-N 2.98Å; L508-A510 VanDerWaalsContact C-N 3.32Å; L508-A510 PolarHBondContact O-N 2.99Å; L508-A511 WeakPolarHBondContact O-CB 3.48Å; L508-A511 PolarHBondContact O-N 3.38Å; L508-S514 WeakPolarHBondContact O-CB 3.37Å; L508-L591 HydrophobicContact CB-CD1 3.81Å; L508-L591 HydrophobicContact CB-CD2 4.36Å; L508-L591 HydrophobicContact CD1-CD1 3.77Å; L508-L591 HydrophobicContact CG-CD1 4.32Å; L508-K594 HydrophobicContact CD1-CD 4.35Å
509	A	92.6	Very high	83.5	Confident	3 Å²	3	47.6 Å²	47.6	3%	0.025	26%	0.255	C	S	.	.	H	α-helix	trans	-67.7	-32.2	177.1	0	0	0	0	0	112.8	K505 I506 I521 I523 K550	K505-A509 PolarHBondContact O-N 3.13Å; K505-A509 VanDerWaalsContact O-N 3.11Å; I506-A509 PolarHBondContact O-N 3.04Å; I506-A509 VanDerWaalsContact O-N 3.16Å; A509-I521 HydrophobicContact CB-CD1 4.34Å; A509-I521 HydrophobicContact CB-CG1 4.07Å; A509-I523 HydrophobicContact CB-CD1 4.06Å; A509-I523 HydrophobicContact CB-CG1 4.32Å; A509-I523 HydrophobicContact CB-CG2 3.91Å; A509-K550 PolarHBondContact O-NZ 3.31Å
510	A	93.4	Very high	82.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-81.4	-13	174.7	0	0	0	0	0	113.6	I506 L508 I523 K550 I553 V554	I506-A510 WeakPolarHBondContact O-CB 3.26Å; I506-A510 PolarHBondContact O-N 2.92Å; L508-A510 VanDerWaalsContact C-N 3.32Å; L508-A510 PolarHBondContact O-N 2.99Å; A510-I523 HydrophobicContact CB-CD1 3.82Å; A510-K550 HydrophobicContact CB-CB 4.32Å; A510-K550 HydrophobicContact CB-CG 4.44Å; A510-I553 HydrophobicContact CB-CB 4.16Å; A510-I553 HydrophobicContact CB-CG2 3.59Å; A510-V554 HydrophobicContact CB-CG2 3.84Å
511	A	88.9	Confident	81.6	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	29%	0.289	C	S	.	.	S	Bend	trans	-64.1	132.2	179	0	0	0	0	0	110.9	L507 L508 T513 S514 F595	L507-A511 WeakPolarHBondContact O-CB 3.45Å; L507-A511 PolarHBondContact O-N 2.88Å; L507-A511 VanDerWaalsContact O-N 3.07Å; L508-A511 WeakPolarHBondContact O-CB 3.48Å; L508-A511 PolarHBondContact O-N 3.38Å; A511-T513 PolarHBondContact O-N 3.05Å; A511-S514 PolarHBondContact O-N 3.46Å; A511-F595 HydrophobicContact CB-CD2 4.12Å
512	P	80.7	Confident	81.1	Confident	64 Å²	64	52.1 Å²	52.1	42%	0.416	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-11.6	-179.5	-23.2	32.2	0	0	0	114.9	Y603	P512-Y603 HydrophobicContact CG-CD2 3.83Å; P512-Y603 HydrophobicContact CG-CE2 3.66Å
513	T	76.6	Confident	80.8	Confident	44 Å²	44	52.3 Å²	52.3	27%	0.27	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	4.9	176.6	61.1	0	0	0	0	113.8	A511 K594 Q598	A511-T513 PolarHBondContact O-N 3.05Å; T513-K594 WeakPolarHBondContact OG1-CE 3.36Å; T513-Q598 HydrophobicContact CG2-CB 3.91Å; T513-Q598 HydrophobicContact CG2-CG 4.41Å
514	S	76.3	Confident	80.4	Confident	21 Å²	21	53.9 Å²	53.9	15%	0.147	30%	0.297	C	S	.	.			trans	-79.1	151.4	172.2	-149.6	0	0	0	0	112	L508 A511 D519	L508-S514 WeakPolarHBondContact O-CB 3.37Å; A511-S514 PolarHBondContact O-N 3.46Å; S514-D519 VanDerWaalsContact CB-OD1 3.32Å; S514-D519 WeakPolarHBondContact CB-OD1 3.37Å; S514-D519 PolarHBondContact OG-OD1 3.03Å
515	K	65.3	Low	79.9	Confident	159 Å²	159	53.6 Å²	53.6	69%	0.691	30%	0.296	S	S	*	.			trans	-111	138.6	174.6	-63.8	-174.2	178.4	-175.5	0	108.5	K517 T518	K515-K517 PolarHBondContact O-N 2.99Å; K515-T518 PolarHBondContact N-OG1 3.43Å; K515-T518 WeakPolarHBondContact O-CA 3.42Å; K515-T518 PolarHBondContact O-N 3.13Å; K515-T518 PolarHBondContact O-OG1 3.39Å
516	A	56	Low	79.4	Confident	93 Å²	93	49.7 Å²	49.7	77%	0.769	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-54.7	-26.1	-178.7	0	0	0	0	0	114.7	T518 D519	A516-T518 VanDerWaalsContact C-N 3.27Å; A516-T518 PolarHBondContact O-N 3.02Å; A516-D519 WeakPolarHBondContact CA-OD2 3.28Å
517	K	46.9	Very low	79.1	Confident	210 Å²	210	49.7 Å²	49.7	91%	0.913	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-79.3	1.8	173.9	-67.7	-167.5	175.1	-172.4	0	115	K515	K515-K517 PolarHBondContact O-N 2.99Å
518	T	50.3	Low	78.9	Confident	97 Å²	97	51.1 Å²	51.1	60%	0.595	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-124.9	-0.3	-179.2	54.5	0	0	0	0	113.6	K515 A516 S520	K515-T518 PolarHBondContact N-OG1 3.43Å; K515-T518 WeakPolarHBondContact O-CA 3.42Å; K515-T518 PolarHBondContact O-N 3.13Å; K515-T518 PolarHBondContact O-OG1 3.39Å; A516-T518 VanDerWaalsContact C-N 3.27Å; A516-T518 PolarHBondContact O-N 3.02Å; T518-S520 PolarHBondContact O-N 3.37Å
519	D	60.8	Low	78.6	Confident	46 Å²	46	49.2 Å²	49.2	25%	0.246	28%	0.278	C	S	.	.			trans	-83.3	106.8	-178.2	-65.6	-41.2	0	0	0	110.3	S514 A516 I521	S514-D519 VanDerWaalsContact CB-OD1 3.32Å; S514-D519 WeakPolarHBondContact CB-OD1 3.37Å; S514-D519 PolarHBondContact OG-OD1 3.03Å; A516-D519 WeakPolarHBondContact CA-OD2 3.28Å; D519-I521 PolarHBondContact O-N 3.32Å
520	S	68.8	Low	78.3	Confident	97 Å²	97	56 Å²	56	68%	0.678	31%	0.309	S	S	*	.	S	Bend	trans	-71.5	-1.9	-178.7	61.3	0	0	0	0	115.4	T518	T518-S520 PolarHBondContact O-N 3.37Å
521	I	85.9	Confident	77.9	Confident	23 Å²	23	64.1 Å²	64.1	12%	0.118	35%	0.347	C	S	.	.	S	Bend	trans	-148.5	137.4	-177	47.3	173.9	0	0	0	109.4	F251 K505 I506 A509 D519 I523	F251-I521 HydrophobicContact CE1-CB 4.29Å; F251-I521 HydrophobicContact CE1-CD1 4.2Å; K505-I521 HydrophobicContact CB-CD1 4.07Å; I506-I521 HydrophobicContact CB-CD1 4.43Å; I506-I521 HydrophobicContact CG1-CD1 3.83Å; A509-I521 HydrophobicContact CB-CD1 4.34Å; A509-I521 HydrophobicContact CB-CG1 4.07Å; D519-I521 PolarHBondContact O-N 3.32Å; I521-I523 HydrophobicContact CD1-CG2 4.16Å; I521-I523 HydrophobicContact CG1-CG2 4.3Å; I521-I523 PolarHBondContact O-N 2.8Å
522	N	87.3	Confident	77.8	Confident	72 Å²	72	69 Å²	69	39%	0.385	37%	0.371	S	S	.	.			trans	-88	96.1	176	179.3	17	0	0	0	110.9	F251 L524	F251-N522 WeakPolarHBondContact CZ-O 3.35Å; N522-L524 VanDerWaalsContact C-N 3.26Å; N522-L524 PolarHBondContact O-N 3.3Å; N522-L524 PolarHBondContact OD1-N 2.92Å
523	I	91.1	Very high	78	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.041	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-3.9	177.4	62.5	167.3	0	0	0	114.3	F251 I506 A509 A510 I521 H549 K550 I553	F251-I523 HydrophobicContact CE1-CG2 4.27Å; F251-I523 HydrophobicContact CZ-CG2 4.3Å; I506-I523 HydrophobicContact CG2-CG2 4.12Å; A509-I523 HydrophobicContact CB-CD1 4.06Å; A509-I523 HydrophobicContact CB-CG1 4.32Å; A509-I523 HydrophobicContact CB-CG2 3.91Å; A510-I523 HydrophobicContact CB-CD1 3.82Å; I521-I523 HydrophobicContact CD1-CG2 4.16Å; I521-I523 HydrophobicContact CG1-CG2 4.3Å; I521-I523 PolarHBondContact O-N 2.8Å; I523-H549 PolarHBondContact O-NE2 2.88Å; I523-K550 HydrophobicContact CD1-CG 4.06Å; I523-I553 HydrophobicContact CB-CD1 4.41Å; I523-I553 HydrophobicContact CD1-CD1 4.44Å
524	L	89.9	Confident	78.6	Confident	33 Å²	33	72 Å²	72	17%	0.173	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	3	-170.5	-57	-179.6	0	0	0	114.5	N522 D526 V527 L528 V546	N522-L524 VanDerWaalsContact C-N 3.26Å; N522-L524 PolarHBondContact O-N 3.3Å; N522-L524 PolarHBondContact OD1-N 2.92Å; L524-D526 PolarHBondContact O-N 3.3Å; L524-D526 VanDerWaalsContact O-N 3.14Å; L524-V527 PolarHBondContact O-N 3.16Å; L524-L528 HydrophobicContact CB-CD1 4.26Å; L524-L528 HydrophobicContact CB-CG 4.2Å; L524-L528 WeakPolarHBondContact O-CG 3.38Å; L524-L528 PolarHBondContact O-N 3.1Å; L524-L528 VanDerWaalsContact O-N 3.08Å; L524-V546 HydrophobicContact CD1-CG1 3.8Å; L524-V546 HydrophobicContact CD1-CG2 4.4Å; L524-V546 HydrophobicContact CD2-CG1 3.96Å
525	A	86.6	Confident	79.3	Confident	2 Å²	2	74 Å²	74	2%	0.017	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.1	179.3	0	0	0	0	0	113.6	I186 S187 L188 V527	I186-A525 HydrophobicContact CB-CB 4.25Å; I186-A525 HydrophobicContact CG2-CB 3.87Å; S187-A525 CarbonylContact C-O 3.53Å; L188-A525 WeakPolarHBondContact CA-O 3.33Å; L188-A525 PolarHBondContact N-O 3.41Å; A525-V527 VanDerWaalsContact C-N 3.28Å; A525-V527 PolarHBondContact O-N 3.34Å
526	D	84.5	Confident	80.4	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.005	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	5.4	178.1	-174.6	56.9	0	0	0	114	R195 P260 K262 K263 L524 H549	R195-D526 WeakPolarHBondContact CD-OD1 3.27Å; P260-D526 HydrophobicContact CB-CB 3.96Å; P260-D526 WeakPolarHBondContact CB-OD1 3.4Å; K262-D526 WeakPolarHBondContact CE-OD2 3.38Å; K263-D526 IonicContact NZ-OD1 3.46Å; K263-D526 PolarHBondContact NZ-OD1 3.35Å; K263-D526 IonicContact NZ-OD2 2.72Å; K263-D526 PolarHBondContact NZ-OD2 3.25Å; L524-D526 PolarHBondContact O-N 3.3Å; L524-D526 VanDerWaalsContact O-N 3.14Å; D526-H549 IonicContact OD2-CE1 3.84Å
527	V	90.1	Very high	81.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-39.7	177.6	-170.1	0	0	0	0	111.9	T67 L524 A525 L542 D545 V546 H549	T67-V527 WeakPolarHBondContact CB-O 3.49Å; T67-V527 WeakPolarHBondContact CG2-O 3.46Å; T67-V527 PolarHBondContact OG1-O 3.46Å; L524-V527 PolarHBondContact O-N 3.16Å; A525-V527 VanDerWaalsContact C-N 3.28Å; A525-V527 PolarHBondContact O-N 3.34Å; V527-L542 HydrophobicContact CG1-CD1 3.91Å; V527-D545 HydrophobicContact CG1-CB 4.21Å; V527-V546 HydrophobicContact CG1-CG2 3.99Å; V527-H549 HydrophobicContact CG2-CB 3.69Å; V527-H549 WeakPolarHBondContact CG2-ND1 3.48Å
528	L	90.1	Very high	83.8	Confident	32 Å²	32	64.8 Å²	64.8	17%	0.168	36%	0.356	C	S	.	.			trans	-64.9	126.8	-172.3	-66.3	175.5	0	0	0	111.2	S187 L188 L524 M532	S187-L528 WeakPolarHBondContact CA-O 3.3Å; L188-L528 PolarHBondContact N-O 3.42Å; L524-L528 HydrophobicContact CB-CD1 4.26Å; L524-L528 HydrophobicContact CB-CG 4.2Å; L524-L528 WeakPolarHBondContact O-CG 3.38Å; L524-L528 PolarHBondContact O-N 3.1Å; L524-L528 VanDerWaalsContact O-N 3.08Å; L528-M532 HydrophobicContact CB-CE 4.32Å; L528-M532 HydrophobicContact CD2-CE 4.29Å
529	P	89.3	Confident	85.7	Confident	27 Å²	27	62.7 Å²	62.7	18%	0.175	35%	0.346	C	S	.	.			trans	-70.1	165.3	173.9	32.1	-36.3	0	0	0	111.2	E531	P529-E531 WeakPolarHBondContact CB-O 3.42Å; P529-E531 WeakPolarHBondContact CG-O 3.38Å
530	E	85	Confident	87.2	Confident	144 Å²	144	63.3 Å²	63.3	67%	0.673	35%	0.348	S	S	*	.	S	Bend	trans	-65	-47.3	171	-67	-172.2	112	0	0	111.6	A189	A189-E530 HydrophobicContact CB-CG 3.5Å; A189-E530 WeakPolarHBondContact CB-OE1 3.24Å
531	E	85.8	Confident	88.2	Confident	172 Å²	172	61.3 Å²	61.3	80%	0.804	33%	0.327	S	S	*	.	S	Bend	trans	-98.8	125.8	174	-63.5	-168.1	161.3	0	0	110.7	P529	P529-E531 WeakPolarHBondContact CB-O 3.42Å; P529-E531 WeakPolarHBondContact CG-O 3.38Å
532	M	86	Confident	88.5	Confident	103 Å²	103	61.3 Å²	61.3	51%	0.507	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-70.3	142.8	179.6	-70.6	-68.9	152.3	0	0	111.4	L528 T534	L528-M532 HydrophobicContact CB-CE 4.32Å; L528-M532 HydrophobicContact CD2-CE 4.29Å; M532-T534 PolarHBondContact O-N 2.98Å
533	P	86.3	Confident	88.7	Confident	35 Å²	35	59.5 Å²	59.5	23%	0.227	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-62.1	126.2	-174.4	25.3	-35.2	0	0	0	112.1	Q538 L542	P533-Q538 HydrophobicContact CB-CB 3.48Å; P533-Q538 VanDerWaalsContact CB-CB 3.48Å; P533-L542 HydrophobicContact CG-CD2 3.81Å
534	T	88.2	Confident	88.8	Confident	136 Å²	136	60.3 Å²	60.3	83%	0.834	33%	0.331	S	S	*	.			trans	-87.5	-19.5	-179.5	54.5	0	0	0	0	113.1	M532	M532-T534 PolarHBondContact O-N 2.98Å
535	T	90.5	Very high	88.9	Confident	63 Å²	63	58.8 Å²	58.8	39%	0.387	32%	0.323	S	S	.	.	S	Bend	trans	-103	154.1	179.3	68.4	0	0	0	0	112.6	L537 Q538 S539	T535-L537 VanDerWaalsContact C-N 3.33Å; T535-L537 PolarHBondContact O-N 3.49Å; T535-Q538 PolarHBondContact O-N 2.95Å; T535-Q538 WeakPolarHBondContact OG1-CB 3.42Å; T535-Q538 WeakPolarHBondContact OG1-CG 3.23Å; T535-Q538 PolarHBondContact OG1-N 3.48Å; T535-Q538 PolarHBondContact OG1-OE1 3.29Å; T535-S539 WeakPolarHBondContact O-CB 3.43Å; T535-S539 PolarHBondContact O-N 3.42Å; T535-S539 PolarHBondContact O-OG 3.26Å
536	V	88.2	Confident	89.2	Confident	115 Å²	115	60 Å²	60	70%	0.697	33%	0.33	S	S	*	.	H	α-helix	trans	-60.3	-43.5	175.3	-178.7	0	0	0	0	110.9	S539 M540	V536-S539 CarbonylContact O-C 3.4Å; V536-S539 WeakPolarHBondContact O-CB 3.26Å; V536-S539 PolarHBondContact O-N 3.06Å; V536-S539 VanDerWaalsContact O-N 3.16Å; V536-M540 HydrophobicContact CG1-CG 4.4Å; V536-M540 HydrophobicContact CG1-SD 4.07Å; V536-M540 WeakPolarHBondContact O-CG 3.43Å; V536-M540 PolarHBondContact O-N 3.26Å
537	L	87.4	Confident	89.7	Confident	61 Å²	61	63.6 Å²	63.6	32%	0.319	35%	0.35	S	S	.	.	H	α-helix	trans	-60.8	-47.9	180	-175.1	77.6	0	0	0	112.4	T535 S539 M540 K541 L626 L631	T535-L537 VanDerWaalsContact C-N 3.33Å; T535-L537 PolarHBondContact O-N 3.49Å; L537-S539 VanDerWaalsContact C-N 3.27Å; L537-S539 PolarHBondContact O-N 3.14Å; L537-M540 PolarHBondContact O-N 3.37Å; L537-K541 PolarHBondContact O-N 2.88Å; L537-L626 HydrophobicContact CD2-CB 4.29Å; L537-L626 WeakPolarHBondContact CD2-O 3.47Å; L537-L631 HydrophobicContact CD1-CD1 3.64Å; L537-L631 HydrophobicContact CD1-CG 4.44Å; L537-L631 HydrophobicContact CG-CD1 4.37Å
538	Q	88	Confident	89.9	Confident	93 Å²	93	63.7 Å²	63.7	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-34.2	176.3	-67.8	162.1	-31.9	0	0	111.4	P533 T535 K541 L542	P533-Q538 HydrophobicContact CB-CB 3.48Å; P533-Q538 VanDerWaalsContact CB-CB 3.48Å; T535-Q538 PolarHBondContact O-N 2.95Å; T535-Q538 WeakPolarHBondContact OG1-CB 3.42Å; T535-Q538 WeakPolarHBondContact OG1-CG 3.23Å; T535-Q538 PolarHBondContact OG1-N 3.48Å; T535-Q538 PolarHBondContact OG1-OE1 3.29Å; Q538-K541 PolarHBondContact O-N 2.82Å; Q538-L542 WeakPolarHBondContact O-CB 3.23Å; Q538-L542 PolarHBondContact O-N 3.35Å
539	S	90.8	Very high	90.2	Very high	54 Å²	54	62.1 Å²	62.1	38%	0.378	34%	0.342	S	S	.	.	H	α-helix	trans	-67	-40.1	175.2	-58.4	0	0	0	0	112.2	T535 V536 L537 L542 G543	T535-S539 WeakPolarHBondContact O-CB 3.43Å; T535-S539 PolarHBondContact O-N 3.42Å; T535-S539 PolarHBondContact O-OG 3.26Å; V536-S539 CarbonylContact O-C 3.4Å; V536-S539 WeakPolarHBondContact O-CB 3.26Å; V536-S539 PolarHBondContact O-N 3.06Å; V536-S539 VanDerWaalsContact O-N 3.16Å; L537-S539 VanDerWaalsContact C-N 3.27Å; L537-S539 PolarHBondContact O-N 3.14Å; S539-L542 PolarHBondContact O-N 3.39Å; S539-G543 PolarHBondContact O-N 3.04Å
540	M	90.8	Very high	90.4	Very high	58 Å²	58	62.8 Å²	62.8	29%	0.286	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-48.4	172.7	-70.8	172.1	73.3	0	0	111	V536 L537 L542 G543 V544 A628 L631 E632	V536-M540 HydrophobicContact CG1-CG 4.4Å; V536-M540 HydrophobicContact CG1-SD 4.07Å; V536-M540 WeakPolarHBondContact O-CG 3.43Å; V536-M540 PolarHBondContact O-N 3.26Å; L537-M540 PolarHBondContact O-N 3.37Å; M540-L542 VanDerWaalsContact C-N 3.32Å; M540-L542 PolarHBondContact O-N 3.08Å; M540-G543 PolarHBondContact O-N 3.05Å; M540-G543 VanDerWaalsContact O-N 3.14Å; M540-V544 WeakPolarHBondContact O-CG2 3.44Å; M540-V544 PolarHBondContact O-N 3.48Å; M540-A628 HydrophobicContact CE-CB 4.3Å; M540-A628 HydrophobicContact SD-CB 4.42Å; M540-L631 HydrophobicContact CB-CD1 3.96Å; M540-E632 HydrophobicContact CE-CG 4.49Å
541	K	91.1	Very high	91	Very high	55 Å²	55	56.3 Å²	56.3	24%	0.239	31%	0.311	C	S	.	.	H	α-helix	trans	-54.4	-46.1	174.6	178.2	-176	169.8	-178.4	0	111.8	Y66 L537 Q538 V544 D545 I610 L613	Y66-K541 VanDerWaalsContact CB-CE 3.41Å; Y66-K541 VanDerWaalsContact O-CE 3.27Å; Y66-K541 WeakPolarHBondContact O-CE 3.46Å; Y66-K541 PolarHBondContact O-NZ 3.3Å; L537-K541 PolarHBondContact O-N 2.88Å; Q538-K541 PolarHBondContact O-N 2.82Å; K541-V544 PolarHBondContact O-N 3.34Å; K541-D545 PolarHBondContact O-N 3.15Å; K541-D545 VanDerWaalsContact O-N 3.1Å; K541-I610 HydrophobicContact CG-CD1 4.15Å; K541-L613 HydrophobicContact CD-CD1 4.11Å
542	L	91.8	Very high	91.5	Very high	23 Å²	23	48.1 Å²	48.1	12%	0.12	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-39.7	177.9	-177.5	61.1	0	0	0	112	T67 V527 P533 Q538 S539 M540 V544 D545 V546	T67-L542 HydrophobicContact CG2-CD1 4.11Å; V527-L542 HydrophobicContact CG1-CD1 3.91Å; P533-L542 HydrophobicContact CG-CD2 3.81Å; Q538-L542 WeakPolarHBondContact O-CB 3.23Å; Q538-L542 PolarHBondContact O-N 3.35Å; S539-L542 PolarHBondContact O-N 3.39Å; M540-L542 VanDerWaalsContact C-N 3.32Å; M540-L542 PolarHBondContact O-N 3.08Å; L542-V544 PolarHBondContact O-N 3.16Å; L542-D545 PolarHBondContact O-N 2.94Å; L542-V546 HydrophobicContact CD1-CG2 4.23Å; L542-V546 HydrophobicContact CG-CG2 4.39Å; L542-V546 WeakPolarHBondContact O-CB 3.48Å; L542-V546 VanDerWaalsContact O-CG2 3.3Å; L542-V546 WeakPolarHBondContact O-CG2 3.49Å; L542-V546 PolarHBondContact O-N 3.28Å
543	G	91.8	Very high	92.1	Very high	35 Å²	35	43.2 Å²	43.2	36%	0.361	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-41.4	175.2	0	0	0	0	0	113.2	S539 M540 N547	S539-G543 PolarHBondContact O-N 3.04Å; M540-G543 PolarHBondContact O-N 3.05Å; M540-G543 VanDerWaalsContact O-N 3.14Å; G543-N547 PolarHBondContact O-N 2.88Å; G543-N547 VanDerWaalsContact O-N 3.16Å; G543-N547 PolarHBondContact O-ND2 2.94Å
544	V	92.1	Very high	92.6	Very high	24 Å²	24	41.6 Å²	41.6	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-48.2	174.1	170.4	0	0	0	0	111.1	M540 K541 L542 N547 R548 I610	M540-V544 WeakPolarHBondContact O-CG2 3.44Å; M540-V544 PolarHBondContact O-N 3.48Å; K541-V544 PolarHBondContact O-N 3.34Å; L542-V544 PolarHBondContact O-N 3.16Å; V544-N547 PolarHBondContact O-N 2.95Å; V544-R548 WeakPolarHBondContact O-CB 3.37Å; V544-R548 PolarHBondContact O-N 2.84Å; V544-I610 HydrophobicContact CB-CD1 4.43Å; V544-I610 HydrophobicContact CG1-CD1 4.03Å; V544-I610 HydrophobicContact CG1-CG1 3.95Å
545	D	93	Very high	93.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-69.7	-35.1	-179.3	-160.1	23.3	0	0	0	112.8	S65 Y66 V527 K541 L542 N547 R548 H549	S65-D545 WeakPolarHBondContact CA-OD2 3.22Å; S65-D545 WeakPolarHBondContact CB-OD2 3.5Å; S65-D545 PolarHBondContact OG-OD1 3.4Å; S65-D545 PolarHBondContact OG-OD2 2.91Å; Y66-D545 HydrophobicContact CD2-CB 3.8Å; Y66-D545 PolarHBondContact N-OD2 3.16Å; V527-D545 HydrophobicContact CG1-CB 4.21Å; K541-D545 PolarHBondContact O-N 3.15Å; K541-D545 VanDerWaalsContact O-N 3.1Å; L542-D545 PolarHBondContact O-N 2.94Å; D545-N547 VanDerWaalsContact C-N 3.31Å; D545-N547 PolarHBondContact O-N 3.45Å; D545-R548 WeakPolarHBondContact O-CB 3.23Å; D545-R548 PolarHBondContact O-N 2.81Å; D545-R548 IonicContact OD1-NH1 3.78Å; D545-R548 PolarHBondContact OD1-NH1 3.24Å; D545-H549 WeakPolarHBondContact O-CB 3.42Å; D545-H549 PolarHBondContact O-N 3.48Å
546	V	93.5	Very high	93.4	Very high	27 Å²	27	32.1 Å²	32.1	16%	0.164	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-38.8	173.1	162.4	0	0	0	0	111.5	L524 V527 L542 K550	L524-V546 HydrophobicContact CD1-CG1 3.8Å; L524-V546 HydrophobicContact CD1-CG2 4.4Å; L524-V546 HydrophobicContact CD2-CG1 3.96Å; V527-V546 HydrophobicContact CG1-CG2 3.99Å; L542-V546 HydrophobicContact CD1-CG2 4.23Å; L542-V546 HydrophobicContact CG-CG2 4.39Å; L542-V546 WeakPolarHBondContact O-CB 3.48Å; L542-V546 VanDerWaalsContact O-CG2 3.3Å; L542-V546 WeakPolarHBondContact O-CG2 3.49Å; L542-V546 PolarHBondContact O-N 3.28Å; V546-K550 WeakPolarHBondContact O-CG 3.08Å; V546-K550 PolarHBondContact O-N 3.06Å
547	N	93.8	Very high	93.9	Very high	78 Å²	78	26.6 Å²	26.6	42%	0.417	15%	0.147	S	C	.	.	H	α-helix	trans	-69.4	-48.8	173.1	-71.5	-24.8	0	0	0	111.3	G543 V544 D545 H549 K550 E551 N608	G543-N547 PolarHBondContact O-N 2.88Å; G543-N547 VanDerWaalsContact O-N 3.16Å; G543-N547 PolarHBondContact O-ND2 2.94Å; V544-N547 PolarHBondContact O-N 2.95Å; D545-N547 VanDerWaalsContact C-N 3.31Å; D545-N547 PolarHBondContact O-N 3.45Å; N547-H549 VanDerWaalsContact C-N 3.29Å; N547-H549 PolarHBondContact O-N 3.46Å; N547-K550 WeakPolarHBondContact O-CB 3.49Å; N547-K550 PolarHBondContact O-N 2.94Å; N547-E551 WeakPolarHBondContact O-CG 3.49Å; N547-E551 PolarHBondContact O-N 3.23Å; N547-N608 HydrophobicContact CB-CB 4.12Å; N547-N608 VanDerWaalsContact CB-CG 3.43Å; N547-N608 WeakPolarHBondContact CB-OD1 3.4Å; N547-N608 PolarHBondContact ND2-OD1 3.05Å
548	R	94.6	Very high	94.5	Very high	1 Å²	1	23.7 Å²	23.7	0%	0.004	13%	0.132	C	C	.	.	H	α-helix	trans	-51.8	-46.8	176.6	-174.3	176	168.5	-88.4	-0.1	111.9	S61 Y64 Y66 V544 D545 K550 E551 I552 N608	S61-R548 PolarHBondContact O-NH2 3.49Å; S61-R548 PolarHBondContact OG-NH2 3.1Å; Y64-R548 PolarHBondContact O-NH1 3.04Å; Y66-R548 WeakPolarHBondContact OH-CD 3.5Å; Y66-R548 PolarHBondContact OH-NE 3.16Å; Y66-R548 VanDerWaalsContact OH-NE 3.1Å; V544-R548 WeakPolarHBondContact O-CB 3.37Å; V544-R548 PolarHBondContact O-N 2.84Å; D545-R548 WeakPolarHBondContact O-CB 3.23Å; D545-R548 PolarHBondContact O-N 2.81Å; D545-R548 IonicContact OD1-NH1 3.78Å; D545-R548 PolarHBondContact OD1-NH1 3.24Å; R548-K550 VanDerWaalsContact C-N 3.33Å; R548-K550 PolarHBondContact O-N 2.91Å; R548-E551 WeakPolarHBondContact O-CB 3.33Å; R548-E551 PolarHBondContact O-N 3.35Å; R548-E551 VanDerWaalsContact O-N 3.13Å; R548-I552 HydrophobicContact CG-CD1 3.97Å; R548-I552 WeakPolarHBondContact O-CD1 3.29Å; R548-I552 VanDerWaalsContact O-CG1 3.27Å; R548-I552 WeakPolarHBondContact O-CG1 3.49Å; R548-I552 PolarHBondContact O-N 3.35Å; R548-N608 HydrophobicContact CB-CB 4.29Å; R548-N608 VanDerWaalsContact CB-O 3.25Å; R548-N608 WeakPolarHBondContact CB-O 3.1Å; R548-N608 WeakPolarHBondContact CD-O 3.36Å; R548-N608 VanDerWaalsContact CG-O 3.24Å; R548-N608 WeakPolarHBondContact CG-O 3.48Å
549	H	95.4	Very high	95	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-42.1	176.7	-171	99.6	0	0	0	112.5	K262 I523 D526 V527 D545 N547 I552 I553	K262-H549 WeakPolarHBondContact CB-CE1 3.47Å; I523-H549 PolarHBondContact O-NE2 2.88Å; D526-H549 IonicContact OD2-CE1 3.84Å; V527-H549 HydrophobicContact CG2-CB 3.69Å; V527-H549 WeakPolarHBondContact CG2-ND1 3.48Å; D545-H549 WeakPolarHBondContact O-CB 3.42Å; D545-H549 PolarHBondContact O-N 3.48Å; N547-H549 VanDerWaalsContact C-N 3.29Å; N547-H549 PolarHBondContact O-N 3.46Å; H549-I552 PolarHBondContact O-N 3.08Å; H549-I553 WeakPolarHBondContact NE2-CD1 3.48Å; H549-I553 WeakPolarHBondContact O-CG1 3.34Å; H549-I553 PolarHBondContact O-N 3.11Å
550	K	95.4	Very high	95.3	Very high	41 Å²	41	16.8 Å²	16.8	18%	0.178	9%	0.094	C	C	.	.	H	α-helix	trans	-64.5	-42.1	174	-70.7	-174.4	179.6	-155.2	0	112	A509 A510 I523 V546 N547 R548 I552 I553 V554	A509-K550 PolarHBondContact O-NZ 3.31Å; A510-K550 HydrophobicContact CB-CB 4.32Å; A510-K550 HydrophobicContact CB-CG 4.44Å; I523-K550 HydrophobicContact CD1-CG 4.06Å; V546-K550 WeakPolarHBondContact O-CG 3.08Å; V546-K550 PolarHBondContact O-N 3.06Å; N547-K550 WeakPolarHBondContact O-CB 3.49Å; N547-K550 PolarHBondContact O-N 2.94Å; R548-K550 VanDerWaalsContact C-N 3.33Å; R548-K550 PolarHBondContact O-N 2.91Å; K550-I552 VanDerWaalsContact C-N 3.34Å; K550-I552 PolarHBondContact O-N 3.26Å; K550-I553 PolarHBondContact O-N 3.36Å; K550-V554 VanDerWaalsContact O-CG2 3.26Å; K550-V554 WeakPolarHBondContact O-CG2 3.19Å; K550-V554 PolarHBondContact O-N 3.18Å
551	E	95.8	Very high	95.7	Very high	7 Å²	7	14.1 Å²	14.1	3%	0.033	8%	0.081	C	C	.	.	H	α-helix	trans	-59.5	-43.6	175.5	-61	-178.5	165.3	0	0	112.2	N547 R548 V554 K555 N608 C640 R642 N643	N547-E551 WeakPolarHBondContact O-CG 3.49Å; N547-E551 PolarHBondContact O-N 3.23Å; R548-E551 WeakPolarHBondContact O-CB 3.33Å; R548-E551 PolarHBondContact O-N 3.35Å; R548-E551 VanDerWaalsContact O-N 3.13Å; E551-V554 PolarHBondContact O-N 3.35Å; E551-K555 WeakPolarHBondContact O-CB 3.27Å; E551-K555 PolarHBondContact O-N 2.88Å; E551-N608 PolarHBondContact OE1-ND2 3.15Å; E551-C640 PolarHBondContact OE2-SG 2.9Å; E551-R642 HydrophobicContact CB-CB 4.36Å; E551-R642 IonicContact OE2-CZ 2.66Å; E551-R642 VanDerWaalsContact OE2-CZ 3.27Å; E551-R642 IonicContact OE2-NE 2.66Å; E551-R642 PolarHBondContact OE2-NE 2.91Å; E551-R642 IonicContact OE2-NH2 3.41Å; E551-R642 PolarHBondContact OE2-NH2 3.29Å; E551-N643 WeakPolarHBondContact CB-OD1 3.45Å; E551-N643 VanDerWaalsContact CD-ND2 3.29Å; E551-N643 VanDerWaalsContact CD-OD1 3.22Å; E551-N643 WeakPolarHBondContact CG-OD1 3.39Å; E551-N643 PolarHBondContact OE1-ND2 3.4Å
552	I	97.4	Very high	96.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-65	-43.3	179.3	-63	161.7	0	0	0	111	E62 K262 L266 R548 H549 K550 V554 K555 A556	E62-I552 HydrophobicContact CB-CD1 3.79Å; E62-I552 HydrophobicContact CB-CG1 4.01Å; E62-I552 HydrophobicContact CB-CG2 4.19Å; E62-I552 HydrophobicContact CG-CD1 3.78Å; E62-I552 HydrophobicContact CG-CG1 3.73Å; K262-I552 HydrophobicContact CD-CB 4.39Å; K262-I552 HydrophobicContact CD-CD1 4.15Å; K262-I552 HydrophobicContact CD-CG2 4.02Å; K262-I552 HydrophobicContact CG-CB 4.46Å; K262-I552 HydrophobicContact CG-CG2 3.8Å; L266-I552 HydrophobicContact CD1-CG2 4Å; L266-I552 HydrophobicContact CD2-CG2 3.91Å; L266-I552 HydrophobicContact CG-CG2 4.08Å; R548-I552 HydrophobicContact CG-CD1 3.97Å; R548-I552 WeakPolarHBondContact O-CD1 3.29Å; R548-I552 VanDerWaalsContact O-CG1 3.27Å; R548-I552 WeakPolarHBondContact O-CG1 3.49Å; R548-I552 PolarHBondContact O-N 3.35Å; H549-I552 PolarHBondContact O-N 3.08Å; K550-I552 VanDerWaalsContact C-N 3.34Å; K550-I552 PolarHBondContact O-N 3.26Å; I552-V554 PolarHBondContact O-N 2.89Å; I552-K555 WeakPolarHBondContact O-CB 3.36Å; I552-K555 PolarHBondContact O-N 2.84Å; I552-A556 PolarHBondContact O-N 3.47Å
553	I	97.7	Very high	96.4	Very high	1 Å²	1	10.4 Å²	10.4	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-61.5	-42.9	174.6	-76.4	-179.7	0	0	0	111.5	K262 L265 I506 A510 I523 H549 K550 I557	K262-I553 HydrophobicContact CB-CD1 4.47Å; K262-I553 HydrophobicContact CB-CG1 4.23Å; L265-I553 HydrophobicContact CD1-CG1 4.31Å; L265-I553 HydrophobicContact CD1-CG2 4.09Å; I506-I553 HydrophobicContact CG2-CG2 3.51Å; A510-I553 HydrophobicContact CB-CB 4.16Å; A510-I553 HydrophobicContact CB-CG2 3.59Å; I523-I553 HydrophobicContact CB-CD1 4.41Å; I523-I553 HydrophobicContact CD1-CD1 4.44Å; H549-I553 WeakPolarHBondContact NE2-CD1 3.48Å; H549-I553 WeakPolarHBondContact O-CG1 3.34Å; H549-I553 PolarHBondContact O-N 3.11Å; K550-I553 PolarHBondContact O-N 3.36Å; I553-I557 HydrophobicContact CG2-CD1 3.67Å; I553-I557 HydrophobicContact CG2-CG1 4.48Å; I553-I557 VanDerWaalsContact O-CG1 3.3Å; I553-I557 WeakPolarHBondContact O-CG1 3.2Å; I553-I557 PolarHBondContact O-N 3.34Å
554	V	97.8	Very high	96.7	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-64	-42.8	175.8	176.9	0	0	0	0	110.7	L507 A510 K550 E551 I552 S558 F595 L650	L507-V554 HydrophobicContact CD1-CB 4.33Å; L507-V554 HydrophobicContact CD1-CG1 4.03Å; L507-V554 HydrophobicContact CD1-CG2 4.1Å; A510-V554 HydrophobicContact CB-CG2 3.84Å; K550-V554 VanDerWaalsContact O-CG2 3.26Å; K550-V554 WeakPolarHBondContact O-CG2 3.19Å; K550-V554 PolarHBondContact O-N 3.18Å; E551-V554 PolarHBondContact O-N 3.35Å; I552-V554 PolarHBondContact O-N 2.89Å; V554-S558 WeakPolarHBondContact O-CB 3.41Å; V554-S558 PolarHBondContact O-N 3.37Å; V554-S558 PolarHBondContact O-OG 3.05Å; V554-S558 VanDerWaalsContact O-OG 3.1Å; V554-F595 HydrophobicContact CG1-CE2 3.77Å; V554-F595 HydrophobicContact CG1-CZ 3.84Å; V554-F595 HydrophobicContact CG2-CE2 4.17Å; V554-L650 HydrophobicContact CG1-CD1 4.41Å
