A0A087XLI8_POEFO Loading...

Armadillo repeat containing 3

AlphaFold DB , UniProt , Accession A0A087XLI8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 881 aa.

						>A0A087XLI8_POEFO|A0A087XLI8
MGKKTGKDKEKEDKDAFETLSLESKAPGTVVLLLSSQEEDILLKASEAIQKFAEKGEENKVMLLGLGVLGPLCKLIDHSNKLIKRNALMTLGNMATNGEVSEALKKEDFIPSLLQKLTPEEDVFVHEFATLCLAAVAMDFTCRVQINANDGMPPLIKLLSSPDPDVAKNSLEIIFNLVQDLENLEVLHELGAIPPLLELLKSDFPVIQHLALQIFQCVTTDLETRKTFREELGFERFLDLLDNMEFNDLHAEALQTVSNCLGDIETLQIIHLNGGLTRLAEFVLAPSSPEIQSIAIKCITRAAQSSESREVFHEQMIEKVLVELLSAADDNVKASACQAIAAMSFHPCSKDRFRELEGVPIVVQLLSSESSVLKEAATQALSSLTHSNEANALAVYEAGGHEILIQQLSESSASTVASSAATISNMAEQEIIQSSILTLGGVQALVEPLKSTDTQVLMYTALCVAQLACDNEERDKFHKAGGLEPLVNLLHSNDKEVLRHACFAVNVCAGDTACAVTMCRLGALEILQEINQSANRRSSFSELATTSLLNSNLPVKYNRLGRLTANDIITSNFFDAGQACVGEPFLTLEELISQPLNQQRAIIVFNVPVEFCFSKTDSCYVCCAPLERHSPSGHGRRDKSLELSLVVNGKLISGSPIPRLGSHPTVVVVGEHKPFVCHRDTVELAEDRKPSPTESEIKKGRMTPKRKREKDKPDEEPQDVLTEKSPIIFGDVSLLMLIKEAKDSVLSLTDEREQYAALARLVSDAMGGAVPLEKLHELDWVLHQSDLRFQLKSNVIPIGMINKGTYCHRALLFKCLADTIEKSCTLVRGDYNRAWNEVLLFEEVHENLRSPEPICYIVDLMHQPGTLMPIDSPAAQQYQTI
					

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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	39.3	Very low	38.7	Very low	255 Å²	255	177.9 Å²	177.9	100%	1.256	91%	0.913	S	S	*	*				0	135.5	0	-67.3	-159.3	-155.7	0	0	108.3
2	G	39.2	Very low	38.9	Very low	77 Å²	77	177.4 Å²	177.4	79%	0.794	90%	0.904	S	S	*	*			trans	133.5	82.6	168.2	0	0	0	0	0	116.8
3	K	36.9	Very low	38.8	Very low	208 Å²	208	175.4 Å²	175.4	90%	0.904	90%	0.897	S	S	*	*			trans	45.8	114.1	150.8	-74.9	178.3	173.6	177.4	0	121.4
4	K	39	Very low	39	Very low	210 Å²	210	175.8 Å²	175.8	91%	0.913	89%	0.889	S	S	*	*			trans	-95.2	131.2	154.7	-84.8	-179.2	173.3	177.9	0	110.3
5	T	39.3	Very low	39.3	Very low	142 Å²	142	173.2 Å²	173.2	87%	0.871	88%	0.879	S	S	*	*			trans	-158	140.7	159.8	45.6	0	0	0	0	104.8
6	G	33.9	Very low	39.5	Very low	75 Å²	75	168.1 Å²	168.1	77%	0.773	87%	0.871	S	S	*	*			cis	-178	148	0.8	0	0	0	0	0	104.3
7	K	41	Very low	39.8	Very low	215 Å²	215	169.2 Å²	169.2	94%	0.935	87%	0.868	S	S	*	*			trans	-77.7	122.4	174.4	-93.2	-179.7	170.9	178.7	0	108.7
8	D	35	Very low	40.1	Very low	167 Å²	167	169.8 Å²	169.8	89%	0.893	87%	0.866	S	S	*	*			trans	-126.8	138.7	155.9	-90.9	-38.4	0	0	0	109.5
9	K	47.7	Very low	40.4	Very low	206 Å²	206	168.5 Å²	168.5	90%	0.896	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-80.2	123.3	177.5	-72.9	176.9	172	-178	0	108.8
10	E	37.3	Very low	40.7	Very low	199 Å²	199	167.6 Å²	167.6	93%	0.93	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-101.1	140.6	155.7	-92.3	-179.8	160.9	0	0	110.2
11	K	36.6	Very low	41	Very low	203 Å²	203	163.9 Å²	163.9	88%	0.883	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-72.3	145.5	-167.6	-72.7	166.9	172	173.6	0	111.2	D13	K11-D13 PolarHBondContact O-N 3.23Å
12	E	41.3	Very low	41.8	Very low	172 Å²	172	155.6 Å²	155.6	80%	0.804	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-52.8	120	162.2	-70.7	170.6	165.7	0	0	109.8	K14	E12-K14 PolarHBondContact O-N 3.26Å
13	D	37.4	Very low	42.6	Very low	151 Å²	151	159.9 Å²	159.9	81%	0.807	81%	0.812	S	S	*	*			trans	-78	111.6	167.3	-140.6	-2.9	0	0	0	107.5	K11 D15	K11-D13 PolarHBondContact O-N 3.23Å; D13-D15 PolarHBondContact O-N 3.41Å
14	K	42.5	Very low	43.8	Very low	181 Å²	181	151.9 Å²	151.9	79%	0.787	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	26.8	-173.4	-85.3	-170.8	173.2	-174.5	0	113.4	E12	E12-K14 PolarHBondContact O-N 3.26Å
15	D	42.7	Very low	45.1	Very low	137 Å²	137	151.5 Å²	151.5	73%	0.733	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	28.9	-177.2	-90.7	-26.6	0	0	0	113.6	D13 F17	D13-D15 PolarHBondContact O-N 3.41Å; D15-F17 PolarHBondContact O-N 2.89Å
16	A	42.2	Very low	47.1	Very low	92 Å²	92	147 Å²	147	76%	0.76	76%	0.758	S	S	*	*			trans	-79.9	96.3	162.7	0	0	0	0	0	108.7	E18	A16-E18 PolarHBondContact O-N 3.07Å
17	F	45.4	Very low	49.4	Very low	186 Å²	186	145 Å²	145	82%	0.816	73%	0.731	S	S	*	*			trans	-50.6	126.4	167.2	-88.2	-93.6	0	0	0	109.4	D15 T19	D15-F17 PolarHBondContact O-N 2.89Å; F17-T19 PolarHBondContact O-N 3.35Å
18	E	45.1	Very low	51.6	Low	180 Å²	180	136 Å²	136	84%	0.841	70%	0.699	S	S	*	*			trans	-57.1	130.3	167.7	-75.5	-179.6	162.4	0	0	108.7	A16 L20	A16-E18 PolarHBondContact O-N 3.07Å; E18-L20 PolarHBondContact O-N 3.2Å
19	T	45.3	Very low	54.1	Low	146 Å²	146	131.1 Å²	131.1	90%	0.896	68%	0.676	S	S	*	*			trans	-59.6	102.6	175.4	-1.3	0	0	0	0	108.9	F17 S21	F17-T19 PolarHBondContact O-N 3.35Å; T19-S21 PolarHBondContact O-N 3.25Å; T19-S21 VanDerWaalsContact O-N 3.07Å
20	L	47.4	Very low	56	Low	150 Å²	150	121.8 Å²	121.8	79%	0.785	64%	0.636	S	S	*	*			trans	-59.4	111.6	175.4	-91	149.8	0	0	0	109.4	E18 L22	E18-L20 PolarHBondContact O-N 3.2Å; L20-L22 PolarHBondContact O-N 3.2Å
21	S	47.5	Very low	58.5	Low	90 Å²	90	112.7 Å²	112.7	63%	0.629	59%	0.594	S	S	*	*			trans	-72.6	91.2	169.7	61.5	0	0	0	0	109	T19 E23	T19-S21 PolarHBondContact O-N 3.25Å; T19-S21 VanDerWaalsContact O-N 3.07Å; S21-E23 VanDerWaalsContact C-N 3.28Å; S21-E23 PolarHBondContact O-N 3.28Å
22	L	54.5	Low	61	Low	80 Å²	80	109.4 Å²	109.4	42%	0.419	59%	0.585	S	S	.	*			trans	-77.3	76.7	-179.5	-139.6	140.7	0	0	0	110.2	L20 L33	L20-L22 PolarHBondContact O-N 3.2Å; L22-L33 HydrophobicContact CD2-CD1 3.53Å; L22-L33 HydrophobicContact CD2-CD2 4.3Å
23	E	55.8	Low	63.3	Low	167 Å²	167	103.2 Å²	103.2	78%	0.78	56%	0.557	S	S	*	*			trans	-98.3	83	171.5	-72.3	-174.2	-176.3	0	0	109.7	S21	S21-E23 VanDerWaalsContact C-N 3.28Å; S21-E23 PolarHBondContact O-N 3.28Å
24	S	62.2	Low	65.8	Low	40 Å²	40	96.3 Å²	96.3	28%	0.28	52%	0.52	S	S	.	.			trans	-77.6	128.1	171.4	-178.7	0	0	0	0	110.4	A26 T29	S24-A26 PolarHBondContact OG-N 3.07Å; S24-T29 WeakPolarHBondContact OG-CB 3.46Å
25	K	66.6	Low	67.9	Low	203 Å²	203	92.1 Å²	92.1	88%	0.883	51%	0.514	S	S	*	.			trans	-88.6	-7	177.3	-64.7	-175.4	179.5	-179.5	0	113.9
26	A	82.1	Confident	70.1	Confident	46 Å²	46	87 Å²	87	38%	0.38	49%	0.489	S	S	.	.			trans	-95.7	117.8	-177.4	0	0	0	0	0	110.5	S24 G28 T29 V30	S24-A26 PolarHBondContact OG-N 3.07Å; A26-G28 VanDerWaalsContact C-N 3.32Å; A26-G28 PolarHBondContact O-N 3.48Å; A26-T29 WeakPolarHBondContact O-CB 3.46Å; A26-T29 PolarHBondContact O-N 2.93Å; A26-V30 PolarHBondContact O-N 3.29Å
27	P	82.9	Confident	72.2	Confident	34 Å²	34	92 Å²	92	22%	0.221	50%	0.497	C	S	.	.	H	α-helix	trans	-60.2	-38.9	-172.8	20.7	-31.1	0	0	0	112.7	T29 V30 V31 F52 M62 L63 L66	P27-T29 VanDerWaalsContact C-N 3.31Å; P27-T29 PolarHBondContact O-N 3.33Å; P27-V30 PolarHBondContact O-N 3.21Å; P27-V30 VanDerWaalsContact O-N 3.1Å; P27-V31 WeakPolarHBondContact O-CG2 3.46Å; P27-V31 PolarHBondContact O-N 3.1Å; P27-F52 HydrophobicContact CB-CD1 4.37Å; P27-F52 HydrophobicContact CB-CE1 3.99Å; P27-F52 HydrophobicContact CB-CZ 4.2Å; P27-F52 HydrophobicContact CG-CE1 4.38Å; P27-F52 HydrophobicContact CG-CZ 4.17Å; P27-M62 HydrophobicContact CG-SD 3.84Å; P27-L63 HydrophobicContact CB-CD2 4.47Å; P27-L66 HydrophobicContact CB-CD1 3.94Å; P27-L66 HydrophobicContact CG-CD1 4.21Å
28	G	85.6	Confident	74.3	Confident	25 Å²	25	89.1 Å²	89.1	26%	0.258	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-36	176.5	0	0	0	0	0	113.8	A26 L32	A26-G28 VanDerWaalsContact C-N 3.32Å; A26-G28 PolarHBondContact O-N 3.48Å; G28-L32 WeakPolarHBondContact O-CG 3.35Å; G28-L32 PolarHBondContact O-N 3.13Å
29	T	87.4	Confident	76.4	Confident	66 Å²	66	84.9 Å²	84.9	41%	0.405	47%	0.466	S	S	.	.	H	α-helix	trans	-68.4	-40.1	174.3	-53.6	0	0	0	0	111.1	S24 A26 P27 L32 L33	S24-T29 WeakPolarHBondContact OG-CB 3.46Å; A26-T29 WeakPolarHBondContact O-CB 3.46Å; A26-T29 PolarHBondContact O-N 2.93Å; P27-T29 VanDerWaalsContact C-N 3.31Å; P27-T29 PolarHBondContact O-N 3.33Å; T29-L32 PolarHBondContact O-N 2.99Å; T29-L33 WeakPolarHBondContact O-CG 3.41Å; T29-L33 PolarHBondContact O-N 3.17Å; T29-L33 VanDerWaalsContact O-N 3.13Å
30	V	88.8	Confident	78.3	Confident	10 Å²	10	83.9 Å²	83.9	6%	0.061	46%	0.455	C	S	.	.	H	α-helix	trans	-67.1	-37.6	178.5	-172.3	0	0	0	0	111.3	A26 P27 L32 L33 L34 A45 A48 I49	A26-V30 PolarHBondContact O-N 3.29Å; P27-V30 PolarHBondContact O-N 3.21Å; P27-V30 VanDerWaalsContact O-N 3.1Å; V30-L32 VanDerWaalsContact C-N 3.32Å; V30-L32 PolarHBondContact O-N 2.92Å; V30-L33 WeakPolarHBondContact O-CB 3.3Å; V30-L33 PolarHBondContact O-N 3.41Å; V30-L33 VanDerWaalsContact O-N 3.1Å; V30-L34 PolarHBondContact O-N 3.3Å; V30-A45 HydrophobicContact CG1-CB 4Å; V30-A45 WeakPolarHBondContact CG1-O 3.38Å; V30-A48 HydrophobicContact CG1-CB 3.97Å; V30-I49 HydrophobicContact CB-CD1 3.96Å; V30-I49 HydrophobicContact CB-CG1 4.37Å; V30-I49 HydrophobicContact CG1-CD1 3.77Å; V30-I49 HydrophobicContact CG1-CG1 3.62Å
31	V	89.7	Confident	80.3	Confident	8 Å²	8	79 Å²	79	5%	0.048	43%	0.429	C	S	.	.	H	α-helix	trans	-59.3	-42	173.5	173.7	0	0	0	0	111.3	P27 L33 L34 I49 L63 L66 V68	P27-V31 WeakPolarHBondContact O-CG2 3.46Å; P27-V31 PolarHBondContact O-N 3.1Å; V31-L33 VanDerWaalsContact C-N 3.31Å; V31-L33 PolarHBondContact O-N 3.1Å; V31-L34 VanDerWaalsContact O-CB 3.31Å; V31-L34 WeakPolarHBondContact O-CB 3.43Å; V31-L34 PolarHBondContact O-N 3.26Å; V31-I49 HydrophobicContact CG2-CD1 3.77Å; V31-L63 HydrophobicContact CG2-CD2 3.96Å; V31-L66 HydrophobicContact CG2-CB 4.15Å; V31-L66 HydrophobicContact CG2-CD1 4.47Å; V31-V68 HydrophobicContact CG1-CB 4.3Å; V31-V68 HydrophobicContact CG1-CG2 4.34Å; V31-V68 HydrophobicContact CG2-CB 4.12Å; V31-V68 HydrophobicContact CG2-CG2 3.9Å
32	L	87.8	Confident	82.4	Confident	134 Å²	134	75 Å²	75	70%	0.702	40%	0.401	S	S	*	.	H	α-helix	trans	-64.5	-35.5	175.3	-68.2	170.9	0	0	0	112.5	G28 T29 V30 L34 S35	G28-L32 WeakPolarHBondContact O-CG 3.35Å; G28-L32 PolarHBondContact O-N 3.13Å; T29-L32 PolarHBondContact O-N 2.99Å; V30-L32 VanDerWaalsContact C-N 3.32Å; V30-L32 PolarHBondContact O-N 2.92Å; L32-L34 PolarHBondContact O-N 3.45Å; L32-S35 PolarHBondContact O-N 3.49Å; L32-S35 VanDerWaalsContact O-N 3.13Å
33	L	90.4	Very high	84.1	Confident	41 Å²	41	73.1 Å²	73.1	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-67.1	-16.8	177.5	-66.9	171.8	0	0	0	113.1	L22 T29 V30 V31 S35 S36 I41 A45	L22-L33 HydrophobicContact CD2-CD1 3.53Å; L22-L33 HydrophobicContact CD2-CD2 4.3Å; T29-L33 WeakPolarHBondContact O-CG 3.41Å; T29-L33 PolarHBondContact O-N 3.17Å; T29-L33 VanDerWaalsContact O-N 3.13Å; V30-L33 WeakPolarHBondContact O-CB 3.3Å; V30-L33 PolarHBondContact O-N 3.41Å; V30-L33 VanDerWaalsContact O-N 3.1Å; V31-L33 VanDerWaalsContact C-N 3.31Å; V31-L33 PolarHBondContact O-N 3.1Å; L33-S35 PolarHBondContact O-N 3.22Å; L33-S36 WeakPolarHBondContact O-CB 3.24Å; L33-S36 PolarHBondContact O-N 2.84Å; L33-I41 HydrophobicContact CB-CG2 4.24Å; L33-I41 HydrophobicContact CD2-CG2 3.95Å; L33-I41 HydrophobicContact CG-CG2 4.5Å; L33-A45 HydrophobicContact CB-CB 3.81Å
34	L	89.4	Confident	85.8	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.2	171.5	-63.3	176.5	0	0	0	113.4	V30 V31 L32 L42 A45 I49 V68 P71 L72 L75	V30-L34 PolarHBondContact O-N 3.3Å; V31-L34 VanDerWaalsContact O-CB 3.31Å; V31-L34 WeakPolarHBondContact O-CB 3.43Å; V31-L34 PolarHBondContact O-N 3.26Å; L32-L34 PolarHBondContact O-N 3.45Å; L34-L42 HydrophobicContact CD2-CD1 4.49Å; L34-L42 WeakPolarHBondContact O-CD1 3.44Å; L34-A45 HydrophobicContact CD2-CB 3.99Å; L34-I49 HydrophobicContact CD1-CG1 4.23Å; L34-I49 HydrophobicContact CD2-CG1 4.42Å; L34-I49 HydrophobicContact CG-CG1 4.48Å; L34-V68 HydrophobicContact CD1-CG2 3.79Å; L34-P71 HydrophobicContact CB-CB 3.85Å; L34-P71 HydrophobicContact CD1-CB 4.09Å; L34-L72 HydrophobicContact CD1-CD2 4.13Å; L34-L72 HydrophobicContact CD1-CG 4.35Å; L34-L75 HydrophobicContact CB-CD1 4.32Å; L34-L75 HydrophobicContact CD2-CD1 4.01Å
35	S	87.5	Confident	87.1	Confident	93 Å²	93	68.5 Å²	68.5	65%	0.65	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	8.6	173.4	-58.3	0	0	0	0	113.3	L32 L33	L32-S35 PolarHBondContact O-N 3.49Å; L32-S35 VanDerWaalsContact O-N 3.13Å; L33-S35 PolarHBondContact O-N 3.22Å
36	S	88.8	Confident	88.3	Confident	31 Å²	31	58.8 Å²	58.8	22%	0.217	32%	0.322	C	S	.	.			trans	-66.2	142.4	178.1	-179.7	0	0	0	0	111.8	L33 E38	L33-S36 WeakPolarHBondContact O-CB 3.24Å; L33-S36 PolarHBondContact O-N 2.84Å; S36-E38 PolarHBondContact OG-N 3.27Å; S36-E38 VanDerWaalsContact OG-N 3.15Å
37	Q	86.4	Confident	88.8	Confident	196 Å²	196	60.2 Å²	60.2	92%	0.916	32%	0.321	S	S	*	.	S	Bend	trans	-80.6	-19.2	171.4	-63	-170.6	4.5	0	0	112.6	E39	Q37-E39 PolarHBondContact O-N 3.13Å
38	E	89.1	Confident	89.2	Confident	125 Å²	125	60.7 Å²	60.7	58%	0.584	33%	0.327	S	S	*	.			trans	-80.8	117.3	179.2	-60.6	-61.1	154.4	0	0	110.8	S36 D40 I41 L42	S36-E38 PolarHBondContact OG-N 3.27Å; S36-E38 VanDerWaalsContact OG-N 3.15Å; E38-D40 VanDerWaalsContact C-N 3.35Å; E38-D40 PolarHBondContact O-N 3.21Å; E38-I41 HydrophobicContact CB-CB 4.15Å; E38-I41 HydrophobicContact CB-CD1 3.82Å; E38-I41 HydrophobicContact CB-CG1 3.88Å; E38-I41 HydrophobicContact CG-CD1 4.12Å; E38-I41 PolarHBondContact O-N 3.2Å; E38-I41 VanDerWaalsContact O-N 3.15Å; E38-L42 PolarHBondContact O-N 3.29Å
39	E	88.3	Confident	89.4	Confident	91 Å²	91	59.6 Å²	59.6	43%	0.425	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-38.6	-173.7	-166	174.9	166	0	0	112.8	Q37 I41 L42 L43 N80 I83	Q37-E39 PolarHBondContact O-N 3.13Å; E39-I41 VanDerWaalsContact C-N 3.32Å; E39-I41 PolarHBondContact O-N 3.06Å; E39-L42 PolarHBondContact O-N 3.48Å; E39-L43 WeakPolarHBondContact O-CB 3.43Å; E39-L43 PolarHBondContact O-N 3.15Å; E39-N80 VanDerWaalsContact OE1-CB 3.25Å; E39-N80 WeakPolarHBondContact OE1-CB 3.45Å; E39-N80 PolarHBondContact OE1-ND2 2.98Å; E39-I83 HydrophobicContact CG-CD1 3.76Å
40	D	87.1	Confident	89.7	Confident	125 Å²	125	57.2 Å²	57.2	67%	0.668	30%	0.3	S	S	*	.	H	α-helix	trans	-65.1	-35.7	177.4	-71.9	-30.6	0	0	0	112.6	E38 K44	E38-D40 VanDerWaalsContact C-N 3.35Å; E38-D40 PolarHBondContact O-N 3.21Å; D40-K44 WeakPolarHBondContact O-CG 3.31Å; D40-K44 PolarHBondContact O-N 3.43Å
41	I	88.6	Confident	89.8	Confident	47 Å²	47	61.5 Å²	61.5	24%	0.241	32%	0.318	C	S	.	.	H	α-helix	trans	-71.9	-43.6	176.8	-60.8	-177.2	0	0	0	109.2	L33 E38 E39 L43 K44 A45	L33-I41 HydrophobicContact CB-CG2 4.24Å; L33-I41 HydrophobicContact CD2-CG2 3.95Å; L33-I41 HydrophobicContact CG-CG2 4.5Å; E38-I41 HydrophobicContact CB-CB 4.15Å; E38-I41 HydrophobicContact CB-CD1 3.82Å; E38-I41 HydrophobicContact CB-CG1 3.88Å; E38-I41 HydrophobicContact CG-CD1 4.12Å; E38-I41 PolarHBondContact O-N 3.2Å; E38-I41 VanDerWaalsContact O-N 3.15Å; E39-I41 VanDerWaalsContact C-N 3.32Å; E39-I41 PolarHBondContact O-N 3.06Å; I41-L43 VanDerWaalsContact C-N 3.34Å; I41-L43 PolarHBondContact O-N 3Å; I41-K44 PolarHBondContact O-N 3.43Å; I41-A45 VanDerWaalsContact O-CB 3.24Å; I41-A45 WeakPolarHBondContact O-CB 3.15Å; I41-A45 PolarHBondContact O-N 3.37Å
42	L	91	Very high	89.9	Confident	7 Å²	7	63.4 Å²	63.4	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-39.2	179.7	-170.3	57.6	0	0	0	112.1	L34 E38 E39 A45 S46 L75 I83	L34-L42 HydrophobicContact CD2-CD1 4.49Å; L34-L42 WeakPolarHBondContact O-CD1 3.44Å; E38-L42 PolarHBondContact O-N 3.29Å; E39-L42 PolarHBondContact O-N 3.48Å; L42-A45 PolarHBondContact O-N 3.15Å; L42-S46 VanDerWaalsContact O-CB 3.31Å; L42-S46 WeakPolarHBondContact O-CB 3.46Å; L42-S46 PolarHBondContact O-N 3.45Å; L42-S46 PolarHBondContact O-OG 3.13Å; L42-L75 HydrophobicContact CD1-CD1 3.89Å; L42-L75 HydrophobicContact CD1-CD2 3.91Å; L42-L75 HydrophobicContact CD2-CD2 3.68Å; L42-L75 HydrophobicContact CG-CD2 4.11Å; L42-I83 HydrophobicContact CB-CD1 4.02Å; L42-I83 HydrophobicContact CD2-CD1 3.96Å; L42-I83 HydrophobicContact CD2-CG2 4.2Å; L42-I83 HydrophobicContact CG-CD1 3.93Å; L42-I83 HydrophobicContact CG-CG2 4.08Å
43	L	91.3	Very high	90	Very high	41 Å²	41	57 Å²	57	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-50.5	174	-178.9	61.5	0	0	0	111.6	E39 I41 A45 S46 E47 L82 I83	E39-L43 WeakPolarHBondContact O-CB 3.43Å; E39-L43 PolarHBondContact O-N 3.15Å; I41-L43 VanDerWaalsContact C-N 3.34Å; I41-L43 PolarHBondContact O-N 3Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 2.92Å; L43-S46 PolarHBondContact O-N 3.03Å; L43-S46 PolarHBondContact O-OG 3.22Å; L43-E47 WeakPolarHBondContact O-CB 3.33Å; L43-E47 PolarHBondContact O-N 2.87Å; L43-L82 HydrophobicContact CD1-CB 3.55Å; L43-L82 HydrophobicContact CD1-CD1 4.28Å; L43-L82 HydrophobicContact CD2-CD1 4.36Å; L43-I83 HydrophobicContact CB-CD1 4.29Å; L43-I83 HydrophobicContact CB-CG1 4.06Å; L43-I83 HydrophobicContact CD1-CG1 4Å
44	K	89.9	Confident	90	Very high	105 Å²	105	59.6 Å²	59.6	46%	0.457	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-38.6	177.6	-72.6	179.1	-178.8	178.2	0	112.5	D40 I41 A48	D40-K44 WeakPolarHBondContact O-CG 3.31Å; D40-K44 PolarHBondContact O-N 3.43Å; I41-K44 PolarHBondContact O-N 3.43Å; K44-A48 VanDerWaalsContact O-CB 3.3Å; K44-A48 WeakPolarHBondContact O-CB 3.39Å; K44-A48 PolarHBondContact O-N 3.42Å
45	A	91.1	Very high	90	Very high	4 Å²	4	67 Å²	67	3%	0.033	34%	0.335	C	S	.	.	H	α-helix	trans	-66.6	-47.7	178	0	0	0	0	0	111.4	V30 L33 L34 I41 L42 L43 E47 A48 I49	V30-A45 HydrophobicContact CG1-CB 4Å; V30-A45 WeakPolarHBondContact CG1-O 3.38Å; L33-A45 HydrophobicContact CB-CB 3.81Å; L34-A45 HydrophobicContact CD2-CB 3.99Å; I41-A45 VanDerWaalsContact O-CB 3.24Å; I41-A45 WeakPolarHBondContact O-CB 3.15Å; I41-A45 PolarHBondContact O-N 3.37Å; L42-A45 PolarHBondContact O-N 3.15Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 2.92Å; A45-E47 PolarHBondContact O-N 3.38Å; A45-A48 PolarHBondContact O-N 3.18Å; A45-I49 VanDerWaalsContact O-CG1 3.3Å; A45-I49 WeakPolarHBondContact O-CG1 3.46Å; A45-I49 PolarHBondContact O-N 3.07Å
46	S	91.8	Very high	90	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-40.1	177.3	60.8	0	0	0	0	112.4	L42 L43 I49 Q50 N86	L42-S46 VanDerWaalsContact O-CB 3.31Å; L42-S46 WeakPolarHBondContact O-CB 3.46Å; L42-S46 PolarHBondContact O-N 3.45Å; L42-S46 PolarHBondContact O-OG 3.13Å; L43-S46 PolarHBondContact O-N 3.03Å; L43-S46 PolarHBondContact O-OG 3.22Å; S46-I49 PolarHBondContact O-N 3.07Å; S46-Q50 WeakPolarHBondContact O-CB 3.36Å; S46-Q50 PolarHBondContact O-N 3.37Å; S46-N86 PolarHBondContact OG-ND2 2.93Å
47	E	91.7	Very high	90.1	Very high	76 Å²	76	66.9 Å²	66.9	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-41.6	174.8	-170.8	-175.3	172.1	0	0	112	L43 A45 Q50 K51 N86	L43-E47 WeakPolarHBondContact O-CB 3.33Å; L43-E47 PolarHBondContact O-N 2.87Å; A45-E47 PolarHBondContact O-N 3.38Å; E47-Q50 PolarHBondContact O-N 2.96Å; E47-Q50 PolarHBondContact O-OE1 3.26Å; E47-K51 WeakPolarHBondContact O-CG 3.39Å; E47-K51 PolarHBondContact O-N 3.45Å; E47-K51 WeakPolarHBondContact OE1-CE 3.33Å; E47-K51 IonicContact OE1-NZ 2.64Å; E47-K51 PolarHBondContact OE1-NZ 2.96Å; E47-N86 PolarHBondContact N-ND2 3.23Å
48	A	90.6	Very high	90.3	Very high	43 Å²	43	65.5 Å²	65.5	36%	0.355	32%	0.322	S	S	.	.	H	α-helix	trans	-66.4	-39.7	178.4	0	0	0	0	0	112.4	V30 K44 A45 F52	V30-A48 HydrophobicContact CG1-CB 3.97Å; K44-A48 VanDerWaalsContact O-CB 3.3Å; K44-A48 WeakPolarHBondContact O-CB 3.39Å; K44-A48 PolarHBondContact O-N 3.42Å; A45-A48 PolarHBondContact O-N 3.18Å; A48-F52 VanDerWaalsContact O-CB 3.31Å; A48-F52 WeakPolarHBondContact O-CB 3.46Å; A48-F52 PolarHBondContact O-N 2.88Å
49	I	91.9	Very high	90.4	Very high	2 Å²	2	61 Å²	61	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-44.9	176.6	-67.5	-69.8	0	0	0	110.6	V30 V31 L34 A45 S46 K51 F52 A53 L63 V68 T90	V30-I49 HydrophobicContact CB-CD1 3.96Å; V30-I49 HydrophobicContact CB-CG1 4.37Å; V30-I49 HydrophobicContact CG1-CD1 3.77Å; V30-I49 HydrophobicContact CG1-CG1 3.62Å; V31-I49 HydrophobicContact CG2-CD1 3.77Å; L34-I49 HydrophobicContact CD1-CG1 4.23Å; L34-I49 HydrophobicContact CD2-CG1 4.42Å; L34-I49 HydrophobicContact CG-CG1 4.48Å; A45-I49 VanDerWaalsContact O-CG1 3.3Å; A45-I49 WeakPolarHBondContact O-CG1 3.46Å; A45-I49 PolarHBondContact O-N 3.07Å; S46-I49 PolarHBondContact O-N 3.07Å; I49-K51 PolarHBondContact O-N 2.64Å; I49-F52 WeakPolarHBondContact O-CB 3.31Å; I49-F52 PolarHBondContact O-N 3.35Å; I49-F52 VanDerWaalsContact O-N 3.07Å; I49-A53 PolarHBondContact O-N 3.07Å; I49-L63 HydrophobicContact CD1-CD2 3.68Å; I49-L63 HydrophobicContact CG2-CD1 4.04Å; I49-L63 HydrophobicContact CG2-CD2 4.44Å; I49-V68 HydrophobicContact CG2-CG2 4.07Å; I49-T90 HydrophobicContact CG2-CG2 3.68Å
50	Q	92.3	Very high	90.6	Very high	16 Å²	16	57.4 Å²	57.4	8%	0.075	28%	0.284	C	S	.	.	H	α-helix	trans	-56.2	-53	176.8	174.3	-92.7	-18.9	0	0	111.5	S46 E47 F52 A53 E54 M89 T90	S46-Q50 WeakPolarHBondContact O-CB 3.36Å; S46-Q50 PolarHBondContact O-N 3.37Å; E47-Q50 PolarHBondContact O-N 2.96Å; E47-Q50 PolarHBondContact O-OE1 3.26Å; Q50-F52 PolarHBondContact O-N 3.21Å; Q50-A53 PolarHBondContact O-N 3.49Å; Q50-E54 PolarHBondContact NE2-OE1 3.48Å; Q50-E54 PolarHBondContact NE2-OE2 3.27Å; Q50-E54 WeakPolarHBondContact O-CG 3.37Å; Q50-E54 PolarHBondContact O-N 2.99Å; Q50-E54 VanDerWaalsContact O-N 3.13Å; Q50-M89 HydrophobicContact CG-CB 4.39Å; Q50-M89 HydrophobicContact CG-CE 3.41Å; Q50-M89 VanDerWaalsContact CG-CE 3.41Å; Q50-M89 HydrophobicContact CG-CG 3.85Å; Q50-M89 HydrophobicContact CG-SD 3.94Å; Q50-M89 PolarHBondContact NE2-SD 3.32Å; Q50-T90 VanDerWaalsContact CA-OG1 3.3Å; Q50-T90 WeakPolarHBondContact CA-OG1 3.38Å; Q50-T90 VanDerWaalsContact CB-OG1 3.3Å; Q50-T90 WeakPolarHBondContact CB-OG1 3.49Å
51	K	90.8	Very high	90.9	Very high	100 Å²	100	53.8 Å²	53.8	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-25.3	176.6	-69.2	-179.6	-172.8	166.7	0	113.4	E47 I49 K55	E47-K51 WeakPolarHBondContact O-CG 3.39Å; E47-K51 PolarHBondContact O-N 3.45Å; E47-K51 WeakPolarHBondContact OE1-CE 3.33Å; E47-K51 IonicContact OE1-NZ 2.64Å; E47-K51 PolarHBondContact OE1-NZ 2.96Å; I49-K51 PolarHBondContact O-N 2.64Å; K51-K55 WeakPolarHBondContact O-CD 3.38Å; K51-K55 WeakPolarHBondContact O-CE 3.29Å; K51-K55 WeakPolarHBondContact O-CG 3.26Å
52	F	91.4	Very high	91	Very high	48 Å²	48	56 Å²	56	21%	0.211	28%	0.277	C	S	.	.	H	α-helix	trans	-78.7	-43.8	178	-172.5	-104.4	0	0	0	111.3	P27 A48 I49 Q50 E54 K55 N59 M62 L63	P27-F52 HydrophobicContact CB-CD1 4.37Å; P27-F52 HydrophobicContact CB-CE1 3.99Å; P27-F52 HydrophobicContact CB-CZ 4.2Å; P27-F52 HydrophobicContact CG-CE1 4.38Å; P27-F52 HydrophobicContact CG-CZ 4.17Å; A48-F52 VanDerWaalsContact O-CB 3.31Å; A48-F52 WeakPolarHBondContact O-CB 3.46Å; A48-F52 PolarHBondContact O-N 2.88Å; I49-F52 WeakPolarHBondContact O-CB 3.31Å; I49-F52 PolarHBondContact O-N 3.35Å; I49-F52 VanDerWaalsContact O-N 3.07Å; Q50-F52 PolarHBondContact O-N 3.21Å; F52-E54 VanDerWaalsContact C-N 3.31Å; F52-E54 PolarHBondContact O-N 3.06Å; F52-K55 PolarHBondContact O-N 3.49Å; F52-N59 HydrophobicContact CD1-CB 3.87Å; F52-N59 HydrophobicContact CE1-CB 3.57Å; F52-N59 HydrophobicContact CG-CB 4.5Å; F52-N59 HydrophobicContact CZ-CB 3.95Å; F52-N59 WeakPolarHBondContact CZ-OD1 3.41Å; F52-N59 WeakPolarHBondContact O-CB 3.3Å; F52-N59 PolarHBondContact O-ND2 3.47Å; F52-M62 HydrophobicContact CE1-SD 4.24Å; F52-M62 HydrophobicContact CZ-SD 4Å; F52-L63 HydrophobicContact CD1-CD1 3.91Å; F52-L63 HydrophobicContact CD1-CD2 3.91Å; F52-L63 HydrophobicContact CD1-CG 3.8Å; F52-L63 HydrophobicContact CE1-CD2 4.27Å; F52-L63 HydrophobicContact CE1-CG 4.09Å
53	A	90.9	Very high	91.1	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-37.1	176.8	0	0	0	0	0	112.4	I49 Q50 K55 L63 T90 M94	I49-A53 PolarHBondContact O-N 3.07Å; Q50-A53 PolarHBondContact O-N 3.49Å; A53-K55 VanDerWaalsContact C-N 3.26Å; A53-K55 PolarHBondContact O-N 2.98Å; A53-L63 HydrophobicContact CB-CD1 3.86Å; A53-T90 HydrophobicContact CB-CG2 4.15Å; A53-M94 HydrophobicContact CB-CG 3.94Å; A53-M94 HydrophobicContact CB-SD 4.37Å
54	E	89.8	Confident	91.2	Very high	96 Å²	96	55.6 Å²	55.6	45%	0.449	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.5	178.9	-75.2	179	170.9	0	0	114.7	Q50 F52 G56 N93	Q50-E54 PolarHBondContact NE2-OE1 3.48Å; Q50-E54 PolarHBondContact NE2-OE2 3.27Å; Q50-E54 WeakPolarHBondContact O-CG 3.37Å; Q50-E54 PolarHBondContact O-N 2.99Å; Q50-E54 VanDerWaalsContact O-N 3.13Å; F52-E54 VanDerWaalsContact C-N 3.31Å; F52-E54 PolarHBondContact O-N 3.06Å; E54-G56 VanDerWaalsContact C-N 3.29Å; E54-G56 PolarHBondContact O-N 3.45Å; E54-N93 PolarHBondContact OE1-ND2 2.97Å
55	K	89.4	Confident	91.3	Very high	161 Å²	161	54 Å²	54	70%	0.7	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.4	-174	-77.6	172.1	-175.5	-179.9	0	114.4	K51 F52 A53 N59	K51-K55 WeakPolarHBondContact O-CD 3.38Å; K51-K55 WeakPolarHBondContact O-CE 3.29Å; K51-K55 WeakPolarHBondContact O-CG 3.26Å; F52-K55 PolarHBondContact O-N 3.49Å; A53-K55 VanDerWaalsContact C-N 3.26Å; A53-K55 PolarHBondContact O-N 2.98Å; K55-N59 WeakPolarHBondContact CB-ND2 3.4Å
56	G	88.2	Confident	91.3	Very high	27 Å²	27	57.1 Å²	57.1	28%	0.278	30%	0.304	S	S	.	.			trans	157.2	164.6	173.5	0	0	0	0	0	115	E54 E58 N59 K60	E54-G56 VanDerWaalsContact C-N 3.29Å; E54-G56 PolarHBondContact O-N 3.45Å; G56-E58 PolarHBondContact O-N 3.2Å; G56-N59 WeakPolarHBondContact O-CB 3.31Å; G56-N59 PolarHBondContact O-N 3.44Å; G56-N59 VanDerWaalsContact O-N 3.13Å; G56-K60 PolarHBondContact O-N 2.98Å
57	E	89.8	Confident	91.3	Very high	94 Å²	94	59.3 Å²	59.3	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-59.8	-39.3	-177.3	-65.2	-55.6	128	0	0	113.5	N59 K60 V61 N97	E57-N59 PolarHBondContact O-N 2.87Å; E57-K60 WeakPolarHBondContact O-CB 3.39Å; E57-K60 PolarHBondContact O-N 3.45Å; E57-K60 WeakPolarHBondContact OE1-CE 3.36Å; E57-K60 IonicContact OE1-NZ 3.63Å; E57-K60 PolarHBondContact OE1-NZ 2.92Å; E57-K60 WeakPolarHBondContact OE2-CD 3.4Å; E57-K60 IonicContact OE2-NZ 2.76Å; E57-V61 PolarHBondContact O-N 2.94Å; E57-V61 VanDerWaalsContact O-N 3.15Å; E57-N97 PolarHBondContact OE2-ND2 3.1Å
58	E	90.5	Very high	91.4	Very high	168 Å²	168	55.7 Å²	55.7	79%	0.785	31%	0.31	S	S	*	.	H	α-helix	trans	-58.8	-34.1	177.5	-64	-179.6	-177.5	0	0	112.1	G56 M62	G56-E58 PolarHBondContact O-N 3.2Å; E58-M62 WeakPolarHBondContact O-CB 3.39Å; E58-M62 PolarHBondContact O-N 3.32Å
59	N	92.2	Very high	91.5	Very high	30 Å²	30	54.1 Å²	54.1	16%	0.16	30%	0.295	C	S	.	.	H	α-helix	trans	-71.2	-35.8	177.6	-65.8	-14.3	0	0	0	111.4	F52 K55 G56 E57 M62 L63	F52-N59 HydrophobicContact CD1-CB 3.87Å; F52-N59 HydrophobicContact CE1-CB 3.57Å; F52-N59 HydrophobicContact CG-CB 4.5Å; F52-N59 HydrophobicContact CZ-CB 3.95Å; F52-N59 WeakPolarHBondContact CZ-OD1 3.41Å; F52-N59 WeakPolarHBondContact O-CB 3.3Å; F52-N59 PolarHBondContact O-ND2 3.47Å; K55-N59 WeakPolarHBondContact CB-ND2 3.4Å; G56-N59 WeakPolarHBondContact O-CB 3.31Å; G56-N59 PolarHBondContact O-N 3.44Å; G56-N59 VanDerWaalsContact O-N 3.13Å; E57-N59 PolarHBondContact O-N 2.87Å; N59-M62 PolarHBondContact O-N 3.36Å; N59-L63 WeakPolarHBondContact O-CB 3.46Å; N59-L63 VanDerWaalsContact O-CG 3.26Å; N59-L63 WeakPolarHBondContact O-CG 3.38Å; N59-L63 PolarHBondContact O-N 3.5Å
60	K	93.1	Very high	91.4	Very high	16 Å²	16	54.9 Å²	54.9	7%	0.07	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-46.7	176	-58.2	176.6	-179.5	177	0	110.4	G56 E57 L63 L64 N93 M94 T96 N97 V100	G56-K60 PolarHBondContact O-N 2.98Å; E57-K60 WeakPolarHBondContact O-CB 3.39Å; E57-K60 PolarHBondContact O-N 3.45Å; E57-K60 WeakPolarHBondContact OE1-CE 3.36Å; E57-K60 IonicContact OE1-NZ 3.63Å; E57-K60 PolarHBondContact OE1-NZ 2.92Å; E57-K60 WeakPolarHBondContact OE2-CD 3.4Å; E57-K60 IonicContact OE2-NZ 2.76Å; K60-L63 PolarHBondContact O-N 3.35Å; K60-L64 PolarHBondContact O-N 2.81Å; K60-N93 WeakPolarHBondContact CE-O 3.32Å; K60-N93 PolarHBondContact NZ-O 3.24Å; K60-M94 HydrophobicContact CB-CE 4.49Å; K60-M94 HydrophobicContact CB-CG 4.39Å; K60-M94 HydrophobicContact CG-CG 4.19Å; K60-M94 WeakPolarHBondContact O-CE 3.23Å; K60-T96 PolarHBondContact NZ-OG1 2.8Å; K60-N97 HydrophobicContact CD-CB 4.1Å; K60-V100 HydrophobicContact CB-CG2 4.4Å
61	V	92.4	Very high	91.4	Very high	48 Å²	48	55.4 Å²	55.4	29%	0.291	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-39.6	176.5	-179.1	0	0	0	0	111.5	E57 L64 G65	E57-V61 PolarHBondContact O-N 2.94Å; E57-V61 VanDerWaalsContact O-N 3.15Å; V61-L64 WeakPolarHBondContact O-CB 3.32Å; V61-L64 PolarHBondContact O-N 2.92Å; V61-G65 PolarHBondContact O-N 3.24Å
62	M	91.8	Very high	91.6	Very high	94 Å²	94	50.7 Å²	50.7	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-46.7	174.7	-177.9	-179	-65.9	0	0	111.9	P27 F52 E58 N59 L64 G65 L66	P27-M62 HydrophobicContact CG-SD 3.84Å; F52-M62 HydrophobicContact CE1-SD 4.24Å; F52-M62 HydrophobicContact CZ-SD 4Å; E58-M62 WeakPolarHBondContact O-CB 3.39Å; E58-M62 PolarHBondContact O-N 3.32Å; N59-M62 PolarHBondContact O-N 3.36Å; M62-L64 VanDerWaalsContact C-N 3.3Å; M62-L64 PolarHBondContact O-N 3.15Å; M62-G65 PolarHBondContact O-N 3.4Å; M62-L66 HydrophobicContact CG-CD1 4.13Å; M62-L66 VanDerWaalsContact O-CG 3.29Å; M62-L66 WeakPolarHBondContact O-CG 3.16Å; M62-L66 PolarHBondContact O-N 2.85Å
63	L	92.9	Very high	91.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-38	177.5	-75.2	177.2	0	0	0	111.9	P27 V31 I49 F52 A53 N59 K60 L66 G67 V68 M94	P27-L63 HydrophobicContact CB-CD2 4.47Å; V31-L63 HydrophobicContact CG2-CD2 3.96Å; I49-L63 HydrophobicContact CD1-CD2 3.68Å; I49-L63 HydrophobicContact CG2-CD1 4.04Å; I49-L63 HydrophobicContact CG2-CD2 4.44Å; F52-L63 HydrophobicContact CD1-CD1 3.91Å; F52-L63 HydrophobicContact CD1-CD2 3.91Å; F52-L63 HydrophobicContact CD1-CG 3.8Å; F52-L63 HydrophobicContact CE1-CD2 4.27Å; F52-L63 HydrophobicContact CE1-CG 4.09Å; A53-L63 HydrophobicContact CB-CD1 3.86Å; N59-L63 WeakPolarHBondContact O-CB 3.46Å; N59-L63 VanDerWaalsContact O-CG 3.26Å; N59-L63 WeakPolarHBondContact O-CG 3.38Å; N59-L63 PolarHBondContact O-N 3.5Å; K60-L63 PolarHBondContact O-N 3.35Å; L63-L66 PolarHBondContact O-N 3.13Å; L63-G67 PolarHBondContact O-N 2.64Å; L63-V68 HydrophobicContact CB-CB 4.25Å; L63-V68 HydrophobicContact CB-CG1 3.8Å; L63-V68 WeakPolarHBondContact O-CB 3.19Å; L63-V68 WeakPolarHBondContact O-CG1 3.33Å; L63-V68 PolarHBondContact O-N 3.33Å; L63-M94 HydrophobicContact CB-CE 3.79Å; L63-M94 HydrophobicContact CB-SD 4.29Å; L63-M94 HydrophobicContact CD1-CE 4.43Å; L63-M94 HydrophobicContact CD1-SD 3.92Å
64	L	93.1	Very high	91.6	Very high	39 Å²	39	57.4 Å²	57.4	20%	0.204	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-50.1	171.5	173.8	63.8	0	0	0	111.3	K60 V61 M62 L66 G67 L69 E99 V100 A103	K60-L64 PolarHBondContact O-N 2.81Å; V61-L64 WeakPolarHBondContact O-CB 3.32Å; V61-L64 PolarHBondContact O-N 2.92Å; M62-L64 VanDerWaalsContact C-N 3.3Å; M62-L64 PolarHBondContact O-N 3.15Å; L64-L66 PolarHBondContact O-N 2.96Å; L64-L66 VanDerWaalsContact O-N 3.17Å; L64-G67 PolarHBondContact O-N 3.32Å; L64-L69 HydrophobicContact CD1-CD1 3.57Å; L64-L69 HydrophobicContact CD1-CG 4.07Å; L64-E99 HydrophobicContact CD2-CB 4.14Å; L64-V100 HydrophobicContact CB-CG2 4.23Å; L64-V100 HydrophobicContact CD2-CG2 4.15Å; L64-A103 HydrophobicContact CD1-CB 3.46Å; L64-A103 VanDerWaalsContact CD1-CB 3.46Å; L64-A103 HydrophobicContact CD2-CB 4.31Å
65	G	90.7	Very high	91.7	Very high	71 Å²	71	53.4 Å²	53.4	73%	0.732	30%	0.3	S	S	*	.	H	α-helix	trans	-61.6	-22.2	177.2	0	0	0	0	0	114.2	V61 M62	V61-G65 PolarHBondContact O-N 3.24Å; M62-G65 PolarHBondContact O-N 3.4Å
66	L	92.5	Very high	91.8	Very high	71 Å²	71	45.7 Å²	45.7	37%	0.372	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.5	174.5	-66.7	169.4	0	0	0	113.7	P27 V31 M62 L63 L64	P27-L66 HydrophobicContact CB-CD1 3.94Å; P27-L66 HydrophobicContact CG-CD1 4.21Å; V31-L66 HydrophobicContact CG2-CB 4.15Å; V31-L66 HydrophobicContact CG2-CD1 4.47Å; M62-L66 HydrophobicContact CG-CD1 4.13Å; M62-L66 VanDerWaalsContact O-CG 3.29Å; M62-L66 WeakPolarHBondContact O-CG 3.16Å; M62-L66 PolarHBondContact O-N 2.85Å; L63-L66 PolarHBondContact O-N 3.13Å; L64-L66 PolarHBondContact O-N 2.96Å; L64-L66 VanDerWaalsContact O-N 3.17Å
67	G	92.1	Very high	91.9	Very high	46 Å²	46	48 Å²	48	47%	0.474	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	32.9	176.8	0	0	0	0	0	114.4	L63 L64 L69 P71	L63-G67 PolarHBondContact O-N 2.64Å; L64-G67 PolarHBondContact O-N 3.32Å; G67-L69 VanDerWaalsContact C-N 3.33Å; G67-L69 PolarHBondContact O-N 3.38Å; G67-P71 VanDerWaalsContact O-CD 3.32Å; G67-P71 WeakPolarHBondContact O-CD 3.34Å
68	V	93.6	Very high	92.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.262	C	S	.	.			trans	-68.6	-25.6	-175.2	80.4	0	0	0	0	114.5	V31 L34 I49 L63 P71 L72 M94	V31-V68 HydrophobicContact CG1-CB 4.3Å; V31-V68 HydrophobicContact CG1-CG2 4.34Å; V31-V68 HydrophobicContact CG2-CB 4.12Å; V31-V68 HydrophobicContact CG2-CG2 3.9Å; L34-V68 HydrophobicContact CD1-CG2 3.79Å; I49-V68 HydrophobicContact CG2-CG2 4.07Å; L63-V68 HydrophobicContact CB-CB 4.25Å; L63-V68 HydrophobicContact CB-CG1 3.8Å; L63-V68 WeakPolarHBondContact O-CB 3.19Å; L63-V68 WeakPolarHBondContact O-CG1 3.33Å; L63-V68 PolarHBondContact O-N 3.33Å; V68-P71 WeakPolarHBondContact O-CD 3.16Å; V68-L72 HydrophobicContact CB-CD1 4.39Å; V68-L72 HydrophobicContact CG1-CD1 3.97Å; V68-L72 HydrophobicContact CG2-CD1 3.71Å; V68-L72 HydrophobicContact CG2-CG 3.96Å; V68-L72 WeakPolarHBondContact O-CG 3.23Å; V68-L72 PolarHBondContact O-N 3.34Å; V68-L72 VanDerWaalsContact O-N 3.14Å; V68-M94 HydrophobicContact CG1-CE 3.68Å; V68-M94 HydrophobicContact CG1-SD 3.93Å
69	L	92.2	Very high	92	Very high	9 Å²	9	42.9 Å²	42.9	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-50.9	-168.4	-61	-176	0	0	0	112.8	L64 G67 L72 C73 L91 M94 V100 A103 L104	L64-L69 HydrophobicContact CD1-CD1 3.57Å; L64-L69 HydrophobicContact CD1-CG 4.07Å; G67-L69 VanDerWaalsContact C-N 3.33Å; G67-L69 PolarHBondContact O-N 3.38Å; L69-L72 PolarHBondContact O-N 3.48Å; L69-L72 VanDerWaalsContact O-N 3.08Å; L69-C73 PolarHBondContact O-N 3.06Å; L69-C73 PolarHBondContact O-SG 2.69Å; L69-L91 HydrophobicContact CD2-CD2 4.19Å; L69-M94 HydrophobicContact CD2-CE 4.25Å; L69-V100 HydrophobicContact CD1-CG1 4.35Å; L69-V100 HydrophobicContact CD2-CG1 3.86Å; L69-A103 HydrophobicContact CD1-CB 3.7Å; L69-L104 HydrophobicContact CB-CD2 4.44Å; L69-L104 HydrophobicContact CD1-CD2 4.03Å; L69-L104 HydrophobicContact CD1-CG 3.98Å; L69-L104 HydrophobicContact CD2-CD2 3.98Å; L69-L104 HydrophobicContact CD2-CG 4.26Å; L69-L104 HydrophobicContact CG-CD2 4.37Å
70	G	90.4	Very high	91.9	Very high	19 Å²	19	43 Å²	43	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-56.1	-49	-179.8	0	0	0	0	0	113.8	K74	G70-K74 PolarHBondContact O-N 3.34Å
71	P	92.4	Very high	91.7	Very high	27 Å²	27	49.5 Å²	49.5	18%	0.175	29%	0.29	C	S	.	.	H	α-helix	trans	-56.3	-46.4	171	-27.5	34.1	0	0	0	113.5	L34 G67 V68 K74 L75	L34-P71 HydrophobicContact CB-CB 3.85Å; L34-P71 HydrophobicContact CD1-CB 4.09Å; G67-P71 VanDerWaalsContact O-CD 3.32Å; G67-P71 WeakPolarHBondContact O-CD 3.34Å; V68-P71 WeakPolarHBondContact O-CD 3.16Å; P71-K74 PolarHBondContact O-N 3.15Å; P71-L75 WeakPolarHBondContact O-CG 3.49Å; P71-L75 PolarHBondContact O-N 3.43Å
72	L	93.1	Very high	91.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-42.4	-179.1	-70.7	172.9	0	0	0	112.7	L34 V68 L69 K74 L75 I76 A87 T90 L91 M94	L34-L72 HydrophobicContact CD1-CD2 4.13Å; L34-L72 HydrophobicContact CD1-CG 4.35Å; V68-L72 HydrophobicContact CB-CD1 4.39Å; V68-L72 HydrophobicContact CG1-CD1 3.97Å; V68-L72 HydrophobicContact CG2-CD1 3.71Å; V68-L72 HydrophobicContact CG2-CG 3.96Å; V68-L72 WeakPolarHBondContact O-CG 3.23Å; V68-L72 PolarHBondContact O-N 3.34Å; V68-L72 VanDerWaalsContact O-N 3.14Å; L69-L72 PolarHBondContact O-N 3.48Å; L69-L72 VanDerWaalsContact O-N 3.08Å; L72-K74 PolarHBondContact O-N 2.92Å; L72-L75 PolarHBondContact O-N 3.33Å; L72-I76 PolarHBondContact O-N 3.47Å; L72-A87 HydrophobicContact CD2-CB 4.35Å; L72-T90 HydrophobicContact CD1-CG2 3.57Å; L72-T90 HydrophobicContact CD2-CG2 4.29Å; L72-L91 HydrophobicContact CB-CD1 3.97Å; L72-L91 HydrophobicContact CB-CD2 3.82Å; L72-L91 HydrophobicContact CB-CG 3.79Å; L72-L91 HydrophobicContact CD1-CD2 4.02Å; L72-L91 HydrophobicContact CD1-CG 4.19Å; L72-M94 HydrophobicContact CD1-SD 4.38Å
73	C	92.3	Very high	91.6	Very high	16 Å²	16	46.9 Å²	46.9	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-57.8	-38.4	177.4	-68.3	0	0	0	0	111.7	L69 L75 I76 F109	L69-C73 PolarHBondContact O-N 3.06Å; L69-C73 PolarHBondContact O-SG 2.69Å; C73-L75 VanDerWaalsContact C-N 3.32Å; C73-L75 PolarHBondContact O-N 2.89Å; C73-I76 WeakPolarHBondContact O-CG1 3.35Å; C73-I76 PolarHBondContact O-N 2.88Å; C73-F109 HydrophobicContact CB-CB 4.17Å
74	K	90.5	Very high	91.6	Very high	173 Å²	173	48 Å²	48	75%	0.752	28%	0.28	S	S	*	.	H	α-helix	trans	-67.7	-30.5	175.1	-68.4	175.8	-177.3	176.7	0	113.3	G70 P71 L72 I76	G70-K74 PolarHBondContact O-N 3.34Å; P71-K74 PolarHBondContact O-N 3.15Å; L72-K74 PolarHBondContact O-N 2.92Å; K74-I76 VanDerWaalsContact C-N 3.32Å
75	L	92.9	Very high	91.5	Very high	12 Å²	12	49.4 Å²	49.4	6%	0.063	28%	0.283	C	S	.	.	H	α-helix	trans	-79.9	-12.4	-177.3	-66.1	175.9	0	0	0	113.6	L34 L42 P71 L72 C73 D77 H78 I83 A87	L34-L75 HydrophobicContact CB-CD1 4.32Å; L34-L75 HydrophobicContact CD2-CD1 4.01Å; L42-L75 HydrophobicContact CD1-CD1 3.89Å; L42-L75 HydrophobicContact CD1-CD2 3.91Å; L42-L75 HydrophobicContact CD2-CD2 3.68Å; L42-L75 HydrophobicContact CG-CD2 4.11Å; P71-L75 WeakPolarHBondContact O-CG 3.49Å; P71-L75 PolarHBondContact O-N 3.43Å; L72-L75 PolarHBondContact O-N 3.33Å; C73-L75 VanDerWaalsContact C-N 3.32Å; C73-L75 PolarHBondContact O-N 2.89Å; L75-D77 PolarHBondContact O-N 3.34Å; L75-H78 VanDerWaalsContact O-CB 3.25Å; L75-H78 WeakPolarHBondContact O-CB 3.35Å; L75-H78 PolarHBondContact O-N 3.29Å; L75-H78 VanDerWaalsContact O-N 3.16Å; L75-I83 HydrophobicContact CB-CG2 4.34Å; L75-I83 HydrophobicContact CD1-CG2 4.47Å; L75-I83 HydrophobicContact CD2-CG2 4Å; L75-I83 HydrophobicContact CG-CG2 4.5Å; L75-A87 HydrophobicContact CB-CB 3.64Å
76	I	91.8	Very high	91.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-35.6	172.8	-60.6	169.9	0	0	0	111	L72 C73 K74 K84 L88 L91 L113 K116	L72-I76 PolarHBondContact O-N 3.47Å; C73-I76 WeakPolarHBondContact O-CG1 3.35Å; C73-I76 PolarHBondContact O-N 2.88Å; K74-I76 VanDerWaalsContact C-N 3.32Å; I76-K84 WeakPolarHBondContact O-CD 3.3Å; I76-K84 VanDerWaalsContact O-CG 3.29Å; I76-K84 WeakPolarHBondContact O-CG 3.3Å; I76-L88 HydrophobicContact CG1-CD2 4.22Å; I76-L88 HydrophobicContact CG2-CD2 3.95Å; I76-L88 HydrophobicContact CG2-CG 4.41Å; I76-L91 HydrophobicContact CD1-CD1 3.56Å; I76-L91 HydrophobicContact CG1-CD1 3.75Å; I76-L113 HydrophobicContact CD1-CD2 3.88Å; I76-L113 HydrophobicContact CD1-CG 4.39Å; I76-L113 HydrophobicContact CG2-CD2 4.3Å; I76-K116 HydrophobicContact CG2-CG 4.1Å; I76-K116 WeakPolarHBondContact O-CE 3.34Å
77	D	90.3	Very high	91.7	Very high	76 Å²	76	43.6 Å²	43.6	41%	0.406	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	12.5	-177.9	-69.1	-48.4	0	0	0	113.5	L75 S112 K116	L75-D77 PolarHBondContact O-N 3.34Å; D77-S112 WeakPolarHBondContact OD2-CB 3.4Å; D77-S112 PolarHBondContact OD2-OG 3.08Å; D77-K116 WeakPolarHBondContact OD1-CE 3.39Å; D77-K116 IonicContact OD1-NZ 2.8Å; D77-K116 PolarHBondContact OD1-NZ 2.6Å
78	H	92.3	Very high	91.8	Very high	46 Å²	46	41.5 Å²	41.5	21%	0.213	21%	0.213	C	C	.	.			trans	-67	142.4	-178.7	-163.2	-86.6	0	0	0	112.1	L75 N80 I83	L75-H78 VanDerWaalsContact O-CB 3.25Å; L75-H78 WeakPolarHBondContact O-CB 3.35Å; L75-H78 PolarHBondContact O-N 3.29Å; L75-H78 VanDerWaalsContact O-N 3.16Å; H78-N80 VanDerWaalsContact C-N 3.33Å; H78-N80 WeakPolarHBondContact ND1-CB 3.42Å; H78-N80 PolarHBondContact ND1-N 3.3Å; H78-N80 PolarHBondContact O-N 3.33Å; H78-I83 HydrophobicContact CB-CG2 4.03Å
79	S	89.4	Confident	91.8	Very high	107 Å²	107	42.5 Å²	42.5	75%	0.748	22%	0.218	S	C	*	.	S	Bend	trans	-64.9	-35.1	-178	55.6	0	0	0	0	113	K81	S79-K81 PolarHBondContact O-N 3.14Å
80	N	90.4	Very high	91.8	Very high	33 Å²	33	42 Å²	42	18%	0.176	22%	0.216	C	C	.	.	S	Bend	trans	-72.1	120.5	173.9	-170.8	-40	0	0	0	111.8	E39 H78 L82 I83 K84	E39-N80 VanDerWaalsContact OE1-CB 3.25Å; E39-N80 WeakPolarHBondContact OE1-CB 3.45Å; E39-N80 PolarHBondContact OE1-ND2 2.98Å; H78-N80 VanDerWaalsContact C-N 3.33Å; H78-N80 WeakPolarHBondContact ND1-CB 3.42Å; H78-N80 PolarHBondContact ND1-N 3.3Å; H78-N80 PolarHBondContact O-N 3.33Å; N80-L82 VanDerWaalsContact C-N 3.32Å; N80-L82 PolarHBondContact O-N 3.31Å; N80-L82 WeakPolarHBondContact OD1-CB 3.33Å; N80-L82 PolarHBondContact OD1-N 3.27Å; N80-I83 HydrophobicContact CB-CB 4.19Å; N80-I83 HydrophobicContact CB-CD1 3.91Å; N80-I83 HydrophobicContact CB-CG1 4.12Å; N80-I83 PolarHBondContact O-N 3.34Å; N80-K84 WeakPolarHBondContact O-CB 3.25Å; N80-K84 PolarHBondContact O-N 3.15Å
81	K	89.6	Confident	92	Very high	153 Å²	153	41.1 Å²	41.1	67%	0.665	21%	0.207	S	C	*	.	H	α-helix	trans	-58.2	-37.4	179.3	-61.5	-172.6	178.3	-168.7	0	113.7	S79 R85	S79-K81 PolarHBondContact O-N 3.14Å; K81-R85 WeakPolarHBondContact O-CB 3.38Å; K81-R85 VanDerWaalsContact O-CG 3.23Å; K81-R85 WeakPolarHBondContact O-CG 3.36Å; K81-R85 PolarHBondContact O-N 3.03Å
82	L	89.9	Confident	92	Very high	87 Å²	87	39.9 Å²	39.9	46%	0.455	20%	0.198	S	C	.	.	H	α-helix	trans	-72.3	-42.6	-178.9	-64.1	176.8	0	0	0	111.8	L43 N80 R85 N86	L43-L82 HydrophobicContact CD1-CB 3.55Å; L43-L82 HydrophobicContact CD1-CD1 4.28Å; L43-L82 HydrophobicContact CD2-CD1 4.36Å; N80-L82 VanDerWaalsContact C-N 3.32Å; N80-L82 PolarHBondContact O-N 3.31Å; N80-L82 WeakPolarHBondContact OD1-CB 3.33Å; N80-L82 PolarHBondContact OD1-N 3.27Å; L82-R85 PolarHBondContact O-N 3.45Å; L82-N86 WeakPolarHBondContact O-CB 3.39Å; L82-N86 VanDerWaalsContact O-CG 3.23Å; L82-N86 PolarHBondContact O-N 2.67Å
83	I	92.3	Very high	92	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-47	176.8	-66.3	172.3	0	0	0	110	E39 L42 L43 L75 H78 N80 R85 N86 A87	E39-I83 HydrophobicContact CG-CD1 3.76Å; L42-I83 HydrophobicContact CB-CD1 4.02Å; L42-I83 HydrophobicContact CD2-CD1 3.96Å; L42-I83 HydrophobicContact CD2-CG2 4.2Å; L42-I83 HydrophobicContact CG-CD1 3.93Å; L42-I83 HydrophobicContact CG-CG2 4.08Å; L43-I83 HydrophobicContact CB-CD1 4.29Å; L43-I83 HydrophobicContact CB-CG1 4.06Å; L43-I83 HydrophobicContact CD1-CG1 4Å; L75-I83 HydrophobicContact CB-CG2 4.34Å; L75-I83 HydrophobicContact CD1-CG2 4.47Å; L75-I83 HydrophobicContact CD2-CG2 4Å; L75-I83 HydrophobicContact CG-CG2 4.5Å; H78-I83 HydrophobicContact CB-CG2 4.03Å; N80-I83 HydrophobicContact CB-CB 4.19Å; N80-I83 HydrophobicContact CB-CD1 3.91Å; N80-I83 HydrophobicContact CB-CG1 4.12Å; N80-I83 PolarHBondContact O-N 3.34Å; I83-R85 PolarHBondContact O-N 3.08Å; I83-N86 PolarHBondContact O-N 3.42Å; I83-A87 WeakPolarHBondContact O-CB 3.33Å; I83-A87 PolarHBondContact O-N 2.69Å
84	K	91.7	Very high	92.1	Very high	22 Å²	22	40.6 Å²	40.6	10%	0.096	20%	0.201	C	C	.	.	H	α-helix	trans	-56.9	-47.5	174.6	167	168.7	47.7	164.8	0	112	I76 N80 A87 L88 K116 E121	I76-K84 WeakPolarHBondContact O-CD 3.3Å; I76-K84 VanDerWaalsContact O-CG 3.29Å; I76-K84 WeakPolarHBondContact O-CG 3.3Å; N80-K84 WeakPolarHBondContact O-CB 3.25Å; N80-K84 PolarHBondContact O-N 3.15Å; K84-A87 PolarHBondContact O-N 3.02Å; K84-L88 HydrophobicContact CG-CD1 4.03Å; K84-L88 WeakPolarHBondContact O-CG 3.25Å; K84-L88 PolarHBondContact O-N 2.66Å; K84-K116 HydrophobicContact CD-CD 4.39Å; K84-E121 IonicContact NZ-OE1 2.62Å; K84-E121 PolarHBondContact NZ-OE1 2.8Å; K84-E121 IonicContact NZ-OE2 3.64Å; K84-E121 PolarHBondContact NZ-OE2 2.92Å
85	R	91.4	Very high	92.2	Very high	70 Å²	70	32.4 Å²	32.4	26%	0.264	17%	0.166	S	C	.	.	H	α-helix	trans	-60	-47.5	176.6	-81.8	178.8	166.9	173.6	-6.3	112.5	K81 L82 I83 A87 L88 M89 D122 F124 V125	K81-R85 WeakPolarHBondContact O-CB 3.38Å; K81-R85 VanDerWaalsContact O-CG 3.23Å; K81-R85 WeakPolarHBondContact O-CG 3.36Å; K81-R85 PolarHBondContact O-N 3.03Å; L82-R85 PolarHBondContact O-N 3.45Å; I83-R85 PolarHBondContact O-N 3.08Å; R85-A87 VanDerWaalsContact C-N 3.3Å; R85-A87 PolarHBondContact O-N 2.93Å; R85-L88 PolarHBondContact O-N 3.37Å; R85-M89 VanDerWaalsContact O-CB 3.31Å; R85-M89 WeakPolarHBondContact O-CB 3.24Å; R85-M89 PolarHBondContact O-N 3.31Å; R85-D122 IonicContact CZ-OD1 3.87Å; R85-D122 IonicContact NH2-OD1 3.49Å; R85-D122 PolarHBondContact NH2-OD1 3.07Å; R85-D122 IonicContact NH2-OD2 3.88Å; R85-D122 PolarHBondContact NH2-OD2 3.15Å; R85-F124 HydrophobicContact CB-CD1 4.22Å; R85-F124 HydrophobicContact CB-CE1 4.04Å; R85-F124 HydrophobicContact CG-CD1 3.84Å; R85-F124 HydrophobicContact CG-CE1 4.18Å; R85-V125 HydrophobicContact CG-CG2 4.09Å