555	K	97.5	Very high	97	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-54.7	-58.3	174.4	163.6	172.2	167.2	-175.1	0	110.7	E59 E62 W269 E551 I552 S558 A559 W641 R642 F645 S646	E59-K555 WeakPolarHBondContact OE1-CE 3.34Å; E59-K555 IonicContact OE1-NZ 3.72Å; E59-K555 PolarHBondContact OE1-NZ 3.3Å; E59-K555 IonicContact OE2-NZ 3.43Å; E62-K555 IonicContact OE1-NZ 2.67Å; E62-K555 PolarHBondContact OE1-NZ 3.02Å; E62-K555 VanDerWaalsContact OE2-CD 3.3Å; E62-K555 WeakPolarHBondContact OE2-CD 3.35Å; E62-K555 WeakPolarHBondContact OE2-CE 3.14Å; E62-K555 IonicContact OE2-NZ 2.61Å; E62-K555 PolarHBondContact OE2-NZ 3.28Å; W269-K555 HydrophobicContact CH2-CD 4.44Å; W269-K555 HydrophobicContact CH2-CG 4.25Å; W269-K555 HydrophobicContact CZ3-CD 4.4Å; W269-K555 VanDerWaalsContact CZ3-CE 3.46Å; W269-K555 HydrophobicContact CZ3-CG 4.18Å; E551-K555 WeakPolarHBondContact O-CB 3.27Å; E551-K555 PolarHBondContact O-N 2.88Å; I552-K555 WeakPolarHBondContact O-CB 3.36Å; I552-K555 PolarHBondContact O-N 2.84Å; K555-S558 PolarHBondContact O-N 3.14Å; K555-S558 PolarHBondContact O-OG 2.92Å; K555-A559 PolarHBondContact O-N 3.43Å; K555-A559 VanDerWaalsContact O-N 3.08Å; K555-W641 HydrophobicContact CD-CE3 4.49Å; K555-W641 HydrophobicContact CD-CZ3 4.06Å; K555-R642 HydrophobicContact CB-CB 4.49Å; K555-R642 HydrophobicContact CD-CB 4.21Å; K555-R642 HydrophobicContact CD-CG 3.83Å; K555-F645 HydrophobicContact CB-CD1 4.46Å; K555-F645 HydrophobicContact CD-CD1 4.46Å; K555-F645 HydrophobicContact CG-CD1 3.87Å; K555-F645 HydrophobicContact CG-CE1 3.87Å; K555-S646 VanDerWaalsContact CA-OG 3.29Å; K555-S646 WeakPolarHBondContact CA-OG 3.22Å; K555-S646 PolarHBondContact N-OG 3.49Å
556	A	98.5	Very high	97.3	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-59.1	-51.5	-177.8	0	0	0	0	0	112.8	L265 W269 I552 S558 A559 I560	L265-A556 HydrophobicContact CB-CB 4.05Å; W269-A556 HydrophobicContact CE3-CB 4.33Å; I552-A556 PolarHBondContact O-N 3.47Å; A556-S558 VanDerWaalsContact C-N 3.34Å; A556-S558 PolarHBondContact O-N 3.07Å; A556-A559 PolarHBondContact O-N 3.41Å; A556-A559 VanDerWaalsContact O-N 3.15Å; A556-I560 WeakPolarHBondContact O-CG1 3.43Å; A556-I560 PolarHBondContact O-N 2.82Å
557	I	98.6	Very high	97.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.1	-41.2	-178.8	-63.1	169.9	0	0	0	111.2	L265 L503 I506 L507 I553 A559 L561	L265-I557 HydrophobicContact CD1-CD1 3.85Å; L265-I557 HydrophobicContact CD1-CG1 3.82Å; L265-I557 HydrophobicContact CD2-CG1 4.02Å; L265-I557 HydrophobicContact CG-CG1 4.5Å; L503-I557 HydrophobicContact CB-CG2 4.11Å; L503-I557 HydrophobicContact CD2-CG1 4.18Å; L503-I557 HydrophobicContact CD2-CG2 4.34Å; I506-I557 HydrophobicContact CB-CD1 3.79Å; I506-I557 HydrophobicContact CG2-CD1 3.63Å; L507-I557 HydrophobicContact CB-CD1 4.19Å; L507-I557 HydrophobicContact CB-CG2 4.22Å; L507-I557 HydrophobicContact CD1-CG2 4.47Å; L507-I557 HydrophobicContact CD2-CG2 4.38Å; I553-I557 HydrophobicContact CG2-CD1 3.67Å; I553-I557 HydrophobicContact CG2-CG1 4.48Å; I553-I557 VanDerWaalsContact O-CG1 3.3Å; I553-I557 WeakPolarHBondContact O-CG1 3.2Å; I553-I557 PolarHBondContact O-N 3.34Å; I557-A559 VanDerWaalsContact C-N 3.25Å; I557-A559 PolarHBondContact O-N 2.92Å; I557-L561 HydrophobicContact CG2-CD1 3.87Å; I557-L561 HydrophobicContact CG2-CG 4.24Å; I557-L561 WeakPolarHBondContact O-CB 3.42Å; I557-L561 WeakPolarHBondContact O-CG 3.43Å; I557-L561 PolarHBondContact O-N 2.58Å
558	S	98.6	Very high	97.7	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-64.9	-30.8	178.8	78.7	0	0	0	0	112.5	V554 K555 A556 L562 N649	V554-S558 WeakPolarHBondContact O-CB 3.41Å; V554-S558 PolarHBondContact O-N 3.37Å; V554-S558 PolarHBondContact O-OG 3.05Å; V554-S558 VanDerWaalsContact O-OG 3.1Å; K555-S558 PolarHBondContact O-N 3.14Å; K555-S558 PolarHBondContact O-OG 2.92Å; A556-S558 VanDerWaalsContact C-N 3.34Å; A556-S558 PolarHBondContact O-N 3.07Å; S558-L562 VanDerWaalsContact O-CB 3.27Å; S558-L562 WeakPolarHBondContact O-CB 3.47Å; S558-L562 PolarHBondContact O-N 2.81Å; S558-N649 WeakPolarHBondContact OG-CB 3.35Å; S558-N649 PolarHBondContact OG-ND2 2.98Å
559	A	98.4	Very high	97.8	Very high	2 Å²	2	7.2 Å²	7.2	2%	0.017	3%	0.032	C	C	.	.	H	α-helix	trans	-77.7	-48.3	176.6	0	0	0	0	0	112.1	W269 K555 A556 I557 L561 L562 L563 F645	W269-A559 HydrophobicContact CD2-CB 4.02Å; W269-A559 VanDerWaalsContact CE2-CB 3.45Å; W269-A559 HydrophobicContact CG-CB 4.14Å; W269-A559 HydrophobicContact CZ2-CB 3.93Å; W269-A559 VanDerWaalsContact NE1-CB 3.25Å; K555-A559 PolarHBondContact O-N 3.43Å; K555-A559 VanDerWaalsContact O-N 3.08Å; A556-A559 PolarHBondContact O-N 3.41Å; A556-A559 VanDerWaalsContact O-N 3.15Å; I557-A559 VanDerWaalsContact C-N 3.25Å; I557-A559 PolarHBondContact O-N 2.92Å; A559-L561 PolarHBondContact O-N 2.63Å; A559-L562 PolarHBondContact O-N 2.65Å; A559-L562 VanDerWaalsContact O-N 3.1Å; A559-L563 WeakPolarHBondContact O-CB 3.37Å; A559-L563 WeakPolarHBondContact O-CG 3.16Å; A559-L563 PolarHBondContact O-N 2.89Å; A559-F645 HydrophobicContact CB-CE1 4Å; A559-F645 HydrophobicContact CB-CZ 4.01Å
560	I	98.8	Very high	97.9	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-51.2	-54.7	174.8	-68.5	161.4	0	0	0	110.5	F245 L265 L268 W269 I272 L503 A556 L562 L563 L564	F245-I560 HydrophobicContact CZ-CG2 4Å; L265-I560 HydrophobicContact CD2-CD1 4.18Å; L268-I560 HydrophobicContact CB-CD1 4.34Å; L268-I560 HydrophobicContact CD2-CD1 4.02Å; L268-I560 HydrophobicContact CG-CD1 3.98Å; W269-I560 HydrophobicContact CB-CD1 4.05Å; W269-I560 HydrophobicContact CB-CG1 3.73Å; W269-I560 HydrophobicContact CG-CG1 4.33Å; I272-I560 HydrophobicContact CD1-CG2 4.02Å; L503-I560 HydrophobicContact CD1-CG2 4.09Å; A556-I560 WeakPolarHBondContact O-CG1 3.43Å; A556-I560 PolarHBondContact O-N 2.82Å; I560-L562 VanDerWaalsContact C-N 3.27Å; I560-L562 PolarHBondContact O-N 3.25Å; I560-L563 PolarHBondContact O-N 2.87Å; I560-L564 HydrophobicContact CG2-CD1 4.05Å; I560-L564 WeakPolarHBondContact O-CG 3.41Å; I560-L564 PolarHBondContact O-N 3.23Å
561	L	98.8	Very high	97.9	Very high	1 Å²	1	6.7 Å²	6.7	1%	0.005	3%	0.031	C	C	.	.	H	α-helix	trans	-61.3	-36.1	-179.1	-70.8	179.1	0	0	0	112.3	M500 L503 L504 I557 A559 L565 M579 L583 I653	M500-L561 HydrophobicContact CE-CD2 4.27Å; M500-L561 HydrophobicContact SD-CD2 3.76Å; L503-L561 HydrophobicContact CD1-CD2 3.55Å; L503-L561 HydrophobicContact CD1-CG 4.06Å; L504-L561 HydrophobicContact CD2-CD1 4.34Å; I557-L561 HydrophobicContact CG2-CD1 3.87Å; I557-L561 HydrophobicContact CG2-CG 4.24Å; I557-L561 WeakPolarHBondContact O-CB 3.42Å; I557-L561 WeakPolarHBondContact O-CG 3.43Å; I557-L561 PolarHBondContact O-N 2.58Å; A559-L561 PolarHBondContact O-N 2.63Å; L561-L565 VanDerWaalsContact O-CB 3.23Å; L561-L565 WeakPolarHBondContact O-CB 3.49Å; L561-L565 WeakPolarHBondContact O-CD1 3.49Å; L561-L565 WeakPolarHBondContact O-CG 3.08Å; L561-L565 PolarHBondContact O-N 3.24Å; L561-L565 VanDerWaalsContact O-N 3.13Å; L561-M579 HydrophobicContact CD2-CE 3.79Å; L561-L583 HydrophobicContact CD1-CD2 4.41Å; L561-L583 HydrophobicContact CD2-CD1 4.38Å; L561-L583 HydrophobicContact CD2-CD2 3.89Å; L561-I653 HydrophobicContact CB-CD1 3.64Å; L561-I653 HydrophobicContact CB-CG1 4.4Å; L561-I653 HydrophobicContact CD1-CD1 4.44Å
562	L	98.6	Very high	97.9	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-76.4	-36.2	-179.8	-178.6	59.8	0	0	0	113.3	F279 S558 A559 I560 K566 N649 R652 I653 K656	F279-L562 HydrophobicContact CZ-CD2 3.98Å; F279-L562 HydrophobicContact CZ-CG 4.23Å; S558-L562 VanDerWaalsContact O-CB 3.27Å; S558-L562 WeakPolarHBondContact O-CB 3.47Å; S558-L562 PolarHBondContact O-N 2.81Å; A559-L562 PolarHBondContact O-N 2.65Å; A559-L562 VanDerWaalsContact O-N 3.1Å; I560-L562 VanDerWaalsContact C-N 3.27Å; I560-L562 PolarHBondContact O-N 3.25Å; L562-K566 HydrophobicContact CG-CD 4.42Å; L562-K566 VanDerWaalsContact O-CB 3.3Å; L562-K566 WeakPolarHBondContact O-CB 3.19Å; L562-K566 VanDerWaalsContact O-CG 3.27Å; L562-K566 WeakPolarHBondContact O-CG 3.38Å; L562-K566 PolarHBondContact O-N 3.28Å; L562-N649 HydrophobicContact CD2-CB 4.26Å; L562-N649 WeakPolarHBondContact CD2-OD1 3.16Å; L562-R652 HydrophobicContact CD1-CB 3.7Å; L562-R652 HydrophobicContact CD2-CB 3.89Å; L562-R652 HydrophobicContact CD2-CG 4.46Å; L562-R652 HydrophobicContact CG-CB 4.49Å; L562-I653 HydrophobicContact CB-CD1 4.31Å; L562-I653 HydrophobicContact CB-CG1 4.09Å; L562-I653 HydrophobicContact CD1-CG1 4.31Å; L562-K656 HydrophobicContact CD1-CD 3.86Å
563	L	98.3	Very high	97.9	Very high	1 Å²	1	7 Å²	7	1%	0.005	3%	0.033	C	C	.	.	H	α-helix	trans	-65.4	-52.3	175.1	-79	160.7	0	0	0	110.4	I272 L273 F279 A559 I560 L565 K566 H567	I272-L563 HydrophobicContact CG2-CB 4.17Å; I272-L563 HydrophobicContact CG2-CD1 4.41Å; L273-L563 HydrophobicContact CB-CD1 4.22Å; L273-L563 HydrophobicContact CD1-CD1 4.19Å; L273-L563 HydrophobicContact CD1-CD2 4.05Å; F279-L563 HydrophobicContact CD1-CD2 4.04Å; F279-L563 HydrophobicContact CE1-CD2 3.5Å; F279-L563 HydrophobicContact CE1-CG 4Å; F279-L563 HydrophobicContact CZ-CD2 4.28Å; F279-L563 HydrophobicContact CZ-CG 4.44Å; A559-L563 WeakPolarHBondContact O-CB 3.37Å; A559-L563 WeakPolarHBondContact O-CG 3.16Å; A559-L563 PolarHBondContact O-N 2.89Å; I560-L563 PolarHBondContact O-N 2.87Å; L563-L565 PolarHBondContact O-N 3Å; L563-K566 CarbonylContact O-C 3.58Å; L563-K566 WeakPolarHBondContact O-CA 3.49Å; L563-K566 VanDerWaalsContact O-CB 3.28Å; L563-K566 WeakPolarHBondContact O-CB 3.33Å; L563-K566 PolarHBondContact O-N 3.34Å; L563-H567 PolarHBondContact O-CD2 2.96Å; L563-H567 PolarHBondContact O-N 2.76Å
564	L	98.6	Very high	97.9	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-61.7	-48	178.6	-65.6	-178	0	0	0	112.1	F245 I272 L276 L488 I560 K566 H567 F568 M579	F245-L564 HydrophobicContact CE2-CD1 4.18Å; F245-L564 HydrophobicContact CZ-CD1 3.75Å; I272-L564 HydrophobicContact CD1-CD1 4.4Å; I272-L564 HydrophobicContact CD1-CD2 4.24Å; I272-L564 HydrophobicContact CD1-CG 4.43Å; I272-L564 HydrophobicContact CG2-CD2 4.1Å; L276-L564 HydrophobicContact CD2-CD2 4.41Å; L488-L564 HydrophobicContact CD2-CD2 3.74Å; I560-L564 HydrophobicContact CG2-CD1 4.05Å; I560-L564 WeakPolarHBondContact O-CG 3.41Å; I560-L564 PolarHBondContact O-N 3.23Å; L564-K566 PolarHBondContact O-N 3.23Å; L564-H567 PolarHBondContact O-N 2.68Å; L564-F568 HydrophobicContact CB-CD2 4.1Å; L564-F568 HydrophobicContact CB-CE2 3.81Å; L564-F568 HydrophobicContact CB-CZ 4.42Å; L564-F568 HydrophobicContact CD1-CE2 4.39Å; L564-F568 HydrophobicContact CD2-CE1 4.4Å; L564-F568 HydrophobicContact CD2-CE2 4.03Å; L564-F568 HydrophobicContact CD2-CZ 3.77Å; L564-F568 HydrophobicContact CG-CE2 4.29Å; L564-F568 WeakPolarHBondContact O-CB 3.14Å; L564-F568 WeakPolarHBondContact O-CD2 3.42Å; L564-F568 WeakPolarHBondContact O-CG 3.4Å; L564-F568 PolarHBondContact O-N 2.81Å; L564-M579 HydrophobicContact CB-CE 3.59Å; L564-M579 HydrophobicContact CB-SD 3.73Å; L564-M579 HydrophobicContact CD1-CE 4.07Å; L564-M579 HydrophobicContact CG-CE 4.49Å
565	L	98.6	Very high	97.9	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-62.8	-12.1	174.4	-72.4	172.8	0	0	0	113.4	L561 L563 F576 M579 A580 L583 I653 K656 L657	L561-L565 VanDerWaalsContact O-CB 3.23Å; L561-L565 WeakPolarHBondContact O-CB 3.49Å; L561-L565 WeakPolarHBondContact O-CD1 3.49Å; L561-L565 WeakPolarHBondContact O-CG 3.08Å; L561-L565 PolarHBondContact O-N 3.24Å; L561-L565 VanDerWaalsContact O-N 3.13Å; L563-L565 PolarHBondContact O-N 3Å; L565-F576 HydrophobicContact CB-CD2 4.21Å; L565-F576 HydrophobicContact CB-CE2 4.22Å; L565-F576 HydrophobicContact CD2-CD2 3.75Å; L565-F576 HydrophobicContact CD2-CE2 3.75Å; L565-F576 WeakPolarHBondContact O-CD2 3.21Å; L565-M579 HydrophobicContact CB-SD 4.44Å; L565-M579 HydrophobicContact CD2-CB 4.25Å; L565-M579 HydrophobicContact CD2-CE 4.33Å; L565-M579 HydrophobicContact CD2-CG 4.01Å; L565-M579 HydrophobicContact CD2-SD 3.52Å; L565-M579 VanDerWaalsContact CD2-SD 3.52Å; L565-M579 HydrophobicContact CG-CE 3.97Å; L565-M579 HydrophobicContact CG-SD 3.66Å; L565-A580 HydrophobicContact CD2-CB 4.26Å; L565-L583 HydrophobicContact CD1-CD1 3.78Å; L565-L583 HydrophobicContact CD2-CD1 4.07Å; L565-L583 HydrophobicContact CG-CD1 4.18Å; L565-I653 HydrophobicContact CD1-CG1 4.31Å; L565-I653 HydrophobicContact CD1-CG2 3.96Å; L565-K656 HydrophobicContact CB-CD 4.02Å; L565-K656 PolarHBondContact O-NZ 2.67Å; L565-L657 HydrophobicContact CD1-CD2 4.44Å
566	K	97.8	Very high	98	Very high	32 Å²	32	7.9 Å²	7.9	14%	0.139	4%	0.036	C	C	.	.	H	α-helix	trans	-92.8	-56.1	174.1	-91.2	177.2	171.7	-171.2	0	111.4	F279 L282 L562 L563 L564 K569 L570	F279-K566 HydrophobicContact CD1-CD 3.58Å; F279-K566 HydrophobicContact CE1-CD 3.42Å; F279-K566 VanDerWaalsContact CE1-CD 3.42Å; F279-K566 HydrophobicContact CZ-CD 4.34Å; L282-K566 HydrophobicContact CD2-CB 3.63Å; L282-K566 HydrophobicContact CD2-CD 3.73Å; L282-K566 HydrophobicContact CD2-CG 3.98Å; L562-K566 HydrophobicContact CG-CD 4.42Å; L562-K566 VanDerWaalsContact O-CB 3.3Å; L562-K566 WeakPolarHBondContact O-CB 3.19Å; L562-K566 VanDerWaalsContact O-CG 3.27Å; L562-K566 WeakPolarHBondContact O-CG 3.38Å; L562-K566 PolarHBondContact O-N 3.28Å; L563-K566 CarbonylContact O-C 3.58Å; L563-K566 WeakPolarHBondContact O-CA 3.49Å; L563-K566 VanDerWaalsContact O-CB 3.28Å; L563-K566 WeakPolarHBondContact O-CB 3.33Å; L563-K566 PolarHBondContact O-N 3.34Å; L564-K566 PolarHBondContact O-N 3.23Å; K566-K569 PolarHBondContact O-N 3.22Å; K566-K569 VanDerWaalsContact O-N 3.13Å; K566-L570 PolarHBondContact O-N 3Å
567	H	98.1	Very high	97.9	Very high	5 Å²	5	8.6 Å²	8.6	2%	0.023	4%	0.039	C	C	.	.	H	α-helix	trans	-63	-51.5	-176.5	-76.1	-58.1	0	0	0	111.6	L276 G277 T485 L563 L564 K569 L570 N571	L276-H567 HydrophobicContact CD2-CB 3.79Å; L276-H567 PolarHBondContact O-CE1 3.31Å; L276-H567 PolarHBondContact O-NE2 2.89Å; G277-H567 PolarHBondContact O-CE1 2.67Å; G277-H567 PolarHBondContact O-NE2 3.14Å; T485-H567 HydrophobicContact CG2-CB 3.92Å; L563-H567 PolarHBondContact O-CD2 2.96Å; L563-H567 PolarHBondContact O-N 2.76Å; L564-H567 PolarHBondContact O-N 2.68Å; H567-K569 PolarHBondContact O-N 3.36Å; H567-K569 VanDerWaalsContact O-N 3.1Å; H567-L570 PolarHBondContact O-N 3.12Å; H567-N571 WeakPolarHBondContact O-CB 3.21Å; H567-N571 PolarHBondContact O-N 2.85Å
568	F	98.3	Very high	97.9	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-55.6	-33	173.4	-62.6	-27.8	0	0	0	112.2	T485 Y489 I492 L564 L570 N571 H572 Q575 F576 M579	T485-F568 HydrophobicContact CG2-CD1 3.66Å; T485-F568 HydrophobicContact CG2-CE1 4.08Å; Y489-F568 AromaticContact CD2-CD1 3.98Å; Y489-F568 HydrophobicContact CD2-CD1 3.98Å; Y489-F568 HydrophobicContact CD2-CD2 4.22Å; Y489-F568 AromaticContact CD2-CE1 3.9Å; Y489-F568 HydrophobicContact CD2-CE1 3.9Å; Y489-F568 HydrophobicContact CD2-CE2 4.12Å; Y489-F568 HydrophobicContact CD2-CG 4.17Å; Y489-F568 AromaticContact CD2-CZ 3.96Å; Y489-F568 HydrophobicContact CD2-CZ 3.96Å; Y489-F568 HydrophobicContact CG-CD1 4.49Å; Y489-F568 HydrophobicContact CG-CE1 4.29Å; I492-F568 HydrophobicContact CD1-CE2 3.91Å; I492-F568 HydrophobicContact CD1-CZ 3.63Å; I492-F568 HydrophobicContact CG1-CZ 4.47Å; L564-F568 HydrophobicContact CB-CD2 4.1Å; L564-F568 HydrophobicContact CB-CE2 3.81Å; L564-F568 HydrophobicContact CB-CZ 4.42Å; L564-F568 HydrophobicContact CD1-CE2 4.39Å; L564-F568 HydrophobicContact CD2-CE1 4.4Å; L564-F568 HydrophobicContact CD2-CE2 4.03Å; L564-F568 HydrophobicContact CD2-CZ 3.77Å; L564-F568 HydrophobicContact CG-CE2 4.29Å; L564-F568 WeakPolarHBondContact O-CB 3.14Å; L564-F568 WeakPolarHBondContact O-CD2 3.42Å; L564-F568 WeakPolarHBondContact O-CG 3.4Å; L564-F568 PolarHBondContact O-N 2.81Å; F568-L570 PolarHBondContact O-N 3.42Å; F568-N571 PolarHBondContact O-N 3.1Å; F568-H572 CarbonylContact O-C 3.46Å; F568-H572 PolarHBondContact O-N 3.2Å; F568-Q575 HydrophobicContact CB-CB 3.85Å; F568-Q575 HydrophobicContact CG-CB 4.29Å; F568-F576 HydrophobicContact CB-CB 4.35Å; F568-M579 HydrophobicContact CD2-SD 3.84Å; F568-M579 HydrophobicContact CE2-SD 4.06Å
569	K	97.6	Very high	97.9	Very high	61 Å²	61	10.8 Å²	10.8	27%	0.265	5%	0.048	S	C	.	.	H	α-helix	trans	-75	-21.6	178.6	-161.7	167.1	-171.7	67	0	114.1	K566 H567 F576	K566-K569 PolarHBondContact O-N 3.22Å; K566-K569 VanDerWaalsContact O-N 3.13Å; H567-K569 PolarHBondContact O-N 3.36Å; H567-K569 VanDerWaalsContact O-N 3.1Å; K569-F576 HydrophobicContact CB-CB 3.62Å; K569-F576 HydrophobicContact CB-CD1 4.42Å; K569-F576 HydrophobicContact CB-CD2 3.84Å; K569-F576 HydrophobicContact CB-CG 3.67Å; K569-F576 HydrophobicContact CD-CB 4.48Å; K569-F576 HydrophobicContact CD-CD1 3.65Å; K569-F576 HydrophobicContact CD-CD2 3.9Å; K569-F576 HydrophobicContact CD-CE1 3.8Å; K569-F576 HydrophobicContact CD-CE2 4.01Å; K569-F576 HydrophobicContact CD-CG 3.71Å; K569-F576 HydrophobicContact CD-CZ 3.97Å; K569-F576 HydrophobicContact CG-CB 3.96Å; K569-F576 HydrophobicContact CG-CD1 3.97Å; K569-F576 HydrophobicContact CG-CD2 4.18Å; K569-F576 HydrophobicContact CG-CG 3.74Å
570	L	96.1	Very high	97.8	Very high	15 Å²	15	10.7 Å²	10.7	8%	0.079	5%	0.047	C	C	.	.	H	α-helix	trans	-87.5	-36.6	171.3	-177.6	61.9	0	0	0	111.1	L282 I285 K286 K289 Q461 K566 H567 F568	L282-L570 HydrophobicContact CD1-CB 4.07Å; L282-L570 HydrophobicContact CD1-CD2 3.51Å; L282-L570 HydrophobicContact CD1-CG 4.45Å; I285-L570 HydrophobicContact CB-CD2 4.05Å; I285-L570 HydrophobicContact CG2-CD2 3.75Å; K286-L570 HydrophobicContact CB-CD1 3.86Å; K286-L570 HydrophobicContact CB-CD2 3.8Å; K286-L570 HydrophobicContact CD-CD1 4.3Å; K286-L570 HydrophobicContact CG-CD1 3.81Å; K289-L570 HydrophobicContact CB-CD1 4.49Å; K289-L570 HydrophobicContact CD-CD1 4.37Å; K289-L570 HydrophobicContact CD-CG 4.41Å; Q461-L570 PolarHBondContact NE2-O 3.46Å; K566-L570 PolarHBondContact O-N 3Å; H567-L570 PolarHBondContact O-N 3.12Å; F568-L570 PolarHBondContact O-N 3.42Å
571	N	96	Very high	97.7	Very high	15 Å²	15	11 Å²	11	8%	0.08	5%	0.049	C	C	.	.	H	α-helix	trans	-67	-65.3	178.6	-168.6	37.9	0	0	0	110.9	K289 Q461 T485 E486 H567 F568 Q575	K289-N571 PolarHBondContact NZ-O 3.49Å; Q461-N571 PolarHBondContact NE2-O 2.93Å; T485-N571 HydrophobicContact CG2-CB 3.55Å; E486-N571 PolarHBondContact OE2-ND2 3.04Å; H567-N571 WeakPolarHBondContact O-CB 3.21Å; H567-N571 PolarHBondContact O-N 2.85Å; F568-N571 PolarHBondContact O-N 3.1Å; N571-Q575 PolarHBondContact ND2-NE2 3.36Å; N571-Q575 PolarHBondContact ND2-OE1 3.47Å
572	H	96.3	Very high	97.6	Very high	9 Å²	9	12.8 Å²	12.8	4%	0.042	6%	0.057	C	C	.	.			trans	-147.1	131.1	165.5	-161.7	-114.7	0	0	0	115.6	Q461 E465 F568 Y574 Q575 F576 F757	Q461-H572 WeakPolarHBondContact CB-NE2 3.38Å; E465-H572 IonicContact OE1-CE1 3.57Å; E465-H572 PolarHBondContact OE1-CE1 3.41Å; E465-H572 VanDerWaalsContact OE1-CE1 3.28Å; E465-H572 IonicContact OE1-NE2 2.92Å; F568-H572 CarbonylContact O-C 3.46Å; F568-H572 PolarHBondContact O-N 3.2Å; H572-Y574 VanDerWaalsContact C-N 3.25Å; H572-Y574 AromaticContact CE1-CD2 3.83Å; H572-Y574 PolarHBondContact O-N 2.87Å; H572-Q575 HydrophobicContact CB-CG 4Å; H572-Q575 VanDerWaalsContact O-CB 3.31Å; H572-Q575 WeakPolarHBondContact O-CB 3.24Å; H572-Q575 PolarHBondContact O-N 3.47Å; H572-F576 PolarHBondContact O-N 2.93Å; H572-F757 HydrophobicContact CB-CE2 4.46Å; H572-F757 HydrophobicContact CB-CZ 3.92Å; H572-F757 AromaticContact CE1-CD2 3.59Å; H572-F757 AromaticContact CE1-CE2 3.37Å; H572-F757 WeakPolarHBondContact CE1-CE2 3.11Å; H572-F757 AromaticContact CE1-CZ 3.89Å; H572-F757 AromaticContact CG-CE2 3.76Å; H572-F757 AromaticContact CG-CZ 3.65Å; H572-F757 AromaticContact ND1-CD2 3.56Å; H572-F757 AromaticContact ND1-CE1 3.63Å; H572-F757 AromaticContact ND1-CE2 3Å; H572-F757 WeakPolarHBondContact ND1-CE2 3.31Å; H572-F757 AromaticContact ND1-CZ 3.03Å; H572-F757 WeakPolarHBondContact ND1-CZ 3.44Å
573	V	97.2	Very high	97.5	Very high	4 Å²	4	12.8 Å²	12.8	2%	0.024	6%	0.057	C	C	.	.	H	α-helix	trans	-47.6	-39.8	-177.8	63.5	0	0	0	0	114.8	A458 Q461 M462 F576 E577	A458-V573 HydrophobicContact CB-CB 3.97Å; A458-V573 HydrophobicContact CB-CG2 3.74Å; Q461-V573 HydrophobicContact CB-CB 4.33Å; Q461-V573 HydrophobicContact CB-CG1 3.68Å; M462-V573 HydrophobicContact CG-CG1 4.02Å; M462-V573 HydrophobicContact CG-CG2 4.48Å; M462-V573 HydrophobicContact SD-CG2 4.43Å; V573-F576 WeakPolarHBondContact O-CB 2.97Å; V573-F576 PolarHBondContact O-N 3.48Å; V573-E577 PolarHBondContact O-N 2.69Å
574	Y	97.4	Very high	97.4	Very high	16 Å²	16	13.2 Å²	13.2	6%	0.063	6%	0.06	C	C	.	.	H	α-helix	trans	-78.7	-25.7	-179.9	-67.6	-41.4	0	0	0	114	E465 H572 F576 E577 Y578 L750 I754 F757	E465-Y574 HydrophobicContact CB-CE2 3.76Å; E465-Y574 HydrophobicContact CG-CD2 3.95Å; E465-Y574 HydrophobicContact CG-CE2 3.69Å; H572-Y574 VanDerWaalsContact C-N 3.25Å; H572-Y574 AromaticContact CE1-CD2 3.83Å; H572-Y574 PolarHBondContact O-N 2.87Å; Y574-F576 VanDerWaalsContact C-N 3.28Å; Y574-F576 PolarHBondContact O-N 2.95Å; Y574-E577 PolarHBondContact O-N 2.91Å; Y574-Y578 WeakPolarHBondContact O-CB 3.17Å; Y574-Y578 PolarHBondContact O-N 2.82Å; Y574-L750 HydrophobicContact CE1-CD1 4.22Å; Y574-I754 HydrophobicContact CD1-CG1 3.72Å; Y574-I754 HydrophobicContact CE1-CG1 4.49Å; Y574-I754 HydrophobicContact CG-CG1 4.13Å; Y574-F757 HydrophobicContact CD2-CB 3.73Å; Y574-F757 HydrophobicContact CD2-CD1 4.46Å; Y574-F757 HydrophobicContact CD2-CD2 4.42Å; Y574-F757 AromaticContact CD2-CG 3.95Å; Y574-F757 HydrophobicContact CD2-CG 3.95Å; Y574-F757 HydrophobicContact CG-CB 4.36Å; Y574-F757 HydrophobicContact CG-CD1 4.5Å; Y574-F757 HydrophobicContact CG-CG 4.42Å
575	Q	98.3	Very high	97.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-58.2	-45.1	167.3	-65.5	174.9	-16.4	0	0	110.3	E486 Y489 F568 N571 H572 M579 F757 Y762	E486-Q575 PolarHBondContact OE2-NE2 3.22Å; Y489-Q575 HydrophobicContact CD1-CG 3.77Å; Y489-Q575 HydrophobicContact CD2-CB 3.64Å; Y489-Q575 HydrophobicContact CD2-CG 3.73Å; Y489-Q575 HydrophobicContact CE1-CB 4.41Å; Y489-Q575 HydrophobicContact CE1-CG 3.73Å; Y489-Q575 HydrophobicContact CE2-CB 3.44Å; Y489-Q575 VanDerWaalsContact CE2-CB 3.44Å; Y489-Q575 HydrophobicContact CE2-CG 3.69Å; Y489-Q575 HydrophobicContact CG-CB 4.2Å; Y489-Q575 HydrophobicContact CG-CG 3.76Å; F568-Q575 HydrophobicContact CB-CB 3.85Å; F568-Q575 HydrophobicContact CG-CB 4.29Å; N571-Q575 PolarHBondContact ND2-NE2 3.36Å; N571-Q575 PolarHBondContact ND2-OE1 3.47Å; H572-Q575 HydrophobicContact CB-CG 4Å; H572-Q575 VanDerWaalsContact O-CB 3.31Å; H572-Q575 WeakPolarHBondContact O-CB 3.24Å; H572-Q575 PolarHBondContact O-N 3.47Å; Q575-M579 PolarHBondContact O-N 3.41Å; Q575-F757 HydrophobicContact CG-CE1 3.9Å; Q575-F757 HydrophobicContact CG-CZ 4.14Å; Q575-Y762 PolarHBondContact NE2-OH 3.24Å
576	F	98.3	Very high	97	Very high	5 Å²	5	19 Å²	19	2%	0.022	9%	0.09	C	C	.	.	H	α-helix	trans	-65	-44.3	175.1	158.4	-90.5	0	0	0	113	L565 F568 K569 H572 V573 Y574 A580 K656	L565-F576 HydrophobicContact CB-CD2 4.21Å; L565-F576 HydrophobicContact CB-CE2 4.22Å; L565-F576 HydrophobicContact CD2-CD2 3.75Å; L565-F576 HydrophobicContact CD2-CE2 3.75Å; L565-F576 WeakPolarHBondContact O-CD2 3.21Å; F568-F576 HydrophobicContact CB-CB 4.35Å; K569-F576 HydrophobicContact CB-CB 3.62Å; K569-F576 HydrophobicContact CB-CD1 4.42Å; K569-F576 HydrophobicContact CB-CD2 3.84Å; K569-F576 HydrophobicContact CB-CG 3.67Å; K569-F576 HydrophobicContact CD-CB 4.48Å; K569-F576 HydrophobicContact CD-CD1 3.65Å; K569-F576 HydrophobicContact CD-CD2 3.9Å; K569-F576 HydrophobicContact CD-CE1 3.8Å; K569-F576 HydrophobicContact CD-CE2 4.01Å; K569-F576 HydrophobicContact CD-CG 3.71Å; K569-F576 HydrophobicContact CD-CZ 3.97Å; K569-F576 HydrophobicContact CG-CB 3.96Å; K569-F576 HydrophobicContact CG-CD1 3.97Å; K569-F576 HydrophobicContact CG-CD2 4.18Å; K569-F576 HydrophobicContact CG-CG 3.74Å; H572-F576 PolarHBondContact O-N 2.93Å; V573-F576 WeakPolarHBondContact O-CB 2.97Å; V573-F576 PolarHBondContact O-N 3.48Å; Y574-F576 VanDerWaalsContact C-N 3.28Å; Y574-F576 PolarHBondContact O-N 2.95Å; F576-A580 HydrophobicContact CE1-CB 4.47Å; F576-A580 HydrophobicContact CE2-CB 4.47Å; F576-A580 HydrophobicContact CZ-CB 4.27Å; F576-A580 WeakPolarHBondContact O-CB 3.37Å; F576-A580 PolarHBondContact O-N 3.27Å; F576-K656 HydrophobicContact CE2-CB 4.21Å; F576-K656 HydrophobicContact CZ-CB 4.4Å
577	E	97.7	Very high	96.9	Very high	14 Å²	14	22 Å²	22	7%	0.065	11%	0.108	C	C	.	.	H	α-helix	trans	-69.9	-32.2	-179.2	-67.4	-71.6	177.9	0	0	112.1	V573 Y574 A580 Q581 K661 R664 L750 I754	V573-E577 PolarHBondContact O-N 2.69Å; Y574-E577 PolarHBondContact O-N 2.91Å; E577-A580 PolarHBondContact O-N 2.91Å; E577-Q581 WeakPolarHBondContact O-CB 3.22Å; E577-Q581 PolarHBondContact O-N 3.37Å; E577-K661 VanDerWaalsContact CD-CE 3.5Å; E577-K661 WeakPolarHBondContact OE1-CE 3.49Å; E577-K661 IonicContact OE1-NZ 3.3Å; E577-K661 PolarHBondContact OE1-NZ 3.42Å; E577-K661 WeakPolarHBondContact OE2-CE 3.35Å; E577-K661 IonicContact OE2-NZ 3.31Å; E577-K661 PolarHBondContact OE2-NZ 2.97Å; E577-K661 VanDerWaalsContact OE2-NZ 3.1Å; E577-R664 IonicContact OE2-CZ 2.7Å; E577-R664 IonicContact OE2-NH1 3.57Å; E577-R664 PolarHBondContact OE2-NH1 2.78Å; E577-R664 IonicContact OE2-NH2 2.67Å; E577-L750 HydrophobicContact CB-CD1 4.19Å; E577-L750 HydrophobicContact CG-CD1 4.09Å; E577-I754 HydrophobicContact CB-CD1 3.6Å; E577-I754 HydrophobicContact CB-CG1 4.17Å
578	Y	97.9	Very high	96.8	Very high	47 Å²	47	21.9 Å²	21.9	18%	0.184	11%	0.107	C	C	.	.	H	α-helix	trans	-60.3	-53.2	172.5	-167.6	-122.4	0	0	0	110.9	Y489 L493 L496 Y574 A580 Q581 H582 I754	Y489-Y578 VanDerWaalsContact OH-CD1 3.3Å; Y489-Y578 WeakPolarHBondContact OH-CD1 3.46Å; L493-Y578 HydrophobicContact CD1-CD1 4.04Å; L493-Y578 HydrophobicContact CD1-CE1 3.55Å; L496-Y578 HydrophobicContact CB-CE1 4.26Å; L496-Y578 HydrophobicContact CD2-CD1 3.34Å; L496-Y578 HydrophobicContact CD2-CE1 3.69Å; L496-Y578 HydrophobicContact CD2-CG 4.34Å; Y574-Y578 WeakPolarHBondContact O-CB 3.17Å; Y574-Y578 PolarHBondContact O-N 2.82Å; Y578-A580 VanDerWaalsContact C-N 3.31Å; Y578-A580 PolarHBondContact O-N 3.1Å; Y578-Q581 PolarHBondContact O-N 3.43Å; Y578-H582 AromaticContact CD2-NE2 3.62Å; Y578-H582 AromaticContact CE1-CD2 3.96Å; Y578-H582 AromaticContact CE1-NE2 3.74Å; Y578-H582 AromaticContact CE2-CD2 3.97Å; Y578-H582 AromaticContact CE2-NE2 3.16Å; Y578-H582 WeakPolarHBondContact CE2-NE2 3.21Å; Y578-H582 AromaticContact CZ-CD2 3.91Å; Y578-H582 AromaticContact CZ-NE2 3.21Å; Y578-H582 PolarHBondContact O-CD2 3.38Å; Y578-H582 PolarHBondContact O-N 2.77Å; Y578-H582 VanDerWaalsContact O-N 3.15Å; Y578-I754 HydrophobicContact CD2-CG2 3.47Å; Y578-I754 VanDerWaalsContact CD2-CG2 3.47Å; Y578-I754 HydrophobicContact CE2-CG2 4.47Å; Y578-I754 HydrophobicContact CG-CG2 3.85Å
579	M	98.1	Very high	96.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.9	-42.3	174.8	-171	-164.8	178.1	0	0	111.8	L496 M500 L561 L564 L565 F568 Q575 H582 L583	L496-M579 HydrophobicContact CD1-CG 4.47Å; L496-M579 HydrophobicContact CD2-CB 4.1Å; M500-M579 HydrophobicContact CE-CE 3.9Å; M500-M579 HydrophobicContact CG-CG 4.42Å; M500-M579 HydrophobicContact SD-CE 3.41Å; M500-M579 WeakPolarHBondContact SD-CE 3.17Å; M500-M579 HydrophobicContact SD-CG 3.78Å; M500-M579 HydrophobicContact SD-SD 4.48Å; L561-M579 HydrophobicContact CD2-CE 3.79Å; L564-M579 HydrophobicContact CB-CE 3.59Å; L564-M579 HydrophobicContact CB-SD 3.73Å; L564-M579 HydrophobicContact CD1-CE 4.07Å; L564-M579 HydrophobicContact CG-CE 4.49Å; L565-M579 HydrophobicContact CB-SD 4.44Å; L565-M579 HydrophobicContact CD2-CB 4.25Å; L565-M579 HydrophobicContact CD2-CE 4.33Å; L565-M579 HydrophobicContact CD2-CG 4.01Å; L565-M579 HydrophobicContact CD2-SD 3.52Å; L565-M579 VanDerWaalsContact CD2-SD 3.52Å; L565-M579 HydrophobicContact CG-CE 3.97Å; L565-M579 HydrophobicContact CG-SD 3.66Å; F568-M579 HydrophobicContact CD2-SD 3.84Å; F568-M579 HydrophobicContact CE2-SD 4.06Å; Q575-M579 PolarHBondContact O-N 3.41Å; M579-H582 PolarHBondContact O-N 3.22Å; M579-L583 HydrophobicContact CE-CD1 4.26Å; M579-L583 HydrophobicContact CG-CD1 4.41Å; M579-L583 WeakPolarHBondContact O-CG 3.28Å; M579-L583 PolarHBondContact O-N 3.14Å
580	A	98	Very high	96.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.6	-38.3	-179.6	0	0	0	0	0	113	L565 F576 E577 Y578 V584 L657	L565-A580 HydrophobicContact CD2-CB 4.26Å; F576-A580 HydrophobicContact CE1-CB 4.47Å; F576-A580 HydrophobicContact CE2-CB 4.47Å; F576-A580 HydrophobicContact CZ-CB 4.27Å; F576-A580 WeakPolarHBondContact O-CB 3.37Å; F576-A580 PolarHBondContact O-N 3.27Å; E577-A580 PolarHBondContact O-N 2.91Å; Y578-A580 VanDerWaalsContact C-N 3.31Å; Y578-A580 PolarHBondContact O-N 3.1Å; A580-V584 VanDerWaalsContact O-CG2 3.24Å; A580-V584 WeakPolarHBondContact O-CG2 3.42Å; A580-V584 PolarHBondContact O-N 2.96Å; A580-V584 VanDerWaalsContact O-N 3.07Å; A580-L657 HydrophobicContact CB-CD2 3.68Å
581	Q	95.1	Very high	96.6	Very high	5 Å²	5	20.5 Å²	20.5	2%	0.023	10%	0.104	C	C	.	.	H	α-helix	trans	-64	-47.3	174.7	-83.3	-166	-26.3	0	0	111	E577 Y578 L583 V584 F585 E747	E577-Q581 WeakPolarHBondContact O-CB 3.22Å; E577-Q581 PolarHBondContact O-N 3.37Å; Y578-Q581 PolarHBondContact O-N 3.43Å; Q581-L583 PolarHBondContact O-N 2.8Å; Q581-V584 PolarHBondContact O-N 3.24Å; Q581-F585 HydrophobicContact CB-CD2 4.4Å; Q581-F585 HydrophobicContact CB-CE2 3.75Å; Q581-F585 HydrophobicContact CB-CZ 4.11Å; Q581-F585 HydrophobicContact CG-CE2 4.39Å; Q581-F585 HydrophobicContact CG-CZ 4.29Å; Q581-F585 WeakPolarHBondContact O-CD2 3.49Å; Q581-F585 VanDerWaalsContact O-CG 3.28Å; Q581-F585 WeakPolarHBondContact O-CG 3.32Å; Q581-F585 PolarHBondContact O-N 2.85Å; Q581-E747 PolarHBondContact NE2-O 3Å; Q581-E747 PolarHBondContact NE2-OE2 3.5Å
582	H	96.8	Very high	96.7	Very high	39 Å²	39	19.9 Å²	19.9	18%	0.181	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-39.8	177.6	-70.3	-50.6	0	0	0	113.1	M500 Y578 M579 V584 F585 A586	M500-H582 HydrophobicContact CB-CB 4.49Å; M500-H582 HydrophobicContact CG-CB 4.4Å; Y578-H582 AromaticContact CD2-NE2 3.62Å; Y578-H582 AromaticContact CE1-CD2 3.96Å; Y578-H582 AromaticContact CE1-NE2 3.74Å; Y578-H582 AromaticContact CE2-CD2 3.97Å; Y578-H582 AromaticContact CE2-NE2 3.16Å; Y578-H582 WeakPolarHBondContact CE2-NE2 3.21Å; Y578-H582 AromaticContact CZ-CD2 3.91Å; Y578-H582 AromaticContact CZ-NE2 3.21Å; Y578-H582 PolarHBondContact O-CD2 3.38Å; Y578-H582 PolarHBondContact O-N 2.77Å; Y578-H582 VanDerWaalsContact O-N 3.15Å; M579-H582 PolarHBondContact O-N 3.22Å; H582-V584 VanDerWaalsContact C-N 3.33Å; H582-V584 PolarHBondContact O-N 3.46Å; H582-F585 PolarHBondContact O-N 3.45Å; H582-A586 WeakPolarHBondContact O-CB 3.42Å; H582-A586 PolarHBondContact O-N 3.47Å
583	L	98.1	Very high	96.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.9	-39.7	171.6	-74.4	172.8	0	0	0	112.7	M500 L504 L561 L565 M579 Q581 N587 C588 L657	M500-L583 HydrophobicContact CB-CD2 4.05Å; M500-L583 HydrophobicContact CB-CG 4.48Å; M500-L583 HydrophobicContact CG-CD2 4.17Å; M500-L583 HydrophobicContact CG-CG 4.23Å; M500-L583 HydrophobicContact SD-CD1 4.34Å; M500-L583 HydrophobicContact SD-CD2 3.68Å; M500-L583 HydrophobicContact SD-CG 3.89Å; L504-L583 HydrophobicContact CD1-CD2 3.75Å; L504-L583 HydrophobicContact CD2-CD2 4.25Å; L504-L583 HydrophobicContact CG-CD2 4.12Å; L561-L583 HydrophobicContact CD1-CD2 4.41Å; L561-L583 HydrophobicContact CD2-CD1 4.38Å; L561-L583 HydrophobicContact CD2-CD2 3.89Å; L565-L583 HydrophobicContact CD1-CD1 3.78Å; L565-L583 HydrophobicContact CD2-CD1 4.07Å; L565-L583 HydrophobicContact CG-CD1 4.18Å; M579-L583 HydrophobicContact CE-CD1 4.26Å; M579-L583 HydrophobicContact CG-CD1 4.41Å; M579-L583 WeakPolarHBondContact O-CG 3.28Å; M579-L583 PolarHBondContact O-N 3.14Å; Q581-L583 PolarHBondContact O-N 2.8Å; L583-N587 PolarHBondContact O-N 3.31Å; L583-C588 HydrophobicContact CB-CB 4.02Å; L583-C588 HydrophobicContact CD2-CB 4.48Å; L583-C588 WeakPolarHBondContact O-CB 3.49Å; L583-C588 PolarHBondContact O-N 3.45Å; L583-L657 HydrophobicContact CB-CD1 4.4Å; L583-L657 HydrophobicContact CB-CD2 4.22Å; L583-L657 HydrophobicContact CD1-CD2 4.2Å
584	V	95.2	Very high	96.5	Very high	10 Å²	10	23.4 Å²	23.4	6%	0.061	12%	0.116	C	C	.	.	H	α-helix	trans	-68.5	-45.6	178.8	170.2	0	0	0	0	111.1	A580 Q581 H582 A586 N587 I589 L657 R664 M667	A580-V584 VanDerWaalsContact O-CG2 3.24Å; A580-V584 WeakPolarHBondContact O-CG2 3.42Å; A580-V584 PolarHBondContact O-N 2.96Å; A580-V584 VanDerWaalsContact O-N 3.07Å; Q581-V584 PolarHBondContact O-N 3.24Å; H582-V584 VanDerWaalsContact C-N 3.33Å; H582-V584 PolarHBondContact O-N 3.46Å; V584-A586 VanDerWaalsContact C-N 3.32Å; V584-A586 PolarHBondContact O-N 2.78Å; V584-N587 PolarHBondContact O-N 3.2Å; V584-N587 VanDerWaalsContact O-N 3.08Å; V584-I589 HydrophobicContact CG1-CD1 4.49Å; V584-I589 HydrophobicContact CG2-CD1 3.99Å; V584-I589 HydrophobicContact CG2-CG1 4.5Å; V584-L657 HydrophobicContact CG2-CB 4.28Å; V584-L657 HydrophobicContact CG2-CD1 4.25Å; V584-L657 HydrophobicContact CG2-CD2 4.32Å; V584-R664 HydrophobicContact CG1-CG 4.46Å; V584-M667 HydrophobicContact CG1-CE 4.21Å; V584-M667 HydrophobicContact CG1-SD 4.1Å
585	F	93.2	Very high	96.3	Very high	96 Å²	96	22.9 Å²	22.9	42%	0.421	11%	0.114	S	C	.	.	H	α-helix	trans	-65.5	-34.8	176.7	-55.8	-36.2	0	0	0	112.1	Q581 H582 N587 R751	Q581-F585 HydrophobicContact CB-CD2 4.4Å; Q581-F585 HydrophobicContact CB-CE2 3.75Å; Q581-F585 HydrophobicContact CB-CZ 4.11Å; Q581-F585 HydrophobicContact CG-CE2 4.39Å; Q581-F585 HydrophobicContact CG-CZ 4.29Å; Q581-F585 WeakPolarHBondContact O-CD2 3.49Å; Q581-F585 VanDerWaalsContact O-CG 3.28Å; Q581-F585 WeakPolarHBondContact O-CG 3.32Å; Q581-F585 PolarHBondContact O-N 2.85Å; H582-F585 PolarHBondContact O-N 3.45Å; F585-N587 PolarHBondContact O-N 3.07Å; F585-N587 VanDerWaalsContact O-N 3.12Å; F585-N587 PolarHBondContact O-ND2 3Å; F585-R751 VanDerWaalsContact CZ-NH2 3.32Å
586	A	95.3	Very high	96.2	Very high	27 Å²	27	22.9 Å²	22.9	22%	0.223	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	16.6	171.6	0	0	0	0	0	114.1	I501 L504 H582 V584 C588	I501-A586 HydrophobicContact CG1-CB 3.71Å; L504-A586 HydrophobicContact CD1-CB 3.53Å; H582-A586 WeakPolarHBondContact O-CB 3.42Å; H582-A586 PolarHBondContact O-N 3.47Å; V584-A586 VanDerWaalsContact C-N 3.32Å; V584-A586 PolarHBondContact O-N 2.78Å; A586-C588 PolarHBondContact O-N 3.07Å
587	N	95.4	Very high	96	Very high	95 Å²	95	26.9 Å²	26.9	51%	0.508	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	29.9	174.5	-65.6	-76.6	0	0	0	115.8	L583 V584 F585 I589 P590 L591	L583-N587 PolarHBondContact O-N 3.31Å; V584-N587 PolarHBondContact O-N 3.2Å; V584-N587 VanDerWaalsContact O-N 3.08Å; F585-N587 PolarHBondContact O-N 3.07Å; F585-N587 VanDerWaalsContact O-N 3.12Å; F585-N587 PolarHBondContact O-ND2 3Å; N587-I589 VanDerWaalsContact C-N 3.28Å; N587-I589 PolarHBondContact O-N 3.44Å; N587-P590 HydrophobicContact CB-CB 4.41Å; N587-P590 HydrophobicContact CB-CG 4.13Å; N587-P590 VanDerWaalsContact O-CD 3.31Å; N587-P590 WeakPolarHBondContact O-CD 3.45Å; N587-L591 WeakPolarHBondContact O-CB 3.4Å; N587-L591 PolarHBondContact O-N 2.94Å
588	C	97.4	Very high	95.7	Very high	1 Å²	1	28 Å²	28	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-56.7	-38.8	175.1	-174.6	0	0	0	0	113	L504 L583 A586 L591 I592 L657	L504-C588 HydrophobicContact CD1-CB 3.87Å; L504-C588 HydrophobicContact CD2-CB 3.87Å; L583-C588 HydrophobicContact CB-CB 4.02Å; L583-C588 HydrophobicContact CD2-CB 4.48Å; L583-C588 WeakPolarHBondContact O-CB 3.49Å; L583-C588 PolarHBondContact O-N 3.45Å; A586-C588 PolarHBondContact O-N 3.07Å; C588-L591 PolarHBondContact O-N 3.48Å; C588-I592 WeakPolarHBondContact O-CG1 3.29Å; C588-I592 PolarHBondContact O-N 2.95Å; C588-I592 VanDerWaalsContact SG-CD1 3.57Å; C588-L657 HydrophobicContact CB-CD1 4.12Å
589	I	96.1	Very high	95.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-57	177.9	-67.9	175.3	0	0	0	111.1	V584 N587 L591 I592 L593 L654 L657 T658 R664 M667 L668	V584-I589 HydrophobicContact CG1-CD1 4.49Å; V584-I589 HydrophobicContact CG2-CD1 3.99Å; V584-I589 HydrophobicContact CG2-CG1 4.5Å; N587-I589 VanDerWaalsContact C-N 3.28Å; N587-I589 PolarHBondContact O-N 3.44Å; I589-L591 VanDerWaalsContact C-N 3.29Å; I589-L591 PolarHBondContact O-N 3.07Å; I589-I592 PolarHBondContact O-N 3.25Å; I589-L593 HydrophobicContact CG2-CD1 4.23Å; I589-L593 WeakPolarHBondContact O-CG 3.43Å; I589-L593 PolarHBondContact O-N 3.24Å; I589-L593 VanDerWaalsContact O-N 3.08Å; I589-L654 HydrophobicContact CB-CD1 4.23Å; I589-L654 HydrophobicContact CG1-CD1 3.81Å; I589-L654 HydrophobicContact CG2-CD1 4.11Å; I589-L657 HydrophobicContact CD1-CB 4.47Å; I589-L657 HydrophobicContact CG1-CD1 4.12Å; I589-T658 HydrophobicContact CD1-CG2 3.91Å; I589-R664 HydrophobicContact CD1-CB 4.23Å; I589-M667 HydrophobicContact CD1-SD 4.33Å; I589-L668 HydrophobicContact CG2-CD2 3.93Å
590	P	95.4	Very high	95.1	Very high	29 Å²	29	30.9 Å²	30.9	19%	0.188	16%	0.159	C	C	.	.	H	α-helix	trans	-51.3	-42.5	170.2	-29.9	33.4	0	0	0	114.6	N587 L593 K594 F671	N587-P590 HydrophobicContact CB-CB 4.41Å; N587-P590 HydrophobicContact CB-CG 4.13Å; N587-P590 VanDerWaalsContact O-CD 3.31Å; N587-P590 WeakPolarHBondContact O-CD 3.45Å; P590-L593 PolarHBondContact O-N 2.97Å; P590-K594 WeakPolarHBondContact O-CB 3.14Å; P590-K594 PolarHBondContact O-N 3.41Å; P590-F671 HydrophobicContact CG-CD2 4.26Å; P590-F671 HydrophobicContact CG-CE1 4.17Å; P590-F671 HydrophobicContact CG-CE2 3.69Å; P590-F671 HydrophobicContact CG-CZ 3.65Å
591	L	95.6	Very high	94.8	Very high	19 Å²	19	33.2 Å²	33.2	10%	0.099	17%	0.171	C	C	.	.	H	α-helix	trans	-63.7	-47.4	-177.9	179.2	57.6	0	0	0	112.1	L504 L507 L508 N587 C588 I589 L593 K594 F595	L504-L591 HydrophobicContact CB-CD2 4.13Å; L504-L591 HydrophobicContact CD2-CD2 3.91Å; L504-L591 WeakPolarHBondContact O-CD2 3.24Å; L507-L591 HydrophobicContact CB-CD2 4.2Å; L507-L591 HydrophobicContact CD2-CD2 3.95Å; L507-L591 HydrophobicContact CG-CD2 4.13Å; L508-L591 HydrophobicContact CB-CD1 3.81Å; L508-L591 HydrophobicContact CB-CD2 4.36Å; L508-L591 HydrophobicContact CD1-CD1 3.77Å; L508-L591 HydrophobicContact CG-CD1 4.32Å; N587-L591 WeakPolarHBondContact O-CB 3.4Å; N587-L591 PolarHBondContact O-N 2.94Å; C588-L591 PolarHBondContact O-N 3.48Å; I589-L591 VanDerWaalsContact C-N 3.29Å; I589-L591 PolarHBondContact O-N 3.07Å; L591-L593 VanDerWaalsContact C-N 3.31Å; L591-L593 PolarHBondContact O-N 3.21Å; L591-K594 PolarHBondContact O-N 2.93Å; L591-F595 WeakPolarHBondContact O-CB 3.23Å; L591-F595 PolarHBondContact O-N 2.9Å
592	I	97.3	Very high	94.6	Very high	2 Å²	2	36 Å²	36	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-40.3	176.4	-66.3	169.4	0	0	0	110.3	C588 I589 F595 F596 L650 I653 L654	C588-I592 WeakPolarHBondContact O-CG1 3.29Å; C588-I592 PolarHBondContact O-N 2.95Å; C588-I592 VanDerWaalsContact SG-CD1 3.57Å; I589-I592 PolarHBondContact O-N 3.25Å; I592-F595 WeakPolarHBondContact O-CB 2.96Å; I592-F595 PolarHBondContact O-N 3.5Å; I592-F596 HydrophobicContact CG2-CD2 3.78Å; I592-F596 HydrophobicContact CG2-CE2 3.97Å; I592-F596 WeakPolarHBondContact O-CD2 3.43Å; I592-F596 PolarHBondContact O-N 2.95Å; I592-L650 HydrophobicContact CD1-CD2 4.49Å; I592-L650 HydrophobicContact CG1-CB 4.37Å; I592-L650 HydrophobicContact CG1-CD2 4.23Å; I592-L650 HydrophobicContact CG2-CB 4.11Å; I592-I653 HydrophobicContact CD1-CB 4.34Å; I592-I653 HydrophobicContact CD1-CG2 3.95Å; I592-L654 HydrophobicContact CD1-CB 4.24Å; I592-L654 HydrophobicContact CG2-CB 4.27Å; I592-L654 HydrophobicContact CG2-CD2 3.86Å
593	L	95.6	Very high	94.4	Very high	7 Å²	7	35 Å²	35	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-37.3	176.6	-66.1	-179.9	0	0	0	112.7	I589 P590 L591 F596 N597 L654 L668 F671 S673 I676	I589-L593 HydrophobicContact CG2-CD1 4.23Å; I589-L593 WeakPolarHBondContact O-CG 3.43Å; I589-L593 PolarHBondContact O-N 3.24Å; I589-L593 VanDerWaalsContact O-N 3.08Å; P590-L593 PolarHBondContact O-N 2.97Å; L591-L593 VanDerWaalsContact C-N 3.31Å; L591-L593 PolarHBondContact O-N 3.21Å; L593-F596 PolarHBondContact O-N 3.35Å; L593-N597 WeakPolarHBondContact O-CB 3.43Å; L593-N597 PolarHBondContact O-N 2.89Å; L593-N597 VanDerWaalsContact O-N 3.09Å; L593-L654 HydrophobicContact CD2-CD2 3.98Å; L593-L668 HydrophobicContact CD1-CD2 4.18Å; L593-F671 HydrophobicContact CD1-CB 3.6Å; L593-F671 HydrophobicContact CD1-CG 4.39Å; L593-S673 VanDerWaalsContact CD2-CB 3.45Å; L593-I676 HydrophobicContact CB-CD1 4.5Å
594	K	93.7	Very high	94.1	Very high	80 Å²	80	35 Å²	35	35%	0.348	19%	0.186	S	C	.	.	H	α-helix	trans	-62.5	-45.3	171	-174.3	-167.7	173.3	-165.8	0	111	L508 T513 P590 L591 F596 N597	L508-K594 HydrophobicContact CD1-CD 4.35Å; T513-K594 WeakPolarHBondContact OG1-CE 3.36Å; P590-K594 WeakPolarHBondContact O-CB 3.14Å; P590-K594 PolarHBondContact O-N 3.41Å; L591-K594 PolarHBondContact O-N 2.93Å; K594-F596 VanDerWaalsContact C-N 3.28Å; K594-F596 PolarHBondContact O-N 3.08Å; K594-N597 WeakPolarHBondContact O-CB 3.15Å; K594-N597 PolarHBondContact O-N 3.47Å
595	F	94.9	Very high	93.9	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-37.3	176.1	-175	-82.6	0	0	0	112.2	A511 V554 L591 I592 N597 Q598 Y603 L650	A511-F595 HydrophobicContact CB-CD2 4.12Å; V554-F595 HydrophobicContact CG1-CE2 3.77Å; V554-F595 HydrophobicContact CG1-CZ 3.84Å; V554-F595 HydrophobicContact CG2-CE2 4.17Å; L591-F595 WeakPolarHBondContact O-CB 3.23Å; L591-F595 PolarHBondContact O-N 2.9Å; I592-F595 WeakPolarHBondContact O-CB 2.96Å; I592-F595 PolarHBondContact O-N 3.5Å; F595-N597 VanDerWaalsContact C-N 3.33Å; F595-Q598 WeakPolarHBondContact O-CG 3.23Å; F595-Q598 PolarHBondContact O-NE2 3.46Å; F595-Y603 HydrophobicContact CE1-CD1 4.41Å; F595-Y603 AromaticContact CE1-CE1 3.84Å; F595-Y603 HydrophobicContact CE1-CE1 3.84Å; F595-Y603 HydrophobicContact CZ-CD1 4.35Å; F595-Y603 AromaticContact CZ-CE1 3.48Å; F595-Y603 HydrophobicContact CZ-CE1 3.48Å; F595-Y603 VanDerWaalsContact CZ-CE1 3.48Å; F595-Y603 AromaticContact CZ-CZ 3.71Å; F595-L650 HydrophobicContact CD1-CD1 3.63Å; F595-L650 HydrophobicContact CD2-CD1 4.23Å; F595-L650 HydrophobicContact CE1-CD1 3.67Å; F595-L650 HydrophobicContact CE2-CD1 4.26Å; F595-L650 HydrophobicContact CG-CD1 3.93Å; F595-L650 HydrophobicContact CZ-CD1 3.98Å
596	F	95.6	Very high	93.8	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-80.2	-6.9	174.3	-82.6	-74.8	0	0	0	114.6	I592 L593 K594 Q598 I600 C647 L650 L651 I676 A680 M688	I592-F596 HydrophobicContact CG2-CD2 3.78Å; I592-F596 HydrophobicContact CG2-CE2 3.97Å; I592-F596 WeakPolarHBondContact O-CD2 3.43Å; I592-F596 PolarHBondContact O-N 2.95Å; L593-F596 PolarHBondContact O-N 3.35Å; K594-F596 VanDerWaalsContact C-N 3.28Å; K594-F596 PolarHBondContact O-N 3.08Å; F596-Q598 PolarHBondContact O-N 3.12Å; F596-Q598 VanDerWaalsContact O-N 3.09Å; F596-I600 HydrophobicContact CD1-CD1 3.67Å; F596-I600 HydrophobicContact CD1-CG1 3.99Å; F596-I600 HydrophobicContact CE1-CD1 4.22Å; F596-I600 HydrophobicContact CE1-CG2 4.47Å; F596-I600 HydrophobicContact CG-CD1 4.43Å; F596-C647 HydrophobicContact CE1-CB 4.1Å; F596-C647 HydrophobicContact CZ-CB 3.87Å; F596-C647 WeakPolarHBondContact CZ-O 3.44Å; F596-L650 HydrophobicContact CE2-CB 4.05Å; F596-L651 HydrophobicContact CE1-CD1 4.19Å; F596-L651 HydrophobicContact CE1-CG 4.32Å; F596-L651 HydrophobicContact CE2-CD2 4.05Å; F596-L651 HydrophobicContact CE2-CG 3.8Å; F596-L651 HydrophobicContact CZ-CD1 3.79Å; F596-L651 HydrophobicContact CZ-CD2 4.09Å; F596-L651 HydrophobicContact CZ-CG 3.56Å; F596-I676 VanDerWaalsContact C-CG2 3.47Å; F596-I676 HydrophobicContact CB-CG2 3.66Å; F596-I676 VanDerWaalsContact O-CG2 3.27Å; F596-I676 WeakPolarHBondContact O-CG2 3.07Å; F596-A680 HydrophobicContact CD1-CB 4.24Å; F596-M688 HydrophobicContact CE1-CE 3.89Å
597	N	93.4	Very high	93.4	Very high	88 Å²	88	38 Å²	38	47%	0.471	20%	0.204	S	C	.	.	S	Bend	trans	-86.3	41.3	-177.2	-164.1	22.8	0	0	0	114	L593 K594 F595 I676 R679	L593-N597 WeakPolarHBondContact O-CB 3.43Å; L593-N597 PolarHBondContact O-N 2.89Å; L593-N597 VanDerWaalsContact O-N 3.09Å; K594-N597 WeakPolarHBondContact O-CB 3.15Å; K594-N597 PolarHBondContact O-N 3.47Å; F595-N597 VanDerWaalsContact C-N 3.33Å; N597-I676 HydrophobicContact CB-CD1 4.27Å; N597-I676 HydrophobicContact CB-CG2 4.48Å; N597-R679 PolarHBondContact OD1-NH2 3.34Å
598	Q	91.1	Very high	93.2	Very high	38 Å²	38	34.5 Å²	34.5	18%	0.178	19%	0.185	C	C	.	.	S	Bend	trans	-135.4	-176.2	-179.1	60.8	-179.7	-27.7	0	0	111.1	T513 F595 F596 I600	T513-Q598 HydrophobicContact CG2-CB 3.91Å; T513-Q598 HydrophobicContact CG2-CG 4.41Å; F595-Q598 WeakPolarHBondContact O-CG 3.23Å; F595-Q598 PolarHBondContact O-NE2 3.46Å; F596-Q598 PolarHBondContact O-N 3.12Å; F596-Q598 VanDerWaalsContact O-N 3.09Å; Q598-I600 HydrophobicContact CG-CD1 3.58Å; Q598-I600 HydrophobicContact CG-CG1 4.46Å; Q598-I600 PolarHBondContact O-N 3Å; Q598-I600 VanDerWaalsContact O-N 3.07Å
599	N	91.9	Very high	92.8	Very high	100 Å²	100	36 Å²	36	54%	0.535	20%	0.195	S	C	.	.			trans	-77.7	91.3	169.4	-169.6	-3.1	0	0	0	110.1	M601 S602 Y603	N599-M601 PolarHBondContact O-N 3.3Å; N599-M601 PolarHBondContact OD1-N 3.41Å; N599-S602 PolarHBondContact ND2-OG 3.41Å; N599-S602 PolarHBondContact O-N 3.35Å; N599-Y603 PolarHBondContact O-N 2.79Å
600	I	92.9	Very high	92.5	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.036	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-28	-176.2	-58.2	-64.4	0	0	0	112.6	F596 Q598 Y603 I604 V683 M688	F596-I600 HydrophobicContact CD1-CD1 3.67Å; F596-I600 HydrophobicContact CD1-CG1 3.99Å; F596-I600 HydrophobicContact CE1-CD1 4.22Å; F596-I600 HydrophobicContact CE1-CG2 4.47Å; F596-I600 HydrophobicContact CG-CD1 4.43Å; Q598-I600 HydrophobicContact CG-CD1 3.58Å; Q598-I600 HydrophobicContact CG-CG1 4.46Å; Q598-I600 PolarHBondContact O-N 3Å; Q598-I600 VanDerWaalsContact O-N 3.07Å; I600-Y603 PolarHBondContact O-N 2.57Å; I600-I604 HydrophobicContact CG2-CG2 4.44Å; I600-I604 WeakPolarHBondContact O-CG1 3.47Å; I600-I604 PolarHBondContact O-N 3.05Å; I600-V683 HydrophobicContact CG2-CG2 3.93Å; I600-M688 HydrophobicContact CG2-CE 3.79Å
601	M	90.3	Very high	92.2	Very high	49 Å²	49	37.2 Å²	37.2	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-53.9	171.9	-65.3	-55.8	-57.1	0	0	110.3	N599 Y603 I604 T605 K682 V683	N599-M601 PolarHBondContact O-N 3.3Å; N599-M601 PolarHBondContact OD1-N 3.41Å; M601-Y603 PolarHBondContact O-N 2.97Å; M601-I604 HydrophobicContact CE-CD1 4.37Å; M601-I604 VanDerWaalsContact O-CG1 3.32Å; M601-I604 WeakPolarHBondContact O-CG1 3.32Å; M601-I604 PolarHBondContact O-N 3.02Å; M601-I604 VanDerWaalsContact O-N 3.14Å; M601-I604 HydrophobicContact SD-CD1 4.42Å; M601-T605 WeakPolarHBondContact O-CG2 3.24Å; M601-T605 PolarHBondContact O-N 3.49Å; M601-T605 PolarHBondContact O-OG1 3.22Å; M601-K682 HydrophobicContact CG-CB 4.33Å; M601-K682 HydrophobicContact SD-CB 4.18Å; M601-V683 HydrophobicContact SD-CB 4.35Å; M601-V683 HydrophobicContact SD-CG2 3.72Å
602	S	91.3	Very high	91.9	Very high	65 Å²	65	38 Å²	38	46%	0.455	21%	0.209	S	C	.	.	H	α-helix	trans	-59.7	-31.2	178.1	-58.1	0	0	0	0	113.5	N599 A606	N599-S602 PolarHBondContact ND2-OG 3.41Å; N599-S602 PolarHBondContact O-N 3.35Å; S602-A606 PolarHBondContact O-N 3.48Å
603	Y	92.8	Very high	91.6	Very high	17 Å²	17	39.1 Å²	39.1	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-70.7	-45.9	174.2	176.6	-118.2	0	0	0	112.2	P512 F595 N599 I600 M601 T605 A606 N643	P512-Y603 HydrophobicContact CG-CD2 3.83Å; P512-Y603 HydrophobicContact CG-CE2 3.66Å; F595-Y603 HydrophobicContact CE1-CD1 4.41Å; F595-Y603 AromaticContact CE1-CE1 3.84Å; F595-Y603 HydrophobicContact CE1-CE1 3.84Å; F595-Y603 HydrophobicContact CZ-CD1 4.35Å; F595-Y603 AromaticContact CZ-CE1 3.48Å; F595-Y603 HydrophobicContact CZ-CE1 3.48Å; F595-Y603 VanDerWaalsContact CZ-CE1 3.48Å; F595-Y603 AromaticContact CZ-CZ 3.71Å; N599-Y603 PolarHBondContact O-N 2.79Å; I600-Y603 PolarHBondContact O-N 2.57Å; M601-Y603 PolarHBondContact O-N 2.97Å; Y603-T605 VanDerWaalsContact C-N 3.3Å; Y603-T605 PolarHBondContact O-N 3.12Å; Y603-A606 WeakPolarHBondContact O-CB 3.44Å; Y603-A606 PolarHBondContact O-N 2.59Å; Y603-N643 HydrophobicContact CD1-CB 4.13Å; Y603-N643 HydrophobicContact CE1-CB 3.65Å; Y603-N643 HydrophobicContact CE2-CB 4.09Å; Y603-N643 VanDerWaalsContact CE2-CG 3.42Å; Y603-N643 WeakPolarHBondContact CE2-ND2 3.31Å; Y603-N643 VanDerWaalsContact CZ-OD1 3.3Å; Y603-N643 PolarHBondContact O-ND2 2.94Å; Y603-N643 PolarHBondContact OH-OD1 3.32Å
604	I	92.2	Very high	91.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.9	-20.7	177.5	69.2	171.2	0	0	0	113.2	L46 I600 M601 F639 C640 L644 V683	L46-I604 HydrophobicContact CD1-CD1 3.72Å; I600-I604 HydrophobicContact CG2-CG2 4.44Å; I600-I604 WeakPolarHBondContact O-CG1 3.47Å; I600-I604 PolarHBondContact O-N 3.05Å; M601-I604 HydrophobicContact CE-CD1 4.37Å; M601-I604 VanDerWaalsContact O-CG1 3.32Å; M601-I604 WeakPolarHBondContact O-CG1 3.32Å; M601-I604 PolarHBondContact O-N 3.02Å; M601-I604 VanDerWaalsContact O-N 3.14Å; M601-I604 HydrophobicContact SD-CD1 4.42Å; I604-F639 CarbonylContact O-C 3.59Å; I604-F639 VanDerWaalsContact O-CA 3.24Å; I604-F639 WeakPolarHBondContact O-CA 3.47Å; I604-C640 PolarHBondContact O-N 3.22Å; I604-L644 HydrophobicContact CG2-CB 4.49Å; I604-V683 HydrophobicContact CD1-CB 4.21Å; I604-V683 HydrophobicContact CD1-CG1 3.51Å; I604-V683 HydrophobicContact CD1-CG2 3.71Å
605	T	90.7	Very high	91.5	Very high	71 Å²	71	36.7 Å²	36.7	44%	0.436	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	14.2	174.1	68.4	0	0	0	0	113.3	M601 Y603 K607	M601-T605 WeakPolarHBondContact O-CG2 3.24Å; M601-T605 PolarHBondContact O-N 3.49Å; M601-T605 PolarHBondContact O-OG1 3.22Å; Y603-T605 VanDerWaalsContact C-N 3.3Å; Y603-T605 PolarHBondContact O-N 3.12Å; T605-K607 PolarHBondContact O-N 2.78Å
606	A	90.1	Very high	91.5	Very high	24 Å²	24	36.5 Å²	36.5	20%	0.198	21%	0.205	C	C	.	.			trans	-71.5	125.3	-179.1	0	0	0	0	0	111.4	S602 Y603 N608	S602-A606 PolarHBondContact O-N 3.48Å; Y603-A606 WeakPolarHBondContact O-CB 3.44Å; Y603-A606 PolarHBondContact O-N 2.59Å; A606-N608 PolarHBondContact O-N 2.71Å
607	K	88.5	Confident	91.3	Very high	102 Å²	102	40.4 Å²	40.4	44%	0.443	22%	0.22	S	C	.	.			trans	-91.9	86.5	175.7	-65.2	-167.2	178	-170	0	110.1	T605 G634 D635	T605-K607 PolarHBondContact O-N 2.78Å; K607-G634 PolarHBondContact NZ-O 3.01Å; K607-D635 VanDerWaalsContact CE-O 3.29Å; K607-D635 WeakPolarHBondContact CE-O 3.42Å; K607-D635 PolarHBondContact NZ-O 3.03Å
608	N	90.3	Very high	91.3	Very high	21 Å²	21	37.1 Å²	37.1	11%	0.112	20%	0.204	C	C	.	.			trans	-113.8	52.2	176.3	-65.5	-58.6	0	0	0	111.1	N547 R548 E551 A606 R642	N547-N608 HydrophobicContact CB-CB 4.12Å; N547-N608 VanDerWaalsContact CB-CG 3.43Å; N547-N608 WeakPolarHBondContact CB-OD1 3.4Å; N547-N608 PolarHBondContact ND2-OD1 3.05Å; R548-N608 HydrophobicContact CB-CB 4.29Å; R548-N608 VanDerWaalsContact CB-O 3.25Å; R548-N608 WeakPolarHBondContact CB-O 3.1Å; R548-N608 WeakPolarHBondContact CD-O 3.36Å; R548-N608 VanDerWaalsContact CG-O 3.24Å; R548-N608 WeakPolarHBondContact CG-O 3.48Å; E551-N608 PolarHBondContact OE1-ND2 3.15Å; A606-N608 PolarHBondContact O-N 2.71Å; N608-R642 PolarHBondContact O-NH2 3.31Å
609	S	89.1	Confident	91.4	Very high	31 Å²	31	36.9 Å²	36.9	22%	0.217	21%	0.205	C	C	.	.			trans	-154.7	145.6	176.7	-59.6	0	0	0	0	110	Y66 R642	Y66-S609 WeakPolarHBondContact OH-CA 3.46Å; S609-R642 PolarHBondContact OG-NH1 2.7Å; S609-R642 PolarHBondContact OG-NH2 3.08Å
610	I	90.3	Very high	91.3	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.041	19%	0.188	C	C	.	.			trans	-123	91.5	-177.1	-53.9	164	0	0	0	105.9	Y66 K541 V544 V612 L613 D614 L626 L631	Y66-I610 HydrophobicContact CD2-CD1 3.88Å; Y66-I610 HydrophobicContact CE2-CB 4.1Å; Y66-I610 HydrophobicContact CE2-CD1 3.83Å; Y66-I610 HydrophobicContact CE2-CG1 3.98Å; Y66-I610 PolarHBondContact OH-N 3.08Å; K541-I610 HydrophobicContact CG-CD1 4.15Å; V544-I610 HydrophobicContact CB-CD1 4.43Å; V544-I610 HydrophobicContact CG1-CD1 4.03Å; V544-I610 HydrophobicContact CG1-CG1 3.95Å; I610-V612 HydrophobicContact CG2-CG2 3.94Å; I610-V612 PolarHBondContact O-N 3.1Å; I610-V612 VanDerWaalsContact O-N 3.13Å; I610-L613 HydrophobicContact CB-CB 4.33Å; I610-L613 HydrophobicContact CB-CD1 4.32Å; I610-L613 HydrophobicContact CB-CG 4.44Å; I610-L613 HydrophobicContact CD1-CD1 4.09Å; I610-L613 HydrophobicContact CG2-CB 4.25Å; I610-L613 HydrophobicContact CG2-CD1 3.97Å; I610-L613 HydrophobicContact CG2-CG 3.91Å; I610-L613 WeakPolarHBondContact O-CA 3.39Å; I610-L613 PolarHBondContact O-N 3.24Å; I610-D614 PolarHBondContact O-N 3.16Å; I610-L626 HydrophobicContact CG2-CD2 4.33Å; I610-L631 HydrophobicContact CD1-CD2 3.54Å; I610-L631 HydrophobicContact CG1-CD2 3.98Å; I610-L631 HydrophobicContact CG2-CD2 4.21Å
611	S	88.2	Confident	91.1	Very high	47 Å²	47	36.9 Å²	36.9	33%	0.329	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-56.7	-33.4	-167.3	36.1	0	0	0	0	113.7	L613 D614 D635	S611-L613 PolarHBondContact O-N 2.91Å; S611-D614 PolarHBondContact O-N 3.11Å; S611-D635 PolarHBondContact OG-OD1 3.23Å
612	V	89	Confident	90.8	Very high	35 Å²	35	43.6 Å²	43.6	21%	0.212	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-68.5	-15.4	174.5	-60.2	0	0	0	0	114.8	I610 Y617 C618 L623 P624 L626	I610-V612 HydrophobicContact CG2-CG2 3.94Å; I610-V612 PolarHBondContact O-N 3.1Å; I610-V612 VanDerWaalsContact O-N 3.13Å; V612-Y617 HydrophobicContact CB-CE1 4.15Å; V612-Y617 HydrophobicContact CG1-CE1 4.15Å; V612-C618 WeakPolarHBondContact O-CB 3.44Å; V612-L623 WeakPolarHBondContact O-CD2 3.39Å; V612-P624 HydrophobicContact CB-CG 4.37Å; V612-P624 HydrophobicContact CG1-CG 4.11Å; V612-P624 HydrophobicContact CG2-CG 4.44Å; V612-L626 HydrophobicContact CG2-CD2 4.15Å