86	N	93.1	Very high	92.1	Very high	19 Å²	19	35.4 Å²	35.4	10%	0.102	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-40.1	178.7	-70.4	-11.7	0	0	0	111.5	S46 E47 L82 I83 T90	S46-N86 PolarHBondContact OG-ND2 2.93Å; E47-N86 PolarHBondContact N-ND2 3.23Å; L82-N86 WeakPolarHBondContact O-CB 3.39Å; L82-N86 VanDerWaalsContact O-CG 3.23Å; L82-N86 PolarHBondContact O-N 2.67Å; I83-N86 PolarHBondContact O-N 3.42Å; N86-T90 WeakPolarHBondContact O-CB 3.31Å; N86-T90 PolarHBondContact O-N 3.01Å; N86-T90 PolarHBondContact O-OG1 2.88Å
87	A	93.8	Very high	92.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-48.4	177.2	0	0	0	0	0	111.9	L72 L75 I83 K84 R85 T90 L91	L72-A87 HydrophobicContact CD2-CB 4.35Å; L75-A87 HydrophobicContact CB-CB 3.64Å; I83-A87 WeakPolarHBondContact O-CB 3.33Å; I83-A87 PolarHBondContact O-N 2.69Å; K84-A87 PolarHBondContact O-N 3.02Å; R85-A87 VanDerWaalsContact C-N 3.3Å; R85-A87 PolarHBondContact O-N 2.93Å; A87-T90 PolarHBondContact O-N 3.38Å; A87-L91 WeakPolarHBondContact O-CB 3.43Å; A87-L91 WeakPolarHBondContact O-CG 3.45Å; A87-L91 PolarHBondContact O-N 3.11Å
88	L	93.9	Very high	92.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-47.1	177.1	-77.6	169.1	0	0	0	112.3	I76 K84 R85 T90 L91 G92 L113 V125 F128 A129	I76-L88 HydrophobicContact CG1-CD2 4.22Å; I76-L88 HydrophobicContact CG2-CD2 3.95Å; I76-L88 HydrophobicContact CG2-CG 4.41Å; K84-L88 HydrophobicContact CG-CD1 4.03Å; K84-L88 WeakPolarHBondContact O-CG 3.25Å; K84-L88 PolarHBondContact O-N 2.66Å; R85-L88 PolarHBondContact O-N 3.37Å; L88-T90 VanDerWaalsContact C-N 3.32Å; L88-T90 PolarHBondContact O-N 3.44Å; L88-L91 PolarHBondContact O-N 3.23Å; L88-G92 PolarHBondContact O-N 3.34Å; L88-L113 HydrophobicContact CD2-CD2 3.32Å; L88-V125 HydrophobicContact CD1-CB 4.31Å; L88-V125 HydrophobicContact CD1-CG1 3.69Å; L88-V125 HydrophobicContact CD1-CG2 4.3Å; L88-F128 HydrophobicContact CB-CB 4.18Å; L88-A129 HydrophobicContact CD2-CB 4.24Å
89	M	93.3	Very high	92	Very high	21 Å²	21	38.8 Å²	38.8	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-43.9	178.2	175.1	165.4	44.6	0	0	111.6	Q50 R85 N93 F124 F128	Q50-M89 HydrophobicContact CG-CB 4.39Å; Q50-M89 HydrophobicContact CG-CE 3.41Å; Q50-M89 VanDerWaalsContact CG-CE 3.41Å; Q50-M89 HydrophobicContact CG-CG 3.85Å; Q50-M89 HydrophobicContact CG-SD 3.94Å; Q50-M89 PolarHBondContact NE2-SD 3.32Å; R85-M89 VanDerWaalsContact O-CB 3.31Å; R85-M89 WeakPolarHBondContact O-CB 3.24Å; R85-M89 PolarHBondContact O-N 3.31Å; M89-N93 VanDerWaalsContact O-CB 3.24Å; M89-N93 WeakPolarHBondContact O-CB 3.41Å; M89-N93 VanDerWaalsContact O-CG 3.23Å; M89-N93 PolarHBondContact O-N 2.79Å; M89-N93 PolarHBondContact O-ND2 2.86Å; M89-F124 HydrophobicContact CB-CE1 4.28Å; M89-F124 HydrophobicContact CB-CZ 4.37Å; M89-F124 HydrophobicContact CE-CE1 4.38Å; M89-F124 HydrophobicContact CE-CZ 3.84Å; M89-F124 HydrophobicContact SD-CE1 4.47Å; M89-F124 HydrophobicContact SD-CZ 3.67Å; M89-F128 HydrophobicContact CB-CD1 4.06Å; M89-F128 HydrophobicContact CB-CD2 4.11Å; M89-F128 HydrophobicContact CB-CE1 4.23Å; M89-F128 HydrophobicContact CB-CE2 4.33Å; M89-F128 HydrophobicContact CB-CG 3.99Å; M89-F128 HydrophobicContact CB-CZ 4.38Å; M89-F128 HydrophobicContact CG-CD1 4.06Å; M89-F128 HydrophobicContact CG-CD2 4.47Å; M89-F128 HydrophobicContact CG-CE1 3.75Å; M89-F128 HydrophobicContact CG-CE2 4.24Å; M89-F128 HydrophobicContact CG-CG 4.41Å; M89-F128 HydrophobicContact CG-CZ 3.85Å; M89-F128 HydrophobicContact SD-CE1 4.47Å; M89-F128 HydrophobicContact SD-CE2 4.3Å; M89-F128 HydrophobicContact SD-CZ 4.01Å
90	T	94	Very high	92.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-49.5	174.4	-54.5	0	0	0	0	110.8	I49 Q50 A53 L72 N86 A87 L88 M94	I49-T90 HydrophobicContact CG2-CG2 3.68Å; Q50-T90 VanDerWaalsContact CA-OG1 3.3Å; Q50-T90 WeakPolarHBondContact CA-OG1 3.38Å; Q50-T90 VanDerWaalsContact CB-OG1 3.3Å; Q50-T90 WeakPolarHBondContact CB-OG1 3.49Å; A53-T90 HydrophobicContact CB-CG2 4.15Å; L72-T90 HydrophobicContact CD1-CG2 3.57Å; L72-T90 HydrophobicContact CD2-CG2 4.29Å; N86-T90 WeakPolarHBondContact O-CB 3.31Å; N86-T90 PolarHBondContact O-N 3.01Å; N86-T90 PolarHBondContact O-OG1 2.88Å; A87-T90 PolarHBondContact O-N 3.38Å; L88-T90 VanDerWaalsContact C-N 3.32Å; L88-T90 PolarHBondContact O-N 3.44Å; T90-M94 HydrophobicContact CG2-CG 4.19Å; T90-M94 HydrophobicContact CG2-SD 3.72Å; T90-M94 VanDerWaalsContact O-CB 3.23Å; T90-M94 WeakPolarHBondContact O-CB 3.44Å; T90-M94 WeakPolarHBondContact O-CG 3.47Å; T90-M94 PolarHBondContact O-N 3.49Å
91	L	94.1	Very high	92.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-48.1	-178	-78.5	171.9	0	0	0	112.5	L69 L72 I76 A87 L88 N93 M94 A95 L104	L69-L91 HydrophobicContact CD2-CD2 4.19Å; L72-L91 HydrophobicContact CB-CD1 3.97Å; L72-L91 HydrophobicContact CB-CD2 3.82Å; L72-L91 HydrophobicContact CB-CG 3.79Å; L72-L91 HydrophobicContact CD1-CD2 4.02Å; L72-L91 HydrophobicContact CD1-CG 4.19Å; I76-L91 HydrophobicContact CD1-CD1 3.56Å; I76-L91 HydrophobicContact CG1-CD1 3.75Å; A87-L91 WeakPolarHBondContact O-CB 3.43Å; A87-L91 WeakPolarHBondContact O-CG 3.45Å; A87-L91 PolarHBondContact O-N 3.11Å; L88-L91 PolarHBondContact O-N 3.23Å; L91-N93 PolarHBondContact O-N 3.4Å; L91-M94 PolarHBondContact O-N 3.03Å; L91-A95 VanDerWaalsContact O-CB 3.25Å; L91-A95 WeakPolarHBondContact O-CB 3.32Å; L91-A95 PolarHBondContact O-N 3.4Å; L91-L104 HydrophobicContact CD2-CD2 4.06Å
92	G	92.1	Very high	92.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.2	-47.9	177.4	0	0	0	0	0	111.9	L88 M94 A95	L88-G92 PolarHBondContact O-N 3.34Å; G92-M94 VanDerWaalsContact C-N 3.33Å; G92-M94 PolarHBondContact O-N 2.81Å; G92-A95 PolarHBondContact O-N 2.98Å
93	N	93	Very high	92.2	Very high	32 Å²	32	27.7 Å²	27.7	17%	0.171	15%	0.153	C	C	.	.	H	α-helix	trans	-63.5	-38.7	176.9	-73.3	-15.8	0	0	0	112.3	E54 K60 M89 L91 T96	E54-N93 PolarHBondContact OE1-ND2 2.97Å; K60-N93 WeakPolarHBondContact CE-O 3.32Å; K60-N93 PolarHBondContact NZ-O 3.24Å; M89-N93 VanDerWaalsContact O-CB 3.24Å; M89-N93 WeakPolarHBondContact O-CB 3.41Å; M89-N93 VanDerWaalsContact O-CG 3.23Å; M89-N93 PolarHBondContact O-N 2.79Å; M89-N93 PolarHBondContact O-ND2 2.86Å; L91-N93 PolarHBondContact O-N 3.4Å; N93-T96 PolarHBondContact O-OG1 3.2Å
94	M	94.2	Very high	92	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-72.6	-36.2	178.6	-73.7	-172.3	64.2	0	0	112.7	A53 K60 L63 V68 L69 L72 T90 L91 G92 T96 N97 V100	A53-M94 HydrophobicContact CB-CG 3.94Å; A53-M94 HydrophobicContact CB-SD 4.37Å; K60-M94 HydrophobicContact CB-CE 4.49Å; K60-M94 HydrophobicContact CB-CG 4.39Å; K60-M94 HydrophobicContact CG-CG 4.19Å; K60-M94 WeakPolarHBondContact O-CE 3.23Å; L63-M94 HydrophobicContact CB-CE 3.79Å; L63-M94 HydrophobicContact CB-SD 4.29Å; L63-M94 HydrophobicContact CD1-CE 4.43Å; L63-M94 HydrophobicContact CD1-SD 3.92Å; V68-M94 HydrophobicContact CG1-CE 3.68Å; V68-M94 HydrophobicContact CG1-SD 3.93Å; L69-M94 HydrophobicContact CD2-CE 4.25Å; L72-M94 HydrophobicContact CD1-SD 4.38Å; T90-M94 HydrophobicContact CG2-CG 4.19Å; T90-M94 HydrophobicContact CG2-SD 3.72Å; T90-M94 VanDerWaalsContact O-CB 3.23Å; T90-M94 WeakPolarHBondContact O-CB 3.44Å; T90-M94 WeakPolarHBondContact O-CG 3.47Å; T90-M94 PolarHBondContact O-N 3.49Å; L91-M94 PolarHBondContact O-N 3.03Å; G92-M94 VanDerWaalsContact C-N 3.33Å; G92-M94 PolarHBondContact O-N 2.81Å; M94-T96 PolarHBondContact O-N 3.43Å; M94-N97 WeakPolarHBondContact O-CB 3.19Å; M94-N97 PolarHBondContact O-N 2.84Å; M94-V100 HydrophobicContact CB-CG1 4.04Å; M94-V100 HydrophobicContact CE-CG1 4.28Å; M94-V100 HydrophobicContact CE-CG2 4.16Å; M94-V100 WeakPolarHBondContact O-CB 3.44Å
95	A	92.9	Very high	91.8	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-24.6	-177.8	0	0	0	0	0	113.2	L91 G92 N97 L104 A135	L91-A95 VanDerWaalsContact O-CB 3.25Å; L91-A95 WeakPolarHBondContact O-CB 3.32Å; L91-A95 PolarHBondContact O-N 3.4Å; G92-A95 PolarHBondContact O-N 2.98Å; A95-N97 PolarHBondContact O-N 3.32Å; A95-N97 VanDerWaalsContact O-N 3.15Å; A95-L104 HydrophobicContact CB-CD1 3.7Å; A95-A135 HydrophobicContact CB-CB 3.92Å; A95-A135 WeakPolarHBondContact O-CB 3.41Å
96	T	90.5	Very high	91.5	Very high	75 Å²	75	34.3 Å²	34.3	46%	0.46	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.6	172.3	61.7	0	0	0	0	113.8	K60 N93 M94 L131	K60-T96 PolarHBondContact NZ-OG1 2.8Å; N93-T96 PolarHBondContact O-OG1 3.2Å; M94-T96 PolarHBondContact O-N 3.43Å; T96-L131 HydrophobicContact CG2-CD1 4.22Å; T96-L131 HydrophobicContact CG2-CG 4.48Å
97	N	93	Very high	91.2	Very high	22 Å²	22	37.1 Å²	37.1	12%	0.118	20%	0.197	C	C	.	.	S	Bend	trans	-85.8	128.4	174.2	-175.7	-76.9	0	0	0	110.8	E57 K60 M94 A95 E99 V100 S101	E57-N97 PolarHBondContact OE2-ND2 3.1Å; K60-N97 HydrophobicContact CD-CB 4.1Å; M94-N97 WeakPolarHBondContact O-CB 3.19Å; M94-N97 PolarHBondContact O-N 2.84Å; A95-N97 PolarHBondContact O-N 3.32Å; A95-N97 VanDerWaalsContact O-N 3.15Å; N97-E99 PolarHBondContact O-N 3.38Å; N97-E99 PolarHBondContact OD1-N 3.42Å; N97-V100 HydrophobicContact CB-CB 4.22Å; N97-V100 HydrophobicContact CB-CG2 3.95Å; N97-V100 PolarHBondContact O-N 2.96Å; N97-V100 VanDerWaalsContact O-N 3.11Å; N97-V100 PolarHBondContact OD1-N 3.28Å; N97-S101 PolarHBondContact O-N 2.8Å
98	G	89.1	Confident	90.8	Very high	52 Å²	52	43.2 Å²	43.2	54%	0.536	23%	0.229	S	C	.	.	H	α-helix	trans	-56.7	-42.3	-176.2	0	0	0	0	0	114.6	V100 S101 E102	G98-V100 VanDerWaalsContact C-N 3.32Å; G98-V100 PolarHBondContact O-N 3.19Å; G98-S101 PolarHBondContact O-N 2.91Å; G98-E102 WeakPolarHBondContact O-CG 3.49Å; G98-E102 PolarHBondContact O-N 2.89Å
99	E	90.8	Very high	90.6	Very high	119 Å²	119	43.2 Å²	43.2	56%	0.556	23%	0.229	S	C	*	.	H	α-helix	trans	-66.6	-36.5	179	-66.6	-177.1	-136.4	0	0	112	L64 N97 A103	L64-E99 HydrophobicContact CD2-CB 4.14Å; N97-E99 PolarHBondContact O-N 3.38Å; N97-E99 PolarHBondContact OD1-N 3.42Å; E99-A103 PolarHBondContact O-N 2.97Å; E99-A103 VanDerWaalsContact O-N 3.15Å
100	V	91.6	Very high	90.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.9	-44	176.8	-178.6	0	0	0	0	110.9	K60 L64 L69 M94 N97 G98 E102 A103 L104	K60-V100 HydrophobicContact CB-CG2 4.4Å; L64-V100 HydrophobicContact CB-CG2 4.23Å; L64-V100 HydrophobicContact CD2-CG2 4.15Å; L69-V100 HydrophobicContact CD1-CG1 4.35Å; L69-V100 HydrophobicContact CD2-CG1 3.86Å; M94-V100 HydrophobicContact CB-CG1 4.04Å; M94-V100 HydrophobicContact CE-CG1 4.28Å; M94-V100 HydrophobicContact CE-CG2 4.16Å; M94-V100 WeakPolarHBondContact O-CB 3.44Å; N97-V100 HydrophobicContact CB-CB 4.22Å; N97-V100 HydrophobicContact CB-CG2 3.95Å; N97-V100 PolarHBondContact O-N 2.96Å; N97-V100 VanDerWaalsContact O-N 3.11Å; N97-V100 PolarHBondContact OD1-N 3.28Å; G98-V100 VanDerWaalsContact C-N 3.32Å; G98-V100 PolarHBondContact O-N 3.19Å; V100-E102 VanDerWaalsContact C-N 3.31Å; V100-E102 PolarHBondContact O-N 2.92Å; V100-A103 PolarHBondContact O-N 3.21Å; V100-A103 VanDerWaalsContact O-N 3.1Å; V100-L104 HydrophobicContact CG1-CD1 3.99Å; V100-L104 HydrophobicContact CG1-CG 4.21Å; V100-L104 WeakPolarHBondContact O-CB 3.48Å; V100-L104 WeakPolarHBondContact O-CG 3.17Å; V100-L104 PolarHBondContact O-N 3.48Å
101	S	90.6	Very high	90.6	Very high	13 Å²	13	43.7 Å²	43.7	9%	0.091	23%	0.234	C	C	.	.	H	α-helix	trans	-56	-46.9	175.4	-173.8	0	0	0	0	110.7	N97 G98 A103 L104 K105 A135	N97-S101 PolarHBondContact O-N 2.8Å; G98-S101 PolarHBondContact O-N 2.91Å; S101-A103 VanDerWaalsContact C-N 3.31Å; S101-A103 PolarHBondContact O-N 3.32Å; S101-L104 PolarHBondContact O-N 3.29Å; S101-K105 WeakPolarHBondContact O-CG 3.29Å; S101-K105 PolarHBondContact O-N 3.32Å; S101-A135 PolarHBondContact OG-O 2.84Å
102	E	89.4	Confident	90.5	Very high	109 Å²	109	44.8 Å²	44.8	51%	0.509	24%	0.241	S	C	.	.	H	α-helix	trans	-58.7	-38.4	174.7	-72.2	-55.1	140.5	0	0	113.7	G98 V100 K105	G98-E102 WeakPolarHBondContact O-CG 3.49Å; G98-E102 PolarHBondContact O-N 2.89Å; V100-E102 VanDerWaalsContact C-N 3.31Å; V100-E102 PolarHBondContact O-N 2.92Å; E102-K105 WeakPolarHBondContact OE1-CE 3.42Å; E102-K105 IonicContact OE1-NZ 2.66Å; E102-K105 PolarHBondContact OE1-NZ 3.06Å; E102-K105 WeakPolarHBondContact OE2-CE 3.25Å; E102-K105 IonicContact OE2-NZ 3.58Å; E102-K105 PolarHBondContact OE2-NZ 2.97Å
103	A	90.8	Very high	90.5	Very high	24 Å²	24	44.8 Å²	44.8	20%	0.198	24%	0.241	C	C	.	.	H	α-helix	trans	-72.7	-38.1	177.5	0	0	0	0	0	112.4	L64 L69 E99 V100 S101 K105 K106	L64-A103 HydrophobicContact CD1-CB 3.46Å; L64-A103 VanDerWaalsContact CD1-CB 3.46Å; L64-A103 HydrophobicContact CD2-CB 4.31Å; L69-A103 HydrophobicContact CD1-CB 3.7Å; E99-A103 PolarHBondContact O-N 2.97Å; E99-A103 VanDerWaalsContact O-N 3.15Å; V100-A103 PolarHBondContact O-N 3.21Å; V100-A103 VanDerWaalsContact O-N 3.1Å; S101-A103 VanDerWaalsContact C-N 3.31Å; S101-A103 PolarHBondContact O-N 3.32Å; A103-K105 PolarHBondContact O-N 3.16Å; A103-K106 PolarHBondContact O-N 3.43Å
104	L	89.4	Confident	90.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-33.6	178.2	-82.5	170.4	0	0	0	112.1	L69 L91 A95 V100 S101 K106 E107 F109	L69-L104 HydrophobicContact CB-CD2 4.44Å; L69-L104 HydrophobicContact CD1-CD2 4.03Å; L69-L104 HydrophobicContact CD1-CG 3.98Å; L69-L104 HydrophobicContact CD2-CD2 3.98Å; L69-L104 HydrophobicContact CD2-CG 4.26Å; L69-L104 HydrophobicContact CG-CD2 4.37Å; L91-L104 HydrophobicContact CD2-CD2 4.06Å; A95-L104 HydrophobicContact CB-CD1 3.7Å; V100-L104 HydrophobicContact CG1-CD1 3.99Å; V100-L104 HydrophobicContact CG1-CG 4.21Å; V100-L104 WeakPolarHBondContact O-CB 3.48Å; V100-L104 WeakPolarHBondContact O-CG 3.17Å; V100-L104 PolarHBondContact O-N 3.48Å; S101-L104 PolarHBondContact O-N 3.29Å; L104-K106 PolarHBondContact O-N 3.37Å; L104-E107 PolarHBondContact O-N 2.76Å; L104-F109 HydrophobicContact CB-CE1 3.89Å; L104-F109 HydrophobicContact CB-CZ 4.04Å; L104-F109 HydrophobicContact CD2-CD1 4.42Å; L104-F109 HydrophobicContact CD2-CE1 4.21Å; L104-F109 HydrophobicContact CD2-CZ 4.32Å; L104-F109 WeakPolarHBondContact O-CE1 3.38Å
105	K	86.1	Confident	90.5	Very high	47 Å²	47	49.7 Å²	49.7	20%	0.204	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-23.9	176.8	-62	174.8	-169.2	-175.6	0	114.5	S101 E102 A103 D139	S101-K105 WeakPolarHBondContact O-CG 3.29Å; S101-K105 PolarHBondContact O-N 3.32Å; E102-K105 WeakPolarHBondContact OE1-CE 3.42Å; E102-K105 IonicContact OE1-NZ 2.66Å; E102-K105 PolarHBondContact OE1-NZ 3.06Å; E102-K105 WeakPolarHBondContact OE2-CE 3.25Å; E102-K105 IonicContact OE2-NZ 3.58Å; E102-K105 PolarHBondContact OE2-NZ 2.97Å; A103-K105 PolarHBondContact O-N 3.16Å; K105-D139 HydrophobicContact CD-CB 4.25Å; K105-D139 WeakPolarHBondContact CE-OD2 3.11Å; K105-D139 IonicContact NZ-OD2 2.91Å; K105-D139 PolarHBondContact NZ-OD2 3.37Å
106	K	85.9	Confident	90.5	Very high	184 Å²	184	50.8 Å²	50.8	80%	0.8	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-12.9	-179.1	-61.6	177	-174.7	169.4	0	113.1	A103 L104	A103-K106 PolarHBondContact O-N 3.43Å; L104-K106 PolarHBondContact O-N 3.37Å
107	E	86.1	Confident	90.7	Very high	79 Å²	79	47.4 Å²	47.4	37%	0.369	25%	0.248	S	C	.	.	S	Bend	trans	-94	146.5	177.3	-60.6	-67.1	158.3	0	0	109.7	L104 F109	L104-E107 PolarHBondContact O-N 2.76Å; E107-F109 HydrophobicContact CB-CD1 4Å; E107-F109 WeakPolarHBondContact O-CD1 3.28Å; E107-F109 PolarHBondContact O-N 3.38Å
108	D	86.4	Confident	90.5	Very high	127 Å²	127	48.9 Å²	48.9	68%	0.679	26%	0.257	S	S	*	.			trans	-95.7	79.5	177.2	-172.7	23.6	0	0	0	110.3
109	F	89.4	Confident	90.3	Very high	3 Å²	3	50 Å²	50	1%	0.013	26%	0.255	C	S	.	.			trans	-121.7	-15.7	-172.6	73.5	-78.5	0	0	0	114.1	C73 L104 E107 S112 L113 V136	C73-F109 HydrophobicContact CB-CB 4.17Å; L104-F109 HydrophobicContact CB-CE1 3.89Å; L104-F109 HydrophobicContact CB-CZ 4.04Å; L104-F109 HydrophobicContact CD2-CD1 4.42Å; L104-F109 HydrophobicContact CD2-CE1 4.21Å; L104-F109 HydrophobicContact CD2-CZ 4.32Å; L104-F109 WeakPolarHBondContact O-CE1 3.38Å; E107-F109 HydrophobicContact CB-CD1 4Å; E107-F109 WeakPolarHBondContact O-CD1 3.28Å; E107-F109 PolarHBondContact O-N 3.38Å; F109-S112 PolarHBondContact O-N 3.27Å; F109-L113 HydrophobicContact CD2-CD1 3.47Å; F109-L113 VanDerWaalsContact CD2-CD1 3.47Å; F109-L113 HydrophobicContact CD2-CG 3.94Å; F109-L113 HydrophobicContact CE2-CD1 3.44Å; F109-L113 VanDerWaalsContact CE2-CD1 3.44Å; F109-L113 HydrophobicContact CE2-CG 4.4Å; F109-L113 PolarHBondContact O-N 3.09Å; F109-L113 VanDerWaalsContact O-N 3.07Å; F109-V136 HydrophobicContact CZ-CG1 3.99Å; F109-V136 HydrophobicContact CZ-CG2 4.28Å
110	I	93.2	Very high	90	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-45.9	-179.6	-65.3	-177.5	0	0	0	112	S112 L113 L114 L133 V136 C142 Q145 I146	I110-S112 VanDerWaalsContact C-N 3.3Å; I110-S112 PolarHBondContact O-N 3.4Å; I110-L113 PolarHBondContact O-N 3.47Å; I110-L113 VanDerWaalsContact O-N 3.15Å; I110-L114 HydrophobicContact CG2-CD1 4.01Å; I110-L114 HydrophobicContact CG2-CG 4.3Å; I110-L114 WeakPolarHBondContact O-CG 3.37Å; I110-L114 PolarHBondContact O-N 3.46Å; I110-L133 HydrophobicContact CG2-CD2 4.16Å; I110-V136 HydrophobicContact CD1-CG2 4.43Å; I110-C142 HydrophobicContact CD1-CB 3.85Å; I110-Q145 HydrophobicContact CD1-CB 3.97Å; I110-I146 HydrophobicContact CD1-CG1 4.27Å; I110-I146 HydrophobicContact CG2-CG1 3.68Å
111	P	93	Very high	89.9	Confident	29 Å²	29	53.8 Å²	53.8	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-40.1	177.8	-23.2	33.8	0	0	0	112.7	L114 Q115	P111-L114 PolarHBondContact O-N 3.08Å; P111-Q115 WeakPolarHBondContact O-CG 3.33Å; P111-Q115 PolarHBondContact O-N 3.42Å; P111-Q115 VanDerWaalsContact O-N 3.13Å
112	S	92.3	Very high	89.8	Confident	23 Å²	23	56.7 Å²	56.7	16%	0.161	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-39.1	176.7	-70.3	0	0	0	0	112	D77 F109 I110 K116	D77-S112 WeakPolarHBondContact OD2-CB 3.4Å; D77-S112 PolarHBondContact OD2-OG 3.08Å; F109-S112 PolarHBondContact O-N 3.27Å; I110-S112 VanDerWaalsContact C-N 3.3Å; I110-S112 PolarHBondContact O-N 3.4Å; S112-K116 WeakPolarHBondContact O-CG 3.27Å
113	L	93.7	Very high	89.9	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.3	-44.3	175.8	-70.9	-176.4	0	0	0	112.4	I76 L88 F109 I110 Q115 K116 A129 C132 L133	I76-L113 HydrophobicContact CD1-CD2 3.88Å; I76-L113 HydrophobicContact CD1-CG 4.39Å; I76-L113 HydrophobicContact CG2-CD2 4.3Å; L88-L113 HydrophobicContact CD2-CD2 3.32Å; F109-L113 HydrophobicContact CD2-CD1 3.47Å; F109-L113 VanDerWaalsContact CD2-CD1 3.47Å; F109-L113 HydrophobicContact CD2-CG 3.94Å; F109-L113 HydrophobicContact CE2-CD1 3.44Å; F109-L113 VanDerWaalsContact CE2-CD1 3.44Å; F109-L113 HydrophobicContact CE2-CG 4.4Å; F109-L113 PolarHBondContact O-N 3.09Å; F109-L113 VanDerWaalsContact O-N 3.07Å; I110-L113 PolarHBondContact O-N 3.47Å; I110-L113 VanDerWaalsContact O-N 3.15Å; L113-Q115 VanDerWaalsContact C-N 3.28Å; L113-Q115 PolarHBondContact O-N 3.35Å; L113-K116 WeakPolarHBondContact O-CA 3.44Å; L113-K116 WeakPolarHBondContact O-CB 3.45Å; L113-K116 PolarHBondContact O-N 2.97Å; L113-A129 HydrophobicContact CD2-CB 4.25Å; L113-C132 HydrophobicContact CD1-CB 3.92Å; L113-L133 HydrophobicContact CB-CD1 4.2Å; L113-L133 HydrophobicContact CB-CD2 4.14Å; L113-L133 HydrophobicContact CB-CG 4.16Å; L113-L133 HydrophobicContact CD1-CD2 3.95Å; L113-L133 HydrophobicContact CD1-CG 3.94Å
114	L	94.3	Very high	89.8	Confident	14 Å²	14	55.8 Å²	55.8	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-37.1	178.8	-68	176.2	0	0	0	111.9	I110 P111 K116 L117 L133 I146 N149	I110-L114 HydrophobicContact CG2-CD1 4.01Å; I110-L114 HydrophobicContact CG2-CG 4.3Å; I110-L114 WeakPolarHBondContact O-CG 3.37Å; I110-L114 PolarHBondContact O-N 3.46Å; P111-L114 PolarHBondContact O-N 3.08Å; L114-K116 PolarHBondContact O-N 2.77Å; L114-K116 VanDerWaalsContact O-N 3.16Å; L114-L117 HydrophobicContact CD2-CD1 3.87Å; L114-L117 WeakPolarHBondContact O-CB 3.14Å; L114-L117 PolarHBondContact O-N 3.33Å; L114-L117 VanDerWaalsContact O-N 3.07Å; L114-L133 HydrophobicContact CD2-CD1 3.82Å; L114-I146 HydrophobicContact CD2-CG2 4.45Å; L114-N149 HydrophobicContact CD1-CB 3.56Å
115	Q	92.1	Very high	89.9	Confident	122 Å²	122	55.9 Å²	55.9	57%	0.57	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.1	172.7	-72.4	177.9	26.1	0	0	114.1	P111 L113 T118	P111-Q115 WeakPolarHBondContact O-CG 3.33Å; P111-Q115 PolarHBondContact O-N 3.42Å; P111-Q115 VanDerWaalsContact O-N 3.13Å; L113-Q115 VanDerWaalsContact C-N 3.28Å; L113-Q115 PolarHBondContact O-N 3.35Å; Q115-T118 WeakPolarHBondContact O-CG2 3.43Å
116	K	93	Very high	90.3	Very high	23 Å²	23	54.2 Å²	54.2	10%	0.1	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-3.3	175	-54.9	-45.1	169.3	-148.7	0	113.6	I76 D77 K84 S112 L113 L114 T118 E121 V125 H126	I76-K116 HydrophobicContact CG2-CG 4.1Å; I76-K116 WeakPolarHBondContact O-CE 3.34Å; D77-K116 WeakPolarHBondContact OD1-CE 3.39Å; D77-K116 IonicContact OD1-NZ 2.8Å; D77-K116 PolarHBondContact OD1-NZ 2.6Å; K84-K116 HydrophobicContact CD-CD 4.39Å; S112-K116 WeakPolarHBondContact O-CG 3.27Å; L113-K116 WeakPolarHBondContact O-CA 3.44Å; L113-K116 WeakPolarHBondContact O-CB 3.45Å; L113-K116 PolarHBondContact O-N 2.97Å; L114-K116 PolarHBondContact O-N 2.77Å; L114-K116 VanDerWaalsContact O-N 3.16Å; K116-T118 PolarHBondContact O-N 2.72Å; K116-E121 WeakPolarHBondContact O-CB 3.09Å; K116-V125 HydrophobicContact CB-CG1 3.71Å; K116-V125 HydrophobicContact CG-CG1 4.41Å; K116-H126 PolarHBondContact O-CD2 2.87Å; K116-H126 VanDerWaalsContact O-CD2 3.24Å
117	L	93.6	Very high	90.7	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	25%	0.246	C	C	.	.			trans	-86.2	13.1	176.6	-55.3	-174	0	0	0	113	L114 A129 T130 L133 P154 L155 L158	L114-L117 HydrophobicContact CD2-CD1 3.87Å; L114-L117 WeakPolarHBondContact O-CB 3.14Å; L114-L117 PolarHBondContact O-N 3.33Å; L114-L117 VanDerWaalsContact O-N 3.07Å; L117-A129 HydrophobicContact CD2-CB 3.82Å; L117-T130 HydrophobicContact CD2-CG2 3.72Å; L117-L133 HydrophobicContact CD1-CD1 3.83Å; L117-P154 HydrophobicContact CB-CB 3.78Å; L117-P154 HydrophobicContact CB-CG 4.44Å; L117-P154 HydrophobicContact CD1-CB 4.43Å; L117-P154 HydrophobicContact CD1-CG 4.46Å; L117-L155 HydrophobicContact CD1-CD2 3.88Å; L117-L155 HydrophobicContact CD1-CG 4.35Å; L117-L158 HydrophobicContact CB-CD1 4Å; L117-L158 HydrophobicContact CD1-CD1 4.39Å; L117-L158 HydrophobicContact CD2-CD1 3.92Å; L117-L158 HydrophobicContact CG-CD1 4.32Å
118	T	89.8	Confident	91.1	Very high	53 Å²	53	44.4 Å²	44.4	33%	0.325	23%	0.232	S	C	.	.	S	Bend	trans	-74.7	150	177.7	77.9	0	0	0	0	110.5	Q115 K116 E120 E121 H126	Q115-T118 WeakPolarHBondContact O-CG2 3.43Å; K116-T118 PolarHBondContact O-N 2.72Å; T118-E120 WeakPolarHBondContact CB-OE2 3.38Å; T118-E120 PolarHBondContact O-N 3.24Å; T118-E120 VanDerWaalsContact O-N 3.09Å; T118-E120 PolarHBondContact OG1-OE2 3.03Å; T118-E121 PolarHBondContact O-N 3.47Å; T118-E121 VanDerWaalsContact O-N 3.16Å; T118-H126 PolarHBondContact O-CE1 3.46Å; T118-H126 PolarHBondContact O-NE2 3.47Å
119	P	83.9	Confident	91.5	Very high	74 Å²	74	38.4 Å²	38.4	48%	0.481	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.8	-175.6	29.6	-38.7	0	0	0	114.2
120	E	85.6	Confident	91.8	Very high	153 Å²	153	38.2 Å²	38.2	72%	0.715	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-20.3	177	-56.3	76.1	-162.3	0	0	113.3	T118	T118-E120 WeakPolarHBondContact CB-OE2 3.38Å; T118-E120 PolarHBondContact O-N 3.24Å; T118-E120 VanDerWaalsContact O-N 3.09Å; T118-E120 PolarHBondContact OG1-OE2 3.03Å
121	E	89.3	Confident	92	Very high	46 Å²	46	39.7 Å²	39.7	22%	0.215	21%	0.207	C	C	.	.	S	Bend	trans	-76.4	157.9	174.5	-72	-74.4	-174.9	0	0	110.7	K84 K116 T118 V125 H126	K84-E121 IonicContact NZ-OE1 2.62Å; K84-E121 PolarHBondContact NZ-OE1 2.8Å; K84-E121 IonicContact NZ-OE2 3.64Å; K84-E121 PolarHBondContact NZ-OE2 2.92Å; K116-E121 WeakPolarHBondContact O-CB 3.09Å; T118-E121 PolarHBondContact O-N 3.47Å; T118-E121 VanDerWaalsContact O-N 3.16Å; E121-V125 HydrophobicContact CB-CB 4.29Å; E121-V125 HydrophobicContact CB-CG1 4.02Å; E121-V125 HydrophobicContact CG-CG1 4.28Å; E121-H126 PolarHBondContact O-CE1 3.21Å; E121-H126 VanDerWaalsContact O-CE1 3.26Å
122	D	88.6	Confident	92	Very high	75 Å²	75	38.4 Å²	38.4	40%	0.401	20%	0.198	S	C	.	.			trans	-77.4	149.3	-176.9	-178.5	-90.8	0	0	0	111.3	R85 F124 V125 H126	R85-D122 IonicContact CZ-OD1 3.87Å; R85-D122 IonicContact NH2-OD1 3.49Å; R85-D122 PolarHBondContact NH2-OD1 3.07Å; R85-D122 IonicContact NH2-OD2 3.88Å; R85-D122 PolarHBondContact NH2-OD2 3.15Å; D122-F124 PolarHBondContact O-N 2.73Å; D122-F124 VanDerWaalsContact O-N 3.08Å; D122-F124 WeakPolarHBondContact OD1-CB 3.45Å; D122-F124 PolarHBondContact OD1-N 2.68Å; D122-V125 WeakPolarHBondContact O-CA 3.06Å; D122-V125 VanDerWaalsContact O-CB 3.27Å; D122-V125 WeakPolarHBondContact O-CB 3.35Å; D122-V125 PolarHBondContact O-N 3.47Å; D122-H126 PolarHBondContact O-N 2.94Å
123	V	90.8	Very high	92.2	Very high	53 Å²	53	37.3 Å²	37.3	32%	0.321	19%	0.191	S	C	.	.	H	α-helix	trans	-51	-37.4	-179.9	176.6	0	0	0	0	112.4	V125 H126 E127 D163 V166	V123-V125 VanDerWaalsContact C-N 3.31Å; V123-V125 PolarHBondContact O-N 3.22Å; V123-H126 WeakPolarHBondContact O-CB 3.44Å; V123-H126 PolarHBondContact O-N 3.39Å; V123-H126 VanDerWaalsContact O-N 3.13Å; V123-E127 PolarHBondContact O-N 3Å; V123-D163 HydrophobicContact CG1-CB 3.35Å; V123-V166 HydrophobicContact CG1-CG2 4.08Å
124	F	89.6	Confident	92.3	Very high	60 Å²	60	37.4 Å²	37.4	26%	0.263	19%	0.191	S	C	.	.	H	α-helix	trans	-63	-37.3	176.3	-171.3	-84.6	0	0	0	112.5	R85 M89 D122 H126 E127 F128	R85-F124 HydrophobicContact CB-CD1 4.22Å; R85-F124 HydrophobicContact CB-CE1 4.04Å; R85-F124 HydrophobicContact CG-CD1 3.84Å; R85-F124 HydrophobicContact CG-CE1 4.18Å; M89-F124 HydrophobicContact CB-CE1 4.28Å; M89-F124 HydrophobicContact CB-CZ 4.37Å; M89-F124 HydrophobicContact CE-CE1 4.38Å; M89-F124 HydrophobicContact CE-CZ 3.84Å; M89-F124 HydrophobicContact SD-CE1 4.47Å; M89-F124 HydrophobicContact SD-CZ 3.67Å; D122-F124 PolarHBondContact O-N 2.73Å; D122-F124 VanDerWaalsContact O-N 3.08Å; D122-F124 WeakPolarHBondContact OD1-CB 3.45Å; D122-F124 PolarHBondContact OD1-N 2.68Å; F124-H126 VanDerWaalsContact C-N 3.32Å; F124-E127 PolarHBondContact O-N 2.71Å; F124-F128 AromaticContact CD1-CD2 3.83Å; F124-F128 HydrophobicContact CD1-CD2 3.83Å; F124-F128 HydrophobicContact CD1-CE2 4.07Å; F124-F128 HydrophobicContact CD2-CD2 4.38Å; F124-F128 AromaticContact CD2-CE2 3.87Å; F124-F128 HydrophobicContact CD2-CE2 3.87Å; F124-F128 AromaticContact CE1-CD2 3.52Å; F124-F128 HydrophobicContact CE1-CD2 3.52Å; F124-F128 AromaticContact CE1-CE2 3.59Å; F124-F128 HydrophobicContact CE1-CE2 3.59Å; F124-F128 HydrophobicContact CE2-CD2 4.13Å; F124-F128 AromaticContact CE2-CE2 3.38Å; F124-F128 HydrophobicContact CE2-CE2 3.38Å; F124-F128 HydrophobicContact CE2-CZ 4.27Å; F124-F128 HydrophobicContact CG-CD2 4.26Å; F124-F128 HydrophobicContact CG-CE2 4.21Å; F124-F128 AromaticContact CZ-CD2 3.7Å; F124-F128 HydrophobicContact CZ-CD2 3.7Å; F124-F128 AromaticContact CZ-CE2 3.22Å; F124-F128 HydrophobicContact CZ-CE2 3.22Å; F124-F128 HydrophobicContact CZ-CZ 4.11Å; F124-F128 WeakPolarHBondContact O-CD2 3.31Å; F124-F128 PolarHBondContact O-N 3.47Å
125	V	91.8	Very high	92.2	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-40.9	175.4	168.7	0	0	0	0	109.7	R85 L88 K116 E121 D122 V123 A129	R85-V125 HydrophobicContact CG-CG2 4.09Å; L88-V125 HydrophobicContact CD1-CB 4.31Å; L88-V125 HydrophobicContact CD1-CG1 3.69Å; L88-V125 HydrophobicContact CD1-CG2 4.3Å; K116-V125 HydrophobicContact CB-CG1 3.71Å; K116-V125 HydrophobicContact CG-CG1 4.41Å; E121-V125 HydrophobicContact CB-CB 4.29Å; E121-V125 HydrophobicContact CB-CG1 4.02Å; E121-V125 HydrophobicContact CG-CG1 4.28Å; D122-V125 WeakPolarHBondContact O-CA 3.06Å; D122-V125 VanDerWaalsContact O-CB 3.27Å; D122-V125 WeakPolarHBondContact O-CB 3.35Å; D122-V125 PolarHBondContact O-N 3.47Å; V123-V125 VanDerWaalsContact C-N 3.31Å; V123-V125 PolarHBondContact O-N 3.22Å; V125-A129 WeakPolarHBondContact O-CB 3.44Å; V125-A129 PolarHBondContact O-N 3.39Å
126	H	94.3	Very high	92.3	Very high	11 Å²	11	31.7 Å²	31.7	5%	0.051	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-44.4	175.4	-56.7	152.2	0	0	0	111.9	K116 T118 E121 D122 V123 F124 F128 A129 T130 L158 V166	K116-H126 PolarHBondContact O-CD2 2.87Å; K116-H126 VanDerWaalsContact O-CD2 3.24Å; T118-H126 PolarHBondContact O-CE1 3.46Å; T118-H126 PolarHBondContact O-NE2 3.47Å; E121-H126 PolarHBondContact O-CE1 3.21Å; E121-H126 VanDerWaalsContact O-CE1 3.26Å; D122-H126 PolarHBondContact O-N 2.94Å; V123-H126 WeakPolarHBondContact O-CB 3.44Å; V123-H126 PolarHBondContact O-N 3.39Å; V123-H126 VanDerWaalsContact O-N 3.13Å; F124-H126 VanDerWaalsContact C-N 3.32Å; H126-F128 PolarHBondContact O-N 3.37Å; H126-A129 PolarHBondContact O-N 3.42Å; H126-T130 VanDerWaalsContact O-CB 3.3Å; H126-T130 WeakPolarHBondContact O-CB 3.5Å; H126-T130 VanDerWaalsContact O-CG2 3.26Å; H126-T130 WeakPolarHBondContact O-CG2 3.45Å; H126-T130 PolarHBondContact O-N 3.48Å; H126-T130 PolarHBondContact O-OG1 3.4Å; H126-L158 HydrophobicContact CB-CD1 4.47Å; H126-L158 HydrophobicContact CB-CD2 4.33Å; H126-V166 HydrophobicContact CB-CG1 3.95Å; H126-V166 HydrophobicContact CB-CG2 3.91Å
127	E	94.3	Very high	92.3	Very high	43 Å²	43	30.6 Å²	30.6	20%	0.201	16%	0.162	C	C	.	.	H	α-helix	trans	-56.1	-55.2	-177.7	-175.1	-166.5	155.6	0	0	111.1	V123 F124 T130 L131 D165 V166 N169	V123-E127 PolarHBondContact O-N 3Å; F124-E127 PolarHBondContact O-N 2.71Å; E127-T130 PolarHBondContact O-OG1 2.86Å; E127-L131 VanDerWaalsContact O-CB 3.28Å; E127-L131 WeakPolarHBondContact O-CB 3.34Å; E127-L131 PolarHBondContact O-N 3.24Å; E127-D165 HydrophobicContact CG-CB 4Å; E127-V166 HydrophobicContact CB-CG2 3.89Å; E127-N169 PolarHBondContact O-ND2 3.13Å
128	F	94.2	Very high	92.2	Very high	15 Å²	15	37.3 Å²	37.3	7%	0.066	20%	0.195	C	C	.	.	H	α-helix	trans	-79	-28.7	-176	-68.8	-74.9	0	0	0	113.6	L88 M89 F124 H126 L131 C132	L88-F128 HydrophobicContact CB-CB 4.18Å; M89-F128 HydrophobicContact CB-CD1 4.06Å; M89-F128 HydrophobicContact CB-CD2 4.11Å; M89-F128 HydrophobicContact CB-CE1 4.23Å; M89-F128 HydrophobicContact CB-CE2 4.33Å; M89-F128 HydrophobicContact CB-CG 3.99Å; M89-F128 HydrophobicContact CB-CZ 4.38Å; M89-F128 HydrophobicContact CG-CD1 4.06Å; M89-F128 HydrophobicContact CG-CD2 4.47Å; M89-F128 HydrophobicContact CG-CE1 3.75Å; M89-F128 HydrophobicContact CG-CE2 4.24Å; M89-F128 HydrophobicContact CG-CG 4.41Å; M89-F128 HydrophobicContact CG-CZ 3.85Å; M89-F128 HydrophobicContact SD-CE1 4.47Å; M89-F128 HydrophobicContact SD-CE2 4.3Å; M89-F128 HydrophobicContact SD-CZ 4.01Å; F124-F128 AromaticContact CD1-CD2 3.83Å; F124-F128 HydrophobicContact CD1-CD2 3.83Å; F124-F128 HydrophobicContact CD1-CE2 4.07Å; F124-F128 HydrophobicContact CD2-CD2 4.38Å; F124-F128 AromaticContact CD2-CE2 3.87Å; F124-F128 HydrophobicContact CD2-CE2 3.87Å; F124-F128 AromaticContact CE1-CD2 3.52Å; F124-F128 HydrophobicContact CE1-CD2 3.52Å; F124-F128 AromaticContact CE1-CE2 3.59Å; F124-F128 HydrophobicContact CE1-CE2 3.59Å; F124-F128 HydrophobicContact CE2-CD2 4.13Å; F124-F128 AromaticContact CE2-CE2 3.38Å; F124-F128 HydrophobicContact CE2-CE2 3.38Å; F124-F128 HydrophobicContact CE2-CZ 4.27Å; F124-F128 HydrophobicContact CG-CD2 4.26Å; F124-F128 HydrophobicContact CG-CE2 4.21Å; F124-F128 AromaticContact CZ-CD2 3.7Å; F124-F128 HydrophobicContact CZ-CD2 3.7Å; F124-F128 AromaticContact CZ-CE2 3.22Å; F124-F128 HydrophobicContact CZ-CE2 3.22Å; F124-F128 HydrophobicContact CZ-CZ 4.11Å; F124-F128 WeakPolarHBondContact O-CD2 3.31Å; F124-F128 PolarHBondContact O-N 3.47Å; H126-F128 PolarHBondContact O-N 3.37Å; F128-L131 HydrophobicContact CD1-CD2 4.03Å; F128-L131 HydrophobicContact CE1-CD2 4.33Å; F128-C132 WeakPolarHBondContact O-CB 3.35Å; F128-C132 PolarHBondContact O-N 2.69Å; F128-C132 VanDerWaalsContact O-N 3.09Å
129	A	95.2	Very high	92.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-46.2	171.9	0	0	0	0	0	110.9	L88 L113 L117 V125 H126 C132 L133	L88-A129 HydrophobicContact CD2-CB 4.24Å; L113-A129 HydrophobicContact CD2-CB 4.25Å; L117-A129 HydrophobicContact CD2-CB 3.82Å; V125-A129 WeakPolarHBondContact O-CB 3.44Å; V125-A129 PolarHBondContact O-N 3.39Å; H126-A129 PolarHBondContact O-N 3.42Å; A129-C132 PolarHBondContact O-N 2.89Å; A129-L133 WeakPolarHBondContact O-CG 3.3Å; A129-L133 PolarHBondContact O-N 3.4Å
130	T	96.3	Very high	92.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.5	-36.7	176	56.8	0	0	0	0	111.9	L117 H126 E127 C132 L133 A134 L155 L158 N169 I173	L117-T130 HydrophobicContact CD2-CG2 3.72Å; H126-T130 VanDerWaalsContact O-CB 3.3Å; H126-T130 WeakPolarHBondContact O-CB 3.5Å; H126-T130 VanDerWaalsContact O-CG2 3.26Å; H126-T130 WeakPolarHBondContact O-CG2 3.45Å; H126-T130 PolarHBondContact O-N 3.48Å; H126-T130 PolarHBondContact O-OG1 3.4Å; E127-T130 PolarHBondContact O-OG1 2.86Å; T130-C132 VanDerWaalsContact C-N 3.32Å; T130-C132 PolarHBondContact O-N 3.13Å; T130-L133 PolarHBondContact O-N 2.8Å; T130-A134 WeakPolarHBondContact O-CB 3.39Å; T130-A134 PolarHBondContact O-N 3.28Å; T130-L155 HydrophobicContact CG2-CD2 4.39Å; T130-L158 HydrophobicContact CG2-CD1 3.98Å; T130-N169 WeakPolarHBondContact OG1-CB 3.33Å; T130-I173 HydrophobicContact CG2-CD1 4.35Å
131	L	95.8	Very high	92.8	Very high	32 Å²	32	35.8 Å²	35.8	17%	0.168	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-44.8	174	-178.5	62.9	0	0	0	111.8	T96 E127 F128 A135	T96-L131 HydrophobicContact CG2-CD1 4.22Å; T96-L131 HydrophobicContact CG2-CG 4.48Å; E127-L131 VanDerWaalsContact O-CB 3.28Å; E127-L131 WeakPolarHBondContact O-CB 3.34Å; E127-L131 PolarHBondContact O-N 3.24Å; F128-L131 HydrophobicContact CD1-CD2 4.03Å; F128-L131 HydrophobicContact CE1-CD2 4.33Å; L131-A135 PolarHBondContact O-N 2.98Å
132	C	94.7	Very high	93	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-64.4	-46.1	176.7	-166.5	0	0	0	0	111.4	L113 F128 A129 T130 A134 A135 V136	L113-C132 HydrophobicContact CD1-CB 3.92Å; F128-C132 WeakPolarHBondContact O-CB 3.35Å; F128-C132 PolarHBondContact O-N 2.69Å; F128-C132 VanDerWaalsContact O-N 3.09Å; A129-C132 PolarHBondContact O-N 2.89Å; T130-C132 VanDerWaalsContact C-N 3.32Å; T130-C132 PolarHBondContact O-N 3.13Å; C132-A134 PolarHBondContact O-N 3.06Å; C132-A135 PolarHBondContact O-N 3Å; C132-V136 PolarHBondContact O-N 3.03Å
133	L	95.8	Very high	93.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-40.1	178.4	-73.5	170.7	0	0	0	112.5	I110 L113 L114 L117 A129 T130 A135 V136 A137 I146 I173	I110-L133 HydrophobicContact CG2-CD2 4.16Å; L113-L133 HydrophobicContact CB-CD1 4.2Å; L113-L133 HydrophobicContact CB-CD2 4.14Å; L113-L133 HydrophobicContact CB-CG 4.16Å; L113-L133 HydrophobicContact CD1-CD2 3.95Å; L113-L133 HydrophobicContact CD1-CG 3.94Å; L114-L133 HydrophobicContact CD2-CD1 3.82Å; L117-L133 HydrophobicContact CD1-CD1 3.83Å; A129-L133 WeakPolarHBondContact O-CG 3.3Å; A129-L133 PolarHBondContact O-N 3.4Å; T130-L133 PolarHBondContact O-N 2.8Å; L133-A135 VanDerWaalsContact C-N 3.34Å; L133-A135 PolarHBondContact O-N 3.12Å; L133-V136 WeakPolarHBondContact O-CG2 3.18Å; L133-V136 PolarHBondContact O-N 2.86Å; L133-A137 WeakPolarHBondContact O-CB 3.02Å; L133-A137 PolarHBondContact O-N 2.83Å; L133-I146 HydrophobicContact CD2-CD1 4.28Å; L133-I146 HydrophobicContact CD2-CG1 4.3Å; L133-I173 HydrophobicContact CB-CD1 3.59Å; L133-I173 HydrophobicContact CB-CG1 4.14Å
134	A	95.4	Very high	93.2	Very high	2 Å²	2	32.5 Å²	32.5	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-59.9	-45.4	177.7	0	0	0	0	0	111.3	T130 C132 V136 A137 E172 I173	T130-A134 WeakPolarHBondContact O-CB 3.39Å; T130-A134 PolarHBondContact O-N 3.28Å; C132-A134 PolarHBondContact O-N 3.06Å; A134-V136 VanDerWaalsContact C-N 3.35Å; A134-V136 PolarHBondContact O-N 3.27Å; A134-A137 PolarHBondContact O-N 3.38Å; A134-E172 HydrophobicContact CB-CB 4.35Å; A134-E172 HydrophobicContact CB-CG 4.27Å; A134-I173 VanDerWaalsContact CA-CG1 3.47Å; A134-I173 HydrophobicContact CB-CD1 4.44Å; A134-I173 HydrophobicContact CB-CG1 3.81Å
135	A	93.4	Very high	93.3	Very high	16 Å²	16	32.4 Å²	32.4	13%	0.132	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-34.8	179.8	0	0	0	0	0	113.4	A95 S101 L131 C132 L133	A95-A135 HydrophobicContact CB-CB 3.92Å; A95-A135 WeakPolarHBondContact O-CB 3.41Å; S101-A135 PolarHBondContact OG-O 2.84Å; L131-A135 PolarHBondContact O-N 2.98Å; C132-A135 PolarHBondContact O-N 3Å; L133-A135 VanDerWaalsContact C-N 3.34Å; L133-A135 PolarHBondContact O-N 3.12Å
136	V	93.1	Very high	93.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-88	-22.7	178.1	-58.2	0	0	0	0	113.4	F109 I110 C132 L133 A134 M138 D139 C142	F109-V136 HydrophobicContact CZ-CG1 3.99Å; F109-V136 HydrophobicContact CZ-CG2 4.28Å; I110-V136 HydrophobicContact CD1-CG2 4.43Å; C132-V136 PolarHBondContact O-N 3.03Å; L133-V136 WeakPolarHBondContact O-CG2 3.18Å; L133-V136 PolarHBondContact O-N 2.86Å; A134-V136 VanDerWaalsContact C-N 3.35Å; A134-V136 PolarHBondContact O-N 3.27Å; V136-M138 PolarHBondContact O-N 3.47Å; V136-M138 VanDerWaalsContact O-N 3.12Å; V136-D139 WeakPolarHBondContact O-CB 3.35Å; V136-D139 PolarHBondContact O-N 3.26Å; V136-C142 HydrophobicContact CB-CB 4.21Å; V136-C142 HydrophobicContact CG2-CB 4.31Å; V136-C142 WeakPolarHBondContact O-CB 3.5Å
137	A	93.6	Very high	93.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.7	176.6	0	0	0	0	0	113.5	L133 A134 D139 R143 I146 I173 N176	L133-A137 WeakPolarHBondContact O-CB 3.02Å; L133-A137 PolarHBondContact O-N 2.83Å; A134-A137 PolarHBondContact O-N 3.38Å; A137-D139 PolarHBondContact O-N 3.24Å; A137-R143 WeakPolarHBondContact O-CD 3.18Å; A137-R143 WeakPolarHBondContact O-CG 3.17Å; A137-I146 HydrophobicContact CB-CD1 4.02Å; A137-I173 HydrophobicContact CB-CG2 4.22Å; A137-N176 HydrophobicContact CB-CB 4.07Å
138	M	90.3	Very high	93	Very high	146 Å²	146	35.5 Å²	35.5	72%	0.719	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.6	168.4	-61.3	-175	72.4	0	0	112.8	V136	V136-M138 PolarHBondContact O-N 3.47Å; V136-M138 VanDerWaalsContact O-N 3.12Å
139	D	91.1	Very high	92.8	Very high	36 Å²	36	38.1 Å²	38.1	19%	0.193	21%	0.21	C	C	.	.	S	Bend	trans	-91.4	134.6	178.4	-175.6	-92.9	0	0	0	112.4	K105 V136 A137 T141 C142 R143	K105-D139 HydrophobicContact CD-CB 4.25Å; K105-D139 WeakPolarHBondContact CE-OD2 3.11Å; K105-D139 IonicContact NZ-OD2 2.91Å; K105-D139 PolarHBondContact NZ-OD2 3.37Å; V136-D139 WeakPolarHBondContact O-CB 3.35Å; V136-D139 PolarHBondContact O-N 3.26Å; A137-D139 PolarHBondContact O-N 3.24Å; D139-T141 VanDerWaalsContact C-N 3.32Å; D139-T141 PolarHBondContact O-N 3.18Å; D139-T141 WeakPolarHBondContact OD1-CA 3.44Å; D139-T141 WeakPolarHBondContact OD1-CB 3.27Å; D139-T141 PolarHBondContact OD1-N 3.18Å; D139-T141 PolarHBondContact OD1-OG1 3.05Å; D139-T141 VanDerWaalsContact OD1-OG1 3.08Å; D139-C142 HydrophobicContact CB-CB 4.31Å; D139-C142 PolarHBondContact O-N 3.08Å; D139-C142 PolarHBondContact OD1-N 3.17Å; D139-R143 WeakPolarHBondContact O-CG 3.26Å; D139-R143 PolarHBondContact O-N 2.78Å
140	F	90.4	Very high	92.6	Very high	129 Å²	129	44.2 Å²	44.2	57%	0.566	24%	0.243	S	C	*	.	H	α-helix	trans	-55.1	-42.7	179.2	178.3	-91.8	0	0	0	113.5	R143 V144	F140-R143 PolarHBondContact O-N 3.39Å; F140-V144 HydrophobicContact CD1-CG2 4.39Å; F140-V144 HydrophobicContact CE1-CG2 3.9Å; F140-V144 HydrophobicContact CZ-CG2 3.95Å; F140-V144 WeakPolarHBondContact O-CG2 3.37Å; F140-V144 PolarHBondContact O-N 3.46Å
141	T	91.1	Very high	92.4	Very high	84 Å²	84	44.2 Å²	44.2	52%	0.515	24%	0.243	S	C	.	.	H	α-helix	trans	-66.8	-42.6	-177.1	-42	0	0	0	0	111.2	D139 V144 Q145	D139-T141 VanDerWaalsContact C-N 3.32Å; D139-T141 PolarHBondContact O-N 3.18Å; D139-T141 WeakPolarHBondContact OD1-CA 3.44Å; D139-T141 WeakPolarHBondContact OD1-CB 3.27Å; D139-T141 PolarHBondContact OD1-N 3.18Å; D139-T141 PolarHBondContact OD1-OG1 3.05Å; D139-T141 VanDerWaalsContact OD1-OG1 3.08Å; T141-V144 PolarHBondContact O-N 2.86Å; T141-Q145 WeakPolarHBondContact O-CG 3.49Å; T141-Q145 PolarHBondContact O-N 3.37Å
142	C	92.8	Very high	92.3	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66.6	-38.2	177.9	-68	0	0	0	0	111.6	I110 V136 D139 V144 Q145 I146	I110-C142 HydrophobicContact CD1-CB 3.85Å; V136-C142 HydrophobicContact CB-CB 4.21Å; V136-C142 HydrophobicContact CG2-CB 4.31Å; V136-C142 WeakPolarHBondContact O-CB 3.5Å; D139-C142 HydrophobicContact CB-CB 4.31Å; D139-C142 PolarHBondContact O-N 3.08Å; D139-C142 PolarHBondContact OD1-N 3.17Å; C142-V144 PolarHBondContact O-N 3.21Å; C142-Q145 PolarHBondContact O-N 3Å; C142-I146 VanDerWaalsContact O-CG1 3.27Å; C142-I146 WeakPolarHBondContact O-CG1 3.44Å; C142-I146 PolarHBondContact O-N 3.43Å
143	R	92.6	Very high	92.3	Very high	32 Å²	32	45.8 Å²	45.8	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-47.2	173.1	-69.5	-170.8	-55.9	169.7	18.3	112.2	A137 D139 F140 Q145 I146 N147 N176 L177 D180	A137-R143 WeakPolarHBondContact O-CD 3.18Å; A137-R143 WeakPolarHBondContact O-CG 3.17Å; D139-R143 WeakPolarHBondContact O-CG 3.26Å; D139-R143 PolarHBondContact O-N 2.78Å; F140-R143 PolarHBondContact O-N 3.39Å; R143-Q145 VanDerWaalsContact C-N 3.3Å; R143-Q145 PolarHBondContact O-N 3.33Å; R143-I146 PolarHBondContact O-N 3.23Å; R143-N147 PolarHBondContact O-N 3.07Å; R143-N147 PolarHBondContact O-ND2 3.39Å; R143-N176 WeakPolarHBondContact CD-O 3.4Å; R143-N176 PolarHBondContact NH1-O 3.16Å; R143-L177 HydrophobicContact CB-CD2 3.65Å; R143-L177 HydrophobicContact CG-CD2 3.78Å; R143-D180 IonicContact CZ-OD1 3.79Å; R143-D180 IonicContact CZ-OD2 2.77Å; R143-D180 VanDerWaalsContact CZ-OD2 3.22Å; R143-D180 IonicContact NE-OD2 2.73Å; R143-D180 IonicContact NH1-OD1 2.92Å; R143-D180 IonicContact NH1-OD2 3.39Å; R143-D180 VanDerWaalsContact NH2-CG 3.27Å; R143-D180 IonicContact NH2-OD1 2.72Å; R143-D180 PolarHBondContact NH2-OD1 2.92Å; R143-D180 IonicContact NH2-OD2 2.6Å; R143-D180 PolarHBondContact NH2-OD2 3.36Å
144	V	90.8	Very high	92.2	Very high	72 Å²	72	47.3 Å²	47.3	44%	0.436	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-41.8	176	174.1	0	0	0	0	111.3	F140 T141 C142 N147 A148	F140-V144 HydrophobicContact CD1-CG2 4.39Å; F140-V144 HydrophobicContact CE1-CG2 3.9Å; F140-V144 HydrophobicContact CZ-CG2 3.95Å; F140-V144 WeakPolarHBondContact O-CG2 3.37Å; F140-V144 PolarHBondContact O-N 3.46Å; T141-V144 PolarHBondContact O-N 2.86Å; C142-V144 PolarHBondContact O-N 3.21Å; V144-N147 PolarHBondContact O-N 3.13Å; V144-A148 VanDerWaalsContact O-CB 3.31Å; V144-A148 WeakPolarHBondContact O-CB 3.5Å; V144-A148 PolarHBondContact O-N 2.75Å
145	Q	91.8	Very high	92.2	Very high	59 Å²	59	47.2 Å²	47.2	28%	0.276	26%	0.263	S	S	.	.	H	α-helix	trans	-65.9	-40.5	176.5	-74.3	-179.6	-25.8	0	0	112.8	I110 T141 C142 R143 N147 A148 N149	I110-Q145 HydrophobicContact CD1-CB 3.97Å; T141-Q145 WeakPolarHBondContact O-CG 3.49Å; T141-Q145 PolarHBondContact O-N 3.37Å; C142-Q145 PolarHBondContact O-N 3Å; R143-Q145 VanDerWaalsContact C-N 3.3Å; R143-Q145 PolarHBondContact O-N 3.33Å; Q145-N147 VanDerWaalsContact C-N 3.32Å; Q145-N147 PolarHBondContact O-N 3.19Å; Q145-A148 PolarHBondContact O-N 3.16Å; Q145-N149 PolarHBondContact O-N 2.78Å; Q145-N149 PolarHBondContact O-ND2 2.85Å
146	I	93.5	Very high	92.3	Very high	1 Å²	1	47 Å²	47	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-44.4	176.8	-68	164	0	0	0	110	I110 L114 L133 A137 C142 R143 N149 G151 L177	I110-I146 HydrophobicContact CD1-CG1 4.27Å; I110-I146 HydrophobicContact CG2-CG1 3.68Å; L114-I146 HydrophobicContact CD2-CG2 4.45Å; L133-I146 HydrophobicContact CD2-CD1 4.28Å; L133-I146 HydrophobicContact CD2-CG1 4.3Å; A137-I146 HydrophobicContact CB-CD1 4.02Å; C142-I146 VanDerWaalsContact O-CG1 3.27Å; C142-I146 WeakPolarHBondContact O-CG1 3.44Å; C142-I146 PolarHBondContact O-N 3.43Å; R143-I146 PolarHBondContact O-N 3.23Å; I146-N149 PolarHBondContact O-N 3.4Å; I146-G151 WeakPolarHBondContact O-CA 3.49Å; I146-G151 PolarHBondContact O-N 3.43Å; I146-L177 HydrophobicContact CB-CD2 4.37Å; I146-L177 HydrophobicContact CG2-CD1 3.88Å; I146-L177 HydrophobicContact CG2-CD2 4.39Å
147	N	90.2	Very high	92.3	Very high	41 Å²	41	53.3 Å²	53.3	22%	0.219	29%	0.287	C	S	.	.	H	α-helix	trans	-67.5	-43	178.3	-69.3	-23	0	0	0	112.7	R143 V144 Q145 N149 D150 N183	R143-N147 PolarHBondContact O-N 3.07Å; R143-N147 PolarHBondContact O-ND2 3.39Å; V144-N147 PolarHBondContact O-N 3.13Å; Q145-N147 VanDerWaalsContact C-N 3.32Å; Q145-N147 PolarHBondContact O-N 3.19Å; N147-N149 PolarHBondContact O-N 3.01Å; N147-N149 VanDerWaalsContact O-N 3.13Å; N147-D150 PolarHBondContact O-N 3.44Å; N147-D150 VanDerWaalsContact O-N 3.17Å; N147-N183 PolarHBondContact ND2-ND2 3.27Å; N147-N183 PolarHBondContact ND2-OD1 3.38Å