613	L	91.4	Very high	90.3	Very high	26 Å²	26	45 Å²	45	14%	0.136	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-104.1	-2.7	176.7	-64.6	-176.7	0	0	0	113.5	Y66 K541 I610 S611 C618 L623 L626	Y66-L613 HydrophobicContact CD1-CB 3.63Å; Y66-L613 HydrophobicContact CD1-CD1 4.44Å; Y66-L613 HydrophobicContact CE1-CB 3.75Å; Y66-L613 HydrophobicContact CG-CB 4.31Å; Y66-L613 HydrophobicContact CG-CD1 4.32Å; K541-L613 HydrophobicContact CD-CD1 4.11Å; I610-L613 HydrophobicContact CB-CB 4.33Å; I610-L613 HydrophobicContact CB-CD1 4.32Å; I610-L613 HydrophobicContact CB-CG 4.44Å; I610-L613 HydrophobicContact CD1-CD1 4.09Å; I610-L613 HydrophobicContact CG2-CB 4.25Å; I610-L613 HydrophobicContact CG2-CD1 3.97Å; I610-L613 HydrophobicContact CG2-CG 3.91Å; I610-L613 WeakPolarHBondContact O-CA 3.39Å; I610-L613 PolarHBondContact O-N 3.24Å; S611-L613 PolarHBondContact O-N 2.91Å; L613-C618 PolarHBondContact O-SG 2.95Å; L613-L623 HydrophobicContact CD2-CD1 4.34Å; L613-L623 HydrophobicContact CD2-CD2 4.41Å; L613-L626 HydrophobicContact CD1-CD1 4.05Å; L613-L626 HydrophobicContact CD2-CD1 4.41Å
614	D	93.1	Very high	89.7	Confident	31 Å²	31	47.6 Å²	47.6	17%	0.166	26%	0.255	C	S	.	.	S	Bend	trans	-74.3	138.8	177.4	-80.5	19.9	0	0	0	110.6	S61 Y66 I610 S611 Y617 C618	S61-D614 WeakPolarHBondContact CB-OD2 3.43Å; S61-D614 PolarHBondContact OG-OD1 3.43Å; S61-D614 PolarHBondContact OG-OD2 2.85Å; Y66-D614 WeakPolarHBondContact CE1-OD1 3.28Å; Y66-D614 VanDerWaalsContact CZ-OD1 3.26Å; Y66-D614 PolarHBondContact OH-OD1 2.63Å; I610-D614 PolarHBondContact O-N 3.16Å; S611-D614 PolarHBondContact O-N 3.11Å; D614-Y617 WeakPolarHBondContact O-CB 3.36Å; D614-Y617 PolarHBondContact O-N 2.92Å; D614-Y617 VanDerWaalsContact O-N 3.14Å; D614-C618 VanDerWaalsContact C-SG 3.58Å; D614-C618 WeakPolarHBondContact O-CB 2.99Å; D614-C618 PolarHBondContact O-N 2.86Å; D614-C618 PolarHBondContact O-SG 3.47Å; D614-C618 VanDerWaalsContact O-SG 3.35Å
615	F	94.3	Very high	89.1	Confident	5 Å²	5	56.3 Å²	56.3	2%	0.022	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	135.1	174.8	177.8	-85	0	0	0	109.5	L60 S61 Y64 F72 Q131 F134 M147 V619	L60-F615 HydrophobicContact CB-CD1 4.19Å; L60-F615 HydrophobicContact CD1-CD1 4.46Å; L60-F615 HydrophobicContact CD1-CE1 4.18Å; S61-F615 PolarHBondContact N-O 2.88Å; Y64-F615 HydrophobicContact CD2-CB 3.91Å; Y64-F615 HydrophobicContact CD2-CD1 4.19Å; Y64-F615 HydrophobicContact CD2-CG 4.04Å; Y64-F615 HydrophobicContact CE2-CB 4.38Å; Y64-F615 AromaticContact CE2-CD1 3.85Å; Y64-F615 HydrophobicContact CE2-CD1 3.85Å; Y64-F615 HydrophobicContact CE2-CE1 4.28Å; Y64-F615 AromaticContact CE2-CG 4Å; Y64-F615 HydrophobicContact CE2-CG 4Å; F72-F615 HydrophobicContact CD1-CD2 4Å; F72-F615 HydrophobicContact CD1-CE2 4.09Å; F72-F615 AromaticContact CE1-CD2 3.33Å; F72-F615 HydrophobicContact CE1-CD2 3.33Å; F72-F615 AromaticContact CE1-CE2 3.71Å; F72-F615 HydrophobicContact CE1-CE2 3.71Å; F72-F615 HydrophobicContact CE1-CG 4.06Å; F72-F615 HydrophobicContact CE2-CD2 4.32Å; F72-F615 HydrophobicContact CZ-CB 3.95Å; F72-F615 AromaticContact CZ-CD2 3.53Å; F72-F615 HydrophobicContact CZ-CD2 3.53Å; F72-F615 HydrophobicContact CZ-CE2 4.37Å; F72-F615 AromaticContact CZ-CG 3.98Å; F72-F615 HydrophobicContact CZ-CG 3.98Å; Q131-F615 HydrophobicContact CB-CE2 4.41Å; Q131-F615 HydrophobicContact CB-CZ 3.99Å; Q131-F615 HydrophobicContact CG-CE2 4.43Å; Q131-F615 HydrophobicContact CG-CZ 4.1Å; F134-F615 HydrophobicContact CD1-CE2 4.27Å; M147-F615 HydrophobicContact CE-CE1 3.98Å; M147-F615 HydrophobicContact CE-CZ 4.29Å; F615-V619 HydrophobicContact CD2-CG1 4.04Å; F615-V619 HydrophobicContact CD2-CG2 3.82Å; F615-V619 HydrophobicContact CE2-CG1 4.27Å; F615-V619 HydrophobicContact CE2-CG2 3.6Å
616	P	94.5	Very high	88.6	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	cis	-91.5	-9.1	12.8	36.4	-38.3	0	0	0	116.2	W56 E140 V143 C618 V619 V620	W56-P616 HydrophobicContact CH2-CG 3.8Å; W56-P616 HydrophobicContact CZ3-CG 3.77Å; E140-P616 HydrophobicContact CB-CG 4.05Å; E140-P616 HydrophobicContact CG-CG 3.87Å; E140-P616 WeakPolarHBondContact OE2-CG 3.47Å; V143-P616 HydrophobicContact CG1-CB 4.09Å; P616-C618 PolarHBondContact O-N 3.16Å; P616-C618 VanDerWaalsContact O-N 3.11Å; P616-V619 WeakPolarHBondContact O-CG2 3.35Å; P616-V619 PolarHBondContact O-N 3.32Å; P616-V620 PolarHBondContact O-N 2.97Å
617	Y	92.7	Very high	88.3	Confident	83 Å²	83	57.4 Å²	57.4	33%	0.325	30%	0.298	S	S	.	.	H	α-helix	trans	-47.3	-46.5	-177.1	-177.5	-81.6	0	0	0	112.6	V612 D614 V619 V620 H621	V612-Y617 HydrophobicContact CB-CE1 4.15Å; V612-Y617 HydrophobicContact CG1-CE1 4.15Å; D614-Y617 WeakPolarHBondContact O-CB 3.36Å; D614-Y617 PolarHBondContact O-N 2.92Å; D614-Y617 VanDerWaalsContact O-N 3.14Å; Y617-V619 PolarHBondContact O-N 3.1Å; Y617-V619 VanDerWaalsContact O-N 3.12Å; Y617-V620 PolarHBondContact O-N 3.38Å; Y617-H621 HydrophobicContact CD1-CB 4.39Å; Y617-H621 AromaticContact CD2-CD2 3.36Å; Y617-H621 WeakPolarHBondContact CD2-CD2 3.35Å; Y617-H621 HydrophobicContact CE1-CB 3.94Å; Y617-H621 HydrophobicContact CE2-CB 4.4Å; Y617-H621 AromaticContact CE2-CD2 3.39Å; Y617-H621 WeakPolarHBondContact CE2-CD2 3.35Å; Y617-H621 AromaticContact CE2-CG 3.94Å; Y617-H621 AromaticContact CG-CD2 3.8Å; Y617-H621 AromaticContact CZ-CD2 3.84Å; Y617-H621 AromaticContact CZ-CG 3.97Å; Y617-H621 PolarHBondContact O-N 3.15Å
618	C	92.5	Very high	87.8	Confident	19 Å²	19	54.7 Å²	54.7	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-69.9	-4.4	-175.5	70.8	0	0	0	0	116.4	V612 L613 D614 P616 L623	V612-C618 WeakPolarHBondContact O-CB 3.44Å; L613-C618 PolarHBondContact O-SG 2.95Å; D614-C618 VanDerWaalsContact C-SG 3.58Å; D614-C618 WeakPolarHBondContact O-CB 2.99Å; D614-C618 PolarHBondContact O-N 2.86Å; D614-C618 PolarHBondContact O-SG 3.47Å; D614-C618 VanDerWaalsContact O-SG 3.35Å; P616-C618 PolarHBondContact O-N 3.16Å; P616-C618 VanDerWaalsContact O-N 3.11Å; C618-L623 HydrophobicContact CB-CD2 3.99Å
619	V	93	Very high	87	Confident	32 Å²	32	61.3 Å²	61.3	19%	0.194	33%	0.325	C	S	.	.	H	α-helix	trans	-115.1	-8.1	173.1	-60	0	0	0	0	113.8	F72 F134 F615 P616 Y617	F72-V619 HydrophobicContact CB-CG1 3.9Å; F72-V619 HydrophobicContact CD1-CG1 4.17Å; F72-V619 HydrophobicContact CD2-CG1 3.84Å; F72-V619 HydrophobicContact CE2-CG1 4.41Å; F72-V619 HydrophobicContact CG-CG1 3.72Å; F134-V619 HydrophobicContact CB-CG2 3.86Å; F134-V619 HydrophobicContact CD1-CB 4.47Å; F134-V619 HydrophobicContact CD1-CG2 4Å; F134-V619 HydrophobicContact CD2-CB 3.59Å; F134-V619 HydrophobicContact CD2-CG1 4.37Å; F134-V619 HydrophobicContact CD2-CG2 3.76Å; F134-V619 HydrophobicContact CE2-CB 3.77Å; F134-V619 HydrophobicContact CE2-CG1 4.1Å; F134-V619 HydrophobicContact CE2-CG2 4.3Å; F134-V619 HydrophobicContact CG-CB 3.98Å; F134-V619 HydrophobicContact CG-CG2 3.59Å; F134-V619 HydrophobicContact CZ-CB 4.29Å; F134-V619 HydrophobicContact CZ-CG1 4.2Å; F615-V619 HydrophobicContact CD2-CG1 4.04Å; F615-V619 HydrophobicContact CD2-CG2 3.82Å; F615-V619 HydrophobicContact CE2-CG1 4.27Å; F615-V619 HydrophobicContact CE2-CG2 3.6Å; P616-V619 WeakPolarHBondContact O-CG2 3.35Å; P616-V619 PolarHBondContact O-N 3.32Å; Y617-V619 PolarHBondContact O-N 3.1Å; Y617-V619 VanDerWaalsContact O-N 3.12Å
620	V	91.1	Very high	86.2	Confident	30 Å²	30	62 Å²	62	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-100	-36.9	177.6	175.7	0	0	0	0	111.3	V143 P616 Y617	V143-V620 HydrophobicContact CG2-CG2 3.66Å; P616-V620 PolarHBondContact O-N 2.97Å; Y617-V620 PolarHBondContact O-N 3.38Å
621	H	88.4	Confident	85.4	Confident	77 Å²	77	62.4 Å²	62.4	36%	0.356	33%	0.332	S	S	.	.	S	Bend	trans	-106.4	148.8	-174.1	-62.3	-67.8	0	0	0	112.6	Y617 L623	Y617-H621 HydrophobicContact CD1-CB 4.39Å; Y617-H621 AromaticContact CD2-CD2 3.36Å; Y617-H621 WeakPolarHBondContact CD2-CD2 3.35Å; Y617-H621 HydrophobicContact CE1-CB 3.94Å; Y617-H621 HydrophobicContact CE2-CB 4.4Å; Y617-H621 AromaticContact CE2-CD2 3.39Å; Y617-H621 WeakPolarHBondContact CE2-CD2 3.35Å; Y617-H621 AromaticContact CE2-CG 3.94Å; Y617-H621 AromaticContact CG-CD2 3.8Å; Y617-H621 AromaticContact CZ-CD2 3.84Å; Y617-H621 AromaticContact CZ-CG 3.97Å; Y617-H621 PolarHBondContact O-N 3.15Å; H621-L623 PolarHBondContact O-N 2.93Å
622	E	82.9	Confident	84.4	Confident	191 Å²	191	67 Å²	67	89%	0.893	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-62.7	127	169.7	-66.5	-170.8	152.3	0	0	109.8
623	L	81.9	Confident	83.2	Confident	93 Å²	93	68.9 Å²	68.9	49%	0.487	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-77.2	125.3	-176.7	-65	179	0	0	0	110.5	V612 L613 C618 H621	V612-L623 WeakPolarHBondContact O-CD2 3.39Å; L613-L623 HydrophobicContact CD2-CD1 4.34Å; L613-L623 HydrophobicContact CD2-CD2 4.41Å; C618-L623 HydrophobicContact CB-CD2 3.99Å; H621-L623 PolarHBondContact O-N 2.93Å
624	P	80.1	Confident	81.5	Confident	72 Å²	72	68.2 Å²	68.2	47%	0.468	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-68.5	156.9	173.5	30.2	-35.1	0	0	0	111.1	V612 L626	V612-P624 HydrophobicContact CB-CG 4.37Å; V612-P624 HydrophobicContact CG1-CG 4.11Å; V612-P624 HydrophobicContact CG2-CG 4.44Å; P624-L626 PolarHBondContact O-N 3.43Å
625	E	78.1	Confident	80	Confident	183 Å²	183	70.6 Å²	70.6	86%	0.855	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-61	120.6	172.6	-67.3	-168.1	162.1	0	0	110.7	T627	E625-T627 PolarHBondContact O-N 3.45Å
626	L	81.4	Confident	78.4	Confident	50 Å²	50	78.5 Å²	78.5	26%	0.262	42%	0.422	S	S	.	.			trans	-71.5	112.4	179	-72	168.5	0	0	0	110.3	L537 I610 V612 L613 P624 L631	L537-L626 HydrophobicContact CD2-CB 4.29Å; L537-L626 WeakPolarHBondContact CD2-O 3.47Å; I610-L626 HydrophobicContact CG2-CD2 4.33Å; V612-L626 HydrophobicContact CG2-CD2 4.15Å; L613-L626 HydrophobicContact CD1-CD1 4.05Å; L613-L626 HydrophobicContact CD2-CD1 4.41Å; P624-L626 PolarHBondContact O-N 3.43Å; L626-L631 HydrophobicContact CD2-CD2 4.26Å
627	T	82.6	Confident	77.3	Confident	69 Å²	69	82.3 Å²	82.3	42%	0.423	45%	0.446	S	S	.	.			trans	-98.3	160.6	168.6	69.5	0	0	0	0	110.7	E625 E629 S630 L631	E625-T627 PolarHBondContact O-N 3.45Å; T627-E629 PolarHBondContact O-N 3.18Å; T627-S630 PolarHBondContact N-OG 3.28Å; T627-S630 PolarHBondContact O-N 2.9Å; T627-S630 VanDerWaalsContact O-N 3.12Å; T627-S630 PolarHBondContact O-OG 3.5Å; T627-S630 WeakPolarHBondContact OG1-CB 3.49Å; T627-S630 PolarHBondContact OG1-N 2.8Å; T627-L631 PolarHBondContact O-N 3.47Å
628	A	78.1	Confident	76.7	Confident	45 Å²	45	83.4 Å²	83.4	37%	0.372	45%	0.454	S	S	.	.	H	α-helix	trans	-58.6	-39.8	173	0	0	0	0	0	111.5	M540 S630 L631 E632	M540-A628 HydrophobicContact CE-CB 4.3Å; M540-A628 HydrophobicContact SD-CB 4.42Å; A628-S630 VanDerWaalsContact C-N 3.33Å; A628-S630 PolarHBondContact O-N 2.95Å; A628-L631 WeakPolarHBondContact O-CB 3.4Å; A628-L631 PolarHBondContact O-N 3.07Å; A628-L631 VanDerWaalsContact O-N 3.14Å; A628-E632 PolarHBondContact O-N 3.33Å
629	E	73.6	Confident	76.5	Confident	159 Å²	159	84.3 Å²	84.3	74%	0.743	46%	0.455	S	S	*	.	H	α-helix	trans	-59.9	-40.4	174.5	-62.7	174.9	-178	0	0	111.9	T627 L631 E632 A633	T627-E629 PolarHBondContact O-N 3.18Å; E629-L631 VanDerWaalsContact C-N 3.28Å; E629-L631 PolarHBondContact O-N 3.16Å; E629-E632 PolarHBondContact O-N 3.47Å; E629-A633 WeakPolarHBondContact O-CB 3.46Å; E629-A633 PolarHBondContact O-N 3.25Å
630	S	73.9	Confident	76.4	Confident	46 Å²	46	83.4 Å²	83.4	32%	0.322	45%	0.45	S	S	.	.	H	α-helix	trans	-66.9	-25	176.5	75.3	0	0	0	0	114.1	T627 A628	T627-S630 PolarHBondContact N-OG 3.28Å; T627-S630 PolarHBondContact O-N 2.9Å; T627-S630 VanDerWaalsContact O-N 3.12Å; T627-S630 PolarHBondContact O-OG 3.5Å; T627-S630 WeakPolarHBondContact OG1-CB 3.49Å; T627-S630 PolarHBondContact OG1-N 2.8Å; A628-S630 VanDerWaalsContact C-N 3.33Å; A628-S630 PolarHBondContact O-N 2.95Å
631	L	73.4	Confident	76.6	Confident	17 Å²	17	83.5 Å²	83.5	9%	0.089	45%	0.448	C	S	.	.	H	α-helix	trans	-78.8	-29.4	174.5	-64.8	176.9	0	0	0	112.3	L537 M540 I610 L626 T627 A628 E629	L537-L631 HydrophobicContact CD1-CD1 3.64Å; L537-L631 HydrophobicContact CD1-CG 4.44Å; L537-L631 HydrophobicContact CG-CD1 4.37Å; M540-L631 HydrophobicContact CB-CD1 3.96Å; I610-L631 HydrophobicContact CD1-CD2 3.54Å; I610-L631 HydrophobicContact CG1-CD2 3.98Å; I610-L631 HydrophobicContact CG2-CD2 4.21Å; L626-L631 HydrophobicContact CD2-CD2 4.26Å; T627-L631 PolarHBondContact O-N 3.47Å; A628-L631 WeakPolarHBondContact O-CB 3.4Å; A628-L631 PolarHBondContact O-N 3.07Å; A628-L631 VanDerWaalsContact O-N 3.14Å; E629-L631 VanDerWaalsContact C-N 3.28Å; E629-L631 PolarHBondContact O-N 3.16Å
632	E	67.2	Low	76.8	Confident	142 Å²	142	80.9 Å²	80.9	66%	0.664	43%	0.434	S	S	*	.	H	α-helix	trans	-87.7	-29.9	177.5	-65.7	-175.8	-171.7	0	0	112.1	M540 A628 E629 G634	M540-E632 HydrophobicContact CE-CG 4.49Å; A628-E632 PolarHBondContact O-N 3.33Å; E629-E632 PolarHBondContact O-N 3.47Å; E632-G634 PolarHBondContact O-N 3.14Å
633	A	62.2	Low	77.4	Confident	75 Å²	75	71.8 Å²	71.8	62%	0.62	39%	0.392	S	S	*	.			trans	-76.6	40.2	175	0	0	0	0	0	113.9	E629	E629-A633 WeakPolarHBondContact O-CB 3.46Å; E629-A633 PolarHBondContact O-N 3.25Å
634	G	56.4	Low	78.1	Confident	12 Å²	12	67.3 Å²	67.3	12%	0.124	37%	0.369	C	S	.	.			trans	-59.3	159.8	169.6	0	0	0	0	0	112	K607 E632	K607-G634 PolarHBondContact NZ-O 3.01Å; E632-G634 PolarHBondContact O-N 3.14Å
635	D	61	Low	78.8	Confident	82 Å²	82	64 Å²	64	44%	0.439	35%	0.347	S	S	.	.			trans	-47.2	158.2	-166	-49.5	-25	0	0	0	116.4	K607 S611 T637	K607-D635 VanDerWaalsContact CE-O 3.29Å; K607-D635 WeakPolarHBondContact CE-O 3.42Å; K607-D635 PolarHBondContact NZ-O 3.03Å; S611-D635 PolarHBondContact OG-OD1 3.23Å; D635-T637 HydrophobicContact CB-CG2 4.03Å; D635-T637 PolarHBondContact O-N 3.29Å
636	N	61.5	Low	79.7	Confident	171 Å²	171	55.3 Å²	55.3	91%	0.914	31%	0.306	S	S	*	.	S	Bend	trans	-71.1	23.3	174.4	-77.9	-35.4	0	0	0	114.2
637	T	71.7	Confident	80.5	Confident	81 Å²	81	52.9 Å²	52.9	50%	0.497	29%	0.294	S	S	.	.			trans	-69.3	129.3	174.6	51.5	0	0	0	0	111.2	D635 F639	D635-T637 HydrophobicContact CB-CG2 4.03Å; D635-T637 PolarHBondContact O-N 3.29Å; T637-F639 PolarHBondContact O-N 3.26Å
638	Q	80.4	Confident	81.2	Confident	106 Å²	106	49.6 Å²	49.6	50%	0.495	27%	0.274	S	S	.	.	S	Bend	trans	-71	-17.1	179.7	-61.3	-179.4	15.1	0	0	113.7	L46	L46-Q638 HydrophobicContact CD2-CB 4.44Å
639	F	88.1	Confident	82.1	Confident	37 Å²	37	47.5 Å²	47.5	16%	0.162	26%	0.256	C	S	.	.	S	Bend	trans	-156.4	156.4	-178.6	57.8	-95.4	0	0	0	111.1	L46 E47 F48 I604 T637 L644	L46-F639 HydrophobicContact CB-CD1 4.21Å; L46-F639 HydrophobicContact CB-CE1 4.42Å; L46-F639 HydrophobicContact CD2-CD1 4.23Å; E47-F639 WeakPolarHBondContact O-CE1 3.28Å; E47-F639 WeakPolarHBondContact O-CZ 3.38Å; F48-F639 HydrophobicContact CB-CE1 4.17Å; F48-F639 HydrophobicContact CB-CE2 4.17Å; F48-F639 HydrophobicContact CB-CZ 3.78Å; F48-F639 HydrophobicContact CD2-CD2 4.23Å; F48-F639 AromaticContact CD2-CE2 3.59Å; F48-F639 HydrophobicContact CD2-CE2 3.59Å; F48-F639 HydrophobicContact CD2-CZ 4.04Å; F48-F639 HydrophobicContact CG-CE2 4.35Å; F48-F639 HydrophobicContact CG-CZ 4.42Å; I604-F639 CarbonylContact O-C 3.59Å; I604-F639 VanDerWaalsContact O-CA 3.24Å; I604-F639 WeakPolarHBondContact O-CA 3.47Å; T637-F639 PolarHBondContact O-N 3.26Å; F639-L644 HydrophobicContact CB-CD2 4.45Å; F639-L644 HydrophobicContact CD1-CD2 4.47Å; F639-L644 HydrophobicContact CD2-CD2 3.93Å; F639-L644 HydrophobicContact CE2-CD2 4.4Å; F639-L644 HydrophobicContact CG-CD2 4.01Å
640	C	91.5	Very high	83.3	Confident	14 Å²	14	40 Å²	40	10%	0.095	22%	0.221	C	C	.	.			trans	-83.3	119.2	165.5	171.5	0	0	0	0	109.7	E551 I604 R642 N643 L644	E551-C640 PolarHBondContact OE2-SG 2.9Å; I604-C640 PolarHBondContact O-N 3.22Å; C640-R642 PolarHBondContact O-N 3.27Å; C640-N643 HydrophobicContact CB-CB 4.22Å; C640-N643 PolarHBondContact O-N 2.91Å; C640-L644 PolarHBondContact O-N 3.32Å
641	W	93.4	Very high	84.5	Confident	32 Å²	32	37.8 Å²	37.8	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-46.7	-178	-171.2	103.9	0	0	0	111.7	F48 D54 K555 N643 L644 F645	F48-W641 AromaticContact CD2-CD1 3.8Å; F48-W641 HydrophobicContact CD2-CG 4.42Å; F48-W641 AromaticContact CE2-CD1 3.4Å; F48-W641 HydrophobicContact CE2-CD2 4.1Å; F48-W641 AromaticContact CE2-CE2 3.92Å; F48-W641 AromaticContact CE2-CG 3.77Å; F48-W641 HydrophobicContact CE2-CG 3.77Å; F48-W641 AromaticContact CE2-NE1 3.45Å; D54-W641 HydrophobicContact CB-CD2 4Å; D54-W641 HydrophobicContact CB-CE3 3.94Å; D54-W641 HydrophobicContact CB-CH2 4.17Å; D54-W641 HydrophobicContact CB-CZ2 4.2Å; D54-W641 HydrophobicContact CB-CZ3 4.05Å; D54-W641 WeakPolarHBondContact OD2-CB 3.34Å; D54-W641 VanDerWaalsContact OD2-CD2 3.23Å; K555-W641 HydrophobicContact CD-CE3 4.49Å; K555-W641 HydrophobicContact CD-CZ3 4.06Å; W641-N643 VanDerWaalsContact C-N 3.29Å; W641-N643 PolarHBondContact O-N 2.93Å; W641-L644 PolarHBondContact O-N 2.98Å; W641-F645 HydrophobicContact CD2-CB 4.29Å; W641-F645 HydrophobicContact CE3-CB 3.83Å; W641-F645 HydrophobicContact CE3-CG 4.21Å; W641-F645 HydrophobicContact CH2-CB 3.96Å; W641-F645 HydrophobicContact CH2-CD1 4.07Å; W641-F645 AromaticContact CH2-CD2 3.36Å; W641-F645 HydrophobicContact CH2-CD2 3.36Å; W641-F645 HydrophobicContact CH2-CE1 4.35Å; W641-F645 AromaticContact CH2-CE2 3.74Å; W641-F645 HydrophobicContact CH2-CE2 3.74Å; W641-F645 AromaticContact CH2-CG 3.55Å; W641-F645 HydrophobicContact CH2-CG 3.55Å; W641-F645 HydrophobicContact CH2-CZ 4.21Å; W641-F645 HydrophobicContact CZ2-CB 4.41Å; W641-F645 AromaticContact CZ2-CD2 3.92Å; W641-F645 HydrophobicContact CZ2-CD2 3.92Å; W641-F645 HydrophobicContact CZ2-CE2 4.47Å; W641-F645 HydrophobicContact CZ2-CG 4.31Å; W641-F645 HydrophobicContact CZ3-CB 3.63Å; W641-F645 AromaticContact CZ3-CD1 3.73Å; W641-F645 HydrophobicContact CZ3-CD1 3.73Å; W641-F645 AromaticContact CZ3-CD2 3.84Å; W641-F645 HydrophobicContact CZ3-CD2 3.84Å; W641-F645 HydrophobicContact CZ3-CE1 4.26Å; W641-F645 HydrophobicContact CZ3-CE2 4.38Å; W641-F645 AromaticContact CZ3-CG 3.48Å; W641-F645 HydrophobicContact CZ3-CG 3.48Å; W641-F645 VanDerWaalsContact CZ3-CG 3.48Å; W641-F645 VanDerWaalsContact O-CB 3.27Å; W641-F645 WeakPolarHBondContact O-CB 3.33Å; W641-F645 PolarHBondContact O-N 3.26Å
642	R	94.3	Very high	85.6	Confident	21 Å²	21	38 Å²	38	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-50.7	-46.8	177.7	-61.6	-178.5	-72.3	-85.7	-0.4	112.5	E62 E551 K555 N608 S609 C640 S646	E62-R642 WeakPolarHBondContact OE1-CD 3.3Å; E62-R642 WeakPolarHBondContact OE1-CG 3.3Å; E62-R642 IonicContact OE1-NH1 2.63Å; E551-R642 HydrophobicContact CB-CB 4.36Å; E551-R642 IonicContact OE2-CZ 2.66Å; E551-R642 VanDerWaalsContact OE2-CZ 3.27Å; E551-R642 IonicContact OE2-NE 2.66Å; E551-R642 PolarHBondContact OE2-NE 2.91Å; E551-R642 IonicContact OE2-NH2 3.41Å; E551-R642 PolarHBondContact OE2-NH2 3.29Å; K555-R642 HydrophobicContact CB-CB 4.49Å; K555-R642 HydrophobicContact CD-CB 4.21Å; K555-R642 HydrophobicContact CD-CG 3.83Å; N608-R642 PolarHBondContact O-NH2 3.31Å; S609-R642 PolarHBondContact OG-NH1 2.7Å; S609-R642 PolarHBondContact OG-NH2 3.08Å; C640-R642 PolarHBondContact O-N 3.27Å; R642-S646 WeakPolarHBondContact O-CB 3.47Å; R642-S646 PolarHBondContact O-N 3.39Å; R642-S646 PolarHBondContact O-OG 3.09Å
643	N	95.3	Very high	87.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-74	-37.6	-173.5	-66.7	-9.1	0	0	0	111.4	E551 Y603 C640 W641 C647	E551-N643 WeakPolarHBondContact CB-OD1 3.45Å; E551-N643 VanDerWaalsContact CD-ND2 3.29Å; E551-N643 VanDerWaalsContact CD-OD1 3.22Å; E551-N643 WeakPolarHBondContact CG-OD1 3.39Å; E551-N643 PolarHBondContact OE1-ND2 3.4Å; Y603-N643 HydrophobicContact CD1-CB 4.13Å; Y603-N643 HydrophobicContact CE1-CB 3.65Å; Y603-N643 HydrophobicContact CE2-CB 4.09Å; Y603-N643 VanDerWaalsContact CE2-CG 3.42Å; Y603-N643 WeakPolarHBondContact CE2-ND2 3.31Å; Y603-N643 VanDerWaalsContact CZ-OD1 3.3Å; Y603-N643 PolarHBondContact O-ND2 2.94Å; Y603-N643 PolarHBondContact OH-OD1 3.32Å; C640-N643 HydrophobicContact CB-CB 4.22Å; C640-N643 PolarHBondContact O-N 2.91Å; W641-N643 VanDerWaalsContact C-N 3.29Å; W641-N643 PolarHBondContact O-N 2.93Å; N643-C647 WeakPolarHBondContact O-CB 3.44Å; N643-C647 PolarHBondContact O-N 3.46Å; N643-C647 PolarHBondContact O-SG 3.45Å; N643-C647 VanDerWaalsContact O-SG 3.37Å
644	L	95	Very high	88.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-72.3	-44.3	177.2	-174.7	48.5	0	0	0	111.9	L46 F48 I604 F639 C640 W641 C647 I648 V683 Q685 M688	L46-L644 HydrophobicContact CD1-CD2 4.23Å; F48-L644 HydrophobicContact CB-CD2 3.67Å; F48-L644 HydrophobicContact CD1-CD2 3.99Å; F48-L644 HydrophobicContact CD1-CG 4.04Å; F48-L644 HydrophobicContact CD2-CB 4.33Å; F48-L644 HydrophobicContact CD2-CD2 3.62Å; F48-L644 HydrophobicContact CD2-CG 3.97Å; F48-L644 HydrophobicContact CE1-CG 4.15Å; F48-L644 HydrophobicContact CE2-CB 4.13Å; F48-L644 HydrophobicContact CE2-CD2 4.21Å; F48-L644 HydrophobicContact CE2-CG 4.06Å; F48-L644 HydrophobicContact CG-CD2 3.48Å; F48-L644 VanDerWaalsContact CG-CD2 3.48Å; F48-L644 HydrophobicContact CG-CG 3.96Å; F48-L644 HydrophobicContact CZ-CB 4.44Å; F48-L644 HydrophobicContact CZ-CG 4.16Å; I604-L644 HydrophobicContact CG2-CB 4.49Å; F639-L644 HydrophobicContact CB-CD2 4.45Å; F639-L644 HydrophobicContact CD1-CD2 4.47Å; F639-L644 HydrophobicContact CD2-CD2 3.93Å; F639-L644 HydrophobicContact CE2-CD2 4.4Å; F639-L644 HydrophobicContact CG-CD2 4.01Å; C640-L644 PolarHBondContact O-N 3.32Å; W641-L644 PolarHBondContact O-N 2.98Å; L644-C647 PolarHBondContact O-N 2.84Å; L644-I648 HydrophobicContact CD1-CD1 4.19Å; L644-I648 HydrophobicContact CG-CD1 4.3Å; L644-I648 WeakPolarHBondContact O-CG1 3.34Å; L644-I648 PolarHBondContact O-N 2.9Å; L644-V683 HydrophobicContact CD1-CG1 4.17Å; L644-Q685 HydrophobicContact CD1-CB 4.38Å; L644-Q685 HydrophobicContact CD1-CG 4.41Å; L644-Q685 HydrophobicContact CD2-CG 4.29Å; L644-M688 HydrophobicContact CD1-SD 3.83Å
645	F	96.3	Very high	90.8	Very high	2 Å²	2	28 Å²	28	1%	0.009	14%	0.143	C	C	.	.	H	α-helix	trans	-56.1	-49.3	170.3	174.7	-102.8	0	0	0	111.5	F48 Y50 S51 W269 K555 A559 W641 C647 I648 N649	F48-F645 HydrophobicContact CZ-CB 4.14Å; Y50-F645 AromaticContact CD2-CD2 3.94Å; Y50-F645 HydrophobicContact CD2-CD2 3.94Å; Y50-F645 AromaticContact CE2-CD2 3.42Å; Y50-F645 HydrophobicContact CE2-CD2 3.42Å; Y50-F645 VanDerWaalsContact CE2-CD2 3.42Å; Y50-F645 AromaticContact CE2-CE2 3.75Å; Y50-F645 HydrophobicContact CE2-CE2 3.75Å; Y50-F645 HydrophobicContact CE2-CG 4.4Å; Y50-F645 AromaticContact CZ-CE2 3.86Å; S51-F645 WeakPolarHBondContact O-CE2 3.42Å; W269-F645 HydrophobicContact CH2-CE1 4.48Å; W269-F645 HydrophobicContact CZ2-CE1 4.25Å; W269-F645 HydrophobicContact CZ2-CZ 4.04Å; K555-F645 HydrophobicContact CB-CD1 4.46Å; K555-F645 HydrophobicContact CD-CD1 4.46Å; K555-F645 HydrophobicContact CG-CD1 3.87Å; K555-F645 HydrophobicContact CG-CE1 3.87Å; A559-F645 HydrophobicContact CB-CE1 4Å; A559-F645 HydrophobicContact CB-CZ 4.01Å; W641-F645 HydrophobicContact CD2-CB 4.29Å; W641-F645 HydrophobicContact CE3-CB 3.83Å; W641-F645 HydrophobicContact CE3-CG 4.21Å; W641-F645 HydrophobicContact CH2-CB 3.96Å; W641-F645 HydrophobicContact CH2-CD1 4.07Å; W641-F645 AromaticContact CH2-CD2 3.36Å; W641-F645 HydrophobicContact CH2-CD2 3.36Å; W641-F645 HydrophobicContact CH2-CE1 4.35Å; W641-F645 AromaticContact CH2-CE2 3.74Å; W641-F645 HydrophobicContact CH2-CE2 3.74Å; W641-F645 AromaticContact CH2-CG 3.55Å; W641-F645 HydrophobicContact CH2-CG 3.55Å; W641-F645 HydrophobicContact CH2-CZ 4.21Å; W641-F645 HydrophobicContact CZ2-CB 4.41Å; W641-F645 AromaticContact CZ2-CD2 3.92Å; W641-F645 HydrophobicContact CZ2-CD2 3.92Å; W641-F645 HydrophobicContact CZ2-CE2 4.47Å; W641-F645 HydrophobicContact CZ2-CG 4.31Å; W641-F645 HydrophobicContact CZ3-CB 3.63Å; W641-F645 AromaticContact CZ3-CD1 3.73Å; W641-F645 HydrophobicContact CZ3-CD1 3.73Å; W641-F645 AromaticContact CZ3-CD2 3.84Å; W641-F645 HydrophobicContact CZ3-CD2 3.84Å; W641-F645 HydrophobicContact CZ3-CE1 4.26Å; W641-F645 HydrophobicContact CZ3-CE2 4.38Å; W641-F645 AromaticContact CZ3-CG 3.48Å; W641-F645 HydrophobicContact CZ3-CG 3.48Å; W641-F645 VanDerWaalsContact CZ3-CG 3.48Å; W641-F645 VanDerWaalsContact O-CB 3.27Å; W641-F645 WeakPolarHBondContact O-CB 3.33Å; W641-F645 PolarHBondContact O-N 3.26Å; F645-C647 PolarHBondContact O-N 3.48Å; F645-I648 PolarHBondContact O-N 3.18Å; F645-N649 WeakPolarHBondContact CD1-ND2 3.13Å; F645-N649 WeakPolarHBondContact CE1-ND2 3.28Å; F645-N649 WeakPolarHBondContact CZ-ND2 3.25Å; F645-N649 WeakPolarHBondContact O-CB 3.21Å; F645-N649 VanDerWaalsContact O-CG 3.22Å; F645-N649 PolarHBondContact O-N 2.84Å; F645-N649 PolarHBondContact O-OD1 3Å
646	S	97.4	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-57.3	-48.5	175.7	-67.5	0	0	0	0	112.7	K555 R642 I648 N649 L650	K555-S646 VanDerWaalsContact CA-OG 3.29Å; K555-S646 WeakPolarHBondContact CA-OG 3.22Å; K555-S646 PolarHBondContact N-OG 3.49Å; R642-S646 WeakPolarHBondContact O-CB 3.47Å; R642-S646 PolarHBondContact O-N 3.39Å; R642-S646 PolarHBondContact O-OG 3.09Å; S646-I648 VanDerWaalsContact C-N 3.33Å; S646-I648 PolarHBondContact O-N 3.42Å; S646-N649 PolarHBondContact O-N 2.99Å; S646-L650 WeakPolarHBondContact O-CG 3.47Å; S646-L650 PolarHBondContact O-N 2.84Å
647	C	97.3	Very high	94.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.7	-45.9	176.3	-81.3	0	0	0	0	111.7	F596 N643 L644 F645 N649 L651 M688	F596-C647 HydrophobicContact CE1-CB 4.1Å; F596-C647 HydrophobicContact CZ-CB 3.87Å; F596-C647 WeakPolarHBondContact CZ-O 3.44Å; N643-C647 WeakPolarHBondContact O-CB 3.44Å; N643-C647 PolarHBondContact O-N 3.46Å; N643-C647 PolarHBondContact O-SG 3.45Å; N643-C647 VanDerWaalsContact O-SG 3.37Å; L644-C647 PolarHBondContact O-N 2.84Å; F645-C647 PolarHBondContact O-N 3.48Å; C647-N649 VanDerWaalsContact C-N 3.34Å; C647-N649 PolarHBondContact O-N 3.18Å; C647-L651 WeakPolarHBondContact O-CB 3.15Å; C647-L651 WeakPolarHBondContact O-CD1 3.33Å; C647-L651 VanDerWaalsContact O-CG 3.28Å; C647-L651 WeakPolarHBondContact O-CG 3.33Å; C647-L651 PolarHBondContact O-N 3.47Å; C647-M688 HydrophobicContact CB-CE 3.9Å; C647-M688 HydrophobicContact CB-SD 4Å
648	I	96.9	Very high	95.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.4	-41.8	177.4	-71.7	164.1	0	0	0	111	F48 Y50 L644 F645 S646 L651 R652 M687 M688	F48-I648 HydrophobicContact CD1-CD1 4.03Å; F48-I648 HydrophobicContact CE1-CD1 3.42Å; F48-I648 VanDerWaalsContact CE1-CD1 3.42Å; F48-I648 HydrophobicContact CZ-CD1 4.22Å; Y50-I648 HydrophobicContact CD2-CB 4.25Å; Y50-I648 HydrophobicContact CD2-CD1 4.1Å; Y50-I648 HydrophobicContact CD2-CG2 3.68Å; Y50-I648 HydrophobicContact CE2-CB 4.08Å; Y50-I648 HydrophobicContact CE2-CG2 3.46Å; Y50-I648 VanDerWaalsContact CE2-CG2 3.46Å; L644-I648 HydrophobicContact CD1-CD1 4.19Å; L644-I648 HydrophobicContact CG-CD1 4.3Å; L644-I648 WeakPolarHBondContact O-CG1 3.34Å; L644-I648 PolarHBondContact O-N 2.9Å; F645-I648 PolarHBondContact O-N 3.18Å; S646-I648 VanDerWaalsContact C-N 3.33Å; S646-I648 PolarHBondContact O-N 3.42Å; I648-L651 PolarHBondContact O-N 3.44Å; I648-R652 HydrophobicContact CG2-CG 4.45Å; I648-R652 WeakPolarHBondContact O-CB 3.34Å; I648-R652 WeakPolarHBondContact O-CG 3.42Å; I648-R652 PolarHBondContact O-N 2.75Å; I648-M687 HydrophobicContact CG2-CG 4.01Å; I648-M687 HydrophobicContact CG2-SD 3.66Å; I648-M688 HydrophobicContact CD1-CB 4.35Å; I648-M688 HydrophobicContact CG1-CB 3.78Å; I648-M688 HydrophobicContact CG1-CG 4.4Å