148	A	90.6	Very high	92.4	Very high	80 Å²	80	54 Å²	54	66%	0.661	29%	0.291	S	S	*	.	H	α-helix	trans	-64.2	-16.6	178.5	0	0	0	0	0	113.9	V144 Q145	V144-A148 VanDerWaalsContact O-CB 3.31Å; V144-A148 WeakPolarHBondContact O-CB 3.5Å; V144-A148 PolarHBondContact O-N 2.75Å; Q145-A148 PolarHBondContact O-N 3.16Å
149	N	91.3	Very high	92.7	Very high	69 Å²	69	47.2 Å²	47.2	37%	0.369	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	25.8	178.2	-71.9	-84.5	0	0	0	112.7	L114 Q145 I146 N147 G151	L114-N149 HydrophobicContact CD1-CB 3.56Å; Q145-N149 PolarHBondContact O-N 2.78Å; Q145-N149 PolarHBondContact O-ND2 2.85Å; I146-N149 PolarHBondContact O-N 3.4Å; N147-N149 PolarHBondContact O-N 3.01Å; N147-N149 VanDerWaalsContact O-N 3.13Å; N149-G151 VanDerWaalsContact C-N 3.28Å; N149-G151 PolarHBondContact O-N 3.14Å
150	D	90.9	Very high	92.8	Very high	129 Å²	129	50 Å²	50	69%	0.69	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	43.4	178.8	-62.3	-47.4	0	0	0	112.9	N147 M152 P153 P154	N147-D150 PolarHBondContact O-N 3.44Å; N147-D150 VanDerWaalsContact O-N 3.17Å; D150-M152 VanDerWaalsContact C-N 3.34Å; D150-M152 PolarHBondContact O-N 3.3Å; D150-P153 WeakPolarHBondContact O-CD 3.46Å; D150-P154 WeakPolarHBondContact O-CD 3.46Å
151	G	92.3	Very high	92.9	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.26	C	S	.	.			trans	-72.1	-21.7	-177	0	0	0	0	0	114.8	I146 N149 P154 L155	I146-G151 WeakPolarHBondContact O-CA 3.49Å; I146-G151 PolarHBondContact O-N 3.43Å; N149-G151 VanDerWaalsContact C-N 3.28Å; N149-G151 PolarHBondContact O-N 3.14Å; G151-P154 VanDerWaalsContact O-CD 3.27Å; G151-P154 WeakPolarHBondContact O-CD 3.15Å; G151-P154 VanDerWaalsContact O-CG 3.26Å; G151-P154 WeakPolarHBondContact O-CG 3.39Å; G151-L155 VanDerWaalsContact O-CD1 3.25Å; G151-L155 WeakPolarHBondContact O-CD1 3.28Å; G151-L155 WeakPolarHBondContact O-CG 3.46Å
152	M	92.9	Very high	92.9	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.03	27%	0.274	C	S	.	.	H	α-helix	trans	-67.9	-48.5	-175.5	-73.2	-82.5	72.2	0	0	115.3	D150 L155 I156 I174 L177 V186 L190	D150-M152 VanDerWaalsContact C-N 3.34Å; D150-M152 PolarHBondContact O-N 3.3Å; M152-L155 HydrophobicContact CE-CB 4.14Å; M152-L155 HydrophobicContact CE-CD1 3.5Å; M152-L155 HydrophobicContact CE-CG 4.46Å; M152-L155 PolarHBondContact O-N 3.14Å; M152-L155 VanDerWaalsContact O-N 3.15Å; M152-I156 PolarHBondContact O-N 3.34Å; M152-I174 HydrophobicContact CE-CB 4.4Å; M152-I174 HydrophobicContact CE-CG1 3.59Å; M152-L177 HydrophobicContact CE-CB 4.47Å; M152-L177 HydrophobicContact CE-CD1 3.22Å; M152-L177 HydrophobicContact CE-CG 4.44Å; M152-L177 HydrophobicContact SD-CB 4.34Å; M152-L177 HydrophobicContact SD-CD1 3.89Å; M152-V186 HydrophobicContact CB-CG1 4.12Å; M152-V186 HydrophobicContact CG-CG1 4.27Å; M152-L190 HydrophobicContact CB-CD1 3.81Å
153	P	94.3	Very high	92.9	Very high	60 Å²	60	48.6 Å²	48.6	39%	0.39	28%	0.283	S	S	.	.	H	α-helix	trans	-52.6	-48.3	178.8	-24.1	30.1	0	0	0	115.6	D150 L155 K157 L190	D150-P153 WeakPolarHBondContact O-CD 3.46Å; P153-L155 VanDerWaalsContact C-N 3.33Å; P153-L155 PolarHBondContact O-N 3.2Å; P153-K157 PolarHBondContact O-N 3.26Å; P153-L190 HydrophobicContact CB-CD1 4.4Å; P153-L190 HydrophobicContact CB-CD2 4.45Å; P153-L190 HydrophobicContact CG-CD1 3.74Å; P153-L190 HydrophobicContact CG-CD2 3.99Å
154	P	94.6	Very high	93	Very high	31 Å²	31	48.8 Å²	48.8	20%	0.201	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-35.7	178.2	24.4	-32.5	0	0	0	112.3	L117 D150 G151 K157 L158	L117-P154 HydrophobicContact CB-CB 3.78Å; L117-P154 HydrophobicContact CB-CG 4.44Å; L117-P154 HydrophobicContact CD1-CB 4.43Å; L117-P154 HydrophobicContact CD1-CG 4.46Å; D150-P154 WeakPolarHBondContact O-CD 3.46Å; G151-P154 VanDerWaalsContact O-CD 3.27Å; G151-P154 WeakPolarHBondContact O-CD 3.15Å; G151-P154 VanDerWaalsContact O-CG 3.26Å; G151-P154 WeakPolarHBondContact O-CG 3.39Å; P154-K157 PolarHBondContact O-N 3.06Å; P154-L158 WeakPolarHBondContact O-CG 3.3Å; P154-L158 PolarHBondContact O-N 2.98Å
155	L	95.7	Very high	93.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-43.4	178.8	-67.2	169.4	0	0	0	112.2	L117 T130 G151 M152 P153 K157 L158 L159 I173 I174 L177	L117-L155 HydrophobicContact CD1-CD2 3.88Å; L117-L155 HydrophobicContact CD1-CG 4.35Å; T130-L155 HydrophobicContact CG2-CD2 4.39Å; G151-L155 VanDerWaalsContact O-CD1 3.25Å; G151-L155 WeakPolarHBondContact O-CD1 3.28Å; G151-L155 WeakPolarHBondContact O-CG 3.46Å; M152-L155 HydrophobicContact CE-CB 4.14Å; M152-L155 HydrophobicContact CE-CD1 3.5Å; M152-L155 HydrophobicContact CE-CG 4.46Å; M152-L155 PolarHBondContact O-N 3.14Å; M152-L155 VanDerWaalsContact O-N 3.15Å; P153-L155 VanDerWaalsContact C-N 3.33Å; P153-L155 PolarHBondContact O-N 3.2Å; L155-K157 VanDerWaalsContact C-N 3.27Å; L155-K157 PolarHBondContact O-N 3.23Å; L155-L158 PolarHBondContact O-N 3.43Å; L155-L159 PolarHBondContact O-N 3.3Å; L155-I173 HydrophobicContact CD1-CB 4.12Å; L155-I173 HydrophobicContact CD1-CG2 3.45Å; L155-I173 VanDerWaalsContact CD1-CG2 3.45Å; L155-I173 HydrophobicContact CD2-CB 4.38Å; L155-I173 HydrophobicContact CD2-CD1 3.59Å; L155-I173 HydrophobicContact CD2-CG2 4.4Å; L155-I174 HydrophobicContact CB-CD1 4.2Å; L155-I174 HydrophobicContact CB-CG1 4.15Å; L155-L177 HydrophobicContact CD1-CD1 4.27Å
156	I	94.9	Very high	93.4	Very high	13 Å²	13	46.4 Å²	46.4	7%	0.067	28%	0.276	C	S	.	.	H	α-helix	trans	-61	-39.6	175.7	-68.2	165.4	0	0	0	110.5	M152 L158 L159 I174 L190 A192	M152-I156 PolarHBondContact O-N 3.34Å; I156-L158 VanDerWaalsContact C-N 3.34Å; I156-L158 PolarHBondContact O-N 3.42Å; I156-L159 VanDerWaalsContact O-CB 3.27Å; I156-L159 WeakPolarHBondContact O-CB 3.41Å; I156-L159 WeakPolarHBondContact O-CG 3.24Å; I156-L159 PolarHBondContact O-N 2.94Å; I156-I174 HydrophobicContact CG1-CD1 4.42Å; I156-L190 HydrophobicContact CD1-CB 3.46Å; I156-L190 VanDerWaalsContact CD1-CB 3.46Å; I156-L190 HydrophobicContact CD1-CD1 3.66Å; I156-L190 HydrophobicContact CD1-CG 4.22Å; I156-A192 HydrophobicContact CD1-CB 3.77Å; I156-A192 HydrophobicContact CG1-CB 3.88Å; I156-A192 HydrophobicContact CG2-CB 4.04Å
157	K	93.6	Very high	93.6	Very high	132 Å²	132	46.6 Å²	46.6	57%	0.574	28%	0.277	S	S	*	.	H	α-helix	trans	-65.8	-37	177.3	-171.6	173.3	-177.9	173.4	0	112.6	P153 P154 L155 L159 S160	P153-K157 PolarHBondContact O-N 3.26Å; P154-K157 PolarHBondContact O-N 3.06Å; L155-K157 VanDerWaalsContact C-N 3.27Å; L155-K157 PolarHBondContact O-N 3.23Å; K157-L159 PolarHBondContact O-N 3.31Å; K157-S160 PolarHBondContact O-N 2.95Å
158	L	95.4	Very high	93.9	Very high	14 Å²	14	47.1 Å²	47.1	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-72.4	-11.9	178.6	-71.3	176.4	0	0	0	113.6	L117 H126 T130 P154 L155 I156 S160 S161 V166 S170	L117-L158 HydrophobicContact CB-CD1 4Å; L117-L158 HydrophobicContact CD1-CD1 4.39Å; L117-L158 HydrophobicContact CD2-CD1 3.92Å; L117-L158 HydrophobicContact CG-CD1 4.32Å; H126-L158 HydrophobicContact CB-CD1 4.47Å; H126-L158 HydrophobicContact CB-CD2 4.33Å; T130-L158 HydrophobicContact CG2-CD1 3.98Å; P154-L158 WeakPolarHBondContact O-CG 3.3Å; P154-L158 PolarHBondContact O-N 2.98Å; L155-L158 PolarHBondContact O-N 3.43Å; I156-L158 VanDerWaalsContact C-N 3.34Å; I156-L158 PolarHBondContact O-N 3.42Å; L158-S160 PolarHBondContact O-N 2.74Å; L158-S161 WeakPolarHBondContact O-CB 3.42Å; L158-S161 PolarHBondContact O-N 3.03Å; L158-V166 HydrophobicContact CB-CG1 4.11Å; L158-V166 HydrophobicContact CD1-CG1 4.4Å; L158-V166 HydrophobicContact CD2-CG1 4.08Å; L158-V166 HydrophobicContact CG-CG1 4.43Å; L158-S170 WeakPolarHBondContact CB-OG 3.31Å
159	L	95.2	Very high	94.2	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.5	169.7	-66.7	-178.7	0	0	0	112.7	L155 I156 K157 S161 L171 I174 P195 L196 L199	L155-L159 PolarHBondContact O-N 3.3Å; I156-L159 VanDerWaalsContact O-CB 3.27Å; I156-L159 WeakPolarHBondContact O-CB 3.41Å; I156-L159 WeakPolarHBondContact O-CG 3.24Å; I156-L159 PolarHBondContact O-N 2.94Å; K157-L159 PolarHBondContact O-N 3.31Å; L159-S161 VanDerWaalsContact C-N 3.29Å; L159-L171 HydrophobicContact CD2-CD2 3.58Å; L159-L171 HydrophobicContact CD2-CG 3.68Å; L159-I174 HydrophobicContact CD1-CD1 3.96Å; L159-I174 HydrophobicContact CD2-CD1 3.86Å; L159-I174 HydrophobicContact CG-CD1 4.03Å; L159-P195 HydrophobicContact CB-CB 4.27Å; L159-P195 HydrophobicContact CD1-CB 4.08Å; L159-L196 HydrophobicContact CD1-CD2 3.91Å; L159-L196 HydrophobicContact CD1-CG 4.18Å; L159-L199 HydrophobicContact CB-CD1 3.98Å; L159-L199 HydrophobicContact CD2-CD1 3.86Å; L159-L199 HydrophobicContact CG-CD1 4.35Å
160	S	93.1	Very high	94.5	Very high	94 Å²	94	40.3 Å²	40.3	66%	0.657	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	15.4	175.8	-53.7	0	0	0	0	113.6	K157 L158	K157-S160 PolarHBondContact O-N 2.95Å; L158-S160 PolarHBondContact O-N 2.74Å
161	S	93.4	Very high	94.8	Very high	23 Å²	23	34.2 Å²	34.2	16%	0.161	20%	0.197	C	C	.	.			trans	-60.6	139.6	175.8	-179.5	0	0	0	0	110.7	L158 L159 D163	L158-S161 WeakPolarHBondContact O-CB 3.42Å; L158-S161 PolarHBondContact O-N 3.03Å; L159-S161 VanDerWaalsContact C-N 3.29Å; S161-D163 PolarHBondContact O-N 2.77Å; S161-D163 PolarHBondContact OG-N 3Å; S161-D163 VanDerWaalsContact OG-N 3.14Å
162	P	90.4	Very high	95	Very high	123 Å²	123	36.6 Å²	36.6	80%	0.799	21%	0.208	S	C	*	.	S	Bend	trans	-69.3	-14	171.4	31.3	-36.3	0	0	0	112.6
163	D	94.4	Very high	95.2	Very high	38 Å²	38	36.3 Å²	36.3	20%	0.203	21%	0.207	C	C	.	.			trans	-92.9	122.9	179.3	-175	-84.9	0	0	0	111.3	V123 S161 D165 V166 A167	V123-D163 HydrophobicContact CG1-CB 3.35Å; S161-D163 PolarHBondContact O-N 2.77Å; S161-D163 PolarHBondContact OG-N 3Å; S161-D163 VanDerWaalsContact OG-N 3.14Å; D163-D165 VanDerWaalsContact C-N 3.35Å; D163-D165 PolarHBondContact O-N 3.15Å; D163-D165 WeakPolarHBondContact OD1-CA 3.09Å; D163-D165 WeakPolarHBondContact OD1-CB 3.26Å; D163-D165 PolarHBondContact OD1-N 3.47Å; D163-V166 HydrophobicContact CB-CB 4.19Å; D163-V166 HydrophobicContact CB-CG2 3.92Å; D163-V166 PolarHBondContact O-N 3.48Å; D163-V166 WeakPolarHBondContact OD1-CG2 3.12Å; D163-V166 PolarHBondContact OD1-N 3.43Å; D163-A167 PolarHBondContact O-N 2.87Å; D163-A167 VanDerWaalsContact O-N 3.14Å
164	P	94.6	Very high	95.3	Very high	36 Å²	36	33.5 Å²	33.5	23%	0.234	19%	0.188	C	C	.	.	H	α-helix	trans	-69.4	-30.8	-174.6	28.3	-34.9	0	0	0	113	A167 K168 F204 I207	P164-A167 PolarHBondContact O-N 3.02Å; P164-K168 WeakPolarHBondContact O-CB 3.21Å; P164-K168 PolarHBondContact O-N 3.09Å; P164-F204 HydrophobicContact CB-CD1 4.46Å; P164-F204 HydrophobicContact CB-CD2 3.8Å; P164-F204 HydrophobicContact CB-CE1 4.24Å; P164-F204 HydrophobicContact CB-CE2 3.55Å; P164-F204 HydrophobicContact CB-CG 4.25Å; P164-F204 HydrophobicContact CB-CZ 3.78Å; P164-F204 HydrophobicContact CG-CE1 4.28Å; P164-F204 HydrophobicContact CG-CE2 3.97Å; P164-F204 HydrophobicContact CG-CZ 3.76Å; P164-I207 HydrophobicContact CB-CD1 4.05Å
165	D	94.8	Very high	95.3	Very high	81 Å²	81	34.2 Å²	34.2	43%	0.433	19%	0.189	S	C	.	.	H	α-helix	trans	-71.2	-40.7	179.7	-68.6	-54.1	0	0	0	110.3	E127 D163 K168 N169	E127-D165 HydrophobicContact CG-CB 4Å; D163-D165 VanDerWaalsContact C-N 3.35Å; D163-D165 PolarHBondContact O-N 3.15Å; D163-D165 WeakPolarHBondContact OD1-CA 3.09Å; D163-D165 WeakPolarHBondContact OD1-CB 3.26Å; D163-D165 PolarHBondContact OD1-N 3.47Å; D165-K168 PolarHBondContact O-N 3.43Å; D165-N169 VanDerWaalsContact O-CB 3.31Å; D165-N169 WeakPolarHBondContact O-CB 3.25Å; D165-N169 PolarHBondContact O-N 3.39Å; D165-N169 PolarHBondContact O-ND2 3.01Å
166	V	96.1	Very high	95.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-47.7	171.4	177.3	0	0	0	0	111.5	V123 H126 E127 L158 D163 S170	V123-V166 HydrophobicContact CG1-CG2 4.08Å; H126-V166 HydrophobicContact CB-CG1 3.95Å; H126-V166 HydrophobicContact CB-CG2 3.91Å; E127-V166 HydrophobicContact CB-CG2 3.89Å; L158-V166 HydrophobicContact CB-CG1 4.11Å; L158-V166 HydrophobicContact CD1-CG1 4.4Å; L158-V166 HydrophobicContact CD2-CG1 4.08Å; L158-V166 HydrophobicContact CG-CG1 4.43Å; D163-V166 HydrophobicContact CB-CB 4.19Å; D163-V166 HydrophobicContact CB-CG2 3.92Å; D163-V166 PolarHBondContact O-N 3.48Å; D163-V166 WeakPolarHBondContact OD1-CG2 3.12Å; D163-V166 PolarHBondContact OD1-N 3.43Å; V166-S170 VanDerWaalsContact O-CB 3.3Å; V166-S170 WeakPolarHBondContact O-CB 3.26Å; V166-S170 PolarHBondContact O-N 3.36Å; V166-S170 PolarHBondContact O-OG 3.26Å
167	A	96.2	Very high	95.2	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-45.8	179.4	0	0	0	0	0	111.5	D163 P164 S170 L171 I207	D163-A167 PolarHBondContact O-N 2.87Å; D163-A167 VanDerWaalsContact O-N 3.14Å; P164-A167 PolarHBondContact O-N 3.02Å; A167-S170 PolarHBondContact O-N 2.98Å; A167-L171 WeakPolarHBondContact O-CG 3.41Å; A167-L171 PolarHBondContact O-N 3.42Å; A167-I207 HydrophobicContact CB-CD1 4.29Å
168	K	97.2	Very high	95.2	Very high	53 Å²	53	28.7 Å²	28.7	23%	0.23	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-46.3	177.4	177.1	-101.7	160.2	-161.7	0	111.9	P164 D165 L171 E172 V206 I207 L210	P164-K168 WeakPolarHBondContact O-CB 3.21Å; P164-K168 PolarHBondContact O-N 3.09Å; D165-K168 PolarHBondContact O-N 3.43Å; K168-L171 PolarHBondContact O-N 2.92Å; K168-E172 WeakPolarHBondContact CE-OE2 3.35Å; K168-E172 IonicContact NZ-OE2 2.75Å; K168-E172 PolarHBondContact NZ-OE2 2.86Å; K168-E172 PolarHBondContact O-N 3.17Å; K168-V206 HydrophobicContact CG-CG1 3.97Å; K168-I207 HydrophobicContact CB-CD1 4.49Å; K168-I207 HydrophobicContact CB-CG1 4.02Å; K168-L210 HydrophobicContact CG-CD1 3.96Å
169	N	97	Very high	94.9	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.032	18%	0.182	C	C	.	.	H	α-helix	trans	-67.6	-38	178.2	-67.2	-22.5	0	0	0	111.6	E127 T130 D165 E172 I173	E127-N169 PolarHBondContact O-ND2 3.13Å; T130-N169 WeakPolarHBondContact OG1-CB 3.33Å; D165-N169 VanDerWaalsContact O-CB 3.31Å; D165-N169 WeakPolarHBondContact O-CB 3.25Å; D165-N169 PolarHBondContact O-N 3.39Å; D165-N169 PolarHBondContact O-ND2 3.01Å; N169-E172 PolarHBondContact O-N 3.43Å; N169-I173 WeakPolarHBondContact O-CD1 3.4Å; N169-I173 VanDerWaalsContact O-CG1 3.24Å; N169-I173 WeakPolarHBondContact O-CG1 3.27Å; N169-I173 PolarHBondContact O-N 3.2Å
170	S	97.3	Very high	94.4	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-43.1	175.6	-59.3	0	0	0	0	111.8	L158 V166 A167 I173 I174	L158-S170 WeakPolarHBondContact CB-OG 3.31Å; V166-S170 VanDerWaalsContact O-CB 3.3Å; V166-S170 WeakPolarHBondContact O-CB 3.26Å; V166-S170 PolarHBondContact O-N 3.36Å; V166-S170 PolarHBondContact O-OG 3.26Å; A167-S170 PolarHBondContact O-N 2.98Å; S170-I173 PolarHBondContact O-N 3.48Å; S170-I174 WeakPolarHBondContact O-CD1 3.06Å; S170-I174 VanDerWaalsContact O-CG1 3.28Å; S170-I174 WeakPolarHBondContact O-CG1 3.47Å; S170-I174 PolarHBondContact O-N 3.21Å
171	L	97.5	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-44.9	173	-76.1	171.1	0	0	0	112	L159 A167 K168 I173 I174 F175 L196 L199 I207 L210 A211 I214	L159-L171 HydrophobicContact CD2-CD2 3.58Å; L159-L171 HydrophobicContact CD2-CG 3.68Å; A167-L171 WeakPolarHBondContact O-CG 3.41Å; A167-L171 PolarHBondContact O-N 3.42Å; K168-L171 PolarHBondContact O-N 2.92Å; L171-I173 VanDerWaalsContact C-N 3.33Å; L171-I173 PolarHBondContact O-N 3.11Å; L171-I174 PolarHBondContact O-N 3.43Å; L171-F175 WeakPolarHBondContact O-CB 3.47Å; L171-F175 PolarHBondContact O-N 2.9Å; L171-L196 HydrophobicContact CD2-CD2 3.53Å; L171-L199 HydrophobicContact CD1-CD1 4.05Å; L171-L199 HydrophobicContact CD2-CD1 3.88Å; L171-L199 HydrophobicContact CG-CD1 4.13Å; L171-I207 HydrophobicContact CD1-CB 4.32Å; L171-I207 HydrophobicContact CD1-CG2 3.73Å; L171-L210 HydrophobicContact CB-CB 3.99Å; L171-L210 HydrophobicContact CB-CD1 4.19Å; L171-L210 HydrophobicContact CD1-CB 3.98Å; L171-A211 HydrophobicContact CD2-CB 4.47Å; L171-I214 HydrophobicContact CB-CD1 4.26Å; L171-I214 HydrophobicContact CD2-CD1 3.49Å; L171-I214 VanDerWaalsContact CD2-CD1 3.49Å; L171-I214 HydrophobicContact CG-CD1 4.5Å
172	E	96.8	Very high	93.3	Very high	50 Å²	50	42.7 Å²	42.7	23%	0.234	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-41.1	179.8	-171.4	173.2	171.9	0	0	111.9	A134 K168 N169 N176	A134-E172 HydrophobicContact CB-CB 4.35Å; A134-E172 HydrophobicContact CB-CG 4.27Å; K168-E172 WeakPolarHBondContact CE-OE2 3.35Å; K168-E172 IonicContact NZ-OE2 2.75Å; K168-E172 PolarHBondContact NZ-OE2 2.86Å; K168-E172 PolarHBondContact O-N 3.17Å; N169-E172 PolarHBondContact O-N 3.43Å; E172-N176 VanDerWaalsContact O-CG 3.32Å; E172-N176 PolarHBondContact O-N 3.31Å; E172-N176 PolarHBondContact O-ND2 3.19Å
173	I	96.7	Very high	93.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-48.6	174	-59.3	157	0	0	0	110.3	T130 L133 A134 A137 L155 N169 S170 L171 F175 N176 L177	T130-I173 HydrophobicContact CG2-CD1 4.35Å; L133-I173 HydrophobicContact CB-CD1 3.59Å; L133-I173 HydrophobicContact CB-CG1 4.14Å; A134-I173 VanDerWaalsContact CA-CG1 3.47Å; A134-I173 HydrophobicContact CB-CD1 4.44Å; A134-I173 HydrophobicContact CB-CG1 3.81Å; A137-I173 HydrophobicContact CB-CG2 4.22Å; L155-I173 HydrophobicContact CD1-CB 4.12Å; L155-I173 HydrophobicContact CD1-CG2 3.45Å; L155-I173 VanDerWaalsContact CD1-CG2 3.45Å; L155-I173 HydrophobicContact CD2-CB 4.38Å; L155-I173 HydrophobicContact CD2-CD1 3.59Å; L155-I173 HydrophobicContact CD2-CG2 4.4Å; N169-I173 WeakPolarHBondContact O-CD1 3.4Å; N169-I173 VanDerWaalsContact O-CG1 3.24Å; N169-I173 WeakPolarHBondContact O-CG1 3.27Å; N169-I173 PolarHBondContact O-N 3.2Å; S170-I173 PolarHBondContact O-N 3.48Å; L171-I173 VanDerWaalsContact C-N 3.33Å; L171-I173 PolarHBondContact O-N 3.11Å; I173-F175 VanDerWaalsContact C-N 3.35Å; I173-F175 PolarHBondContact O-N 3.13Å; I173-N176 PolarHBondContact O-N 3.04Å; I173-L177 HydrophobicContact CG2-CD1 3.76Å; I173-L177 HydrophobicContact CG2-CG 4.34Å; I173-L177 VanDerWaalsContact O-CG 3.26Å; I173-L177 WeakPolarHBondContact O-CG 3.49Å; I173-L177 PolarHBondContact O-N 2.87Å
174	I	96.3	Very high	92.8	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-47.5	178.7	-69.8	162	0	0	0	110.3	M152 L155 I156 L159 S170 L171 N176 L177 V178 L187 I214	M152-I174 HydrophobicContact CE-CB 4.4Å; M152-I174 HydrophobicContact CE-CG1 3.59Å; L155-I174 HydrophobicContact CB-CD1 4.2Å; L155-I174 HydrophobicContact CB-CG1 4.15Å; I156-I174 HydrophobicContact CG1-CD1 4.42Å; L159-I174 HydrophobicContact CD1-CD1 3.96Å; L159-I174 HydrophobicContact CD2-CD1 3.86Å; L159-I174 HydrophobicContact CG-CD1 4.03Å; S170-I174 WeakPolarHBondContact O-CD1 3.06Å; S170-I174 VanDerWaalsContact O-CG1 3.28Å; S170-I174 WeakPolarHBondContact O-CG1 3.47Å; S170-I174 PolarHBondContact O-N 3.21Å; L171-I174 PolarHBondContact O-N 3.43Å; I174-N176 VanDerWaalsContact C-N 3.3Å; I174-N176 PolarHBondContact O-N 3.2Å; I174-L177 PolarHBondContact O-N 2.97Å; I174-V178 HydrophobicContact CG2-CG1 3.98Å; I174-V178 WeakPolarHBondContact O-CG1 3.43Å; I174-V178 WeakPolarHBondContact O-CG2 3.13Å; I174-V178 PolarHBondContact O-N 3.35Å; I174-L187 HydrophobicContact CG2-CD1 3.97Å; I174-I214 HydrophobicContact CB-CD1 4.21Å; I174-I214 HydrophobicContact CG2-CD1 3.92Å; I174-I214 HydrophobicContact CG2-CG1 4.44Å; I174-I214 HydrophobicContact CG2-CG2 4.38Å
175	F	95.8	Very high	92.4	Very high	47 Å²	47	40 Å²	40	21%	0.206	20%	0.195	C	C	.	.	H	α-helix	trans	-55.2	-44.9	177.8	175.1	-108.8	0	0	0	112.2	L171 I173 L177 V178 Q179 Q213 I214	L171-F175 WeakPolarHBondContact O-CB 3.47Å; L171-F175 PolarHBondContact O-N 2.9Å; I173-F175 VanDerWaalsContact C-N 3.35Å; I173-F175 PolarHBondContact O-N 3.13Å; F175-L177 VanDerWaalsContact C-N 3.33Å; F175-L177 PolarHBondContact O-N 3.32Å; F175-V178 WeakPolarHBondContact O-CG2 3.35Å; F175-Q179 WeakPolarHBondContact O-CG 3.37Å; F175-Q179 PolarHBondContact O-NE2 3.38Å; F175-Q213 HydrophobicContact CD2-CB 3.93Å; F175-Q213 HydrophobicContact CE2-CB 3.74Å; F175-Q213 HydrophobicContact CZ-CB 4.46Å; F175-I214 HydrophobicContact CB-CD1 4.27Å; F175-I214 HydrophobicContact CB-CG1 3.8Å; F175-I214 HydrophobicContact CD2-CG1 4.14Å; F175-I214 HydrophobicContact CG-CG1 4.47Å
176	N	94.8	Very high	92.1	Very high	24 Å²	24	38.6 Å²	38.6	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-35.5	177.5	-74.6	-29.9	0	0	0	112.5	A137 R143 E172 I173 I174	A137-N176 HydrophobicContact CB-CB 4.07Å; R143-N176 WeakPolarHBondContact CD-O 3.4Å; R143-N176 PolarHBondContact NH1-O 3.16Å; E172-N176 VanDerWaalsContact O-CG 3.32Å; E172-N176 PolarHBondContact O-N 3.31Å; E172-N176 PolarHBondContact O-ND2 3.19Å; I173-N176 PolarHBondContact O-N 3.04Å; I174-N176 VanDerWaalsContact C-N 3.3Å; I174-N176 PolarHBondContact O-N 3.2Å
177	L	93.6	Very high	91.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-74.6	-42	179.2	-66.9	170.2	0	0	0	112.4	R143 I146 M152 L155 I173 I174 F175 Q179 D180 N183	R143-L177 HydrophobicContact CB-CD2 3.65Å; R143-L177 HydrophobicContact CG-CD2 3.78Å; I146-L177 HydrophobicContact CB-CD2 4.37Å; I146-L177 HydrophobicContact CG2-CD1 3.88Å; I146-L177 HydrophobicContact CG2-CD2 4.39Å; M152-L177 HydrophobicContact CE-CB 4.47Å; M152-L177 HydrophobicContact CE-CD1 3.22Å; M152-L177 HydrophobicContact CE-CG 4.44Å; M152-L177 HydrophobicContact SD-CB 4.34Å; M152-L177 HydrophobicContact SD-CD1 3.89Å; L155-L177 HydrophobicContact CD1-CD1 4.27Å; I173-L177 HydrophobicContact CG2-CD1 3.76Å; I173-L177 HydrophobicContact CG2-CG 4.34Å; I173-L177 VanDerWaalsContact O-CG 3.26Å; I173-L177 WeakPolarHBondContact O-CG 3.49Å; I173-L177 PolarHBondContact O-N 2.87Å; I174-L177 PolarHBondContact O-N 2.97Å; F175-L177 VanDerWaalsContact C-N 3.33Å; F175-L177 PolarHBondContact O-N 3.32Å; L177-Q179 PolarHBondContact O-N 2.97Å; L177-Q179 VanDerWaalsContact O-N 3.12Å; L177-D180 PolarHBondContact O-N 2.77Å; L177-D180 VanDerWaalsContact O-N 3.08Å; L177-N183 PolarHBondContact O-ND2 3.01Å
178	V	92.3	Very high	91.4	Very high	4 Å²	4	41 Å²	41	2%	0.024	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-5.5	-178.2	-60.3	0	0	0	0	114.2	I174 F175 D180 L184 L187 C217	I174-V178 HydrophobicContact CG2-CG1 3.98Å; I174-V178 WeakPolarHBondContact O-CG1 3.43Å; I174-V178 WeakPolarHBondContact O-CG2 3.13Å; I174-V178 PolarHBondContact O-N 3.35Å; F175-V178 WeakPolarHBondContact O-CG2 3.35Å; V178-D180 PolarHBondContact O-N 3.45Å; V178-L184 HydrophobicContact CB-CD2 3.83Å; V178-L184 HydrophobicContact CG1-CD2 4.23Å; V178-L187 HydrophobicContact CG1-CD1 3.41Å; V178-L187 VanDerWaalsContact CG1-CD1 3.41Å; V178-C217 HydrophobicContact CG2-CB 3.95Å
179	Q	89.3	Confident	91.1	Very high	89 Å²	89	45.1 Å²	45.1	42%	0.416	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.1	167.2	-57	-52.6	-58.7	0	0	112	F175 L177 C217	F175-Q179 WeakPolarHBondContact O-CG 3.37Å; F175-Q179 PolarHBondContact O-NE2 3.38Å; L177-Q179 PolarHBondContact O-N 2.97Å; L177-Q179 VanDerWaalsContact O-N 3.12Å; Q179-C217 PolarHBondContact NE2-SG 3.48Å; Q179-C217 VanDerWaalsContact NE2-SG 3.38Å
180	D	85.8	Confident	90.8	Very high	40 Å²	40	48.1 Å²	48.1	21%	0.214	24%	0.236	C	C	.	.	S	Bend	trans	-92.8	120.4	173.7	-56.5	-37.3	0	0	0	109.2	R143 L177 V178 E182 N183	R143-D180 IonicContact CZ-OD1 3.79Å; R143-D180 IonicContact CZ-OD2 2.77Å; R143-D180 VanDerWaalsContact CZ-OD2 3.22Å; R143-D180 IonicContact NE-OD2 2.73Å; R143-D180 IonicContact NH1-OD1 2.92Å; R143-D180 IonicContact NH1-OD2 3.39Å; R143-D180 VanDerWaalsContact NH2-CG 3.27Å; R143-D180 IonicContact NH2-OD1 2.72Å; R143-D180 PolarHBondContact NH2-OD1 2.92Å; R143-D180 IonicContact NH2-OD2 2.6Å; R143-D180 PolarHBondContact NH2-OD2 3.36Å; L177-D180 PolarHBondContact O-N 2.77Å; L177-D180 VanDerWaalsContact O-N 3.08Å; V178-D180 PolarHBondContact O-N 3.45Å; D180-E182 PolarHBondContact O-N 3.23Å; D180-E182 VanDerWaalsContact O-N 3.11Å; D180-N183 WeakPolarHBondContact O-CB 3.42Å; D180-N183 PolarHBondContact O-N 3.38Å
181	L	78.9	Confident	90.5	Very high	136 Å²	136	49.8 Å²	49.8	71%	0.712	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.5	-170.2	-68.8	173.9	0	0	0	114.3	N183 L184	L181-N183 PolarHBondContact O-N 3.3Å; L181-L184 HydrophobicContact CD2-CD1 3.88Å; L181-L184 WeakPolarHBondContact O-CB 3.4Å; L181-L184 PolarHBondContact O-N 2.98Å; L181-L184 VanDerWaalsContact O-N 3.13Å
182	E	83.8	Confident	90.3	Very high	164 Å²	164	49.9 Å²	49.9	77%	0.766	25%	0.254	S	S	*	.	H	α-helix	trans	-60.3	-27.1	178.5	-63.3	177.7	179.8	0	0	112.4	D180 L184	D180-E182 PolarHBondContact O-N 3.23Å; D180-E182 VanDerWaalsContact O-N 3.11Å; E182-L184 VanDerWaalsContact C-N 3.33Å
183	N	86.4	Confident	90.1	Very high	11 Å²	11	47.5 Å²	47.5	6%	0.059	24%	0.243	C	C	.	.	H	α-helix	trans	-81.5	-13.4	-178.8	-60.4	-35.5	0	0	0	113	N147 L177 D180 L181 L187	N147-N183 PolarHBondContact ND2-ND2 3.27Å; N147-N183 PolarHBondContact ND2-OD1 3.38Å; L177-N183 PolarHBondContact O-ND2 3.01Å; D180-N183 WeakPolarHBondContact O-CB 3.42Å; D180-N183 PolarHBondContact O-N 3.38Å; L181-N183 PolarHBondContact O-N 3.3Å; N183-L187 WeakPolarHBondContact O-CB 3.46Å; N183-L187 PolarHBondContact O-N 2.87Å
184	L	87.7	Confident	90	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-39.2	175.1	-63.3	179.3	0	0	0	111.3	V178 L181 E182 L187 H188 V218 D221 T224	V178-L184 HydrophobicContact CB-CD2 3.83Å; V178-L184 HydrophobicContact CG1-CD2 4.23Å; L181-L184 HydrophobicContact CD2-CD1 3.88Å; L181-L184 WeakPolarHBondContact O-CB 3.4Å; L181-L184 PolarHBondContact O-N 2.98Å; L181-L184 VanDerWaalsContact O-N 3.13Å; E182-L184 VanDerWaalsContact C-N 3.33Å; L184-L187 PolarHBondContact O-N 2.76Å; L184-H188 WeakPolarHBondContact O-CB 3.27Å; L184-H188 PolarHBondContact O-N 3.48Å; L184-V218 HydrophobicContact CD2-CB 4.47Å; L184-V218 HydrophobicContact CD2-CG1 3.98Å; L184-D221 HydrophobicContact CB-CB 4.31Å; L184-D221 HydrophobicContact CD1-CB 3.76Å; L184-T224 WeakPolarHBondContact O-CG2 3.16Å
185	E	85.6	Confident	90	Very high	126 Å²	126	51.3 Å²	51.3	59%	0.589	27%	0.267	S	S	*	.	H	α-helix	trans	-63.2	-45.2	175.6	-173.6	172.9	-164.6	0	0	110.8	L187 H188 E189	E185-L187 VanDerWaalsContact C-N 3.34Å; E185-L187 PolarHBondContact O-N 3.06Å; E185-H188 WeakPolarHBondContact O-CB 3.38Å; E185-H188 PolarHBondContact O-N 3.17Å; E185-E189 WeakPolarHBondContact O-CG 3.33Å; E185-E189 PolarHBondContact O-N 3.02Å
186	V	88.3	Confident	90	Very high	53 Å²	53	49 Å²	49	32%	0.321	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-42.8	175.9	179.7	0	0	0	0	111.4	M152 H188 E189 L190	M152-V186 HydrophobicContact CB-CG1 4.12Å; M152-V186 HydrophobicContact CG-CG1 4.27Å; V186-H188 VanDerWaalsContact C-N 3.32Å; V186-H188 PolarHBondContact O-N 3.37Å; V186-E189 PolarHBondContact O-N 3.08Å; V186-L190 HydrophobicContact CG1-CD1 3.7Å; V186-L190 HydrophobicContact CG1-CG 4.34Å; V186-L190 WeakPolarHBondContact O-CB 3.39Å; V186-L190 WeakPolarHBondContact O-CG 3.33Å; V186-L190 PolarHBondContact O-N 3.12Å
187	L	90.2	Very high	90	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-39.7	177.9	-173.2	154.1	0	0	0	111.9	I174 V178 N183 L184 E185 G191 A192 I214 V218	I174-L187 HydrophobicContact CG2-CD1 3.97Å; V178-L187 HydrophobicContact CG1-CD1 3.41Å; V178-L187 VanDerWaalsContact CG1-CD1 3.41Å; N183-L187 WeakPolarHBondContact O-CB 3.46Å; N183-L187 PolarHBondContact O-N 2.87Å; L184-L187 PolarHBondContact O-N 2.76Å; E185-L187 VanDerWaalsContact C-N 3.34Å; E185-L187 PolarHBondContact O-N 3.06Å; L187-G191 PolarHBondContact O-N 3.01Å; L187-A192 HydrophobicContact CD1-CB 4.36Å; L187-A192 HydrophobicContact CD2-CB 3.6Å; L187-A192 HydrophobicContact CG-CB 3.57Å; L187-A192 PolarHBondContact O-N 3.21Å; L187-I214 HydrophobicContact CD1-CG2 4.49Å; L187-V218 HydrophobicContact CD1-CG1 4.05Å; L187-V218 HydrophobicContact CD2-CG1 3.93Å
188	H	88.5	Confident	90	Very high	53 Å²	53	53.2 Å²	53.2	25%	0.245	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-53.1	173	166.2	-114.8	0	0	0	111.8	L184 E185 V186 L190 G191 T224 T227	L184-H188 WeakPolarHBondContact O-CB 3.27Å; L184-H188 PolarHBondContact O-N 3.48Å; E185-H188 WeakPolarHBondContact O-CB 3.38Å; E185-H188 PolarHBondContact O-N 3.17Å; V186-H188 VanDerWaalsContact C-N 3.32Å; V186-H188 PolarHBondContact O-N 3.37Å; H188-L190 PolarHBondContact O-N 3.38Å; H188-G191 PolarHBondContact O-N 3.3Å; H188-T224 HydrophobicContact CB-CG2 3.74Å; H188-T227 PolarHBondContact CD2-OG1 3.2Å; H188-T227 PolarHBondContact NE2-OG1 3.03Å; H188-T227 VanDerWaalsContact NE2-OG1 3.16Å
189	E	89.8	Confident	90.1	Very high	141 Å²	141	54.1 Å²	54.1	66%	0.659	28%	0.281	S	S	*	.	H	α-helix	trans	-59.6	-32.9	-178.9	-71.9	-173.4	160.3	0	0	113	E185 V186 G191	E185-E189 WeakPolarHBondContact O-CG 3.33Å; E185-E189 PolarHBondContact O-N 3.02Å; V186-E189 PolarHBondContact O-N 3.08Å; E189-G191 VanDerWaalsContact C-N 3.31Å
190	L	91.6	Very high	90.3	Very high	69 Å²	69	50.5 Å²	50.5	36%	0.361	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.2	179	-64.8	175.3	0	0	0	113.8	M152 P153 I156 V186 H188	M152-L190 HydrophobicContact CB-CD1 3.81Å; P153-L190 HydrophobicContact CB-CD1 4.4Å; P153-L190 HydrophobicContact CB-CD2 4.45Å; P153-L190 HydrophobicContact CG-CD1 3.74Å; P153-L190 HydrophobicContact CG-CD2 3.99Å; I156-L190 HydrophobicContact CD1-CB 3.46Å; I156-L190 VanDerWaalsContact CD1-CB 3.46Å; I156-L190 HydrophobicContact CD1-CD1 3.66Å; I156-L190 HydrophobicContact CD1-CG 4.22Å; V186-L190 HydrophobicContact CG1-CD1 3.7Å; V186-L190 HydrophobicContact CG1-CG 4.34Å; V186-L190 WeakPolarHBondContact O-CB 3.39Å; V186-L190 WeakPolarHBondContact O-CG 3.33Å; V186-L190 PolarHBondContact O-N 3.12Å; H188-L190 PolarHBondContact O-N 3.38Å
191	G	91.3	Very high	90.5	Very high	35 Å²	35	54.2 Å²	54.2	36%	0.361	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	44.4	175.5	0	0	0	0	0	113.6	L187 H188 E189 I193 P194	L187-G191 PolarHBondContact O-N 3.01Å; H188-G191 PolarHBondContact O-N 3.3Å; E189-G191 VanDerWaalsContact C-N 3.31Å; G191-I193 VanDerWaalsContact C-N 3.33Å; G191-I193 PolarHBondContact O-N 2.88Å; G191-P194 WeakPolarHBondContact O-CD 3.33Å
192	A	92.9	Very high	91.2	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	25%	0.252	C	S	.	.			trans	-77.2	-14.5	-176.8	0	0	0	0	0	114.7	I156 L187 P195 L196	I156-A192 HydrophobicContact CD1-CB 3.77Å; I156-A192 HydrophobicContact CG1-CB 3.88Å; I156-A192 HydrophobicContact CG2-CB 4.04Å; L187-A192 HydrophobicContact CD1-CB 4.36Å; L187-A192 HydrophobicContact CD2-CB 3.6Å; L187-A192 HydrophobicContact CG-CB 3.57Å; L187-A192 PolarHBondContact O-N 3.21Å; A192-P195 VanDerWaalsContact O-CD 3.3Å; A192-P195 WeakPolarHBondContact O-CD 3.39Å; A192-L196 HydrophobicContact CB-CD1 4.32Å; A192-L196 WeakPolarHBondContact O-CD1 3.38Å; A192-L196 VanDerWaalsContact O-CG 3.23Å; A192-L196 WeakPolarHBondContact O-CG 3.14Å; A192-L196 PolarHBondContact O-N 2.93Å; A192-L196 VanDerWaalsContact O-N 3.16Å
193	I	93.6	Very high	91.5	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-49.3	-175.3	-67	-166.6	0	0	0	113.4	G191 L196 L197 F215 T224 T227 F228 E231	G191-I193 VanDerWaalsContact C-N 3.33Å; G191-I193 PolarHBondContact O-N 2.88Å; I193-L196 PolarHBondContact O-N 3.45Å; I193-L197 HydrophobicContact CG2-CD1 4.02Å; I193-L197 HydrophobicContact CG2-CG 4.27Å; I193-L197 PolarHBondContact O-N 3.33Å; I193-F215 HydrophobicContact CG2-CE1 4.33Å; I193-T224 WeakPolarHBondContact CD1-O 3.43Å; I193-T227 HydrophobicContact CB-CG2 4.29Å; I193-T227 HydrophobicContact CD1-CG2 3.97Å; I193-T227 HydrophobicContact CG1-CG2 4.4Å; I193-F228 HydrophobicContact CD1-CB 3.95Å; I193-F228 HydrophobicContact CG2-CD2 4.39Å; I193-E231 HydrophobicContact CG2-CB 4.16Å; I193-E231 HydrophobicContact CG2-CG 4.24Å
194	P	94.4	Very high	91.8	Very high	48 Å²	48	53 Å²	53	31%	0.312	28%	0.275	S	S	.	.	H	α-helix	trans	-60.4	-45.2	179.5	-16.6	25.8	0	0	0	113.7	G191 L196 L197 E198 E231	G191-P194 WeakPolarHBondContact O-CD 3.33Å; P194-L196 VanDerWaalsContact C-N 3.33Å; P194-L196 PolarHBondContact O-N 3.24Å; P194-L197 PolarHBondContact O-N 3.5Å; P194-E198 PolarHBondContact O-N 3.42Å; P194-E198 VanDerWaalsContact O-N 3.14Å; P194-E231 HydrophobicContact CG-CG 3.97Å
195	P	94.8	Very high	91.9	Very high	32 Å²	32	56 Å²	56	21%	0.208	29%	0.294	C	S	.	.	H	α-helix	trans	-56.5	-42.3	171.9	-26.8	33.5	0	0	0	113.8	L159 A192 E198 L199	L159-P195 HydrophobicContact CB-CB 4.27Å; L159-P195 HydrophobicContact CD1-CB 4.08Å; A192-P195 VanDerWaalsContact O-CD 3.3Å; A192-P195 WeakPolarHBondContact O-CD 3.39Å; P195-E198 PolarHBondContact O-N 2.94Å; P195-L199 WeakPolarHBondContact O-CG 3.41Å; P195-L199 PolarHBondContact O-N 3.19Å
196	L	95.8	Very high	92.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.2	-39.7	178.1	-69.7	168.5	0	0	0	112.1	L159 L171 A192 I193 P194 E198 L199 I214 F215	L159-L196 HydrophobicContact CD1-CD2 3.91Å; L159-L196 HydrophobicContact CD1-CG 4.18Å; L171-L196 HydrophobicContact CD2-CD2 3.53Å; A192-L196 HydrophobicContact CB-CD1 4.32Å; A192-L196 WeakPolarHBondContact O-CD1 3.38Å; A192-L196 VanDerWaalsContact O-CG 3.23Å; A192-L196 WeakPolarHBondContact O-CG 3.14Å; A192-L196 PolarHBondContact O-N 2.93Å; A192-L196 VanDerWaalsContact O-N 3.16Å; I193-L196 PolarHBondContact O-N 3.45Å; P194-L196 VanDerWaalsContact C-N 3.33Å; P194-L196 PolarHBondContact O-N 3.24Å; L196-E198 VanDerWaalsContact C-N 3.29Å; L196-E198 PolarHBondContact O-N 3.18Å; L196-L199 PolarHBondContact O-N 3.28Å; L196-I214 HydrophobicContact CD1-CG2 3.75Å; L196-I214 HydrophobicContact CD2-CD1 4.02Å; L196-I214 HydrophobicContact CD2-CG2 4.3Å; L196-F215 HydrophobicContact CB-CE1 4.24Å; L196-F215 HydrophobicContact CB-CE2 3.7Å; L196-F215 HydrophobicContact CB-CZ 3.42Å; L196-F215 VanDerWaalsContact CB-CZ 3.42Å
197	L	94.8	Very high	92.7	Very high	7 Å²	7	51.9 Å²	51.9	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-33.6	176.7	-75.7	175.5	0	0	0	112.1	I193 P194 L200 F215 F228 E231 R236 F237	I193-L197 HydrophobicContact CG2-CD1 4.02Å; I193-L197 HydrophobicContact CG2-CG 4.27Å; I193-L197 PolarHBondContact O-N 3.33Å; P194-L197 PolarHBondContact O-N 3.5Å; L197-L200 HydrophobicContact CD2-CD1 4.13Å; L197-L200 WeakPolarHBondContact O-CB 3.46Å; L197-L200 PolarHBondContact O-N 2.86Å; L197-F215 HydrophobicContact CB-CZ 4.4Å; L197-F215 HydrophobicContact CD2-CE1 4.16Å; L197-F215 HydrophobicContact CD2-CE2 4.1Å; L197-F215 HydrophobicContact CD2-CZ 3.58Å; L197-F215 HydrophobicContact CG-CE1 4.35Å; L197-F215 HydrophobicContact CG-CZ 3.7Å; L197-F228 HydrophobicContact CD2-CE2 3.99Å; L197-E231 HydrophobicContact CD1-CB 3.87Å; L197-R236 HydrophobicContact CD2-CB 4.48Å; L197-F237 HydrophobicContact CD2-CD2 4.46Å; L197-F237 HydrophobicContact CD2-CE2 3.98Å
198	E	94.4	Very high	92.9	Very high	104 Å²	104	52.4 Å²	52.4	49%	0.486	28%	0.28	S	S	.	.	H	α-helix	trans	-71.3	-33	178	-164.4	59.2	-157.6	0	0	111.9	P194 P195 L196 L200 K201	P194-E198 PolarHBondContact O-N 3.42Å; P194-E198 VanDerWaalsContact O-N 3.14Å; P195-E198 PolarHBondContact O-N 2.94Å; L196-E198 VanDerWaalsContact C-N 3.29Å; L196-E198 PolarHBondContact O-N 3.18Å; E198-L200 PolarHBondContact O-N 3.09Å; E198-K201 VanDerWaalsContact CD-NZ 3.33Å; E198-K201 WeakPolarHBondContact O-CB 3.36Å; E198-K201 PolarHBondContact O-N 3.31Å; E198-K201 IonicContact OE1-NZ 3.22Å; E198-K201 PolarHBondContact OE1-NZ 3.31Å; E198-K201 VanDerWaalsContact OE1-NZ 3.09Å; E198-K201 IonicContact OE2-NZ 3.49Å; E198-K201 PolarHBondContact OE2-NZ 2.88Å
199	L	95.1	Very high	93.1	Very high	23 Å²	23	52.3 Å²	52.3	12%	0.12	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-16.6	177.6	-70.9	173.5	0	0	0	114	L159 L171 P195 L196 K201 S202 I207 A211	L159-L199 HydrophobicContact CB-CD1 3.98Å; L159-L199 HydrophobicContact CD2-CD1 3.86Å; L159-L199 HydrophobicContact CG-CD1 4.35Å; L171-L199 HydrophobicContact CD1-CD1 4.05Å; L171-L199 HydrophobicContact CD2-CD1 3.88Å; L171-L199 HydrophobicContact CG-CD1 4.13Å; P195-L199 WeakPolarHBondContact O-CG 3.41Å; P195-L199 PolarHBondContact O-N 3.19Å; L196-L199 PolarHBondContact O-N 3.28Å; L199-K201 PolarHBondContact O-N 2.99Å; L199-S202 WeakPolarHBondContact O-CB 3.38Å; L199-S202 PolarHBondContact O-N 3.19Å; L199-S202 VanDerWaalsContact O-N 3.09Å; L199-I207 HydrophobicContact CB-CG2 4.05Å; L199-I207 HydrophobicContact CD2-CG2 3.86Å; L199-I207 HydrophobicContact CG-CG2 4.39Å; L199-A211 HydrophobicContact CB-CB 4.31Å
200	L	92.5	Very high	93.4	Very high	14 Å²	14	46.5 Å²	46.5	7%	0.073	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-21	170.7	-60.9	179	0	0	0	112.7	L197 E198 S202 Q208 A211 L212 F215 F237	L197-L200 HydrophobicContact CD2-CD1 4.13Å; L197-L200 WeakPolarHBondContact O-CB 3.46Å; L197-L200 PolarHBondContact O-N 2.86Å; E198-L200 PolarHBondContact O-N 3.09Å; L200-S202 VanDerWaalsContact C-N 3.33Å; L200-Q208 PolarHBondContact O-NE2 3.31Å; L200-A211 HydrophobicContact CD2-CB 4.01Å; L200-L212 HydrophobicContact CD2-CD2 3.67Å; L200-L212 HydrophobicContact CD2-CG 3.73Å; L200-F215 HydrophobicContact CD1-CE2 4.14Å; L200-F215 HydrophobicContact CD2-CD2 4.46Å; L200-F215 HydrophobicContact CD2-CE2 4.41Å; L200-F215 HydrophobicContact CG-CE2 4.31Å; L200-F237 HydrophobicContact CD1-CD2 4.12Å; L200-F237 HydrophobicContact CD1-CE2 3.52Å; L200-F237 HydrophobicContact CD1-CZ 4.01Å
201	K	90.9	Very high	93.6	Very high	118 Å²	118	43.2 Å²	43.2	51%	0.513	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	6.2	175.7	-56	176.7	-168.2	151.8	0	113.5	E198 L199	E198-K201 VanDerWaalsContact CD-NZ 3.33Å; E198-K201 WeakPolarHBondContact O-CB 3.36Å; E198-K201 PolarHBondContact O-N 3.31Å; E198-K201 IonicContact OE1-NZ 3.22Å; E198-K201 PolarHBondContact OE1-NZ 3.31Å; E198-K201 VanDerWaalsContact OE1-NZ 3.09Å; E198-K201 IonicContact OE2-NZ 3.49Å; E198-K201 PolarHBondContact OE2-NZ 2.88Å; L199-K201 PolarHBondContact O-N 2.99Å
202	S	92.6	Very high	93.8	Very high	22 Å²	22	41.5 Å²	41.5	15%	0.154	22%	0.218	C	C	.	.			trans	-61.3	141.2	-179.9	-179	0	0	0	0	111.4	L199 L200 F204 Q208	L199-S202 WeakPolarHBondContact O-CB 3.38Å; L199-S202 PolarHBondContact O-N 3.19Å; L199-S202 VanDerWaalsContact O-N 3.09Å; L200-S202 VanDerWaalsContact C-N 3.33Å; S202-F204 PolarHBondContact O-N 3.42Å; S202-F204 PolarHBondContact OG-N 2.95Å; S202-Q208 VanDerWaalsContact O-CD 3.31Å; S202-Q208 PolarHBondContact O-NE2 3.13Å
203	D	90.4	Very high	93.8	Very high	157 Å²	157	44.6 Å²	44.6	84%	0.84	23%	0.232	S	C	*	.	S	Bend	trans	-69.6	-6.6	172.2	-63.2	-44.4	0	0	0	112.7
204	F	92.4	Very high	93.9	Very high	107 Å²	107	44.5 Å²	44.5	47%	0.469	23%	0.232	S	C	.	.			trans	-106.3	111.6	-177.5	-58.8	-85.1	0	0	0	111.5	P164 S202 V206 I207 Q208	P164-F204 HydrophobicContact CB-CD1 4.46Å; P164-F204 HydrophobicContact CB-CD2 3.8Å; P164-F204 HydrophobicContact CB-CE1 4.24Å; P164-F204 HydrophobicContact CB-CE2 3.55Å; P164-F204 HydrophobicContact CB-CG 4.25Å; P164-F204 HydrophobicContact CB-CZ 3.78Å; P164-F204 HydrophobicContact CG-CE1 4.28Å; P164-F204 HydrophobicContact CG-CE2 3.97Å; P164-F204 HydrophobicContact CG-CZ 3.76Å; S202-F204 PolarHBondContact O-N 3.42Å; S202-F204 PolarHBondContact OG-N 2.95Å; F204-V206 VanDerWaalsContact C-N 3.28Å; F204-V206 PolarHBondContact O-N 3.31Å; F204-I207 HydrophobicContact CB-CB 4.32Å; F204-I207 HydrophobicContact CB-CD1 3.94Å; F204-I207 HydrophobicContact CB-CG1 4.05Å; F204-I207 HydrophobicContact CD2-CD1 4.13Å; F204-I207 HydrophobicContact CG-CD1 4.3Å; F204-I207 WeakPolarHBondContact O-CB 3.5Å; F204-I207 PolarHBondContact O-N 3.09Å; F204-Q208 PolarHBondContact O-N 3.06Å
205	P	90.9	Very high	93.9	Very high	65 Å²	65	42.2 Å²	42.2	42%	0.422	22%	0.217	S	C	.	.	H	α-helix	trans	-57.5	-35.8	-177.7	-28.8	35.8	0	0	0	114.6	I207 Q208 H209	P205-I207 VanDerWaalsContact C-N 3.26Å; P205-I207 PolarHBondContact O-N 3.25Å; P205-Q208 WeakPolarHBondContact O-CB 3.33Å; P205-Q208 PolarHBondContact O-N 3.32Å; P205-Q208 VanDerWaalsContact O-N 3.13Å; P205-H209 PolarHBondContact O-CD2 3.23Å; P205-H209 PolarHBondContact O-N 2.92Å
206	V	93.1	Very high	93.9	Very high	87 Å²	87	43.3 Å²	43.3	53%	0.527	22%	0.22	S	C	.	.	H	α-helix	trans	-60.5	-37.3	178.5	-179.8	0	0	0	0	111.7	K168 F204 L210	K168-V206 HydrophobicContact CG-CG1 3.97Å; F204-V206 VanDerWaalsContact C-N 3.28Å; F204-V206 PolarHBondContact O-N 3.31Å; V206-L210 HydrophobicContact CG1-CD1 4.16Å; V206-L210 WeakPolarHBondContact O-CB 3.49Å; V206-L210 WeakPolarHBondContact O-CG 3.46Å; V206-L210 PolarHBondContact O-N 2.91Å; V206-L210 VanDerWaalsContact O-N 3.11Å
207	I	95.8	Very high	93.7	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-42.6	177	-66.7	-178.7	0	0	0	109.9	P164 A167 K168 L171 L199 F204 P205 L210 A211	P164-I207 HydrophobicContact CB-CD1 4.05Å; A167-I207 HydrophobicContact CB-CD1 4.29Å; K168-I207 HydrophobicContact CB-CD1 4.49Å; K168-I207 HydrophobicContact CB-CG1 4.02Å; L171-I207 HydrophobicContact CD1-CB 4.32Å; L171-I207 HydrophobicContact CD1-CG2 3.73Å; L199-I207 HydrophobicContact CB-CG2 4.05Å; L199-I207 HydrophobicContact CD2-CG2 3.86Å; L199-I207 HydrophobicContact CG-CG2 4.39Å; F204-I207 HydrophobicContact CB-CB 4.32Å; F204-I207 HydrophobicContact CB-CD1 3.94Å; F204-I207 HydrophobicContact CB-CG1 4.05Å; F204-I207 HydrophobicContact CD2-CD1 4.13Å; F204-I207 HydrophobicContact CG-CD1 4.3Å; F204-I207 WeakPolarHBondContact O-CB 3.5Å; F204-I207 PolarHBondContact O-N 3.09Å; P205-I207 VanDerWaalsContact C-N 3.26Å; P205-I207 PolarHBondContact O-N 3.25Å; I207-L210 PolarHBondContact O-N 3.16Å; I207-A211 WeakPolarHBondContact O-CB 3.44Å; I207-A211 PolarHBondContact O-N 2.98Å
208	Q	94.3	Very high	93.5	Very high	12 Å²	12	44 Å²	44	6%	0.056	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-48.1	177.7	-62	175	-53.2	0	0	111.4	L200 S202 F204 P205 A211 L212 L249	L200-Q208 PolarHBondContact O-NE2 3.31Å; S202-Q208 VanDerWaalsContact O-CD 3.31Å; S202-Q208 PolarHBondContact O-NE2 3.13Å; F204-Q208 PolarHBondContact O-N 3.06Å; P205-Q208 WeakPolarHBondContact O-CB 3.33Å; P205-Q208 PolarHBondContact O-N 3.32Å; P205-Q208 VanDerWaalsContact O-N 3.13Å; Q208-A211 PolarHBondContact O-N 3.35Å; Q208-L212 WeakPolarHBondContact O-CG 3.23Å; Q208-L212 PolarHBondContact O-N 2.92Å; Q208-L249 HydrophobicContact CB-CD1 3.86Å; Q208-L249 HydrophobicContact CB-CD2 4.17Å; Q208-L249 HydrophobicContact CG-CD1 4.38Å
209	H	93.5	Very high	93.3	Very high	51 Å²	51	39.1 Å²	39.1	24%	0.236	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-47.6	177.1	-78.1	-71.4	0	0	0	112.4	P205 A211 L212 Q213 D248 L249 E252	P205-H209 PolarHBondContact O-CD2 3.23Å; P205-H209 PolarHBondContact O-N 2.92Å; H209-A211 VanDerWaalsContact C-N 3.33Å; H209-A211 PolarHBondContact O-N 3.31Å; H209-L212 PolarHBondContact O-N 3.42Å; H209-Q213 WeakPolarHBondContact O-CG 3.49Å; H209-Q213 PolarHBondContact O-N 3.28Å; H209-D248 PolarHBondContact CE1-O 3.28Å; H209-L249 VanDerWaalsContact CE1-CD2 3.41Å; H209-L249 WeakPolarHBondContact CE1-CD2 3.14Å; H209-E252 IonicContact CE1-OE1 2.68Å; H209-E252 PolarHBondContact CE1-OE1 3.06Å; H209-E252 IonicContact ND1-OE1 2.71Å; H209-E252 PolarHBondContact ND1-OE1 3.48Å
210	L	95.3	Very high	93	Very high	18 Å²	18	41.8 Å²	41.8	9%	0.094	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-40.9	178.4	-78	169.2	0	0	0	111.9	K168 L171 V206 I207 Q213 I214	K168-L210 HydrophobicContact CG-CD1 3.96Å; L171-L210 HydrophobicContact CB-CB 3.99Å; L171-L210 HydrophobicContact CB-CD1 4.19Å; L171-L210 HydrophobicContact CD1-CB 3.98Å; V206-L210 HydrophobicContact CG1-CD1 4.16Å; V206-L210 WeakPolarHBondContact O-CB 3.49Å; V206-L210 WeakPolarHBondContact O-CG 3.46Å; V206-L210 PolarHBondContact O-N 2.91Å; V206-L210 VanDerWaalsContact O-N 3.11Å; I207-L210 PolarHBondContact O-N 3.16Å; L210-Q213 PolarHBondContact O-N 3.19Å; L210-I214 WeakPolarHBondContact O-CG1 3.48Å; L210-I214 PolarHBondContact O-N 3.41Å
211	A	96.5	Very high	92.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-44.2	174.8	0	0	0	0	0	111.4	L171 L199 L200 I207 Q208 H209 I214 F215	L171-A211 HydrophobicContact CD2-CB 4.47Å; L199-A211 HydrophobicContact CB-CB 4.31Å; L200-A211 HydrophobicContact CD2-CB 4.01Å; I207-A211 WeakPolarHBondContact O-CB 3.44Å; I207-A211 PolarHBondContact O-N 2.98Å; Q208-A211 PolarHBondContact O-N 3.35Å; H209-A211 VanDerWaalsContact C-N 3.33Å; H209-A211 PolarHBondContact O-N 3.31Å; A211-I214 PolarHBondContact O-N 3.13Å; A211-F215 WeakPolarHBondContact O-CD2 3.45Å; A211-F215 PolarHBondContact O-N 2.99Å