649	N	98.3	Very high	95.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.4	-50.2	179	-71.5	-11	0	0	0	112.5	Y50 S558 L562 F645 S646 C647 L651 R652 I653	Y50-N649 WeakPolarHBondContact CE2-OD1 3.36Å; Y50-N649 PolarHBondContact OH-OD1 2.97Å; S558-N649 WeakPolarHBondContact OG-CB 3.35Å; S558-N649 PolarHBondContact OG-ND2 2.98Å; L562-N649 HydrophobicContact CD2-CB 4.26Å; L562-N649 WeakPolarHBondContact CD2-OD1 3.16Å; F645-N649 WeakPolarHBondContact CD1-ND2 3.13Å; F645-N649 WeakPolarHBondContact CE1-ND2 3.28Å; F645-N649 WeakPolarHBondContact CZ-ND2 3.25Å; F645-N649 WeakPolarHBondContact O-CB 3.21Å; F645-N649 VanDerWaalsContact O-CG 3.22Å; F645-N649 PolarHBondContact O-N 2.84Å; F645-N649 PolarHBondContact O-OD1 3Å; S646-N649 PolarHBondContact O-N 2.99Å; C647-N649 VanDerWaalsContact C-N 3.34Å; C647-N649 PolarHBondContact O-N 3.18Å; N649-L651 VanDerWaalsContact C-N 3.29Å; N649-L651 PolarHBondContact O-N 3.41Å; N649-R652 CarbonylContact O-C 3.35Å; N649-R652 WeakPolarHBondContact O-CA 3.1Å; N649-R652 WeakPolarHBondContact O-CB 3.16Å; N649-R652 PolarHBondContact O-N 3.49Å; N649-I653 WeakPolarHBondContact O-CG1 3.24Å; N649-I653 PolarHBondContact O-N 2.83Å
650	L	98.3	Very high	95.6	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-62	-37.1	178.9	-63.6	175.2	0	0	0	111.3	L507 V554 I592 F595 F596 S646 I653 L654	L507-L650 HydrophobicContact CD2-CD2 4.03Å; V554-L650 HydrophobicContact CG1-CD1 4.41Å; I592-L650 HydrophobicContact CD1-CD2 4.49Å; I592-L650 HydrophobicContact CG1-CB 4.37Å; I592-L650 HydrophobicContact CG1-CD2 4.23Å; I592-L650 HydrophobicContact CG2-CB 4.11Å; F595-L650 HydrophobicContact CD1-CD1 3.63Å; F595-L650 HydrophobicContact CD2-CD1 4.23Å; F595-L650 HydrophobicContact CE1-CD1 3.67Å; F595-L650 HydrophobicContact CE2-CD1 4.26Å; F595-L650 HydrophobicContact CG-CD1 3.93Å; F595-L650 HydrophobicContact CZ-CD1 3.98Å; F596-L650 HydrophobicContact CE2-CB 4.05Å; S646-L650 WeakPolarHBondContact O-CG 3.47Å; S646-L650 PolarHBondContact O-N 2.84Å; L650-I653 HydrophobicContact CD2-CD1 4.35Å; L650-I653 PolarHBondContact O-N 3.23Å; L650-L654 WeakPolarHBondContact O-CB 3.21Å; L650-L654 PolarHBondContact O-N 2.81Å
651	L	98.2	Very high	95.5	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.6	-37.6	171.7	-72.3	164.3	0	0	0	112.8	F596 C647 I648 N649 L654 N655 L677 M688 V692 L695	F596-L651 HydrophobicContact CE1-CD1 4.19Å; F596-L651 HydrophobicContact CE1-CG 4.32Å; F596-L651 HydrophobicContact CE2-CD2 4.05Å; F596-L651 HydrophobicContact CE2-CG 3.8Å; F596-L651 HydrophobicContact CZ-CD1 3.79Å; F596-L651 HydrophobicContact CZ-CD2 4.09Å; F596-L651 HydrophobicContact CZ-CG 3.56Å; C647-L651 WeakPolarHBondContact O-CB 3.15Å; C647-L651 WeakPolarHBondContact O-CD1 3.33Å; C647-L651 VanDerWaalsContact O-CG 3.28Å; C647-L651 WeakPolarHBondContact O-CG 3.33Å; C647-L651 PolarHBondContact O-N 3.47Å; I648-L651 PolarHBondContact O-N 3.44Å; N649-L651 VanDerWaalsContact C-N 3.29Å; N649-L651 PolarHBondContact O-N 3.41Å; L651-L654 PolarHBondContact O-N 2.92Å; L651-N655 WeakPolarHBondContact O-CB 3.36Å; L651-N655 PolarHBondContact O-N 3Å; L651-N655 PolarHBondContact O-ND2 2.79Å; L651-L677 HydrophobicContact CD2-CD2 3.95Å; L651-M688 HydrophobicContact CD1-CE 4.22Å; L651-M688 HydrophobicContact CD1-CG 3.71Å; L651-V692 HydrophobicContact CD1-CG2 3.63Å; L651-V692 HydrophobicContact CD2-CG2 3.8Å; L651-V692 HydrophobicContact CG-CG2 4.38Å; L651-L695 HydrophobicContact CD2-CD1 3.83Å
652	R	98	Very high	95.3	Very high	20 Å²	20	22.2 Å²	22.2	8%	0.075	9%	0.094	C	C	.	.	H	α-helix	trans	-67.1	-38.6	175.1	-75.2	169.4	108	-161.2	19.1	112.1	Y50 F279 L562 I648 N649 K656 Y691	Y50-R652 PolarHBondContact OH-NH1 2.85Å; F279-R652 VanDerWaalsContact CE2-NH1 3.32Å; L562-R652 HydrophobicContact CD1-CB 3.7Å; L562-R652 HydrophobicContact CD2-CB 3.89Å; L562-R652 HydrophobicContact CD2-CG 4.46Å; L562-R652 HydrophobicContact CG-CB 4.49Å; I648-R652 HydrophobicContact CG2-CG 4.45Å; I648-R652 WeakPolarHBondContact O-CB 3.34Å; I648-R652 WeakPolarHBondContact O-CG 3.42Å; I648-R652 PolarHBondContact O-N 2.75Å; N649-R652 CarbonylContact O-C 3.35Å; N649-R652 WeakPolarHBondContact O-CA 3.1Å; N649-R652 WeakPolarHBondContact O-CB 3.16Å; N649-R652 PolarHBondContact O-N 3.49Å; R652-K656 WeakPolarHBondContact O-CG 3.46Å; R652-K656 PolarHBondContact O-N 3.27Å; R652-K656 VanDerWaalsContact O-N 3.1Å; R652-Y691 HydrophobicContact CG-CD1 4.06Å; R652-Y691 HydrophobicContact CG-CD2 3.58Å; R652-Y691 HydrophobicContact CG-CE1 3.86Å; R652-Y691 HydrophobicContact CG-CE2 3.38Å; R652-Y691 HydrophobicContact CG-CG 3.93Å; R652-Y691 PolarHBondContact NE-OH 2.78Å
653	I	98.6	Very high	94.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.5	-52.2	172.3	-68.1	161.5	0	0	0	109.7	L561 L562 L565 I592 N649 L650 N655 K656 L657	L561-I653 HydrophobicContact CB-CD1 3.64Å; L561-I653 HydrophobicContact CB-CG1 4.4Å; L561-I653 HydrophobicContact CD1-CD1 4.44Å; L562-I653 HydrophobicContact CB-CD1 4.31Å; L562-I653 HydrophobicContact CB-CG1 4.09Å; L562-I653 HydrophobicContact CD1-CG1 4.31Å; L565-I653 HydrophobicContact CD1-CG1 4.31Å; L565-I653 HydrophobicContact CD1-CG2 3.96Å; I592-I653 HydrophobicContact CD1-CB 4.34Å; I592-I653 HydrophobicContact CD1-CG2 3.95Å; N649-I653 WeakPolarHBondContact O-CG1 3.24Å; N649-I653 PolarHBondContact O-N 2.83Å; L650-I653 HydrophobicContact CD2-CD1 4.35Å; L650-I653 PolarHBondContact O-N 3.23Å; I653-N655 VanDerWaalsContact C-N 3.29Å; I653-N655 PolarHBondContact O-N 2.62Å; I653-K656 WeakPolarHBondContact O-CA 3.27Å; I653-K656 WeakPolarHBondContact O-CB 3.1Å; I653-K656 PolarHBondContact O-N 3.3Å; I653-L657 HydrophobicContact CG2-CD1 4.14Å; I653-L657 HydrophobicContact CG2-CG 4.31Å; I653-L657 WeakPolarHBondContact O-CG 3.39Å; I653-L657 PolarHBondContact O-N 2.83Å
654	L	98.1	Very high	94.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58.9	-40.1	-179.8	-170.1	58.1	0	0	0	112.2	I589 I592 L593 L650 L651 K656 L657 T658 L668 L695	I589-L654 HydrophobicContact CB-CD1 4.23Å; I589-L654 HydrophobicContact CG1-CD1 3.81Å; I589-L654 HydrophobicContact CG2-CD1 4.11Å; I592-L654 HydrophobicContact CD1-CB 4.24Å; I592-L654 HydrophobicContact CG2-CB 4.27Å; I592-L654 HydrophobicContact CG2-CD2 3.86Å; L593-L654 HydrophobicContact CD2-CD2 3.98Å; L650-L654 WeakPolarHBondContact O-CB 3.21Å; L650-L654 PolarHBondContact O-N 2.81Å; L651-L654 PolarHBondContact O-N 2.92Å; L654-K656 VanDerWaalsContact C-N 3.34Å; L654-K656 PolarHBondContact O-N 2.76Å; L654-L657 PolarHBondContact O-N 3.31Å; L654-T658 HydrophobicContact CD1-CG2 4.48Å; L654-T658 PolarHBondContact O-N 2.81Å; L654-T658 PolarHBondContact O-OG1 2.73Å; L654-L668 HydrophobicContact CD1-CD2 3.97Å; L654-L668 HydrophobicContact CD2-CD2 4.25Å; L654-L668 HydrophobicContact CG-CD2 4.3Å; L654-L695 HydrophobicContact CB-CD1 4.2Å; L654-L695 HydrophobicContact CB-CD2 4.48Å; L654-L695 HydrophobicContact CD2-CD1 3.79Å; L654-L695 HydrophobicContact CD2-CD2 4.37Å; L654-L695 HydrophobicContact CG-CD1 4.01Å; L654-L695 HydrophobicContact CG-CD2 3.92Å
655	N	97.6	Very high	94.6	Very high	21 Å²	21	22.9 Å²	22.9	11%	0.112	10%	0.101	C	C	.	.	H	α-helix	trans	-59.5	-40.4	170.8	-92	-102.3	0	0	0	113	L651 I653 K659 Y691 K694 L695	L651-N655 WeakPolarHBondContact O-CB 3.36Å; L651-N655 PolarHBondContact O-N 3Å; L651-N655 PolarHBondContact O-ND2 2.79Å; I653-N655 VanDerWaalsContact C-N 3.29Å; I653-N655 PolarHBondContact O-N 2.62Å; N655-K659 WeakPolarHBondContact O-CB 3.43Å; N655-K659 PolarHBondContact O-N 3.07Å; N655-K659 VanDerWaalsContact O-N 3.16Å; N655-Y691 HydrophobicContact CB-CD1 4.26Å; N655-Y691 PolarHBondContact ND2-O 3.05Å; N655-K694 WeakPolarHBondContact OD1-CB 3.21Å; N655-L695 WeakPolarHBondContact ND2-CD1 3.44Å; N655-L695 WeakPolarHBondContact ND2-CG 3.19Å
656	K	97.2	Very high	94.2	Very high	46 Å²	46	23.5 Å²	23.5	20%	0.2	10%	0.104	C	C	.	.	H	α-helix	trans	-69.3	-40.7	179.9	-82.2	165.3	161.3	-74.5	0	112	L562 L565 F576 R652 I653 L654	L562-K656 HydrophobicContact CD1-CD 3.86Å; L565-K656 HydrophobicContact CB-CD 4.02Å; L565-K656 PolarHBondContact O-NZ 2.67Å; F576-K656 HydrophobicContact CE2-CB 4.21Å; F576-K656 HydrophobicContact CZ-CB 4.4Å; R652-K656 WeakPolarHBondContact O-CG 3.46Å; R652-K656 PolarHBondContact O-N 3.27Å; R652-K656 VanDerWaalsContact O-N 3.1Å; I653-K656 WeakPolarHBondContact O-CA 3.27Å; I653-K656 WeakPolarHBondContact O-CB 3.1Å; I653-K656 PolarHBondContact O-N 3.3Å; L654-K656 VanDerWaalsContact C-N 3.34Å; L654-K656 PolarHBondContact O-N 2.76Å
657	L	96.9	Very high	93.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.4	-38.4	-178.5	-63.7	-178.6	0	0	0	112.2	L565 A580 L583 V584 C588 I589 I653 L654 R664	L565-L657 HydrophobicContact CD1-CD2 4.44Å; A580-L657 HydrophobicContact CB-CD2 3.68Å; L583-L657 HydrophobicContact CB-CD1 4.4Å; L583-L657 HydrophobicContact CB-CD2 4.22Å; L583-L657 HydrophobicContact CD1-CD2 4.2Å; V584-L657 HydrophobicContact CG2-CB 4.28Å; V584-L657 HydrophobicContact CG2-CD1 4.25Å; V584-L657 HydrophobicContact CG2-CD2 4.32Å; C588-L657 HydrophobicContact CB-CD1 4.12Å; I589-L657 HydrophobicContact CD1-CB 4.47Å; I589-L657 HydrophobicContact CG1-CD1 4.12Å; I653-L657 HydrophobicContact CG2-CD1 4.14Å; I653-L657 HydrophobicContact CG2-CG 4.31Å; I653-L657 WeakPolarHBondContact O-CG 3.39Å; I653-L657 PolarHBondContact O-N 2.83Å; L654-L657 PolarHBondContact O-N 3.31Å; L657-R664 WeakPolarHBondContact O-CD 3.21Å; L657-R664 PolarHBondContact O-NH1 3.36Å
658	T	94.4	Very high	93.6	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.012	12%	0.115	C	C	.	.	H	α-helix	trans	-99	-20	-172.4	66.7	0	0	0	0	115.6	I589 L654 W660 K661 R664 T665 L668	I589-T658 HydrophobicContact CD1-CG2 3.91Å; L654-T658 HydrophobicContact CD1-CG2 4.48Å; L654-T658 PolarHBondContact O-N 2.81Å; L654-T658 PolarHBondContact O-OG1 2.73Å; T658-W660 PolarHBondContact O-N 3.47Å; T658-K661 PolarHBondContact O-N 2.99Å; T658-R664 HydrophobicContact CG2-CB 4.15Å; T658-R664 WeakPolarHBondContact CG2-O 3.39Å; T658-T665 PolarHBondContact O-OG1 3.45Å; T658-L668 HydrophobicContact CG2-CD1 3.87Å; T658-L668 HydrophobicContact CG2-CD2 4.32Å; T658-L668 HydrophobicContact CG2-CG 4.01Å
659	K	91.7	Very high	93.3	Very high	131 Å²	131	27.3 Å²	27.3	57%	0.57	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	120.2	-178.8	172.9	-173.3	173.1	-164	0	111.7	N655 K661	N655-K659 WeakPolarHBondContact O-CB 3.43Å; N655-K659 PolarHBondContact O-N 3.07Å; N655-K659 VanDerWaalsContact O-N 3.16Å; K659-K661 VanDerWaalsContact C-N 3.27Å; K659-K661 PolarHBondContact O-N 3.3Å
660	W	83.4	Confident	92.9	Very high	134 Å²	134	31.4 Å²	31.4	51%	0.508	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	28.8	-176.7	-53.8	124.6	0	0	0	114.7	T658 R725	T658-W660 PolarHBondContact O-N 3.47Å; W660-R725 VanDerWaalsContact CZ2-NH2 3.27Å
661	K	89.7	Confident	92.6	Very high	30 Å²	30	35.6 Å²	35.6	13%	0.13	17%	0.168	C	C	.	.			trans	-125.4	105.9	172.2	-55.6	-69.4	175.9	178.3	0	108.3	E577 T658 K659 R664 T665 L750	E577-K661 VanDerWaalsContact CD-CE 3.5Å; E577-K661 WeakPolarHBondContact OE1-CE 3.49Å; E577-K661 IonicContact OE1-NZ 3.3Å; E577-K661 PolarHBondContact OE1-NZ 3.42Å; E577-K661 WeakPolarHBondContact OE2-CE 3.35Å; E577-K661 IonicContact OE2-NZ 3.31Å; E577-K661 PolarHBondContact OE2-NZ 2.97Å; E577-K661 VanDerWaalsContact OE2-NZ 3.1Å; T658-K661 PolarHBondContact O-N 2.99Å; K659-K661 VanDerWaalsContact C-N 3.27Å; K659-K661 PolarHBondContact O-N 3.3Å; K661-R664 HydrophobicContact CB-CB 3.91Å; K661-R664 HydrophobicContact CB-CG 3.88Å; K661-R664 PolarHBondContact O-N 2.95Å; K661-T665 WeakPolarHBondContact O-CB 3.5Å; K661-T665 PolarHBondContact O-N 3.32Å; K661-T665 PolarHBondContact O-OG1 3.37Å; K661-L750 HydrophobicContact CD-CD2 4.43Å
662	H	87.9	Confident	92.4	Very high	58 Å²	58	43.4 Å²	43.4	27%	0.269	20%	0.202	S	C	.	.	H	α-helix	trans	-67.1	-47.4	-173.9	-69.5	121	0	0	0	111.7	R664 T665 M666 F743 E746	H662-R664 PolarHBondContact O-N 3.14Å; H662-T665 CarbonylContact O-C 3.29Å; H662-T665 WeakPolarHBondContact O-CA 3.44Å; H662-T665 WeakPolarHBondContact O-CB 3.18Å; H662-T665 PolarHBondContact O-N 3.39Å; H662-M666 PolarHBondContact O-N 2.95Å; H662-F743 HydrophobicContact CB-CB 4.28Å; H662-F743 HydrophobicContact CB-CD1 3.32Å; H662-F743 HydrophobicContact CB-CD2 3.79Å; H662-F743 HydrophobicContact CB-CE1 3.45Å; H662-F743 VanDerWaalsContact CB-CE1 3.45Å; H662-F743 HydrophobicContact CB-CE2 3.92Å; H662-F743 HydrophobicContact CB-CG 3.49Å; H662-F743 VanDerWaalsContact CB-CG 3.49Å; H662-F743 HydrophobicContact CB-CZ 3.75Å; H662-F743 AromaticContact CG-CD1 3.96Å; H662-F743 AromaticContact CG-CE1 3.74Å; H662-F743 AromaticContact ND1-CE1 3.88Å; H662-E746 IonicContact ND1-OE1 3.21Å; H662-E746 PolarHBondContact ND1-OE1 3.17Å; H662-E746 IonicContact ND1-OE2 2.83Å
663	S	87.3	Confident	92.3	Very high	24 Å²	24	42.5 Å²	42.5	17%	0.168	20%	0.198	C	C	.	.	H	α-helix	trans	-48.4	-55.2	172.5	-179.8	0	0	0	0	112.1	T665 M666 M667	S663-T665 VanDerWaalsContact C-N 3.26Å; S663-T665 PolarHBondContact O-N 2.95Å; S663-M666 WeakPolarHBondContact O-CB 3.35Å; S663-M666 PolarHBondContact O-N 3.24Å; S663-M666 VanDerWaalsContact O-N 3.1Å; S663-M667 PolarHBondContact O-N 3.14Å
664	R	91.9	Very high	92.1	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-67.6	-23.8	-178.9	-52.1	174.7	-164.4	172.7	5.4	113.3	E577 V584 I589 L657 T658 K661 H662 E747	E577-R664 IonicContact OE2-CZ 2.7Å; E577-R664 IonicContact OE2-NH1 3.57Å; E577-R664 PolarHBondContact OE2-NH1 2.78Å; E577-R664 IonicContact OE2-NH2 2.67Å; V584-R664 HydrophobicContact CG1-CG 4.46Å; I589-R664 HydrophobicContact CD1-CB 4.23Å; L657-R664 WeakPolarHBondContact O-CD 3.21Å; L657-R664 PolarHBondContact O-NH1 3.36Å; T658-R664 HydrophobicContact CG2-CB 4.15Å; T658-R664 WeakPolarHBondContact CG2-O 3.39Å; K661-R664 HydrophobicContact CB-CB 3.91Å; K661-R664 HydrophobicContact CB-CG 3.88Å; K661-R664 PolarHBondContact O-N 2.95Å; H662-R664 PolarHBondContact O-N 3.14Å; R664-E747 IonicContact CZ-OE1 3.85Å; R664-E747 VanDerWaalsContact CZ-OE1 3.3Å; R664-E747 IonicContact CZ-OE2 3.55Å; R664-E747 IonicContact NE-OE1 2.78Å; R664-E747 PolarHBondContact NE-OE1 2.92Å; R664-E747 IonicContact NE-OE2 3.53Å; R664-E747 IonicContact NH2-OE1 3.06Å; R664-E747 PolarHBondContact NH2-OE1 2.8Å; R664-E747 IonicContact NH2-OE2 2.76Å; R664-E747 PolarHBondContact NH2-OE2 3.19Å
665	T	91.5	Very high	91.9	Very high	8 Å²	8	46.3 Å²	46.3	5%	0.049	22%	0.224	C	C	.	.	H	α-helix	trans	-77.2	-38.9	171.9	-57.1	0	0	0	0	111.2	T658 K661 H662 S663 M667 L668 V669 V698 Q699 Y702	T658-T665 PolarHBondContact O-OG1 3.45Å; K661-T665 WeakPolarHBondContact O-CB 3.5Å; K661-T665 PolarHBondContact O-N 3.32Å; K661-T665 PolarHBondContact O-OG1 3.37Å; H662-T665 CarbonylContact O-C 3.29Å; H662-T665 WeakPolarHBondContact O-CA 3.44Å; H662-T665 WeakPolarHBondContact O-CB 3.18Å; H662-T665 PolarHBondContact O-N 3.39Å; S663-T665 VanDerWaalsContact C-N 3.26Å; S663-T665 PolarHBondContact O-N 2.95Å; T665-M667 VanDerWaalsContact C-N 3.28Å; T665-M667 PolarHBondContact O-N 3.17Å; T665-L668 VanDerWaalsContact O-CB 3.31Å; T665-L668 WeakPolarHBondContact O-CB 3.49Å; T665-L668 PolarHBondContact O-N 2.92Å; T665-V669 PolarHBondContact O-N 2.85Å; T665-V698 HydrophobicContact CG2-CB 3.95Å; T665-V698 HydrophobicContact CG2-CG2 3.91Å; T665-V698 VanDerWaalsContact CG2-O 3.31Å; T665-V698 WeakPolarHBondContact CG2-O 3.48Å; T665-Q699 HydrophobicContact CG2-CG 4.47Å; T665-Y702 HydrophobicContact CG2-CD2 4.34Å; T665-Y702 HydrophobicContact CG2-CE2 3.87Å
666	M	87.8	Confident	91.8	Very high	16 Å²	16	46.2 Å²	46.2	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-35.3	171.7	-72.5	-61.5	-71.5	0	0	111.9	H662 S663 L668 V669 V670 Y702 A738 P740 F743	H662-M666 PolarHBondContact O-N 2.95Å; S663-M666 WeakPolarHBondContact O-CB 3.35Å; S663-M666 PolarHBondContact O-N 3.24Å; S663-M666 VanDerWaalsContact O-N 3.1Å; M666-L668 VanDerWaalsContact C-N 3.29Å; M666-L668 PolarHBondContact O-N 2.78Å; M666-V669 WeakPolarHBondContact O-CB 3.5Å; M666-V669 PolarHBondContact O-N 3.26Å; M666-V670 WeakPolarHBondContact O-CG2 3.41Å; M666-V670 PolarHBondContact O-N 3.16Å; M666-Y702 HydrophobicContact CG-CE1 4.49Å; M666-Y702 HydrophobicContact CG-CE2 4.49Å; M666-Y702 HydrophobicContact SD-CD1 3.49Å; M666-Y702 WeakPolarHBondContact SD-CD1 3.45Å; M666-Y702 HydrophobicContact SD-CD2 3.86Å; M666-Y702 HydrophobicContact SD-CE1 3.47Å; M666-Y702 WeakPolarHBondContact SD-CE1 3.25Å; M666-Y702 HydrophobicContact SD-CE2 3.85Å; M666-Y702 HydrophobicContact SD-CG 3.67Å; M666-A738 WeakPolarHBondContact CE-O 3.42Å; M666-P740 HydrophobicContact CB-CB 4.42Å; M666-P740 HydrophobicContact CE-CG 4.23Å; M666-F743 HydrophobicContact CG-CD2 4.49Å; M666-F743 HydrophobicContact CG-CE2 4.28Å
667	M	89.8	Confident	91.8	Very high	45 Å²	45	44 Å²	44	22%	0.222	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-42.5	170.4	-65	173.6	75.9	0	0	112.1	V584 I589 S663 T665 V669 V670 F671	V584-M667 HydrophobicContact CG1-CE 4.21Å; V584-M667 HydrophobicContact CG1-SD 4.1Å; I589-M667 HydrophobicContact CD1-SD 4.33Å; S663-M667 PolarHBondContact O-N 3.14Å; T665-M667 VanDerWaalsContact C-N 3.28Å; T665-M667 PolarHBondContact O-N 3.17Å; M667-V669 PolarHBondContact O-N 2.71Å; M667-V670 PolarHBondContact O-N 3.01Å; M667-F671 HydrophobicContact CB-CD2 4.28Å; M667-F671 HydrophobicContact CB-CE2 4.29Å; M667-F671 HydrophobicContact CE-CE2 4.19Å; M667-F671 WeakPolarHBondContact O-CB 3.27Å; M667-F671 WeakPolarHBondContact O-CD2 3.43Å; M667-F671 PolarHBondContact O-N 3.06Å
668	L	92.8	Very high	91.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-33.3	176.9	-65.1	178.7	0	0	0	113	I589 L593 L654 T658 T665 M666 K672 S673 L695 V698 Q699	I589-L668 HydrophobicContact CG2-CD2 3.93Å; L593-L668 HydrophobicContact CD1-CD2 4.18Å; L654-L668 HydrophobicContact CD1-CD2 3.97Å; L654-L668 HydrophobicContact CD2-CD2 4.25Å; L654-L668 HydrophobicContact CG-CD2 4.3Å; T658-L668 HydrophobicContact CG2-CD1 3.87Å; T658-L668 HydrophobicContact CG2-CD2 4.32Å; T658-L668 HydrophobicContact CG2-CG 4.01Å; T665-L668 VanDerWaalsContact O-CB 3.31Å; T665-L668 WeakPolarHBondContact O-CB 3.49Å; T665-L668 PolarHBondContact O-N 2.92Å; M666-L668 VanDerWaalsContact C-N 3.29Å; M666-L668 PolarHBondContact O-N 2.78Å; L668-K672 PolarHBondContact O-N 2.79Å; L668-S673 WeakPolarHBondContact O-CB 3.44Å; L668-S673 PolarHBondContact O-N 2.83Å; L668-S673 PolarHBondContact O-OG 3.16Å; L668-L695 HydrophobicContact CD1-CD2 3.91Å; L668-V698 HydrophobicContact CD1-CG2 4.49Å; L668-Q699 HydrophobicContact CB-CG 4.1Å; L668-Q699 HydrophobicContact CD1-CG 4.36Å; L668-Q699 PolarHBondContact O-OE1 2.69Å
669	V	90.5	Very high	91.5	Very high	35 Å²	35	51.8 Å²	51.8	21%	0.212	24%	0.243	C	C	.	.	H	α-helix	trans	-75.1	-46.6	178.2	-176.3	0	0	0	0	110	T665 M666 M667 F671 K672 Q699 Y702	T665-V669 PolarHBondContact O-N 2.85Å; M666-V669 WeakPolarHBondContact O-CB 3.5Å; M666-V669 PolarHBondContact O-N 3.26Å; M667-V669 PolarHBondContact O-N 2.71Å; V669-F671 PolarHBondContact O-N 3.4Å; V669-K672 WeakPolarHBondContact O-CA 3.31Å; V669-K672 PolarHBondContact O-N 3.28Å; V669-Q699 HydrophobicContact CG2-CB 4.34Å; V669-Q699 HydrophobicContact CG2-CG 3.99Å; V669-Y702 HydrophobicContact CG2-CD2 3.98Å; V669-Y702 HydrophobicContact CG2-CG 4.25Å
670	V	89.1	Confident	91.6	Very high	86 Å²	86	45.5 Å²	45.5	52%	0.521	22%	0.216	S	C	.	.	H	α-helix	trans	-59.2	-44.5	176.6	171.5	0	0	0	0	111.4	M666 M667 K672 P740	M666-V670 WeakPolarHBondContact O-CG2 3.41Å; M666-V670 PolarHBondContact O-N 3.16Å; M667-V670 PolarHBondContact O-N 3.01Å; V670-K672 PolarHBondContact O-N 2.89Å; V670-K672 VanDerWaalsContact O-N 3.14Å; V670-P740 HydrophobicContact CG2-CG 4.04Å
671	F	92.4	Very high	92	Very high	90 Å²	90	39.4 Å²	39.4	40%	0.395	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	11.1	174	-67.6	-61	0	0	0	114.1	P590 L593 M667 V669 S673	P590-F671 HydrophobicContact CG-CD2 4.26Å; P590-F671 HydrophobicContact CG-CE1 4.17Å; P590-F671 HydrophobicContact CG-CE2 3.69Å; P590-F671 HydrophobicContact CG-CZ 3.65Å; L593-F671 HydrophobicContact CD1-CB 3.6Å; L593-F671 HydrophobicContact CD1-CG 4.39Å; M667-F671 HydrophobicContact CB-CD2 4.28Å; M667-F671 HydrophobicContact CB-CE2 4.29Å; M667-F671 HydrophobicContact CE-CE2 4.19Å; M667-F671 WeakPolarHBondContact O-CB 3.27Å; M667-F671 WeakPolarHBondContact O-CD2 3.43Å; M667-F671 PolarHBondContact O-N 3.06Å; V669-F671 PolarHBondContact O-N 3.4Å; F671-S673 VanDerWaalsContact C-N 3.26Å; F671-S673 PolarHBondContact O-N 3.4Å
672	K	93.8	Very high	92	Very high	164 Å²	164	42.5 Å²	42.5	71%	0.713	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	44	176.5	-59.9	178.5	-178	175.8	0	112.4	L668 V669 V670 A674 P675	L668-K672 PolarHBondContact O-N 2.79Å; V669-K672 WeakPolarHBondContact O-CA 3.31Å; V669-K672 PolarHBondContact O-N 3.28Å; V670-K672 PolarHBondContact O-N 2.89Å; V670-K672 VanDerWaalsContact O-N 3.14Å; K672-A674 VanDerWaalsContact C-N 3.34Å; K672-A674 PolarHBondContact O-N 3.23Å; K672-P675 WeakPolarHBondContact O-CD 3.32Å
673	S	95.8	Very high	92.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.9	-27.5	-172.8	76.7	0	0	0	0	113.9	L593 L668 F671 I676 L677 Q699	L593-S673 VanDerWaalsContact CD2-CB 3.45Å; L668-S673 WeakPolarHBondContact O-CB 3.44Å; L668-S673 PolarHBondContact O-N 2.83Å; L668-S673 PolarHBondContact O-OG 3.16Å; F671-S673 VanDerWaalsContact C-N 3.26Å; F671-S673 PolarHBondContact O-N 3.4Å; S673-I676 WeakPolarHBondContact O-CA 3.43Å; S673-I676 WeakPolarHBondContact O-CB 3.41Å; S673-I676 PolarHBondContact O-N 3.03Å; S673-L677 WeakPolarHBondContact O-CB 3.45Å; S673-L677 WeakPolarHBondContact O-CG 3.47Å; S673-L677 PolarHBondContact O-N 3.17Å; S673-Q699 VanDerWaalsContact OG-CD 3.24Å; S673-Q699 PolarHBondContact OG-NE2 2.96Å; S673-Q699 PolarHBondContact OG-OE1 2.94Å
674	A	94.8	Very high	92	Very high	1 Å²	1	40 Å²	40	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-43.4	-172.6	0	0	0	0	0	114.2	K672 K678 L696 L703 W707	K672-A674 VanDerWaalsContact C-N 3.34Å; K672-A674 PolarHBondContact O-N 3.23Å; A674-K678 VanDerWaalsContact O-CB 3.25Å; A674-K678 WeakPolarHBondContact O-CB 3.19Å; A674-K678 PolarHBondContact O-N 3.16Å; A674-L696 HydrophobicContact CB-CD2 3.87Å; A674-L703 HydrophobicContact CB-CD1 3.76Å; A674-L703 HydrophobicContact CB-CD2 4.1Å; A674-W707 HydrophobicContact CB-CZ2 4.29Å
675	P	94.4	Very high	91.9	Very high	80 Å²	80	40.7 Å²	40.7	52%	0.519	20%	0.196	S	C	.	.	H	α-helix	trans	-58.7	-40	167.4	-28.6	35	0	0	0	115.1	K672 K678 R679	K672-P675 WeakPolarHBondContact O-CD 3.32Å; P675-K678 PolarHBondContact O-N 3.23Å; P675-R679 PolarHBondContact O-N 3.14Å
676	I	95.4	Very high	91.8	Very high	18 Å²	18	41.1 Å²	41.1	9%	0.092	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-52.2	179.5	-56	176.4	0	0	0	109.3	L593 F596 N597 S673 K678 R679 A680	L593-I676 HydrophobicContact CB-CD1 4.5Å; F596-I676 VanDerWaalsContact C-CG2 3.47Å; F596-I676 HydrophobicContact CB-CG2 3.66Å; F596-I676 VanDerWaalsContact O-CG2 3.27Å; F596-I676 WeakPolarHBondContact O-CG2 3.07Å; N597-I676 HydrophobicContact CB-CD1 4.27Å; N597-I676 HydrophobicContact CB-CG2 4.48Å; S673-I676 WeakPolarHBondContact O-CA 3.43Å; S673-I676 WeakPolarHBondContact O-CB 3.41Å; S673-I676 PolarHBondContact O-N 3.03Å; I676-K678 PolarHBondContact O-N 3.33Å; I676-R679 PolarHBondContact O-N 2.96Å; I676-R679 VanDerWaalsContact O-N 3.17Å; I676-A680 PolarHBondContact O-N 3.29Å
677	L	96.2	Very high	91.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-41.7	175.8	-70.6	170.7	0	0	0	112.1	L651 S673 R679 A680 L681 V692 L695 L696	L651-L677 HydrophobicContact CD2-CD2 3.95Å; S673-L677 WeakPolarHBondContact O-CB 3.45Å; S673-L677 WeakPolarHBondContact O-CG 3.47Å; S673-L677 PolarHBondContact O-N 3.17Å; L677-R679 VanDerWaalsContact C-N 3.28Å; L677-R679 PolarHBondContact O-N 3.18Å; L677-A680 WeakPolarHBondContact O-CB 3.4Å; L677-A680 PolarHBondContact O-N 3.39Å; L677-L681 PolarHBondContact O-N 3.22Å; L677-V692 HydrophobicContact CB-CG1 3.94Å; L677-V692 HydrophobicContact CD2-CG1 4.27Å; L677-V692 WeakPolarHBondContact O-CG1 3.18Å; L677-L695 HydrophobicContact CD1-CB 3.72Å; L677-L695 HydrophobicContact CD2-CB 4.39Å; L677-L695 HydrophobicContact CD2-CD1 3.93Å; L677-L696 HydrophobicContact CB-CD1 4.46Å; L677-L696 HydrophobicContact CB-CD2 3.89Å; L677-L696 HydrophobicContact CB-CG 4.13Å; L677-L696 HydrophobicContact CD1-CD2 4.29Å
678	K	93.4	Very high	92.1	Very high	47 Å²	47	38.7 Å²	38.7	20%	0.204	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-35	176	-173.9	-177	176.1	-178.6	0	112.4	P315 A674 P675 I676 L681 N711	P315-K678 HydrophobicContact CB-CG 4.31Å; P315-K678 HydrophobicContact CG-CG 3.78Å; A674-K678 VanDerWaalsContact O-CB 3.25Å; A674-K678 WeakPolarHBondContact O-CB 3.19Å; A674-K678 PolarHBondContact O-N 3.16Å; P675-K678 PolarHBondContact O-N 3.23Å; I676-K678 PolarHBondContact O-N 3.33Å; K678-L681 WeakPolarHBondContact O-CB 3.48Å; K678-L681 PolarHBondContact O-N 3.06Å; K678-N711 WeakPolarHBondContact CD-OD1 3.45Å; K678-N711 VanDerWaalsContact CE-OD1 3.3Å; K678-N711 WeakPolarHBondContact CE-OD1 3.23Å; K678-N711 PolarHBondContact NZ-OD1 3.47Å
679	R	92.4	Very high	92.1	Very high	118 Å²	118	38.9 Å²	38.9	45%	0.445	19%	0.189	S	C	.	.	H	α-helix	trans	-68.9	-37.6	172.9	-68.4	-176	-56.5	-173.1	1.1	112.1	N597 P675 I676 L677 L681 K682	N597-R679 PolarHBondContact OD1-NH2 3.34Å; P675-R679 PolarHBondContact O-N 3.14Å; I676-R679 PolarHBondContact O-N 2.96Å; I676-R679 VanDerWaalsContact O-N 3.17Å; L677-R679 VanDerWaalsContact C-N 3.28Å; L677-R679 PolarHBondContact O-N 3.18Å; R679-L681 PolarHBondContact O-N 2.96Å; R679-K682 WeakPolarHBondContact O-CB 3.31Å; R679-K682 PolarHBondContact O-N 3.17Å
680	A	93.3	Very high	92.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-23.2	177.1	0	0	0	0	0	113.2	F596 I676 L677 K682 V683 M688 V692	F596-A680 HydrophobicContact CD1-CB 4.24Å; I676-A680 PolarHBondContact O-N 3.29Å; L677-A680 WeakPolarHBondContact O-CB 3.4Å; L677-A680 PolarHBondContact O-N 3.39Å; A680-K682 PolarHBondContact O-N 3.44Å; A680-V683 PolarHBondContact O-N 3.07Å; A680-M688 HydrophobicContact CB-CE 4.28Å; A680-V692 HydrophobicContact CB-CG2 4.05Å
681	L	92.3	Very high	92.6	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.031	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.1	171	-65.1	177.7	0	0	0	114.3	P315 L677 K678 R679 V683 Q689 V692 L693 L696 T714	P315-L681 HydrophobicContact CG-CB 3.99Å; P315-L681 HydrophobicContact CG-CD1 4.02Å; L677-L681 PolarHBondContact O-N 3.22Å; K678-L681 WeakPolarHBondContact O-CB 3.48Å; K678-L681 PolarHBondContact O-N 3.06Å; R679-L681 PolarHBondContact O-N 2.96Å; L681-V683 PolarHBondContact O-N 3.38Å; L681-Q689 HydrophobicContact CD2-CB 4.14Å; L681-Q689 HydrophobicContact CD2-CG 4.15Å; L681-Q689 PolarHBondContact O-NE2 2.99Å; L681-V692 HydrophobicContact CD1-CG1 4.49Å; L681-V692 HydrophobicContact CD2-CB 3.73Å; L681-V692 HydrophobicContact CD2-CG1 3.46Å; L681-V692 VanDerWaalsContact CD2-CG1 3.46Å; L681-V692 HydrophobicContact CG-CB 4.47Å; L681-V692 HydrophobicContact CG-CG1 3.68Å; L681-L693 HydrophobicContact CD1-CD2 4.03Å; L681-L693 HydrophobicContact CD2-CD2 4.04Å; L681-L693 HydrophobicContact CD2-CG 3.94Å; L681-L696 HydrophobicContact CD1-CD1 3.88Å; L681-T714 HydrophobicContact CD1-CG2 4.18Å
682	K	89.1	Confident	92.8	Very high	95 Å²	95	30.6 Å²	30.6	41%	0.413	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.8	171.1	-74.9	-163.5	169.4	-161.5	0	112.8	M601 R679 A680 K684	M601-K682 HydrophobicContact CG-CB 4.33Å; M601-K682 HydrophobicContact SD-CB 4.18Å; R679-K682 WeakPolarHBondContact O-CB 3.31Å; R679-K682 PolarHBondContact O-N 3.17Å; A680-K682 PolarHBondContact O-N 3.44Å; K682-K684 PolarHBondContact O-N 2.98Å
683	V	89.5	Confident	92.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	11%	0.109	C	C	.	.	S	Bend	trans	-70.6	113.3	174.1	-177.1	0	0	0	0	109	L46 I600 M601 I604 L644 A680 L681 Q685 M688 Q689	L46-V683 HydrophobicContact CD1-CG1 3.91Å; I600-V683 HydrophobicContact CG2-CG2 3.93Å; M601-V683 HydrophobicContact SD-CB 4.35Å; M601-V683 HydrophobicContact SD-CG2 3.72Å; I604-V683 HydrophobicContact CD1-CB 4.21Å; I604-V683 HydrophobicContact CD1-CG1 3.51Å; I604-V683 HydrophobicContact CD1-CG2 3.71Å; L644-V683 HydrophobicContact CD1-CG1 4.17Å; A680-V683 PolarHBondContact O-N 3.07Å; L681-V683 PolarHBondContact O-N 3.38Å; V683-Q685 HydrophobicContact CG1-CB 3.99Å; V683-Q685 PolarHBondContact O-N 3.09Å; V683-M688 HydrophobicContact CB-CE 4.14Å; V683-M688 HydrophobicContact CB-SD 3.85Å; V683-M688 HydrophobicContact CG1-SD 3.69Å; V683-M688 HydrophobicContact CG2-CE 3.74Å; V683-M688 HydrophobicContact CG2-SD 3.99Å; V683-Q689 WeakPolarHBondContact O-CG 3.28Å; V683-Q689 PolarHBondContact O-NE2 3.49Å
684	K	86.9	Confident	92.9	Very high	28 Å²	28	25 Å²	25	12%	0.122	12%	0.118	C	C	.	.			trans	-80	63.1	177.2	-65.6	-175.7	-177.2	177.6	0	111.5	S41 S43 D45 L46 A311 K682	S41-K684 PolarHBondContact O-NZ 2.82Å; S41-K684 PolarHBondContact OG-NZ 3.01Å; S43-K684 WeakPolarHBondContact O-CD 3.45Å; S43-K684 WeakPolarHBondContact O-CE 3.49Å; S43-K684 PolarHBondContact O-NZ 3.09Å; S43-K684 VanDerWaalsContact OG-CE 3.29Å; S43-K684 WeakPolarHBondContact OG-CE 3.37Å; D45-K684 WeakPolarHBondContact OD1-CD 3.39Å; L46-K684 PolarHBondContact N-O 3.43Å; A311-K684 HydrophobicContact CB-CB 4.23Å; K682-K684 PolarHBondContact O-N 2.98Å
685	Q	89.4	Confident	93	Very high	16 Å²	16	25 Å²	25	8%	0.075	12%	0.118	C	C	.	.			trans	-131.1	124.2	173.6	-157.5	-71.2	-25	0	0	109.3	F48 L644 V683 M687 M688 Q689	F48-Q685 HydrophobicContact CB-CG 4.15Å; F48-Q685 HydrophobicContact CD1-CG 4.09Å; F48-Q685 PolarHBondContact O-NE2 3.46Å; L644-Q685 HydrophobicContact CD1-CB 4.38Å; L644-Q685 HydrophobicContact CD1-CG 4.41Å; L644-Q685 HydrophobicContact CD2-CG 4.29Å; V683-Q685 HydrophobicContact CG1-CB 3.99Å; V683-Q685 PolarHBondContact O-N 3.09Å; Q685-M687 PolarHBondContact O-N 3.36Å; Q685-M688 HydrophobicContact CB-CB 4.31Å; Q685-M688 PolarHBondContact O-N 3.37Å; Q685-Q689 WeakPolarHBondContact O-CG 3.34Å; Q685-Q689 PolarHBondContact O-N 3.35Å
686	A	88.3	Confident	93	Very high	17 Å²	17	21.1 Å²	21.1	14%	0.14	9%	0.093	C	C	.	.	H	α-helix	trans	-68.4	-37.6	-164.3	0	0	0	0	0	114.6	M309 L690	M309-A686 HydrophobicContact CB-CB 4.18Å; M309-A686 WeakPolarHBondContact O-CB 3.43Å; A686-L690 WeakPolarHBondContact O-CB 3.26Å; A686-L690 PolarHBondContact O-N 3.1Å
687	M	91.1	Very high	93	Very high	10 Å²	10	21.2 Å²	21.2	5%	0.049	9%	0.093	C	C	.	.	H	α-helix	trans	-67.2	-45.2	177	-171.5	176	-53.1	0	0	110.8	Y50 I306 I648 Q685 L690 Y691	Y50-M687 HydrophobicContact CD1-CE 3.82Å; Y50-M687 HydrophobicContact CD1-SD 3.87Å; Y50-M687 HydrophobicContact CD2-SD 4.15Å; Y50-M687 HydrophobicContact CE1-SD 4.37Å; Y50-M687 HydrophobicContact CG-CE 3.82Å; Y50-M687 HydrophobicContact CG-SD 3.76Å; I306-M687 HydrophobicContact CB-CE 4.47Å; I306-M687 HydrophobicContact CG2-CB 3.68Å; I306-M687 HydrophobicContact CG2-CE 3.64Å; I306-M687 HydrophobicContact CG2-CG 3.8Å; I306-M687 HydrophobicContact CG2-SD 4.48Å; I648-M687 HydrophobicContact CG2-CG 4.01Å; I648-M687 HydrophobicContact CG2-SD 3.66Å; Q685-M687 PolarHBondContact O-N 3.36Å; M687-L690 PolarHBondContact O-N 3.33Å; M687-Y691 HydrophobicContact CG-CD2 3.82Å; M687-Y691 HydrophobicContact CG-CE2 3.54Å; M687-Y691 WeakPolarHBondContact O-CD2 3.47Å; M687-Y691 PolarHBondContact O-N 2.84Å; M687-Y691 VanDerWaalsContact O-N 3.15Å; M687-Y691 HydrophobicContact SD-CE2 4.08Å
688	M	93.2	Very high	92.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.6	-55.2	176.4	-176.6	162.6	174.7	0	0	111	F596 I600 L644 C647 I648 L651 A680 V683 Q685 L690 Y691 V692	F596-M688 HydrophobicContact CE1-CE 3.89Å; I600-M688 HydrophobicContact CG2-CE 3.79Å; L644-M688 HydrophobicContact CD1-SD 3.83Å; C647-M688 HydrophobicContact CB-CE 3.9Å; C647-M688 HydrophobicContact CB-SD 4Å; I648-M688 HydrophobicContact CD1-CB 4.35Å; I648-M688 HydrophobicContact CG1-CB 3.78Å; I648-M688 HydrophobicContact CG1-CG 4.4Å; L651-M688 HydrophobicContact CD1-CE 4.22Å; L651-M688 HydrophobicContact CD1-CG 3.71Å; A680-M688 HydrophobicContact CB-CE 4.28Å; V683-M688 HydrophobicContact CB-CE 4.14Å; V683-M688 HydrophobicContact CB-SD 3.85Å; V683-M688 HydrophobicContact CG1-SD 3.69Å; V683-M688 HydrophobicContact CG2-CE 3.74Å; V683-M688 HydrophobicContact CG2-SD 3.99Å; Q685-M688 HydrophobicContact CB-CB 4.31Å; Q685-M688 PolarHBondContact O-N 3.37Å; M688-L690 VanDerWaalsContact C-N 3.3Å; M688-L690 PolarHBondContact O-N 3.39Å; M688-Y691 PolarHBondContact O-N 2.95Å; M688-Y691 VanDerWaalsContact O-N 3.16Å; M688-V692 WeakPolarHBondContact O-CG2 3.46Å; M688-V692 PolarHBondContact O-N 2.94Å
689	Q	93.6	Very high	92.6	Very high	5 Å²	5	21.4 Å²	21.4	2%	0.023	10%	0.098	C	C	.	.	H	α-helix	trans	-58.2	-40.9	178.2	-72.2	-177.5	-25.9	0	0	112.1	A312 L681 V683 Q685 Y691 V692 L693	A312-Q689 PolarHBondContact O-NE2 3.04Å; A312-Q689 PolarHBondContact O-OE1 3.26Å; L681-Q689 HydrophobicContact CD2-CB 4.14Å; L681-Q689 HydrophobicContact CD2-CG 4.15Å; L681-Q689 PolarHBondContact O-NE2 2.99Å; V683-Q689 WeakPolarHBondContact O-CG 3.28Å; V683-Q689 PolarHBondContact O-NE2 3.49Å; Q685-Q689 WeakPolarHBondContact O-CG 3.34Å; Q685-Q689 PolarHBondContact O-N 3.35Å; Q689-Y691 PolarHBondContact O-N 3.08Å; Q689-V692 PolarHBondContact O-N 2.94Å; Q689-L693 WeakPolarHBondContact O-CB 3.43Å; Q689-L693 WeakPolarHBondContact O-CG 3.43Å; Q689-L693 PolarHBondContact O-N 3.2Å
690	L	93.8	Very high	92.5	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.016	8%	0.076	C	C	.	.	H	α-helix	trans	-59	-42.4	177	174.1	65.5	0	0	0	112.8	I306 M309 W403 A686 M687 M688 K694 K721 V722	I306-L690 HydrophobicContact CD1-CD2 3.52Å; I306-L690 HydrophobicContact CG1-CD2 3.5Å; I306-L690 VanDerWaalsContact CG1-CD2 3.5Å; I306-L690 HydrophobicContact CG2-CD2 4.45Å; M309-L690 HydrophobicContact CE-CD2 4.4Å; W403-L690 HydrophobicContact CZ2-CD1 4.4Å; W403-L690 HydrophobicContact CZ2-CD2 3.95Å; A686-L690 WeakPolarHBondContact O-CB 3.26Å; A686-L690 PolarHBondContact O-N 3.1Å; M687-L690 PolarHBondContact O-N 3.33Å; M688-L690 VanDerWaalsContact C-N 3.3Å; M688-L690 PolarHBondContact O-N 3.39Å; L690-K694 HydrophobicContact CD1-CD 4.47Å; L690-K694 HydrophobicContact CG-CD 4.35Å; L690-K694 WeakPolarHBondContact O-CD 3.26Å; L690-K694 VanDerWaalsContact O-CG 3.27Å; L690-K694 WeakPolarHBondContact O-CG 3.41Å; L690-K694 PolarHBondContact O-N 2.86Å; L690-K721 WeakPolarHBondContact CD1-O 3.09Å; L690-V722 HydrophobicContact CD1-CG2 4.31Å
691	Y	96.1	Very high	92.1	Very high	33 Å²	33	17.3 Å²	17.3	13%	0.129	8%	0.083	C	C	.	.	H	α-helix	trans	-74.4	-30	177.9	-73	-67.5	0	0	0	112.7	R652 N655 M687 M688 Q689 K694 L695	R652-Y691 HydrophobicContact CG-CD1 4.06Å; R652-Y691 HydrophobicContact CG-CD2 3.58Å; R652-Y691 HydrophobicContact CG-CE1 3.86Å; R652-Y691 HydrophobicContact CG-CE2 3.38Å; R652-Y691 HydrophobicContact CG-CG 3.93Å; R652-Y691 PolarHBondContact NE-OH 2.78Å; N655-Y691 HydrophobicContact CB-CD1 4.26Å; N655-Y691 PolarHBondContact ND2-O 3.05Å; M687-Y691 HydrophobicContact CG-CD2 3.82Å; M687-Y691 HydrophobicContact CG-CE2 3.54Å; M687-Y691 WeakPolarHBondContact O-CD2 3.47Å; M687-Y691 PolarHBondContact O-N 2.84Å; M687-Y691 VanDerWaalsContact O-N 3.15Å; M687-Y691 HydrophobicContact SD-CE2 4.08Å; M688-Y691 PolarHBondContact O-N 2.95Å; M688-Y691 VanDerWaalsContact O-N 3.16Å; Q689-Y691 PolarHBondContact O-N 3.08Å; Y691-K694 HydrophobicContact CD1-CD 3.87Å; Y691-K694 HydrophobicContact CE1-CD 4.25Å; Y691-L695 WeakPolarHBondContact O-CG 3.49Å; Y691-L695 PolarHBondContact O-N 3.46Å
692	V	97	Very high	91.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.8	-47.2	168.5	177.5	0	0	0	0	111.5	L651 L677 A680 L681 M688 Q689 K694 L695 L696	L651-V692 HydrophobicContact CD1-CG2 3.63Å; L651-V692 HydrophobicContact CD2-CG2 3.8Å; L651-V692 HydrophobicContact CG-CG2 4.38Å; L677-V692 HydrophobicContact CB-CG1 3.94Å; L677-V692 HydrophobicContact CD2-CG1 4.27Å; L677-V692 WeakPolarHBondContact O-CG1 3.18Å; A680-V692 HydrophobicContact CB-CG2 4.05Å; L681-V692 HydrophobicContact CD1-CG1 4.49Å; L681-V692 HydrophobicContact CD2-CB 3.73Å; L681-V692 HydrophobicContact CD2-CG1 3.46Å; L681-V692 VanDerWaalsContact CD2-CG1 3.46Å; L681-V692 HydrophobicContact CG-CB 4.47Å; L681-V692 HydrophobicContact CG-CG1 3.68Å; M688-V692 WeakPolarHBondContact O-CG2 3.46Å; M688-V692 PolarHBondContact O-N 2.94Å; Q689-V692 PolarHBondContact O-N 2.94Å; V692-K694 VanDerWaalsContact C-N 3.32Å; V692-K694 PolarHBondContact O-N 3.28Å; V692-L695 PolarHBondContact O-N 3.01Å; V692-L695 VanDerWaalsContact O-N 3.14Å; V692-L696 HydrophobicContact CG1-CD1 3.96Å; V692-L696 WeakPolarHBondContact O-CG 3.29Å; V692-L696 PolarHBondContact O-N 3.38Å
693	L	96	Very high	91.6	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-63.7	-35.2	179.7	-69.5	168.3	0	0	0	112.1	L681 Q689 L696 K697 T714 A717 I718 K721 V722	L681-L693 HydrophobicContact CD1-CD2 4.03Å; L681-L693 HydrophobicContact CD2-CD2 4.04Å; L681-L693 HydrophobicContact CD2-CG 3.94Å; Q689-L693 WeakPolarHBondContact O-CB 3.43Å; Q689-L693 WeakPolarHBondContact O-CG 3.43Å; Q689-L693 PolarHBondContact O-N 3.2Å; L693-L696 PolarHBondContact O-N 3.39Å; L693-K697 WeakPolarHBondContact O-CB 3.31Å; L693-K697 PolarHBondContact O-N 3.45Å; L693-T714 HydrophobicContact CD2-CG2 4.3Å; L693-A717 HydrophobicContact CD1-CB 4.11Å; L693-A717 HydrophobicContact CD2-CB 3.82Å; L693-I718 HydrophobicContact CB-CG1 4.19Å; L693-I718 HydrophobicContact CD2-CG1 3.85Å; L693-K721 HydrophobicContact CD1-CB 3.99Å; L693-K721 HydrophobicContact CD1-CG 4.22Å; L693-V722 HydrophobicContact CB-CG2 3.65Å
694	K	95.4	Very high	91.4	Very high	44 Å²	44	16.4 Å²	16.4	19%	0.191	8%	0.084	C	C	.	.	H	α-helix	trans	-62.2	-43.4	171.1	-75.2	162.3	-177.8	162.4	0	112.5	N655 L690 Y691 V692 L696 K697 V698 V722	N655-K694 WeakPolarHBondContact OD1-CB 3.21Å; L690-K694 HydrophobicContact CD1-CD 4.47Å; L690-K694 HydrophobicContact CG-CD 4.35Å; L690-K694 WeakPolarHBondContact O-CD 3.26Å; L690-K694 VanDerWaalsContact O-CG 3.27Å; L690-K694 WeakPolarHBondContact O-CG 3.41Å; L690-K694 PolarHBondContact O-N 2.86Å; Y691-K694 HydrophobicContact CD1-CD 3.87Å; Y691-K694 HydrophobicContact CE1-CD 4.25Å; V692-K694 VanDerWaalsContact C-N 3.32Å; V692-K694 PolarHBondContact O-N 3.28Å; K694-L696 VanDerWaalsContact C-N 3.33Å; K694-K697 PolarHBondContact O-N 2.98Å; K694-V698 PolarHBondContact O-N 2.92Å; K694-V722 HydrophobicContact CG-CG1 3.76Å; K694-V722 HydrophobicContact CG-CG2 4.27Å
695	L	96.4	Very high	91.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-68.3	-31.9	177.1	-72.7	164.5	0	0	0	112.7	L651 L654 N655 L668 L677 Y691 V692 V698 Q699	L651-L695 HydrophobicContact CD2-CD1 3.83Å; L654-L695 HydrophobicContact CB-CD1 4.2Å; L654-L695 HydrophobicContact CB-CD2 4.48Å; L654-L695 HydrophobicContact CD2-CD1 3.79Å; L654-L695 HydrophobicContact CD2-CD2 4.37Å; L654-L695 HydrophobicContact CG-CD1 4.01Å; L654-L695 HydrophobicContact CG-CD2 3.92Å; N655-L695 WeakPolarHBondContact ND2-CD1 3.44Å; N655-L695 WeakPolarHBondContact ND2-CG 3.19Å; L668-L695 HydrophobicContact CD1-CD2 3.91Å; L677-L695 HydrophobicContact CD1-CB 3.72Å; L677-L695 HydrophobicContact CD2-CB 4.39Å; L677-L695 HydrophobicContact CD2-CD1 3.93Å; Y691-L695 WeakPolarHBondContact O-CG 3.49Å; Y691-L695 PolarHBondContact O-N 3.46Å; V692-L695 PolarHBondContact O-N 3.01Å; V692-L695 VanDerWaalsContact O-N 3.14Å; L695-V698 WeakPolarHBondContact O-CG2 3.33Å; L695-Q699 PolarHBondContact O-NE2 2.9Å
696	L	95.3	Very high	91.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.4	-42.8	172	-68.6	168.4	0	0	0	111	A674 L677 L681 V692 L693 K694 V698 Q699 T700 W707 T714 I718	A674-L696 HydrophobicContact CB-CD2 3.87Å; L677-L696 HydrophobicContact CB-CD1 4.46Å; L677-L696 HydrophobicContact CB-CD2 3.89Å; L677-L696 HydrophobicContact CB-CG 4.13Å; L677-L696 HydrophobicContact CD1-CD2 4.29Å; L681-L696 HydrophobicContact CD1-CD1 3.88Å; V692-L696 HydrophobicContact CG1-CD1 3.96Å; V692-L696 WeakPolarHBondContact O-CG 3.29Å; V692-L696 PolarHBondContact O-N 3.38Å; L693-L696 PolarHBondContact O-N 3.39Å; K694-L696 VanDerWaalsContact C-N 3.33Å; L696-V698 PolarHBondContact O-N 3.3Å; L696-Q699 PolarHBondContact O-N 3.01Å; L696-T700 WeakPolarHBondContact O-CG2 3.4Å; L696-T700 PolarHBondContact O-N 3.48Å; L696-T700 VanDerWaalsContact O-N 3.15Å; L696-W707 HydrophobicContact CD2-CZ2 4.46Å; L696-T714 HydrophobicContact CD1-CG2 3.82Å; L696-I718 HydrophobicContact CB-CD1 4.12Å
697	K	93.4	Very high	91.1	Very high	19 Å²	19	33.7 Å²	33.7	8%	0.083	15%	0.152	C	C	.	.	H	α-helix	trans	-56	-42.7	177.9	-176.7	173.8	176.5	173.4	0	113.2	L693 K694 Q699 T700 I718 V722 R723 H724 D728 W730	L693-K697 WeakPolarHBondContact O-CB 3.31Å; L693-K697 PolarHBondContact O-N 3.45Å; K694-K697 PolarHBondContact O-N 2.98Å; K697-Q699 PolarHBondContact O-N 2.69Å; K697-T700 PolarHBondContact O-N 3.42Å; K697-T700 PolarHBondContact O-OG1 3.01Å; K697-I718 HydrophobicContact CB-CD1 4.38Å; K697-I718 HydrophobicContact CB-CG2 3.73Å; K697-I718 HydrophobicContact CD-CG2 3.75Å; K697-I718 HydrophobicContact CG-CG2 3.82Å; K697-V722 HydrophobicContact CD-CB 4.35Å; K697-V722 HydrophobicContact CD-CG1 3.74Å; K697-R723 PolarHBondContact NZ-O 2.97Å; K697-H724 PolarHBondContact NZ-ND1 2.92Å; K697-D728 WeakPolarHBondContact CE-OD2 3.48Å; K697-D728 IonicContact NZ-OD1 2.62Å; K697-D728 IonicContact NZ-OD2 2.85Å; K697-D728 PolarHBondContact NZ-OD2 3.14Å; K697-W730 HydrophobicContact CD-CD2 4.23Å; K697-W730 HydrophobicContact CD-CG 4.32Å; K697-W730 VanDerWaalsContact CE-CG 3.47Å; K697-W730 HydrophobicContact CG-CB 4.22Å; K697-W730 HydrophobicContact CG-CD2 3.89Å; K697-W730 HydrophobicContact CG-CE3 3.85Å; K697-W730 HydrophobicContact CG-CG 4.03Å
698	V	90.8	Very high	91	Very high	51 Å²	51	35 Å²	35	31%	0.309	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.7	178.6	-62.8	0	0	0	0	113.3	T665 L668 K694 L695 L696	T665-V698 HydrophobicContact CG2-CB 3.95Å; T665-V698 HydrophobicContact CG2-CG2 3.91Å; T665-V698 VanDerWaalsContact CG2-O 3.31Å; T665-V698 WeakPolarHBondContact CG2-O 3.48Å; L668-V698 HydrophobicContact CD1-CG2 4.49Å; K694-V698 PolarHBondContact O-N 2.92Å; L695-V698 WeakPolarHBondContact O-CG2 3.33Å; L696-V698 PolarHBondContact O-N 3.3Å
699	Q	91.5	Very high	90.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-18.5	178.3	-70.4	176.2	81.8	0	0	114	T665 L668 V669 S673 L695 L696 K697 K701 Y702 L703	T665-Q699 HydrophobicContact CG2-CG 4.47Å; L668-Q699 HydrophobicContact CB-CG 4.1Å; L668-Q699 HydrophobicContact CD1-CG 4.36Å; L668-Q699 PolarHBondContact O-OE1 2.69Å; V669-Q699 HydrophobicContact CG2-CB 4.34Å; V669-Q699 HydrophobicContact CG2-CG 3.99Å; S673-Q699 VanDerWaalsContact OG-CD 3.24Å; S673-Q699 PolarHBondContact OG-NE2 2.96Å; S673-Q699 PolarHBondContact OG-OE1 2.94Å; L695-Q699 PolarHBondContact O-NE2 2.9Å; L696-Q699 PolarHBondContact O-N 3.01Å; K697-Q699 PolarHBondContact O-N 2.69Å; Q699-K701 VanDerWaalsContact C-N 3.25Å; Q699-K701 PolarHBondContact O-N 3.32Å; Q699-K701 VanDerWaalsContact O-N 3.14Å; Q699-Y702 PolarHBondContact O-N 2.92Å; Q699-L703 HydrophobicContact CB-CD1 3.86Å; Q699-L703 HydrophobicContact CB-CG 4.29Å; Q699-L703 WeakPolarHBondContact O-CG 3.41Å; Q699-L703 PolarHBondContact O-N 2.79Å
700	T	89.8	Confident	90.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.6	-170.4	48.6	0	0	0	0	114.2	L696 K697 Y702 L703 W707 M715 I718 W730	L696-T700 WeakPolarHBondContact O-CG2 3.4Å; L696-T700 PolarHBondContact O-N 3.48Å; L696-T700 VanDerWaalsContact O-N 3.15Å; K697-T700 PolarHBondContact O-N 3.42Å; K697-T700 PolarHBondContact O-OG1 3.01Å; T700-Y702 VanDerWaalsContact C-N 3.31Å; T700-Y702 PolarHBondContact O-N 3.23Å; T700-L703 PolarHBondContact O-N 2.93Å; T700-W707 HydrophobicContact CG2-CZ3 4.03Å; T700-M715 HydrophobicContact CG2-CE 4.33Å; T700-M715 HydrophobicContact CG2-SD 3.85Å; T700-I718 HydrophobicContact CG2-CD1 4.18Å; T700-W730 WeakPolarHBondContact CB-O 3.36Å; T700-W730 HydrophobicContact CG2-CE3 4.06Å; T700-W730 HydrophobicContact CG2-CZ3 4.2Å; T700-W730 PolarHBondContact OG1-O 3.33Å
701	K	85.1	Confident	90.5	Very high	33 Å²	33	47.5 Å²	47.5	14%	0.143	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-36.7	176.3	59.9	169.1	178.5	168.3	0	112.9	Q699 D735	Q699-K701 VanDerWaalsContact C-N 3.25Å; Q699-K701 PolarHBondContact O-N 3.32Å; Q699-K701 VanDerWaalsContact O-N 3.14Å; K701-D735 HydrophobicContact CD-CB 4.33Å; K701-D735 WeakPolarHBondContact CD-OD2 3.31Å; K701-D735 WeakPolarHBondContact CE-OD2 3.43Å; K701-D735 IonicContact NZ-OD2 2.75Å; K701-D735 PolarHBondContact NZ-OD2 2.9Å
702	Y	85.3	Confident	90.2	Very high	27 Å²	27	51.2 Å²	51.2	11%	0.106	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.2	-179.5	-52.9	-60.5	0	0	0	114.3	T665 M666 V669 Q699 T700 G704 D735 A738	T665-Y702 HydrophobicContact CG2-CD2 4.34Å; T665-Y702 HydrophobicContact CG2-CE2 3.87Å; M666-Y702 HydrophobicContact CG-CE1 4.49Å; M666-Y702 HydrophobicContact CG-CE2 4.49Å; M666-Y702 HydrophobicContact SD-CD1 3.49Å; M666-Y702 WeakPolarHBondContact SD-CD1 3.45Å; M666-Y702 HydrophobicContact SD-CD2 3.86Å; M666-Y702 HydrophobicContact SD-CE1 3.47Å; M666-Y702 WeakPolarHBondContact SD-CE1 3.25Å; M666-Y702 HydrophobicContact SD-CE2 3.85Å; M666-Y702 HydrophobicContact SD-CG 3.67Å; V669-Y702 HydrophobicContact CG2-CD2 3.98Å; V669-Y702 HydrophobicContact CG2-CG 4.25Å; Q699-Y702 PolarHBondContact O-N 2.92Å; T700-Y702 VanDerWaalsContact C-N 3.31Å; T700-Y702 PolarHBondContact O-N 3.23Å; Y702-G704 VanDerWaalsContact C-N 3.29Å; Y702-G704 PolarHBondContact O-N 3.02Å; Y702-D735 HydrophobicContact CE1-CB 4.16Å; Y702-A738 HydrophobicContact CE1-CB 4.18Å
703	L	86.8	Confident	89.8	Confident	39 Å²	39	57.6 Å²	57.6	20%	0.204	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	3	-177	-67.6	168.3	0	0	0	114	A674 Q699 T700 W707	A674-L703 HydrophobicContact CB-CD1 3.76Å; A674-L703 HydrophobicContact CB-CD2 4.1Å; Q699-L703 HydrophobicContact CB-CD1 3.86Å; Q699-L703 HydrophobicContact CB-CG 4.29Å; Q699-L703 WeakPolarHBondContact O-CG 3.41Å; Q699-L703 PolarHBondContact O-N 2.79Å; T700-L703 PolarHBondContact O-N 2.93Å; L703-W707 HydrophobicContact CB-CB 4.08Å; L703-W707 HydrophobicContact CB-CD2 3.96Å; L703-W707 HydrophobicContact CB-CE3 4.12Å; L703-W707 HydrophobicContact CB-CG 3.95Å; L703-W707 HydrophobicContact CD1-CD2 3.88Å; L703-W707 HydrophobicContact CD1-CE3 4.02Å; L703-W707 HydrophobicContact CD1-CH2 4.07Å; L703-W707 HydrophobicContact CD1-CZ2 3.91Å; L703-W707 HydrophobicContact CD1-CZ3 4.12Å; L703-W707 HydrophobicContact CG-CD2 4.45Å; L703-W707 WeakPolarHBondContact O-CB 3.47Å
704	G	84.1	Confident	89.6	Confident	16 Å²	16	57.6 Å²	57.6	17%	0.165	27%	0.269	C	S	.	.	H	α-helix	trans	72.2	-179.5	174.4	0	0	0	0	0	115.2	Y702 R708	Y702-G704 VanDerWaalsContact C-N 3.29Å; Y702-G704 PolarHBondContact O-N 3.02Å; G704-R708 PolarHBondContact O-NE 3.16Å; G704-R708 PolarHBondContact O-NH2 2.71Å
705	R	84.7	Confident	89.5	Confident	212 Å²	212	56.4 Å²	56.4	80%	0.8	26%	0.264	S	S	*	.	H	α-helix	trans	-77.9	-37.8	-174.9	-168.2	178.1	-177.7	-172	1.2	112.9	R708 K709	R705-R708 PolarHBondContact O-N 3.02Å; R705-K709 PolarHBondContact O-N 3.49Å; R705-K709 VanDerWaalsContact O-N 3.12Å
706	Q	85.1	Confident	89.2	Confident	170 Å²	170	59 Å²	59	79%	0.794	28%	0.282	S	S	*	.	H	α-helix	trans	-65.4	-42	-177.2	-170.1	-179.7	8.5	0	0	112.2	K709 S710	Q706-K709 PolarHBondContact O-N 3.46Å; Q706-S710 PolarHBondContact O-N 3.4Å; Q706-S710 PolarHBondContact O-OG 2.86Å
707	W	88.9	Confident	89	Confident	43 Å²	43	59.5 Å²	59.5	16%	0.163	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-42.8	176.4	-172	98.3	0	0	0	111.9	A674 L696 T700 L703 K709 S710 N711 T714 M715	A674-W707 HydrophobicContact CB-CZ2 4.29Å; L696-W707 HydrophobicContact CD2-CZ2 4.46Å; T700-W707 HydrophobicContact CG2-CZ3 4.03Å; L703-W707 HydrophobicContact CB-CB 4.08Å; L703-W707 HydrophobicContact CB-CD2 3.96Å; L703-W707 HydrophobicContact CB-CE3 4.12Å; L703-W707 HydrophobicContact CB-CG 3.95Å; L703-W707 HydrophobicContact CD1-CD2 3.88Å; L703-W707 HydrophobicContact CD1-CE3 4.02Å; L703-W707 HydrophobicContact CD1-CH2 4.07Å; L703-W707 HydrophobicContact CD1-CZ2 3.91Å; L703-W707 HydrophobicContact CD1-CZ3 4.12Å; L703-W707 HydrophobicContact CG-CD2 4.45Å; L703-W707 WeakPolarHBondContact O-CB 3.47Å; W707-K709 VanDerWaalsContact C-N 3.35Å; W707-K709 PolarHBondContact O-N 3.05Å; W707-S710 PolarHBondContact O-N 2.82Å; W707-S710 PolarHBondContact O-OG 3.15Å; W707-N711 HydrophobicContact CD2-CB 4.21Å; W707-N711 HydrophobicContact CE3-CB 4.1Å; W707-N711 HydrophobicContact CH2-CB 4.01Å; W707-N711 HydrophobicContact CZ2-CB 4.12Å; W707-N711 HydrophobicContact CZ3-CB 4Å; W707-N711 PolarHBondContact NE1-ND2 3.03Å; W707-N711 VanDerWaalsContact O-CB 3.31Å; W707-N711 WeakPolarHBondContact O-CB 3.45Å; W707-N711 PolarHBondContact O-N 3.01Å; W707-N711 PolarHBondContact O-ND2 2.78Å; W707-T714 HydrophobicContact CH2-CG2 4.4Å; W707-M715 HydrophobicContact CZ3-SD 4.13Å
708	R	88.8	Confident	89	Confident	37 Å²	37	58.6 Å²	58.6	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-42.7	175.8	-74.5	177.2	-80.8	155.2	-6.9	111.6	G704 R705 N711 M712 M715 A731	G704-R708 PolarHBondContact O-NE 3.16Å; G704-R708 PolarHBondContact O-NH2 2.71Å; R705-R708 PolarHBondContact O-N 3.02Å; R708-N711 PolarHBondContact O-N 3.22Å; R708-M712 PolarHBondContact O-N 3.28Å; R708-M715 HydrophobicContact CG-CE 4.03Å; R708-M715 HydrophobicContact CG-SD 4.03Å; R708-A731 VanDerWaalsContact CD-O 3.27Å; R708-A731 WeakPolarHBondContact CD-O 3.24Å; R708-A731 PolarHBondContact NH1-O 2.91Å
709	K	88	Confident	89	Confident	178 Å²	178	62.7 Å²	62.7	77%	0.774	29%	0.294	S	S	*	.	H	α-helix	trans	-61.3	-43.3	175.3	-172.2	176.5	179.1	179.9	0	112.4	R705 Q706 W707	R705-K709 PolarHBondContact O-N 3.49Å; R705-K709 VanDerWaalsContact O-N 3.12Å; Q706-K709 PolarHBondContact O-N 3.46Å; W707-K709 VanDerWaalsContact C-N 3.35Å; W707-K709 PolarHBondContact O-N 3.05Å
710	S	89.5	Confident	88.9	Confident	82 Å²	82	67.9 Å²	67.9	57%	0.573	32%	0.318	S	S	*	.	H	α-helix	trans	-82.2	-10.3	-178.9	60.7	0	0	0	0	114.9	Q706 W707	Q706-S710 PolarHBondContact O-N 3.4Å; Q706-S710 PolarHBondContact O-OG 2.86Å; W707-S710 PolarHBondContact O-N 2.82Å; W707-S710 PolarHBondContact O-OG 3.15Å
711	N	91.7	Very high	88.9	Confident	10 Å²	10	69.5 Å²	69.5	5%	0.053	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	30.5	-179	-65.7	-84.4	0	0	0	113	K678 W707 R708 K713 T714 M715	K678-N711 WeakPolarHBondContact CD-OD1 3.45Å; K678-N711 VanDerWaalsContact CE-OD1 3.3Å; K678-N711 WeakPolarHBondContact CE-OD1 3.23Å; K678-N711 PolarHBondContact NZ-OD1 3.47Å; W707-N711 HydrophobicContact CD2-CB 4.21Å; W707-N711 HydrophobicContact CE3-CB 4.1Å; W707-N711 HydrophobicContact CH2-CB 4.01Å; W707-N711 HydrophobicContact CZ2-CB 4.12Å; W707-N711 HydrophobicContact CZ3-CB 4Å; W707-N711 PolarHBondContact NE1-ND2 3.03Å; W707-N711 VanDerWaalsContact O-CB 3.31Å; W707-N711 WeakPolarHBondContact O-CB 3.45Å; W707-N711 PolarHBondContact O-N 3.01Å; W707-N711 PolarHBondContact O-ND2 2.78Å; R708-N711 PolarHBondContact O-N 3.22Å; N711-K713 VanDerWaalsContact C-N 3.29Å; N711-K713 PolarHBondContact O-N 3.36Å; N711-T714 WeakPolarHBondContact O-CA 3.36Å; N711-T714 WeakPolarHBondContact O-CB 3.45Å; N711-T714 PolarHBondContact O-N 2.96Å; N711-T714 PolarHBondContact O-OG1 3.49Å; N711-M715 PolarHBondContact O-N 3.15Å
712	M	89.7	Confident	89.2	Confident	111 Å²	111	68.3 Å²	68.3	55%	0.547	32%	0.321	S	S	.	.	H	α-helix	trans	-56.2	-36.9	-176.1	-164.6	59.3	65.3	0	0	113.8	R708 T714 M715 S716	R708-M712 PolarHBondContact O-N 3.28Å; M712-T714 VanDerWaalsContact C-N 3.28Å; M712-T714 PolarHBondContact O-N 3.33Å; M712-M715 WeakPolarHBondContact O-CB 3.22Å; M712-M715 PolarHBondContact O-N 3.02Å; M712-M715 VanDerWaalsContact O-N 3.13Å; M712-M715 HydrophobicContact SD-CB 4.13Å; M712-M715 HydrophobicContact SD-CG 4.45Å; M712-S716 PolarHBondContact O-N 2.87Å; M712-S716 PolarHBondContact O-OG 3.44Å
713	K	89.9	Confident	89.4	Confident	134 Å²	134	70.4 Å²	70.4	58%	0.583	33%	0.329	S	S	*	.	H	α-helix	trans	-55.8	-42	171.4	-76.7	-171.8	172.7	-172.1	0	112.2	N711 A717	N711-K713 VanDerWaalsContact C-N 3.29Å; N711-K713 PolarHBondContact O-N 3.36Å; K713-A717 WeakPolarHBondContact O-CB 3.14Å; K713-A717 PolarHBondContact O-N 3.46Å
714	T	92.1	Very high	89.4	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-67.2	-41.4	176	-44.6	0	0	0	0	111.4	L681 L693 L696 W707 N711 M712 S716 A717 I718	L681-T714 HydrophobicContact CD1-CG2 4.18Å; L693-T714 HydrophobicContact CD2-CG2 4.3Å; L696-T714 HydrophobicContact CD1-CG2 3.82Å; W707-T714 HydrophobicContact CH2-CG2 4.4Å; N711-T714 WeakPolarHBondContact O-CA 3.36Å; N711-T714 WeakPolarHBondContact O-CB 3.45Å; N711-T714 PolarHBondContact O-N 2.96Å; N711-T714 PolarHBondContact O-OG1 3.49Å; M712-T714 VanDerWaalsContact C-N 3.28Å; M712-T714 PolarHBondContact O-N 3.33Å; T714-S716 PolarHBondContact O-N 2.84Å; T714-A717 PolarHBondContact O-N 3.05Å; T714-I718 HydrophobicContact CG2-CD1 4.34Å; T714-I718 VanDerWaalsContact O-CG1 3.31Å; T714-I718 WeakPolarHBondContact O-CG1 3.46Å; T714-I718 PolarHBondContact O-N 3.3Å