212	L	95.4	Very high	92.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.2	-39.2	176.3	-70.1	168.9	0	0	0	112.6	L200 Q208 H209 F215 Q216 F237 L240 L249 E252 A253	L200-L212 HydrophobicContact CD2-CD2 3.67Å; L200-L212 HydrophobicContact CD2-CG 3.73Å; Q208-L212 WeakPolarHBondContact O-CG 3.23Å; Q208-L212 PolarHBondContact O-N 2.92Å; H209-L212 PolarHBondContact O-N 3.42Å; L212-F215 WeakPolarHBondContact O-CA 3.46Å; L212-F215 WeakPolarHBondContact O-CB 3.47Å; L212-F215 PolarHBondContact O-N 3.43Å; L212-F215 VanDerWaalsContact O-N 3.13Å; L212-Q216 WeakPolarHBondContact O-CG 3.39Å; L212-Q216 PolarHBondContact O-N 3.45Å; L212-F237 HydrophobicContact CD2-CD1 4.31Å; L212-F237 HydrophobicContact CD2-CE1 3.37Å; L212-F237 HydrophobicContact CD2-CZ 3.59Å; L212-L240 HydrophobicContact CD2-CD1 4.48Å; L212-L249 HydrophobicContact CD1-CB 3.79Å; L212-L249 HydrophobicContact CD1-CD1 4.41Å; L212-L249 HydrophobicContact CD1-CD2 4.05Å; L212-L249 HydrophobicContact CD1-CG 4.3Å; L212-E252 HydrophobicContact CB-CB 3.8Å; L212-E252 HydrophobicContact CD1-CB 4.1Å; L212-E252 HydrophobicContact CG-CB 4.47Å; L212-A253 HydrophobicContact CD2-CB 4.3Å
213	Q	94.1	Very high	92.4	Very high	65 Å²	65	46 Å²	46	30%	0.304	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-41.2	174.8	-74.7	179.5	-32.6	0	0	112	F175 H209 L210 F215 Q216 C217	F175-Q213 HydrophobicContact CD2-CB 3.93Å; F175-Q213 HydrophobicContact CE2-CB 3.74Å; F175-Q213 HydrophobicContact CZ-CB 4.46Å; H209-Q213 WeakPolarHBondContact O-CG 3.49Å; H209-Q213 PolarHBondContact O-N 3.28Å; L210-Q213 PolarHBondContact O-N 3.19Å; Q213-F215 VanDerWaalsContact C-N 3.32Å; Q213-Q216 WeakPolarHBondContact O-CB 3.33Å; Q213-Q216 PolarHBondContact O-N 3.05Å; Q213-C217 PolarHBondContact O-N 3.11Å
214	I	94.8	Very high	92.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-42.1	171.9	-65.7	163.8	0	0	0	110	L171 I174 F175 L187 L196 L210 A211 Q216 C217 V218	L171-I214 HydrophobicContact CB-CD1 4.26Å; L171-I214 HydrophobicContact CD2-CD1 3.49Å; L171-I214 VanDerWaalsContact CD2-CD1 3.49Å; L171-I214 HydrophobicContact CG-CD1 4.5Å; I174-I214 HydrophobicContact CB-CD1 4.21Å; I174-I214 HydrophobicContact CG2-CD1 3.92Å; I174-I214 HydrophobicContact CG2-CG1 4.44Å; I174-I214 HydrophobicContact CG2-CG2 4.38Å; F175-I214 HydrophobicContact CB-CD1 4.27Å; F175-I214 HydrophobicContact CB-CG1 3.8Å; F175-I214 HydrophobicContact CD2-CG1 4.14Å; F175-I214 HydrophobicContact CG-CG1 4.47Å; L187-I214 HydrophobicContact CD1-CG2 4.49Å; L196-I214 HydrophobicContact CD1-CG2 3.75Å; L196-I214 HydrophobicContact CD2-CD1 4.02Å; L196-I214 HydrophobicContact CD2-CG2 4.3Å; L210-I214 WeakPolarHBondContact O-CG1 3.48Å; L210-I214 PolarHBondContact O-N 3.41Å; A211-I214 PolarHBondContact O-N 3.13Å; I214-Q216 VanDerWaalsContact C-N 3.29Å; I214-Q216 PolarHBondContact O-N 3.3Å; I214-C217 WeakPolarHBondContact O-CB 3.35Å; I214-C217 PolarHBondContact O-N 2.81Å; I214-V218 HydrophobicContact CG2-CG1 4.01Å; I214-V218 WeakPolarHBondContact O-CG1 3.3Å; I214-V218 PolarHBondContact O-N 3.2Å
215	F	95.1	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-36.8	176.9	-83.3	-60.2	0	0	0	113.2	I193 L196 L197 L200 A211 L212 Q213 C217 V218 T219 F228 F237 T256	I193-F215 HydrophobicContact CG2-CE1 4.33Å; L196-F215 HydrophobicContact CB-CE1 4.24Å; L196-F215 HydrophobicContact CB-CE2 3.7Å; L196-F215 HydrophobicContact CB-CZ 3.42Å; L196-F215 VanDerWaalsContact CB-CZ 3.42Å; L197-F215 HydrophobicContact CB-CZ 4.4Å; L197-F215 HydrophobicContact CD2-CE1 4.16Å; L197-F215 HydrophobicContact CD2-CE2 4.1Å; L197-F215 HydrophobicContact CD2-CZ 3.58Å; L197-F215 HydrophobicContact CG-CE1 4.35Å; L197-F215 HydrophobicContact CG-CZ 3.7Å; L200-F215 HydrophobicContact CD1-CE2 4.14Å; L200-F215 HydrophobicContact CD2-CD2 4.46Å; L200-F215 HydrophobicContact CD2-CE2 4.41Å; L200-F215 HydrophobicContact CG-CE2 4.31Å; A211-F215 WeakPolarHBondContact O-CD2 3.45Å; A211-F215 PolarHBondContact O-N 2.99Å; L212-F215 WeakPolarHBondContact O-CA 3.46Å; L212-F215 WeakPolarHBondContact O-CB 3.47Å; L212-F215 PolarHBondContact O-N 3.43Å; L212-F215 VanDerWaalsContact O-N 3.13Å; Q213-F215 VanDerWaalsContact C-N 3.32Å; F215-C217 VanDerWaalsContact C-N 3.3Å; F215-C217 PolarHBondContact O-N 3.33Å; F215-V218 HydrophobicContact CD1-CG2 3.88Å; F215-T219 WeakPolarHBondContact O-CB 3.4Å; F215-T219 VanDerWaalsContact O-CG2 3.28Å; F215-T219 WeakPolarHBondContact O-CG2 3.46Å; F215-T219 PolarHBondContact O-N 3.37Å; F215-T219 PolarHBondContact O-OG1 3.04Å; F215-F228 AromaticContact CD1-CD2 3.84Å; F215-F228 HydrophobicContact CD1-CD2 3.84Å; F215-F228 AromaticContact CD1-CE2 3.72Å; F215-F228 HydrophobicContact CD1-CE2 3.72Å; F215-F228 AromaticContact CE1-CD2 3.67Å; F215-F228 HydrophobicContact CE1-CD2 3.67Å; F215-F228 AromaticContact CE1-CE2 3.72Å; F215-F228 HydrophobicContact CE1-CE2 3.72Å; F215-F228 HydrophobicContact CG-CE2 4.5Å; F215-F228 HydrophobicContact CZ-CE2 4.45Å; F215-F237 HydrophobicContact CB-CZ 3.9Å; F215-F237 HydrophobicContact CD1-CZ 4.45Å; F215-F237 HydrophobicContact CD2-CE2 4.1Å; F215-F237 AromaticContact CD2-CZ 3.66Å; F215-F237 HydrophobicContact CD2-CZ 3.66Å; F215-F237 HydrophobicContact CE2-CE2 4.31Å; F215-F237 HydrophobicContact CE2-CZ 4.31Å; F215-F237 HydrophobicContact CG-CE2 4.29Å; F215-F237 AromaticContact CG-CZ 3.75Å; F215-F237 HydrophobicContact CG-CZ 3.75Å; F215-T256 HydrophobicContact CB-CG2 3.83Å
216	Q	93.1	Very high	92	Very high	54 Å²	54	36.4 Å²	36.4	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-61.7	-38	173.5	-70.1	176.4	11.8	0	0	112.3	L212 Q213 I214 T219 T220 E252 Q255 N259	L212-Q216 WeakPolarHBondContact O-CG 3.39Å; L212-Q216 PolarHBondContact O-N 3.45Å; Q213-Q216 WeakPolarHBondContact O-CB 3.33Å; Q213-Q216 PolarHBondContact O-N 3.05Å; I214-Q216 VanDerWaalsContact C-N 3.29Å; I214-Q216 PolarHBondContact O-N 3.3Å; Q216-T219 PolarHBondContact O-OG1 3.48Å; Q216-T220 WeakPolarHBondContact O-CG2 3.21Å; Q216-E252 PolarHBondContact NE2-O 3.16Å; Q216-Q255 HydrophobicContact CG-CB 4.37Å; Q216-Q255 HydrophobicContact CG-CG 4.2Å; Q216-N259 PolarHBondContact O-ND2 2.9Å; Q216-N259 VanDerWaalsContact O-ND2 3.14Å
217	C	91.5	Very high	91.8	Very high	22 Å²	22	33.1 Å²	33.1	15%	0.149	17%	0.166	C	C	.	.	H	α-helix	trans	-71	-52.4	176.4	-64.1	0	0	0	0	111.5	V178 Q179 Q213 I214 F215 T219 T220	V178-C217 HydrophobicContact CG2-CB 3.95Å; Q179-C217 PolarHBondContact NE2-SG 3.48Å; Q179-C217 VanDerWaalsContact NE2-SG 3.38Å; Q213-C217 PolarHBondContact O-N 3.11Å; I214-C217 WeakPolarHBondContact O-CB 3.35Å; I214-C217 PolarHBondContact O-N 2.81Å; F215-C217 VanDerWaalsContact C-N 3.3Å; F215-C217 PolarHBondContact O-N 3.33Å; C217-T219 VanDerWaalsContact C-N 3.31Å; C217-T219 PolarHBondContact O-N 3.5Å; C217-T220 WeakPolarHBondContact O-CB 3.28Å; C217-T220 PolarHBondContact O-N 3.23Å; C217-T220 VanDerWaalsContact O-N 3.11Å; C217-T220 PolarHBondContact O-OG1 2.97Å
218	V	90.8	Very high	91.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.2	-34.6	-176.2	-53.9	0	0	0	0	111.5	L184 L187 I214 F215 T220 D221 T224	L184-V218 HydrophobicContact CD2-CB 4.47Å; L184-V218 HydrophobicContact CD2-CG1 3.98Å; L187-V218 HydrophobicContact CD1-CG1 4.05Å; L187-V218 HydrophobicContact CD2-CG1 3.93Å; I214-V218 HydrophobicContact CG2-CG1 4.01Å; I214-V218 WeakPolarHBondContact O-CG1 3.3Å; I214-V218 PolarHBondContact O-N 3.2Å; F215-V218 HydrophobicContact CD1-CG2 3.88Å; V218-T220 PolarHBondContact O-N 3.41Å; V218-D221 PolarHBondContact O-N 3.48Å; V218-D221 VanDerWaalsContact O-N 3.1Å; V218-T224 HydrophobicContact CB-CG2 4.3Å; V218-T224 PolarHBondContact O-OG1 2.88Å
219	T	90.5	Very high	91.4	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-2.1	178	54.4	0	0	0	0	114.5	F215 Q216 C217 R225 F228 T256 N259 C260	F215-T219 WeakPolarHBondContact O-CB 3.4Å; F215-T219 VanDerWaalsContact O-CG2 3.28Å; F215-T219 WeakPolarHBondContact O-CG2 3.46Å; F215-T219 PolarHBondContact O-N 3.37Å; F215-T219 PolarHBondContact O-OG1 3.04Å; Q216-T219 PolarHBondContact O-OG1 3.48Å; C217-T219 VanDerWaalsContact C-N 3.31Å; C217-T219 PolarHBondContact O-N 3.5Å; T219-R225 WeakPolarHBondContact O-CD 3.5Å; T219-R225 WeakPolarHBondContact O-CG 3.36Å; T219-R225 PolarHBondContact O-NH1 3.24Å; T219-F228 HydrophobicContact CG2-CG 4.46Å; T219-T256 HydrophobicContact CG2-CG2 3.59Å; T219-N259 PolarHBondContact OG1-ND2 3.22Å; T219-N259 VanDerWaalsContact OG1-ND2 3.07Å; T219-C260 VanDerWaalsContact CG2-SG 3.53Å
220	T	88.8	Confident	91.2	Very high	80 Å²	80	36.9 Å²	36.9	49%	0.491	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-24.1	170	67.8	0	0	0	0	113.4	Q216 C217 V218 R225	Q216-T220 WeakPolarHBondContact O-CG2 3.21Å; C217-T220 WeakPolarHBondContact O-CB 3.28Å; C217-T220 PolarHBondContact O-N 3.23Å; C217-T220 VanDerWaalsContact O-N 3.11Å; C217-T220 PolarHBondContact O-OG1 2.97Å; V218-T220 PolarHBondContact O-N 3.41Å; T220-R225 PolarHBondContact O-NH1 3.35Å
221	D	88.4	Confident	91	Very high	50 Å²	50	40 Å²	40	27%	0.267	20%	0.196	S	C	.	.	S	Bend	trans	-90.9	149.7	178.6	166.1	66.5	0	0	0	112.2	L184 V218 E223 T224 R225	L184-D221 HydrophobicContact CB-CB 4.31Å; L184-D221 HydrophobicContact CD1-CB 3.76Å; V218-D221 PolarHBondContact O-N 3.48Å; V218-D221 VanDerWaalsContact O-N 3.1Å; D221-E223 PolarHBondContact OD2-N 3.14Å; D221-T224 WeakPolarHBondContact CB-OG1 3.31Å; D221-T224 PolarHBondContact O-OG1 2.95Å; D221-T224 PolarHBondContact OD2-N 3.13Å; D221-T224 PolarHBondContact OD2-OG1 3.43Å; D221-R225 VanDerWaalsContact O-CB 3.29Å; D221-R225 WeakPolarHBondContact O-CB 3.47Å; D221-R225 WeakPolarHBondContact O-CG 3.43Å; D221-R225 PolarHBondContact O-N 3.02Å; D221-R225 PolarHBondContact O-NH1 3.46Å
222	L	87.4	Confident	90.6	Very high	101 Å²	101	44.5 Å²	44.5	53%	0.529	22%	0.22	S	C	.	.	H	α-helix	trans	-74.9	-44.1	-172.2	-176.8	67.3	0	0	0	113	R225 K226	L222-R225 PolarHBondContact O-N 3.29Å; L222-K226 PolarHBondContact O-N 3.1Å; L222-K226 VanDerWaalsContact O-N 3.12Å
223	E	87.6	Confident	90.3	Very high	90 Å²	90	44.5 Å²	44.5	42%	0.421	22%	0.22	S	C	.	.	H	α-helix	trans	-72.7	-45.4	-175.6	-65.8	-59.5	146.2	0	0	110.7	D221 R225 K226 T227	D221-E223 PolarHBondContact OD2-N 3.14Å; E223-R225 VanDerWaalsContact C-N 3.34Å; E223-R225 PolarHBondContact O-N 3.38Å; E223-K226 WeakPolarHBondContact O-CB 3.38Å; E223-K226 PolarHBondContact O-N 3.2Å; E223-T227 PolarHBondContact O-N 3.4Å; E223-T227 PolarHBondContact O-OG1 3.31Å
224	T	87.4	Confident	90	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-39.4	172.2	46.3	0	0	0	0	112.8	L184 H188 I193 V218 D221 K226 T227 F228	L184-T224 WeakPolarHBondContact O-CG2 3.16Å; H188-T224 HydrophobicContact CB-CG2 3.74Å; I193-T224 WeakPolarHBondContact CD1-O 3.43Å; V218-T224 HydrophobicContact CB-CG2 4.3Å; V218-T224 PolarHBondContact O-OG1 2.88Å; D221-T224 WeakPolarHBondContact CB-OG1 3.31Å; D221-T224 PolarHBondContact O-OG1 2.95Å; D221-T224 PolarHBondContact OD2-N 3.13Å; D221-T224 PolarHBondContact OD2-OG1 3.43Å; T224-K226 VanDerWaalsContact C-N 3.3Å; T224-K226 PolarHBondContact O-N 2.94Å; T224-T227 PolarHBondContact O-N 2.88Å; T224-F228 WeakPolarHBondContact O-CB 3.33Å; T224-F228 PolarHBondContact O-N 3.17Å
225	R	89.3	Confident	89.6	Confident	40 Å²	40	43.4 Å²	43.4	15%	0.151	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-38	171.4	-87.8	-163.5	-56.3	-86.2	-3.6	112.8	T219 T220 D221 L222 E223 F228 R229	T219-R225 WeakPolarHBondContact O-CD 3.5Å; T219-R225 WeakPolarHBondContact O-CG 3.36Å; T219-R225 PolarHBondContact O-NH1 3.24Å; T220-R225 PolarHBondContact O-NH1 3.35Å; D221-R225 VanDerWaalsContact O-CB 3.29Å; D221-R225 WeakPolarHBondContact O-CB 3.47Å; D221-R225 WeakPolarHBondContact O-CG 3.43Å; D221-R225 PolarHBondContact O-N 3.02Å; D221-R225 PolarHBondContact O-NH1 3.46Å; L222-R225 PolarHBondContact O-N 3.29Å; E223-R225 VanDerWaalsContact C-N 3.34Å; E223-R225 PolarHBondContact O-N 3.38Å; R225-F228 WeakPolarHBondContact O-CB 3.43Å; R225-F228 PolarHBondContact O-N 3.05Å; R225-R229 PolarHBondContact O-N 2.93Å
226	K	88.6	Confident	89.4	Confident	88 Å²	88	48 Å²	48	38%	0.383	23%	0.232	S	C	.	.	H	α-helix	trans	-65	-46.7	177.6	176.1	-178.2	171.4	-165.1	0	111	L222 E223 T224 F228 R229 E230	L222-K226 PolarHBondContact O-N 3.1Å; L222-K226 VanDerWaalsContact O-N 3.12Å; E223-K226 WeakPolarHBondContact O-CB 3.38Å; E223-K226 PolarHBondContact O-N 3.2Å; T224-K226 VanDerWaalsContact C-N 3.3Å; T224-K226 PolarHBondContact O-N 2.94Å; K226-F228 VanDerWaalsContact C-N 3.32Å; K226-F228 PolarHBondContact O-N 3.37Å; K226-R229 WeakPolarHBondContact O-CB 3.5Å; K226-R229 PolarHBondContact O-N 3.4Å; K226-R229 VanDerWaalsContact O-N 3.15Å; K226-E230 WeakPolarHBondContact CE-OE1 3.48Å; K226-E230 WeakPolarHBondContact O-CG 3.28Å; K226-E230 PolarHBondContact O-N 3.48Å
227	T	89.8	Confident	89.3	Confident	19 Å²	19	45.4 Å²	45.4	12%	0.117	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-38	175	-54.7	0	0	0	0	112	H188 I193 E223 T224 R229 E230 E231	H188-T227 PolarHBondContact CD2-OG1 3.2Å; H188-T227 PolarHBondContact NE2-OG1 3.03Å; H188-T227 VanDerWaalsContact NE2-OG1 3.16Å; I193-T227 HydrophobicContact CB-CG2 4.29Å; I193-T227 HydrophobicContact CD1-CG2 3.97Å; I193-T227 HydrophobicContact CG1-CG2 4.4Å; E223-T227 PolarHBondContact O-N 3.4Å; E223-T227 PolarHBondContact O-OG1 3.31Å; T224-T227 PolarHBondContact O-N 2.88Å; T227-R229 VanDerWaalsContact C-N 3.26Å; T227-R229 PolarHBondContact O-N 3.2Å; T227-E230 PolarHBondContact O-N 2.98Å; T227-E231 HydrophobicContact CG2-CG 4.37Å; T227-E231 WeakPolarHBondContact O-CB 3.29Å; T227-E231 WeakPolarHBondContact O-CG 3.5Å; T227-E231 PolarHBondContact O-N 3.41Å
228	F	91.3	Very high	89.2	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.009	22%	0.216	C	C	.	.	H	α-helix	trans	-57.2	-41.1	172.8	-178	-98.4	0	0	0	112.1	I193 L197 F215 T219 T224 R225 K226 G233 F234 F237 T256	I193-F228 HydrophobicContact CD1-CB 3.95Å; I193-F228 HydrophobicContact CG2-CD2 4.39Å; L197-F228 HydrophobicContact CD2-CE2 3.99Å; F215-F228 AromaticContact CD1-CD2 3.84Å; F215-F228 HydrophobicContact CD1-CD2 3.84Å; F215-F228 AromaticContact CD1-CE2 3.72Å; F215-F228 HydrophobicContact CD1-CE2 3.72Å; F215-F228 AromaticContact CE1-CD2 3.67Å; F215-F228 HydrophobicContact CE1-CD2 3.67Å; F215-F228 AromaticContact CE1-CE2 3.72Å; F215-F228 HydrophobicContact CE1-CE2 3.72Å; F215-F228 HydrophobicContact CG-CE2 4.5Å; F215-F228 HydrophobicContact CZ-CE2 4.45Å; T219-F228 HydrophobicContact CG2-CG 4.46Å; T224-F228 WeakPolarHBondContact O-CB 3.33Å; T224-F228 PolarHBondContact O-N 3.17Å; R225-F228 WeakPolarHBondContact O-CB 3.43Å; R225-F228 PolarHBondContact O-N 3.05Å; K226-F228 VanDerWaalsContact C-N 3.32Å; K226-F228 PolarHBondContact O-N 3.37Å; F228-G233 VanDerWaalsContact CZ-CA 3.49Å; F228-G233 WeakPolarHBondContact CZ-O 3.13Å; F228-G233 WeakPolarHBondContact O-CA 3.4Å; F228-G233 PolarHBondContact O-N 3.22Å; F228-F234 HydrophobicContact CD1-CD2 4.27Å; F228-F234 HydrophobicContact CD1-CE1 4.31Å; F228-F234 AromaticContact CD1-CE2 3.68Å; F228-F234 HydrophobicContact CD1-CE2 3.68Å; F228-F234 AromaticContact CD1-CZ 3.65Å; F228-F234 HydrophobicContact CD1-CZ 3.65Å; F228-F234 HydrophobicContact CE1-CD1 4.13Å; F228-F234 HydrophobicContact CE1-CD2 4.14Å; F228-F234 AromaticContact CE1-CE1 3.82Å; F228-F234 HydrophobicContact CE1-CE1 3.82Å; F228-F234 AromaticContact CE1-CE2 3.86Å; F228-F234 HydrophobicContact CE1-CE2 3.86Å; F228-F234 HydrophobicContact CE1-CG 4.23Å; F228-F234 AromaticContact CE1-CZ 3.64Å; F228-F234 HydrophobicContact CE1-CZ 3.64Å; F228-F237 HydrophobicContact CE2-CD2 4.09Å; F228-F237 AromaticContact CE2-CE2 3.65Å; F228-F237 HydrophobicContact CE2-CE2 3.65Å; F228-F237 HydrophobicContact CE2-CZ 4.3Å; F228-F237 AromaticContact CZ-CD2 3.68Å; F228-F237 HydrophobicContact CZ-CD2 3.68Å; F228-F237 AromaticContact CZ-CE2 3.68Å; F228-F237 HydrophobicContact CZ-CE2 3.68Å; F228-F237 HydrophobicContact CZ-CG 4.3Å; F228-F237 HydrophobicContact CZ-CZ 4.33Å; F228-T256 HydrophobicContact CZ-CG2 4.36Å
229	R	89.4	Confident	89.1	Confident	23 Å²	23	49 Å²	49	9%	0.087	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-45.8	174.3	179.1	175.2	59.3	-108.2	12.2	112.2	R225 K226 T227 E231 L232 F234 D263 E265 T266 I269	R225-R229 PolarHBondContact O-N 2.93Å; K226-R229 WeakPolarHBondContact O-CB 3.5Å; K226-R229 PolarHBondContact O-N 3.4Å; K226-R229 VanDerWaalsContact O-N 3.15Å; T227-R229 VanDerWaalsContact C-N 3.26Å; T227-R229 PolarHBondContact O-N 3.2Å; R229-E231 PolarHBondContact O-N 2.88Å; R229-L232 PolarHBondContact O-N 3.5Å; R229-F234 HydrophobicContact CB-CE2 4.02Å; R229-F234 HydrophobicContact CG-CE2 4.42Å; R229-D263 IonicContact CZ-OD2 3.51Å; R229-D263 IonicContact NH1-OD2 3.58Å; R229-D263 PolarHBondContact NH1-OD2 3.3Å; R229-E265 IonicContact CZ-OE2 2.86Å; R229-E265 IonicContact NE-OE2 2.77Å; R229-E265 IonicContact NH2-OE2 3.09Å; R229-E265 PolarHBondContact NH2-OE2 3.02Å; R229-T266 PolarHBondContact NH1-OG1 3.26Å; R229-T266 VanDerWaalsContact NH1-OG1 3.11Å; R229-I269 HydrophobicContact CG-CD1 3.66Å
230	E	89.6	Confident	89.2	Confident	122 Å²	122	49.4 Å²	49.4	57%	0.57	24%	0.24	S	C	*	.	H	α-helix	trans	-61.8	-32.4	179.7	-71.4	173.4	176.8	0	0	112.4	K226 T227 L232	K226-E230 WeakPolarHBondContact CE-OE1 3.48Å; K226-E230 WeakPolarHBondContact O-CG 3.28Å; K226-E230 PolarHBondContact O-N 3.48Å; T227-E230 PolarHBondContact O-N 2.98Å; E230-L232 VanDerWaalsContact C-N 3.29Å; E230-L232 PolarHBondContact O-N 3.11Å
231	E	90.7	Very high	89.2	Confident	83 Å²	83	45.7 Å²	45.7	39%	0.388	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	15	178.6	-66.5	-64.1	158.5	0	0	114.3	I193 P194 L197 T227 R229 G233	I193-E231 HydrophobicContact CG2-CB 4.16Å; I193-E231 HydrophobicContact CG2-CG 4.24Å; P194-E231 HydrophobicContact CG-CG 3.97Å; L197-E231 HydrophobicContact CD1-CB 3.87Å; T227-E231 HydrophobicContact CG2-CG 4.37Å; T227-E231 WeakPolarHBondContact O-CB 3.29Å; T227-E231 WeakPolarHBondContact O-CG 3.5Å; T227-E231 PolarHBondContact O-N 3.41Å; R229-E231 PolarHBondContact O-N 2.88Å; E231-G233 PolarHBondContact O-N 3.13Å
232	L	88.9	Confident	89.2	Confident	95 Å²	95	47.3 Å²	47.3	50%	0.497	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	34.4	-179.3	-53.5	175.6	0	0	0	113.1	R229 E230 F234 E235 R236	R229-L232 PolarHBondContact O-N 3.5Å; E230-L232 VanDerWaalsContact C-N 3.29Å; E230-L232 PolarHBondContact O-N 3.11Å; L232-F234 VanDerWaalsContact C-N 3.26Å; L232-F234 PolarHBondContact O-N 3.45Å; L232-E235 VanDerWaalsContact C-OE2 3.23Å; L232-E235 WeakPolarHBondContact CA-OE2 3.41Å; L232-E235 WeakPolarHBondContact CB-OE2 3.43Å; L232-E235 PolarHBondContact O-N 3.27Å; L232-R236 WeakPolarHBondContact O-CG 3.21Å; L232-R236 PolarHBondContact O-N 3.39Å
233	G	89.9	Confident	89.3	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-35.9	-178.1	0	0	0	0	0	112.7	F228 E231 R236 F237	F228-G233 VanDerWaalsContact CZ-CA 3.49Å; F228-G233 WeakPolarHBondContact CZ-O 3.13Å; F228-G233 WeakPolarHBondContact O-CA 3.4Å; F228-G233 PolarHBondContact O-N 3.22Å; E231-G233 PolarHBondContact O-N 3.13Å; G233-R236 PolarHBondContact O-N 3.4Å; G233-F237 WeakPolarHBondContact O-CD2 3.21Å; G233-F237 PolarHBondContact O-N 2.99Å
234	F	86.4	Confident	89.2	Confident	4 Å²	4	45 Å²	45	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-49.5	178.3	-69.8	-71	0	0	0	112.6	F228 R229 L232 R236 F237 L238 C260 T266 I270	F228-F234 HydrophobicContact CD1-CD2 4.27Å; F228-F234 HydrophobicContact CD1-CE1 4.31Å; F228-F234 AromaticContact CD1-CE2 3.68Å; F228-F234 HydrophobicContact CD1-CE2 3.68Å; F228-F234 AromaticContact CD1-CZ 3.65Å; F228-F234 HydrophobicContact CD1-CZ 3.65Å; F228-F234 HydrophobicContact CE1-CD1 4.13Å; F228-F234 HydrophobicContact CE1-CD2 4.14Å; F228-F234 AromaticContact CE1-CE1 3.82Å; F228-F234 HydrophobicContact CE1-CE1 3.82Å; F228-F234 AromaticContact CE1-CE2 3.86Å; F228-F234 HydrophobicContact CE1-CE2 3.86Å; F228-F234 HydrophobicContact CE1-CG 4.23Å; F228-F234 AromaticContact CE1-CZ 3.64Å; F228-F234 HydrophobicContact CE1-CZ 3.64Å; R229-F234 HydrophobicContact CB-CE2 4.02Å; R229-F234 HydrophobicContact CG-CE2 4.42Å; L232-F234 VanDerWaalsContact C-N 3.26Å; L232-F234 PolarHBondContact O-N 3.45Å; F234-R236 VanDerWaalsContact C-N 3.26Å; F234-R236 PolarHBondContact O-N 3.46Å; F234-F237 PolarHBondContact O-N 2.97Å; F234-F237 VanDerWaalsContact O-N 3.16Å; F234-L238 WeakPolarHBondContact O-CG 3.35Å; F234-L238 PolarHBondContact O-N 2.95Å; F234-C260 HydrophobicContact CD1-CB 4.48Å; F234-C260 HydrophobicContact CE1-CB 3.15Å; F234-C260 HydrophobicContact CZ-CB 3.2Å; F234-C260 WeakPolarHBondContact CZ-SG 3.46Å; F234-T266 HydrophobicContact CD1-CG2 4.17Å; F234-T266 HydrophobicContact CD2-CG2 3.99Å; F234-T266 HydrophobicContact CE1-CG2 3.59Å; F234-T266 HydrophobicContact CE2-CG2 3.37Å; F234-T266 HydrophobicContact CG-CG2 4.37Å; F234-T266 HydrophobicContact CZ-CG2 3.17Å; F234-I270 HydrophobicContact CB-CG1 4.37Å; F234-I270 HydrophobicContact CD1-CD1 3.7Å; F234-I270 HydrophobicContact CD1-CG1 4.25Å; F234-I270 HydrophobicContact CE1-CD1 4.14Å; F234-I270 HydrophobicContact CG-CD1 4.1Å; F234-I270 HydrophobicContact CG-CG1 4.15Å
235	E	86.8	Confident	89.1	Confident	38 Å²	38	52.7 Å²	52.7	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-43.4	179.8	-66.7	78.7	-175.9	0	0	110.3	L232 F237 L238 D239 N273	L232-E235 VanDerWaalsContact C-OE2 3.23Å; L232-E235 WeakPolarHBondContact CA-OE2 3.41Å; L232-E235 WeakPolarHBondContact CB-OE2 3.43Å; L232-E235 PolarHBondContact O-N 3.27Å; E235-F237 VanDerWaalsContact C-N 3.34Å; E235-F237 PolarHBondContact O-N 3.07Å; E235-L238 PolarHBondContact O-N 3.42Å; E235-D239 WeakPolarHBondContact O-CB 3.48Å; E235-D239 PolarHBondContact O-N 3.28Å; E235-N273 PolarHBondContact OE1-ND2 3.11Å
236	R	90.3	Very high	88.9	Confident	95 Å²	95	53.8 Å²	53.8	36%	0.358	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-39.4	177.2	-62.4	-60.7	-178.4	82.5	8.3	113	L197 L232 G233 F234 D239 L240	L197-R236 HydrophobicContact CD2-CB 4.48Å; L232-R236 WeakPolarHBondContact O-CG 3.21Å; L232-R236 PolarHBondContact O-N 3.39Å; G233-R236 PolarHBondContact O-N 3.4Å; F234-R236 VanDerWaalsContact C-N 3.26Å; F234-R236 PolarHBondContact O-N 3.46Å; R236-D239 PolarHBondContact O-N 3.14Å; R236-L240 PolarHBondContact O-N 3.32Å; R236-L240 VanDerWaalsContact O-N 3.09Å
237	F	92.1	Very high	88.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-72.6	-38.3	177.7	-86.6	-115.9	0	0	0	111.8	L197 L200 L212 F215 F228 G233 F234 E235 D239 L240 L241 A253 T256 V257	L197-F237 HydrophobicContact CD2-CD2 4.46Å; L197-F237 HydrophobicContact CD2-CE2 3.98Å; L200-F237 HydrophobicContact CD1-CD2 4.12Å; L200-F237 HydrophobicContact CD1-CE2 3.52Å; L200-F237 HydrophobicContact CD1-CZ 4.01Å; L212-F237 HydrophobicContact CD2-CD1 4.31Å; L212-F237 HydrophobicContact CD2-CE1 3.37Å; L212-F237 HydrophobicContact CD2-CZ 3.59Å; F215-F237 HydrophobicContact CB-CZ 3.9Å; F215-F237 HydrophobicContact CD1-CZ 4.45Å; F215-F237 HydrophobicContact CD2-CE2 4.1Å; F215-F237 AromaticContact CD2-CZ 3.66Å; F215-F237 HydrophobicContact CD2-CZ 3.66Å; F215-F237 HydrophobicContact CE2-CE2 4.31Å; F215-F237 HydrophobicContact CE2-CZ 4.31Å; F215-F237 HydrophobicContact CG-CE2 4.29Å; F215-F237 AromaticContact CG-CZ 3.75Å; F215-F237 HydrophobicContact CG-CZ 3.75Å; F228-F237 HydrophobicContact CE2-CD2 4.09Å; F228-F237 AromaticContact CE2-CE2 3.65Å; F228-F237 HydrophobicContact CE2-CE2 3.65Å; F228-F237 HydrophobicContact CE2-CZ 4.3Å; F228-F237 AromaticContact CZ-CD2 3.68Å; F228-F237 HydrophobicContact CZ-CD2 3.68Å; F228-F237 AromaticContact CZ-CE2 3.68Å; F228-F237 HydrophobicContact CZ-CE2 3.68Å; F228-F237 HydrophobicContact CZ-CG 4.3Å; F228-F237 HydrophobicContact CZ-CZ 4.33Å; G233-F237 WeakPolarHBondContact O-CD2 3.21Å; G233-F237 PolarHBondContact O-N 2.99Å; F234-F237 PolarHBondContact O-N 2.97Å; F234-F237 VanDerWaalsContact O-N 3.16Å; E235-F237 VanDerWaalsContact C-N 3.34Å; E235-F237 PolarHBondContact O-N 3.07Å; F237-D239 VanDerWaalsContact C-N 3.31Å; F237-D239 PolarHBondContact O-N 3.14Å; F237-L240 WeakPolarHBondContact O-CB 3.41Å; F237-L240 PolarHBondContact O-N 3.38Å; F237-L241 WeakPolarHBondContact O-CG 3.28Å; F237-L241 PolarHBondContact O-N 2.69Å; F237-A253 HydrophobicContact CD1-CB 3.88Å; F237-A253 HydrophobicContact CE1-CB 4.28Å; F237-T256 HydrophobicContact CD1-CG2 4.13Å; F237-T256 VanDerWaalsContact CE1-CB 3.44Å; F237-T256 HydrophobicContact CE1-CG2 3.52Å; F237-T256 HydrophobicContact CZ-CG2 3.81Å; F237-V257 HydrophobicContact CB-CG2 3.9Å; F237-V257 HydrophobicContact CD1-CG2 4.33Å
238	L	89	Confident	88.7	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-39.1	172.7	-65.9	176.9	0	0	0	111.3	F234 E235 L240 L241 D242 R278 L279	F234-L238 WeakPolarHBondContact O-CG 3.35Å; F234-L238 PolarHBondContact O-N 2.95Å; E235-L238 PolarHBondContact O-N 3.42Å; L238-L240 VanDerWaalsContact C-N 3.28Å; L238-L240 PolarHBondContact O-N 2.77Å; L238-L241 HydrophobicContact CD2-CD1 4.29Å; L238-L241 PolarHBondContact O-N 3.09Å; L238-L241 VanDerWaalsContact O-N 3.15Å; L238-D242 PolarHBondContact O-N 2.67Å; L238-R278 VanDerWaalsContact CB-CZ 3.49Å; L238-R278 PolarHBondContact O-NH2 2.93Å; L238-R278 VanDerWaalsContact O-NH2 3.15Å; L238-L279 HydrophobicContact CD2-CD2 3.83Å; L238-L279 HydrophobicContact CD2-CG 3.95Å
239	D	89.4	Confident	88.7	Confident	85 Å²	85	55.3 Å²	55.3	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-33.7	175.2	-65.1	-13.2	0	0	0	112.2	E235 R236 F237 N243 R278	E235-D239 WeakPolarHBondContact O-CB 3.48Å; E235-D239 PolarHBondContact O-N 3.28Å; R236-D239 PolarHBondContact O-N 3.14Å; F237-D239 VanDerWaalsContact C-N 3.31Å; F237-D239 PolarHBondContact O-N 3.14Å; D239-N243 PolarHBondContact O-N 3.35Å; D239-R278 IonicContact OD1-CZ 3.76Å; D239-R278 IonicContact OD1-NH1 3.43Å; D239-R278 PolarHBondContact OD1-NH1 2.94Å; D239-R278 VanDerWaalsContact OD1-NH1 3.11Å; D239-R278 IonicContact OD1-NH2 3.53Å; D239-R278 PolarHBondContact OD1-NH2 3.16Å
240	L	91	Very high	88.8	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-41.6	172.6	-172	160.8	0	0	0	111.2	L212 R236 F237 L238 N243 F246 L249 H250 A253	L212-L240 HydrophobicContact CD2-CD1 4.48Å; R236-L240 PolarHBondContact O-N 3.32Å; R236-L240 VanDerWaalsContact O-N 3.09Å; F237-L240 WeakPolarHBondContact O-CB 3.41Å; F237-L240 PolarHBondContact O-N 3.38Å; L238-L240 VanDerWaalsContact C-N 3.28Å; L238-L240 PolarHBondContact O-N 2.77Å; L240-N243 PolarHBondContact O-N 2.7Å; L240-F246 HydrophobicContact CD2-CB 4.13Å; L240-F246 HydrophobicContact CG-CB 4.44Å; L240-F246 HydrophobicContact CG-CD2 4.11Å; L240-L249 HydrophobicContact CD1-CD1 4.49Å; L240-L249 HydrophobicContact CD2-CB 4.05Å; L240-H250 PolarHBondContact O-NE2 3.22Å; L240-A253 HydrophobicContact CD2-CB 3.78Å
241	L	90.3	Very high	88.9	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-36.3	177.9	-64.4	174.6	0	0	0	113	F237 L238 N243 H250 A253 L254 L279 F282	F237-L241 WeakPolarHBondContact O-CG 3.28Å; F237-L241 PolarHBondContact O-N 2.69Å; L238-L241 HydrophobicContact CD2-CD1 4.29Å; L238-L241 PolarHBondContact O-N 3.09Å; L238-L241 VanDerWaalsContact O-N 3.15Å; L241-N243 PolarHBondContact O-N 3.48Å; L241-H250 HydrophobicContact CD2-CB 4.02Å; L241-H250 PolarHBondContact O-CE1 3.1Å; L241-H250 VanDerWaalsContact O-CE1 3.31Å; L241-H250 PolarHBondContact O-NE2 3.3Å; L241-A253 HydrophobicContact CD2-CB 4.02Å; L241-L254 HydrophobicContact CD1-CD2 3.57Å; L241-L254 HydrophobicContact CD1-CG 4.21Å; L241-L254 HydrophobicContact CD2-CD2 4.03Å; L241-L254 HydrophobicContact CD2-CG 3.75Å; L241-L254 HydrophobicContact CG-CD2 4.47Å; L241-L279 HydrophobicContact CD1-CD2 4.24Å; L241-F282 HydrophobicContact CB-CD2 4.02Å; L241-F282 HydrophobicContact CB-CE2 4Å; L241-F282 HydrophobicContact CD2-CE2 4.3Å; L241-F282 HydrophobicContact CD2-CZ 4.22Å; L241-F282 WeakPolarHBondContact O-CE2 3.47Å
242	D	88.8	Confident	89	Confident	85 Å²	85	47.3 Å²	47.3	46%	0.455	24%	0.236	S	C	.	.	H	α-helix	trans	-66.1	-24.2	176.4	-75.7	6	0	0	0	112.4	L238 M244 R278	L238-D242 PolarHBondContact O-N 2.67Å; D242-M244 PolarHBondContact O-N 3.1Å; D242-R278 IonicContact OD1-NE 2.73Å; D242-R278 IonicContact OD1-NH2 3Å; D242-R278 IonicContact OD2-CZ 2.86Å; D242-R278 IonicContact OD2-NE 3.21Å; D242-R278 PolarHBondContact OD2-NE 3.02Å; D242-R278 VanDerWaalsContact OD2-NE 3.1Å; D242-R278 IonicContact OD2-NH2 3.51Å; D242-R278 PolarHBondContact OD2-NH2 3.11Å
243	N	88.1	Confident	89.2	Confident	53 Å²	53	42.8 Å²	42.8	28%	0.283	21%	0.212	S	C	.	.			trans	-86.1	103.4	175.3	-169.8	-0.2	0	0	0	111.6	D239 L240 L241 E245 F246 H250	D239-N243 PolarHBondContact O-N 3.35Å; L240-N243 PolarHBondContact O-N 2.7Å; L241-N243 PolarHBondContact O-N 3.48Å; N243-E245 PolarHBondContact O-N 3.26Å; N243-E245 VanDerWaalsContact O-N 3.17Å; N243-E245 WeakPolarHBondContact OD1-CB 3.17Å; N243-E245 PolarHBondContact OD1-N 3.2Å; N243-F246 HydrophobicContact CB-CD2 3.67Å; N243-F246 HydrophobicContact CB-CE2 4Å; N243-F246 WeakPolarHBondContact ND2-CD2 3.34Å; N243-F246 WeakPolarHBondContact ND2-CE2 3.45Å; N243-F246 PolarHBondContact O-N 2.99Å; N243-F246 VanDerWaalsContact O-N 3.09Å; N243-H250 PolarHBondContact O-NE2 3.03Å
244	M	85.2	Confident	89.4	Confident	88 Å²	88	42.8 Å²	42.8	43%	0.433	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-66.7	-13.1	179.2	-61.1	-65.4	144.8	0	0	114.1	D242 F246 F282 A285	D242-M244 PolarHBondContact O-N 3.1Å; M244-F246 PolarHBondContact O-N 2.74Å; M244-F282 HydrophobicContact CE-CD2 4.24Å; M244-F282 HydrophobicContact CE-CE2 4.13Å; M244-A285 HydrophobicContact CE-CB 3.87Å; M244-A285 HydrophobicContact SD-CB 4.34Å
245	E	85.1	Confident	89.7	Confident	163 Å²	163	45.6 Å²	45.6	76%	0.762	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-67.7	-23.3	171.9	-63.3	-175.7	157.9	0	0	112.2	N243 N247	N243-E245 PolarHBondContact O-N 3.26Å; N243-E245 VanDerWaalsContact O-N 3.17Å; N243-E245 WeakPolarHBondContact OD1-CB 3.17Å; N243-E245 PolarHBondContact OD1-N 3.2Å; E245-N247 PolarHBondContact O-N 3.23Å
246	F	85.3	Confident	89.9	Confident	62 Å²	62	43.8 Å²	43.8	27%	0.272	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-96.4	28.9	-179.7	-58.9	-42.5	0	0	0	113.3	L240 N243 M244 D248 L249 H250	L240-F246 HydrophobicContact CD2-CB 4.13Å; L240-F246 HydrophobicContact CG-CB 4.44Å; L240-F246 HydrophobicContact CG-CD2 4.11Å; N243-F246 HydrophobicContact CB-CD2 3.67Å; N243-F246 HydrophobicContact CB-CE2 4Å; N243-F246 WeakPolarHBondContact ND2-CD2 3.34Å; N243-F246 WeakPolarHBondContact ND2-CE2 3.45Å; N243-F246 PolarHBondContact O-N 2.99Å; N243-F246 VanDerWaalsContact O-N 3.09Å; M244-F246 PolarHBondContact O-N 2.74Å; F246-D248 VanDerWaalsContact C-OD1 3.29Å; F246-D248 PolarHBondContact O-N 3.22Å; F246-L249 HydrophobicContact CB-CB 4.27Å; F246-L249 HydrophobicContact CB-CD1 4.11Å; F246-L249 HydrophobicContact CB-CG 4.33Å; F246-L249 HydrophobicContact CD1-CD1 4.12Å; F246-L249 HydrophobicContact CG-CD1 4.22Å; F246-L249 WeakPolarHBondContact O-CA 3.21Å; F246-L249 WeakPolarHBondContact O-CB 3.5Å; F246-L249 PolarHBondContact O-N 3.47Å; F246-H250 PolarHBondContact O-CD2 3.34Å; F246-H250 PolarHBondContact O-N 3.24Å; F246-H250 PolarHBondContact O-NE2 2.93Å
247	N	86.8	Confident	90	Very high	58 Å²	58	39.4 Å²	39.4	31%	0.31	20%	0.201	S	C	.	.	H	α-helix	trans	-55.1	-36.1	-177.3	-166.6	-51.5	0	0	0	112.6	E245 L249 H250 I291	E245-N247 PolarHBondContact O-N 3.23Å; N247-L249 PolarHBondContact O-N 2.97Å; N247-H250 PolarHBondContact O-N 3Å; N247-I291 WeakPolarHBondContact O-CD1 3.42Å; N247-I291 WeakPolarHBondContact OD1-CD1 3.38Å
248	D	87.5	Confident	90	Very high	84 Å²	84	39.4 Å²	39.4	45%	0.449	20%	0.201	S	C	.	.	H	α-helix	trans	-63	-23.9	174.2	56.8	-25.4	0	0	0	114.2	H209 F246	H209-D248 PolarHBondContact CE1-O 3.28Å; F246-D248 VanDerWaalsContact C-OD1 3.29Å; F246-D248 PolarHBondContact O-N 3.22Å
249	L	91	Very high	90	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-96.6	-14.3	178.2	-54.4	-175.8	0	0	0	113.5	Q208 H209 L212 L240 F246 N247 A251 E252 A253	Q208-L249 HydrophobicContact CB-CD1 3.86Å; Q208-L249 HydrophobicContact CB-CD2 4.17Å; Q208-L249 HydrophobicContact CG-CD1 4.38Å; H209-L249 VanDerWaalsContact CE1-CD2 3.41Å; H209-L249 WeakPolarHBondContact CE1-CD2 3.14Å; L212-L249 HydrophobicContact CD1-CB 3.79Å; L212-L249 HydrophobicContact CD1-CD1 4.41Å; L212-L249 HydrophobicContact CD1-CD2 4.05Å; L212-L249 HydrophobicContact CD1-CG 4.3Å; L240-L249 HydrophobicContact CD1-CD1 4.49Å; L240-L249 HydrophobicContact CD2-CB 4.05Å; F246-L249 HydrophobicContact CB-CB 4.27Å; F246-L249 HydrophobicContact CB-CD1 4.11Å; F246-L249 HydrophobicContact CB-CG 4.33Å; F246-L249 HydrophobicContact CD1-CD1 4.12Å; F246-L249 HydrophobicContact CG-CD1 4.22Å; F246-L249 WeakPolarHBondContact O-CA 3.21Å; F246-L249 WeakPolarHBondContact O-CB 3.5Å; F246-L249 PolarHBondContact O-N 3.47Å; N247-L249 PolarHBondContact O-N 2.97Å; L249-A251 VanDerWaalsContact C-N 3.28Å; L249-A251 PolarHBondContact O-N 2.81Å; L249-E252 PolarHBondContact O-N 2.75Å; L249-A253 WeakPolarHBondContact O-CB 3.49Å; L249-A253 PolarHBondContact O-N 3.06Å
250	H	92.5	Very high	89.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-34.8	-171.8	-73.9	-179.4	0	0	0	112.4	L240 L241 N243 F246 N247 A253 L254 F282 I291	L240-H250 PolarHBondContact O-NE2 3.22Å; L241-H250 HydrophobicContact CD2-CB 4.02Å; L241-H250 PolarHBondContact O-CE1 3.1Å; L241-H250 VanDerWaalsContact O-CE1 3.31Å; L241-H250 PolarHBondContact O-NE2 3.3Å; N243-H250 PolarHBondContact O-NE2 3.03Å; F246-H250 PolarHBondContact O-CD2 3.34Å; F246-H250 PolarHBondContact O-N 3.24Å; F246-H250 PolarHBondContact O-NE2 2.93Å; N247-H250 PolarHBondContact O-N 3Å; H250-A253 PolarHBondContact O-N 3.32Å; H250-L254 VanDerWaalsContact O-CB 3.29Å; H250-L254 WeakPolarHBondContact O-CB 3.2Å; H250-L254 WeakPolarHBondContact O-CD1 3.47Å; H250-L254 WeakPolarHBondContact O-CG 3.43Å; H250-L254 PolarHBondContact O-N 2.72Å; H250-F282 HydrophobicContact CB-CZ 4.26Å; H250-F282 AromaticContact CE1-CE2 3.78Å; H250-F282 AromaticContact ND1-CE2 3.58Å; H250-F282 AromaticContact ND1-CZ 3.43Å; H250-F282 WeakPolarHBondContact ND1-CZ 2.73Å; H250-I291 HydrophobicContact CB-CD1 4.2Å; H250-I291 HydrophobicContact CB-CG1 4.49Å; H250-I291 HydrophobicContact CB-CG2 4.11Å
251	A	91.9	Very high	89.7	Confident	23 Å²	23	36.2 Å²	36.2	19%	0.19	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-49.9	178.4	0	0	0	0	0	111.2	L249 L254 Q255 I291 I294	L249-A251 VanDerWaalsContact C-N 3.28Å; L249-A251 PolarHBondContact O-N 2.81Å; A251-L254 PolarHBondContact O-N 2.92Å; A251-Q255 WeakPolarHBondContact O-CB 3.18Å; A251-Q255 PolarHBondContact O-N 3.1Å; A251-I291 HydrophobicContact CB-CG1 4.18Å; A251-I294 HydrophobicContact CB-CD1 3.99Å
252	E	91.9	Very high	89.2	Confident	37 Å²	37	39.3 Å²	39.3	17%	0.173	22%	0.216	C	C	.	.	H	α-helix	trans	-70.7	-36	-179.3	-63.8	94.7	137.2	0	0	112.8	H209 L212 Q216 L249 Q255 T256	H209-E252 IonicContact CE1-OE1 2.68Å; H209-E252 PolarHBondContact CE1-OE1 3.06Å; H209-E252 IonicContact ND1-OE1 2.71Å; H209-E252 PolarHBondContact ND1-OE1 3.48Å; L212-E252 HydrophobicContact CB-CB 3.8Å; L212-E252 HydrophobicContact CD1-CB 4.1Å; L212-E252 HydrophobicContact CG-CB 4.47Å; Q216-E252 PolarHBondContact NE2-O 3.16Å; L249-E252 PolarHBondContact O-N 2.75Å; E252-Q255 PolarHBondContact O-N 3.2Å; E252-T256 PolarHBondContact O-N 3.09Å; E252-T256 VanDerWaalsContact O-N 3.13Å; E252-T256 PolarHBondContact O-OG1 3.17Å
253	A	93.9	Very high	88.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-48.5	174.5	0	0	0	0	0	111.4	L212 F237 L240 L241 L249 H250 Q255 T256 V257	L212-A253 HydrophobicContact CD2-CB 4.3Å; F237-A253 HydrophobicContact CD1-CB 3.88Å; F237-A253 HydrophobicContact CE1-CB 4.28Å; L240-A253 HydrophobicContact CD2-CB 3.78Å; L241-A253 HydrophobicContact CD2-CB 4.02Å; L249-A253 WeakPolarHBondContact O-CB 3.49Å; L249-A253 PolarHBondContact O-N 3.06Å; H250-A253 PolarHBondContact O-N 3.32Å; A253-Q255 VanDerWaalsContact C-N 3.31Å; A253-Q255 PolarHBondContact O-N 3.42Å; A253-T256 WeakPolarHBondContact O-CB 3.42Å; A253-T256 PolarHBondContact O-N 2.86Å; A253-V257 WeakPolarHBondContact O-CG2 3.27Å; A253-V257 PolarHBondContact O-N 3.08Å
254	L	93.5	Very high	88.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-38.3	177	-74.3	167.2	0	0	0	112.1	L241 H250 A251 T256 V257 S258 L279 F282 I291 I294 A295 C298	L241-L254 HydrophobicContact CD1-CD2 3.57Å; L241-L254 HydrophobicContact CD1-CG 4.21Å; L241-L254 HydrophobicContact CD2-CD2 4.03Å; L241-L254 HydrophobicContact CD2-CG 3.75Å; L241-L254 HydrophobicContact CG-CD2 4.47Å; H250-L254 VanDerWaalsContact O-CB 3.29Å; H250-L254 WeakPolarHBondContact O-CB 3.2Å; H250-L254 WeakPolarHBondContact O-CD1 3.47Å; H250-L254 WeakPolarHBondContact O-CG 3.43Å; H250-L254 PolarHBondContact O-N 2.72Å; A251-L254 PolarHBondContact O-N 2.92Å; L254-T256 VanDerWaalsContact C-N 3.31Å; L254-T256 PolarHBondContact O-N 3.48Å; L254-V257 PolarHBondContact O-N 3.31Å; L254-S258 WeakPolarHBondContact O-CB 3.25Å; L254-S258 PolarHBondContact O-N 3.01Å; L254-L279 HydrophobicContact CD2-CD2 4.34Å; L254-F282 HydrophobicContact CD1-CE1 3.77Å; L254-F282 HydrophobicContact CD1-CZ 4.4Å; L254-F282 HydrophobicContact CD2-CD1 4.45Å; L254-F282 HydrophobicContact CD2-CE1 4.4Å; L254-I291 HydrophobicContact CD1-CG2 3.84Å; L254-I294 HydrophobicContact CB-CB 4.37Å; L254-I294 HydrophobicContact CB-CG2 3.52Å; L254-I294 HydrophobicContact CD1-CB 4.32Å; L254-I294 HydrophobicContact CD1-CG2 4.33Å; L254-A295 HydrophobicContact CD1-CB 4.02Å; L254-A295 HydrophobicContact CD2-CB 4.33Å; L254-C298 PolarHBondContact O-SG 3.04Å; L254-C298 VanDerWaalsContact O-SG 3.38Å
255	Q	92.3	Very high	88.5	Confident	62 Å²	62	40.6 Å²	40.6	29%	0.29	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-41	177.3	-174.7	55.6	61	0	0	111.6	Q216 A251 E252 A253 S258 N259	Q216-Q255 HydrophobicContact CG-CB 4.37Å; Q216-Q255 HydrophobicContact CG-CG 4.2Å; A251-Q255 WeakPolarHBondContact O-CB 3.18Å; A251-Q255 PolarHBondContact O-N 3.1Å; E252-Q255 PolarHBondContact O-N 3.2Å; A253-Q255 VanDerWaalsContact C-N 3.31Å; A253-Q255 PolarHBondContact O-N 3.42Å; Q255-S258 WeakPolarHBondContact O-CB 3.41Å; Q255-S258 PolarHBondContact O-N 2.69Å; Q255-N259 PolarHBondContact NE2-OD1 3.3Å; Q255-N259 VanDerWaalsContact NE2-OD1 3.11Å; Q255-N259 PolarHBondContact O-N 2.96Å; Q255-N259 VanDerWaalsContact O-N 3.11Å; Q255-N259 PolarHBondContact O-OD1 3.41Å
256	T	92.8	Very high	88.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-48	173.5	-55.9	0	0	0	0	111.1	F215 T219 F228 F237 E252 A253 L254 S258 N259 C260	F215-T256 HydrophobicContact CB-CG2 3.83Å; T219-T256 HydrophobicContact CG2-CG2 3.59Å; F228-T256 HydrophobicContact CZ-CG2 4.36Å; F237-T256 HydrophobicContact CD1-CG2 4.13Å; F237-T256 VanDerWaalsContact CE1-CB 3.44Å; F237-T256 HydrophobicContact CE1-CG2 3.52Å; F237-T256 HydrophobicContact CZ-CG2 3.81Å; E252-T256 PolarHBondContact O-N 3.09Å; E252-T256 VanDerWaalsContact O-N 3.13Å; E252-T256 PolarHBondContact O-OG1 3.17Å; A253-T256 WeakPolarHBondContact O-CB 3.42Å; A253-T256 PolarHBondContact O-N 2.86Å; L254-T256 VanDerWaalsContact C-N 3.31Å; L254-T256 PolarHBondContact O-N 3.48Å; T256-S258 VanDerWaalsContact C-N 3.27Å; T256-S258 PolarHBondContact O-N 3.3Å; T256-N259 PolarHBondContact O-N 3.44Å; T256-C260 PolarHBondContact O-SG 2.99Å
257	V	92.1	Very high	88.3	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-57.6	-43.4	175.1	172.8	0	0	0	0	110.5	F237 A253 L254 N259 C260 L261 L279	F237-V257 HydrophobicContact CB-CG2 3.9Å; F237-V257 HydrophobicContact CD1-CG2 4.33Å; A253-V257 WeakPolarHBondContact O-CG2 3.27Å; A253-V257 PolarHBondContact O-N 3.08Å; L254-V257 PolarHBondContact O-N 3.31Å; V257-N259 PolarHBondContact O-N 3.39Å; V257-C260 WeakPolarHBondContact O-CB 3.47Å; V257-C260 PolarHBondContact O-N 2.82Å; V257-C260 VanDerWaalsContact O-N 3.1Å; V257-L261 HydrophobicContact CG1-CD1 3.99Å; V257-L261 HydrophobicContact CG1-CG 4.19Å; V257-L261 WeakPolarHBondContact O-CG 3.4Å; V257-L261 PolarHBondContact O-N 2.91Å; V257-L261 VanDerWaalsContact O-N 3.14Å; V257-L279 HydrophobicContact CG1-CD1 4.26Å; V257-L279 HydrophobicContact CG1-CD2 4.36Å
258	S	90.6	Very high	88	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-42	-179.4	-141.9	0	0	0	0	113.2	L254 Q255 T256 C260 L261 C298 R301	L254-S258 WeakPolarHBondContact O-CB 3.25Å; L254-S258 PolarHBondContact O-N 3.01Å; Q255-S258 WeakPolarHBondContact O-CB 3.41Å; Q255-S258 PolarHBondContact O-N 2.69Å; T256-S258 VanDerWaalsContact C-N 3.27Å; T256-S258 PolarHBondContact O-N 3.3Å; S258-C260 PolarHBondContact O-N 3.5Å; S258-L261 PolarHBondContact O-N 3.43Å; S258-C298 VanDerWaalsContact CB-SG 3.58Å; S258-C298 PolarHBondContact OG-SG 3.37Å; S258-R301 WeakPolarHBondContact O-CD 3.46Å; S258-R301 PolarHBondContact OG-NH1 3.35Å
259	N	89.4	Confident	87.5	Confident	39 Å²	39	32.2 Å²	32.2	21%	0.209	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-31	178.3	-70.3	-9.4	0	0	0	112.1	Q216 T219 Q255 T256 V257	Q216-N259 PolarHBondContact O-ND2 2.9Å; Q216-N259 VanDerWaalsContact O-ND2 3.14Å; T219-N259 PolarHBondContact OG1-ND2 3.22Å; T219-N259 VanDerWaalsContact OG1-ND2 3.07Å; Q255-N259 PolarHBondContact NE2-OD1 3.3Å; Q255-N259 VanDerWaalsContact NE2-OD1 3.11Å; Q255-N259 PolarHBondContact O-N 2.96Å; Q255-N259 VanDerWaalsContact O-N 3.11Å; Q255-N259 PolarHBondContact O-OD1 3.41Å; T256-N259 PolarHBondContact O-N 3.44Å; V257-N259 PolarHBondContact O-N 3.39Å
260	C	88.2	Confident	87.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-90	-22	-176.2	-67.6	0	0	0	0	114.6	T219 F234 T256 V257 S258 G262 D263 T266	T219-C260 VanDerWaalsContact CG2-SG 3.53Å; F234-C260 HydrophobicContact CD1-CB 4.48Å; F234-C260 HydrophobicContact CE1-CB 3.15Å; F234-C260 HydrophobicContact CZ-CB 3.2Å; F234-C260 WeakPolarHBondContact CZ-SG 3.46Å; T256-C260 PolarHBondContact O-SG 2.99Å; V257-C260 WeakPolarHBondContact O-CB 3.47Å; V257-C260 PolarHBondContact O-N 2.82Å; V257-C260 VanDerWaalsContact O-N 3.1Å; S258-C260 PolarHBondContact O-N 3.5Å; C260-G262 PolarHBondContact O-N 3.47Å; C260-G262 VanDerWaalsContact O-N 3.09Å; C260-D263 PolarHBondContact O-N 2.88Å; C260-T266 HydrophobicContact CB-CG2 4.2Å
261	L	87.5	Confident	86.5	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-4.8	178.5	-70.1	171.4	0	0	0	113.5	V257 S258 L267 I270 L279 C298 R301 A302	V257-L261 HydrophobicContact CG1-CD1 3.99Å; V257-L261 HydrophobicContact CG1-CG 4.19Å; V257-L261 WeakPolarHBondContact O-CG 3.4Å; V257-L261 PolarHBondContact O-N 2.91Å; V257-L261 VanDerWaalsContact O-N 3.14Å; S258-L261 PolarHBondContact O-N 3.43Å; L261-L267 HydrophobicContact CB-CD2 4.34Å; L261-L267 HydrophobicContact CD2-CD2 3.58Å; L261-L267 WeakPolarHBondContact O-CD1 3.45Å; L261-I270 HydrophobicContact CD2-CD1 3.65Å; L261-L279 HydrophobicContact CD1-CD1 4.22Å; L261-L279 HydrophobicContact CD2-CD1 4.48Å; L261-C298 HydrophobicContact CD1-CB 3.59Å; L261-C298 VanDerWaalsContact CD1-O 3.31Å; L261-C298 WeakPolarHBondContact CD1-O 3.43Å; L261-R301 HydrophobicContact CB-CB 4.08Å; L261-A302 HydrophobicContact CD1-CB 4.32Å; L261-A302 HydrophobicContact CD2-CB 4.2Å
262	G	78.6	Confident	85.8	Confident	66 Å²	66	41.5 Å²	41.5	68%	0.68	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-10.7	168.7	0	0	0	0	0	114.6	C260	C260-G262 PolarHBondContact O-N 3.47Å; C260-G262 VanDerWaalsContact O-N 3.09Å
263	D	82.4	Confident	85.3	Confident	26 Å²	26	44.3 Å²	44.3	14%	0.139	24%	0.238	C	C	.	.			trans	-93.9	123.3	-178.7	173.5	29.3	0	0	0	111.5	R229 C260 E265 T266 L267	R229-D263 IonicContact CZ-OD2 3.51Å; R229-D263 IonicContact NH1-OD2 3.58Å; R229-D263 PolarHBondContact NH1-OD2 3.3Å; C260-D263 PolarHBondContact O-N 2.88Å; D263-E265 PolarHBondContact O-N 3.3Å; D263-E265 PolarHBondContact OD1-N 3.4Å; D263-T266 WeakPolarHBondContact O-CB 3.36Å; D263-T266 PolarHBondContact O-N 3.45Å; D263-T266 WeakPolarHBondContact OD2-CB 3.45Å; D263-T266 PolarHBondContact OD2-N 3.48Å; D263-T266 PolarHBondContact OD2-OG1 2.98Å; D263-L267 WeakPolarHBondContact O-CG 3.48Å; D263-L267 PolarHBondContact O-N 3.38Å
264	I	83.1	Confident	84.9	Confident	121 Å²	121	45.7 Å²	45.7	62%	0.621	25%	0.252	S	S	*	.	H	α-helix	trans	-62.3	-42	-175	-61.1	172.8	0	0	0	111.1	L267 Q268	I264-L267 PolarHBondContact O-N 2.71Å; I264-Q268 WeakPolarHBondContact O-CG 3.47Å; I264-Q268 PolarHBondContact O-N 3.18Å