715	M	91.9	Very high	89.3	Confident	18 Å²	18	71.2 Å²	71.2	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-45.8	175.9	-60.5	-61.5	-69.1	0	0	111.2	T700 W707 R708 N711 M712 I718 Y719 W730 A731	T700-M715 HydrophobicContact CG2-CE 4.33Å; T700-M715 HydrophobicContact CG2-SD 3.85Å; W707-M715 HydrophobicContact CZ3-SD 4.13Å; R708-M715 HydrophobicContact CG-CE 4.03Å; R708-M715 HydrophobicContact CG-SD 4.03Å; N711-M715 PolarHBondContact O-N 3.15Å; M712-M715 WeakPolarHBondContact O-CB 3.22Å; M712-M715 PolarHBondContact O-N 3.02Å; M712-M715 VanDerWaalsContact O-N 3.13Å; M712-M715 HydrophobicContact SD-CB 4.13Å; M712-M715 HydrophobicContact SD-CG 4.45Å; M715-I718 PolarHBondContact O-N 3.25Å; M715-Y719 PolarHBondContact O-N 3.17Å; M715-W730 HydrophobicContact CE-CE3 4.08Å; M715-W730 HydrophobicContact CE-CH2 3.9Å; M715-W730 HydrophobicContact CE-CZ3 3.4Å; M715-W730 HydrophobicContact SD-CZ3 4Å; M715-A731 HydrophobicContact CE-CB 4.19Å
716	S	91.3	Very high	89.2	Confident	55 Å²	55	64.8 Å²	64.8	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-40.1	175.1	-58.3	0	0	0	0	112.6	M712 T714 Y719 Q720	M712-S716 PolarHBondContact O-N 2.87Å; M712-S716 PolarHBondContact O-OG 3.44Å; T714-S716 PolarHBondContact O-N 2.84Å; S716-Y719 PolarHBondContact O-N 3.17Å; S716-Q720 WeakPolarHBondContact O-CB 3.41Å; S716-Q720 VanDerWaalsContact O-CG 3.3Å; S716-Q720 WeakPolarHBondContact O-CG 3.48Å; S716-Q720 PolarHBondContact O-N 3.4Å
717	A	91.6	Very high	88.7	Confident	12 Å²	12	60.4 Å²	60.4	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-39.3	175.7	0	0	0	0	0	112.4	A312 L693 K713 T714 Q720 K721	A312-A717 HydrophobicContact CB-CB 4.34Å; L693-A717 HydrophobicContact CD1-CB 4.11Å; L693-A717 HydrophobicContact CD2-CB 3.82Å; K713-A717 WeakPolarHBondContact O-CB 3.14Å; K713-A717 PolarHBondContact O-N 3.46Å; T714-A717 PolarHBondContact O-N 3.05Å; A717-Q720 PolarHBondContact O-N 3.43Å; A717-K721 WeakPolarHBondContact O-CB 3.42Å; A717-K721 WeakPolarHBondContact O-CG 3.44Å; A717-K721 PolarHBondContact O-N 2.82Å
718	I	92.9	Very high	88.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.6	-47.3	171	-66.3	165.4	0	0	0	109.7	L693 L696 K697 T700 T714 M715 Q720 V722 W730	L693-I718 HydrophobicContact CB-CG1 4.19Å; L693-I718 HydrophobicContact CD2-CG1 3.85Å; L696-I718 HydrophobicContact CB-CD1 4.12Å; K697-I718 HydrophobicContact CB-CD1 4.38Å; K697-I718 HydrophobicContact CB-CG2 3.73Å; K697-I718 HydrophobicContact CD-CG2 3.75Å; K697-I718 HydrophobicContact CG-CG2 3.82Å; T700-I718 HydrophobicContact CG2-CD1 4.18Å; T714-I718 HydrophobicContact CG2-CD1 4.34Å; T714-I718 VanDerWaalsContact O-CG1 3.31Å; T714-I718 WeakPolarHBondContact O-CG1 3.46Å; T714-I718 PolarHBondContact O-N 3.3Å; M715-I718 PolarHBondContact O-N 3.25Å; I718-Q720 PolarHBondContact O-N 3.07Å; I718-V722 HydrophobicContact CG2-CB 4.2Å; I718-V722 HydrophobicContact CG2-CG2 4.18Å; I718-V722 WeakPolarHBondContact O-CB 3.43Å; I718-V722 PolarHBondContact O-N 2.93Å; I718-W730 HydrophobicContact CB-CH2 3.75Å; I718-W730 HydrophobicContact CB-CZ3 3.85Å; I718-W730 HydrophobicContact CD1-CZ3 3.88Å; I718-W730 HydrophobicContact CG1-CZ3 4.47Å; I718-W730 HydrophobicContact CG2-CD2 4.47Å; I718-W730 HydrophobicContact CG2-CE3 3.98Å; I718-W730 HydrophobicContact CG2-CH2 3.42Å; I718-W730 VanDerWaalsContact CG2-CH2 3.42Å; I718-W730 HydrophobicContact CG2-CZ2 3.93Å; I718-W730 HydrophobicContact CG2-CZ3 3.43Å; I718-W730 VanDerWaalsContact CG2-CZ3 3.43Å
719	Y	90.5	Very high	87.6	Confident	136 Å²	136	62.2 Å²	62.2	53%	0.533	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-42.3	179.6	-177.5	-97.6	0	0	0	113.1	L401 M715 S716 H724	L401-Y719 HydrophobicContact CD2-CE1 4.39Å; M715-Y719 PolarHBondContact O-N 3.17Å; S716-Y719 PolarHBondContact O-N 3.17Å; Y719-H724 AromaticContact CD2-NE2 3.7Å; Y719-H724 PolarHBondContact O-NE2 2.66Å
720	Q	89.6	Confident	87.4	Confident	109 Å²	109	54.9 Å²	54.9	51%	0.509	27%	0.271	S	S	.	.	H	α-helix	trans	-77.6	-32.8	-177.7	-71.3	172.2	-7.2	0	0	114.2	P402 S716 A717 I718	P402-Q720 VanDerWaalsContact CD-O 3.25Å; P402-Q720 WeakPolarHBondContact CD-O 3.39Å; P402-Q720 WeakPolarHBondContact CG-O 3.4Å; S716-Q720 WeakPolarHBondContact O-CB 3.41Å; S716-Q720 VanDerWaalsContact O-CG 3.3Å; S716-Q720 WeakPolarHBondContact O-CG 3.48Å; S716-Q720 PolarHBondContact O-N 3.4Å; A717-Q720 PolarHBondContact O-N 3.43Å; I718-Q720 PolarHBondContact O-N 3.07Å
721	K	89.3	Confident	87	Confident	34 Å²	34	52.7 Å²	52.7	15%	0.148	26%	0.258	C	S	.	.	H	α-helix	trans	-112.2	-19.8	-167.8	-55.3	-70.8	-174.2	167	0	114.5	M309 R310 A311 W403 L690 L693 A717	M309-K721 HydrophobicContact SD-CD 4.15Å; R310-K721 PolarHBondContact O-NZ 2.81Å; A311-K721 PolarHBondContact O-NZ 3.31Å; W403-K721 PolarHBondContact NE1-O 3.01Å; L690-K721 WeakPolarHBondContact CD1-O 3.09Å; L693-K721 HydrophobicContact CD1-CB 3.99Å; L693-K721 HydrophobicContact CD1-CG 4.22Å; A717-K721 WeakPolarHBondContact O-CB 3.42Å; A717-K721 WeakPolarHBondContact O-CG 3.44Å; A717-K721 PolarHBondContact O-N 2.82Å
722	V	91.5	Very high	86.2	Confident	9 Å²	9	60 Å²	60	6%	0.055	29%	0.286	C	S	.	.	S	Bend	trans	-106.7	132.3	-174.8	-173.8	0	0	0	0	110.9	L690 L693 K694 K697 I718 H724	L690-V722 HydrophobicContact CD1-CG2 4.31Å; L693-V722 HydrophobicContact CB-CG2 3.65Å; K694-V722 HydrophobicContact CG-CG1 3.76Å; K694-V722 HydrophobicContact CG-CG2 4.27Å; K697-V722 HydrophobicContact CD-CB 4.35Å; K697-V722 HydrophobicContact CD-CG1 3.74Å; I718-V722 HydrophobicContact CG2-CB 4.2Å; I718-V722 HydrophobicContact CG2-CG2 4.18Å; I718-V722 WeakPolarHBondContact O-CB 3.43Å; I718-V722 PolarHBondContact O-N 2.93Å; V722-H724 PolarHBondContact O-CE1 2.97Å; V722-H724 PolarHBondContact O-N 2.74Å; V722-H724 PolarHBondContact O-NE2 2.85Å
723	R	89	Confident	85	Confident	71 Å²	71	55.3 Å²	55.3	27%	0.268	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-54.9	136.2	175.7	-172.7	-177.3	-69.7	115.4	-14	111.2	E300 W403 A404 K697	E300-R723 IonicContact OE1-CZ 3.74Å; E300-R723 IonicContact OE1-NE 3.56Å; E300-R723 PolarHBondContact OE1-NE 3.18Å; E300-R723 IonicContact OE1-NH2 3.94Å; E300-R723 PolarHBondContact OE1-NH2 3.39Å; W403-R723 HydrophobicContact CB-CB 3.64Å; W403-R723 HydrophobicContact CB-CG 3.67Å; W403-R723 HydrophobicContact CD2-CB 4.07Å; W403-R723 VanDerWaalsContact CE3-NH2 3.25Å; W403-R723 HydrophobicContact CG-CB 3.6Å; W403-R723 HydrophobicContact CG-CG 4.18Å; A404-R723 WeakPolarHBondContact O-CD 3.28Å; A404-R723 WeakPolarHBondContact O-CG 3.32Å; A404-R723 PolarHBondContact O-NE 3.13Å; K697-R723 PolarHBondContact NZ-O 2.97Å
724	H	86.6	Confident	83.6	Confident	27 Å²	27	54.3 Å²	54.3	13%	0.125	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-101.7	165.8	173.6	-57.7	-62.4	0	0	0	112.6	P405 K406 K697 Y719 V722 D728 W730	P405-H724 WeakPolarHBondContact CA-O 3.42Å; K406-H724 PolarHBondContact N-O 3.45Å; K697-H724 PolarHBondContact NZ-ND1 2.92Å; Y719-H724 AromaticContact CD2-NE2 3.7Å; Y719-H724 PolarHBondContact O-NE2 2.66Å; V722-H724 PolarHBondContact O-CE1 2.97Å; V722-H724 PolarHBondContact O-N 2.74Å; V722-H724 PolarHBondContact O-NE2 2.85Å; H724-D728 VanDerWaalsContact CA-OD2 3.26Å; H724-D728 WeakPolarHBondContact CA-OD2 3.29Å; H724-D728 IonicContact ND1-OD2 3.61Å; H724-W730 AromaticContact CE1-CZ2 3.95Å; H724-W730 AromaticContact ND1-NE1 3.65Å
725	R	83.2	Confident	82.2	Confident	45 Å²	45	57.1 Å²	57.1	17%	0.17	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-103.4	169.2	159	-53.8	-165.7	155.2	-176.6	-2.2	109.7	K406 D411 W660 D728	K406-R725 WeakPolarHBondContact O-CA 3.48Å; K406-R725 WeakPolarHBondContact O-CB 3.33Å; K406-R725 WeakPolarHBondContact O-CG 3.49Å; D411-R725 IonicContact OD1-NH1 2.66Å; D411-R725 IonicContact OD2-CZ 3.52Å; D411-R725 IonicContact OD2-NE 3.38Å; D411-R725 IonicContact OD2-NH1 3.74Å; D411-R725 PolarHBondContact OD2-NH1 2.93Å; W660-R725 VanDerWaalsContact CZ2-NH2 3.27Å; R725-D728 HydrophobicContact CB-CB 3.85Å; R725-D728 PolarHBondContact N-OD2 3.05Å; R725-D728 WeakPolarHBondContact O-CB 3.3Å
726	L	81.1	Confident	80.6	Confident	76 Å²	76	61.7 Å²	61.7	40%	0.398	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-34.2	174.1	-61.6	-179.8	0	0	0	111.4	P405 V407 T448 L449 H452	P405-L726 HydrophobicContact CB-CD2 3.97Å; P405-L726 HydrophobicContact CB-CG 4.33Å; P405-L726 HydrophobicContact CG-CD2 4.04Å; V407-L726 HydrophobicContact CG2-CB 4.21Å; V407-L726 HydrophobicContact CG2-CD1 3.91Å; V407-L726 HydrophobicContact CG2-CG 4.06Å; T448-L726 HydrophobicContact CG2-CD1 4.18Å; L449-L726 HydrophobicContact CD2-CB 3.96Å; L449-L726 HydrophobicContact CD2-CD1 4.07Å; H452-L726 HydrophobicContact CB-CD1 4.3Å
727	N	76.3	Confident	79.3	Confident	78 Å²	78	65.7 Å²	65.7	42%	0.417	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	40.7	177.4	-56.8	-6.8	0	0	0	111.3	D411 D729	D411-N727 PolarHBondContact O-ND2 3.5Å; N727-D729 PolarHBondContact O-N 2.94Å
728	D	75.9	Confident	78.1	Confident	44 Å²	44	66.2 Å²	66.2	24%	0.235	33%	0.328	C	S	.	.			trans	-94.1	90.5	-170.9	-152.3	-22.9	0	0	0	111.4	K697 H724 R725 W730	K697-D728 WeakPolarHBondContact CE-OD2 3.48Å; K697-D728 IonicContact NZ-OD1 2.62Å; K697-D728 IonicContact NZ-OD2 2.85Å; K697-D728 PolarHBondContact NZ-OD2 3.14Å; H724-D728 VanDerWaalsContact CA-OD2 3.26Å; H724-D728 WeakPolarHBondContact CA-OD2 3.29Å; H724-D728 IonicContact ND1-OD2 3.61Å; R725-D728 HydrophobicContact CB-CB 3.85Å; R725-D728 PolarHBondContact N-OD2 3.05Å; R725-D728 WeakPolarHBondContact O-CB 3.3Å; D728-W730 VanDerWaalsContact C-N 3.31Å; D728-W730 PolarHBondContact O-N 2.9Å
729	D	77.5	Confident	76.9	Confident	74 Å²	74	72.7 Å²	72.7	40%	0.396	35%	0.352	S	S	.	.			trans	-81.5	-0.7	-171.9	77.2	-34.2	0	0	0	115	N727 A731 Y732	N727-D729 PolarHBondContact O-N 2.94Å; D729-A731 PolarHBondContact O-N 3.31Å; D729-Y732 WeakPolarHBondContact O-CA 3.27Å; D729-Y732 WeakPolarHBondContact O-CB 3.29Å; D729-Y732 PolarHBondContact O-N 3.46Å
730	W	83.8	Confident	75.6	Confident	25 Å²	25	68.7 Å²	68.7	10%	0.095	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.7	-27.2	-173.5	72.1	-76.7	0	0	0	117.4	K697 T700 M715 I718 H724 D728 Y732	K697-W730 HydrophobicContact CD-CD2 4.23Å; K697-W730 HydrophobicContact CD-CG 4.32Å; K697-W730 VanDerWaalsContact CE-CG 3.47Å; K697-W730 HydrophobicContact CG-CB 4.22Å; K697-W730 HydrophobicContact CG-CD2 3.89Å; K697-W730 HydrophobicContact CG-CE3 3.85Å; K697-W730 HydrophobicContact CG-CG 4.03Å; T700-W730 WeakPolarHBondContact CB-O 3.36Å; T700-W730 HydrophobicContact CG2-CE3 4.06Å; T700-W730 HydrophobicContact CG2-CZ3 4.2Å; T700-W730 PolarHBondContact OG1-O 3.33Å; M715-W730 HydrophobicContact CE-CE3 4.08Å; M715-W730 HydrophobicContact CE-CH2 3.9Å; M715-W730 HydrophobicContact CE-CZ3 3.4Å; M715-W730 HydrophobicContact SD-CZ3 4Å; I718-W730 HydrophobicContact CB-CH2 3.75Å; I718-W730 HydrophobicContact CB-CZ3 3.85Å; I718-W730 HydrophobicContact CD1-CZ3 3.88Å; I718-W730 HydrophobicContact CG1-CZ3 4.47Å; I718-W730 HydrophobicContact CG2-CD2 4.47Å; I718-W730 HydrophobicContact CG2-CE3 3.98Å; I718-W730 HydrophobicContact CG2-CH2 3.42Å; I718-W730 VanDerWaalsContact CG2-CH2 3.42Å; I718-W730 HydrophobicContact CG2-CZ2 3.93Å; I718-W730 HydrophobicContact CG2-CZ3 3.43Å; I718-W730 VanDerWaalsContact CG2-CZ3 3.43Å; H724-W730 AromaticContact CE1-CZ2 3.95Å; H724-W730 AromaticContact ND1-NE1 3.65Å; D728-W730 VanDerWaalsContact C-N 3.31Å; D728-W730 PolarHBondContact O-N 2.9Å; W730-Y732 CarbonylContact C-O 3.57Å
731	A	81.1	Confident	74.6	Confident	36 Å²	36	70.8 Å²	70.8	30%	0.298	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-25.1	179	0	0	0	0	0	113	R708 M715 D729	R708-A731 VanDerWaalsContact CD-O 3.27Å; R708-A731 WeakPolarHBondContact CD-O 3.24Å; R708-A731 PolarHBondContact NH1-O 2.91Å; M715-A731 HydrophobicContact CE-CB 4.19Å; D729-A731 PolarHBondContact O-N 3.31Å
732	Y	75	Confident	73.7	Confident	162 Å²	162	73 Å²	73	64%	0.635	36%	0.36	S	S	*	.	S	Bend	trans	-84.4	161.5	167.3	-57.8	-89	0	0	0	108.7	D729 W730	D729-Y732 WeakPolarHBondContact O-CA 3.27Å; D729-Y732 WeakPolarHBondContact O-CB 3.29Å; D729-Y732 PolarHBondContact O-N 3.46Å; W730-Y732 CarbonylContact C-O 3.57Å
733	G	63.8	Low	73	Confident	14 Å²	14	74 Å²	74	14%	0.144	36%	0.363	C	S	.	.			trans	-142.8	80.7	-170.7	0	0	0	0	0	108.6
734	N	61.7	Low	72.5	Confident	113 Å²	113	76.5 Å²	76.5	60%	0.604	38%	0.378	S	S	*	.			trans	-98.6	-33.2	-171.2	-53.3	-16.1	0	0	0	110.2	L736	N734-L736 VanDerWaalsContact C-N 3.32Å; N734-L736 PolarHBondContact O-N 3.2Å
735	D	63.2	Low	72.4	Confident	61 Å²	61	78.7 Å²	78.7	33%	0.326	40%	0.401	S	S	.	.			trans	-80.1	65.4	176.5	-61.7	-8.7	0	0	0	112.4	K701 Y702 A738	K701-D735 HydrophobicContact CD-CB 4.33Å; K701-D735 WeakPolarHBondContact CD-OD2 3.31Å; K701-D735 WeakPolarHBondContact CE-OD2 3.43Å; K701-D735 IonicContact NZ-OD2 2.75Å; K701-D735 PolarHBondContact NZ-OD2 2.9Å; Y702-D735 HydrophobicContact CE1-CB 4.16Å; D735-A738 HydrophobicContact CB-CB 4.25Å
736	L	58.6	Low	72.4	Confident	114 Å²	114	80.7 Å²	80.7	60%	0.597	41%	0.412	S	S	*	.	S	Bend	trans	-83.2	-29.2	174	-68.6	179.5	0	0	0	113.3	N734	N734-L736 VanDerWaalsContact C-N 3.32Å; N734-L736 PolarHBondContact O-N 3.2Å
737	D	63.2	Low	72.6	Confident	140 Å²	140	78 Å²	78	75%	0.749	40%	0.398	S	S	*	.	S	Bend	trans	-90	-4.6	-175.3	-59.9	-59.8	0	0	0	114.4	R739	D737-R739 WeakPolarHBondContact O-CG 3.17Å; D737-R739 PolarHBondContact O-N 2.77Å
738	A	66.6	Low	73.2	Confident	22 Å²	22	77 Å²	77	18%	0.182	40%	0.396	C	S	.	.			trans	-69	121.1	-177.6	0	0	0	0	0	111.5	M666 Y702 D735 F743	M666-A738 WeakPolarHBondContact CE-O 3.42Å; Y702-A738 HydrophobicContact CE1-CB 4.18Å; D735-A738 HydrophobicContact CB-CB 4.25Å; A738-F743 HydrophobicContact CB-CE2 4.27Å; A738-F743 HydrophobicContact CB-CZ 4.21Å
739	R	68.1	Low	73.9	Confident	137 Å²	137	77.8 Å²	77.8	52%	0.517	41%	0.409	S	S	.	.			trans	-104.3	156.3	-171.3	-40.1	-175	-163.3	175.4	8.6	110.9	D737 W741 D742	D737-R739 WeakPolarHBondContact O-CG 3.17Å; D737-R739 PolarHBondContact O-N 2.77Å; R739-W741 HydrophobicContact CB-CD2 3.97Å; R739-W741 HydrophobicContact CB-CE3 4.39Å; R739-W741 HydrophobicContact CB-CG 4.49Å; R739-W741 HydrophobicContact CB-CH2 4.25Å; R739-W741 HydrophobicContact CB-CZ2 3.8Å; R739-W741 HydrophobicContact CG-CZ2 4.11Å; R739-W741 PolarHBondContact O-N 3.26Å; R739-W741 VanDerWaalsContact O-N 3.15Å; R739-D742 WeakPolarHBondContact CB-OD2 3.4Å; R739-D742 WeakPolarHBondContact CG-OD2 3.43Å; R739-D742 PolarHBondContact N-OD2 3.36Å; R739-D742 PolarHBondContact O-N 3.15Å
740	P	63	Low	74.6	Confident	51 Å²	51	75.3 Å²	75.3	33%	0.331	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.5	-177	-26.1	35.5	0	0	0	115	M666 V670	M666-P740 HydrophobicContact CB-CB 4.42Å; M666-P740 HydrophobicContact CE-CG 4.23Å; V670-P740 HydrophobicContact CG2-CG 4.04Å
741	W	68.2	Low	75	Confident	154 Å²	154	78.1 Å²	78.1	58%	0.583	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-17.4	-177.4	51.9	80.6	0	0	0	114.4	R739 F743 Q744	R739-W741 HydrophobicContact CB-CD2 3.97Å; R739-W741 HydrophobicContact CB-CE3 4.39Å; R739-W741 HydrophobicContact CB-CG 4.49Å; R739-W741 HydrophobicContact CB-CH2 4.25Å; R739-W741 HydrophobicContact CB-CZ2 3.8Å; R739-W741 HydrophobicContact CG-CZ2 4.11Å; R739-W741 PolarHBondContact O-N 3.26Å; R739-W741 VanDerWaalsContact O-N 3.15Å; W741-F743 PolarHBondContact O-N 2.86Å; W741-F743 VanDerWaalsContact O-N 3.08Å; W741-Q744 WeakPolarHBondContact O-CB 3.41Å; W741-Q744 PolarHBondContact O-N 3.17Å
742	D	71.2	Confident	75.5	Confident	80 Å²	80	78.1 Å²	78.1	43%	0.428	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25	-179.6	-56.8	-15.2	0	0	0	111.6	R739	R739-D742 WeakPolarHBondContact CB-OD2 3.4Å; R739-D742 WeakPolarHBondContact CG-OD2 3.43Å; R739-D742 PolarHBondContact N-OD2 3.36Å; R739-D742 PolarHBondContact O-N 3.15Å
743	F	75.3	Confident	76.4	Confident	30 Å²	30	71.7 Å²	71.7	13%	0.132	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	8.3	178.9	-52.7	-71.3	0	0	0	113.7	H662 M666 A738 W741 A745 E746 E747	H662-F743 HydrophobicContact CB-CB 4.28Å; H662-F743 HydrophobicContact CB-CD1 3.32Å; H662-F743 HydrophobicContact CB-CD2 3.79Å; H662-F743 HydrophobicContact CB-CE1 3.45Å; H662-F743 VanDerWaalsContact CB-CE1 3.45Å; H662-F743 HydrophobicContact CB-CE2 3.92Å; H662-F743 HydrophobicContact CB-CG 3.49Å; H662-F743 VanDerWaalsContact CB-CG 3.49Å; H662-F743 HydrophobicContact CB-CZ 3.75Å; H662-F743 AromaticContact CG-CD1 3.96Å; H662-F743 AromaticContact CG-CE1 3.74Å; H662-F743 AromaticContact ND1-CE1 3.88Å; M666-F743 HydrophobicContact CG-CD2 4.49Å; M666-F743 HydrophobicContact CG-CE2 4.28Å; A738-F743 HydrophobicContact CB-CE2 4.27Å; A738-F743 HydrophobicContact CB-CZ 4.21Å; W741-F743 PolarHBondContact O-N 2.86Å; W741-F743 VanDerWaalsContact O-N 3.08Å; F743-A745 VanDerWaalsContact C-N 3.25Å; F743-A745 PolarHBondContact O-N 3.24Å; F743-E746 WeakPolarHBondContact O-CB 3.21Å; F743-E746 PolarHBondContact O-N 3.16Å; F743-E747 PolarHBondContact O-N 2.71Å
744	Q	79.3	Confident	77.9	Confident	123 Å²	123	71 Å²	71	58%	0.575	38%	0.378	S	S	*	.	H	α-helix	trans	-65.4	-30.9	178.5	-173.7	167	-13	0	0	111.9	W741 E747 C748	W741-Q744 WeakPolarHBondContact O-CB 3.41Å; W741-Q744 PolarHBondContact O-N 3.17Å; Q744-E747 PolarHBondContact O-N 3.26Å; Q744-C748 PolarHBondContact O-N 3.16Å; Q744-C748 VanDerWaalsContact O-N 3.09Å; Q744-C748 PolarHBondContact O-SG 2.99Å
745	A	83.4	Confident	79.3	Confident	74 Å²	74	70.4 Å²	70.4	61%	0.612	37%	0.372	S	S	*	.	H	α-helix	trans	-62.8	-38.9	172.2	0	0	0	0	0	112.7	F743 E747 C748 A749	F743-A745 VanDerWaalsContact C-N 3.25Å; F743-A745 PolarHBondContact O-N 3.24Å; A745-E747 PolarHBondContact O-N 2.89Å; A745-C748 PolarHBondContact O-N 2.72Å; A745-A749 WeakPolarHBondContact O-CB 3.37Å; A745-A749 PolarHBondContact O-N 3.02Å
746	E	83.8	Confident	80.6	Confident	86 Å²	86	74.8 Å²	74.8	40%	0.402	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-45.6	177.3	-63	-174	156.8	0	0	111.3	H662 F743 L750	H662-E746 IonicContact ND1-OE1 3.21Å; H662-E746 PolarHBondContact ND1-OE1 3.17Å; H662-E746 IonicContact ND1-OE2 2.83Å; F743-E746 WeakPolarHBondContact O-CB 3.21Å; F743-E746 PolarHBondContact O-N 3.16Å; E746-L750 WeakPolarHBondContact O-CB 3.27Å; E746-L750 PolarHBondContact O-N 2.79Å
747	E	86.4	Confident	82.2	Confident	20 Å²	20	69.4 Å²	69.4	9%	0.093	36%	0.355	C	S	.	.	H	α-helix	trans	-72.8	-31.5	-179.6	-69.8	-69.8	167.7	0	0	113	Q581 R664 F743 Q744 A745 R751	Q581-E747 PolarHBondContact NE2-O 3Å; Q581-E747 PolarHBondContact NE2-OE2 3.5Å; R664-E747 IonicContact CZ-OE1 3.85Å; R664-E747 VanDerWaalsContact CZ-OE1 3.3Å; R664-E747 IonicContact CZ-OE2 3.55Å; R664-E747 IonicContact NE-OE1 2.78Å; R664-E747 PolarHBondContact NE-OE1 2.92Å; R664-E747 IonicContact NE-OE2 3.53Å; R664-E747 IonicContact NH2-OE1 3.06Å; R664-E747 PolarHBondContact NH2-OE1 2.8Å; R664-E747 IonicContact NH2-OE2 2.76Å; R664-E747 PolarHBondContact NH2-OE2 3.19Å; F743-E747 PolarHBondContact O-N 2.71Å; Q744-E747 PolarHBondContact O-N 3.26Å; A745-E747 PolarHBondContact O-N 2.89Å; E747-R751 WeakPolarHBondContact O-CB 3.3Å; E747-R751 PolarHBondContact O-N 3.3Å
748	C	88.4	Confident	83.6	Confident	56 Å²	56	63.5 Å²	63.5	38%	0.378	32%	0.324	S	S	.	.	H	α-helix	trans	-70.8	-44.9	174.1	-73.8	0	0	0	0	112.2	Q744 A745 L750 R751 A752	Q744-C748 PolarHBondContact O-N 3.16Å; Q744-C748 VanDerWaalsContact O-N 3.09Å; Q744-C748 PolarHBondContact O-SG 2.99Å; A745-C748 PolarHBondContact O-N 2.72Å; C748-L750 VanDerWaalsContact C-N 3.31Å; C748-L750 PolarHBondContact O-N 3.43Å; C748-R751 PolarHBondContact O-N 3.13Å; C748-A752 PolarHBondContact O-N 2.84Å
749	A	90.6	Very high	84.6	Confident	61 Å²	61	66 Å²	66	50%	0.504	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-40	174.6	0	0	0	0	0	111.7	A745 A752 S753	A745-A749 WeakPolarHBondContact O-CB 3.37Å; A745-A749 PolarHBondContact O-N 3.02Å; A749-A752 PolarHBondContact O-N 3.43Å; A749-S753 PolarHBondContact O-N 3.45Å; A749-S753 PolarHBondContact O-OG 3.32Å
750	L	91.8	Very high	85.4	Confident	22 Å²	22	63.7 Å²	63.7	12%	0.115	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-45.3	173.1	177.6	63.4	0	0	0	112	Y574 E577 K661 E746 C748 S753 I754	Y574-L750 HydrophobicContact CE1-CD1 4.22Å; E577-L750 HydrophobicContact CB-CD1 4.19Å; E577-L750 HydrophobicContact CG-CD1 4.09Å; K661-L750 HydrophobicContact CD-CD2 4.43Å; E746-L750 WeakPolarHBondContact O-CB 3.27Å; E746-L750 PolarHBondContact O-N 2.79Å; C748-L750 VanDerWaalsContact C-N 3.31Å; C748-L750 PolarHBondContact O-N 3.43Å; L750-S753 WeakPolarHBondContact O-CB 3.36Å; L750-S753 PolarHBondContact O-N 3.37Å; L750-I754 HydrophobicContact CD1-CD1 4.03Å; L750-I754 HydrophobicContact CD1-CG1 4.4Å; L750-I754 HydrophobicContact CG-CD1 3.85Å; L750-I754 WeakPolarHBondContact O-CD1 3.41Å; L750-I754 VanDerWaalsContact O-CG1 3.26Å; L750-I754 WeakPolarHBondContact O-CG1 3.18Å; L750-I754 PolarHBondContact O-N 2.83Å; L750-I754 VanDerWaalsContact O-N 3.08Å
751	R	91.9	Very high	86.6	Confident	84 Å²	84	63.6 Å²	63.6	32%	0.317	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-49.7	177.4	-170.5	-169.8	-68.5	103.4	-1.6	111.1	F585 E747 C748 S753 I754 E755	F585-R751 VanDerWaalsContact CZ-NH2 3.32Å; E747-R751 WeakPolarHBondContact O-CB 3.3Å; E747-R751 PolarHBondContact O-N 3.3Å; C748-R751 PolarHBondContact O-N 3.13Å; R751-S753 VanDerWaalsContact C-N 3.25Å; R751-S753 PolarHBondContact O-N 2.94Å; R751-I754 WeakPolarHBondContact O-CB 3.38Å; R751-I754 PolarHBondContact O-N 2.64Å; R751-E755 WeakPolarHBondContact CD-OE1 3.49Å; R751-E755 HydrophobicContact CG-CG 4.31Å; R751-E755 VanDerWaalsContact CG-OE1 3.26Å; R751-E755 WeakPolarHBondContact CG-OE1 3.39Å; R751-E755 WeakPolarHBondContact O-CG 2.92Å; R751-E755 PolarHBondContact O-N 3.37Å
752	A	92.2	Very high	87.6	Confident	37 Å²	37	57.4 Å²	57.4	31%	0.306	30%	0.301	S	S	.	.	H	α-helix	trans	-59.9	-34.6	178.8	0	0	0	0	0	112.9	C748 A749 R756	C748-A752 PolarHBondContact O-N 2.84Å; A749-A752 PolarHBondContact O-N 3.43Å; A752-R756 WeakPolarHBondContact O-CB 3.37Å; A752-R756 VanDerWaalsContact O-CG 3.23Å; A752-R756 WeakPolarHBondContact O-CG 3.47Å; A752-R756 PolarHBondContact O-N 2.78Å
753	S	93.8	Very high	88.2	Confident	27 Å²	27	58.5 Å²	58.5	19%	0.189	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-40.2	174.8	-52	0	0	0	0	112.2	A749 L750 R751 F757	A749-S753 PolarHBondContact O-N 3.45Å; A749-S753 PolarHBondContact O-OG 3.32Å; L750-S753 WeakPolarHBondContact O-CB 3.36Å; L750-S753 PolarHBondContact O-N 3.37Å; R751-S753 VanDerWaalsContact C-N 3.25Å; R751-S753 PolarHBondContact O-N 2.94Å; S753-F757 WeakPolarHBondContact O-CB 3.27Å; S753-F757 PolarHBondContact O-N 3.04Å
754	I	94.4	Very high	87.6	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-70.2	-41.2	178.2	-64.2	158.4	0	0	0	111.2	Y574 E577 Y578 L750 R751 F757 N758	Y574-I754 HydrophobicContact CD1-CG1 3.72Å; Y574-I754 HydrophobicContact CE1-CG1 4.49Å; Y574-I754 HydrophobicContact CG-CG1 4.13Å; E577-I754 HydrophobicContact CB-CD1 3.6Å; E577-I754 HydrophobicContact CB-CG1 4.17Å; Y578-I754 HydrophobicContact CD2-CG2 3.47Å; Y578-I754 VanDerWaalsContact CD2-CG2 3.47Å; Y578-I754 HydrophobicContact CE2-CG2 4.47Å; Y578-I754 HydrophobicContact CG-CG2 3.85Å; L750-I754 HydrophobicContact CD1-CD1 4.03Å; L750-I754 HydrophobicContact CD1-CG1 4.4Å; L750-I754 HydrophobicContact CG-CD1 3.85Å; L750-I754 WeakPolarHBondContact O-CD1 3.41Å; L750-I754 VanDerWaalsContact O-CG1 3.26Å; L750-I754 WeakPolarHBondContact O-CG1 3.18Å; L750-I754 PolarHBondContact O-N 2.83Å; L750-I754 VanDerWaalsContact O-N 3.08Å; R751-I754 WeakPolarHBondContact O-CB 3.38Å; R751-I754 PolarHBondContact O-N 2.64Å; I754-F757 PolarHBondContact O-N 3.5Å; I754-N758 WeakPolarHBondContact O-CB 3.31Å; I754-N758 PolarHBondContact O-N 3.28Å
755	E	91.7	Very high	86.6	Confident	100 Å²	100	64 Å²	64	47%	0.467	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-49	176.2	-73.6	162.9	168.5	0	0	110.4	R751 F757 N758 S759	R751-E755 WeakPolarHBondContact CD-OE1 3.49Å; R751-E755 HydrophobicContact CG-CG 4.31Å; R751-E755 VanDerWaalsContact CG-OE1 3.26Å; R751-E755 WeakPolarHBondContact CG-OE1 3.39Å; R751-E755 WeakPolarHBondContact O-CG 2.92Å; R751-E755 PolarHBondContact O-N 3.37Å; E755-F757 PolarHBondContact O-N 2.86Å; E755-N758 PolarHBondContact O-N 3.14Å; E755-S759 PolarHBondContact O-N 3.48Å; E755-S759 PolarHBondContact O-OG 3.2Å
756	R	89.9	Confident	85	Confident	153 Å²	153	68.4 Å²	68.4	58%	0.577	35%	0.348	S	S	*	.	H	α-helix	trans	-55.7	-47.7	173.6	-73.9	170.9	-178.1	-172.9	-2.4	112.7	Q469 A752 R760	Q469-R756 VanDerWaalsContact OE1-CD 3.27Å; A752-R756 WeakPolarHBondContact O-CB 3.37Å; A752-R756 VanDerWaalsContact O-CG 3.23Å; A752-R756 WeakPolarHBondContact O-CG 3.47Å; A752-R756 PolarHBondContact O-N 2.78Å; R756-R760 WeakPolarHBondContact O-CB 3.15Å; R756-R760 PolarHBondContact O-N 3.4Å
757	F	92.4	Very high	83.7	Confident	1 Å²	1	68 Å²	68	0%	0.004	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-47.8	176.9	164.8	-105.4	0	0	0	112.3	E465 H572 Y574 Q575 S753 I754 E755 R760 R761 Y762	E465-F757 WeakPolarHBondContact OE1-CD2 3.46Å; H572-F757 HydrophobicContact CB-CE2 4.46Å; H572-F757 HydrophobicContact CB-CZ 3.92Å; H572-F757 AromaticContact CE1-CD2 3.59Å; H572-F757 AromaticContact CE1-CE2 3.37Å; H572-F757 WeakPolarHBondContact CE1-CE2 3.11Å; H572-F757 AromaticContact CE1-CZ 3.89Å; H572-F757 AromaticContact CG-CE2 3.76Å; H572-F757 AromaticContact CG-CZ 3.65Å; H572-F757 AromaticContact ND1-CD2 3.56Å; H572-F757 AromaticContact ND1-CE1 3.63Å; H572-F757 AromaticContact ND1-CE2 3Å; H572-F757 WeakPolarHBondContact ND1-CE2 3.31Å; H572-F757 AromaticContact ND1-CZ 3.03Å; H572-F757 WeakPolarHBondContact ND1-CZ 3.44Å; Y574-F757 HydrophobicContact CD2-CB 3.73Å; Y574-F757 HydrophobicContact CD2-CD1 4.46Å; Y574-F757 HydrophobicContact CD2-CD2 4.42Å; Y574-F757 AromaticContact CD2-CG 3.95Å; Y574-F757 HydrophobicContact CD2-CG 3.95Å; Y574-F757 HydrophobicContact CG-CB 4.36Å; Y574-F757 HydrophobicContact CG-CD1 4.5Å; Y574-F757 HydrophobicContact CG-CG 4.42Å; Q575-F757 HydrophobicContact CG-CE1 3.9Å; Q575-F757 HydrophobicContact CG-CZ 4.14Å; S753-F757 WeakPolarHBondContact O-CB 3.27Å; S753-F757 PolarHBondContact O-N 3.04Å; I754-F757 PolarHBondContact O-N 3.5Å; E755-F757 PolarHBondContact O-N 2.86Å; F757-R760 PolarHBondContact O-N 2.99Å; F757-R761 HydrophobicContact CE2-CB 4.48Å; F757-R761 VanDerWaalsContact O-CB 3.3Å; F757-R761 WeakPolarHBondContact O-CB 3.45Å; F757-R761 PolarHBondContact O-N 3.17Å; F757-Y762 HydrophobicContact CD1-CE2 4.46Å; F757-Y762 AromaticContact CE1-CE2 3.83Å; F757-Y762 HydrophobicContact CE1-CE2 3.83Å; F757-Y762 HydrophobicContact CZ-CE2 4.09Å; F757-Y762 VanDerWaalsContact CZ-OH 3.22Å; F757-Y762 WeakPolarHBondContact CZ-OH 3.29Å
758	N	92.6	Very high	82.1	Confident	16 Å²	16	70.8 Å²	70.8	9%	0.086	37%	0.37	C	S	.	.	H	α-helix	trans	-66.9	-43.6	-177.8	-78.2	-12.2	0	0	0	111.7	Y489 I754 E755 R761 Y762	Y489-N758 PolarHBondContact OH-ND2 3.4Å; Y489-N758 PolarHBondContact OH-OD1 3.44Å; Y489-N758 VanDerWaalsContact OH-OD1 3.14Å; I754-N758 WeakPolarHBondContact O-CB 3.31Å; I754-N758 PolarHBondContact O-N 3.28Å; E755-N758 PolarHBondContact O-N 3.14Å; N758-R761 PolarHBondContact O-N 3.28Å; N758-Y762 HydrophobicContact CB-CD2 4.26Å; N758-Y762 WeakPolarHBondContact O-CD2 3.28Å; N758-Y762 PolarHBondContact O-N 2.78Å; N758-Y762 WeakPolarHBondContact OD1-CE2 3.3Å
759	S	87.8	Confident	80.6	Confident	73 Å²	73	72.3 Å²	72.3	51%	0.51	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-44	175.1	-67.9	0	0	0	0	112.1	E755 R761 D763	E755-S759 PolarHBondContact O-N 3.48Å; E755-S759 PolarHBondContact O-OG 3.2Å; S759-R761 PolarHBondContact O-N 3.35Å; S759-D763 VanDerWaalsContact O-CB 3.29Å; S759-D763 WeakPolarHBondContact O-CB 3.32Å; S759-D763 PolarHBondContact O-N 3.13Å
760	R	86.4	Confident	78.8	Confident	90 Å²	90	75.5 Å²	75.5	34%	0.34	39%	0.388	S	S	.	.	H	α-helix	trans	-59.7	-30.6	178.4	-173.6	-177.1	67.9	67.1	-2.6	113.3	E465 E478 R756 F757	E465-R760 VanDerWaalsContact CD-NH2 3.26Å; E465-R760 IonicContact OE1-CZ 3.36Å; E465-R760 IonicContact OE1-NH2 3.87Å; E465-R760 PolarHBondContact OE1-NH2 3.15Å; E465-R760 IonicContact OE2-CZ 3.86Å; E465-R760 IonicContact OE2-NE 3.16Å; E465-R760 PolarHBondContact OE2-NE 2.82Å; E465-R760 IonicContact OE2-NH2 2.77Å; E465-R760 PolarHBondContact OE2-NH2 3.32Å; E478-R760 IonicContact OE2-CZ 2.72Å; E478-R760 VanDerWaalsContact OE2-CZ 3.3Å; E478-R760 IonicContact OE2-NH1 2.92Å; E478-R760 PolarHBondContact OE2-NH1 3.4Å; E478-R760 IonicContact OE2-NH2 3.14Å; E478-R760 PolarHBondContact OE2-NH2 2.89Å; R756-R760 WeakPolarHBondContact O-CB 3.15Å; R756-R760 PolarHBondContact O-N 3.4Å; F757-R760 PolarHBondContact O-N 2.99Å
761	R	87.5	Confident	77.1	Confident	48 Å²	48	78.8 Å²	78.8	18%	0.181	40%	0.401	C	S	.	.	H	α-helix	trans	-114.2	-26.1	-164.3	-171.3	172.9	172.4	120.1	-7.6	115.9	E478 V480 E486 F757 N758 S759	E478-R761 IonicContact OE1-NH1 2.78Å; E478-R761 PolarHBondContact OE1-NH1 3.25Å; E478-R761 IonicContact OE2-CZ 3.2Å; E478-R761 IonicContact OE2-NH1 2.59Å; E478-R761 PolarHBondContact OE2-NH1 3.02Å; V480-R761 VanDerWaalsContact CG2-CZ 3.43Å; E486-R761 VanDerWaalsContact CD-NH2 3.33Å; E486-R761 IonicContact OE1-CZ 3.82Å; E486-R761 IonicContact OE1-NE 2.71Å; E486-R761 PolarHBondContact OE1-NE 3Å; E486-R761 IonicContact OE1-NH2 2.75Å; E486-R761 PolarHBondContact OE1-NH2 3.35Å; E486-R761 IonicContact OE2-NH2 3.2Å; E486-R761 PolarHBondContact OE2-NH2 2.86Å; F757-R761 HydrophobicContact CE2-CB 4.48Å; F757-R761 VanDerWaalsContact O-CB 3.3Å; F757-R761 WeakPolarHBondContact O-CB 3.45Å; F757-R761 PolarHBondContact O-N 3.17Å; N758-R761 PolarHBondContact O-N 3.28Å; S759-R761 PolarHBondContact O-N 3.35Å
762	Y	88.8	Confident	75.5	Confident	25 Å²	25	79.2 Å²	79.2	10%	0.098	41%	0.409	C	S	.	.	H	α-helix	trans	-126.1	-10.8	-177.3	-42	-80.8	0	0	0	114.4	E486 Y489 Q490 L493 Q575 F757 N758 K764	E486-Y762 WeakPolarHBondContact OE1-CE1 3.43Å; E486-Y762 PolarHBondContact OE1-OH 3.45Å; Y489-Y762 AromaticContact CD1-CE1 3.95Å; Y489-Y762 HydrophobicContact CD1-CE1 3.95Å; Y489-Y762 HydrophobicContact CD1-CE2 4.1Å; Y489-Y762 AromaticContact CD1-CZ 3.62Å; Y489-Y762 HydrophobicContact CE1-CD2 4.26Å; Y489-Y762 HydrophobicContact CE1-CE1 4.3Å; Y489-Y762 AromaticContact CE1-CE2 3.6Å; Y489-Y762 HydrophobicContact CE1-CE2 3.6Å; Y489-Y762 AromaticContact CE1-CZ 3.61Å; Q490-Y762 HydrophobicContact CB-CD1 4.36Å; Q490-Y762 HydrophobicContact CG-CD1 4.22Å; L493-Y762 HydrophobicContact CD2-CD1 4.39Å; L493-Y762 HydrophobicContact CD2-CD2 3.5Å; L493-Y762 HydrophobicContact CD2-CE2 4.31Å; L493-Y762 HydrophobicContact CD2-CG 3.56Å; Q575-Y762 PolarHBondContact NE2-OH 3.24Å; F757-Y762 HydrophobicContact CD1-CE2 4.46Å; F757-Y762 AromaticContact CE1-CE2 3.83Å; F757-Y762 HydrophobicContact CE1-CE2 3.83Å; F757-Y762 HydrophobicContact CZ-CE2 4.09Å; F757-Y762 VanDerWaalsContact CZ-OH 3.22Å; F757-Y762 WeakPolarHBondContact CZ-OH 3.29Å; N758-Y762 HydrophobicContact CB-CD2 4.26Å; N758-Y762 WeakPolarHBondContact O-CD2 3.28Å; N758-Y762 PolarHBondContact O-N 2.78Å; N758-Y762 WeakPolarHBondContact OD1-CE2 3.3Å; Y762-K764 PolarHBondContact O-N 3.34Å
763	D	83.4	Confident	73.8	Confident	102 Å²	102	83.7 Å²	83.7	55%	0.545	44%	0.435	S	S	.	.			trans	-73.5	121.8	173.6	-157.9	-25.1	0	0	0	109.6	S759 S765	S759-D763 VanDerWaalsContact O-CB 3.29Å; S759-D763 WeakPolarHBondContact O-CB 3.32Å; S759-D763 PolarHBondContact O-N 3.13Å; D763-S765 VanDerWaalsContact C-N 3.33Å; D763-S765 WeakPolarHBondContact OD1-CB 3.44Å; D763-S765 PolarHBondContact OD1-N 2.78Å
764	K	63.2	Low	72.1	Confident	175 Å²	175	87 Å²	87	76%	0.761	45%	0.454	S	S	*	.			trans	-89.5	-3.2	178.2	-62.9	-175.5	-179.3	-179.3	0	112.1	Y762 H766	Y762-K764 PolarHBondContact O-N 3.34Å; K764-H766 PolarHBondContact O-N 3.2Å
765	S	57.6	Low	70.4	Confident	93 Å²	93	90.7 Å²	90.7	65%	0.65	47%	0.474	S	S	*	.	S	Bend	trans	-72.9	78.6	172.5	-178.8	0	0	0	0	110.8	D763	D763-S765 VanDerWaalsContact C-N 3.33Å; D763-S765 WeakPolarHBondContact OD1-CB 3.44Å; D763-S765 PolarHBondContact OD1-N 2.78Å
766	H	51.5	Low	69	Low	168 Å²	168	92.8 Å²	92.8	78%	0.778	49%	0.488	S	S	*	.			trans	14	112.6	167.3	-63.8	-72.8	0	0	0	117.3	K764	K764-H766 PolarHBondContact O-N 3.2Å
767	S	55.4	Low	67.9	Low	78 Å²	78	88.4 Å²	88.4	55%	0.545	48%	0.481	S	S	.	.	S	Bend	trans	30.9	95.8	150.8	-52.1	0	0	0	0	115.6	P769	S767-P769 VanDerWaalsContact O-N 3.15Å
768	N	53.9	Low	66.4	Low	77 Å²	77	96.9 Å²	96.9	41%	0.412	53%	0.525	S	S	.	.			trans	-33.3	118.6	179.4	179.3	55	0	0	0	111.8	D770 F771	N768-D770 PolarHBondContact ND2-OD2 2.95Å; N768-D770 PolarHBondContact O-N 3.45Å; N768-F771 HydrophobicContact CB-CD2 3.89Å; N768-F771 HydrophobicContact CB-CE2 4.21Å; N768-F771 WeakPolarHBondContact ND2-CE2 3.24Å; N768-F771 PolarHBondContact O-N 3.41Å
769	P	55.3	Low	64.9	Low	89 Å²	89	104.6 Å²	104.6	58%	0.578	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-60.8	-22.7	-162.7	18.9	-32.1	0	0	0	114.4	S767 F771 L772	S767-P769 VanDerWaalsContact O-N 3.15Å; P769-F771 PolarHBondContact O-N 2.76Å; P769-F771 VanDerWaalsContact O-N 3.12Å; P769-L772 HydrophobicContact CB-CD1 4.45Å; P769-L772 PolarHBondContact O-N 2.57Å
770	D	54.4	Low	63.7	Low	127 Å²	127	102.1 Å²	102.1	68%	0.679	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-60.2	-15.9	171.4	-45.2	-42.8	0	0	0	114	N768	N768-D770 PolarHBondContact ND2-OD2 2.95Å; N768-D770 PolarHBondContact O-N 3.45Å
771	F	56	Low	62.4	Low	92 Å²	92	102.2 Å²	102.2	40%	0.404	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-114.4	4.5	-177.5	-54.1	-37.6	0	0	0	113.6	P472 L473 N768 P769	P472-F771 HydrophobicContact CB-CD2 4.44Å; P472-F771 HydrophobicContact CB-CE1 4.07Å; P472-F771 HydrophobicContact CB-CE2 3.77Å; P472-F771 HydrophobicContact CB-CZ 3.57Å; P472-F771 HydrophobicContact CG-CE1 3.69Å; P472-F771 HydrophobicContact CG-CE2 4.24Å; P472-F771 HydrophobicContact CG-CZ 3.51Å; L473-F771 HydrophobicContact CD2-CB 3.74Å; L473-F771 HydrophobicContact CD2-CD1 3.83Å; L473-F771 HydrophobicContact CD2-CG 3.99Å; L473-F771 HydrophobicContact CG-CD1 4.13Å; N768-F771 HydrophobicContact CB-CD2 3.89Å; N768-F771 HydrophobicContact CB-CE2 4.21Å; N768-F771 WeakPolarHBondContact ND2-CE2 3.24Å; N768-F771 PolarHBondContact O-N 3.41Å; P769-F771 PolarHBondContact O-N 2.76Å; P769-F771 VanDerWaalsContact O-N 3.12Å
772	L	56.9	Low	60.9	Low	93 Å²	93	108 Å²	108	49%	0.487	59%	0.587	S	S	.	*	S	Bend	trans	-73.6	146.5	166.2	-67.5	174	0	0	0	109.6	P769 V774	P769-L772 HydrophobicContact CB-CD1 4.45Å; P769-L772 PolarHBondContact O-N 2.57Å; L772-V774 PolarHBondContact O-N 3.27Å
773	P	56.9	Low	59.4	Low	130 Å²	130	109.8 Å²	109.8	84%	0.844	61%	0.613	S	S	*	*			trans	-66	106.5	176.4	26.7	-33.4	0	0	0	110.3	D775	P773-D775 PolarHBondContact O-N 3.45Å
774	V	57.7	Low	58.4	Low	98 Å²	98	110.9 Å²	110.9	59%	0.594	62%	0.615	S	S	*	*			trans	-79.5	115.2	177.2	-175.6	0	0	0	0	109.6	L772 N776	L772-V774 PolarHBondContact O-N 3.27Å; V774-N776 PolarHBondContact O-N 3.38Å; V774-N776 PolarHBondContact O-ND2 3.28Å
775	D	59.3	Low	58	Low	77 Å²	77	114 Å²	114	41%	0.412	62%	0.622	S	S	.	*			trans	-74.3	95.1	171.5	-163.3	-20.4	0	0	0	109.8	P773 C777 S780	P773-D775 PolarHBondContact O-N 3.45Å; D775-C777 PolarHBondContact O-N 3.45Å; D775-C777 WeakPolarHBondContact OD1-CB 3.5Å; D775-C777 PolarHBondContact OD1-N 2.86Å; D775-C777 VanDerWaalsContact OD1-N 3.1Å; D775-S780 WeakPolarHBondContact OD1-CB 3.47Å; D775-S780 WeakPolarHBondContact OD2-CB 3.21Å; D775-S780 PolarHBondContact OD2-OG 3.21Å
776	N	62.1	Low	58.5	Low	143 Å²	143	113.7 Å²	113.7	77%	0.765	62%	0.616	S	S	*	*			trans	-79.6	1.7	-179.9	-68	-65.7	0	0	0	113	V774	V774-N776 PolarHBondContact O-N 3.38Å; V774-N776 PolarHBondContact O-ND2 3.28Å
777	C	67.2	Low	59.3	Low	62 Å²	62	112.8 Å²	112.8	42%	0.419	62%	0.617	S	S	.	*			trans	-94.5	107.5	-179.5	-176.3	0	0	0	0	110.9	D775 Q779 S780	D775-C777 PolarHBondContact O-N 3.45Å; D775-C777 WeakPolarHBondContact OD1-CB 3.5Å; D775-C777 PolarHBondContact OD1-N 2.86Å; D775-C777 VanDerWaalsContact OD1-N 3.1Å; C777-Q779 PolarHBondContact O-N 2.85Å; C777-S780 WeakPolarHBondContact O-CB 3.25Å; C777-S780 PolarHBondContact O-N 3.22Å
778	L	60.6	Low	60.3	Low	179 Å²	179	113 Å²	113	94%	0.937	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-9.6	177.3	-66.6	173.4	0	0	0	114.6
779	Q	60.3	Low	61.7	Low	177 Å²	177	113.4 Å²	113.4	83%	0.827	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-3.5	177.3	-66.2	165	-48.8	0	0	112.7	C777	C777-Q779 PolarHBondContact O-N 2.85Å
780	S	64.1	Low	62.8	Low	21 Å²	21	116.7 Å²	116.7	15%	0.147	63%	0.626	C	S	.	*			trans	-76.7	128.2	179.3	177.1	0	0	0	0	111.4	D775 C777 L782 Q784	D775-S780 WeakPolarHBondContact OD1-CB 3.47Å; D775-S780 WeakPolarHBondContact OD2-CB 3.21Å; D775-S780 PolarHBondContact OD2-OG 3.21Å; C777-S780 WeakPolarHBondContact O-CB 3.25Å; C777-S780 PolarHBondContact O-N 3.22Å; S780-L782 PolarHBondContact OG-N 2.99Å; S780-Q784 PolarHBondContact O-NE2 2.79Å
781	V	59.2	Low	64	Low	92 Å²	92	116.6 Å²	116.6	56%	0.558	63%	0.626	S	S	*	*			trans	-93.7	-9.2	172.4	-157.4	0	0	0	0	110.8	G783 Q784 V786	V781-G783 VanDerWaalsContact C-N 3.31Å; V781-G783 PolarHBondContact O-N 3.02Å; V781-Q784 HydrophobicContact CG1-CB 4.39Å; V781-Q784 PolarHBondContact O-N 3.44Å; V781-V786 HydrophobicContact CG1-CG2 4.07Å
782	L	55.2	Low	65.1	Low	170 Å²	170	115 Å²	115	89%	0.89	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-30.7	-172.7	-62.1	174.2	0	0	0	113.1	S780	S780-L782 PolarHBondContact OG-N 2.99Å
783	G	57.1	Low	66.1	Low	63 Å²	63	116.3 Å²	116.3	65%	0.649	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-4.8	172.4	0	0	0	0	0	115	V781	V781-G783 VanDerWaalsContact C-N 3.31Å; V781-G783 PolarHBondContact O-N 3.02Å
784	Q	62.5	Low	67.3	Low	124 Å²	124	117.8 Å²	117.8	58%	0.579	62%	0.619	S	S	*	*			trans	-103.2	121.3	-172.9	-58.5	-172.1	31.9	0	0	111.4	S780 V781 V786	S780-Q784 PolarHBondContact O-NE2 2.79Å; V781-Q784 HydrophobicContact CG1-CB 4.39Å; V781-Q784 PolarHBondContact O-N 3.44Å; Q784-V786 HydrophobicContact CB-CG2 4.37Å; Q784-V786 PolarHBondContact O-N 3.07Å; Q784-V786 VanDerWaalsContact O-N 3.1Å
785	R	55.7	Low	68.5	Low	241 Å²	241	117 Å²	117	91%	0.909	61%	0.612	S	S	*	*			trans	-72.2	101.9	164.3	-80.7	-168.2	174.8	-159.4	-0.3	109.3
786	V	67.6	Low	69.7	Low	86 Å²	86	118.3 Å²	118.3	52%	0.521	61%	0.612	S	S	.	*			trans	-98.7	108.9	168.4	-178	0	0	0	0	107.9	V781 Q784 L788	V781-V786 HydrophobicContact CG1-CG2 4.07Å; Q784-V786 HydrophobicContact CB-CG2 4.37Å; Q784-V786 PolarHBondContact O-N 3.07Å; Q784-V786 VanDerWaalsContact O-N 3.1Å; V786-L788 HydrophobicContact CG1-CD2 4.4Å; V786-L788 PolarHBondContact O-N 2.85Å
787	D	68.8	Low	70.8	Confident	149 Å²	149	117.6 Å²	117.6	80%	0.797	61%	0.608	S	S	*	*			trans	-71.7	108.6	174.9	-67.2	-42.1	0	0	0	109.4
788	L	76.7	Confident	71.6	Confident	84 Å²	84	120.1 Å²	120.1	44%	0.44	62%	0.617	S	S	.	*			trans	-77.6	131.6	-177.4	-65.2	172	0	0	0	110.8	V786 F792 Q793	V786-L788 HydrophobicContact CG1-CD2 4.4Å; V786-L788 PolarHBondContact O-N 2.85Å; L788-F792 HydrophobicContact CB-CD1 4.15Å; L788-F792 HydrophobicContact CD1-CD1 4.01Å; L788-F792 HydrophobicContact CD1-CE1 3.98Å; L788-F792 HydrophobicContact CD2-CD1 4.1Å; L788-F792 HydrophobicContact CD2-CE1 4.19Å; L788-F792 HydrophobicContact CG-CD1 4.32Å; L788-Q793 HydrophobicContact CB-CG 4.37Å; L788-Q793 PolarHBondContact O-NE2 3.44Å
789	P	81.9	Confident	72.8	Confident	84 Å²	84	116.5 Å²	116.5	55%	0.545	59%	0.591	S	S	.	*			trans	-54.9	146.4	177.8	-26.7	34.8	0	0	0	113.2	D791 F792 Q793	P789-D791 VanDerWaalsContact C-N 3.25Å; P789-D791 PolarHBondContact O-N 3.42Å; P789-F792 WeakPolarHBondContact O-CA 3.5Å; P789-F792 WeakPolarHBondContact O-CB 3.38Å; P789-F792 PolarHBondContact O-N 2.86Å; P789-Q793 PolarHBondContact O-N 2.78Å; P789-Q793 VanDerWaalsContact O-N 3.12Å
790	E	78.6	Confident	73.9	Confident	159 Å²	159	109.7 Å²	109.7	74%	0.743	56%	0.56	S	S	*	*	H	α-helix	trans	-56.7	-39.7	179.9	-62.2	-176.7	152.2	0	0	111.9	F792 Q793 M794	E790-F792 PolarHBondContact O-N 2.62Å; E790-Q793 PolarHBondContact O-N 2.85Å; E790-Q793 VanDerWaalsContact O-N 3.11Å; E790-M794 WeakPolarHBondContact O-CG 3.38Å; E790-M794 PolarHBondContact O-N 2.95Å
791	D	79.1	Confident	74.9	Confident	125 Å²	125	114.8 Å²	114.8	67%	0.668	58%	0.581	S	S	*	*	H	α-helix	trans	-57.3	-34.6	173.1	-67.2	-35.1	0	0	0	113.2	P789 N795	P789-D791 VanDerWaalsContact C-N 3.25Å; P789-D791 PolarHBondContact O-N 3.42Å; D791-N795 WeakPolarHBondContact O-CB 3.49Å; D791-N795 PolarHBondContact O-N 3.22Å; D791-N795 PolarHBondContact O-ND2 3.29Å
792	F	80.3	Confident	76	Confident	57 Å²	57	118.4 Å²	118.4	25%	0.25	59%	0.585	C	S	.	*	H	α-helix	trans	-74.8	-39.2	176.9	-175.7	-93	0	0	0	111.2	L788 P789 E790 N795 Y796 W799	L788-F792 HydrophobicContact CB-CD1 4.15Å; L788-F792 HydrophobicContact CD1-CD1 4.01Å; L788-F792 HydrophobicContact CD1-CE1 3.98Å; L788-F792 HydrophobicContact CD2-CD1 4.1Å; L788-F792 HydrophobicContact CD2-CE1 4.19Å; L788-F792 HydrophobicContact CG-CD1 4.32Å; P789-F792 WeakPolarHBondContact O-CA 3.5Å; P789-F792 WeakPolarHBondContact O-CB 3.38Å; P789-F792 PolarHBondContact O-N 2.86Å; E790-F792 PolarHBondContact O-N 2.62Å; F792-N795 CarbonylContact O-C 3.43Å; F792-N795 PolarHBondContact O-N 3.12Å; F792-Y796 AromaticContact CE1-CD2 3.77Å; F792-Y796 HydrophobicContact CE1-CD2 3.77Å; F792-Y796 HydrophobicContact CE1-CE2 4.25Å; F792-Y796 HydrophobicContact CZ-CD2 4.21Å; F792-Y796 WeakPolarHBondContact O-CA 3.41Å; F792-Y796 PolarHBondContact O-N 2.96Å; F792-W799 HydrophobicContact CE2-CB 4.29Å; F792-W799 AromaticContact CE2-CD1 3.69Å; F792-W799 AromaticContact CE2-CD2 3.76Å; F792-W799 HydrophobicContact CE2-CD2 3.76Å; F792-W799 AromaticContact CE2-CE2 3.92Å; F792-W799 HydrophobicContact CE2-CE3 4.41Å; F792-W799 AromaticContact CE2-CG 3.65Å; F792-W799 HydrophobicContact CE2-CG 3.65Å; F792-W799 AromaticContact CE2-NE1 3.82Å; F792-W799 AromaticContact CZ-CD2 3.74Å; F792-W799 HydrophobicContact CZ-CD2 3.74Å; F792-W799 AromaticContact CZ-CE3 3.93Å; F792-W799 HydrophobicContact CZ-CE3 3.93Å; F792-W799 HydrophobicContact CZ-CG 4.06Å; F792-W799 HydrophobicContact CZ-CZ3 4.41Å
793	Q	78.3	Confident	77.2	Confident	122 Å²	122	112.6 Å²	112.6	57%	0.57	55%	0.553	S	S	*	*	H	α-helix	trans	-63.9	-41.1	175.8	-59.4	-179.1	38.4	0	0	111.3	L788 P789 E790 N795	L788-Q793 HydrophobicContact CB-CG 4.37Å; L788-Q793 PolarHBondContact O-NE2 3.44Å; P789-Q793 PolarHBondContact O-N 2.78Å; P789-Q793 VanDerWaalsContact O-N 3.12Å; E790-Q793 PolarHBondContact O-N 2.85Å; E790-Q793 VanDerWaalsContact O-N 3.11Å; Q793-N795 VanDerWaalsContact C-N 3.32Å; Q793-N795 PolarHBondContact O-N 3.32Å
794	M	81.1	Confident	78.2	Confident	160 Å²	160	112.5 Å²	112.5	79%	0.788	54%	0.54	S	S	*	.	H	α-helix	trans	-70.3	-23.5	177.2	-69.5	-166.9	66.2	0	0	114.4	E790	E790-M794 WeakPolarHBondContact O-CG 3.38Å; E790-M794 PolarHBondContact O-N 2.95Å
795	N	84.2	Confident	79.1	Confident	83 Å²	83	113.9 Å²	113.9	44%	0.444	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	16.6	-178.5	-66.1	-82.2	0	0	0	113	D791 F792 Q793 D797 L798 W799	D791-N795 WeakPolarHBondContact O-CB 3.49Å; D791-N795 PolarHBondContact O-N 3.22Å; D791-N795 PolarHBondContact O-ND2 3.29Å; F792-N795 CarbonylContact O-C 3.43Å; F792-N795 PolarHBondContact O-N 3.12Å; Q793-N795 VanDerWaalsContact C-N 3.32Å; Q793-N795 PolarHBondContact O-N 3.32Å; N795-D797 PolarHBondContact O-N 2.86Å; N795-L798 WeakPolarHBondContact O-CB 3.42Å; N795-L798 PolarHBondContact O-N 2.79Å; N795-W799 PolarHBondContact O-N 3.06Å
796	Y	84.4	Confident	80.2	Confident	104 Å²	104	106.3 Å²	106.3	41%	0.408	53%	0.528	S	S	.	.	H	α-helix	trans	-59.3	-44.9	-170.9	179.5	-109.3	0	0	0	113.5	F792 L798 W799 L800	F792-Y796 AromaticContact CE1-CD2 3.77Å; F792-Y796 HydrophobicContact CE1-CD2 3.77Å; F792-Y796 HydrophobicContact CE1-CE2 4.25Å; F792-Y796 HydrophobicContact CZ-CD2 4.21Å; F792-Y796 WeakPolarHBondContact O-CA 3.41Å; F792-Y796 PolarHBondContact O-N 2.96Å; Y796-L798 PolarHBondContact O-N 2.85Å; Y796-W799 HydrophobicContact CE2-CE3 4.43Å; Y796-W799 WeakPolarHBondContact O-CB 3.19Å; Y796-W799 PolarHBondContact O-N 3.27Å; Y796-W799 VanDerWaalsContact O-N 3.17Å; Y796-L800 HydrophobicContact CD1-CD1 4Å; Y796-L800 HydrophobicContact CE1-CD1 3.42Å; Y796-L800 VanDerWaalsContact CE1-CD1 3.42Å; Y796-L800 HydrophobicContact CE1-CG 4.09Å; Y796-L800 HydrophobicContact CE2-CG 4.36Å; Y796-L800 PolarHBondContact O-N 2.82Å
797	D	84.5	Confident	80.5	Confident	127 Å²	127	107.6 Å²	107.6	68%	0.679	53%	0.527	S	S	*	.	H	α-helix	trans	-65.5	-39.4	-179.8	-58	-40.1	0	0	0	111.9	N795 W799 L800 E801	N795-D797 PolarHBondContact O-N 2.86Å; D797-W799 VanDerWaalsContact C-N 3.32Å; D797-W799 PolarHBondContact O-N 3.48Å; D797-L800 PolarHBondContact O-N 2.79Å; D797-E801 PolarHBondContact O-N 3.47Å
798	L	84.2	Confident	80.5	Confident	115 Å²	115	106.6 Å²	106.6	60%	0.602	53%	0.528	S	S	*	.	H	α-helix	trans	-65.1	-34.8	173.8	-97.6	161.9	0	0	0	112.2	N795 Y796 R802	N795-L798 WeakPolarHBondContact O-CB 3.42Å; N795-L798 PolarHBondContact O-N 2.79Å; Y796-L798 PolarHBondContact O-N 2.85Å; L798-R802 WeakPolarHBondContact O-CB 3.43Å; L798-R802 PolarHBondContact O-N 3.5Å; L798-R802 VanDerWaalsContact O-N 3.15Å
799	W	86.1	Confident	80.2	Confident	104 Å²	104	106.7 Å²	106.7	39%	0.394	53%	0.529	S	S	.	.	H	α-helix	trans	-70.1	-44.4	173.7	178.6	88.8	0	0	0	111.5	F792 N795 Y796 D797 E801 R802 E803 V804	F792-W799 HydrophobicContact CE2-CB 4.29Å; F792-W799 AromaticContact CE2-CD1 3.69Å; F792-W799 AromaticContact CE2-CD2 3.76Å; F792-W799 HydrophobicContact CE2-CD2 3.76Å; F792-W799 AromaticContact CE2-CE2 3.92Å; F792-W799 HydrophobicContact CE2-CE3 4.41Å; F792-W799 AromaticContact CE2-CG 3.65Å; F792-W799 HydrophobicContact CE2-CG 3.65Å; F792-W799 AromaticContact CE2-NE1 3.82Å; F792-W799 AromaticContact CZ-CD2 3.74Å; F792-W799 HydrophobicContact CZ-CD2 3.74Å; F792-W799 AromaticContact CZ-CE3 3.93Å; F792-W799 HydrophobicContact CZ-CE3 3.93Å; F792-W799 HydrophobicContact CZ-CG 4.06Å; F792-W799 HydrophobicContact CZ-CZ3 4.41Å; N795-W799 PolarHBondContact O-N 3.06Å; Y796-W799 HydrophobicContact CE2-CE3 4.43Å; Y796-W799 WeakPolarHBondContact O-CB 3.19Å; Y796-W799 PolarHBondContact O-N 3.27Å; Y796-W799 VanDerWaalsContact O-N 3.17Å; D797-W799 VanDerWaalsContact C-N 3.32Å; D797-W799 PolarHBondContact O-N 3.48Å; W799-E801 PolarHBondContact O-N 3.32Å; W799-R802 PolarHBondContact O-N 2.78Å; W799-E803 HydrophobicContact CD2-CB 4.35Å; W799-E803 HydrophobicContact CG-CG 4.31Å; W799-E803 HydrophobicContact CZ2-CB 4.24Å; W799-E803 WeakPolarHBondContact O-CB 3.35Å; W799-E803 PolarHBondContact O-N 3.16Å; W799-V804 HydrophobicContact CE3-CG2 4.48Å; W799-V804 HydrophobicContact CH2-CG2 3.9Å; W799-V804 HydrophobicContact CZ3-CG2 3.79Å
800	L	82.4	Confident	79.6	Confident	33 Å²	33	105.5 Å²	105.5	17%	0.173	52%	0.522	C	S	.	.	I	π-helix	trans	-57.2	-48.2	174	-81	176.1	0	0	0	111.5	Y796 D797 R802 V804 F805	Y796-L800 HydrophobicContact CD1-CD1 4Å; Y796-L800 HydrophobicContact CE1-CD1 3.42Å; Y796-L800 VanDerWaalsContact CE1-CD1 3.42Å; Y796-L800 HydrophobicContact CE1-CG 4.09Å; Y796-L800 HydrophobicContact CE2-CG 4.36Å; Y796-L800 PolarHBondContact O-N 2.82Å; D797-L800 PolarHBondContact O-N 2.79Å; L800-R802 VanDerWaalsContact C-N 3.35Å; L800-R802 PolarHBondContact O-N 3.28Å; L800-V804 HydrophobicContact CD2-CB 4.22Å; L800-V804 HydrophobicContact CD2-CG2 3.96Å; L800-V804 WeakPolarHBondContact O-CA 3.5Å; L800-V804 WeakPolarHBondContact O-CB 3.33Å; L800-V804 PolarHBondContact O-N 3.33Å; L800-F805 HydrophobicContact CB-CD2 4.33Å; L800-F805 HydrophobicContact CB-CE2 3.91Å; L800-F805 HydrophobicContact CB-CZ 4.46Å; L800-F805 PolarHBondContact O-N 2.87Å
801	E	85.2	Confident	79	Confident	128 Å²	128	106.2 Å²	106.2	60%	0.598	52%	0.518	S	S	*	.	I	π-helix	trans	-62.7	-40.9	-179.5	-166.9	169.7	-143.2	0	0	111.9	D797 W799 S806	D797-E801 PolarHBondContact O-N 3.47Å; W799-E801 PolarHBondContact O-N 3.32Å; E801-S806 VanDerWaalsContact O-CB 3.28Å; E801-S806 WeakPolarHBondContact O-CB 3.44Å; E801-S806 PolarHBondContact O-N 3.46Å; E801-S806 PolarHBondContact O-OG 3.08Å
802	R	81.6	Confident	78.5	Confident	168 Å²	168	108.3 Å²	108.3	63%	0.634	52%	0.524	S	S	*	.	I	π-helix	trans	-83	-33.9	-176.6	-155.7	-170.7	80.6	-173.1	3.5	115.1	L798 W799 L800 S806	L798-R802 WeakPolarHBondContact O-CB 3.43Å; L798-R802 PolarHBondContact O-N 3.5Å; L798-R802 VanDerWaalsContact O-N 3.15Å; W799-R802 PolarHBondContact O-N 2.78Å; L800-R802 VanDerWaalsContact C-N 3.35Å; L800-R802 PolarHBondContact O-N 3.28Å; R802-S806 WeakPolarHBondContact CA-OG 3.26Å; R802-S806 PolarHBondContact O-OG 2.81Å
803	E	80.8	Confident	77.7	Confident	49 Å²	49	112.5 Å²	112.5	23%	0.229	54%	0.544	C	S	.	.	I	π-helix	trans	-109.6	-20.4	-170.6	-59.5	-63.7	143.9	0	0	113.6	W799 K807	W799-E803 HydrophobicContact CD2-CB 4.35Å; W799-E803 HydrophobicContact CG-CG 4.31Å; W799-E803 HydrophobicContact CZ2-CB 4.24Å; W799-E803 WeakPolarHBondContact O-CB 3.35Å; W799-E803 PolarHBondContact O-N 3.16Å; E803-K807 WeakPolarHBondContact O-CD 3.49Å; E803-K807 VanDerWaalsContact OE2-CE 3.3Å; E803-K807 WeakPolarHBondContact OE2-CE 3.46Å; E803-K807 IonicContact OE2-NZ 2.62Å; E803-K807 PolarHBondContact OE2-NZ 3.05Å
804	V	78.2	Confident	76.7	Confident	61 Å²	61	112.1 Å²	112.1	37%	0.37	55%	0.546	S	S	.	.	I	π-helix	trans	-114.5	-47.3	-178.5	-176	0	0	0	0	112.3	W799 L800	W799-V804 HydrophobicContact CE3-CG2 4.48Å; W799-V804 HydrophobicContact CH2-CG2 3.9Å; W799-V804 HydrophobicContact CZ3-CG2 3.79Å; L800-V804 HydrophobicContact CD2-CB 4.22Å; L800-V804 HydrophobicContact CD2-CG2 3.96Å; L800-V804 WeakPolarHBondContact O-CA 3.5Å; L800-V804 WeakPolarHBondContact O-CB 3.33Å; L800-V804 PolarHBondContact O-N 3.33Å
805	F	80.8	Confident	75.4	Confident	153 Å²	153	111.9 Å²	111.9	67%	0.671	55%	0.546	S	S	*	.	I	π-helix	trans	-87.5	-36	-174.1	-58.1	-39.6	0	0	0	114.5	L800	L800-F805 HydrophobicContact CB-CD2 4.33Å; L800-F805 HydrophobicContact CB-CE2 3.91Å; L800-F805 HydrophobicContact CB-CZ 4.46Å; L800-F805 PolarHBondContact O-N 2.87Å
806	S	79.3	Confident	73.4	Confident	81 Å²	81	119.1 Å²	119.1	57%	0.566	58%	0.578	S	S	*	*	S	Bend	trans	-93.9	-6	-179.8	59.2	0	0	0	0	115	E801 R802	E801-S806 VanDerWaalsContact O-CB 3.28Å; E801-S806 WeakPolarHBondContact O-CB 3.44Å; E801-S806 PolarHBondContact O-N 3.46Å; E801-S806 PolarHBondContact O-OG 3.08Å; R802-S806 WeakPolarHBondContact CA-OG 3.26Å; R802-S806 PolarHBondContact O-OG 2.81Å
807	K	75	Confident	72.8	Confident	114 Å²	114	119.9 Å²	119.9	50%	0.496	59%	0.586	S	S	.	*	S	Bend	trans	-86.6	123.9	169.8	-82.9	-173.8	171.3	173.5	0	110.8	E803 I809	E803-K807 WeakPolarHBondContact O-CD 3.49Å; E803-K807 VanDerWaalsContact OE2-CE 3.3Å; E803-K807 WeakPolarHBondContact OE2-CE 3.46Å; E803-K807 IonicContact OE2-NZ 2.62Å; E803-K807 PolarHBondContact OE2-NZ 3.05Å; K807-I809 PolarHBondContact O-N 2.91Å
808	P	68.3	Low	72.2	Confident	127 Å²	127	119.5 Å²	119.5	83%	0.825	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-68.4	121.4	172	28.3	-32.7	0	0	0	109.8	S810	P808-S810 PolarHBondContact O-N 3Å
809	I	71	Confident	71.5	Confident	87 Å²	87	119.7 Å²	119.7	45%	0.446	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-70.6	122.6	178.3	-62.3	171.9	0	0	0	109.4	K807 W811 L814	K807-I809 PolarHBondContact O-N 2.91Å; I809-W811 VanDerWaalsContact C-N 3.33Å; I809-W811 HydrophobicContact CB-CD2 4.38Å; I809-W811 HydrophobicContact CB-CZ2 4.08Å; I809-W811 HydrophobicContact CD1-CH2 4.16Å; I809-W811 HydrophobicContact CD1-CZ2 3.83Å; I809-W811 HydrophobicContact CG2-CD2 3.71Å; I809-W811 HydrophobicContact CG2-CE3 4.04Å; I809-W811 HydrophobicContact CG2-CG 4.14Å; I809-W811 HydrophobicContact CG2-CH2 4.26Å; I809-W811 HydrophobicContact CG2-CZ2 3.94Å; I809-W811 HydrophobicContact CG2-CZ3 4.3Å; I809-W811 PolarHBondContact O-N 3.22Å; I809-L814 HydrophobicContact CG2-CD1 4.05Å
810	S	67.8	Low	70.7	Confident	58 Å²	58	120.6 Å²	120.6	41%	0.406	59%	0.591	S	S	.	*			trans	-78.6	79.6	174	-172.2	0	0	0	0	109.9	P808 E812 E813 L814	P808-S810 PolarHBondContact O-N 3Å; S810-E812 PolarHBondContact O-N 3.13Å; S810-E812 VanDerWaalsContact O-N 3.12Å; S810-E813 WeakPolarHBondContact CB-OE2 3.3Å; S810-E813 PolarHBondContact O-N 3.4Å; S810-E813 VanDerWaalsContact O-N 3.14Å; S810-E813 PolarHBondContact OG-OE2 2.95Å; S810-L814 PolarHBondContact O-N 3.45Å
811	W	67.1	Low	70	Confident	175 Å²	175	126.1 Å²	126.1	66%	0.663	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-20	-176.4	-61.9	100.3	0	0	0	113.9	I809	I809-W811 VanDerWaalsContact C-N 3.33Å; I809-W811 HydrophobicContact CB-CD2 4.38Å; I809-W811 HydrophobicContact CB-CZ2 4.08Å; I809-W811 HydrophobicContact CD1-CH2 4.16Å; I809-W811 HydrophobicContact CD1-CZ2 3.83Å; I809-W811 HydrophobicContact CG2-CD2 3.71Å; I809-W811 HydrophobicContact CG2-CE3 4.04Å; I809-W811 HydrophobicContact CG2-CG 4.14Å; I809-W811 HydrophobicContact CG2-CH2 4.26Å; I809-W811 HydrophobicContact CG2-CZ2 3.94Å; I809-W811 HydrophobicContact CG2-CZ3 4.3Å; I809-W811 PolarHBondContact O-N 3.22Å
812	E	68.2	Low	68.9	Low	168 Å²	168	126 Å²	126	79%	0.785	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-27.9	177.4	-61.8	-173.5	164.4	0	0	113.1	S810	S810-E812 PolarHBondContact O-N 3.13Å; S810-E812 VanDerWaalsContact O-N 3.12Å
813	E	63.8	Low	68	Low	145 Å²	145	123 Å²	123	68%	0.678	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-81.4	-19.3	173.7	-69.7	175.1	129.8	0	0	112.2	S810 L815	S810-E813 WeakPolarHBondContact CB-OE2 3.3Å; S810-E813 PolarHBondContact O-N 3.4Å; S810-E813 VanDerWaalsContact O-N 3.14Å; S810-E813 PolarHBondContact OG-OE2 2.95Å; E813-L815 VanDerWaalsContact C-N 3.25Å; E813-L815 PolarHBondContact O-N 3.23Å
814	L	57.4	Low	67.1	Low	115 Å²	115	128.7 Å²	128.7	60%	0.602	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-85.1	7.1	-179.4	-125.1	162.6	0	0	0	113.5	I809 S810	I809-L814 HydrophobicContact CG2-CD1 4.05Å; S810-L814 PolarHBondContact O-N 3.45Å
815	L	52.7	Low	66.1	Low	154 Å²	154	134.3 Å²	134.3	81%	0.806	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-129	17.6	-177.2	-68.9	173.9	0	0	0	113.2	E813	E813-L815 VanDerWaalsContact C-N 3.25Å; E813-L815 PolarHBondContact O-N 3.23Å
816	Q	42.1	Very low	64.8	Low	235 Å²	235	132.6 Å²	132.6	100%	1.098	67%	0.67	S	S	*	*			trans	-107.6	0	169.6	-65.7	-172	25.7	0	0	111.2

Retrieved 816 of 816 residues in 187.3 ms (Link to these results)

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