265	E	82.1	Confident	84.6	Confident	106 Å²	106	45.7 Å²	45.7	50%	0.495	25%	0.253	S	S	.	.	H	α-helix	trans	-66.8	-41.2	-179.9	-67.5	-174.2	-177	0	0	111.2	R229 D263 Q268 I269	R229-E265 IonicContact CZ-OE2 2.86Å; R229-E265 IonicContact NE-OE2 2.77Å; R229-E265 IonicContact NH2-OE2 3.09Å; R229-E265 PolarHBondContact NH2-OE2 3.02Å; D263-E265 PolarHBondContact O-N 3.3Å; D263-E265 PolarHBondContact OD1-N 3.4Å; E265-Q268 PolarHBondContact O-N 3.28Å; E265-I269 PolarHBondContact O-N 2.67Å
266	T	82.3	Confident	84.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-47.6	173.9	-66.9	0	0	0	0	111.5	R229 F234 C260 D263 Q268 I269 I270	R229-T266 PolarHBondContact NH1-OG1 3.26Å; R229-T266 VanDerWaalsContact NH1-OG1 3.11Å; F234-T266 HydrophobicContact CD1-CG2 4.17Å; F234-T266 HydrophobicContact CD2-CG2 3.99Å; F234-T266 HydrophobicContact CE1-CG2 3.59Å; F234-T266 HydrophobicContact CE2-CG2 3.37Å; F234-T266 HydrophobicContact CG-CG2 4.37Å; F234-T266 HydrophobicContact CZ-CG2 3.17Å; C260-T266 HydrophobicContact CB-CG2 4.2Å; D263-T266 WeakPolarHBondContact O-CB 3.36Å; D263-T266 PolarHBondContact O-N 3.45Å; D263-T266 WeakPolarHBondContact OD2-CB 3.45Å; D263-T266 PolarHBondContact OD2-N 3.48Å; D263-T266 PolarHBondContact OD2-OG1 2.98Å; T266-Q268 VanDerWaalsContact C-N 3.29Å; T266-Q268 PolarHBondContact O-N 3.49Å; T266-I269 PolarHBondContact O-N 2.99Å; T266-I270 HydrophobicContact CG2-CD1 3.56Å; T266-I270 HydrophobicContact CG2-CG1 4.21Å; T266-I270 VanDerWaalsContact O-CG1 3.3Å; T266-I270 WeakPolarHBondContact O-CG1 3.24Å; T266-I270 PolarHBondContact O-N 3.46Å
267	L	83.2	Confident	84.2	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-38.2	177.9	-76.3	175.8	0	0	0	112.5	L261 D263 I264 I269 I270 H271 A302	L261-L267 HydrophobicContact CB-CD2 4.34Å; L261-L267 HydrophobicContact CD2-CD2 3.58Å; L261-L267 WeakPolarHBondContact O-CD1 3.45Å; D263-L267 WeakPolarHBondContact O-CG 3.48Å; D263-L267 PolarHBondContact O-N 3.38Å; I264-L267 PolarHBondContact O-N 2.71Å; L267-I269 PolarHBondContact O-N 2.98Å; L267-I270 PolarHBondContact O-N 3.31Å; L267-H271 VanDerWaalsContact O-CB 3.22Å; L267-H271 WeakPolarHBondContact O-CB 3.36Å; L267-H271 PolarHBondContact O-N 3.14Å; L267-A302 HydrophobicContact CD2-CB 4.09Å
268	Q	80.7	Confident	84.2	Confident	120 Å²	120	46.8 Å²	46.8	56%	0.561	26%	0.257	S	S	*	.	H	α-helix	trans	-62.1	-42.1	176.4	-73	174.4	7.1	0	0	112.2	I264 E265 T266 H271 L272	I264-Q268 WeakPolarHBondContact O-CG 3.47Å; I264-Q268 PolarHBondContact O-N 3.18Å; E265-Q268 PolarHBondContact O-N 3.28Å; T266-Q268 VanDerWaalsContact C-N 3.29Å; T266-Q268 PolarHBondContact O-N 3.49Å; Q268-H271 PolarHBondContact O-N 3Å; Q268-L272 WeakPolarHBondContact O-CG 3.43Å; Q268-L272 PolarHBondContact O-N 3.05Å
269	I	78.1	Confident	84.2	Confident	59 Å²	59	47 Å²	47	30%	0.303	26%	0.258	S	S	.	.	H	α-helix	trans	-69.2	-45.4	177.5	-62.3	-175	0	0	0	110.9	R229 E265 T266 L267 H271 L272 N273	R229-I269 HydrophobicContact CG-CD1 3.66Å; E265-I269 PolarHBondContact O-N 2.67Å; T266-I269 PolarHBondContact O-N 2.99Å; L267-I269 PolarHBondContact O-N 2.98Å; I269-H271 PolarHBondContact O-N 3.4Å; I269-L272 PolarHBondContact O-N 3.21Å; I269-L272 VanDerWaalsContact O-N 3.16Å; I269-N273 WeakPolarHBondContact CG2-ND2 3.41Å; I269-N273 WeakPolarHBondContact O-CB 3.35Å; I269-N273 PolarHBondContact O-N 3.48Å
270	I	82.5	Confident	84.1	Confident	6 Å²	6	45.5 Å²	45.5	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-59.1	-39.3	177.3	-66.3	173.2	0	0	0	110.5	F234 L261 T266 L267 G274 G275 L276	F234-I270 HydrophobicContact CB-CG1 4.37Å; F234-I270 HydrophobicContact CD1-CD1 3.7Å; F234-I270 HydrophobicContact CD1-CG1 4.25Å; F234-I270 HydrophobicContact CE1-CD1 4.14Å; F234-I270 HydrophobicContact CG-CD1 4.1Å; F234-I270 HydrophobicContact CG-CG1 4.15Å; L261-I270 HydrophobicContact CD2-CD1 3.65Å; T266-I270 HydrophobicContact CG2-CD1 3.56Å; T266-I270 HydrophobicContact CG2-CG1 4.21Å; T266-I270 VanDerWaalsContact O-CG1 3.3Å; T266-I270 WeakPolarHBondContact O-CG1 3.24Å; T266-I270 PolarHBondContact O-N 3.46Å; L267-I270 PolarHBondContact O-N 3.31Å; I270-G274 PolarHBondContact O-N 3.12Å; I270-G275 PolarHBondContact O-N 3.4Å; I270-L276 HydrophobicContact CG2-CD2 3.72Å; I270-L276 HydrophobicContact CG2-CG 3.9Å
271	H	79.6	Confident	84.1	Confident	72 Å²	72	51.6 Å²	51.6	33%	0.333	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-52.5	174.5	-177.4	124.4	0	0	0	111.2	L267 Q268 I269 N273 G274 V311	L267-H271 VanDerWaalsContact O-CB 3.22Å; L267-H271 WeakPolarHBondContact O-CB 3.36Å; L267-H271 PolarHBondContact O-N 3.14Å; Q268-H271 PolarHBondContact O-N 3Å; I269-H271 PolarHBondContact O-N 3.4Å; H271-N273 PolarHBondContact O-N 3.46Å; H271-G274 PolarHBondContact O-N 3.15Å; H271-V311 WeakPolarHBondContact CE1-CG2 3.39Å; H271-V311 VanDerWaalsContact ND1-CG2 3.3Å; H271-V311 WeakPolarHBondContact ND1-CG2 3.4Å
272	L	77.3	Confident	84.3	Confident	140 Å²	140	52 Å²	52	73%	0.733	28%	0.282	S	S	*	.	H	α-helix	trans	-61	-32.3	-178.9	-72	170.7	0	0	0	113.1	Q268 I269	Q268-L272 WeakPolarHBondContact O-CG 3.43Å; Q268-L272 PolarHBondContact O-N 3.05Å; I269-L272 PolarHBondContact O-N 3.21Å; I269-L272 VanDerWaalsContact O-N 3.16Å
273	N	80.8	Confident	84.8	Confident	96 Å²	96	48.9 Å²	48.9	51%	0.513	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	5.5	-176.5	-65.5	-13.2	0	0	0	113.4	E235 I269 H271 G275	E235-N273 PolarHBondContact OE1-ND2 3.11Å; I269-N273 WeakPolarHBondContact CG2-ND2 3.41Å; I269-N273 WeakPolarHBondContact O-CB 3.35Å; I269-N273 PolarHBondContact O-N 3.48Å; H271-N273 PolarHBondContact O-N 3.46Å; N273-G275 VanDerWaalsContact C-N 3.25Å; N273-G275 PolarHBondContact O-N 3.09Å
274	G	84.8	Confident	84.8	Confident	29 Å²	29	52.2 Å²	52.2	30%	0.299	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	16.3	179.5	0	0	0	0	0	114.5	I270 H271 L276 T277 R278	I270-G274 PolarHBondContact O-N 3.12Å; H271-G274 PolarHBondContact O-N 3.15Å; G274-L276 VanDerWaalsContact C-N 3.32Å; G274-L276 PolarHBondContact O-N 3.48Å; G274-T277 WeakPolarHBondContact O-CB 3.39Å; G274-T277 PolarHBondContact O-N 2.89Å; G274-R278 PolarHBondContact O-N 2.94Å
275	G	87.9	Confident	84.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-30.2	-177.7	0	0	0	0	0	113.5	I270 N273 T277 R278 L279	I270-G275 PolarHBondContact O-N 3.4Å; N273-G275 VanDerWaalsContact C-N 3.25Å; N273-G275 PolarHBondContact O-N 3.09Å; G275-T277 VanDerWaalsContact C-N 3.31Å; G275-T277 PolarHBondContact O-N 3.15Å; G275-R278 PolarHBondContact O-N 3.1Å; G275-L279 WeakPolarHBondContact O-CG 3.1Å; G275-L279 PolarHBondContact O-N 3.1Å
276	L	88.9	Confident	84.6	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-37.4	173.7	-63.6	-175.3	0	0	0	111.9	I270 G274 L279 A280 A302 V311 F312	I270-L276 HydrophobicContact CG2-CD2 3.72Å; I270-L276 HydrophobicContact CG2-CG 3.9Å; G274-L276 VanDerWaalsContact C-N 3.32Å; G274-L276 PolarHBondContact O-N 3.48Å; L276-L279 PolarHBondContact O-N 2.78Å; L276-A280 WeakPolarHBondContact O-CB 3.3Å; L276-A280 PolarHBondContact O-N 3.38Å; L276-A302 HydrophobicContact CD2-CB 3.98Å; L276-V311 HydrophobicContact CB-CG1 4.09Å; L276-V311 HydrophobicContact CD1-CB 4.24Å; L276-V311 HydrophobicContact CD1-CG1 4.32Å; L276-F312 HydrophobicContact CB-CE1 3.86Å; L276-F312 HydrophobicContact CB-CZ 4.28Å; L276-F312 HydrophobicContact CD2-CE1 4.34Å; L276-F312 HydrophobicContact CD2-CZ 3.9Å; L276-F312 HydrophobicContact CG-CZ 4.45Å
277	T	88.9	Confident	84.7	Confident	30 Å²	30	49.3 Å²	49.3	18%	0.184	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-45.6	175.3	-54.2	0	0	0	0	110.9	G274 G275 L279 A280 E281 Q315	G274-T277 WeakPolarHBondContact O-CB 3.39Å; G274-T277 PolarHBondContact O-N 2.89Å; G275-T277 VanDerWaalsContact C-N 3.31Å; G275-T277 PolarHBondContact O-N 3.15Å; T277-L279 VanDerWaalsContact C-N 3.33Å; T277-L279 PolarHBondContact O-N 3.18Å; T277-A280 WeakPolarHBondContact O-CB 3.4Å; T277-A280 PolarHBondContact O-N 2.79Å; T277-A280 VanDerWaalsContact O-N 3.15Å; T277-E281 WeakPolarHBondContact O-CG 3.29Å; T277-E281 PolarHBondContact O-N 3.26Å; T277-Q315 HydrophobicContact CG2-CG 4.12Å
278	R	90.6	Very high	85	Confident	56 Å²	56	50.8 Å²	50.8	21%	0.211	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-42.7	175.4	-68.8	173.2	72.6	-176.5	5	111.9	L238 D239 D242 G274 G275 A280 E281 F282	L238-R278 VanDerWaalsContact CB-CZ 3.49Å; L238-R278 PolarHBondContact O-NH2 2.93Å; L238-R278 VanDerWaalsContact O-NH2 3.15Å; D239-R278 IonicContact OD1-CZ 3.76Å; D239-R278 IonicContact OD1-NH1 3.43Å; D239-R278 PolarHBondContact OD1-NH1 2.94Å; D239-R278 VanDerWaalsContact OD1-NH1 3.11Å; D239-R278 IonicContact OD1-NH2 3.53Å; D239-R278 PolarHBondContact OD1-NH2 3.16Å; D242-R278 IonicContact OD1-NE 2.73Å; D242-R278 IonicContact OD1-NH2 3Å; D242-R278 IonicContact OD2-CZ 2.86Å; D242-R278 IonicContact OD2-NE 3.21Å; D242-R278 PolarHBondContact OD2-NE 3.02Å; D242-R278 VanDerWaalsContact OD2-NE 3.1Å; D242-R278 IonicContact OD2-NH2 3.51Å; D242-R278 PolarHBondContact OD2-NH2 3.11Å; G274-R278 PolarHBondContact O-N 2.94Å; G275-R278 PolarHBondContact O-N 3.1Å; R278-A280 PolarHBondContact O-N 3.35Å; R278-E281 PolarHBondContact O-N 3.31Å; R278-F282 WeakPolarHBondContact O-CB 3.35Å; R278-F282 PolarHBondContact O-N 3.42Å
279	L	90.4	Very high	85.5	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-41	175.4	-72.4	174.8	0	0	0	112.4	L238 L241 L254 V257 L261 G275 L276 T277 F282 V283 I299	L238-L279 HydrophobicContact CD2-CD2 3.83Å; L238-L279 HydrophobicContact CD2-CG 3.95Å; L241-L279 HydrophobicContact CD1-CD2 4.24Å; L254-L279 HydrophobicContact CD2-CD2 4.34Å; V257-L279 HydrophobicContact CG1-CD1 4.26Å; V257-L279 HydrophobicContact CG1-CD2 4.36Å; L261-L279 HydrophobicContact CD1-CD1 4.22Å; L261-L279 HydrophobicContact CD2-CD1 4.48Å; G275-L279 WeakPolarHBondContact O-CG 3.1Å; G275-L279 PolarHBondContact O-N 3.1Å; L276-L279 PolarHBondContact O-N 2.78Å; T277-L279 VanDerWaalsContact C-N 3.33Å; T277-L279 PolarHBondContact O-N 3.18Å; L279-F282 PolarHBondContact O-N 3.44Å; L279-V283 WeakPolarHBondContact O-CG2 3.41Å; L279-V283 PolarHBondContact O-N 3.16Å; L279-I299 HydrophobicContact CB-CD1 4.1Å
280	A	88.8	Confident	86.1	Confident	9 Å²	9	52 Å²	52	7%	0.074	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-42.2	176.4	0	0	0	0	0	112	L276 T277 R278 I317	L276-A280 WeakPolarHBondContact O-CB 3.3Å; L276-A280 PolarHBondContact O-N 3.38Å; T277-A280 WeakPolarHBondContact O-CB 3.4Å; T277-A280 PolarHBondContact O-N 2.79Å; T277-A280 VanDerWaalsContact O-N 3.15Å; R278-A280 PolarHBondContact O-N 3.35Å; A280-I317 HydrophobicContact CB-CD1 3.81Å
281	E	88.2	Confident	86.6	Confident	128 Å²	128	52 Å²	52	60%	0.598	29%	0.289	S	S	*	.	H	α-helix	trans	-65.7	-39.8	176.2	-70.7	174.8	178	0	0	111.9	T277 R278 V283 L284	T277-E281 WeakPolarHBondContact O-CG 3.29Å; T277-E281 PolarHBondContact O-N 3.26Å; R278-E281 PolarHBondContact O-N 3.31Å; E281-V283 VanDerWaalsContact C-N 3.26Å; E281-V283 PolarHBondContact O-N 2.88Å; E281-L284 PolarHBondContact O-N 3.03Å
282	F	91	Very high	87.2	Confident	9 Å²	9	50.3 Å²	50.3	4%	0.039	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-31.2	-179.7	-175.9	-88.7	0	0	0	113.2	L241 M244 H250 L254 R278 L279 L284 A285 I291 A295	L241-F282 HydrophobicContact CB-CD2 4.02Å; L241-F282 HydrophobicContact CB-CE2 4Å; L241-F282 HydrophobicContact CD2-CE2 4.3Å; L241-F282 HydrophobicContact CD2-CZ 4.22Å; L241-F282 WeakPolarHBondContact O-CE2 3.47Å; M244-F282 HydrophobicContact CE-CD2 4.24Å; M244-F282 HydrophobicContact CE-CE2 4.13Å; H250-F282 HydrophobicContact CB-CZ 4.26Å; H250-F282 AromaticContact CE1-CE2 3.78Å; H250-F282 AromaticContact ND1-CE2 3.58Å; H250-F282 AromaticContact ND1-CZ 3.43Å; H250-F282 WeakPolarHBondContact ND1-CZ 2.73Å; L254-F282 HydrophobicContact CD1-CE1 3.77Å; L254-F282 HydrophobicContact CD1-CZ 4.4Å; L254-F282 HydrophobicContact CD2-CD1 4.45Å; L254-F282 HydrophobicContact CD2-CE1 4.4Å; R278-F282 WeakPolarHBondContact O-CB 3.35Å; R278-F282 PolarHBondContact O-N 3.42Å; L279-F282 PolarHBondContact O-N 3.44Å; F282-L284 PolarHBondContact O-N 3.37Å; F282-L284 VanDerWaalsContact O-N 3.15Å; F282-A285 HydrophobicContact CD2-CB 4.46Å; F282-A285 WeakPolarHBondContact O-CB 3.22Å; F282-A285 PolarHBondContact O-N 3.36Å; F282-I291 HydrophobicContact CE1-CG2 3.81Å; F282-I291 HydrophobicContact CZ-CG2 3.92Å; F282-A295 HydrophobicContact CD1-CB 3.86Å; F282-A295 HydrophobicContact CE1-CB 4.12Å
283	V	89.2	Confident	87.9	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.2	178.6	173.6	0	0	0	0	112.7	L279 E281 Q292 A295 I296 I299 V320 L324	L279-V283 WeakPolarHBondContact O-CG2 3.41Å; L279-V283 PolarHBondContact O-N 3.16Å; E281-V283 VanDerWaalsContact C-N 3.26Å; E281-V283 PolarHBondContact O-N 2.88Å; V283-Q292 PolarHBondContact O-NE2 3.39Å; V283-A295 HydrophobicContact CG2-CB 3.96Å; V283-I296 HydrophobicContact CG1-CG1 3.9Å; V283-I299 HydrophobicContact CG2-CG1 4.08Å; V283-V320 HydrophobicContact CB-CG1 4.37Å; V283-V320 HydrophobicContact CG1-CG1 3.87Å; V283-L324 HydrophobicContact CG1-CD1 3.3Å; V283-L324 HydrophobicContact CG1-CG 4.5Å
284	L	83.1	Confident	88.5	Confident	95 Å²	95	40.4 Å²	40.4	50%	0.497	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.9	176.7	-68.1	177.2	0	0	0	113.4	E281 F282 V320	E281-L284 PolarHBondContact O-N 3.03Å; F282-L284 PolarHBondContact O-N 3.37Å; F282-L284 VanDerWaalsContact O-N 3.15Å; L284-V320 HydrophobicContact CD1-CG2 3.89Å; L284-V320 HydrophobicContact CD2-CB 4.47Å; L284-V320 HydrophobicContact CD2-CG1 3.69Å; L284-V320 HydrophobicContact CD2-CG2 4.33Å; L284-V320 HydrophobicContact CG-CG1 3.86Å; L284-V320 HydrophobicContact CG-CG2 4.17Å
285	A	84.8	Confident	88.9	Confident	16 Å²	16	39.2 Å²	39.2	13%	0.132	22%	0.216	C	C	.	.	S	Bend	trans	-65.7	140.4	179.8	0	0	0	0	0	110.5	M244 F282 S287	M244-A285 HydrophobicContact CE-CB 3.87Å; M244-A285 HydrophobicContact SD-CB 4.34Å; F282-A285 HydrophobicContact CD2-CB 4.46Å; F282-A285 WeakPolarHBondContact O-CB 3.22Å; F282-A285 PolarHBondContact O-N 3.36Å; A285-S287 PolarHBondContact O-N 3.28Å; A285-S287 PolarHBondContact O-OG 3.38Å; A285-S287 VanDerWaalsContact O-OG 3.1Å
286	P	75	Confident	89.3	Confident	118 Å²	118	39.1 Å²	39.1	77%	0.766	22%	0.216	S	C	*	.	S	Bend	trans	-63	107.5	178.7	25.5	-32.4	0	0	0	109.9
287	S	84.4	Confident	89.5	Confident	32 Å²	32	43 Å²	43	22%	0.224	23%	0.233	C	C	.	.			trans	-142.5	169.7	-174.4	55.3	0	0	0	0	110.9	A285	A285-S287 PolarHBondContact O-N 3.28Å; A285-S287 PolarHBondContact O-OG 3.38Å; A285-S287 VanDerWaalsContact O-OG 3.1Å
288	S	89.6	Confident	89.7	Confident	44 Å²	44	41.6 Å²	41.6	31%	0.308	22%	0.224	S	C	.	.			trans	-66.5	152.5	173.4	72.6	0	0	0	0	110.4	E290 I291 Q292	S288-E290 PolarHBondContact O-N 3.29Å; S288-E290 VanDerWaalsContact O-N 3.13Å; S288-I291 PolarHBondContact O-N 3.35Å; S288-I291 VanDerWaalsContact O-N 3.14Å; S288-I291 WeakPolarHBondContact OG-CD1 3.29Å; S288-I291 WeakPolarHBondContact OG-CG1 3.11Å; S288-I291 PolarHBondContact OG-N 3.46Å; S288-Q292 PolarHBondContact O-N 3.25Å
289	P	91.1	Very high	89.9	Confident	64 Å²	64	39 Å²	39	42%	0.416	21%	0.214	S	C	.	.	H	α-helix	trans	-55.5	-31.5	176.2	-26.2	34.6	0	0	0	113.3	S293 D329 V332	P289-S293 VanDerWaalsContact O-CB 3.28Å; P289-S293 WeakPolarHBondContact O-CB 3.35Å; P289-S293 PolarHBondContact O-N 2.86Å; P289-D329 HydrophobicContact CB-CB 3.84Å; P289-D329 HydrophobicContact CG-CB 4.32Å; P289-V332 HydrophobicContact CB-CG2 3.88Å; P289-V332 WeakPolarHBondContact O-CG2 3.41Å
290	E	91.1	Very high	90.1	Very high	139 Å²	139	39.7 Å²	39.7	65%	0.65	22%	0.219	S	C	*	.	H	α-helix	trans	-64.2	-53.5	175.3	-178.3	172	-163.5	0	0	111.8	S288 Q292 S293 I294	S288-E290 PolarHBondContact O-N 3.29Å; S288-E290 VanDerWaalsContact O-N 3.13Å; E290-Q292 VanDerWaalsContact C-N 3.3Å; E290-Q292 PolarHBondContact O-N 2.92Å; E290-S293 WeakPolarHBondContact O-CB 3.35Å; E290-S293 PolarHBondContact O-N 3.4Å; E290-I294 HydrophobicContact CG-CD1 4.2Å; E290-I294 WeakPolarHBondContact O-CG1 3.18Å; E290-I294 PolarHBondContact O-N 3.1Å
291	I	92.3	Very high	90.3	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-44.1	178	-69	166.1	0	0	0	110.3	N247 H250 A251 L254 F282 S288 S293 I294 A295	N247-I291 WeakPolarHBondContact O-CD1 3.42Å; N247-I291 WeakPolarHBondContact OD1-CD1 3.38Å; H250-I291 HydrophobicContact CB-CD1 4.2Å; H250-I291 HydrophobicContact CB-CG1 4.49Å; H250-I291 HydrophobicContact CB-CG2 4.11Å; A251-I291 HydrophobicContact CB-CG1 4.18Å; L254-I291 HydrophobicContact CD1-CG2 3.84Å; F282-I291 HydrophobicContact CE1-CG2 3.81Å; F282-I291 HydrophobicContact CZ-CG2 3.92Å; S288-I291 PolarHBondContact O-N 3.35Å; S288-I291 VanDerWaalsContact O-N 3.14Å; S288-I291 WeakPolarHBondContact OG-CD1 3.29Å; S288-I291 WeakPolarHBondContact OG-CG1 3.11Å; S288-I291 PolarHBondContact OG-N 3.46Å; I291-S293 PolarHBondContact O-N 3.45Å; I291-I294 PolarHBondContact O-N 3.14Å; I291-A295 PolarHBondContact O-N 3.32Å
292	Q	92.6	Very high	90.5	Very high	35 Å²	35	38.4 Å²	38.4	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-43.5	178.1	-170.1	171.3	52.6	0	0	111.8	V283 S288 E290 I294 A295 I296 L324 V332	V283-Q292 PolarHBondContact O-NE2 3.39Å; S288-Q292 PolarHBondContact O-N 3.25Å; E290-Q292 VanDerWaalsContact C-N 3.3Å; E290-Q292 PolarHBondContact O-N 2.92Å; Q292-I294 PolarHBondContact O-N 3.27Å; Q292-A295 PolarHBondContact O-N 2.78Å; Q292-I296 HydrophobicContact CG-CD1 4.23Å; Q292-I296 WeakPolarHBondContact O-CD1 3.43Å; Q292-I296 VanDerWaalsContact O-CG1 3.24Å; Q292-I296 WeakPolarHBondContact O-CG1 3.41Å; Q292-I296 PolarHBondContact O-N 2.98Å; Q292-L324 HydrophobicContact CG-CD2 4.48Å; Q292-L324 VanDerWaalsContact NE2-CD2 3.25Å; Q292-V332 HydrophobicContact CB-CG2 4.46Å; Q292-V332 HydrophobicContact CG-CG1 4.33Å
293	S	93.1	Very high	90.7	Very high	10 Å²	10	38 Å²	38	7%	0.07	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-42.7	174.1	147.3	0	0	0	0	111.8	P289 E290 I291 I296 K297 S335	P289-S293 VanDerWaalsContact O-CB 3.28Å; P289-S293 WeakPolarHBondContact O-CB 3.35Å; P289-S293 PolarHBondContact O-N 2.86Å; E290-S293 WeakPolarHBondContact O-CB 3.35Å; E290-S293 PolarHBondContact O-N 3.4Å; I291-S293 PolarHBondContact O-N 3.45Å; S293-I296 PolarHBondContact O-N 3.19Å; S293-K297 VanDerWaalsContact O-CG 3.3Å; S293-K297 WeakPolarHBondContact O-CG 3.41Å; S293-K297 PolarHBondContact O-N 3.48Å; S293-S335 PolarHBondContact OG-OG 2.88Å
294	I	92.8	Very high	90.8	Very high	19 Å²	19	43.7 Å²	43.7	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-41.1	177.3	-58.4	165.2	0	0	0	110.7	A251 L254 E290 I291 Q292 I296 K297 C298	A251-I294 HydrophobicContact CB-CD1 3.99Å; L254-I294 HydrophobicContact CB-CB 4.37Å; L254-I294 HydrophobicContact CB-CG2 3.52Å; L254-I294 HydrophobicContact CD1-CB 4.32Å; L254-I294 HydrophobicContact CD1-CG2 4.33Å; E290-I294 HydrophobicContact CG-CD1 4.2Å; E290-I294 WeakPolarHBondContact O-CG1 3.18Å; E290-I294 PolarHBondContact O-N 3.1Å; I291-I294 PolarHBondContact O-N 3.14Å; Q292-I294 PolarHBondContact O-N 3.27Å; I294-I296 PolarHBondContact O-N 3.35Å; I294-K297 WeakPolarHBondContact O-CB 3.46Å; I294-K297 PolarHBondContact O-N 3.2Å; I294-K297 VanDerWaalsContact O-N 3.14Å; I294-C298 PolarHBondContact O-N 3.12Å; I294-C298 PolarHBondContact O-SG 2.99Å
295	A	94.3	Very high	91.1	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-44.2	176.2	0	0	0	0	0	111.9	L254 F282 V283 I291 Q292 K297 C298 I299	L254-A295 HydrophobicContact CD1-CB 4.02Å; L254-A295 HydrophobicContact CD2-CB 4.33Å; F282-A295 HydrophobicContact CD1-CB 3.86Å; F282-A295 HydrophobicContact CE1-CB 4.12Å; V283-A295 HydrophobicContact CG2-CB 3.96Å; I291-A295 PolarHBondContact O-N 3.32Å; Q292-A295 PolarHBondContact O-N 2.78Å; A295-K297 VanDerWaalsContact C-N 3.3Å; A295-K297 PolarHBondContact O-N 3.39Å; A295-C298 VanDerWaalsContact O-CB 3.29Å; A295-C298 WeakPolarHBondContact O-CB 3.5Å; A295-C298 PolarHBondContact O-N 3.46Å; A295-C298 VanDerWaalsContact O-N 3.12Å; A295-I299 PolarHBondContact O-N 3.04Å; A295-I299 VanDerWaalsContact O-N 3.16Å
296	I	95	Very high	91.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-35.8	175.2	-61	160.5	0	0	0	111.4	V283 Q292 S293 I294 C298 I299 T300 L321 L324 V332 S335 A339	V283-I296 HydrophobicContact CG1-CG1 3.9Å; Q292-I296 HydrophobicContact CG-CD1 4.23Å; Q292-I296 WeakPolarHBondContact O-CD1 3.43Å; Q292-I296 VanDerWaalsContact O-CG1 3.24Å; Q292-I296 WeakPolarHBondContact O-CG1 3.41Å; Q292-I296 PolarHBondContact O-N 2.98Å; S293-I296 PolarHBondContact O-N 3.19Å; I294-I296 PolarHBondContact O-N 3.35Å; I296-C298 VanDerWaalsContact C-N 3.31Å; I296-C298 PolarHBondContact O-N 3.16Å; I296-I299 WeakPolarHBondContact O-CB 3.13Å; I296-I299 PolarHBondContact O-N 3.42Å; I296-T300 PolarHBondContact O-N 3.25Å; I296-T300 PolarHBondContact O-OG1 3.09Å; I296-L321 HydrophobicContact CG2-CD2 4.19Å; I296-L324 HydrophobicContact CD1-CD1 3.64Å; I296-L324 HydrophobicContact CG1-CD1 3.91Å; I296-V332 HydrophobicContact CD1-CG1 4Å; I296-S335 VanDerWaalsContact CG2-C 3.44Å; I296-S335 WeakPolarHBondContact CG2-O 3.34Å; I296-A339 HydrophobicContact CG2-CB 3.67Å
297	K	93.9	Very high	92.2	Very high	82 Å²	82	42 Å²	42	36%	0.357	22%	0.217	S	C	.	.	H	α-helix	trans	-64.5	-34.8	173.8	-72.2	170.2	-174.2	177.1	0	112.1	S293 I294 A295 T300 R301	S293-K297 VanDerWaalsContact O-CG 3.3Å; S293-K297 WeakPolarHBondContact O-CG 3.41Å; S293-K297 PolarHBondContact O-N 3.48Å; I294-K297 WeakPolarHBondContact O-CB 3.46Å; I294-K297 PolarHBondContact O-N 3.2Å; I294-K297 VanDerWaalsContact O-N 3.14Å; A295-K297 VanDerWaalsContact C-N 3.3Å; A295-K297 PolarHBondContact O-N 3.39Å; K297-T300 WeakPolarHBondContact O-CB 3.14Å; K297-T300 PolarHBondContact O-N 3.39Å; K297-R301 PolarHBondContact O-N 3.11Å
298	C	93.6	Very high	92.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-46.3	170.4	-67.4	0	0	0	0	111.2	L254 S258 L261 I294 A295 I296 T300 R301 A302	L254-C298 PolarHBondContact O-SG 3.04Å; L254-C298 VanDerWaalsContact O-SG 3.38Å; S258-C298 VanDerWaalsContact CB-SG 3.58Å; S258-C298 PolarHBondContact OG-SG 3.37Å; L261-C298 HydrophobicContact CD1-CB 3.59Å; L261-C298 VanDerWaalsContact CD1-O 3.31Å; L261-C298 WeakPolarHBondContact CD1-O 3.43Å; I294-C298 PolarHBondContact O-N 3.12Å; I294-C298 PolarHBondContact O-SG 2.99Å; A295-C298 VanDerWaalsContact O-CB 3.29Å; A295-C298 WeakPolarHBondContact O-CB 3.5Å; A295-C298 PolarHBondContact O-N 3.46Å; A295-C298 VanDerWaalsContact O-N 3.12Å; I296-C298 VanDerWaalsContact C-N 3.31Å; I296-C298 PolarHBondContact O-N 3.16Å; C298-T300 VanDerWaalsContact C-N 3.32Å; C298-T300 PolarHBondContact O-N 3.19Å; C298-R301 PolarHBondContact O-N 3.43Å; C298-A302 WeakPolarHBondContact O-CB 3.41Å; C298-A302 PolarHBondContact O-N 3.19Å
299	I	93.9	Very high	92.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-45.5	173.7	-57	-60.9	0	0	0	110.9	L279 V283 A295 I296 R301 A302 A303 F312 I317	L279-I299 HydrophobicContact CB-CD1 4.1Å; V283-I299 HydrophobicContact CG2-CG1 4.08Å; A295-I299 PolarHBondContact O-N 3.04Å; A295-I299 VanDerWaalsContact O-N 3.16Å; I296-I299 WeakPolarHBondContact O-CB 3.13Å; I296-I299 PolarHBondContact O-N 3.42Å; I299-R301 VanDerWaalsContact C-N 3.33Å; I299-R301 PolarHBondContact O-N 3.04Å; I299-A302 PolarHBondContact O-N 3.29Å; I299-A303 WeakPolarHBondContact O-CB 3.4Å; I299-A303 PolarHBondContact O-N 3.25Å; I299-F312 HydrophobicContact CB-CZ 4.48Å; I299-F312 HydrophobicContact CD1-CD1 4.35Å; I299-F312 HydrophobicContact CD1-CE1 3.49Å; I299-F312 VanDerWaalsContact CD1-CE1 3.49Å; I299-F312 HydrophobicContact CD1-CZ 3.6Å; I299-F312 HydrophobicContact CG2-CD2 4.28Å; I299-F312 HydrophobicContact CG2-CE1 4.45Å; I299-F312 HydrophobicContact CG2-CE2 3.99Å; I299-F312 HydrophobicContact CG2-CZ 4.09Å; I299-I317 HydrophobicContact CG2-CG1 4.14Å
300	T	95.1	Very high	92.8	Very high	21 Å²	21	42 Å²	42	13%	0.129	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-39.9	179.5	-54	0	0	0	0	112.5	I296 K297 C298 Q304 Q338 A339 A342	I296-T300 PolarHBondContact O-N 3.25Å; I296-T300 PolarHBondContact O-OG1 3.09Å; K297-T300 WeakPolarHBondContact O-CB 3.14Å; K297-T300 PolarHBondContact O-N 3.39Å; C298-T300 VanDerWaalsContact C-N 3.32Å; C298-T300 PolarHBondContact O-N 3.19Å; T300-Q304 PolarHBondContact O-NE2 3.13Å; T300-Q338 HydrophobicContact CG2-CB 4.33Å; T300-A339 VanDerWaalsContact OG1-CA 3.32Å; T300-A339 WeakPolarHBondContact OG1-CA 3.32Å; T300-A339 WeakPolarHBondContact OG1-CB 3.49Å; T300-A339 PolarHBondContact OG1-N 3.25Å; T300-A342 HydrophobicContact CG2-CB 4.07Å
301	R	93.2	Very high	92.8	Very high	109 Å²	109	36.2 Å²	36.2	41%	0.411	18%	0.176	S	C	.	.	H	α-helix	trans	-70.3	-46.6	176.2	-77.2	-165.6	168.7	106.3	-0.9	112.1	S258 L261 K297 C298 I299 A303 Q304	S258-R301 WeakPolarHBondContact O-CD 3.46Å; S258-R301 PolarHBondContact OG-NH1 3.35Å; L261-R301 HydrophobicContact CB-CB 4.08Å; K297-R301 PolarHBondContact O-N 3.11Å; C298-R301 PolarHBondContact O-N 3.43Å; I299-R301 VanDerWaalsContact C-N 3.33Å; I299-R301 PolarHBondContact O-N 3.04Å; R301-A303 VanDerWaalsContact C-N 3.28Å; R301-A303 PolarHBondContact O-N 3.39Å; R301-Q304 WeakPolarHBondContact O-CB 3.22Å; R301-Q304 VanDerWaalsContact O-CG 3.28Å; R301-Q304 WeakPolarHBondContact O-CG 3.29Å; R301-Q304 PolarHBondContact O-N 3.42Å
302	A	92.5	Very high	92.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-39.4	176.7	0	0	0	0	0	111.6	L261 L267 L276 C298 I299 Q304 S305 S308 F312	L261-A302 HydrophobicContact CD1-CB 4.32Å; L261-A302 HydrophobicContact CD2-CB 4.2Å; L267-A302 HydrophobicContact CD2-CB 4.09Å; L276-A302 HydrophobicContact CD2-CB 3.98Å; C298-A302 WeakPolarHBondContact O-CB 3.41Å; C298-A302 PolarHBondContact O-N 3.19Å; I299-A302 PolarHBondContact O-N 3.29Å; A302-Q304 PolarHBondContact O-N 3.25Å; A302-S305 PolarHBondContact O-N 3.21Å; A302-S305 VanDerWaalsContact O-N 3.12Å; A302-S308 WeakPolarHBondContact O-CB 3.39Å; A302-S308 PolarHBondContact O-OG 3.24Å; A302-F312 HydrophobicContact CB-CE2 3.65Å; A302-F312 HydrophobicContact CB-CZ 3.73Å
303	A	93.4	Very high	93.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	1.8	179.2	0	0	0	0	0	114.5	I299 R301 S305 R309 F312 A342 M343	I299-A303 WeakPolarHBondContact O-CB 3.4Å; I299-A303 PolarHBondContact O-N 3.25Å; R301-A303 VanDerWaalsContact C-N 3.28Å; R301-A303 PolarHBondContact O-N 3.39Å; A303-S305 VanDerWaalsContact C-N 3.31Å; A303-R309 HydrophobicContact CB-CG 4.07Å; A303-R309 VanDerWaalsContact O-CD 3.28Å; A303-R309 WeakPolarHBondContact O-CD 3.33Å; A303-R309 VanDerWaalsContact O-CG 3.25Å; A303-R309 WeakPolarHBondContact O-CG 3.48Å; A303-R309 PolarHBondContact O-NH1 3.27Å; A303-F312 HydrophobicContact CB-CD2 4.39Å; A303-F312 HydrophobicContact CB-CE2 4.36Å; A303-A342 HydrophobicContact CB-CB 3.91Å; A303-M343 HydrophobicContact CB-CG 4.47Å; A303-M343 HydrophobicContact CB-SD 3.87Å
304	Q	91.5	Very high	93	Very high	122 Å²	122	42 Å²	42	57%	0.57	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-28	167.9	-60.8	-55.9	-44.2	0	0	112	T300 R301 A302 R309	T300-Q304 PolarHBondContact O-NE2 3.13Å; R301-Q304 WeakPolarHBondContact O-CB 3.22Å; R301-Q304 VanDerWaalsContact O-CG 3.28Å; R301-Q304 WeakPolarHBondContact O-CG 3.29Å; R301-Q304 PolarHBondContact O-N 3.42Å; A302-Q304 PolarHBondContact O-N 3.25Å; Q304-R309 PolarHBondContact O-NH1 3.18Å
305	S	90.9	Very high	92.9	Very high	23 Å²	23	45.1 Å²	45.1	16%	0.161	22%	0.216	C	C	.	.	S	Bend	trans	-81.9	140.8	173.3	148.2	0	0	0	0	111.7	A302 A303 E307 S308 R309	A302-S305 PolarHBondContact O-N 3.21Å; A302-S305 VanDerWaalsContact O-N 3.12Å; A303-S305 VanDerWaalsContact C-N 3.31Å; S305-E307 PolarHBondContact OG-N 3.14Å; S305-E307 PolarHBondContact OG-OE2 3.49Å; S305-S308 PolarHBondContact O-N 2.94Å; S305-S308 PolarHBondContact OG-N 3.42Å; S305-S308 VanDerWaalsContact OG-N 3.16Å; S305-S308 PolarHBondContact OG-OG 3.28Å; S305-R309 WeakPolarHBondContact O-CG 3.39Å; S305-R309 PolarHBondContact O-N 3.06Å; S305-R309 VanDerWaalsContact O-N 3.17Å
306	S	91.7	Very high	92.8	Very high	64 Å²	64	48 Å²	48	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-42	174.5	30.2	0	0	0	0	112.8	S308 R309 E310	S306-S308 VanDerWaalsContact C-N 3.32Å; S306-S308 PolarHBondContact O-N 2.94Å; S306-R309 VanDerWaalsContact CA-NH2 3.28Å; S306-R309 PolarHBondContact O-N 3.4Å; S306-E310 PolarHBondContact O-N 3.27Å
307	E	90.1	Very high	92.9	Very high	105 Å²	105	48 Å²	48	49%	0.491	23%	0.23	S	C	.	.	H	α-helix	trans	-64.3	-39.2	-180	-57.7	79.5	-176.7	0	0	110.9	S305 E310 V311	S305-E307 PolarHBondContact OG-N 3.14Å; S305-E307 PolarHBondContact OG-OE2 3.49Å; E307-E310 PolarHBondContact O-N 3.2Å; E307-V311 PolarHBondContact O-N 3.34Å
308	S	91.6	Very high	93	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-68.8	-39.1	177	-59.4	0	0	0	0	111.8	A302 S305 S306 E310 V311 F312	A302-S308 WeakPolarHBondContact O-CB 3.39Å; A302-S308 PolarHBondContact O-OG 3.24Å; S305-S308 PolarHBondContact O-N 2.94Å; S305-S308 PolarHBondContact OG-N 3.42Å; S305-S308 VanDerWaalsContact OG-N 3.16Å; S305-S308 PolarHBondContact OG-OG 3.28Å; S306-S308 VanDerWaalsContact C-N 3.32Å; S306-S308 PolarHBondContact O-N 2.94Å; S308-E310 VanDerWaalsContact C-N 3.31Å; S308-E310 PolarHBondContact O-N 3.24Å; S308-V311 PolarHBondContact O-N 3.16Å; S308-F312 WeakPolarHBondContact O-CB 3.44Å; S308-F312 WeakPolarHBondContact O-CD2 3.43Å; S308-F312 VanDerWaalsContact O-CG 3.32Å; S308-F312 WeakPolarHBondContact O-CG 3.49Å; S308-F312 PolarHBondContact O-N 3.43Å
309	R	94.1	Very high	93.1	Very high	34 Å²	34	49 Å²	49	13%	0.128	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-39	173.9	-71.3	-177.1	-67.5	-98.4	0.5	112.1	A303 Q304 S305 S306 F312 H313 A342 M343 H346	A303-R309 HydrophobicContact CB-CG 4.07Å; A303-R309 VanDerWaalsContact O-CD 3.28Å; A303-R309 WeakPolarHBondContact O-CD 3.33Å; A303-R309 VanDerWaalsContact O-CG 3.25Å; A303-R309 WeakPolarHBondContact O-CG 3.48Å; A303-R309 PolarHBondContact O-NH1 3.27Å; Q304-R309 PolarHBondContact O-NH1 3.18Å; S305-R309 WeakPolarHBondContact O-CG 3.39Å; S305-R309 PolarHBondContact O-N 3.06Å; S305-R309 VanDerWaalsContact O-N 3.17Å; S306-R309 VanDerWaalsContact CA-NH2 3.28Å; S306-R309 PolarHBondContact O-N 3.4Å; R309-F312 PolarHBondContact O-N 3.15Å; R309-H313 WeakPolarHBondContact O-CB 3.39Å; R309-H313 PolarHBondContact O-N 2.72Å; R309-A342 WeakPolarHBondContact CD-O 3.47Å; R309-M343 HydrophobicContact CB-CE 4.4Å; R309-M343 HydrophobicContact CB-SD 4.4Å; R309-M343 HydrophobicContact CG-SD 4.06Å; R309-H346 HydrophobicContact CB-CB 4.09Å
310	E	92.5	Very high	93.2	Very high	107 Å²	107	49.8 Å²	49.8	50%	0.5	24%	0.239	S	C	.	.	H	α-helix	trans	-61.9	-48.8	176.2	-173.4	170.7	-160.3	0	0	111.3	S306 E307 S308 F312 H313 E314	S306-E310 PolarHBondContact O-N 3.27Å; E307-E310 PolarHBondContact O-N 3.2Å; S308-E310 VanDerWaalsContact C-N 3.31Å; S308-E310 PolarHBondContact O-N 3.24Å; E310-F312 PolarHBondContact O-N 3.36Å; E310-H313 WeakPolarHBondContact O-CB 3.42Å; E310-H313 PolarHBondContact O-N 3.4Å; E310-E314 WeakPolarHBondContact O-CG 3.31Å; E310-E314 PolarHBondContact O-N 3.06Å
311	V	91.4	Very high	93.3	Very high	16 Å²	16	48.8 Å²	48.8	10%	0.097	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-47.5	175.7	175	0	0	0	0	111.5	H271 L276 E307 S308 H313 E314 Q315	H271-V311 WeakPolarHBondContact CE1-CG2 3.39Å; H271-V311 VanDerWaalsContact ND1-CG2 3.3Å; H271-V311 WeakPolarHBondContact ND1-CG2 3.4Å; L276-V311 HydrophobicContact CB-CG1 4.09Å; L276-V311 HydrophobicContact CD1-CB 4.24Å; L276-V311 HydrophobicContact CD1-CG1 4.32Å; E307-V311 PolarHBondContact O-N 3.34Å; S308-V311 PolarHBondContact O-N 3.16Å; V311-H313 VanDerWaalsContact C-N 3.27Å; V311-H313 PolarHBondContact O-N 3.25Å; V311-E314 WeakPolarHBondContact O-CB 3.42Å; V311-E314 PolarHBondContact O-N 3.26Å; V311-E314 VanDerWaalsContact O-N 3.16Å; V311-Q315 HydrophobicContact CG1-CG 4.25Å; V311-Q315 VanDerWaalsContact O-CG 3.32Å; V311-Q315 WeakPolarHBondContact O-CG 3.35Å; V311-Q315 PolarHBondContact O-N 3.5Å
312	F	94.4	Very high	93.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-36.1	180	-72.9	-40.4	0	0	0	112.8	L276 I299 A302 A303 S308 R309 E310 Q315 M316 I317 M343	L276-F312 HydrophobicContact CB-CE1 3.86Å; L276-F312 HydrophobicContact CB-CZ 4.28Å; L276-F312 HydrophobicContact CD2-CE1 4.34Å; L276-F312 HydrophobicContact CD2-CZ 3.9Å; L276-F312 HydrophobicContact CG-CZ 4.45Å; I299-F312 HydrophobicContact CB-CZ 4.48Å; I299-F312 HydrophobicContact CD1-CD1 4.35Å; I299-F312 HydrophobicContact CD1-CE1 3.49Å; I299-F312 VanDerWaalsContact CD1-CE1 3.49Å; I299-F312 HydrophobicContact CD1-CZ 3.6Å; I299-F312 HydrophobicContact CG2-CD2 4.28Å; I299-F312 HydrophobicContact CG2-CE1 4.45Å; I299-F312 HydrophobicContact CG2-CE2 3.99Å; I299-F312 HydrophobicContact CG2-CZ 4.09Å; A302-F312 HydrophobicContact CB-CE2 3.65Å; A302-F312 HydrophobicContact CB-CZ 3.73Å; A303-F312 HydrophobicContact CB-CD2 4.39Å; A303-F312 HydrophobicContact CB-CE2 4.36Å; S308-F312 WeakPolarHBondContact O-CB 3.44Å; S308-F312 WeakPolarHBondContact O-CD2 3.43Å; S308-F312 VanDerWaalsContact O-CG 3.32Å; S308-F312 WeakPolarHBondContact O-CG 3.49Å; S308-F312 PolarHBondContact O-N 3.43Å; R309-F312 PolarHBondContact O-N 3.15Å; E310-F312 PolarHBondContact O-N 3.36Å; F312-Q315 CarbonylContact O-C 3.45Å; F312-Q315 PolarHBondContact O-N 3.3Å; F312-M316 PolarHBondContact O-N 3.1Å; F312-M316 VanDerWaalsContact O-N 3.12Å; F312-I317 HydrophobicContact CB-CB 4.09Å; F312-I317 HydrophobicContact CB-CG2 3.65Å; F312-I317 HydrophobicContact CG-CG2 4.48Å; F312-I317 WeakPolarHBondContact O-CB 3.32Å; F312-I317 WeakPolarHBondContact O-CG2 3.49Å; F312-I317 PolarHBondContact O-N 3.42Å; F312-M343 HydrophobicContact CB-CE 3.74Å; F312-M343 HydrophobicContact CB-SD 3.89Å; F312-M343 HydrophobicContact CD2-SD 3.94Å; F312-M343 HydrophobicContact CG-SD 4.35Å
313	H	95.2	Very high	93.6	Very high	49 Å²	49	49 Å²	49	23%	0.227	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-44.8	173.2	-178.7	64.6	0	0	0	111.7	R309 E310 V311 Q315 M316 E318 H346	R309-H313 WeakPolarHBondContact O-CB 3.39Å; R309-H313 PolarHBondContact O-N 2.72Å; E310-H313 WeakPolarHBondContact O-CB 3.42Å; E310-H313 PolarHBondContact O-N 3.4Å; V311-H313 VanDerWaalsContact C-N 3.27Å; V311-H313 PolarHBondContact O-N 3.25Å; H313-Q315 VanDerWaalsContact C-N 3.26Å; H313-Q315 PolarHBondContact O-N 3.4Å; H313-M316 PolarHBondContact O-N 2.98Å; H313-E318 IonicContact CE1-OE1 2.68Å; H313-E318 IonicContact CG-OE1 3.68Å; H313-E318 IonicContact ND1-OE1 3.73Å; H313-E318 PolarHBondContact ND1-OE1 2.89Å; H313-E318 IonicContact ND1-OE2 3.53Å; H313-H346 AromaticContact CD2-CE1 3.79Å; H313-H346 AromaticContact CG-CE1 3.83Å
314	E	92	Very high	93.7	Very high	127 Å²	127	49.6 Å²	49.6	59%	0.593	24%	0.242	S	C	*	.	H	α-helix	trans	-61.1	-35.9	174.5	-69.5	-178.4	165.4	0	0	112.3	E310 V311 M316	E310-E314 WeakPolarHBondContact O-CG 3.31Å; E310-E314 PolarHBondContact O-N 3.06Å; V311-E314 WeakPolarHBondContact O-CB 3.42Å; V311-E314 PolarHBondContact O-N 3.26Å; V311-E314 VanDerWaalsContact O-N 3.16Å; E314-M316 PolarHBondContact O-N 3.46Å
315	Q	90.6	Very high	93.8	Very high	84 Å²	84	43.9 Å²	43.9	39%	0.393	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	5.6	174.9	-59.9	-48.3	-49.2	0	0	113.9	T277 V311 F312 H313 I317	T277-Q315 HydrophobicContact CG2-CG 4.12Å; V311-Q315 HydrophobicContact CG1-CG 4.25Å; V311-Q315 VanDerWaalsContact O-CG 3.32Å; V311-Q315 WeakPolarHBondContact O-CG 3.35Å; V311-Q315 PolarHBondContact O-N 3.5Å; F312-Q315 CarbonylContact O-C 3.45Å; F312-Q315 PolarHBondContact O-N 3.3Å; H313-Q315 VanDerWaalsContact C-N 3.26Å; H313-Q315 PolarHBondContact O-N 3.4Å; Q315-I317 VanDerWaalsContact C-N 3.27Å; Q315-I317 PolarHBondContact O-N 3.26Å
316	M	93.1	Very high	94	Very high	63 Å²	63	47.1 Å²	47.1	31%	0.31	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	34.9	175.8	-67.7	-74.5	-63.1	0	0	113.7	F312 H313 E314 E318 K319 R352	F312-M316 PolarHBondContact O-N 3.1Å; F312-M316 VanDerWaalsContact O-N 3.12Å; H313-M316 PolarHBondContact O-N 2.98Å; E314-M316 PolarHBondContact O-N 3.46Å; M316-E318 PolarHBondContact O-N 2.94Å; M316-E318 VanDerWaalsContact O-N 3.08Å; M316-K319 WeakPolarHBondContact O-CB 3.32Å; M316-K319 PolarHBondContact O-N 3.23Å; M316-K319 VanDerWaalsContact O-N 3.1Å; M316-R352 PolarHBondContact SD-NH2 3.34Å
317	I	95.6	Very high	94	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-56.7	-28.6	179.7	-162.2	59.6	0	0	0	111.8	A280 I299 F312 Q315 K319 V320 L321 M343	A280-I317 HydrophobicContact CB-CD1 3.81Å; I299-I317 HydrophobicContact CG2-CG1 4.14Å; F312-I317 HydrophobicContact CB-CB 4.09Å; F312-I317 HydrophobicContact CB-CG2 3.65Å; F312-I317 HydrophobicContact CG-CG2 4.48Å; F312-I317 WeakPolarHBondContact O-CB 3.32Å; F312-I317 WeakPolarHBondContact O-CG2 3.49Å; F312-I317 PolarHBondContact O-N 3.42Å; Q315-I317 VanDerWaalsContact C-N 3.27Å; Q315-I317 PolarHBondContact O-N 3.26Å; I317-K319 PolarHBondContact O-N 2.92Å; I317-V320 HydrophobicContact CD1-CB 4.19Å; I317-V320 HydrophobicContact CD1-CG1 4.39Å; I317-V320 WeakPolarHBondContact O-CB 3.44Å; I317-V320 PolarHBondContact O-N 2.96Å; I317-L321 HydrophobicContact CG1-CD1 4.23Å; I317-L321 HydrophobicContact CG1-CG 4.17Å; I317-L321 HydrophobicContact CG2-CD1 4.41Å; I317-L321 WeakPolarHBondContact O-CG 3.47Å; I317-L321 PolarHBondContact O-N 2.95Å; I317-M343 HydrophobicContact CG2-CE 3.69Å; I317-M343 HydrophobicContact CG2-CG 4.23Å; I317-M343 HydrophobicContact CG2-SD 4.1Å
318	E	96.9	Very high	94.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-37.3	-177.9	-62.1	90.4	160.4	0	0	111.1	H313 M316 L321 V322 S349 R352 F353 L356	H313-E318 IonicContact CE1-OE1 2.68Å; H313-E318 IonicContact CG-OE1 3.68Å; H313-E318 IonicContact ND1-OE1 3.73Å; H313-E318 PolarHBondContact ND1-OE1 2.89Å; H313-E318 IonicContact ND1-OE2 3.53Å; M316-E318 PolarHBondContact O-N 2.94Å; M316-E318 VanDerWaalsContact O-N 3.08Å; E318-L321 PolarHBondContact O-N 3.29Å; E318-V322 VanDerWaalsContact O-CG2 3.25Å; E318-V322 WeakPolarHBondContact O-CG2 3.36Å; E318-V322 PolarHBondContact O-N 3.35Å; E318-S349 WeakPolarHBondContact OE1-CB 3.37Å; E318-S349 PolarHBondContact OE1-OG 2.67Å; E318-R352 HydrophobicContact CB-CB 4.4Å; E318-R352 HydrophobicContact CB-CG 3.86Å; E318-R352 HydrophobicContact CG-CB 4.22Å; E318-R352 HydrophobicContact CG-CG 4.09Å; E318-F353 VanDerWaalsContact CA-CE1 3.47Å; E318-F353 HydrophobicContact CB-CD1 3.82Å; E318-F353 HydrophobicContact CB-CE1 3.47Å; E318-F353 VanDerWaalsContact CB-CE1 3.47Å; E318-F353 HydrophobicContact CB-CE2 4.48Å; E318-F353 HydrophobicContact CB-CG 4.45Å; E318-F353 HydrophobicContact CB-CZ 3.85Å; E318-F353 HydrophobicContact CG-CD1 4.17Å; E318-F353 HydrophobicContact CG-CD2 4.27Å; E318-F353 HydrophobicContact CG-CE1 3.7Å; E318-F353 HydrophobicContact CG-CE2 3.81Å; E318-F353 HydrophobicContact CG-CG 4.43Å; E318-F353 HydrophobicContact CG-CZ 3.5Å; E318-F353 VanDerWaalsContact CG-CZ 3.5Å; E318-L356 HydrophobicContact CB-CD1 3.91Å
319	K	96.1	Very high	94.2	Very high	103 Å²	103	47.5 Å²	47.5	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-45.4	175.5	-173.6	-174.2	174.2	-159.5	0	111.2	M316 I317 V322 E323 L356	M316-K319 WeakPolarHBondContact O-CB 3.32Å; M316-K319 PolarHBondContact O-N 3.23Å; M316-K319 VanDerWaalsContact O-N 3.1Å; I317-K319 PolarHBondContact O-N 2.92Å; K319-V322 PolarHBondContact O-N 2.97Å; K319-E323 WeakPolarHBondContact CE-OE1 3.29Å; K319-E323 IonicContact NZ-OE1 2.85Å; K319-E323 WeakPolarHBondContact O-CG 3.43Å; K319-E323 PolarHBondContact O-N 3.4Å; K319-L356 HydrophobicContact CB-CD1 4.09Å; K319-L356 HydrophobicContact CB-CD2 4.45Å; K319-L356 HydrophobicContact CG-CD2 4.39Å
320	V	95.4	Very high	94.2	Very high	17 Å²	17	48.5 Å²	48.5	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-47.6	178.2	176.1	0	0	0	0	110.6	V283 L284 I317 V322 E323 L324	V283-V320 HydrophobicContact CB-CG1 4.37Å; V283-V320 HydrophobicContact CG1-CG1 3.87Å; L284-V320 HydrophobicContact CD1-CG2 3.89Å; L284-V320 HydrophobicContact CD2-CB 4.47Å; L284-V320 HydrophobicContact CD2-CG1 3.69Å; L284-V320 HydrophobicContact CD2-CG2 4.33Å; L284-V320 HydrophobicContact CG-CG1 3.86Å; L284-V320 HydrophobicContact CG-CG2 4.17Å; I317-V320 HydrophobicContact CD1-CB 4.19Å; I317-V320 HydrophobicContact CD1-CG1 4.39Å; I317-V320 WeakPolarHBondContact O-CB 3.44Å; I317-V320 PolarHBondContact O-N 2.96Å; V320-V322 VanDerWaalsContact C-N 3.33Å; V320-V322 PolarHBondContact O-N 3.42Å; V320-E323 PolarHBondContact O-N 2.93Å; V320-L324 HydrophobicContact CG1-CD1 4.14Å; V320-L324 WeakPolarHBondContact O-CG 3.48Å; V320-L324 PolarHBondContact O-N 3.1Å
321	L	96.9	Very high	94.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-38.6	179.7	-66.1	175.4	0	0	0	112.3	I296 I317 E318 L324 L325 A339 I340 M343 F353	I296-L321 HydrophobicContact CG2-CD2 4.19Å; I317-L321 HydrophobicContact CG1-CD1 4.23Å; I317-L321 HydrophobicContact CG1-CG 4.17Å; I317-L321 HydrophobicContact CG2-CD1 4.41Å; I317-L321 WeakPolarHBondContact O-CG 3.47Å; I317-L321 PolarHBondContact O-N 2.95Å; E318-L321 PolarHBondContact O-N 3.29Å; L321-L324 HydrophobicContact CD2-CD1 4.47Å; L321-L324 PolarHBondContact O-N 3.3Å; L321-L325 WeakPolarHBondContact O-CG 3.45Å; L321-L325 PolarHBondContact O-N 2.85Å; L321-A339 HydrophobicContact CD1-CB 3.82Å; L321-A339 HydrophobicContact CD2-CB 3.68Å; L321-A339 HydrophobicContact CG-CB 4.41Å; L321-I340 HydrophobicContact CB-CD1 4.42Å; L321-I340 HydrophobicContact CB-CG1 4.01Å; L321-I340 HydrophobicContact CD1-CG1 4.19Å; L321-M343 HydrophobicContact CD1-CG 4.24Å; L321-F353 HydrophobicContact CB-CE1 4.19Å; L321-F353 HydrophobicContact CD1-CE1 4.33Å; L321-F353 HydrophobicContact CD1-CZ 4.03Å
322	V	96.8	Very high	94.5	Very high	12 Å²	12	47 Å²	47	7%	0.073	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-40.3	175.5	171.5	0	0	0	0	111.6	E318 K319 V320 L324 L325 F353 L356 I361	E318-V322 VanDerWaalsContact O-CG2 3.25Å; E318-V322 WeakPolarHBondContact O-CG2 3.36Å; E318-V322 PolarHBondContact O-N 3.35Å; K319-V322 PolarHBondContact O-N 2.97Å; V320-V322 VanDerWaalsContact C-N 3.33Å; V320-V322 PolarHBondContact O-N 3.42Å; V322-L324 VanDerWaalsContact C-N 3.29Å; V322-L324 PolarHBondContact O-N 3.15Å; V322-L325 WeakPolarHBondContact O-CB 3.4Å; V322-L325 PolarHBondContact O-N 3.49Å; V322-F353 HydrophobicContact CG2-CD1 3.82Å; V322-F353 HydrophobicContact CG2-CE1 4.33Å; V322-L356 HydrophobicContact CG2-CB 4.17Å; V322-I361 HydrophobicContact CG1-CD1 4.06Å
323	E	95	Very high	94.6	Very high	100 Å²	100	48.6 Å²	48.6	47%	0.467	27%	0.266	S	S	.	.	H	α-helix	trans	-60.8	-39.2	174.3	-72	173.8	-172.8	0	0	111.5	K319 V320 L325 S326	K319-E323 WeakPolarHBondContact CE-OE1 3.29Å; K319-E323 IonicContact NZ-OE1 2.85Å; K319-E323 WeakPolarHBondContact O-CG 3.43Å; K319-E323 PolarHBondContact O-N 3.4Å; V320-E323 PolarHBondContact O-N 2.93Å; E323-L325 VanDerWaalsContact C-N 3.31Å; E323-L325 PolarHBondContact O-N 2.63Å; E323-S326 PolarHBondContact O-N 3.5Å
324	L	95.1	Very high	94.7	Very high	13 Å²	13	46.5 Å²	46.5	7%	0.068	26%	0.257	C	S	.	.	H	α-helix	trans	-71	-19.3	179.1	-65	171.8	0	0	0	114.5	V283 Q292 I296 V320 L321 V322 S326 A327 V332 A336	V283-L324 HydrophobicContact CG1-CD1 3.3Å; V283-L324 HydrophobicContact CG1-CG 4.5Å; Q292-L324 HydrophobicContact CG-CD2 4.48Å; Q292-L324 VanDerWaalsContact NE2-CD2 3.25Å; I296-L324 HydrophobicContact CD1-CD1 3.64Å; I296-L324 HydrophobicContact CG1-CD1 3.91Å; V320-L324 HydrophobicContact CG1-CD1 4.14Å; V320-L324 WeakPolarHBondContact O-CG 3.48Å; V320-L324 PolarHBondContact O-N 3.1Å; L321-L324 HydrophobicContact CD2-CD1 4.47Å; L321-L324 PolarHBondContact O-N 3.3Å; V322-L324 VanDerWaalsContact C-N 3.29Å; V322-L324 PolarHBondContact O-N 3.15Å; L324-S326 PolarHBondContact O-N 3.48Å; L324-A327 WeakPolarHBondContact O-CB 3.5Å; L324-A327 PolarHBondContact O-N 3.29Å; L324-V332 HydrophobicContact CB-CG1 4.45Å; L324-V332 HydrophobicContact CD2-CG1 4.32Å; L324-A336 HydrophobicContact CB-CB 4.02Å
325	L	95.4	Very high	95	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.4	171.6	-64.3	176.6	0	0	0	112.4	L321 V322 E323 K333 A336 C337 I340 I361 V362 L365	L321-L325 WeakPolarHBondContact O-CG 3.45Å; L321-L325 PolarHBondContact O-N 2.85Å; V322-L325 WeakPolarHBondContact O-CB 3.4Å; V322-L325 PolarHBondContact O-N 3.49Å; E323-L325 VanDerWaalsContact C-N 3.31Å; E323-L325 PolarHBondContact O-N 2.63Å; L325-K333 WeakPolarHBondContact O-CG 3.46Å; L325-A336 HydrophobicContact CD2-CB 4.03Å; L325-C337 VanDerWaalsContact CD2-SG 3.57Å; L325-I340 HydrophobicContact CD1-CD1 3.81Å; L325-I340 HydrophobicContact CD2-CD1 3.87Å; L325-I340 HydrophobicContact CG-CD1 4.07Å; L325-I361 HydrophobicContact CB-CG2 3.62Å; L325-I361 HydrophobicContact CD1-CB 4.21Å; L325-I361 HydrophobicContact CD1-CG2 3.95Å; L325-I361 HydrophobicContact CG-CG2 4.43Å; L325-V362 HydrophobicContact CD1-CG2 3.63Å; L325-V362 HydrophobicContact CD2-CG2 4.41Å; L325-L365 HydrophobicContact CB-CD1 4.36Å; L325-L365 HydrophobicContact CD2-CD1 3.86Å
326	S	93.1	Very high	95.3	Very high	91 Å²	91	36.7 Å²	36.7	64%	0.636	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	10.2	176.4	-58.2	0	0	0	0	113.4	E323 L324	E323-S326 PolarHBondContact O-N 3.5Å; L324-S326 PolarHBondContact O-N 3.48Å
327	A	92.4	Very high	95.6	Very high	23 Å²	23	33.7 Å²	33.7	19%	0.19	20%	0.197	C	C	.	.			trans	-60.6	160.8	176.7	0	0	0	0	0	112	L324 V332 K333	L324-A327 WeakPolarHBondContact O-CB 3.5Å; L324-A327 PolarHBondContact O-N 3.29Å; A327-V332 HydrophobicContact CB-CB 4.11Å; A327-V332 HydrophobicContact CB-CG1 3.71Å; A327-K333 HydrophobicContact CB-CG 4.48Å; A327-K333 WeakPolarHBondContact O-CE 3.28Å
328	A	91.4	Very high	95.7	Very high	104 Å²	104	36.9 Å²	36.9	86%	0.86	21%	0.212	S	C	*	.	S	Bend	trans	-74.5	-33.4	176.6	0	0	0	0	0	112.5
329	D	94.2	Very high	95.7	Very high	50 Å²	50	36.9 Å²	36.9	27%	0.267	21%	0.212	S	C	.	.			trans	-89.6	131.8	-174.2	-177.1	-90.2	0	0	0	112.2	P289 N331 V332 K333	P289-D329 HydrophobicContact CB-CB 3.84Å; P289-D329 HydrophobicContact CG-CB 4.32Å; D329-N331 PolarHBondContact O-N 2.92Å; D329-N331 VanDerWaalsContact OD1-CA 3.31Å; D329-N331 WeakPolarHBondContact OD1-CA 3.38Å; D329-N331 WeakPolarHBondContact OD1-CB 3.23Å; D329-N331 PolarHBondContact OD1-N 3.38Å; D329-N331 PolarHBondContact OD1-ND2 3.45Å; D329-V332 HydrophobicContact CB-CB 4.35Å; D329-V332 HydrophobicContact CB-CG2 4.01Å; D329-V332 PolarHBondContact O-N 3.29Å; D329-V332 PolarHBondContact OD1-N 3.44Å; D329-K333 WeakPolarHBondContact O-CG 3.44Å; D329-K333 PolarHBondContact O-N 2.86Å
330	D	95.2	Very high	95.8	Very high	55 Å²	55	32 Å²	32	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-72.8	-24.5	-177.3	-76.8	-9.8	0	0	0	113.4	K333 A334 L373	D330-K333 PolarHBondContact O-N 3.02Å; D330-K333 IonicContact OD1-NZ 2.77Å; D330-K333 PolarHBondContact OD1-NZ 2.92Å; D330-A334 VanDerWaalsContact O-CB 3.28Å; D330-A334 WeakPolarHBondContact O-CB 3.21Å; D330-A334 PolarHBondContact O-N 2.89Å; D330-L373 HydrophobicContact CB-CD2 3.98Å
331	N	94.3	Very high	95.9	Very high	90 Å²	90	31.4 Å²	31.4	48%	0.481	19%	0.188	S	C	.	.	H	α-helix	trans	-72.8	-35.8	175.3	-55.7	-62.6	0	0	0	111.3	D329 A334 S335	D329-N331 PolarHBondContact O-N 2.92Å; D329-N331 VanDerWaalsContact OD1-CA 3.31Å; D329-N331 WeakPolarHBondContact OD1-CA 3.38Å; D329-N331 WeakPolarHBondContact OD1-CB 3.23Å; D329-N331 PolarHBondContact OD1-N 3.38Å; D329-N331 PolarHBondContact OD1-ND2 3.45Å; N331-A334 PolarHBondContact O-N 2.89Å; N331-S335 WeakPolarHBondContact O-CB 3.44Å; N331-S335 PolarHBondContact O-N 2.99Å; N331-S335 PolarHBondContact O-OG 3.47Å
332	V	95.6	Very high	95.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-48.6	171.9	175.8	0	0	0	0	110	P289 Q292 I296 L324 A327 D329 A334 S335 A336	P289-V332 HydrophobicContact CB-CG2 3.88Å; P289-V332 WeakPolarHBondContact O-CG2 3.41Å; Q292-V332 HydrophobicContact CB-CG2 4.46Å; Q292-V332 HydrophobicContact CG-CG1 4.33Å; I296-V332 HydrophobicContact CD1-CG1 4Å; L324-V332 HydrophobicContact CB-CG1 4.45Å; L324-V332 HydrophobicContact CD2-CG1 4.32Å; A327-V332 HydrophobicContact CB-CB 4.11Å; A327-V332 HydrophobicContact CB-CG1 3.71Å; D329-V332 HydrophobicContact CB-CB 4.35Å; D329-V332 HydrophobicContact CB-CG2 4.01Å; D329-V332 PolarHBondContact O-N 3.29Å; D329-V332 PolarHBondContact OD1-N 3.44Å; V332-A334 VanDerWaalsContact C-N 3.34Å; V332-A334 PolarHBondContact O-N 3.4Å; V332-S335 PolarHBondContact O-N 3.4Å; V332-A336 WeakPolarHBondContact O-CB 3.5Å; V332-A336 PolarHBondContact O-N 2.95Å
333	K	96.8	Very high	95.9	Very high	35 Å²	35	31.1 Å²	31.1	15%	0.152	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-44.2	175.7	-62.7	175.9	-160.9	154.3	0	112	L325 A327 D329 D330 S335 A336 C337 L365 L373	L325-K333 WeakPolarHBondContact O-CG 3.46Å; A327-K333 HydrophobicContact CB-CG 4.48Å; A327-K333 WeakPolarHBondContact O-CE 3.28Å; D329-K333 WeakPolarHBondContact O-CG 3.44Å; D329-K333 PolarHBondContact O-N 2.86Å; D330-K333 PolarHBondContact O-N 3.02Å; D330-K333 IonicContact OD1-NZ 2.77Å; D330-K333 PolarHBondContact OD1-NZ 2.92Å; K333-S335 VanDerWaalsContact C-N 3.35Å; K333-S335 PolarHBondContact O-N 2.77Å; K333-A336 WeakPolarHBondContact O-CB 3.46Å; K333-A336 PolarHBondContact O-N 3.04Å; K333-C337 PolarHBondContact O-N 3.27Å; K333-C337 PolarHBondContact O-SG 3.4Å; K333-C337 VanDerWaalsContact O-SG 3.39Å; K333-L365 HydrophobicContact CD-CD2 3.98Å; K333-L373 HydrophobicContact CB-CD1 3.52Å; K333-L373 HydrophobicContact CB-CD2 4.11Å; K333-L373 HydrophobicContact CB-CG 4.5Å; K333-L373 HydrophobicContact CD-CD2 3.82Å
334	A	97.4	Very high	96	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.033	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-43.1	-179.9	0	0	0	0	0	111.2	D330 N331 V332 A336 C337 Q338 V372 L373 A376	D330-A334 VanDerWaalsContact O-CB 3.28Å; D330-A334 WeakPolarHBondContact O-CB 3.21Å; D330-A334 PolarHBondContact O-N 2.89Å; N331-A334 PolarHBondContact O-N 2.89Å; V332-A334 VanDerWaalsContact C-N 3.34Å; V332-A334 PolarHBondContact O-N 3.4Å; A334-A336 VanDerWaalsContact C-N 3.34Å; A334-A336 PolarHBondContact O-N 3.29Å; A334-C337 PolarHBondContact O-N 3.19Å; A334-Q338 WeakPolarHBondContact O-CG 3.34Å; A334-Q338 PolarHBondContact O-N 3.16Å; A334-V372 HydrophobicContact CB-CG1 4.24Å; A334-L373 HydrophobicContact CB-CB 4.42Å; A334-L373 HydrophobicContact CB-CD1 4.17Å; A334-A376 HydrophobicContact CB-CB 4.11Å; A334-A376 WeakPolarHBondContact O-CB 3.39Å
335	S	97.1	Very high	96	Very high	5 Å²	5	32 Å²	32	4%	0.035	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-39.6	175.4	-56.8	0	0	0	0	111.3	S293 I296 N331 V332 K333 Q338 A339	S293-S335 PolarHBondContact OG-OG 2.88Å; I296-S335 VanDerWaalsContact CG2-C 3.44Å; I296-S335 WeakPolarHBondContact CG2-O 3.34Å; N331-S335 WeakPolarHBondContact O-CB 3.44Å; N331-S335 PolarHBondContact O-N 2.99Å; N331-S335 PolarHBondContact O-OG 3.47Å; V332-S335 PolarHBondContact O-N 3.4Å; K333-S335 VanDerWaalsContact C-N 3.35Å; K333-S335 PolarHBondContact O-N 2.77Å; S335-Q338 PolarHBondContact O-N 2.91Å; S335-A339 PolarHBondContact O-N 3.11Å
336	A	97.6	Very high	96	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.9	-44.2	174.5	0	0	0	0	0	111.6	L324 L325 V332 K333 A334 Q338 A339 I340	L324-A336 HydrophobicContact CB-CB 4.02Å; L325-A336 HydrophobicContact CD2-CB 4.03Å; V332-A336 WeakPolarHBondContact O-CB 3.5Å; V332-A336 PolarHBondContact O-N 2.95Å; K333-A336 WeakPolarHBondContact O-CB 3.46Å; K333-A336 PolarHBondContact O-N 3.04Å; A334-A336 VanDerWaalsContact C-N 3.34Å; A334-A336 PolarHBondContact O-N 3.29Å; A336-Q338 VanDerWaalsContact C-N 3.34Å; A336-Q338 PolarHBondContact O-N 3.44Å; A336-A339 PolarHBondContact O-N 3.15Å; A336-I340 VanDerWaalsContact O-CG1 3.23Å; A336-I340 WeakPolarHBondContact O-CG1 3.38Å; A336-I340 PolarHBondContact O-N 3.08Å
337	C	98.3	Very high	96.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-41.3	173.8	-68.8	0	0	0	0	112.6	L325 K333 A334 I340 A341 A376 A380	L325-C337 VanDerWaalsContact CD2-SG 3.57Å; K333-C337 PolarHBondContact O-N 3.27Å; K333-C337 PolarHBondContact O-SG 3.4Å; K333-C337 VanDerWaalsContact O-SG 3.39Å; A334-C337 PolarHBondContact O-N 3.19Å; C337-I340 PolarHBondContact O-N 3.47Å; C337-A341 PolarHBondContact O-N 2.64Å; C337-A376 HydrophobicContact CB-CB 3.81Å; C337-A376 WeakPolarHBondContact CB-O 3.5Å; C337-A380 HydrophobicContact CB-CB 4.16Å; C337-A380 WeakPolarHBondContact O-CB 3.37Å
338	Q	97.8	Very high	96.2	Very high	68 Å²	68	35.5 Å²	35.5	32%	0.318	20%	0.204	S	C	.	.	H	α-helix	trans	-62.7	-42.7	175.3	-70.2	171.8	-1.8	0	0	112.1	T300 A334 S335 A336 A341 A342 A376	T300-Q338 HydrophobicContact CG2-CB 4.33Å; A334-Q338 WeakPolarHBondContact O-CG 3.34Å; A334-Q338 PolarHBondContact O-N 3.16Å; S335-Q338 PolarHBondContact O-N 2.91Å; A336-Q338 VanDerWaalsContact C-N 3.34Å; A336-Q338 PolarHBondContact O-N 3.44Å; Q338-A341 WeakPolarHBondContact O-CB 3.45Å; Q338-A341 PolarHBondContact O-N 2.96Å; Q338-A342 PolarHBondContact O-N 3.39Å; Q338-A376 HydrophobicContact CG-CB 4.14Å
339	A	97.6	Very high	96.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-40.2	175	0	0	0	0	0	112	I296 T300 L321 S335 A336 A341 A342 M343	I296-A339 HydrophobicContact CG2-CB 3.67Å; T300-A339 VanDerWaalsContact OG1-CA 3.32Å; T300-A339 WeakPolarHBondContact OG1-CA 3.32Å; T300-A339 WeakPolarHBondContact OG1-CB 3.49Å; T300-A339 PolarHBondContact OG1-N 3.25Å; L321-A339 HydrophobicContact CD1-CB 3.82Å; L321-A339 HydrophobicContact CD2-CB 3.68Å; L321-A339 HydrophobicContact CG-CB 4.41Å; S335-A339 PolarHBondContact O-N 3.11Å; A336-A339 PolarHBondContact O-N 3.15Å; A339-A341 VanDerWaalsContact C-N 3.34Å; A339-A341 PolarHBondContact O-N 2.93Å; A339-A342 PolarHBondContact O-N 3.3Å; A339-M343 WeakPolarHBondContact O-CB 3.42Å; A339-M343 WeakPolarHBondContact O-CG 3.48Å; A339-M343 PolarHBondContact O-N 3.41Å
340	I	98.3	Very high	96.6	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-43.7	173.9	-68.3	168.8	0	0	0	110.6	L321 L325 A336 C337 A342 M343 S344 F353 V362 A380 L384	L321-I340 HydrophobicContact CB-CD1 4.42Å; L321-I340 HydrophobicContact CB-CG1 4.01Å; L321-I340 HydrophobicContact CD1-CG1 4.19Å; L325-I340 HydrophobicContact CD1-CD1 3.81Å; L325-I340 HydrophobicContact CD2-CD1 3.87Å; L325-I340 HydrophobicContact CG-CD1 4.07Å; A336-I340 VanDerWaalsContact O-CG1 3.23Å; A336-I340 WeakPolarHBondContact O-CG1 3.38Å; A336-I340 PolarHBondContact O-N 3.08Å; C337-I340 PolarHBondContact O-N 3.47Å; I340-A342 VanDerWaalsContact C-N 3.32Å; I340-A342 PolarHBondContact O-N 2.98Å; I340-M343 PolarHBondContact O-N 2.96Å; I340-S344 WeakPolarHBondContact O-CB 3.43Å; I340-S344 PolarHBondContact O-N 3.28Å; I340-S344 PolarHBondContact O-OG 2.96Å; I340-F353 HydrophobicContact CB-CE1 4.4Å; I340-F353 HydrophobicContact CB-CE2 4.39Å; I340-F353 HydrophobicContact CB-CZ 4.12Å; I340-F353 HydrophobicContact CD1-CE1 4.3Å; I340-F353 HydrophobicContact CG1-CD1 4.27Å; I340-F353 HydrophobicContact CG1-CE1 3.63Å; I340-F353 HydrophobicContact CG1-CE2 4.46Å; I340-F353 HydrophobicContact CG1-CZ 3.74Å; I340-F353 HydrophobicContact CG2-CD1 4.39Å; I340-F353 HydrophobicContact CG2-CD2 4.03Å; I340-F353 HydrophobicContact CG2-CE1 4.29Å; I340-F353 HydrophobicContact CG2-CE2 3.92Å; I340-F353 HydrophobicContact CG2-CG 4.28Å; I340-F353 HydrophobicContact CG2-CZ 4.06Å; I340-V362 HydrophobicContact CD1-CG2 4.43Å; I340-A380 HydrophobicContact CB-CB 4.5Å; I340-A380 HydrophobicContact CG2-CB 4.26Å; I340-L384 HydrophobicContact CG2-CD1 3.8Å; I340-L384 HydrophobicContact CG2-CD2 4.25Å; I340-L384 HydrophobicContact CG2-CG 4.11Å
341	A	97.9	Very high	96.7	Very high	4 Å²	4	29 Å²	29	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-60.3	-41.7	176.8	0	0	0	0	0	111.7	C337 Q338 A339 S344 Q379 A380	C337-A341 PolarHBondContact O-N 2.64Å; Q338-A341 WeakPolarHBondContact O-CB 3.45Å; Q338-A341 PolarHBondContact O-N 2.96Å; A339-A341 VanDerWaalsContact C-N 3.34Å; A339-A341 PolarHBondContact O-N 2.93Å; A341-S344 WeakPolarHBondContact O-CB 3.19Å; A341-S344 PolarHBondContact O-N 3.37Å; A341-Q379 HydrophobicContact CB-CG 4.48Å; A341-A380 HydrophobicContact CB-CB 4.42Å
342	A	97.2	Very high	96.8	Very high	5 Å²	5	28.2 Å²	28.2	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-69.5	-42.5	176.7	0	0	0	0	0	112.7	T300 A303 R309 Q338 A339 I340 S344 F345	T300-A342 HydrophobicContact CG2-CB 4.07Å; A303-A342 HydrophobicContact CB-CB 3.91Å; R309-A342 WeakPolarHBondContact CD-O 3.47Å; Q338-A342 PolarHBondContact O-N 3.39Å; A339-A342 PolarHBondContact O-N 3.3Å; I340-A342 VanDerWaalsContact C-N 3.32Å; I340-A342 PolarHBondContact O-N 2.98Å; A342-S344 VanDerWaalsContact C-N 3.25Å; A342-S344 PolarHBondContact O-N 3.26Å; A342-F345 WeakPolarHBondContact O-CD2 3.47Å; A342-F345 PolarHBondContact O-N 3.3Å
343	M	97.3	Very high	96.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.3	-28.1	176.2	-74.1	-59.7	-59.2	0	0	112.4	A303 R309 F312 I317 L321 A339 I340 F345 H346 S349 F353	A303-M343 HydrophobicContact CB-CG 4.47Å; A303-M343 HydrophobicContact CB-SD 3.87Å; R309-M343 HydrophobicContact CB-CE 4.4Å; R309-M343 HydrophobicContact CB-SD 4.4Å; R309-M343 HydrophobicContact CG-SD 4.06Å; F312-M343 HydrophobicContact CB-CE 3.74Å; F312-M343 HydrophobicContact CB-SD 3.89Å; F312-M343 HydrophobicContact CD2-SD 3.94Å; F312-M343 HydrophobicContact CG-SD 4.35Å; I317-M343 HydrophobicContact CG2-CE 3.69Å; I317-M343 HydrophobicContact CG2-CG 4.23Å; I317-M343 HydrophobicContact CG2-SD 4.1Å; L321-M343 HydrophobicContact CD1-CG 4.24Å; A339-M343 WeakPolarHBondContact O-CB 3.42Å; A339-M343 WeakPolarHBondContact O-CG 3.48Å; A339-M343 PolarHBondContact O-N 3.41Å; I340-M343 PolarHBondContact O-N 2.96Å; M343-F345 PolarHBondContact O-N 3.09Å; M343-F345 VanDerWaalsContact O-N 3.1Å; M343-H346 WeakPolarHBondContact O-CB 3.16Å; M343-H346 PolarHBondContact O-N 3.02Å; M343-S349 WeakPolarHBondContact O-CB 3.43Å; M343-F353 HydrophobicContact CB-CE2 3.79Å; M343-F353 HydrophobicContact CB-CZ 3.98Å
344	S	96.8	Very high	97	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17	178.8	-65.1	0	0	0	0	113.6	I340 A341 A342 H346 K350 L384	I340-S344 WeakPolarHBondContact O-CB 3.43Å; I340-S344 PolarHBondContact O-N 3.28Å; I340-S344 PolarHBondContact O-OG 2.96Å; A341-S344 WeakPolarHBondContact O-CB 3.19Å; A341-S344 PolarHBondContact O-N 3.37Å; A342-S344 VanDerWaalsContact C-N 3.25Å; A342-S344 PolarHBondContact O-N 3.26Å; S344-H346 PolarHBondContact O-N 2.94Å; S344-H346 VanDerWaalsContact O-N 3.17Å; S344-K350 WeakPolarHBondContact O-CE 3.31Å; S344-K350 WeakPolarHBondContact O-CG 3.37Å; S344-L384 VanDerWaalsContact OG-CD2 3.27Å; S344-L384 WeakPolarHBondContact OG-CD2 3.45Å; S344-L384 WeakPolarHBondContact OG-CG 3.49Å
345	F	94.9	Very high	96.9	Very high	132 Å²	132	35 Å²	35	58%	0.579	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.1	170.2	-71.2	-79.7	0	0	0	113.1	A342 M343	A342-F345 WeakPolarHBondContact O-CD2 3.47Å; A342-F345 PolarHBondContact O-N 3.3Å; M343-F345 PolarHBondContact O-N 3.09Å; M343-F345 VanDerWaalsContact O-N 3.1Å
346	H	95.7	Very high	96.9	Very high	37 Å²	37	37 Å²	37	17%	0.171	18%	0.183	C	C	.	.	S	Bend	trans	-93.2	117.6	168.8	-172.5	-104.9	0	0	0	110.6	R309 H313 M343 S344 C348 S349 K350	R309-H346 HydrophobicContact CB-CB 4.09Å; H313-H346 AromaticContact CD2-CE1 3.79Å; H313-H346 AromaticContact CG-CE1 3.83Å; M343-H346 WeakPolarHBondContact O-CB 3.16Å; M343-H346 PolarHBondContact O-N 3.02Å; S344-H346 PolarHBondContact O-N 2.94Å; S344-H346 VanDerWaalsContact O-N 3.17Å; H346-C348 PolarHBondContact O-N 3.32Å; H346-S349 PolarHBondContact ND1-N 3.21Å; H346-S349 PolarHBondContact ND1-OG 3.11Å; H346-S349 VanDerWaalsContact ND1-OG 3.11Å; H346-S349 WeakPolarHBondContact O-CB 3.27Å; H346-S349 PolarHBondContact O-N 3.1Å; H346-S349 VanDerWaalsContact O-N 3.07Å; H346-K350 PolarHBondContact O-N 3.41Å
347	P	93.6	Very high	96.9	Very high	87 Å²	87	43 Å²	43	57%	0.565	21%	0.211	S	C	*	.	H	α-helix	trans	-56.2	-44.2	-174.2	-27.9	35.3	0	0	0	114.4	S349 K350 D351	P347-S349 PolarHBondContact O-N 2.76Å; P347-K350 WeakPolarHBondContact O-CB 3.28Å; P347-K350 PolarHBondContact O-N 2.65Å; P347-K350 VanDerWaalsContact O-N 3.14Å; P347-D351 PolarHBondContact O-N 3.33Å
348	C	96.1	Very high	96.8	Very high	65 Å²	65	43 Å²	43	44%	0.439	21%	0.212	S	C	.	.	H	α-helix	trans	-65.5	-29.7	-179.9	-53	0	0	0	0	112.3	H346 K350 D351 R352	H346-C348 PolarHBondContact O-N 3.32Å; C348-K350 VanDerWaalsContact C-N 3.33Å; C348-D351 PolarHBondContact O-N 3.15Å; C348-R352 WeakPolarHBondContact O-CB 3.46Å; C348-R352 PolarHBondContact O-N 3.4Å
349	S	96.8	Very high	96.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-34.4	177.3	-59.4	0	0	0	0	111.1	E318 M343 H346 P347 D351 R352 F353	E318-S349 WeakPolarHBondContact OE1-CB 3.37Å; E318-S349 PolarHBondContact OE1-OG 2.67Å; M343-S349 WeakPolarHBondContact O-CB 3.43Å; H346-S349 PolarHBondContact ND1-N 3.21Å; H346-S349 PolarHBondContact ND1-OG 3.11Å; H346-S349 VanDerWaalsContact ND1-OG 3.11Å; H346-S349 WeakPolarHBondContact O-CB 3.27Å; H346-S349 PolarHBondContact O-N 3.1Å; H346-S349 VanDerWaalsContact O-N 3.07Å; P347-S349 PolarHBondContact O-N 2.76Å; S349-D351 PolarHBondContact O-N 3.15Å; S349-R352 PolarHBondContact O-N 3.2Å; S349-F353 WeakPolarHBondContact O-CD2 3.37Å; S349-F353 WeakPolarHBondContact O-CG 3.27Å; S349-F353 PolarHBondContact O-N 2.94Å
350	K	96.5	Very high	96.8	Very high	21 Å²	21	41.5 Å²	41.5	9%	0.091	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-47.2	173.2	-63.8	-168.8	-177	-156.7	0	112	S344 H346 P347 C348 R352 R354 S383 H386 N388 N391	S344-K350 WeakPolarHBondContact O-CE 3.31Å; S344-K350 WeakPolarHBondContact O-CG 3.37Å; H346-K350 PolarHBondContact O-N 3.41Å; P347-K350 WeakPolarHBondContact O-CB 3.28Å; P347-K350 PolarHBondContact O-N 2.65Å; P347-K350 VanDerWaalsContact O-N 3.14Å; C348-K350 VanDerWaalsContact C-N 3.33Å; K350-R352 VanDerWaalsContact C-N 3.35Å; K350-R354 PolarHBondContact O-N 2.93Å; K350-S383 VanDerWaalsContact CE-O 3.29Å; K350-S383 WeakPolarHBondContact CE-O 3.48Å; K350-S383 PolarHBondContact NZ-O 3.32Å; K350-H386 PolarHBondContact NZ-O 3Å; K350-N388 HydrophobicContact CD-CB 4.09Å; K350-N391 PolarHBondContact O-ND2 2.67Å
351	D	96.3	Very high	96.8	Very high	53 Å²	53	43.2 Å²	43.2	28%	0.283	22%	0.217	S	C	.	.	H	α-helix	trans	-67.3	-39.6	178.2	-67	-43.6	0	0	0	110.9	P347 C348 S349 F353 R354 E355 N388	P347-D351 PolarHBondContact O-N 3.33Å; C348-D351 PolarHBondContact O-N 3.15Å; S349-D351 PolarHBondContact O-N 3.15Å; D351-F353 PolarHBondContact O-N 2.67Å; D351-R354 WeakPolarHBondContact O-CB 3.35Å; D351-R354 PolarHBondContact O-N 3.4Å; D351-R354 VanDerWaalsContact O-N 3.14Å; D351-R354 IonicContact OD1-CZ 3.63Å; D351-R354 IonicContact OD1-NH1 3.68Å; D351-R354 PolarHBondContact OD1-NH1 2.9Å; D351-R354 IonicContact OD1-NH2 3.11Å; D351-R354 PolarHBondContact OD1-NH2 3.32Å; D351-E355 WeakPolarHBondContact O-CG 3.44Å; D351-E355 PolarHBondContact O-N 3.23Å; D351-N388 PolarHBondContact OD1-ND2 3.45Å
352	R	97.8	Very high	96.8	Very high	73 Å²	73	43 Å²	43	28%	0.275	22%	0.215	S	C	.	.	H	α-helix	trans	-62.1	-42.7	178	-168.1	52.6	141.6	-174.5	-8.5	112.9	M316 E318 C348 S349 K350 R354 E355 L356	M316-R352 PolarHBondContact SD-NH2 3.34Å; E318-R352 HydrophobicContact CB-CB 4.4Å; E318-R352 HydrophobicContact CB-CG 3.86Å; E318-R352 HydrophobicContact CG-CB 4.22Å; E318-R352 HydrophobicContact CG-CG 4.09Å; C348-R352 WeakPolarHBondContact O-CB 3.46Å; C348-R352 PolarHBondContact O-N 3.4Å; S349-R352 PolarHBondContact O-N 3.2Å; K350-R352 VanDerWaalsContact C-N 3.35Å; R352-R354 VanDerWaalsContact C-N 3.27Å; R352-R354 PolarHBondContact O-N 3.26Å; R352-E355 WeakPolarHBondContact CD-OE2 3.45Å; R352-E355 IonicContact CZ-OE2 2.66Å; R352-E355 IonicContact NH1-OE2 2.7Å; R352-E355 PolarHBondContact NH1-OE2 3.05Å; R352-E355 PolarHBondContact O-N 3.37Å; R352-L356 HydrophobicContact CG-CD1 3.88Å; R352-L356 WeakPolarHBondContact O-CB 3.3Å; R352-L356 WeakPolarHBondContact O-CD1 3.44Å; R352-L356 VanDerWaalsContact O-CG 3.22Å; R352-L356 WeakPolarHBondContact O-CG 3.18Å; R352-L356 PolarHBondContact O-N 3.21Å
353	F	98.1	Very high	96.9	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-35.5	174.7	-74.6	-57.4	0	0	0	112.5	E318 L321 V322 I340 M343 S349 D351 G358 L384	E318-F353 VanDerWaalsContact CA-CE1 3.47Å; E318-F353 HydrophobicContact CB-CD1 3.82Å; E318-F353 HydrophobicContact CB-CE1 3.47Å; E318-F353 VanDerWaalsContact CB-CE1 3.47Å; E318-F353 HydrophobicContact CB-CE2 4.48Å; E318-F353 HydrophobicContact CB-CG 4.45Å; E318-F353 HydrophobicContact CB-CZ 3.85Å; E318-F353 HydrophobicContact CG-CD1 4.17Å; E318-F353 HydrophobicContact CG-CD2 4.27Å; E318-F353 HydrophobicContact CG-CE1 3.7Å; E318-F353 HydrophobicContact CG-CE2 3.81Å; E318-F353 HydrophobicContact CG-CG 4.43Å; E318-F353 HydrophobicContact CG-CZ 3.5Å; E318-F353 VanDerWaalsContact CG-CZ 3.5Å; L321-F353 HydrophobicContact CB-CE1 4.19Å; L321-F353 HydrophobicContact CD1-CE1 4.33Å; L321-F353 HydrophobicContact CD1-CZ 4.03Å; V322-F353 HydrophobicContact CG2-CD1 3.82Å; V322-F353 HydrophobicContact CG2-CE1 4.33Å; I340-F353 HydrophobicContact CB-CE1 4.4Å; I340-F353 HydrophobicContact CB-CE2 4.39Å; I340-F353 HydrophobicContact CB-CZ 4.12Å; I340-F353 HydrophobicContact CD1-CE1 4.3Å; I340-F353 HydrophobicContact CG1-CD1 4.27Å; I340-F353 HydrophobicContact CG1-CE1 3.63Å; I340-F353 HydrophobicContact CG1-CE2 4.46Å; I340-F353 HydrophobicContact CG1-CZ 3.74Å; I340-F353 HydrophobicContact CG2-CD1 4.39Å; I340-F353 HydrophobicContact CG2-CD2 4.03Å; I340-F353 HydrophobicContact CG2-CE1 4.29Å; I340-F353 HydrophobicContact CG2-CE2 3.92Å; I340-F353 HydrophobicContact CG2-CG 4.28Å; I340-F353 HydrophobicContact CG2-CZ 4.06Å; M343-F353 HydrophobicContact CB-CE2 3.79Å; M343-F353 HydrophobicContact CB-CZ 3.98Å; S349-F353 WeakPolarHBondContact O-CD2 3.37Å; S349-F353 WeakPolarHBondContact O-CG 3.27Å; S349-F353 PolarHBondContact O-N 2.94Å; D351-F353 PolarHBondContact O-N 2.67Å; F353-G358 WeakPolarHBondContact O-CA 3.35Å; F353-G358 PolarHBondContact O-N 3Å; F353-L384 HydrophobicContact CB-CD2 3.87Å; F353-L384 HydrophobicContact CD2-CD2 3.75Å; F353-L384 HydrophobicContact CG-CD2 4.15Å
354	R	97.2	Very high	96.8	Very high	64 Å²	64	49.4 Å²	49.4	24%	0.242	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-47.9	173.5	-178.4	-173.2	65.7	-116.8	0.3	111.7	K350 D351 R352 L356 E357 V359 N391 A394	K350-R354 PolarHBondContact O-N 2.93Å; D351-R354 WeakPolarHBondContact O-CB 3.35Å; D351-R354 PolarHBondContact O-N 3.4Å; D351-R354 VanDerWaalsContact O-N 3.14Å; D351-R354 IonicContact OD1-CZ 3.63Å; D351-R354 IonicContact OD1-NH1 3.68Å; D351-R354 PolarHBondContact OD1-NH1 2.9Å; D351-R354 IonicContact OD1-NH2 3.11Å; D351-R354 PolarHBondContact OD1-NH2 3.32Å; R352-R354 VanDerWaalsContact C-N 3.27Å; R352-R354 PolarHBondContact O-N 3.26Å; R354-L356 PolarHBondContact O-N 3.43Å; R354-E357 PolarHBondContact O-N 2.97Å; R354-V359 HydrophobicContact CB-CG2 4.28Å; R354-N391 VanDerWaalsContact CB-OD1 3.28Å; R354-N391 WeakPolarHBondContact CB-OD1 3.4Å; R354-N391 WeakPolarHBondContact CD-OD1 3.49Å; R354-N391 PolarHBondContact NH1-OD1 3.37Å; R354-A394 HydrophobicContact CG-CB 4.19Å
355	E	97.1	Very high	96.8	Very high	117 Å²	117	50.3 Å²	50.3	55%	0.547	25%	0.249	S	C	.	.	H	α-helix	trans	-58.3	-30	178.1	-72	173.7	-178.7	0	0	113.5	D351 R352 E357	D351-E355 WeakPolarHBondContact O-CG 3.44Å; D351-E355 PolarHBondContact O-N 3.23Å; R352-E355 WeakPolarHBondContact CD-OE2 3.45Å; R352-E355 IonicContact CZ-OE2 2.66Å; R352-E355 IonicContact NH1-OE2 2.7Å; R352-E355 PolarHBondContact NH1-OE2 3.05Å; R352-E355 PolarHBondContact O-N 3.37Å; E355-E357 VanDerWaalsContact C-N 3.28Å
356	L	97.1	Very high	96.9	Very high	46 Å²	46	44.1 Å²	44.1	24%	0.241	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	9.9	179	-66.9	167.6	0	0	0	113.3	E318 K319 V322 R352 R354 G358	E318-L356 HydrophobicContact CB-CD1 3.91Å; K319-L356 HydrophobicContact CB-CD1 4.09Å; K319-L356 HydrophobicContact CB-CD2 4.45Å; K319-L356 HydrophobicContact CG-CD2 4.39Å; V322-L356 HydrophobicContact CG2-CB 4.17Å; R352-L356 HydrophobicContact CG-CD1 3.88Å; R352-L356 WeakPolarHBondContact O-CB 3.3Å; R352-L356 WeakPolarHBondContact O-CD1 3.44Å; R352-L356 VanDerWaalsContact O-CG 3.22Å; R352-L356 WeakPolarHBondContact O-CG 3.18Å; R352-L356 PolarHBondContact O-N 3.21Å; R354-L356 PolarHBondContact O-N 3.43Å; L356-G358 PolarHBondContact O-N 3.5Å
357	E	96.6	Very high	96.7	Very high	126 Å²	126	46.4 Å²	46.4	59%	0.589	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	25.7	-175.8	-59	-66.6	156.7	0	0	113.3	R354 E355 P360 I361	R354-E357 PolarHBondContact O-N 2.97Å; E355-E357 VanDerWaalsContact C-N 3.28Å; E357-P360 WeakPolarHBondContact O-CD 3.47Å; E357-I361 WeakPolarHBondContact O-CD1 3.49Å; E357-I361 WeakPolarHBondContact O-CG1 3.18Å
358	G	97.1	Very high	96.7	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-70.3	-37.5	178.1	0	0	0	0	0	112.9	F353 L356 I361 V362	F353-G358 WeakPolarHBondContact O-CA 3.35Å; F353-G358 PolarHBondContact O-N 3Å; L356-G358 PolarHBondContact O-N 3.5Å; G358-I361 PolarHBondContact O-N 3.28Å; G358-V362 WeakPolarHBondContact O-CG2 3.4Å; G358-V362 PolarHBondContact O-N 2.98Å
359	V	97.8	Very high	96.4	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-50.6	-177.2	176.7	0	0	0	0	112.2	R354 I361 V362 V363 L381 L384 A394 V395	R354-V359 HydrophobicContact CB-CG2 4.28Å; V359-I361 VanDerWaalsContact C-N 3.28Å; V359-I361 PolarHBondContact O-N 3.01Å; V359-V362 PolarHBondContact O-N 3.02Å; V359-V363 WeakPolarHBondContact O-CG2 3.48Å; V359-V363 PolarHBondContact O-N 3.36Å; V359-L381 HydrophobicContact CG1-CD2 4.4Å; V359-L384 HydrophobicContact CG2-CD1 4.33Å; V359-A394 HydrophobicContact CB-CB 4.25Å; V359-A394 HydrophobicContact CG1-CB 3.91Å; V359-V395 HydrophobicContact CG1-CB 4.39Å; V359-V395 HydrophobicContact CG1-CG2 3.45Å; V359-V395 VanDerWaalsContact CG1-CG2 3.45Å
360	P	97.7	Very high	96.3	Very high	35 Å²	35	51.5 Å²	51.5	23%	0.227	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-35.9	176	-25.7	35.7	0	0	0	113.7	E357 V363 Q364 A398	E357-P360 WeakPolarHBondContact O-CD 3.47Å; P360-V363 PolarHBondContact O-N 3.16Å; P360-Q364 WeakPolarHBondContact O-CG 3.41Å; P360-Q364 PolarHBondContact O-N 3.06Å; P360-Q364 VanDerWaalsContact O-N 3.11Å; P360-A398 HydrophobicContact CB-CB 4.21Å
361	I	97.9	Very high	96.1	Very high	38 Å²	38	53.7 Å²	53.7	20%	0.195	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-46.6	177.2	-60.8	168.1	0	0	0	110	V322 L325 E357 G358 V359 V363 Q364 L365	V322-I361 HydrophobicContact CG1-CD1 4.06Å; L325-I361 HydrophobicContact CB-CG2 3.62Å; L325-I361 HydrophobicContact CD1-CB 4.21Å; L325-I361 HydrophobicContact CD1-CG2 3.95Å; L325-I361 HydrophobicContact CG-CG2 4.43Å; E357-I361 WeakPolarHBondContact O-CD1 3.49Å; E357-I361 WeakPolarHBondContact O-CG1 3.18Å; G358-I361 PolarHBondContact O-N 3.28Å; V359-I361 VanDerWaalsContact C-N 3.28Å; V359-I361 PolarHBondContact O-N 3.01Å; I361-V363 VanDerWaalsContact C-N 3.28Å; I361-V363 PolarHBondContact O-N 3.22Å; I361-Q364 WeakPolarHBondContact O-CB 3.19Å; I361-Q364 PolarHBondContact O-N 3.27Å; I361-Q364 VanDerWaalsContact O-N 3.09Å; I361-L365 WeakPolarHBondContact O-CG 3.42Å; I361-L365 PolarHBondContact O-N 3.2Å
362	V	98	Very high	96.1	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-37.7	177.1	-179.5	0	0	0	0	111.3	L325 I340 G358 V359 Q364 L365 L366 A377 A380 L381	L325-V362 HydrophobicContact CD1-CG2 3.63Å; L325-V362 HydrophobicContact CD2-CG2 4.41Å; I340-V362 HydrophobicContact CD1-CG2 4.43Å; G358-V362 WeakPolarHBondContact O-CG2 3.4Å; G358-V362 PolarHBondContact O-N 2.98Å; V359-V362 PolarHBondContact O-N 3.02Å; V362-Q364 VanDerWaalsContact C-N 3.32Å; V362-Q364 PolarHBondContact O-N 3.02Å; V362-L365 WeakPolarHBondContact O-CB 3.44Å; V362-L365 PolarHBondContact O-N 3.38Å; V362-L365 VanDerWaalsContact O-N 3.13Å; V362-L366 PolarHBondContact O-N 3.16Å; V362-A377 HydrophobicContact CG1-CB 4Å; V362-A377 WeakPolarHBondContact CG1-O 3.39Å; V362-A380 HydrophobicContact CG1-CB 4.26Å; V362-L381 HydrophobicContact CB-CD2 3.91Å; V362-L381 HydrophobicContact CB-CG 4.45Å; V362-L381 HydrophobicContact CG1-CD1 4.35Å; V362-L381 HydrophobicContact CG1-CD2 3.6Å; V362-L381 HydrophobicContact CG1-CG 3.64Å
363	V	97.9	Very high	96	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-39.9	174.2	171.5	0	0	0	0	111.9	V359 P360 I361 L365 L366 L381 V395 A398 I403	V359-V363 WeakPolarHBondContact O-CG2 3.48Å; V359-V363 PolarHBondContact O-N 3.36Å; P360-V363 PolarHBondContact O-N 3.16Å; I361-V363 VanDerWaalsContact C-N 3.28Å; I361-V363 PolarHBondContact O-N 3.22Å; V363-L365 VanDerWaalsContact C-N 3.28Å; V363-L365 PolarHBondContact O-N 3.46Å; V363-L366 VanDerWaalsContact O-CB 3.31Å; V363-L366 WeakPolarHBondContact O-CB 3.37Å; V363-L366 WeakPolarHBondContact O-CG 3.36Å; V363-L366 PolarHBondContact O-N 2.9Å; V363-L381 HydrophobicContact CG2-CD1 3.9Å; V363-L381 HydrophobicContact CG2-CD2 4.27Å; V363-V395 HydrophobicContact CG2-CB 4.42Å; V363-V395 HydrophobicContact CG2-CG1 4Å; V363-V395 HydrophobicContact CG2-CG2 4.35Å; V363-A398 HydrophobicContact CB-CB 4.03Å; V363-A398 HydrophobicContact CG1-CB 3.95Å; V363-A398 HydrophobicContact CG2-CB 4.06Å; V363-I403 HydrophobicContact CG1-CD1 4.42Å
364	Q	96.5	Very high	95.9	Very high	137 Å²	137	53.4 Å²	53.4	64%	0.64	28%	0.281	S	S	*	.	H	α-helix	trans	-62.8	-35.7	175.3	-67.6	170	12.2	0	0	112.2	P360 I361 V362 L366 S367	P360-Q364 WeakPolarHBondContact O-CG 3.41Å; P360-Q364 PolarHBondContact O-N 3.06Å; P360-Q364 VanDerWaalsContact O-N 3.11Å; I361-Q364 WeakPolarHBondContact O-CB 3.19Å; I361-Q364 PolarHBondContact O-N 3.27Å; I361-Q364 VanDerWaalsContact O-N 3.09Å; V362-Q364 VanDerWaalsContact C-N 3.32Å; V362-Q364 PolarHBondContact O-N 3.02Å; Q364-L366 PolarHBondContact O-N 3.44Å; Q364-S367 PolarHBondContact O-N 3.03Å
365	L	97.1	Very high	95.8	Very high	20 Å²	20	53.3 Å²	53.3	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-68.6	-17.9	179.8	-60.5	176.5	0	0	0	113.5	L325 K333 I361 V362 V363 S367 S368 L373 A377	L325-L365 HydrophobicContact CB-CD1 4.36Å; L325-L365 HydrophobicContact CD2-CD1 3.86Å; K333-L365 HydrophobicContact CD-CD2 3.98Å; I361-L365 WeakPolarHBondContact O-CG 3.42Å; I361-L365 PolarHBondContact O-N 3.2Å; V362-L365 WeakPolarHBondContact O-CB 3.44Å; V362-L365 PolarHBondContact O-N 3.38Å; V362-L365 VanDerWaalsContact O-N 3.13Å; V363-L365 VanDerWaalsContact C-N 3.28Å; V363-L365 PolarHBondContact O-N 3.46Å; L365-S367 PolarHBondContact O-N 2.87Å; L365-S368 VanDerWaalsContact O-CB 3.27Å; L365-S368 WeakPolarHBondContact O-CB 3.23Å; L365-S368 PolarHBondContact O-N 3.18Å; L365-S368 VanDerWaalsContact O-N 3.1Å; L365-L373 HydrophobicContact CD1-CD1 4.29Å; L365-L373 HydrophobicContact CD2-CD2 4.32Å; L365-A377 HydrophobicContact CB-CB 3.9Å
366	L	95.2	Very high	95.8	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.1	173.5	-60.1	-179.7	0	0	0	113	V362 V363 Q364 S368 K374 A377 T378 L381 I403 L404 Q407	V362-L366 PolarHBondContact O-N 3.16Å; V363-L366 VanDerWaalsContact O-CB 3.31Å; V363-L366 WeakPolarHBondContact O-CB 3.37Å; V363-L366 WeakPolarHBondContact O-CG 3.36Å; V363-L366 PolarHBondContact O-N 2.9Å; Q364-L366 PolarHBondContact O-N 3.44Å; L366-S368 VanDerWaalsContact C-N 3.32Å; L366-K374 WeakPolarHBondContact O-CE 3.41Å; L366-A377 HydrophobicContact CD2-CB 4.04Å; L366-T378 WeakPolarHBondContact CD2-OG1 3.24Å; L366-L381 HydrophobicContact CD1-CD1 3.67Å; L366-L381 HydrophobicContact CD2-CD1 3.97Å; L366-L381 HydrophobicContact CG-CD1 4.07Å; L366-I403 HydrophobicContact CB-CG2 3.71Å; L366-I403 HydrophobicContact CD1-CB 4.37Å; L366-I403 HydrophobicContact CD1-CG2 4.2Å; L366-L404 HydrophobicContact CD1-CD2 4.07Å; L366-L404 HydrophobicContact CD1-CG 4.23Å; L366-Q407 PolarHBondContact O-NE2 3.27Å
367	S	92.5	Very high	95.9	Very high	86 Å²	86	45.7 Å²	45.7	60%	0.601	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	9.9	178.6	-59.9	0	0	0	0	113.4	Q364 L365	Q364-S367 PolarHBondContact O-N 3.03Å; L365-S367 PolarHBondContact O-N 2.87Å
368	S	92.8	Very high	95.9	Very high	24 Å²	24	39.7 Å²	39.7	17%	0.168	22%	0.219	C	C	.	.			trans	-67.4	146.9	178	-177.1	0	0	0	0	112.5	L365 L366 S370 K374	L365-S368 VanDerWaalsContact O-CB 3.27Å; L365-S368 WeakPolarHBondContact O-CB 3.23Å; L365-S368 PolarHBondContact O-N 3.18Å; L365-S368 VanDerWaalsContact O-N 3.1Å; L366-S368 VanDerWaalsContact C-N 3.32Å; S368-S370 VanDerWaalsContact C-N 3.26Å; S368-S370 PolarHBondContact OG-N 3.23Å; S368-S370 VanDerWaalsContact OG-N 3.16Å; S368-K374 WeakPolarHBondContact O-CE 3.43Å
369	E	91.3	Very high	95.9	Very high	203 Å²	203	43.4 Å²	43.4	95%	0.949	24%	0.236	S	C	*	.	S	Bend	trans	-70.8	-23.2	171.2	-62.1	-173.6	165.9	0	0	112.1	S371	E369-S371 PolarHBondContact O-N 3.37Å
370	S	94.2	Very high	96	Very high	31 Å²	31	43.4 Å²	43.4	22%	0.217	24%	0.236	C	C	.	.			trans	-75.9	111.9	177.5	173.6	0	0	0	0	110.8	S368 V372 L373 K374	S368-S370 VanDerWaalsContact C-N 3.26Å; S368-S370 PolarHBondContact OG-N 3.23Å; S368-S370 VanDerWaalsContact OG-N 3.16Å; S370-V372 PolarHBondContact O-N 3.5Å; S370-L373 PolarHBondContact O-N 2.73Å; S370-L373 PolarHBondContact OG-N 3.32Å; S370-K374 WeakPolarHBondContact O-CB 3.37Å; S370-K374 PolarHBondContact O-N 3.05Å
371	S	93	Very high	96	Very high	68 Å²	68	41.8 Å²	41.8	48%	0.476	23%	0.225	S	C	.	.	H	α-helix	trans	-57.9	-36.8	177	-173.1	0	0	0	0	112.5	E369 E375	E369-S371 PolarHBondContact O-N 3.37Å; S371-E375 WeakPolarHBondContact O-CB 3.38Å; S371-E375 PolarHBondContact O-N 3.32Å
372	V	94.9	Very high	96	Very high	82 Å²	82	40.8 Å²	40.8	50%	0.497	22%	0.221	S	C	.	.	H	α-helix	trans	-67.7	-43.6	-179.6	179.7	0	0	0	0	110.7	A334 S370 A376	A334-V372 HydrophobicContact CB-CG1 4.24Å; S370-V372 PolarHBondContact O-N 3.5Å; V372-A376 WeakPolarHBondContact O-CB 3.38Å; V372-A376 PolarHBondContact O-N 3.38Å; V372-A376 VanDerWaalsContact O-N 3.09Å
373	L	96.2	Very high	96	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-67.9	-44.6	177.9	175.7	53.7	0	0	0	111.6	D330 K333 A334 L365 S370 E375 A376 A377	D330-L373 HydrophobicContact CB-CD2 3.98Å; K333-L373 HydrophobicContact CB-CD1 3.52Å; K333-L373 HydrophobicContact CB-CD2 4.11Å; K333-L373 HydrophobicContact CB-CG 4.5Å; K333-L373 HydrophobicContact CD-CD2 3.82Å; A334-L373 HydrophobicContact CB-CB 4.42Å; A334-L373 HydrophobicContact CB-CD1 4.17Å; L365-L373 HydrophobicContact CD1-CD1 4.29Å; L365-L373 HydrophobicContact CD2-CD2 4.32Å; S370-L373 PolarHBondContact O-N 2.73Å; S370-L373 PolarHBondContact OG-N 3.32Å; L373-E375 VanDerWaalsContact C-N 3.32Å; L373-E375 PolarHBondContact O-N 3.41Å; L373-A376 PolarHBondContact O-N 2.85Å; L373-A377 WeakPolarHBondContact O-CB 3.48Å; L373-A377 PolarHBondContact O-N 3.46Å
374	K	95.3	Very high	96	Very high	38 Å²	38	41.8 Å²	41.8	17%	0.165	23%	0.228	C	C	.	.	H	α-helix	trans	-57	-46.9	176.7	-177.6	-172.8	-65.9	-176.9	0	111.4	L366 S368 S370 A377 T378 Q407 E410 T415	L366-K374 WeakPolarHBondContact O-CE 3.41Å; S368-K374 WeakPolarHBondContact O-CE 3.43Å; S370-K374 WeakPolarHBondContact O-CB 3.37Å; S370-K374 PolarHBondContact O-N 3.05Å; K374-A377 PolarHBondContact O-N 2.89Å; K374-T378 WeakPolarHBondContact O-CB 3.25Å; K374-T378 PolarHBondContact O-N 3.38Å; K374-T378 PolarHBondContact O-OG1 3.4Å; K374-Q407 VanDerWaalsContact CG-NE2 3.33Å; K374-E410 VanDerWaalsContact CD-OE2 3.25Å; K374-E410 WeakPolarHBondContact CD-OE2 3.45Å; K374-E410 IonicContact NZ-OE1 3.69Å; K374-E410 PolarHBondContact NZ-OE1 3.41Å; K374-E410 IonicContact NZ-OE2 3Å; K374-E410 PolarHBondContact NZ-OE2 2.92Å; K374-T415 HydrophobicContact CD-CG2 4.33Å; K374-T415 HydrophobicContact CG-CG2 4.41Å
375	E	96	Very high	96.1	Very high	62 Å²	62	35.3 Å²	35.3	29%	0.29	20%	0.199	S	C	.	.	H	α-helix	trans	-60.2	-50.2	177.6	-175.3	179.5	155.9	0	0	111.5	S371 L373 A377 T378 Q379 S414	S371-E375 WeakPolarHBondContact O-CB 3.38Å; S371-E375 PolarHBondContact O-N 3.32Å; L373-E375 VanDerWaalsContact C-N 3.32Å; L373-E375 PolarHBondContact O-N 3.41Å; E375-A377 VanDerWaalsContact C-N 3.34Å; E375-A377 PolarHBondContact O-N 2.98Å; E375-T378 PolarHBondContact O-N 3.12Å; E375-Q379 WeakPolarHBondContact O-CB 3.41Å; E375-Q379 PolarHBondContact O-N 3.27Å; E375-S414 VanDerWaalsContact CD-CB 3.48Å; E375-S414 VanDerWaalsContact CD-OG 3.25Å; E375-S414 WeakPolarHBondContact CG-OG 3.33Å; E375-S414 WeakPolarHBondContact OE1-CB 3.33Å; E375-S414 PolarHBondContact OE1-OG 3.05Å
376	A	97.5	Very high	96.1	Very high	2 Å²	2	39.4 Å²	39.4	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-41.5	179.3	0	0	0	0	0	112.4	A334 C337 Q338 V372 L373 Q379 A380	A334-A376 HydrophobicContact CB-CB 4.11Å; A334-A376 WeakPolarHBondContact O-CB 3.39Å; C337-A376 HydrophobicContact CB-CB 3.81Å; C337-A376 WeakPolarHBondContact CB-O 3.5Å; Q338-A376 HydrophobicContact CG-CB 4.14Å; V372-A376 WeakPolarHBondContact O-CB 3.38Å; V372-A376 PolarHBondContact O-N 3.38Å; V372-A376 VanDerWaalsContact O-N 3.09Å; L373-A376 PolarHBondContact O-N 2.85Å; A376-Q379 PolarHBondContact O-N 3.06Å; A376-A380 WeakPolarHBondContact O-CB 3.25Å; A376-A380 PolarHBondContact O-N 2.98Å
377	A	98.1	Very high	96.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-43.8	176.8	0	0	0	0	0	111.8	V362 L365 L366 L373 K374 E375 Q379 A380 L381	V362-A377 HydrophobicContact CG1-CB 4Å; V362-A377 WeakPolarHBondContact CG1-O 3.39Å; L365-A377 HydrophobicContact CB-CB 3.9Å; L366-A377 HydrophobicContact CD2-CB 4.04Å; L373-A377 WeakPolarHBondContact O-CB 3.48Å; L373-A377 PolarHBondContact O-N 3.46Å; K374-A377 PolarHBondContact O-N 2.89Å; E375-A377 VanDerWaalsContact C-N 3.34Å; E375-A377 PolarHBondContact O-N 2.98Å; A377-Q379 PolarHBondContact O-N 2.93Å; A377-A380 WeakPolarHBondContact O-CB 3.23Å; A377-A380 PolarHBondContact O-N 3.41Å; A377-L381 PolarHBondContact O-N 3.44Å
378	T	97.6	Very high	96.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-41.9	178.4	-47.1	0	0	0	0	111.2	L366 K374 E375 A380 L381 S382 L404 Q407 T415 S419	L366-T378 WeakPolarHBondContact CD2-OG1 3.24Å; K374-T378 WeakPolarHBondContact O-CB 3.25Å; K374-T378 PolarHBondContact O-N 3.38Å; K374-T378 PolarHBondContact O-OG1 3.4Å; E375-T378 PolarHBondContact O-N 3.12Å; T378-A380 PolarHBondContact O-N 3.43Å; T378-L381 PolarHBondContact O-N 3.26Å; T378-S382 PolarHBondContact O-N 2.85Å; T378-L404 HydrophobicContact CG2-CD2 4.11Å; T378-Q407 PolarHBondContact OG1-OE1 3.18Å; T378-T415 HydrophobicContact CG2-CG2 4.44Å; T378-S419 WeakPolarHBondContact CG2-OG 3.29Å
379	Q	97.6	Very high	96.4	Very high	81 Å²	81	45.5 Å²	45.5	38%	0.379	24%	0.244	S	C	.	.	H	α-helix	trans	-62.6	-41.7	175.1	-172.6	-178.5	10.4	0	0	111.8	A341 E375 A376 A377 L381 S382 S383	A341-Q379 HydrophobicContact CB-CG 4.48Å; E375-Q379 WeakPolarHBondContact O-CB 3.41Å; E375-Q379 PolarHBondContact O-N 3.27Å; A376-Q379 PolarHBondContact O-N 3.06Å; A377-Q379 PolarHBondContact O-N 2.93Å; Q379-L381 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 2.89Å; Q379-S382 PolarHBondContact O-N 3.37Å; Q379-S383 PolarHBondContact O-N 2.84Å; Q379-S383 VanDerWaalsContact O-N 3.12Å; Q379-S383 PolarHBondContact O-OG 3.37Å
380	A	98.4	Very high	96.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-43	176.1	0	0	0	0	0	112	C337 I340 A341 V362 A376 A377 T378 S383 L384	C337-A380 HydrophobicContact CB-CB 4.16Å; C337-A380 WeakPolarHBondContact O-CB 3.37Å; I340-A380 HydrophobicContact CB-CB 4.5Å; I340-A380 HydrophobicContact CG2-CB 4.26Å; A341-A380 HydrophobicContact CB-CB 4.42Å; V362-A380 HydrophobicContact CG1-CB 4.26Å; A376-A380 WeakPolarHBondContact O-CB 3.25Å; A376-A380 PolarHBondContact O-N 2.98Å; A377-A380 WeakPolarHBondContact O-CB 3.23Å; A377-A380 PolarHBondContact O-N 3.41Å; T378-A380 PolarHBondContact O-N 3.43Å; A380-S383 PolarHBondContact O-N 3.49Å; A380-L384 WeakPolarHBondContact O-CB 3.43Å; A380-L384 VanDerWaalsContact O-CG 3.27Å; A380-L384 WeakPolarHBondContact O-CG 3.27Å; A380-L384 PolarHBondContact O-N 3.49Å
381	L	98.2	Very high	96.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-41	176.5	-67.5	-175.8	0	0	0	112.8	V359 V362 V363 L366 A377 T378 Q379 S383 L384 T385 V395 T422	V359-L381 HydrophobicContact CG1-CD2 4.4Å; V362-L381 HydrophobicContact CB-CD2 3.91Å; V362-L381 HydrophobicContact CB-CG 4.45Å; V362-L381 HydrophobicContact CG1-CD1 4.35Å; V362-L381 HydrophobicContact CG1-CD2 3.6Å; V362-L381 HydrophobicContact CG1-CG 3.64Å; V363-L381 HydrophobicContact CG2-CD1 3.9Å; V363-L381 HydrophobicContact CG2-CD2 4.27Å; L366-L381 HydrophobicContact CD1-CD1 3.67Å; L366-L381 HydrophobicContact CD2-CD1 3.97Å; L366-L381 HydrophobicContact CG-CD1 4.07Å; A377-L381 PolarHBondContact O-N 3.44Å; T378-L381 PolarHBondContact O-N 3.26Å; Q379-L381 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 2.89Å; L381-S383 VanDerWaalsContact C-N 3.31Å; L381-S383 PolarHBondContact O-N 3.36Å; L381-L384 HydrophobicContact CD2-CD1 4.39Å; L381-L384 PolarHBondContact O-N 3.33Å; L381-T385 WeakPolarHBondContact O-CB 3.41Å; L381-T385 VanDerWaalsContact O-CG2 3.3Å; L381-T385 WeakPolarHBondContact O-CG2 3.35Å; L381-T385 PolarHBondContact O-N 3.47Å; L381-T385 PolarHBondContact O-OG1 3.46Å; L381-V395 HydrophobicContact CD1-CG1 4.47Å; L381-V395 HydrophobicContact CD2-CG2 3.91Å; L381-T422 HydrophobicContact CB-CG2 4.12Å
382	S	98	Very high	97.1	Very high	17 Å²	17	33.1 Å²	33.1	12%	0.119	18%	0.182	C	C	.	.	H	α-helix	trans	-56.5	-47.4	175.2	178.9	0	0	0	0	110.9	T378 Q379 T385 H386 A421 T422 N425	T378-S382 PolarHBondContact O-N 2.85Å; Q379-S382 PolarHBondContact O-N 3.37Å; S382-T385 PolarHBondContact O-OG1 3.2Å; S382-H386 WeakPolarHBondContact O-CB 3.35Å; S382-H386 PolarHBondContact O-N 3.37Å; S382-H386 VanDerWaalsContact O-N 3.12Å; S382-A421 WeakPolarHBondContact OG-CB 3.49Å; S382-T422 VanDerWaalsContact CA-OG1 3.23Å; S382-T422 WeakPolarHBondContact CA-OG1 3.18Å; S382-T422 WeakPolarHBondContact CB-OG1 3.22Å; S382-T422 PolarHBondContact N-OG1 2.85Å; S382-N425 PolarHBondContact O-ND2 3.04Å
383	S	98	Very high	97.2	Very high	23 Å²	23	32 Å²	32	16%	0.161	17%	0.174	C	C	.	.	H	α-helix	trans	-66.7	-41.3	176.9	-64.2	0	0	0	0	113.3	K350 Q379 A380 L381 T385	K350-S383 VanDerWaalsContact CE-O 3.29Å; K350-S383 WeakPolarHBondContact CE-O 3.48Å; K350-S383 PolarHBondContact NZ-O 3.32Å; Q379-S383 PolarHBondContact O-N 2.84Å; Q379-S383 VanDerWaalsContact O-N 3.12Å; Q379-S383 PolarHBondContact O-OG 3.37Å; A380-S383 PolarHBondContact O-N 3.49Å; L381-S383 VanDerWaalsContact C-N 3.31Å; L381-S383 PolarHBondContact O-N 3.36Å; S383-T385 VanDerWaalsContact C-N 3.34Å; S383-T385 PolarHBondContact O-N 3.21Å
384	L	98	Very high	97.3	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-34	179.9	-79.6	167.4	0	0	0	112.9	I340 S344 F353 V359 A380 L381 N391	I340-L384 HydrophobicContact CG2-CD1 3.8Å; I340-L384 HydrophobicContact CG2-CD2 4.25Å; I340-L384 HydrophobicContact CG2-CG 4.11Å; S344-L384 VanDerWaalsContact OG-CD2 3.27Å; S344-L384 WeakPolarHBondContact OG-CD2 3.45Å; S344-L384 WeakPolarHBondContact OG-CG 3.49Å; F353-L384 HydrophobicContact CB-CD2 3.87Å; F353-L384 HydrophobicContact CD2-CD2 3.75Å; F353-L384 HydrophobicContact CG-CD2 4.15Å; V359-L384 HydrophobicContact CG2-CD1 4.33Å; A380-L384 WeakPolarHBondContact O-CB 3.43Å; A380-L384 VanDerWaalsContact O-CG 3.27Å; A380-L384 WeakPolarHBondContact O-CG 3.27Å; A380-L384 PolarHBondContact O-N 3.49Å; L381-L384 HydrophobicContact CD2-CD1 4.39Å; L381-L384 PolarHBondContact O-N 3.33Å; L384-N391 VanDerWaalsContact O-CB 3.29Å; L384-N391 WeakPolarHBondContact O-CB 3.49Å; L384-N391 PolarHBondContact O-ND2 3.26Å
385	T	97.8	Very high	97.4	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-87.7	-22.9	-177.9	56	0	0	0	0	113.5	L381 S382 S383 S387 N388 A392 V395 T422 N425	L381-T385 WeakPolarHBondContact O-CB 3.41Å; L381-T385 VanDerWaalsContact O-CG2 3.3Å; L381-T385 WeakPolarHBondContact O-CG2 3.35Å; L381-T385 PolarHBondContact O-N 3.47Å; L381-T385 PolarHBondContact O-OG1 3.46Å; S382-T385 PolarHBondContact O-OG1 3.2Å; S383-T385 VanDerWaalsContact C-N 3.34Å; S383-T385 PolarHBondContact O-N 3.21Å; T385-S387 PolarHBondContact O-N 3.41Å; T385-S387 VanDerWaalsContact O-N 3.11Å; T385-N388 PolarHBondContact O-N 3.25Å; T385-A392 HydrophobicContact CG2-CB 4.37Å; T385-V395 HydrophobicContact CG2-CG2 3.81Å; T385-T422 HydrophobicContact CG2-CG2 4.12Å; T385-N425 PolarHBondContact OG1-ND2 3.47Å
386	H	96.8	Very high	97.5	Very high	106 Å²	106	30.8 Å²	30.8	49%	0.491	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	117.2	-178.5	-179.9	-115.6	0	0	0	112	K350 S382 N388 N425	K350-H386 PolarHBondContact NZ-O 3Å; S382-H386 WeakPolarHBondContact O-CB 3.35Å; S382-H386 PolarHBondContact O-N 3.37Å; S382-H386 VanDerWaalsContact O-N 3.12Å; H386-N388 PolarHBondContact O-N 3.19Å; H386-N388 VanDerWaalsContact O-N 3.17Å; H386-N425 WeakPolarHBondContact CA-ND2 3.26Å; H386-N425 PolarHBondContact N-ND2 2.69Å
387	S	95.1	Very high	97.5	Very high	94 Å²	94	37.7 Å²	37.7	66%	0.657	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	32.1	-176.4	-46.1	0	0	0	0	114.4	T385	T385-S387 PolarHBondContact O-N 3.41Å; T385-S387 VanDerWaalsContact O-N 3.11Å
388	N	96.6	Very high	97.4	Very high	21 Å²	21	39.5 Å²	39.5	11%	0.112	22%	0.215	C	C	.	.			trans	-139.6	93.4	175.3	-168.6	-48.6	0	0	0	111	K350 D351 T385 H386 A390 N391 A392	K350-N388 HydrophobicContact CD-CB 4.09Å; D351-N388 PolarHBondContact OD1-ND2 3.45Å; T385-N388 PolarHBondContact O-N 3.25Å; H386-N388 PolarHBondContact O-N 3.19Å; H386-N388 VanDerWaalsContact O-N 3.17Å; N388-A390 VanDerWaalsContact C-N 3.32Å; N388-A390 PolarHBondContact O-N 3.45Å; N388-A390 PolarHBondContact OD1-N 3.07Å; N388-N391 HydrophobicContact CB-CB 4.24Å; N388-N391 PolarHBondContact O-N 3.03Å; N388-N391 PolarHBondContact OD1-N 3.38Å; N388-A392 PolarHBondContact O-N 3.32Å; N388-A392 VanDerWaalsContact O-N 3.09Å
389	E	96.2	Very high	97.4	Very high	123 Å²	123	40.7 Å²	40.7	58%	0.575	23%	0.227	S	C	*	.	H	α-helix	trans	-60.6	-37.2	-178.2	-69	175.6	-166.1	0	0	113.1	N391 A392 L393 Q429	E389-N391 VanDerWaalsContact C-N 3.33Å; E389-N391 PolarHBondContact O-N 2.9Å; E389-A392 WeakPolarHBondContact O-CB 3.43Å; E389-A392 PolarHBondContact O-N 3.39Å; E389-L393 PolarHBondContact O-N 3.12Å; E389-Q429 HydrophobicContact CB-CG 4.5Å; E389-Q429 HydrophobicContact CG-CG 4.35Å; E389-Q429 PolarHBondContact O-NE2 2.97Å
390	A	97.1	Very high	97.3	Very high	42 Å²	42	36.8 Å²	36.8	35%	0.347	21%	0.209	S	C	.	.	H	α-helix	trans	-67.8	-34.7	-179.3	0	0	0	0	0	112	N388 A394	N388-A390 VanDerWaalsContact C-N 3.32Å; N388-A390 PolarHBondContact O-N 3.45Å; N388-A390 PolarHBondContact OD1-N 3.07Å; A390-A394 PolarHBondContact O-N 3.49Å; A390-A394 VanDerWaalsContact O-N 3.08Å
391	N	97.4	Very high	97.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-71.4	-40	172	-75.7	11	0	0	0	112	K350 R354 L384 N388 E389 L393 A394 V395	K350-N391 PolarHBondContact O-ND2 2.67Å; R354-N391 VanDerWaalsContact CB-OD1 3.28Å; R354-N391 WeakPolarHBondContact CB-OD1 3.4Å; R354-N391 WeakPolarHBondContact CD-OD1 3.49Å; R354-N391 PolarHBondContact NH1-OD1 3.37Å; L384-N391 VanDerWaalsContact O-CB 3.29Å; L384-N391 WeakPolarHBondContact O-CB 3.49Å; L384-N391 PolarHBondContact O-ND2 3.26Å; N388-N391 HydrophobicContact CB-CB 4.24Å; N388-N391 PolarHBondContact O-N 3.03Å; N388-N391 PolarHBondContact OD1-N 3.38Å; E389-N391 VanDerWaalsContact C-N 3.33Å; E389-N391 PolarHBondContact O-N 2.9Å; N391-L393 VanDerWaalsContact C-N 3.28Å; N391-L393 PolarHBondContact O-N 2.95Å; N391-A394 PolarHBondContact O-N 3.22Å; N391-V395 WeakPolarHBondContact O-CG2 3.38Å; N391-V395 PolarHBondContact O-N 3.31Å
392	A	97.6	Very high	97.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-41.4	173	0	0	0	0	0	112.1	T385 N388 E389 V395 Y396 M426	T385-A392 HydrophobicContact CG2-CB 4.37Å; N388-A392 PolarHBondContact O-N 3.32Å; N388-A392 VanDerWaalsContact O-N 3.09Å; E389-A392 WeakPolarHBondContact O-CB 3.43Å; E389-A392 PolarHBondContact O-N 3.39Å; A392-V395 PolarHBondContact O-N 2.86Å; A392-Y396 PolarHBondContact O-N 3.25Å; A392-M426 HydrophobicContact CB-CB 4.45Å; A392-M426 HydrophobicContact CB-CG 3.93Å
393	L	97.6	Very high	97.1	Very high	60 Å²	60	43.2 Å²	43.2	31%	0.314	24%	0.238	S	C	.	.	H	α-helix	trans	-63.3	-44.3	174.4	-177	64	0	0	0	111.6	E389 N391 V395 Y396 E397 I432	E389-L393 PolarHBondContact O-N 3.12Å; N391-L393 VanDerWaalsContact C-N 3.28Å; N391-L393 PolarHBondContact O-N 2.95Å; L393-V395 VanDerWaalsContact C-N 3.32Å; L393-V395 PolarHBondContact O-N 2.86Å; L393-Y396 HydrophobicContact CD1-CD1 4.21Å; L393-Y396 WeakPolarHBondContact O-CA 3.37Å; L393-Y396 WeakPolarHBondContact O-CB 3.43Å; L393-Y396 PolarHBondContact O-N 3.35Å; L393-Y396 VanDerWaalsContact O-N 3.08Å; L393-E397 HydrophobicContact CD1-CG 4.39Å; L393-E397 HydrophobicContact CG-CG 4.39Å; L393-E397 WeakPolarHBondContact O-CG 3.39Å; L393-E397 PolarHBondContact O-N 2.8Å; L393-I432 HydrophobicContact CD1-CD1 4.39Å
394	A	97.9	Very high	97	Very high	12 Å²	12	42.1 Å²	42.1	10%	0.099	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-37.7	176.9	0	0	0	0	0	112.7	R354 V359 A390 N391 Y396 A398	R354-A394 HydrophobicContact CG-CB 4.19Å; V359-A394 HydrophobicContact CB-CB 4.25Å; V359-A394 HydrophobicContact CG1-CB 3.91Å; A390-A394 PolarHBondContact O-N 3.49Å; A390-A394 VanDerWaalsContact O-N 3.08Å; N391-A394 PolarHBondContact O-N 3.22Å; A394-Y396 VanDerWaalsContact C-N 3.34Å; A394-A398 WeakPolarHBondContact O-CB 3.43Å; A394-A398 PolarHBondContact O-N 3.25Å; A394-A398 VanDerWaalsContact O-N 3.09Å
395	V	98.2	Very high	97	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-41.5	172.7	176	0	0	0	0	111	V359 V363 L381 T385 N391 A392 L393 A398 G399 G400 L404 M426	V359-V395 HydrophobicContact CG1-CB 4.39Å; V359-V395 HydrophobicContact CG1-CG2 3.45Å; V359-V395 VanDerWaalsContact CG1-CG2 3.45Å; V363-V395 HydrophobicContact CG2-CB 4.42Å; V363-V395 HydrophobicContact CG2-CG1 4Å; V363-V395 HydrophobicContact CG2-CG2 4.35Å; L381-V395 HydrophobicContact CD1-CG1 4.47Å; L381-V395 HydrophobicContact CD2-CG2 3.91Å; T385-V395 HydrophobicContact CG2-CG2 3.81Å; N391-V395 WeakPolarHBondContact O-CG2 3.38Å; N391-V395 PolarHBondContact O-N 3.31Å; A392-V395 PolarHBondContact O-N 2.86Å; L393-V395 VanDerWaalsContact C-N 3.32Å; L393-V395 PolarHBondContact O-N 2.86Å; V395-A398 PolarHBondContact O-N 3.41Å; V395-G399 PolarHBondContact O-N 3.23Å; V395-G400 PolarHBondContact O-N 3.17Å; V395-L404 HydrophobicContact CG1-CD1 4.26Å; V395-M426 HydrophobicContact CB-CE 4.12Å; V395-M426 HydrophobicContact CB-SD 4.07Å; V395-M426 HydrophobicContact CG1-CE 3.81Å; V395-M426 HydrophobicContact CG1-SD 3.55Å; V395-M426 VanDerWaalsContact CG1-SD 3.55Å
396	Y	97.9	Very high	96.9	Very high	63 Å²	63	49 Å²	49	25%	0.247	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-47.9	177	171.1	-104.6	0	0	0	112.3	A392 L393 A394 A398 G399 H401 I432	A392-Y396 PolarHBondContact O-N 3.25Å; L393-Y396 HydrophobicContact CD1-CD1 4.21Å; L393-Y396 WeakPolarHBondContact O-CA 3.37Å; L393-Y396 WeakPolarHBondContact O-CB 3.43Å; L393-Y396 PolarHBondContact O-N 3.35Å; L393-Y396 VanDerWaalsContact O-N 3.08Å; A394-Y396 VanDerWaalsContact C-N 3.34Å; Y396-A398 PolarHBondContact O-N 3.22Å; Y396-G399 WeakPolarHBondContact O-CA 3.18Å; Y396-G399 PolarHBondContact O-N 2.93Å; Y396-H401 AromaticContact CD2-CE1 3.47Å; Y396-H401 VanDerWaalsContact CD2-CE1 3.47Å; Y396-H401 WeakPolarHBondContact CD2-CE1 3.32Å; Y396-H401 AromaticContact CD2-CG 3.86Å; Y396-H401 AromaticContact CD2-ND1 3.4Å; Y396-H401 WeakPolarHBondContact CD2-ND1 3.11Å; Y396-H401 AromaticContact CD2-NE2 3.91Å; Y396-H401 AromaticContact CE2-CE1 3.41Å; Y396-H401 VanDerWaalsContact CE2-CE1 3.41Å; Y396-H401 WeakPolarHBondContact CE2-CE1 3.43Å; Y396-H401 AromaticContact CE2-ND1 3.84Å; Y396-H401 AromaticContact CE2-NE2 3.54Å; Y396-I432 HydrophobicContact CD1-CG1 4.12Å; Y396-I432 HydrophobicContact CD2-CB 4.36Å; Y396-I432 HydrophobicContact CD2-CG1 4.22Å; Y396-I432 HydrophobicContact CD2-CG2 3.75Å; Y396-I432 HydrophobicContact CE2-CG2 4.5Å; Y396-I432 HydrophobicContact CG-CB 4.46Å; Y396-I432 HydrophobicContact CG-CD1 4.27Å; Y396-I432 HydrophobicContact CG-CG1 3.83Å; Y396-I432 HydrophobicContact CG-CG2 4.07Å
397	E	97.1	Very high	96.8	Very high	146 Å²	146	44 Å²	44	68%	0.682	24%	0.24	S	C	*	.	H	α-helix	trans	-61.3	-31.6	178.1	-71.7	179	158	0	0	112.5	L393 G399	L393-E397 HydrophobicContact CD1-CG 4.39Å; L393-E397 HydrophobicContact CG-CG 4.39Å; L393-E397 WeakPolarHBondContact O-CG 3.39Å; L393-E397 PolarHBondContact O-N 2.8Å; E397-G399 PolarHBondContact O-N 3.07Å
398	A	97	Very high	96.8	Very high	39 Å²	39	39.9 Å²	39.9	32%	0.322	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	0.6	173.1	0	0	0	0	0	114.1	P360 V363 A394 V395 Y396	P360-A398 HydrophobicContact CB-CB 4.21Å; V363-A398 HydrophobicContact CB-CB 4.03Å; V363-A398 HydrophobicContact CG1-CB 3.95Å; V363-A398 HydrophobicContact CG2-CB 4.06Å; A394-A398 WeakPolarHBondContact O-CB 3.43Å; A394-A398 PolarHBondContact O-N 3.25Å; A394-A398 VanDerWaalsContact O-N 3.09Å; V395-A398 PolarHBondContact O-N 3.41Å; Y396-A398 PolarHBondContact O-N 3.22Å
399	G	96.4	Very high	96.6	Very high	24 Å²	24	43.8 Å²	43.8	25%	0.247	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	14.1	-179.8	0	0	0	0	0	114.7	V395 Y396 E397 H401 E402	V395-G399 PolarHBondContact O-N 3.23Å; Y396-G399 WeakPolarHBondContact O-CA 3.18Å; Y396-G399 PolarHBondContact O-N 2.93Å; E397-G399 PolarHBondContact O-N 3.07Å; G399-H401 VanDerWaalsContact C-N 3.29Å; G399-H401 PolarHBondContact O-N 3.29Å; G399-E402 PolarHBondContact O-N 3.43Å
400	G	96.7	Very high	96	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-30.3	-173.5	0	0	0	0	0	114.4	V395 E402 I403 L404	V395-G400 PolarHBondContact O-N 3.17Å; G400-E402 VanDerWaalsContact C-N 3.3Å; G400-E402 PolarHBondContact O-N 2.88Å; G400-I403 PolarHBondContact O-N 3.43Å; G400-I403 VanDerWaalsContact O-N 3.16Å; G400-L404 VanDerWaalsContact O-CG 3.23Å; G400-L404 WeakPolarHBondContact O-CG 3.34Å; G400-L404 PolarHBondContact O-N 3.34Å
401	H	95.8	Very high	95.4	Very high	12 Å²	12	45.1 Å²	45.1	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-35.2	-179.6	62.6	-69.2	0	0	0	113.8	Y396 G399 I405 M426 S435 I436	Y396-H401 AromaticContact CD2-CE1 3.47Å; Y396-H401 VanDerWaalsContact CD2-CE1 3.47Å; Y396-H401 WeakPolarHBondContact CD2-CE1 3.32Å; Y396-H401 AromaticContact CD2-CG 3.86Å; Y396-H401 AromaticContact CD2-ND1 3.4Å; Y396-H401 WeakPolarHBondContact CD2-ND1 3.11Å; Y396-H401 AromaticContact CD2-NE2 3.91Å; Y396-H401 AromaticContact CE2-CE1 3.41Å; Y396-H401 VanDerWaalsContact CE2-CE1 3.41Å; Y396-H401 WeakPolarHBondContact CE2-CE1 3.43Å; Y396-H401 AromaticContact CE2-ND1 3.84Å; Y396-H401 AromaticContact CE2-NE2 3.54Å; G399-H401 VanDerWaalsContact C-N 3.29Å; G399-H401 PolarHBondContact O-N 3.29Å; H401-I405 WeakPolarHBondContact O-CD1 3.39Å; H401-I405 VanDerWaalsContact O-CG1 3.24Å; H401-I405 WeakPolarHBondContact O-CG1 3.36Å; H401-I405 PolarHBondContact O-N 3.44Å; H401-I405 VanDerWaalsContact O-N 3.16Å; H401-M426 HydrophobicContact CB-CE 3.87Å; H401-S435 PolarHBondContact NE2-OG 2.63Å; H401-S435 VanDerWaalsContact NE2-OG 3.16Å; H401-I436 HydrophobicContact CB-CG1 4.19Å
402	E	96.3	Very high	95.1	Very high	105 Å²	105	46.1 Å²	46.1	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-66.1	-44.7	176	-68.1	-179.1	-161.8	0	0	111.7	G399 G400 I405 Q406 L439	G399-E402 PolarHBondContact O-N 3.43Å; G400-E402 VanDerWaalsContact C-N 3.3Å; G400-E402 PolarHBondContact O-N 2.88Å; E402-I405 PolarHBondContact O-N 3.38Å; E402-Q406 WeakPolarHBondContact O-CG 3.28Å; E402-Q406 PolarHBondContact O-N 3.49Å; E402-L439 HydrophobicContact CG-CD1 3.69Å
403	I	96.9	Very high	95	Very high	35 Å²	35	47.7 Å²	47.7	18%	0.179	27%	0.273	C	S	.	.	H	α-helix	trans	-67.9	-43.2	-179.2	-55.6	167.5	0	0	0	110.1	V363 L366 G400 I405 Q406 Q407	V363-I403 HydrophobicContact CG1-CD1 4.42Å; L366-I403 HydrophobicContact CB-CG2 3.71Å; L366-I403 HydrophobicContact CD1-CB 4.37Å; L366-I403 HydrophobicContact CD1-CG2 4.2Å; G400-I403 PolarHBondContact O-N 3.43Å; G400-I403 VanDerWaalsContact O-N 3.16Å; I403-I405 VanDerWaalsContact C-N 3.33Å; I403-I405 PolarHBondContact O-N 3.07Å; I403-Q406 WeakPolarHBondContact O-CB 3.28Å; I403-Q406 PolarHBondContact O-N 3.35Å; I403-Q406 VanDerWaalsContact O-N 3.14Å; I403-Q407 HydrophobicContact CG2-CG 4.46Å; I403-Q407 WeakPolarHBondContact O-CG 3.48Å; I403-Q407 PolarHBondContact O-N 3.34Å
404	L	97.4	Very high	94.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-38.3	179.6	-67.3	165.5	0	0	0	111.9	L366 T378 V395 G400 Q406 Q407 L408 T422 I423 M426	L366-L404 HydrophobicContact CD1-CD2 4.07Å; L366-L404 HydrophobicContact CD1-CG 4.23Å; T378-L404 HydrophobicContact CG2-CD2 4.11Å; V395-L404 HydrophobicContact CG1-CD1 4.26Å; G400-L404 VanDerWaalsContact O-CG 3.23Å; G400-L404 WeakPolarHBondContact O-CG 3.34Å; G400-L404 PolarHBondContact O-N 3.34Å; L404-Q406 VanDerWaalsContact C-N 3.33Å; L404-Q407 PolarHBondContact O-N 2.95Å; L404-L408 PolarHBondContact O-N 3.25Å; L404-T422 HydrophobicContact CD1-CG2 3.62Å; L404-T422 HydrophobicContact CD2-CG2 4.49Å; L404-I423 HydrophobicContact CB-CD1 3.99Å; L404-I423 HydrophobicContact CB-CG1 3.84Å; L404-M426 HydrophobicContact CD1-SD 3.94Å
405	I	96.9	Very high	94.7	Very high	22 Å²	22	46.3 Å²	46.3	11%	0.113	27%	0.268	C	S	.	.	H	α-helix	trans	-64.2	-40	174.7	-69.4	166.4	0	0	0	110.7	H401 E402 I403 Q407 L408 I423 I436 L439 A444	H401-I405 WeakPolarHBondContact O-CD1 3.39Å; H401-I405 VanDerWaalsContact O-CG1 3.24Å; H401-I405 WeakPolarHBondContact O-CG1 3.36Å; H401-I405 PolarHBondContact O-N 3.44Å; H401-I405 VanDerWaalsContact O-N 3.16Å; E402-I405 PolarHBondContact O-N 3.38Å; I403-I405 VanDerWaalsContact C-N 3.33Å; I403-I405 PolarHBondContact O-N 3.07Å; I405-Q407 VanDerWaalsContact C-N 3.34Å; I405-L408 WeakPolarHBondContact O-CB 3.28Å; I405-L408 PolarHBondContact O-N 3.47Å; I405-I423 HydrophobicContact CG1-CD1 4.11Å; I405-I436 HydrophobicContact CD1-CG2 4.17Å; I405-L439 HydrophobicContact CD1-CB 3.84Å; I405-L439 HydrophobicContact CD1-CD1 3.97Å; I405-A444 HydrophobicContact CG2-CB 3.94Å
406	Q	95.2	Very high	94.7	Very high	126 Å²	126	46.7 Å²	46.7	59%	0.589	27%	0.27	S	S	*	.	H	α-helix	trans	-64.3	-39.9	175.6	-66.8	170.8	13.6	0	0	111.6	E402 I403 L404 L408 S409	E402-Q406 WeakPolarHBondContact O-CG 3.28Å; E402-Q406 PolarHBondContact O-N 3.49Å; I403-Q406 WeakPolarHBondContact O-CB 3.28Å; I403-Q406 PolarHBondContact O-N 3.35Å; I403-Q406 VanDerWaalsContact O-N 3.14Å; L404-Q406 VanDerWaalsContact C-N 3.33Å; Q406-L408 PolarHBondContact O-N 2.92Å; Q406-S409 PolarHBondContact O-N 3.41Å; Q406-S409 VanDerWaalsContact O-N 3.08Å; Q406-S409 PolarHBondContact O-OG 3.32Å
407	Q	95.4	Very high	94.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-19.8	178.8	-75.4	-178.1	-18.9	0	0	114.1	L366 K374 T378 I403 L404 I405 S409 E410 T415 V416 S419	L366-Q407 PolarHBondContact O-NE2 3.27Å; K374-Q407 VanDerWaalsContact CG-NE2 3.33Å; T378-Q407 PolarHBondContact OG1-OE1 3.18Å; I403-Q407 HydrophobicContact CG2-CG 4.46Å; I403-Q407 WeakPolarHBondContact O-CG 3.48Å; I403-Q407 PolarHBondContact O-N 3.34Å; L404-Q407 PolarHBondContact O-N 2.95Å; I405-Q407 VanDerWaalsContact C-N 3.34Å; Q407-S409 PolarHBondContact O-N 3.45Å; Q407-E410 WeakPolarHBondContact O-CB 3.25Å; Q407-E410 PolarHBondContact O-N 2.78Å; Q407-E410 VanDerWaalsContact O-N 3.1Å; Q407-T415 HydrophobicContact CB-CG2 4.28Å; Q407-T415 HydrophobicContact CG-CG2 4.29Å; Q407-V416 WeakPolarHBondContact O-CG2 3.1Å; Q407-S419 WeakPolarHBondContact CB-OG 3.41Å; Q407-S419 PolarHBondContact OE1-OG 3.28Å; Q407-S419 VanDerWaalsContact OE1-OG 3.1Å
408	L	95.2	Very high	94.6	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.037	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.7	172.6	-65.6	174.9	0	0	0	113.2	L404 I405 Q406 V416 A420 I423 A444 L445 P448	L404-L408 PolarHBondContact O-N 3.25Å; I405-L408 WeakPolarHBondContact O-CB 3.28Å; I405-L408 PolarHBondContact O-N 3.47Å; Q406-L408 PolarHBondContact O-N 2.92Å; L408-V416 HydrophobicContact CD2-CG1 4.35Å; L408-A420 HydrophobicContact CD2-CB 3.98Å; L408-I423 HydrophobicContact CD1-CD1 3.82Å; L408-I423 HydrophobicContact CD2-CD1 4.31Å; L408-I423 HydrophobicContact CG-CD1 4.1Å; L408-A444 HydrophobicContact CD1-CB 3.87Å; L408-L445 HydrophobicContact CD1-CD2 3.82Å; L408-L445 HydrophobicContact CD1-CG 4.48Å; L408-L445 HydrophobicContact CD2-CD2 4.34Å; L408-P448 HydrophobicContact CB-CG 4.11Å; L408-P448 HydrophobicContact CD2-CG 4.45Å; L408-P448 WeakPolarHBondContact O-CG 3.41Å
409	S	91.8	Very high	94.7	Very high	103 Å²	103	35.9 Å²	35.9	72%	0.72	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	3.6	177.2	67.8	0	0	0	0	114.2	Q406 Q407	Q406-S409 PolarHBondContact O-N 3.41Å; Q406-S409 VanDerWaalsContact O-N 3.08Å; Q406-S409 PolarHBondContact O-OG 3.32Å; Q407-S409 PolarHBondContact O-N 3.45Å
410	E	85.3	Confident	94.8	Very high	60 Å²	60	34.7 Å²	34.7	28%	0.28	21%	0.205	S	C	.	.	S	Bend	trans	-77.5	162.8	179.3	-72.5	-171.3	-172	0	0	113.2	K374 Q407 V416	K374-E410 VanDerWaalsContact CD-OE2 3.25Å; K374-E410 WeakPolarHBondContact CD-OE2 3.45Å; K374-E410 IonicContact NZ-OE1 3.69Å; K374-E410 PolarHBondContact NZ-OE1 3.41Å; K374-E410 IonicContact NZ-OE2 3Å; K374-E410 PolarHBondContact NZ-OE2 2.92Å; Q407-E410 WeakPolarHBondContact O-CB 3.25Å; Q407-E410 PolarHBondContact O-N 2.78Å; Q407-E410 VanDerWaalsContact O-N 3.1Å; E410-V416 WeakPolarHBondContact O-CG2 3.42Å
411	S	82.5	Confident	94.8	Very high	132 Å²	132	34.8 Å²	34.8	92%	0.923	21%	0.206	S	C	*	.	S	Bend	trans	-79.6	-19.6	-178.5	56.1	0	0	0	0	114.5	A413	S411-A413 PolarHBondContact O-N 3.37Å
412	S	92.5	Very high	95	Very high	22 Å²	22	34.2 Å²	34.2	15%	0.154	20%	0.203	C	C	.	.			trans	-81.7	112.4	-177.6	179.6	0	0	0	0	110.9	S414 T415 V416	S412-S414 VanDerWaalsContact C-N 3.27Å; S412-S414 PolarHBondContact O-N 3.2Å; S412-T415 WeakPolarHBondContact CB-OG1 3.45Å; S412-T415 PolarHBondContact O-N 3.35Å; S412-T415 PolarHBondContact OG-OG1 3.27Å; S412-V416 WeakPolarHBondContact O-CG2 3.32Å; S412-V416 PolarHBondContact O-N 3.38Å
413	A	94.4	Very high	95	Very high	33 Å²	33	29.2 Å²	29.2	27%	0.273	18%	0.18	S	C	.	.	H	α-helix	trans	-57.3	-40	178.3	0	0	0	0	0	112.5	S411 T415 V416 A417 D453 V456	S411-A413 PolarHBondContact O-N 3.37Å; A413-T415 PolarHBondContact O-N 3.06Å; A413-V416 PolarHBondContact O-N 2.97Å; A413-A417 VanDerWaalsContact O-CB 3.29Å; A413-A417 WeakPolarHBondContact O-CB 3.23Å; A413-A417 PolarHBondContact O-N 3.18Å; A413-D453 HydrophobicContact CB-CB 3.88Å; A413-V456 HydrophobicContact CB-CG2 3.87Å; A413-V456 WeakPolarHBondContact O-CG2 3.44Å
414	S	93.9	Very high	95.1	Very high	43 Å²	43	27.8 Å²	27.8	30%	0.301	17%	0.173	S	C	.	.	H	α-helix	trans	-63	-42.5	178.2	-179.4	0	0	0	0	112.2	E375 S412 S418	E375-S414 VanDerWaalsContact CD-CB 3.48Å; E375-S414 VanDerWaalsContact CD-OG 3.25Å; E375-S414 WeakPolarHBondContact CG-OG 3.33Å; E375-S414 WeakPolarHBondContact OE1-CB 3.33Å; E375-S414 PolarHBondContact OE1-OG 3.05Å; S412-S414 VanDerWaalsContact C-N 3.27Å; S412-S414 PolarHBondContact O-N 3.2Å; S414-S418 WeakPolarHBondContact O-CB 3.45Å; S414-S418 PolarHBondContact O-N 2.97Å; S414-S418 PolarHBondContact O-OG 2.94Å
415	T	95.9	Very high	95.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.4	-45	176.3	-51.8	0	0	0	0	111.4	K374 T378 Q407 S412 A413 S418 S419	K374-T415 HydrophobicContact CD-CG2 4.33Å; K374-T415 HydrophobicContact CG-CG2 4.41Å; T378-T415 HydrophobicContact CG2-CG2 4.44Å; Q407-T415 HydrophobicContact CB-CG2 4.28Å; Q407-T415 HydrophobicContact CG-CG2 4.29Å; S412-T415 WeakPolarHBondContact CB-OG1 3.45Å; S412-T415 PolarHBondContact O-N 3.35Å; S412-T415 PolarHBondContact OG-OG1 3.27Å; A413-T415 PolarHBondContact O-N 3.06Å; T415-S418 PolarHBondContact O-N 3.49Å; T415-S419 VanDerWaalsContact O-CB 3.29Å; T415-S419 WeakPolarHBondContact O-CB 3.29Å; T415-S419 PolarHBondContact O-N 2.92Å; T415-S419 PolarHBondContact O-OG 2.75Å
416	V	97.1	Very high	95.1	Very high	8 Å²	8	27.4 Å²	27.4	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-46.7	177.7	175.5	0	0	0	0	111	Q407 L408 E410 S412 A413 S419 A420 P448 V456	Q407-V416 WeakPolarHBondContact O-CG2 3.1Å; L408-V416 HydrophobicContact CD2-CG1 4.35Å; E410-V416 WeakPolarHBondContact O-CG2 3.42Å; S412-V416 WeakPolarHBondContact O-CG2 3.32Å; S412-V416 PolarHBondContact O-N 3.38Å; A413-V416 PolarHBondContact O-N 2.97Å; V416-S419 PolarHBondContact O-N 3.28Å; V416-A420 PolarHBondContact O-N 3.49Å; V416-P448 HydrophobicContact CG1-CB 3.92Å; V416-P448 HydrophobicContact CG1-CG 3.97Å; V416-V456 HydrophobicContact CB-CG2 4.22Å; V416-V456 HydrophobicContact CG1-CG1 3.76Å; V416-V456 HydrophobicContact CG1-CG2 4.27Å
417	A	97.3	Very high	95.2	Very high	5 Å²	5	21.4 Å²	21.4	4%	0.041	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-48.1	178.8	0	0	0	0	0	111.8	A413 S419 A420 A421 Q455 V456 Y459	A413-A417 VanDerWaalsContact O-CB 3.29Å; A413-A417 WeakPolarHBondContact O-CB 3.23Å; A413-A417 PolarHBondContact O-N 3.18Å; A417-S419 VanDerWaalsContact C-N 3.31Å; A417-S419 PolarHBondContact O-N 3.42Å; A417-A420 PolarHBondContact O-N 3.03Å; A417-A421 WeakPolarHBondContact O-CB 3.46Å; A417-A421 PolarHBondContact O-N 2.83Å; A417-Q455 HydrophobicContact CB-CB 3.99Å; A417-V456 HydrophobicContact CB-CG2 3.95Å; A417-Y459 HydrophobicContact CB-CD2 4.15Å
418	S	97.6	Very high	95.2	Very high	15 Å²	15	26.1 Å²	26.1	11%	0.105	17%	0.165	C	C	.	.	H	α-helix	trans	-66.5	-33.6	178.6	-59.7	0	0	0	0	112.3	S414 T415 T422	S414-S418 WeakPolarHBondContact O-CB 3.45Å; S414-S418 PolarHBondContact O-N 2.97Å; S414-S418 PolarHBondContact O-OG 2.94Å; T415-S418 PolarHBondContact O-N 3.49Å; S418-T422 WeakPolarHBondContact O-CB 3.45Å; S418-T422 PolarHBondContact O-N 3.31Å; S418-T422 PolarHBondContact O-OG1 2.87Å
419	S	98.1	Very high	95.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-50.3	174.8	-60.3	0	0	0	0	111.2	T378 Q407 T415 V416 A417 A421 T422 I423	T378-S419 WeakPolarHBondContact CG2-OG 3.29Å; Q407-S419 WeakPolarHBondContact CB-OG 3.41Å; Q407-S419 PolarHBondContact OE1-OG 3.28Å; Q407-S419 VanDerWaalsContact OE1-OG 3.1Å; T415-S419 VanDerWaalsContact O-CB 3.29Å; T415-S419 WeakPolarHBondContact O-CB 3.29Å; T415-S419 PolarHBondContact O-N 2.92Å; T415-S419 PolarHBondContact O-OG 2.75Å; V416-S419 PolarHBondContact O-N 3.28Å; A417-S419 VanDerWaalsContact C-N 3.31Å; A417-S419 PolarHBondContact O-N 3.42Å; S419-A421 VanDerWaalsContact C-N 3.3Å; S419-A421 PolarHBondContact O-N 2.84Å; S419-T422 PolarHBondContact O-N 3.12Å; S419-I423 VanDerWaalsContact O-CG1 3.25Å; S419-I423 WeakPolarHBondContact O-CG1 3.28Å; S419-I423 PolarHBondContact O-N 3.17Å
420	A	98	Very high	95.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.4	-40.7	177	0	0	0	0	0	112	L408 V416 A417 S424	L408-A420 HydrophobicContact CD2-CB 3.98Å; V416-A420 PolarHBondContact O-N 3.49Å; A417-A420 PolarHBondContact O-N 3.03Å; A420-S424 WeakPolarHBondContact O-CB 3.5Å; A420-S424 PolarHBondContact O-N 3.39Å
421	A	98.1	Very high	95.7	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-48.4	174.4	0	0	0	0	0	111.9	S382 A417 S419 S424 N425 Y459	S382-A421 WeakPolarHBondContact OG-CB 3.49Å; A417-A421 WeakPolarHBondContact O-CB 3.46Å; A417-A421 PolarHBondContact O-N 2.83Å; S419-A421 VanDerWaalsContact C-N 3.3Å; S419-A421 PolarHBondContact O-N 2.84Å; A421-S424 WeakPolarHBondContact O-CB 3.49Å; A421-S424 PolarHBondContact O-N 3.03Å; A421-N425 PolarHBondContact O-N 3.21Å; A421-N425 PolarHBondContact O-ND2 3.44Å; A421-N425 PolarHBondContact O-OD1 3.16Å; A421-Y459 HydrophobicContact CB-CD1 3.46Å; A421-Y459 VanDerWaalsContact CB-CD1 3.46Å; A421-Y459 HydrophobicContact CB-CD2 4.22Å; A421-Y459 HydrophobicContact CB-CE1 3.67Å; A421-Y459 HydrophobicContact CB-CE2 4.4Å; A421-Y459 HydrophobicContact CB-CG 3.76Å
422	T	98.3	Very high	96.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-44.7	179.9	-52.4	0	0	0	0	111.4	L381 S382 T385 L404 S418 S419 S424 N425 M426	L381-T422 HydrophobicContact CB-CG2 4.12Å; S382-T422 VanDerWaalsContact CA-OG1 3.23Å; S382-T422 WeakPolarHBondContact CA-OG1 3.18Å; S382-T422 WeakPolarHBondContact CB-OG1 3.22Å; S382-T422 PolarHBondContact N-OG1 2.85Å; T385-T422 HydrophobicContact CG2-CG2 4.12Å; L404-T422 HydrophobicContact CD1-CG2 3.62Å; L404-T422 HydrophobicContact CD2-CG2 4.49Å; S418-T422 WeakPolarHBondContact O-CB 3.45Å; S418-T422 PolarHBondContact O-N 3.31Å; S418-T422 PolarHBondContact O-OG1 2.87Å; S419-T422 PolarHBondContact O-N 3.12Å; T422-S424 VanDerWaalsContact C-N 3.31Å; T422-S424 PolarHBondContact O-N 3.45Å; T422-N425 PolarHBondContact O-N 3.09Å; T422-M426 HydrophobicContact CG2-CG 4.46Å; T422-M426 HydrophobicContact CG2-SD 3.99Å; T422-M426 WeakPolarHBondContact O-CB 3.38Å; T422-M426 VanDerWaalsContact O-CG 3.22Å; T422-M426 WeakPolarHBondContact O-CG 3.39Å; T422-M426 PolarHBondContact O-N 2.77Å
423	I	98.2	Very high	96.6	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-43.7	175.4	-66.5	166.8	0	0	0	110.2	L404 I405 L408 S419 M426 A427 I436 C463 L467	L404-I423 HydrophobicContact CB-CD1 3.99Å; L404-I423 HydrophobicContact CB-CG1 3.84Å; I405-I423 HydrophobicContact CG1-CD1 4.11Å; L408-I423 HydrophobicContact CD1-CD1 3.82Å; L408-I423 HydrophobicContact CD2-CD1 4.31Å; L408-I423 HydrophobicContact CG-CD1 4.1Å; S419-I423 VanDerWaalsContact O-CG1 3.25Å; S419-I423 WeakPolarHBondContact O-CG1 3.28Å; S419-I423 PolarHBondContact O-N 3.17Å; I423-M426 PolarHBondContact O-N 3.29Å; I423-A427 VanDerWaalsContact O-CB 3.23Å; I423-A427 WeakPolarHBondContact O-CB 3.36Å; I423-A427 PolarHBondContact O-N 3.22Å; I423-I436 HydrophobicContact CG2-CD1 4.07Å; I423-I436 HydrophobicContact CG2-CG2 4.03Å; I423-C463 VanDerWaalsContact CG2-SG 3.58Å; I423-L467 HydrophobicContact CG2-CD1 4.48Å
424	S	97.5	Very high	96.6	Very high	4 Å²	4	29.3 Å²	29.3	3%	0.028	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-46.5	177.4	-168.7	0	0	0	0	112.2	A420 A421 T422 M426 A427 E428	A420-S424 WeakPolarHBondContact O-CB 3.5Å; A420-S424 PolarHBondContact O-N 3.39Å; A421-S424 WeakPolarHBondContact O-CB 3.49Å; A421-S424 PolarHBondContact O-N 3.03Å; T422-S424 VanDerWaalsContact C-N 3.31Å; T422-S424 PolarHBondContact O-N 3.45Å; S424-M426 VanDerWaalsContact C-N 3.3Å; S424-M426 PolarHBondContact O-N 3.31Å; S424-A427 PolarHBondContact O-N 3.17Å; S424-E428 PolarHBondContact O-N 2.92Å
425	N	97.7	Very high	96.8	Very high	15 Å²	15	28.5 Å²	28.5	8%	0.08	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-40.9	177.2	-62.6	-20.9	0	0	0	111.2	S382 T385 H386 A421 T422 E428	S382-N425 PolarHBondContact O-ND2 3.04Å; T385-N425 PolarHBondContact OG1-ND2 3.47Å; H386-N425 WeakPolarHBondContact CA-ND2 3.26Å; H386-N425 PolarHBondContact N-ND2 2.69Å; A421-N425 PolarHBondContact O-N 3.21Å; A421-N425 PolarHBondContact O-ND2 3.44Å; A421-N425 PolarHBondContact O-OD1 3.16Å; T422-N425 PolarHBondContact O-N 3.09Å; N425-E428 WeakPolarHBondContact O-CB 3.26Å; N425-E428 WeakPolarHBondContact O-CG 3.2Å; N425-E428 PolarHBondContact O-N 2.98Å
426	M	97.6	Very high	96.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.7	-38.1	178.3	-72.8	175.4	70.6	0	0	112.7	A392 V395 H401 L404 T422 I423 S424 E428 Q429 I432 I436	A392-M426 HydrophobicContact CB-CB 4.45Å; A392-M426 HydrophobicContact CB-CG 3.93Å; V395-M426 HydrophobicContact CB-CE 4.12Å; V395-M426 HydrophobicContact CB-SD 4.07Å; V395-M426 HydrophobicContact CG1-CE 3.81Å; V395-M426 HydrophobicContact CG1-SD 3.55Å; V395-M426 VanDerWaalsContact CG1-SD 3.55Å; H401-M426 HydrophobicContact CB-CE 3.87Å; L404-M426 HydrophobicContact CD1-SD 3.94Å; T422-M426 HydrophobicContact CG2-CG 4.46Å; T422-M426 HydrophobicContact CG2-SD 3.99Å; T422-M426 WeakPolarHBondContact O-CB 3.38Å; T422-M426 VanDerWaalsContact O-CG 3.22Å; T422-M426 WeakPolarHBondContact O-CG 3.39Å; T422-M426 PolarHBondContact O-N 2.77Å; I423-M426 PolarHBondContact O-N 3.29Å; S424-M426 VanDerWaalsContact C-N 3.3Å; S424-M426 PolarHBondContact O-N 3.31Å; M426-E428 PolarHBondContact O-N 3.2Å; M426-Q429 PolarHBondContact O-N 3.15Å; M426-I432 HydrophobicContact CB-CG2 3.94Å; M426-I432 HydrophobicContact CE-CG2 3.85Å; M426-I436 HydrophobicContact CB-CD1 4.37Å
427	A	96.7	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-1	-179.7	0	0	0	0	0	113.9	I423 S424 Q429 Q433 I436 Q466 L467	I423-A427 VanDerWaalsContact O-CB 3.23Å; I423-A427 WeakPolarHBondContact O-CB 3.36Å; I423-A427 PolarHBondContact O-N 3.22Å; S424-A427 PolarHBondContact O-N 3.17Å; A427-Q429 PolarHBondContact O-N 3.04Å; A427-Q433 HydrophobicContact CB-CB 4.28Å; A427-Q433 HydrophobicContact CB-CG 4.27Å; A427-I436 HydrophobicContact CB-CD1 4.18Å; A427-Q466 HydrophobicContact CB-CG 3.6Å; A427-Q466 PolarHBondContact O-NE2 3.37Å; A427-L467 HydrophobicContact CB-CD2 3.72Å
428	E	94.8	Very high	96.7	Very high	99 Å²	99	34.4 Å²	34.4	46%	0.463	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-28.3	166.7	-68	-178.3	-170.1	0	0	111.7	S424 N425 M426	S424-E428 PolarHBondContact O-N 2.92Å; N425-E428 WeakPolarHBondContact O-CB 3.26Å; N425-E428 WeakPolarHBondContact O-CG 3.2Å; N425-E428 PolarHBondContact O-N 2.98Å; M426-E428 PolarHBondContact O-N 3.2Å
429	Q	94.7	Very high	96.6	Very high	38 Å²	38	37.5 Å²	37.5	18%	0.178	20%	0.201	C	C	.	.	S	Bend	trans	-93.3	125.3	175.8	-70.3	175.5	68.2	0	0	111.4	E389 M426 A427 I431 I432 Q433	E389-Q429 HydrophobicContact CB-CG 4.5Å; E389-Q429 HydrophobicContact CG-CG 4.35Å; E389-Q429 PolarHBondContact O-NE2 2.97Å; M426-Q429 PolarHBondContact O-N 3.15Å; A427-Q429 PolarHBondContact O-N 3.04Å; Q429-I431 VanDerWaalsContact C-N 3.3Å; Q429-I431 PolarHBondContact O-N 3.04Å; Q429-I432 HydrophobicContact CB-CB 4.47Å; Q429-I432 HydrophobicContact CB-CD1 4.07Å; Q429-I432 HydrophobicContact CB-CG1 4.19Å; Q429-I432 PolarHBondContact O-N 3.37Å; Q429-I432 VanDerWaalsContact O-N 3.1Å; Q429-Q433 WeakPolarHBondContact O-CB 3.48Å; Q429-Q433 PolarHBondContact O-N 3.42Å
430	E	94.4	Very high	96.4	Very high	161 Å²	161	38.5 Å²	38.5	75%	0.752	21%	0.211	S	C	*	.	H	α-helix	trans	-56	-39.2	-176.1	-170.4	179.8	-178.5	0	0	113.4	I432 Q433 S434	E430-I432 PolarHBondContact O-N 3.2Å; E430-Q433 PolarHBondContact O-N 3.14Å; E430-S434 WeakPolarHBondContact O-CB 3.47Å; E430-S434 PolarHBondContact O-N 2.9Å
431	I	94.1	Very high	96.2	Very high	128 Å²	128	38.5 Å²	38.5	66%	0.656	21%	0.211	S	C	*	.	H	α-helix	trans	-62.2	-45.3	179.3	-60.7	173.7	0	0	0	110.8	Q429 S435	Q429-I431 VanDerWaalsContact C-N 3.3Å; Q429-I431 PolarHBondContact O-N 3.04Å; I431-S435 PolarHBondContact O-N 3.1Å
432	I	96.6	Very high	96.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-75.2	-40.7	-177.5	-53.7	174.9	0	0	0	109.9	L393 Y396 M426 Q429 E430 S434 S435 I436	L393-I432 HydrophobicContact CD1-CD1 4.39Å; Y396-I432 HydrophobicContact CD1-CG1 4.12Å; Y396-I432 HydrophobicContact CD2-CB 4.36Å; Y396-I432 HydrophobicContact CD2-CG1 4.22Å; Y396-I432 HydrophobicContact CD2-CG2 3.75Å; Y396-I432 HydrophobicContact CE2-CG2 4.5Å; Y396-I432 HydrophobicContact CG-CB 4.46Å; Y396-I432 HydrophobicContact CG-CD1 4.27Å; Y396-I432 HydrophobicContact CG-CG1 3.83Å; Y396-I432 HydrophobicContact CG-CG2 4.07Å; M426-I432 HydrophobicContact CB-CG2 3.94Å; M426-I432 HydrophobicContact CE-CG2 3.85Å; Q429-I432 HydrophobicContact CB-CB 4.47Å; Q429-I432 HydrophobicContact CB-CD1 4.07Å; Q429-I432 HydrophobicContact CB-CG1 4.19Å; Q429-I432 PolarHBondContact O-N 3.37Å; Q429-I432 VanDerWaalsContact O-N 3.1Å; E430-I432 PolarHBondContact O-N 3.2Å; I432-S434 VanDerWaalsContact C-N 3.33Å; I432-S434 PolarHBondContact O-N 3.47Å; I432-S435 PolarHBondContact O-N 3.08Å; I432-I436 HydrophobicContact CG2-CD1 3.83Å; I432-I436 HydrophobicContact CG2-CG1 4.41Å; I432-I436 WeakPolarHBondContact O-CG1 3.4Å; I432-I436 PolarHBondContact O-N 2.91Å
433	Q	97.1	Very high	96	Very high	27 Å²	27	41.9 Å²	41.9	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-54.3	-48.6	174	-172	-172.7	51.2	0	0	111	A427 Q429 E430 S435 I436 L437 Q466 L467	A427-Q433 HydrophobicContact CB-CB 4.28Å; A427-Q433 HydrophobicContact CB-CG 4.27Å; Q429-Q433 WeakPolarHBondContact O-CB 3.48Å; Q429-Q433 PolarHBondContact O-N 3.42Å; E430-Q433 PolarHBondContact O-N 3.14Å; Q433-S435 VanDerWaalsContact C-N 3.31Å; Q433-S435 PolarHBondContact O-N 3.37Å; Q433-I436 PolarHBondContact O-N 3.36Å; Q433-L437 HydrophobicContact CG-CD1 4.04Å; Q433-L437 HydrophobicContact CG-CG 4.42Å; Q433-L437 VanDerWaalsContact O-CG 3.24Å; Q433-L437 WeakPolarHBondContact O-CG 3.41Å; Q433-L437 PolarHBondContact O-N 3.33Å; Q433-Q466 PolarHBondContact NE2-O 3.39Å; Q433-L467 HydrophobicContact CG-CD2 4.16Å
434	S	95.4	Very high	95.9	Very high	70 Å²	70	43.3 Å²	43.3	49%	0.49	24%	0.239	S	C	.	.	H	α-helix	trans	-59.3	-39.4	178.6	-174.5	0	0	0	0	112.9	E430 I432 T438	E430-S434 WeakPolarHBondContact O-CB 3.47Å; E430-S434 PolarHBondContact O-N 2.9Å; I432-S434 VanDerWaalsContact C-N 3.33Å; I432-S434 PolarHBondContact O-N 3.47Å; S434-T438 PolarHBondContact O-N 3.44Å; S434-T438 PolarHBondContact O-OG1 3.43Å
435	S	97.1	Very high	95.9	Very high	26 Å²	26	43.1 Å²	43.1	18%	0.182	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-46.5	175.1	-166.9	0	0	0	0	112.1	H401 I431 I432 Q433 L437 T438 L439	H401-S435 PolarHBondContact NE2-OG 2.63Å; H401-S435 VanDerWaalsContact NE2-OG 3.16Å; I431-S435 PolarHBondContact O-N 3.1Å; I432-S435 PolarHBondContact O-N 3.08Å; Q433-S435 VanDerWaalsContact C-N 3.31Å; Q433-S435 PolarHBondContact O-N 3.37Å; S435-L437 VanDerWaalsContact C-N 3.3Å; S435-L437 PolarHBondContact O-N 2.92Å; S435-T438 WeakPolarHBondContact O-CB 3.38Å; S435-T438 PolarHBondContact O-N 2.87Å; S435-T438 VanDerWaalsContact O-N 3.17Å; S435-L439 PolarHBondContact O-N 3.07Å; S435-L439 VanDerWaalsContact O-N 3.15Å
436	I	97.3	Very high	95.9	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-43.4	177.1	-69.5	162.1	0	0	0	111.1	H401 I405 I423 M426 A427 I432 Q433 L439 G440 G441 L467	H401-I436 HydrophobicContact CB-CG1 4.19Å; I405-I436 HydrophobicContact CD1-CG2 4.17Å; I423-I436 HydrophobicContact CG2-CD1 4.07Å; I423-I436 HydrophobicContact CG2-CG2 4.03Å; M426-I436 HydrophobicContact CB-CD1 4.37Å; A427-I436 HydrophobicContact CB-CD1 4.18Å; I432-I436 HydrophobicContact CG2-CD1 3.83Å; I432-I436 HydrophobicContact CG2-CG1 4.41Å; I432-I436 WeakPolarHBondContact O-CG1 3.4Å; I432-I436 PolarHBondContact O-N 2.91Å; Q433-I436 PolarHBondContact O-N 3.36Å; I436-L439 PolarHBondContact O-N 3.19Å; I436-G440 PolarHBondContact O-N 2.92Å; I436-G441 PolarHBondContact O-N 2.97Å; I436-L467 HydrophobicContact CG2-CD1 3.88Å; I436-L467 HydrophobicContact CG2-CD2 3.9Å
437	L	96.8	Very high	95.8	Very high	18 Å²	18	48.8 Å²	48.8	9%	0.094	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-40.6	177.7	-66.7	172.5	0	0	0	111.9	Q433 S435 L439 G440 V442 L467 E473	Q433-L437 HydrophobicContact CG-CD1 4.04Å; Q433-L437 HydrophobicContact CG-CG 4.42Å; Q433-L437 VanDerWaalsContact O-CG 3.24Å; Q433-L437 WeakPolarHBondContact O-CG 3.41Å; Q433-L437 PolarHBondContact O-N 3.33Å; S435-L437 VanDerWaalsContact C-N 3.3Å; S435-L437 PolarHBondContact O-N 2.92Å; L437-L439 PolarHBondContact O-N 2.78Å; L437-G440 PolarHBondContact O-N 3.48Å; L437-V442 HydrophobicContact CD2-CB 4.44Å; L437-L467 HydrophobicContact CD2-CB 3.97Å; L437-L467 HydrophobicContact CD2-CD2 4.11Å; L437-L467 HydrophobicContact CD2-CG 4.47Å; L437-E473 HydrophobicContact CD1-CG 3.9Å; L437-E473 HydrophobicContact CD2-CB 4.48Å; L437-E473 HydrophobicContact CD2-CG 3.87Å; L437-E473 HydrophobicContact CG-CG 4.37Å
438	T	95.4	Very high	95.8	Very high	119 Å²	119	49.1 Å²	49.1	73%	0.73	27%	0.267	S	S	*	.	H	α-helix	trans	-61.3	-32.2	177.1	-58.8	0	0	0	0	112.4	S434 S435 G440	S434-T438 PolarHBondContact O-N 3.44Å; S434-T438 PolarHBondContact O-OG1 3.43Å; S435-T438 WeakPolarHBondContact O-CB 3.38Å; S435-T438 PolarHBondContact O-N 2.87Å; S435-T438 VanDerWaalsContact O-N 3.17Å; T438-G440 VanDerWaalsContact C-N 3.26Å; T438-G440 PolarHBondContact O-N 3.3Å
439	L	94.8	Very high	95.9	Very high	80 Å²	80	44.6 Å²	44.6	42%	0.419	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	0.2	176.2	-66.9	171.8	0	0	0	114	E402 I405 S435 I436 L437	E402-L439 HydrophobicContact CG-CD1 3.69Å; I405-L439 HydrophobicContact CD1-CB 3.84Å; I405-L439 HydrophobicContact CD1-CD1 3.97Å; S435-L439 PolarHBondContact O-N 3.07Å; S435-L439 VanDerWaalsContact O-N 3.15Å; I436-L439 PolarHBondContact O-N 3.19Å; L437-L439 PolarHBondContact O-N 2.78Å
440	G	94.3	Very high	95.9	Very high	21 Å²	21	48.2 Å²	48.2	22%	0.216	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	30	-177.8	0	0	0	0	0	113.9	I436 L437 T438 V442 Q443 A444	I436-G440 PolarHBondContact O-N 2.92Å; L437-G440 PolarHBondContact O-N 3.48Å; T438-G440 VanDerWaalsContact C-N 3.26Å; T438-G440 PolarHBondContact O-N 3.3Å; G440-V442 VanDerWaalsContact C-N 3.26Å; G440-V442 PolarHBondContact O-N 3.27Å; G440-Q443 PolarHBondContact O-N 3.41Å; G440-Q443 PolarHBondContact O-OE1 3.11Å; G440-A444 PolarHBondContact O-N 3.46Å; G440-A444 VanDerWaalsContact O-N 3.16Å
441	G	94.1	Very high	96	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-35.7	-179.1	0	0	0	0	0	113.6	I436 A444 L445	I436-G441 PolarHBondContact O-N 2.97Å; G441-A444 PolarHBondContact O-N 2.76Å; G441-L445 WeakPolarHBondContact O-CG 3.49Å
442	V	95.7	Very high	96	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.8	-36	179.7	73	0	0	0	0	112.4	L437 G440 L467 K476 F477	L437-V442 HydrophobicContact CD2-CB 4.44Å; G440-V442 VanDerWaalsContact C-N 3.26Å; G440-V442 PolarHBondContact O-N 3.27Å; V442-L467 HydrophobicContact CB-CB 4.37Å; V442-L467 HydrophobicContact CG2-CB 4.37Å; V442-K476 HydrophobicContact CG1-CB 4.15Å; V442-F477 HydrophobicContact CG2-CB 3.78Å; V442-F477 HydrophobicContact CG2-CD2 3.92Å; V442-F477 HydrophobicContact CG2-CG 4.15Å
443	Q	95.8	Very high	96	Very high	71 Å²	71	45.9 Å²	45.9	33%	0.332	26%	0.263	S	S	.	.	H	α-helix	trans	-72.6	-33.8	176.9	-60.8	88.1	-20.8	0	0	111.6	G440 L445 V446 A480	G440-Q443 PolarHBondContact O-N 3.41Å; G440-Q443 PolarHBondContact O-OE1 3.11Å; Q443-L445 PolarHBondContact O-N 2.7Å; Q443-V446 WeakPolarHBondContact O-CG2 3.22Å; Q443-V446 PolarHBondContact O-N 2.61Å; Q443-A480 HydrophobicContact CB-CB 4.28Å; Q443-A480 HydrophobicContact CG-CB 4.04Å
444	A	96.8	Very high	96	Very high	32 Å²	32	47.6 Å²	47.6	26%	0.264	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-21.3	178.4	0	0	0	0	0	113.3	I405 L408 G440 G441 V446 P448	I405-A444 HydrophobicContact CG2-CB 3.94Å; L408-A444 HydrophobicContact CD1-CB 3.87Å; G440-A444 PolarHBondContact O-N 3.46Å; G440-A444 VanDerWaalsContact O-N 3.16Å; G441-A444 PolarHBondContact O-N 2.76Å; A444-V446 VanDerWaalsContact C-N 3.33Å; A444-V446 PolarHBondContact O-N 3.28Å; A444-P448 VanDerWaalsContact O-CD 3.28Å; A444-P448 WeakPolarHBondContact O-CD 3.43Å
445	L	97.2	Very high	96	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.6	179.5	-63.8	170.7	0	0	0	114.1	L408 G441 Q443 E447 P448 L449 T460 C463 V464 L467	L408-L445 HydrophobicContact CD1-CD2 3.82Å; L408-L445 HydrophobicContact CD1-CG 4.48Å; L408-L445 HydrophobicContact CD2-CD2 4.34Å; G441-L445 WeakPolarHBondContact O-CG 3.49Å; Q443-L445 PolarHBondContact O-N 2.7Å; L445-E447 PolarHBondContact O-N 3.12Å; L445-P448 WeakPolarHBondContact O-CD 3.47Å; L445-L449 WeakPolarHBondContact O-CG 3.42Å; L445-L449 PolarHBondContact O-N 2.99Å; L445-T460 HydrophobicContact CB-CG2 3.96Å; L445-T460 HydrophobicContact CD2-CG2 3.89Å; L445-T460 HydrophobicContact CG-CG2 4.48Å; L445-T460 WeakPolarHBondContact O-CG2 3.22Å; L445-C463 HydrophobicContact CD1-CB 3.98Å; L445-C463 HydrophobicContact CD2-CB 4.01Å; L445-V464 HydrophobicContact CB-CG2 3.97Å; L445-V464 HydrophobicContact CD1-CB 4.46Å; L445-V464 HydrophobicContact CD1-CG2 3.7Å; L445-V464 HydrophobicContact CG-CG2 4.45Å; L445-L467 HydrophobicContact CD1-CD1 3.9Å
446	V	96.9	Very high	96	Very high	12 Å²	12	47.3 Å²	47.3	7%	0.073	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-40.8	-174.7	175.8	0	0	0	0	113	Q443 A444 F477 A480	Q443-V446 WeakPolarHBondContact O-CG2 3.22Å; Q443-V446 PolarHBondContact O-N 2.61Å; A444-V446 VanDerWaalsContact C-N 3.33Å; A444-V446 PolarHBondContact O-N 3.28Å; V446-F477 HydrophobicContact CG2-CD2 4.26Å; V446-F477 HydrophobicContact CG2-CE2 4.08Å; V446-A480 HydrophobicContact CG2-CB 3.87Å
447	E	95.9	Very high	96	Very high	122 Å²	122	48.1 Å²	48.1	57%	0.57	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-47	178.1	-79.5	-55.9	138.1	0	0	112.7	L445 L449 K450	L445-E447 PolarHBondContact O-N 3.12Å; E447-L449 PolarHBondContact O-N 3.34Å; E447-L449 VanDerWaalsContact O-N 3.16Å; E447-K450 WeakPolarHBondContact O-CB 3.27Å; E447-K450 PolarHBondContact O-N 3.4Å; E447-K450 IonicContact OE1-NZ 3.33Å; E447-K450 PolarHBondContact OE1-NZ 3.01Å; E447-K450 IonicContact OE2-NZ 3.85Å
448	P	96.9	Very high	96.1	Very high	7 Å²	7	48.2 Å²	48.2	5%	0.045	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-55	-31.6	174.3	-29.9	35.7	0	0	0	115	L408 V416 A444 L445 K450 S451 V456 T460	L408-P448 HydrophobicContact CB-CG 4.11Å; L408-P448 HydrophobicContact CD2-CG 4.45Å; L408-P448 WeakPolarHBondContact O-CG 3.41Å; V416-P448 HydrophobicContact CG1-CB 3.92Å; V416-P448 HydrophobicContact CG1-CG 3.97Å; A444-P448 VanDerWaalsContact O-CD 3.28Å; A444-P448 WeakPolarHBondContact O-CD 3.43Å; L445-P448 WeakPolarHBondContact O-CD 3.47Å; P448-K450 PolarHBondContact O-N 2.89Å; P448-K450 VanDerWaalsContact O-N 3.15Å; P448-S451 WeakPolarHBondContact O-CB 3.39Å; P448-S451 PolarHBondContact O-N 3.37Å; P448-S451 VanDerWaalsContact O-N 3.1Å; P448-V456 HydrophobicContact CB-CG1 3.99Å; P448-V456 WeakPolarHBondContact O-CG1 3.46Å; P448-T460 HydrophobicContact CB-CG2 3.75Å; P448-T460 WeakPolarHBondContact CB-OG1 3.39Å
449	L	96.6	Very high	96.2	Very high	4 Å²	4	46 Å²	46	2%	0.021	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-64.1	-15.1	175.4	-72.6	172.2	0	0	0	114.1	L445 E447 L457 T460 V464 F477 P485 L489	L445-L449 WeakPolarHBondContact O-CG 3.42Å; L445-L449 PolarHBondContact O-N 2.99Å; E447-L449 PolarHBondContact O-N 3.34Å; E447-L449 VanDerWaalsContact O-N 3.16Å; L449-L457 VanDerWaalsContact O-CD2 3.27Å; L449-L457 WeakPolarHBondContact O-CD2 3.14Å; L449-T460 HydrophobicContact CD2-CG2 3.62Å; L449-T460 HydrophobicContact CG-CG2 3.62Å; L449-V464 HydrophobicContact CD1-CG2 4.2Å; L449-F477 HydrophobicContact CD1-CE2 3.93Å; L449-F477 HydrophobicContact CD1-CZ 3.61Å; L449-P485 HydrophobicContact CB-CB 3.62Å; L449-P485 HydrophobicContact CD1-CB 4.36Å; L449-L489 HydrophobicContact CD2-CD1 3.72Å
450	K	95.3	Very high	96.3	Very high	114 Å²	114	42.2 Å²	42.2	50%	0.496	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-94	0.4	177.6	-57.4	174.2	-170.3	167.8	0	112.9	E447 P448 P485	E447-K450 WeakPolarHBondContact O-CB 3.27Å; E447-K450 PolarHBondContact O-N 3.4Å; E447-K450 IonicContact OE1-NZ 3.33Å; E447-K450 PolarHBondContact OE1-NZ 3.01Å; E447-K450 IonicContact OE2-NZ 3.85Å; P448-K450 PolarHBondContact O-N 2.89Å; P448-K450 VanDerWaalsContact O-N 3.15Å; K450-P485 HydrophobicContact CG-CB 4.2Å; K450-P485 HydrophobicContact CG-CG 3.96Å
451	S	95.8	Very high	96.5	Very high	40 Å²	40	41.2 Å²	41.2	28%	0.28	22%	0.217	S	C	.	.			trans	-62.8	157.6	179.7	-174.3	0	0	0	0	112.3	P448 D453 L457	P448-S451 WeakPolarHBondContact O-CB 3.39Å; P448-S451 PolarHBondContact O-N 3.37Å; P448-S451 VanDerWaalsContact O-N 3.1Å; S451-D453 PolarHBondContact OG-N 3.36Å; S451-D453 VanDerWaalsContact OG-N 3.1Å; S451-L457 WeakPolarHBondContact O-CD1 3.3Å; S451-L457 WeakPolarHBondContact O-CD2 3.46Å
452	T	94.6	Very high	96.7	Very high	143 Å²	143	43.1 Å²	43.1	88%	0.877	23%	0.227	S	C	*	.	S	Bend	trans	-93.4	-10.4	169.1	56.9	0	0	0	0	112.8
453	D	96.6	Very high	96.8	Very high	56 Å²	56	43.1 Å²	43.1	30%	0.299	23%	0.227	S	C	.	.			trans	-81.2	126.6	-178.3	-177	-86.1	0	0	0	111.5	A413 S451 Q455 V456 L457	A413-D453 HydrophobicContact CB-CB 3.88Å; S451-D453 PolarHBondContact OG-N 3.36Å; S451-D453 VanDerWaalsContact OG-N 3.1Å; D453-Q455 PolarHBondContact O-N 2.88Å; D453-Q455 WeakPolarHBondContact OD1-CA 3.23Å; D453-Q455 WeakPolarHBondContact OD1-CB 3.3Å; D453-Q455 PolarHBondContact OD1-N 3.37Å; D453-V456 HydrophobicContact CB-CB 4.14Å; D453-V456 HydrophobicContact CB-CG2 3.91Å; D453-V456 PolarHBondContact O-N 2.91Å; D453-V456 PolarHBondContact OD1-N 3.29Å; D453-L457 VanDerWaalsContact O-CG 3.28Å; D453-L457 WeakPolarHBondContact O-CG 3.29Å; D453-L457 PolarHBondContact O-N 2.88Å; D453-L457 VanDerWaalsContact O-N 3.08Å
454	T	96.4	Very high	96.9	Very high	64 Å²	64	39.7 Å²	39.7	39%	0.393	21%	0.211	S	C	.	.	H	α-helix	trans	-66.7	-34.2	-174	53	0	0	0	0	113.1	M458 V497	T454-M458 VanDerWaalsContact O-CB 3.27Å; T454-M458 WeakPolarHBondContact O-CB 3.22Å; T454-M458 PolarHBondContact O-N 3.03Å; T454-V497 WeakPolarHBondContact O-CG2 3.41Å
455	Q	96.3	Very high	96.9	Very high	87 Å²	87	38.6 Å²	38.6	41%	0.407	20%	0.201	S	C	.	.	H	α-helix	trans	-70.7	-42.9	178.9	-65.6	-63.4	-51.7	0	0	110.7	A417 D453 L457 M458 Y459	A417-Q455 HydrophobicContact CB-CB 3.99Å; D453-Q455 PolarHBondContact O-N 2.88Å; D453-Q455 WeakPolarHBondContact OD1-CA 3.23Å; D453-Q455 WeakPolarHBondContact OD1-CB 3.3Å; D453-Q455 PolarHBondContact OD1-N 3.37Å; Q455-L457 VanDerWaalsContact C-N 3.35Å; Q455-L457 PolarHBondContact O-N 3.15Å; Q455-M458 PolarHBondContact O-N 2.92Å; Q455-M458 VanDerWaalsContact OE1-CE 3.24Å; Q455-Y459 VanDerWaalsContact O-CD2 3.28Å; Q455-Y459 WeakPolarHBondContact O-CD2 2.99Å; Q455-Y459 PolarHBondContact O-N 3.48Å
456	V	97.3	Very high	96.8	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-51	173.6	174.8	0	0	0	0	110.3	A413 V416 A417 P448 D453 M458 T460	A413-V456 HydrophobicContact CB-CG2 3.87Å; A413-V456 WeakPolarHBondContact O-CG2 3.44Å; V416-V456 HydrophobicContact CB-CG2 4.22Å; V416-V456 HydrophobicContact CG1-CG1 3.76Å; V416-V456 HydrophobicContact CG1-CG2 4.27Å; A417-V456 HydrophobicContact CB-CG2 3.95Å; P448-V456 HydrophobicContact CB-CG1 3.99Å; P448-V456 WeakPolarHBondContact O-CG1 3.46Å; D453-V456 HydrophobicContact CB-CB 4.14Å; D453-V456 HydrophobicContact CB-CG2 3.91Å; D453-V456 PolarHBondContact O-N 2.91Å; D453-V456 PolarHBondContact OD1-N 3.29Å; V456-M458 PolarHBondContact O-N 3.28Å; V456-T460 WeakPolarHBondContact O-CB 3.4Å; V456-T460 PolarHBondContact O-N 3.44Å; V456-T460 PolarHBondContact O-OG1 3.39Å
457	L	97.7	Very high	96.8	Very high	17 Å²	17	40.6 Å²	40.6	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-43.3	-178.5	-67.3	177.9	0	0	0	112.4	L449 S451 D453 Q455 A461 L489 V497	L449-L457 VanDerWaalsContact O-CD2 3.27Å; L449-L457 WeakPolarHBondContact O-CD2 3.14Å; S451-L457 WeakPolarHBondContact O-CD1 3.3Å; S451-L457 WeakPolarHBondContact O-CD2 3.46Å; D453-L457 VanDerWaalsContact O-CG 3.28Å; D453-L457 WeakPolarHBondContact O-CG 3.29Å; D453-L457 PolarHBondContact O-N 2.88Å; D453-L457 VanDerWaalsContact O-N 3.08Å; Q455-L457 VanDerWaalsContact C-N 3.35Å; Q455-L457 PolarHBondContact O-N 3.15Å; L457-A461 VanDerWaalsContact O-CB 3.29Å; L457-A461 WeakPolarHBondContact O-CB 3.48Å; L457-A461 PolarHBondContact O-N 3.37Å; L457-L489 HydrophobicContact CB-CD2 4.26Å; L457-L489 HydrophobicContact CD1-CD2 3.75Å; L457-L489 HydrophobicContact CD2-CD1 4.43Å; L457-L489 HydrophobicContact CD2-CD2 3.64Å; L457-L489 HydrophobicContact CG-CD2 4.06Å; L457-V497 HydrophobicContact CB-CG1 4.02Å; L457-V497 HydrophobicContact CB-CG2 4.27Å
458	M	97.3	Very high	96.8	Very high	20 Å²	20	34.8 Å²	34.8	10%	0.099	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-55.2	178.9	-178.8	-172.6	68.2	0	0	111.7	T454 Q455 V456 A461 L462 E496 V497 H500	T454-M458 VanDerWaalsContact O-CB 3.27Å; T454-M458 WeakPolarHBondContact O-CB 3.22Å; T454-M458 PolarHBondContact O-N 3.03Å; Q455-M458 PolarHBondContact O-N 2.92Å; Q455-M458 VanDerWaalsContact OE1-CE 3.24Å; V456-M458 PolarHBondContact O-N 3.28Å; M458-A461 PolarHBondContact O-N 3.37Å; M458-L462 PolarHBondContact O-N 2.89Å; M458-E496 HydrophobicContact CG-CB 4.17Å; M458-E496 HydrophobicContact SD-CB 3.63Å; M458-E496 HydrophobicContact SD-CG 4.32Å; M458-V497 HydrophobicContact CB-CG2 4.13Å; M458-H500 WeakPolarHBondContact CG-ND1 3.27Å
459	Y	97.8	Very high	96.6	Very high	73 Å²	73	37.1 Å²	37.1	29%	0.286	20%	0.199	S	C	.	.	H	α-helix	trans	-71.8	-32.5	-177.1	-73.1	-61.8	0	0	0	112.8	A417 A421 Q455 L462 C463	A417-Y459 HydrophobicContact CB-CD2 4.15Å; A421-Y459 HydrophobicContact CB-CD1 3.46Å; A421-Y459 VanDerWaalsContact CB-CD1 3.46Å; A421-Y459 HydrophobicContact CB-CD2 4.22Å; A421-Y459 HydrophobicContact CB-CE1 3.67Å; A421-Y459 HydrophobicContact CB-CE2 4.4Å; A421-Y459 HydrophobicContact CB-CG 3.76Å; Q455-Y459 VanDerWaalsContact O-CD2 3.28Å; Q455-Y459 WeakPolarHBondContact O-CD2 2.99Å; Q455-Y459 PolarHBondContact O-N 3.48Å; Y459-L462 HydrophobicContact CD1-CD2 4.48Å; Y459-L462 PolarHBondContact O-N 2.94Å; Y459-C463 VanDerWaalsContact O-CB 3.3Å; Y459-C463 WeakPolarHBondContact O-CB 3.42Å; Y459-C463 PolarHBondContact O-N 3.25Å
460	T	98	Very high	96.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-45.7	174.8	-55.8	0	0	0	0	110.8	L445 P448 L449 V456 L462 C463 V464	L445-T460 HydrophobicContact CB-CG2 3.96Å; L445-T460 HydrophobicContact CD2-CG2 3.89Å; L445-T460 HydrophobicContact CG-CG2 4.48Å; L445-T460 WeakPolarHBondContact O-CG2 3.22Å; P448-T460 HydrophobicContact CB-CG2 3.75Å; P448-T460 WeakPolarHBondContact CB-OG1 3.39Å; L449-T460 HydrophobicContact CD2-CG2 3.62Å; L449-T460 HydrophobicContact CG-CG2 3.62Å; V456-T460 WeakPolarHBondContact O-CB 3.4Å; V456-T460 PolarHBondContact O-N 3.44Å; V456-T460 PolarHBondContact O-OG1 3.39Å; T460-L462 VanDerWaalsContact C-N 3.33Å; T460-L462 PolarHBondContact O-N 3.4Å; T460-C463 PolarHBondContact O-N 3.39Å; T460-V464 WeakPolarHBondContact O-CG2 3.32Å; T460-V464 PolarHBondContact O-N 3.17Å
461	A	98	Very high	96.3	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-39.7	176.6	0	0	0	0	0	112	L457 M458 V464 A465 L489 H500 A504	L457-A461 VanDerWaalsContact O-CB 3.29Å; L457-A461 WeakPolarHBondContact O-CB 3.48Å; L457-A461 PolarHBondContact O-N 3.37Å; M458-A461 PolarHBondContact O-N 3.37Å; A461-V464 PolarHBondContact O-N 2.92Å; A461-A465 PolarHBondContact O-N 3.06Å; A461-A465 VanDerWaalsContact O-N 3.08Å; A461-L489 HydrophobicContact CB-CD1 4.25Å; A461-H500 HydrophobicContact CB-CB 3.86Å; A461-A504 WeakPolarHBondContact O-CB 3.35Å
462	L	97.5	Very high	96.2	Very high	41 Å²	41	42.9 Å²	42.9	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-59.7	-46.8	172.3	179.8	60	0	0	0	111.5	M458 Y459 T460 V464 A465 Q466	M458-L462 PolarHBondContact O-N 2.89Å; Y459-L462 HydrophobicContact CD1-CD2 4.48Å; Y459-L462 PolarHBondContact O-N 2.94Å; T460-L462 VanDerWaalsContact C-N 3.33Å; T460-L462 PolarHBondContact O-N 3.4Å; L462-V464 VanDerWaalsContact C-N 3.34Å; L462-V464 PolarHBondContact O-N 2.93Å; L462-A465 WeakPolarHBondContact O-CB 3.2Å; L462-A465 PolarHBondContact O-N 3.39Å; L462-A465 VanDerWaalsContact O-N 3.15Å; L462-Q466 PolarHBondContact O-N 3.44Å
463	C	97.8	Very high	96.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-38.8	179.3	-164.4	0	0	0	0	112	I423 L445 Y459 T460 A465 Q466 L467	I423-C463 VanDerWaalsContact CG2-SG 3.58Å; L445-C463 HydrophobicContact CD1-CB 3.98Å; L445-C463 HydrophobicContact CD2-CB 4.01Å; Y459-C463 VanDerWaalsContact O-CB 3.3Å; Y459-C463 WeakPolarHBondContact O-CB 3.42Å; Y459-C463 PolarHBondContact O-N 3.25Å; T460-C463 PolarHBondContact O-N 3.39Å; C463-A465 PolarHBondContact O-N 3.12Å; C463-Q466 PolarHBondContact O-N 2.79Å; C463-Q466 VanDerWaalsContact O-N 3.15Å; C463-L467 WeakPolarHBondContact O-CG 3.31Å; C463-L467 PolarHBondContact O-N 3.1Å
464	V	97.9	Very high	96.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-45.7	172.6	171.4	0	0	0	0	110.9	L445 L449 T460 A461 L462 Q466 L467 A468 F477 A504	L445-V464 HydrophobicContact CB-CG2 3.97Å; L445-V464 HydrophobicContact CD1-CB 4.46Å; L445-V464 HydrophobicContact CD1-CG2 3.7Å; L445-V464 HydrophobicContact CG-CG2 4.45Å; L449-V464 HydrophobicContact CD1-CG2 4.2Å; T460-V464 WeakPolarHBondContact O-CG2 3.32Å; T460-V464 PolarHBondContact O-N 3.17Å; A461-V464 PolarHBondContact O-N 2.92Å; L462-V464 VanDerWaalsContact C-N 3.34Å; L462-V464 PolarHBondContact O-N 2.93Å; V464-Q466 PolarHBondContact O-N 3.22Å; V464-L467 PolarHBondContact O-N 3.34Å; V464-A468 WeakPolarHBondContact O-CB 3.47Å; V464-A468 PolarHBondContact O-N 3.46Å; V464-F477 HydrophobicContact CG1-CD1 4.45Å; V464-F477 HydrophobicContact CG1-CE1 3.97Å; V464-F477 HydrophobicContact CG1-CE2 4.21Å; V464-F477 HydrophobicContact CG1-CZ 3.84Å; V464-F477 HydrophobicContact CG2-CE2 3.91Å; V464-F477 HydrophobicContact CG2-CZ 4.01Å; V464-A504 HydrophobicContact CB-CB 4.37Å; V464-A504 HydrophobicContact CG1-CB 4.16Å
465	A	96.7	Very high	96.1	Very high	8 Å²	8	35.1 Å²	35.1	7%	0.066	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-32	177.8	0	0	0	0	0	112.2	A461 L462 C463 F503 A504 V507	A461-A465 PolarHBondContact O-N 3.06Å; A461-A465 VanDerWaalsContact O-N 3.08Å; L462-A465 WeakPolarHBondContact O-CB 3.2Å; L462-A465 PolarHBondContact O-N 3.39Å; L462-A465 VanDerWaalsContact O-N 3.15Å; C463-A465 PolarHBondContact O-N 3.12Å; A465-F503 HydrophobicContact CB-CD1 3.44Å; A465-F503 VanDerWaalsContact CB-CD1 3.44Å; A465-F503 HydrophobicContact CB-CE1 3.56Å; A465-F503 HydrophobicContact CB-CG 4.1Å; A465-F503 HydrophobicContact CB-CZ 4.29Å; A465-A504 HydrophobicContact CB-CB 4.12Å; A465-V507 HydrophobicContact CB-CG2 4.29Å
466	Q	96.6	Very high	96.1	Very high	54 Å²	54	33.7 Å²	33.7	25%	0.252	17%	0.168	S	C	.	.	H	α-helix	trans	-77	-39	177	-169.9	60.4	27.4	0	0	113	A427 Q433 L462 C463 V464	A427-Q466 HydrophobicContact CB-CG 3.6Å; A427-Q466 PolarHBondContact O-NE2 3.37Å; Q433-Q466 PolarHBondContact NE2-O 3.39Å; L462-Q466 PolarHBondContact O-N 3.44Å; C463-Q466 PolarHBondContact O-N 2.79Å; C463-Q466 VanDerWaalsContact O-N 3.15Å; V464-Q466 PolarHBondContact O-N 3.22Å
467	L	97	Very high	96.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-87.3	-22.4	-176.2	-64.8	-173.6	0	0	0	113.9	I423 A427 Q433 I436 L437 V442 L445 C463 V464 C469	I423-L467 HydrophobicContact CG2-CD1 4.48Å; A427-L467 HydrophobicContact CB-CD2 3.72Å; Q433-L467 HydrophobicContact CG-CD2 4.16Å; I436-L467 HydrophobicContact CG2-CD1 3.88Å; I436-L467 HydrophobicContact CG2-CD2 3.9Å; L437-L467 HydrophobicContact CD2-CB 3.97Å; L437-L467 HydrophobicContact CD2-CD2 4.11Å; L437-L467 HydrophobicContact CD2-CG 4.47Å; V442-L467 HydrophobicContact CB-CB 4.37Å; V442-L467 HydrophobicContact CG2-CB 4.37Å; L445-L467 HydrophobicContact CD1-CD1 3.9Å; C463-L467 WeakPolarHBondContact O-CG 3.31Å; C463-L467 PolarHBondContact O-N 3.1Å; V464-L467 PolarHBondContact O-N 3.34Å; L467-C469 PolarHBondContact O-N 2.96Å
468	A	95.4	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.			trans	-78.1	47.3	177.4	0	0	0	0	0	113	V464 R474 V507	V464-A468 WeakPolarHBondContact O-CB 3.47Å; V464-A468 PolarHBondContact O-N 3.46Å; A468-R474 HydrophobicContact CB-CG 4.05Å; A468-R474 PolarHBondContact O-NE 3.13Å; A468-R474 VanDerWaalsContact O-NE 3.09Å; A468-R474 PolarHBondContact O-NH2 3.37Å; A468-V507 HydrophobicContact CB-CG1 3.87Å; A468-V507 WeakPolarHBondContact O-CG1 3.32Å
469	C	91.6	Very high	96	Very high	56 Å²	56	41.6 Å²	41.6	38%	0.378	20%	0.202	S	C	.	.			trans	-72.6	-32	-168.3	60	0	0	0	0	114	L467 R474	L467-C469 PolarHBondContact O-N 2.96Å; C469-R474 PolarHBondContact O-NH2 3.15Å; C469-R474 VanDerWaalsContact O-NH2 3.1Å
470	D	93.1	Very high	95.9	Very high	68 Å²	68	40.1 Å²	40.1	36%	0.364	21%	0.205	S	C	.	.	S	Bend	trans	-131.9	-179.9	-179.7	69	41	0	0	0	113.3	E472 E473 R474	D470-E472 WeakPolarHBondContact OD1-CA 3.47Å; D470-E472 WeakPolarHBondContact OD1-CB 3.2Å; D470-E472 PolarHBondContact OD1-N 3.18Å; D470-E473 PolarHBondContact OD1-N 3.15Å; D470-R474 WeakPolarHBondContact O-CB 3.3Å; D470-R474 VanDerWaalsContact O-CD 3.31Å; D470-R474 WeakPolarHBondContact O-CD 3.46Å; D470-R474 WeakPolarHBondContact O-CG 3.48Å; D470-R474 PolarHBondContact O-N 2.92Å; D470-R474 VanDerWaalsContact O-N 3.13Å; D470-R474 PolarHBondContact O-NE 3.24Å
471	N	92.9	Very high	95.8	Very high	91 Å²	91	42 Å²	42	49%	0.487	22%	0.224	S	C	.	.	H	α-helix	trans	-71.3	-28.4	-178.1	-69.5	-12.2	0	0	0	113.3	R474 D475	N471-R474 PolarHBondContact OD1-NH1 3.43Å; N471-D475 WeakPolarHBondContact O-CB 3.49Å; N471-D475 PolarHBondContact O-N 3.08Å
472	E	94.8	Very high	95.7	Very high	121 Å²	121	42 Å²	42	57%	0.565	22%	0.224	S	C	*	.	H	α-helix	trans	-70.6	-44.6	178.5	-172.2	-177.4	151.9	0	0	110.3	D470 D475 K476	D470-E472 WeakPolarHBondContact OD1-CA 3.47Å; D470-E472 WeakPolarHBondContact OD1-CB 3.2Å; D470-E472 PolarHBondContact OD1-N 3.18Å; E472-D475 PolarHBondContact O-N 2.84Å; E472-K476 HydrophobicContact CG-CD 4.5Å; E472-K476 WeakPolarHBondContact O-CG 2.73Å; E472-K476 PolarHBondContact O-N 2.83Å; E472-K476 WeakPolarHBondContact OE1-CE 3.47Å; E472-K476 IonicContact OE1-NZ 2.72Å; E472-K476 PolarHBondContact OE1-NZ 3.48Å
473	E	95.6	Very high	95.7	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-69.7	-36.3	178.5	-60.5	-49.8	136.4	0	0	112.3	L437 D470 K476 F477	L437-E473 HydrophobicContact CD1-CG 3.9Å; L437-E473 HydrophobicContact CD2-CB 4.48Å; L437-E473 HydrophobicContact CD2-CG 3.87Å; L437-E473 HydrophobicContact CG-CG 4.37Å; D470-E473 PolarHBondContact OD1-N 3.15Å; E473-K476 PolarHBondContact O-N 3.17Å; E473-K476 IonicContact OE1-NZ 2.81Å; E473-K476 PolarHBondContact OE1-NZ 3.16Å; E473-K476 VanDerWaalsContact OE2-CD 3.3Å; E473-K476 WeakPolarHBondContact OE2-CD 3.37Å; E473-K476 IonicContact OE2-NZ 3.32Å; E473-F477 WeakPolarHBondContact O-CB 3.39Å; E473-F477 PolarHBondContact O-N 3.25Å
474	R	95.6	Very high	95.6	Very high	34 Å²	34	45.7 Å²	45.7	13%	0.128	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-43.3	170.6	-71.6	167.6	-159.9	150.1	6	111.9	A468 C469 D470 N471 F477 H478 V507 D511	A468-R474 HydrophobicContact CB-CG 4.05Å; A468-R474 PolarHBondContact O-NE 3.13Å; A468-R474 VanDerWaalsContact O-NE 3.09Å; A468-R474 PolarHBondContact O-NH2 3.37Å; C469-R474 PolarHBondContact O-NH2 3.15Å; C469-R474 VanDerWaalsContact O-NH2 3.1Å; D470-R474 WeakPolarHBondContact O-CB 3.3Å; D470-R474 VanDerWaalsContact O-CD 3.31Å; D470-R474 WeakPolarHBondContact O-CD 3.46Å; D470-R474 WeakPolarHBondContact O-CG 3.48Å; D470-R474 PolarHBondContact O-N 2.92Å; D470-R474 VanDerWaalsContact O-N 3.13Å; D470-R474 PolarHBondContact O-NE 3.24Å; N471-R474 PolarHBondContact OD1-NH1 3.43Å; R474-F477 PolarHBondContact O-N 3.31Å; R474-H478 VanDerWaalsContact O-CB 3.31Å; R474-H478 WeakPolarHBondContact O-CB 3.46Å; R474-H478 PolarHBondContact O-N 3.16Å; R474-V507 PolarHBondContact NE-O 3.21Å; R474-D511 HydrophobicContact CB-CB 4.24Å
475	D	94.1	Very high	95.6	Very high	53 Å²	53	46.1 Å²	46.1	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-66	-39.3	176.6	178	64.3	0	0	0	112	N471 E472 H478 K479	N471-D475 WeakPolarHBondContact O-CB 3.49Å; N471-D475 PolarHBondContact O-N 3.08Å; E472-D475 PolarHBondContact O-N 2.84Å; D475-H478 PolarHBondContact O-N 3.26Å; D475-K479 WeakPolarHBondContact O-CB 3.43Å; D475-K479 WeakPolarHBondContact O-CG 3.42Å; D475-K479 PolarHBondContact O-N 3.23Å; D475-K479 VanDerWaalsContact OD1-CE 3.27Å; D475-K479 WeakPolarHBondContact OD1-CE 3.05Å; D475-K479 IonicContact OD1-NZ 3.88Å; D475-K479 WeakPolarHBondContact OD2-CE 3.3Å; D475-K479 IonicContact OD2-NZ 2.71Å; D475-K479 PolarHBondContact OD2-NZ 3.28Å
476	K	96.3	Very high	95.7	Very high	57 Å²	57	45.8 Å²	45.8	25%	0.248	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-47	172.2	-76.4	167.3	-175.2	164	0	111.9	V442 E472 E473 H478 K479 A480	V442-K476 HydrophobicContact CG1-CB 4.15Å; E472-K476 HydrophobicContact CG-CD 4.5Å; E472-K476 WeakPolarHBondContact O-CG 2.73Å; E472-K476 PolarHBondContact O-N 2.83Å; E472-K476 WeakPolarHBondContact OE1-CE 3.47Å; E472-K476 IonicContact OE1-NZ 2.72Å; E472-K476 PolarHBondContact OE1-NZ 3.48Å; E473-K476 PolarHBondContact O-N 3.17Å; E473-K476 IonicContact OE1-NZ 2.81Å; E473-K476 PolarHBondContact OE1-NZ 3.16Å; E473-K476 VanDerWaalsContact OE2-CD 3.3Å; E473-K476 WeakPolarHBondContact OE2-CD 3.37Å; E473-K476 IonicContact OE2-NZ 3.32Å; K476-H478 VanDerWaalsContact C-N 3.35Å; K476-K479 PolarHBondContact O-N 3.28Å; K476-A480 WeakPolarHBondContact O-CB 3.29Å; K476-A480 PolarHBondContact O-N 3.49Å
477	F	97.3	Very high	95.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-42.3	176.2	-175.9	-114.3	0	0	0	112.2	V442 V446 L449 V464 E473 R474 A480 G481 G482 L483 L486	V442-F477 HydrophobicContact CG2-CB 3.78Å; V442-F477 HydrophobicContact CG2-CD2 3.92Å; V442-F477 HydrophobicContact CG2-CG 4.15Å; V446-F477 HydrophobicContact CG2-CD2 4.26Å; V446-F477 HydrophobicContact CG2-CE2 4.08Å; L449-F477 HydrophobicContact CD1-CE2 3.93Å; L449-F477 HydrophobicContact CD1-CZ 3.61Å; V464-F477 HydrophobicContact CG1-CD1 4.45Å; V464-F477 HydrophobicContact CG1-CE1 3.97Å; V464-F477 HydrophobicContact CG1-CE2 4.21Å; V464-F477 HydrophobicContact CG1-CZ 3.84Å; V464-F477 HydrophobicContact CG2-CE2 3.91Å; V464-F477 HydrophobicContact CG2-CZ 4.01Å; E473-F477 WeakPolarHBondContact O-CB 3.39Å; E473-F477 PolarHBondContact O-N 3.25Å; R474-F477 PolarHBondContact O-N 3.31Å; F477-A480 PolarHBondContact O-N 3.24Å; F477-G481 PolarHBondContact O-N 3.36Å; F477-G482 VanDerWaalsContact CE1-C 3.49Å; F477-G482 VanDerWaalsContact CZ-C 3.43Å; F477-G482 VanDerWaalsContact CZ-CA 3.45Å; F477-G482 WeakPolarHBondContact CZ-O 3.43Å; F477-G482 PolarHBondContact O-N 3.05Å; F477-L483 HydrophobicContact CD1-CD2 3.93Å; F477-L483 HydrophobicContact CE1-CD2 3.95Å; F477-L486 HydrophobicContact CE1-CD2 4.07Å
478	H	96.4	Very high	95.7	Very high	48 Å²	48	47.4 Å²	47.4	22%	0.222	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-51	175.8	176.9	-163.8	0	0	0	111.6	R474 D475 K476 A480 G481 L483 T517	R474-H478 VanDerWaalsContact O-CB 3.31Å; R474-H478 WeakPolarHBondContact O-CB 3.46Å; R474-H478 PolarHBondContact O-N 3.16Å; D475-H478 PolarHBondContact O-N 3.26Å; K476-H478 VanDerWaalsContact C-N 3.35Å; H478-A480 PolarHBondContact O-N 3.29Å; H478-G481 PolarHBondContact O-N 2.92Å; H478-L483 HydrophobicContact CB-CD1 3.93Å; H478-L483 HydrophobicContact CB-CG 4.3Å; H478-L483 VanDerWaalsContact CD2-CD1 3.48Å; H478-L483 WeakPolarHBondContact CD2-CD1 3.48Å; H478-T517 PolarHBondContact CE1-OG1 3.42Å; H478-T517 VanDerWaalsContact CE1-OG1 3.31Å; H478-T517 PolarHBondContact NE2-OG1 2.97Å
479	K	95.4	Very high	95.8	Very high	157 Å²	157	48.1 Å²	48.1	68%	0.683	25%	0.254	S	S	*	.	H	α-helix	trans	-62.4	-28.8	178.4	-75.1	171.4	177	165.3	0	113.2	D475 K476 G481	D475-K479 WeakPolarHBondContact O-CB 3.43Å; D475-K479 WeakPolarHBondContact O-CG 3.42Å; D475-K479 PolarHBondContact O-N 3.23Å; D475-K479 VanDerWaalsContact OD1-CE 3.27Å; D475-K479 WeakPolarHBondContact OD1-CE 3.05Å; D475-K479 IonicContact OD1-NZ 3.88Å; D475-K479 WeakPolarHBondContact OD2-CE 3.3Å; D475-K479 IonicContact OD2-NZ 2.71Å; D475-K479 PolarHBondContact OD2-NZ 3.28Å; K476-K479 PolarHBondContact O-N 3.28Å; K479-G481 PolarHBondContact O-N 2.85Å
480	A	95.4	Very high	96	Very high	42 Å²	42	45.4 Å²	45.4	35%	0.347	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5.5	173.5	0	0	0	0	0	113.6	Q443 V446 K476 F477 H478	Q443-A480 HydrophobicContact CB-CB 4.28Å; Q443-A480 HydrophobicContact CG-CB 4.04Å; V446-A480 HydrophobicContact CG2-CB 3.87Å; K476-A480 WeakPolarHBondContact O-CB 3.29Å; K476-A480 PolarHBondContact O-N 3.49Å; F477-A480 PolarHBondContact O-N 3.24Å; H478-A480 PolarHBondContact O-N 3.29Å
481	G	95.7	Very high	96.1	Very high	39 Å²	39	47.2 Å²	47.2	40%	0.402	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	19.3	179.5	0	0	0	0	0	114.3	F477 H478 K479 L483 P485	F477-G481 PolarHBondContact O-N 3.36Å; H478-G481 PolarHBondContact O-N 2.92Å; K479-G481 PolarHBondContact O-N 2.85Å; G481-L483 PolarHBondContact O-N 3.22Å; G481-P485 WeakPolarHBondContact O-CD 3.22Å
482	G	96.6	Very high	96.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-21.8	-175.8	0	0	0	0	0	115.6	F477 E484 P485 L486	F477-G482 VanDerWaalsContact CE1-C 3.49Å; F477-G482 VanDerWaalsContact CZ-C 3.43Å; F477-G482 VanDerWaalsContact CZ-CA 3.45Å; F477-G482 WeakPolarHBondContact CZ-O 3.43Å; F477-G482 PolarHBondContact O-N 3.05Å; G482-E484 PolarHBondContact O-N 3.44Å; G482-P485 WeakPolarHBondContact O-CD 3.48Å; G482-L486 WeakPolarHBondContact O-CB 3.18Å; G482-L486 PolarHBondContact O-N 3.05Å
483	L	97.3	Very high	96.1	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-67.6	-34.5	-176.3	-62.8	-179.1	0	0	0	113.2	F477 H478 G481 L486 V487 C508 C514 T517 M518 L521	F477-L483 HydrophobicContact CD1-CD2 3.93Å; F477-L483 HydrophobicContact CE1-CD2 3.95Å; H478-L483 HydrophobicContact CB-CD1 3.93Å; H478-L483 HydrophobicContact CB-CG 4.3Å; H478-L483 VanDerWaalsContact CD2-CD1 3.48Å; H478-L483 WeakPolarHBondContact CD2-CD1 3.48Å; G481-L483 PolarHBondContact O-N 3.22Å; L483-L486 PolarHBondContact O-N 2.9Å; L483-V487 VanDerWaalsContact O-CG2 3.32Å; L483-V487 WeakPolarHBondContact O-CG2 3.46Å; L483-V487 PolarHBondContact O-N 3.48Å; L483-C508 HydrophobicContact CD2-CB 4.2Å; L483-C514 HydrophobicContact CD1-CB 4.1Å; L483-C514 HydrophobicContact CD2-CB 4.45Å; L483-T517 HydrophobicContact CD1-CG2 3.96Å; L483-M518 HydrophobicContact CB-CG 4.29Å; L483-M518 HydrophobicContact CD1-CG 4.32Å; L483-M518 HydrophobicContact CD2-CG 4.14Å; L483-M518 HydrophobicContact CD2-SD 4.13Å; L483-M518 HydrophobicContact CG-CG 4.49Å; L483-L521 HydrophobicContact CB-CD1 4.36Å
484	E	96.9	Very high	96.1	Very high	116 Å²	116	47.7 Å²	47.7	54%	0.542	25%	0.251	S	S	.	.	H	α-helix	trans	-68.5	-52.4	-179.4	173.6	-179.6	-175.5	0	0	112.3	G482 L486 V487 N488 L521	G482-E484 PolarHBondContact O-N 3.44Å; E484-L486 PolarHBondContact O-N 3.24Å; E484-V487 PolarHBondContact O-N 3Å; E484-N488 VanDerWaalsContact O-CG 3.28Å; E484-N488 PolarHBondContact O-N 3.4Å; E484-N488 PolarHBondContact O-ND2 3.34Å; E484-L521 HydrophobicContact CB-CD1 4.08Å; E484-L521 HydrophobicContact CB-CD2 4.29Å; E484-L521 HydrophobicContact CG-CD2 4.3Å
485	P	97.8	Very high	96	Very high	10 Å²	10	53.4 Å²	53.4	7%	0.065	28%	0.277	C	S	.	.	H	α-helix	trans	-53.6	-42.1	170.2	-26.9	34.6	0	0	0	112.6	L449 K450 G481 G482 N488 L489	L449-P485 HydrophobicContact CB-CB 3.62Å; L449-P485 HydrophobicContact CD1-CB 4.36Å; K450-P485 HydrophobicContact CG-CB 4.2Å; K450-P485 HydrophobicContact CG-CG 3.96Å; G481-P485 WeakPolarHBondContact O-CD 3.22Å; G482-P485 WeakPolarHBondContact O-CD 3.48Å; P485-N488 WeakPolarHBondContact O-CB 3.33Å; P485-N488 PolarHBondContact O-N 3.48Å; P485-L489 WeakPolarHBondContact O-CG 3.48Å; P485-L489 PolarHBondContact O-N 2.94Å
486	L	97.8	Very high	96	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-44.3	179.6	177.8	60.3	0	0	0	112.9	F477 G482 L483 E484 N488 L489 A504 V505	F477-L486 HydrophobicContact CE1-CD2 4.07Å; G482-L486 WeakPolarHBondContact O-CB 3.18Å; G482-L486 PolarHBondContact O-N 3.05Å; L483-L486 PolarHBondContact O-N 2.9Å; E484-L486 PolarHBondContact O-N 3.24Å; L486-N488 VanDerWaalsContact C-N 3.32Å; L486-L489 WeakPolarHBondContact O-CB 3.39Å; L486-L489 PolarHBondContact O-N 3.44Å; L486-A504 HydrophobicContact CD1-CB 3.65Å; L486-A504 HydrophobicContact CD2-CB 4.09Å; L486-V505 HydrophobicContact CD1-CG2 4.3Å; L486-V505 HydrophobicContact CD2-CG2 4.08Å; L486-V505 HydrophobicContact CG-CG2 3.86Å
487	V	97.4	Very high	96	Very high	1 Å²	1	52 Å²	52	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-36.8	175.7	171.8	0	0	0	0	110.9	L483 E484 L489 L490 M518 L521 A523 I526	L483-V487 VanDerWaalsContact O-CG2 3.32Å; L483-V487 WeakPolarHBondContact O-CG2 3.46Å; L483-V487 PolarHBondContact O-N 3.48Å; E484-V487 PolarHBondContact O-N 3Å; V487-L489 PolarHBondContact O-N 2.88Å; V487-L490 HydrophobicContact CG1-CD1 4.49Å; V487-L490 VanDerWaalsContact O-CB 3.28Å; V487-L490 WeakPolarHBondContact O-CB 3.41Å; V487-L490 WeakPolarHBondContact O-CG 3.29Å; V487-L490 PolarHBondContact O-N 3.48Å; V487-M518 HydrophobicContact CG2-CB 4.05Å; V487-M518 HydrophobicContact CG2-CG 3.83Å; V487-M518 HydrophobicContact CG2-SD 4.44Å; V487-L521 HydrophobicContact CB-CB 4.33Å; V487-L521 HydrophobicContact CG1-CB 4.03Å; V487-L521 HydrophobicContact CG2-CB 4.28Å; V487-L521 HydrophobicContact CG2-CD1 4.19Å; V487-A523 HydrophobicContact CG1-CB 4.01Å; V487-A523 HydrophobicContact CG2-CB 3.98Å; V487-I526 HydrophobicContact CG1-CD1 3.98Å
488	N	96.9	Very high	96	Very high	88 Å²	88	52.5 Å²	52.5	47%	0.471	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-33.2	176.2	-71.7	-26.4	0	0	0	112.5	E484 P485 L486 L490 H491	E484-N488 VanDerWaalsContact O-CG 3.28Å; E484-N488 PolarHBondContact O-N 3.4Å; E484-N488 PolarHBondContact O-ND2 3.34Å; P485-N488 WeakPolarHBondContact O-CB 3.33Å; P485-N488 PolarHBondContact O-N 3.48Å; L486-N488 VanDerWaalsContact C-N 3.32Å; N488-L490 PolarHBondContact O-N 2.92Å; N488-H491 WeakPolarHBondContact O-CB 3.34Å; N488-H491 PolarHBondContact O-N 3.46Å; N488-H491 VanDerWaalsContact O-N 3.1Å; N488-H491 PolarHBondContact O-ND1 3.46Å
489	L	97	Very high	96	Very high	14 Å²	14	54.2 Å²	54.2	7%	0.073	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-63.2	-21.1	176.2	-63	-175.2	0	0	0	114.2	L449 L457 A461 P485 L486 V487 H491 S492 V497 A501	L449-L489 HydrophobicContact CD2-CD1 3.72Å; L457-L489 HydrophobicContact CB-CD2 4.26Å; L457-L489 HydrophobicContact CD1-CD2 3.75Å; L457-L489 HydrophobicContact CD2-CD1 4.43Å; L457-L489 HydrophobicContact CD2-CD2 3.64Å; L457-L489 HydrophobicContact CG-CD2 4.06Å; A461-L489 HydrophobicContact CB-CD1 4.25Å; P485-L489 WeakPolarHBondContact O-CG 3.48Å; P485-L489 PolarHBondContact O-N 2.94Å; L486-L489 WeakPolarHBondContact O-CB 3.39Å; L486-L489 PolarHBondContact O-N 3.44Å; V487-L489 PolarHBondContact O-N 2.88Å; L489-H491 PolarHBondContact O-N 3.39Å; L489-S492 WeakPolarHBondContact O-CB 3.39Å; L489-S492 PolarHBondContact O-N 2.88Å; L489-V497 HydrophobicContact CD2-CG1 4.42Å; L489-A501 HydrophobicContact CB-CB 3.67Å
490	L	96.5	Very high	96.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-64.3	-18	174.5	-61.1	176.2	0	0	0	112.6	V487 N488 S492 L498 A501 V505 A523 I526 L527 I530 R536	V487-L490 HydrophobicContact CG1-CD1 4.49Å; V487-L490 VanDerWaalsContact O-CB 3.28Å; V487-L490 WeakPolarHBondContact O-CB 3.41Å; V487-L490 WeakPolarHBondContact O-CG 3.29Å; V487-L490 PolarHBondContact O-N 3.48Å; N488-L490 PolarHBondContact O-N 2.92Å; L490-S492 VanDerWaalsContact C-N 3.27Å; L490-S492 PolarHBondContact O-N 3.24Å; L490-L498 HydrophobicContact CD2-CD1 4.35Å; L490-L498 WeakPolarHBondContact O-CD1 3.18Å; L490-A501 HydrophobicContact CD2-CB 4.17Å; L490-V505 HydrophobicContact CD1-CG2 4.3Å; L490-V505 HydrophobicContact CD2-CG2 4.28Å; L490-V505 HydrophobicContact CG-CG2 4.47Å; L490-A523 HydrophobicContact CD1-CB 4.19Å; L490-I526 HydrophobicContact CB-CB 4.49Å; L490-I526 HydrophobicContact CB-CG2 3.61Å; L490-L527 HydrophobicContact CD1-CD2 4.38Å; L490-L527 HydrophobicContact CD1-CG 4.12Å; L490-L527 HydrophobicContact CD2-CD2 4.15Å; L490-I530 HydrophobicContact CB-CD1 4.26Å; L490-R536 PolarHBondContact O-NH2 3.14Å
491	H	95.4	Very high	96.2	Very high	106 Å²	106	45.3 Å²	45.3	49%	0.491	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-79.8	-6.2	172.7	-62.7	99.4	0	0	0	113.7	N488 L489 I526	N488-H491 WeakPolarHBondContact O-CB 3.34Å; N488-H491 PolarHBondContact O-N 3.46Å; N488-H491 VanDerWaalsContact O-N 3.1Å; N488-H491 PolarHBondContact O-ND1 3.46Å; L489-H491 PolarHBondContact O-N 3.39Å; H491-I526 WeakPolarHBondContact CE1-CD1 3.48Å
492	S	94.6	Very high	96.3	Very high	26 Å²	26	43.5 Å²	43.5	18%	0.182	21%	0.211	C	C	.	.			trans	-61.3	141.7	-178.8	-172.1	0	0	0	0	112	L489 L490 D494 R536	L489-S492 WeakPolarHBondContact O-CB 3.39Å; L489-S492 PolarHBondContact O-N 2.88Å; L490-S492 VanDerWaalsContact C-N 3.27Å; L490-S492 PolarHBondContact O-N 3.24Å; S492-D494 PolarHBondContact OG-N 3.06Å; S492-D494 VanDerWaalsContact OG-N 3.15Å; S492-R536 PolarHBondContact O-NH2 3.36Å
493	N	92.1	Very high	96.4	Very high	147 Å²	147	46.6 Å²	46.6	79%	0.786	22%	0.224	S	C	*	.			trans	-90.4	-11.8	171.2	-69.6	-43.9	0	0	0	112.3
494	D	94.8	Very high	96.4	Very high	61 Å²	61	46.4 Å²	46.4	33%	0.326	22%	0.224	S	C	.	.			trans	-76.1	125.9	174	-174.8	-76.4	0	0	0	110	S492 E496 V497 L498	S492-D494 PolarHBondContact OG-N 3.06Å; S492-D494 VanDerWaalsContact OG-N 3.15Å; D494-E496 PolarHBondContact O-N 3.04Å; D494-E496 PolarHBondContact OD1-N 3.28Å; D494-V497 HydrophobicContact CB-CB 4.05Å; D494-V497 HydrophobicContact CB-CG2 3.92Å; D494-V497 PolarHBondContact OD1-N 3.37Å; D494-L498 VanDerWaalsContact O-CB 3.26Å; D494-L498 WeakPolarHBondContact O-CB 3.27Å; D494-L498 PolarHBondContact O-N 2.96Å
495	K	93.4	Very high	96.4	Very high	154 Å²	154	40.9 Å²	40.9	67%	0.67	20%	0.198	S	C	*	.	H	α-helix	trans	-66.7	-37.8	-173.8	-71	-176.4	177.8	179.6	0	112.6	R499	K495-R499 VanDerWaalsContact O-CB 3.27Å; K495-R499 WeakPolarHBondContact O-CB 3.21Å; K495-R499 PolarHBondContact O-N 3.49Å
496	E	94.8	Very high	96.4	Very high	81 Å²	81	42.2 Å²	42.2	38%	0.379	21%	0.205	S	C	.	.	H	α-helix	trans	-76.4	-41.1	-178.9	-71.7	-54.4	126.1	0	0	111	M458 D494 L498 R499 H500	M458-E496 HydrophobicContact CG-CB 4.17Å; M458-E496 HydrophobicContact SD-CB 3.63Å; M458-E496 HydrophobicContact SD-CG 4.32Å; D494-E496 PolarHBondContact O-N 3.04Å; D494-E496 PolarHBondContact OD1-N 3.28Å; E496-L498 VanDerWaalsContact C-N 3.31Å; E496-L498 PolarHBondContact O-N 3.43Å; E496-R499 PolarHBondContact O-N 2.74Å; E496-R499 IonicContact OE1-NE 3.09Å; E496-R499 IonicContact OE2-CZ 3.44Å; E496-R499 IonicContact OE2-NE 3.82Å; E496-R499 PolarHBondContact OE2-NE 2.68Å; E496-R499 IonicContact OE2-NH2 2.77Å; E496-R499 PolarHBondContact OE2-NH2 3.09Å; E496-H500 PolarHBondContact O-N 2.96Å; E496-H500 PolarHBondContact O-ND1 3.49Å; E496-H500 IonicContact OE2-CE1 3.21Å; E496-H500 PolarHBondContact OE2-CE1 2.91Å
497	V	96.8	Very high	96.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-47.5	172.3	177.3	0	0	0	0	110.2	T454 L457 M458 L489 D494 R499 H500 A501	T454-V497 WeakPolarHBondContact O-CG2 3.41Å; L457-V497 HydrophobicContact CB-CG1 4.02Å; L457-V497 HydrophobicContact CB-CG2 4.27Å; M458-V497 HydrophobicContact CB-CG2 4.13Å; L489-V497 HydrophobicContact CD2-CG1 4.42Å; D494-V497 HydrophobicContact CB-CB 4.05Å; D494-V497 HydrophobicContact CB-CG2 3.92Å; D494-V497 PolarHBondContact OD1-N 3.37Å; V497-R499 VanDerWaalsContact C-N 3.34Å; V497-R499 PolarHBondContact O-N 3.23Å; V497-H500 PolarHBondContact O-N 2.92Å; V497-A501 VanDerWaalsContact O-CB 3.29Å; V497-A501 WeakPolarHBondContact O-CB 3.47Å; V497-A501 PolarHBondContact O-N 3.06Å
498	L	96.9	Very high	96.3	Very high	9 Å²	9	43.3 Å²	43.3	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-41	179.5	-177.4	60.7	0	0	0	112.2	L490 D494 E496 A501 C502 I530 R536	L490-L498 HydrophobicContact CD2-CD1 4.35Å; L490-L498 WeakPolarHBondContact O-CD1 3.18Å; D494-L498 VanDerWaalsContact O-CB 3.26Å; D494-L498 WeakPolarHBondContact O-CB 3.27Å; D494-L498 PolarHBondContact O-N 2.96Å; E496-L498 VanDerWaalsContact C-N 3.31Å; E496-L498 PolarHBondContact O-N 3.43Å; L498-A501 PolarHBondContact O-N 2.73Å; L498-C502 WeakPolarHBondContact O-CB 3.49Å; L498-C502 PolarHBondContact O-N 3.05Å; L498-C502 PolarHBondContact O-SG 2.79Å; L498-I530 HydrophobicContact CD1-CD1 3.87Å; L498-I530 HydrophobicContact CD2-CG2 4.35Å; L498-R536 HydrophobicContact CD2-CB 4.14Å
499	R	96.3	Very high	96.2	Very high	85 Å²	85	39.1 Å²	39.1	32%	0.321	19%	0.189	S	C	.	.	H	α-helix	trans	-58.8	-50.1	177.7	-173.5	177.6	78.2	88.2	-5.5	111.3	K495 E496 V497 C502 F503 F540	K495-R499 VanDerWaalsContact O-CB 3.27Å; K495-R499 WeakPolarHBondContact O-CB 3.21Å; K495-R499 PolarHBondContact O-N 3.49Å; E496-R499 PolarHBondContact O-N 2.74Å; E496-R499 IonicContact OE1-NE 3.09Å; E496-R499 IonicContact OE2-CZ 3.44Å; E496-R499 IonicContact OE2-NE 3.82Å; E496-R499 PolarHBondContact OE2-NE 2.68Å; E496-R499 IonicContact OE2-NH2 2.77Å; E496-R499 PolarHBondContact OE2-NH2 3.09Å; V497-R499 VanDerWaalsContact C-N 3.34Å; V497-R499 PolarHBondContact O-N 3.23Å; R499-C502 PolarHBondContact O-N 3.24Å; R499-F503 PolarHBondContact O-N 3.24Å; R499-F540 HydrophobicContact CG-CD2 3.51Å; R499-F540 HydrophobicContact CG-CE2 3.68Å; R499-F540 HydrophobicContact CG-CG 4.12Å; R499-F540 HydrophobicContact CG-CZ 4.42Å
500	H	97.5	Very high	95.9	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.056	20%	0.203	C	C	.	.	H	α-helix	trans	-71	-36.6	-179.3	-65.7	97.7	0	0	0	112.3	M458 A461 E496 V497 F503 A504	M458-H500 WeakPolarHBondContact CG-ND1 3.27Å; A461-H500 HydrophobicContact CB-CB 3.86Å; E496-H500 PolarHBondContact O-N 2.96Å; E496-H500 PolarHBondContact O-ND1 3.49Å; E496-H500 IonicContact OE2-CE1 3.21Å; E496-H500 PolarHBondContact OE2-CE1 2.91Å; V497-H500 PolarHBondContact O-N 2.92Å; H500-F503 PolarHBondContact O-N 3.17Å; H500-A504 WeakPolarHBondContact O-CB 3.45Å; H500-A504 PolarHBondContact O-N 2.95Å
501	A	97.9	Very high	95.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-46.7	172.7	0	0	0	0	0	111.6	L489 L490 V497 L498 F503 A504 V505	L489-A501 HydrophobicContact CB-CB 3.67Å; L490-A501 HydrophobicContact CD2-CB 4.17Å; V497-A501 VanDerWaalsContact O-CB 3.29Å; V497-A501 WeakPolarHBondContact O-CB 3.47Å; V497-A501 PolarHBondContact O-N 3.06Å; L498-A501 PolarHBondContact O-N 2.73Å; A501-F503 VanDerWaalsContact C-N 3.29Å; A501-F503 PolarHBondContact O-N 3.04Å; A501-A504 PolarHBondContact O-N 3.31Å; A501-V505 WeakPolarHBondContact O-CB 3.27Å; A501-V505 VanDerWaalsContact O-CG2 3.29Å; A501-V505 WeakPolarHBondContact O-CG2 3.43Å; A501-V505 PolarHBondContact O-N 2.91Å
502	C	97.8	Very high	95.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-39.8	175.2	-68.4	0	0	0	0	111.7	L498 R499 V505 N506 F540 A544	L498-C502 WeakPolarHBondContact O-CB 3.49Å; L498-C502 PolarHBondContact O-N 3.05Å; L498-C502 PolarHBondContact O-SG 2.79Å; R499-C502 PolarHBondContact O-N 3.24Å; C502-V505 PolarHBondContact O-N 3.44Å; C502-N506 WeakPolarHBondContact O-CB 3.43Å; C502-N506 PolarHBondContact O-N 2.71Å; C502-F540 HydrophobicContact CB-CB 3.76Å; C502-A544 HydrophobicContact CB-CB 4.4Å; C502-A544 WeakPolarHBondContact O-CB 3.47Å
503	F	97.6	Very high	95	Very high	65 Å²	65	41.3 Å²	41.3	29%	0.285	22%	0.22	S	C	.	.	H	α-helix	trans	-64.9	-46.5	177.3	-176.5	-138.5	0	0	0	112.2	A465 R499 H500 A501 V505 N506 V507 F540	A465-F503 HydrophobicContact CB-CD1 3.44Å; A465-F503 VanDerWaalsContact CB-CD1 3.44Å; A465-F503 HydrophobicContact CB-CE1 3.56Å; A465-F503 HydrophobicContact CB-CG 4.1Å; A465-F503 HydrophobicContact CB-CZ 4.29Å; R499-F503 PolarHBondContact O-N 3.24Å; H500-F503 PolarHBondContact O-N 3.17Å; A501-F503 VanDerWaalsContact C-N 3.29Å; A501-F503 PolarHBondContact O-N 3.04Å; F503-V505 PolarHBondContact O-N 3.34Å; F503-N506 WeakPolarHBondContact O-CB 3.28Å; F503-N506 PolarHBondContact O-N 3.46Å; F503-V507 HydrophobicContact CD2-CG2 4.26Å; F503-V507 HydrophobicContact CE2-CG2 3.91Å; F503-V507 HydrophobicContact CZ-CG2 4.28Å; F503-V507 WeakPolarHBondContact O-CG2 3.22Å; F503-V507 PolarHBondContact O-N 3.4Å; F503-F540 HydrophobicContact CB-CD1 3.82Å; F503-F540 HydrophobicContact CB-CE1 4.21Å; F503-F540 HydrophobicContact CD2-CD1 4.15Å; F503-F540 HydrophobicContact CD2-CE1 4.16Å; F503-F540 HydrophobicContact CG-CD1 4.18Å; F503-F540 HydrophobicContact CG-CE1 4.18Å
504	A	97.8	Very high	95.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-40.5	175.5	0	0	0	0	0	112.5	A461 V464 A465 L486 H500 A501 V507 C508	A461-A504 WeakPolarHBondContact O-CB 3.35Å; V464-A504 HydrophobicContact CB-CB 4.37Å; V464-A504 HydrophobicContact CG1-CB 4.16Å; A465-A504 HydrophobicContact CB-CB 4.12Å; L486-A504 HydrophobicContact CD1-CB 3.65Å; L486-A504 HydrophobicContact CD2-CB 4.09Å; H500-A504 WeakPolarHBondContact O-CB 3.45Å; H500-A504 PolarHBondContact O-N 2.95Å; A501-A504 PolarHBondContact O-N 3.31Å; A504-V507 PolarHBondContact O-N 3.47Å; A504-C508 WeakPolarHBondContact O-CB 3.42Å; A504-C508 PolarHBondContact O-N 3.29Å; A504-C508 PolarHBondContact O-SG 3.43Å
505	V	97.8	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-44.4	173.1	168.8	0	0	0	0	110.9	L486 L490 A501 C502 F503 V507 C508 A509 M518 A544 L548	L486-V505 HydrophobicContact CD1-CG2 4.3Å; L486-V505 HydrophobicContact CD2-CG2 4.08Å; L486-V505 HydrophobicContact CG-CG2 3.86Å; L490-V505 HydrophobicContact CD1-CG2 4.3Å; L490-V505 HydrophobicContact CD2-CG2 4.28Å; L490-V505 HydrophobicContact CG-CG2 4.47Å; A501-V505 WeakPolarHBondContact O-CB 3.27Å; A501-V505 VanDerWaalsContact O-CG2 3.29Å; A501-V505 WeakPolarHBondContact O-CG2 3.43Å; A501-V505 PolarHBondContact O-N 2.91Å; C502-V505 PolarHBondContact O-N 3.44Å; F503-V505 PolarHBondContact O-N 3.34Å; V505-V507 VanDerWaalsContact C-N 3.32Å; V505-V507 PolarHBondContact O-N 3.24Å; V505-C508 PolarHBondContact O-N 2.92Å; V505-A509 WeakPolarHBondContact O-CB 3.49Å; V505-A509 PolarHBondContact O-N 3.24Å; V505-M518 HydrophobicContact CB-SD 4.4Å; V505-M518 HydrophobicContact CG1-SD 3.97Å; V505-M518 HydrophobicContact CG2-SD 4.23Å; V505-A544 HydrophobicContact CB-CB 4.4Å; V505-A544 HydrophobicContact CG1-CB 4.07Å; V505-L548 HydrophobicContact CG1-CD1 4.03Å; V505-L548 HydrophobicContact CG1-CG 4.29Å
506	N	97.1	Very high	94.8	Very high	38 Å²	38	26.3 Å²	26.3	20%	0.203	15%	0.148	C	C	.	.	H	α-helix	trans	-57.5	-44	176.3	170.2	64.4	0	0	0	112.2	C502 F503 L543 A544 S547	C502-N506 WeakPolarHBondContact O-CB 3.43Å; C502-N506 PolarHBondContact O-N 2.71Å; F503-N506 WeakPolarHBondContact O-CB 3.28Å; F503-N506 PolarHBondContact O-N 3.46Å; N506-L543 PolarHBondContact OD1-O 2.87Å; N506-A544 HydrophobicContact CB-CB 4.25Å; N506-S547 PolarHBondContact O-OG 2.62Å; N506-S547 VanDerWaalsContact OD1-CB 3.26Å; N506-S547 WeakPolarHBondContact OD1-CB 3.38Å
507	V	96.4	Very high	94.6	Very high	24 Å²	24	23.4 Å²	23.4	15%	0.145	14%	0.136	C	C	.	.	H	α-helix	trans	-68.5	-49.4	178.6	174.2	0	0	0	0	111.2	A465 A468 R474 F503 A504 V505 A509 G510	A465-V507 HydrophobicContact CB-CG2 4.29Å; A468-V507 HydrophobicContact CB-CG1 3.87Å; A468-V507 WeakPolarHBondContact O-CG1 3.32Å; R474-V507 PolarHBondContact NE-O 3.21Å; F503-V507 HydrophobicContact CD2-CG2 4.26Å; F503-V507 HydrophobicContact CE2-CG2 3.91Å; F503-V507 HydrophobicContact CZ-CG2 4.28Å; F503-V507 WeakPolarHBondContact O-CG2 3.22Å; F503-V507 PolarHBondContact O-N 3.4Å; A504-V507 PolarHBondContact O-N 3.47Å; V505-V507 VanDerWaalsContact C-N 3.32Å; V505-V507 PolarHBondContact O-N 3.24Å; V507-A509 PolarHBondContact O-N 3.28Å; V507-G510 PolarHBondContact O-N 3.45Å
508	C	96.3	Very high	94.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.1	-33.3	179.4	-66.2	0	0	0	0	112	L483 A504 V505 G510 D511 C514 M518	L483-C508 HydrophobicContact CD2-CB 4.2Å; A504-C508 WeakPolarHBondContact O-CB 3.42Å; A504-C508 PolarHBondContact O-N 3.29Å; A504-C508 PolarHBondContact O-SG 3.43Å; V505-C508 PolarHBondContact O-N 2.92Å; C508-G510 PolarHBondContact O-N 3.03Å; C508-G510 VanDerWaalsContact O-N 3.16Å; C508-D511 PolarHBondContact O-N 3.29Å; C508-C514 WeakPolarHBondContact O-CB 3.27Å; C508-M518 HydrophobicContact CB-CE 3.85Å; C508-M518 HydrophobicContact CB-SD 4.3Å
509	A	94.9	Very high	94.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-7.9	177.4	0	0	0	0	0	112.9	V505 V507 D511 A515 M518 S547 L548 S551	V505-A509 WeakPolarHBondContact O-CB 3.49Å; V505-A509 PolarHBondContact O-N 3.24Å; V507-A509 PolarHBondContact O-N 3.28Å; A509-D511 PolarHBondContact O-N 2.98Å; A509-A515 HydrophobicContact CB-CB 4.48Å; A509-M518 HydrophobicContact CB-CE 3.75Å; A509-S547 WeakPolarHBondContact CB-OG 3.44Å; A509-L548 HydrophobicContact CB-CD2 3.73Å; A509-L548 HydrophobicContact CB-CG 3.96Å; A509-S551 WeakPolarHBondContact O-CB 3.1Å; A509-S551 PolarHBondContact O-OG 3.21Å
510	G	90.6	Very high	93.8	Very high	36 Å²	36	26 Å²	26	37%	0.371	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.7	170.3	0	0	0	0	0	114.1	V507 C508	V507-G510 PolarHBondContact O-N 3.45Å; C508-G510 PolarHBondContact O-N 3.03Å; C508-G510 VanDerWaalsContact O-N 3.16Å
511	D	90.6	Very high	93.5	Very high	27 Å²	27	28.1 Å²	28.1	14%	0.144	16%	0.158	C	C	.	.	S	Bend	trans	-101.9	135.3	171.2	171.4	60.2	0	0	0	111.6	R474 C508 A509 A513 C514 A515	R474-D511 HydrophobicContact CB-CB 4.24Å; C508-D511 PolarHBondContact O-N 3.29Å; A509-D511 PolarHBondContact O-N 2.98Å; D511-A513 PolarHBondContact O-N 3.3Å; D511-A513 WeakPolarHBondContact OD2-CB 3.42Å; D511-A513 PolarHBondContact OD2-N 3.36Å; D511-A513 VanDerWaalsContact OD2-N 3.09Å; D511-C514 HydrophobicContact CB-CB 4.17Å; D511-C514 PolarHBondContact O-N 3.19Å; D511-C514 PolarHBondContact OD2-N 3.49Å; D511-C514 PolarHBondContact OD2-SG 3.22Å; D511-A515 WeakPolarHBondContact O-CB 3.25Å; D511-A515 PolarHBondContact O-N 3.29Å
512	T	88.7	Confident	93.1	Very high	84 Å²	84	29.1 Å²	29.1	52%	0.515	17%	0.168	S	C	.	.	H	α-helix	trans	-63.4	-40.2	-178.1	-63.8	0	0	0	0	112.3	A515 V516 S551	T512-A515 PolarHBondContact O-N 3.11Å; T512-V516 HydrophobicContact CG2-CG2 4.33Å; T512-V516 VanDerWaalsContact O-CG2 3.24Å; T512-V516 WeakPolarHBondContact O-CG2 3.45Å; T512-V516 PolarHBondContact O-N 3.14Å; T512-S551 WeakPolarHBondContact CG2-O 3.49Å; T512-S551 PolarHBondContact OG1-O 3.41Å
513	A	89.6	Confident	92.9	Very high	44 Å²	44	29.1 Å²	29.1	36%	0.364	17%	0.168	S	C	.	.	H	α-helix	trans	-68.1	-40	-178.8	0	0	0	0	0	111.5	D511 T517	D511-A513 PolarHBondContact O-N 3.3Å; D511-A513 WeakPolarHBondContact OD2-CB 3.42Å; D511-A513 PolarHBondContact OD2-N 3.36Å; D511-A513 VanDerWaalsContact OD2-N 3.09Å; A513-T517 PolarHBondContact O-N 3.49Å; A513-T517 VanDerWaalsContact O-N 3.13Å; A513-T517 PolarHBondContact O-OG1 2.95Å
514	C	93.9	Very high	92.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.6	-46.1	172.7	-64.2	0	0	0	0	111.7	L483 C508 D511 V516 T517 M518	L483-C514 HydrophobicContact CD1-CB 4.1Å; L483-C514 HydrophobicContact CD2-CB 4.45Å; C508-C514 WeakPolarHBondContact O-CB 3.27Å; D511-C514 HydrophobicContact CB-CB 4.17Å; D511-C514 PolarHBondContact O-N 3.19Å; D511-C514 PolarHBondContact OD2-N 3.49Å; D511-C514 PolarHBondContact OD2-SG 3.22Å; C514-V516 PolarHBondContact O-N 3.49Å; C514-T517 PolarHBondContact O-N 3.3Å; C514-M518 HydrophobicContact CB-CE 4.25Å; C514-M518 WeakPolarHBondContact O-CG 3.24Å; C514-M518 PolarHBondContact O-N 2.88Å
515	A	92.4	Very high	92.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-44.9	178.3	0	0	0	0	0	112.3	A509 D511 T512 T517 M518 C519 L548 N552	A509-A515 HydrophobicContact CB-CB 4.48Å; D511-A515 WeakPolarHBondContact O-CB 3.25Å; D511-A515 PolarHBondContact O-N 3.29Å; T512-A515 PolarHBondContact O-N 3.11Å; A515-T517 VanDerWaalsContact C-N 3.33Å; A515-T517 PolarHBondContact O-N 3.33Å; A515-M518 PolarHBondContact O-N 3.48Å; A515-C519 WeakPolarHBondContact O-CB 3.38Å; A515-C519 PolarHBondContact O-N 3.1Å; A515-C519 PolarHBondContact O-SG 3.08Å; A515-L548 HydrophobicContact CB-CD2 4.25Å; A515-N552 HydrophobicContact CB-CB 4.45Å
516	V	88.9	Confident	92	Very high	47 Å²	47	28.3 Å²	28.3	29%	0.285	17%	0.165	S	C	.	.	H	α-helix	trans	-58.3	-46.1	175.2	170.6	0	0	0	0	111.1	T512 C514 C519 R520 N552 T587	T512-V516 HydrophobicContact CG2-CG2 4.33Å; T512-V516 VanDerWaalsContact O-CG2 3.24Å; T512-V516 WeakPolarHBondContact O-CG2 3.45Å; T512-V516 PolarHBondContact O-N 3.14Å; C514-V516 PolarHBondContact O-N 3.49Å; V516-C519 PolarHBondContact O-N 3.39Å; V516-R520 PolarHBondContact O-N 2.9Å; V516-N552 WeakPolarHBondContact CG2-ND2 3.37Å; V516-T587 HydrophobicContact CG1-CG2 4.12Å
517	T	92	Very high	91.9	Very high	21 Å²	21	26.5 Å²	26.5	13%	0.129	16%	0.155	C	C	.	.	H	α-helix	trans	-67	-43.6	-178.4	-56.5	0	0	0	0	112	H478 L483 A513 C514 A515 R520 L521	H478-T517 PolarHBondContact CE1-OG1 3.42Å; H478-T517 VanDerWaalsContact CE1-OG1 3.31Å; H478-T517 PolarHBondContact NE2-OG1 2.97Å; L483-T517 HydrophobicContact CD1-CG2 3.96Å; A513-T517 PolarHBondContact O-N 3.49Å; A513-T517 VanDerWaalsContact O-N 3.13Å; A513-T517 PolarHBondContact O-OG1 2.95Å; C514-T517 PolarHBondContact O-N 3.3Å; A515-T517 VanDerWaalsContact C-N 3.33Å; A515-T517 PolarHBondContact O-N 3.33Å; T517-R520 WeakPolarHBondContact O-CB 3.38Å; T517-R520 PolarHBondContact O-N 3.17Å; T517-L521 HydrophobicContact CG2-CD1 4.29Å; T517-L521 WeakPolarHBondContact O-CG 3.44Å; T517-L521 PolarHBondContact O-N 3.41Å
518	M	94.1	Very high	91.6	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-39.3	175.7	-71.4	-172.5	-74.4	0	0	112.3	L483 V487 V505 C508 A509 C514 A515 R520 L521 G522 A523 L548	L483-M518 HydrophobicContact CB-CG 4.29Å; L483-M518 HydrophobicContact CD1-CG 4.32Å; L483-M518 HydrophobicContact CD2-CG 4.14Å; L483-M518 HydrophobicContact CD2-SD 4.13Å; L483-M518 HydrophobicContact CG-CG 4.49Å; V487-M518 HydrophobicContact CG2-CB 4.05Å; V487-M518 HydrophobicContact CG2-CG 3.83Å; V487-M518 HydrophobicContact CG2-SD 4.44Å; V505-M518 HydrophobicContact CB-SD 4.4Å; V505-M518 HydrophobicContact CG1-SD 3.97Å; V505-M518 HydrophobicContact CG2-SD 4.23Å; C508-M518 HydrophobicContact CB-CE 3.85Å; C508-M518 HydrophobicContact CB-SD 4.3Å; A509-M518 HydrophobicContact CB-CE 3.75Å; C514-M518 HydrophobicContact CB-CE 4.25Å; C514-M518 WeakPolarHBondContact O-CG 3.24Å; C514-M518 PolarHBondContact O-N 2.88Å; A515-M518 PolarHBondContact O-N 3.48Å; M518-R520 VanDerWaalsContact C-N 3.34Å; M518-R520 PolarHBondContact O-N 3.47Å; M518-L521 PolarHBondContact O-N 2.8Å; M518-G522 PolarHBondContact O-N 2.88Å; M518-A523 HydrophobicContact CB-CB 4.12Å; M518-A523 WeakPolarHBondContact O-CB 3.47Å; M518-A523 PolarHBondContact O-N 2.8Å; M518-A523 VanDerWaalsContact O-N 3.09Å; M518-L548 HydrophobicContact CB-CD2 3.88Å; M518-L548 HydrophobicContact CE-CD2 3.79Å; M518-L548 HydrophobicContact SD-CD2 4.46Å
519	C	90.4	Very high	91.4	Very high	3 Å²	3	34 Å²	34	2%	0.02	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-41.6	172.8	-71.2	0	0	0	0	111.8	A515 V516 L521 G522 L524	A515-C519 WeakPolarHBondContact O-CB 3.38Å; A515-C519 PolarHBondContact O-N 3.1Å; A515-C519 PolarHBondContact O-SG 3.08Å; V516-C519 PolarHBondContact O-N 3.39Å; C519-L521 PolarHBondContact O-N 3.08Å; C519-G522 PolarHBondContact O-N 3.26Å; C519-L524 HydrophobicContact CB-CD1 4.43Å; C519-L524 WeakPolarHBondContact SG-CD1 3.41Å
520	R	87.7	Confident	91.3	Very high	145 Å²	145	34 Å²	34	55%	0.547	19%	0.189	S	C	.	.	H	α-helix	trans	-62.7	-32.6	175.6	-173.6	-175.4	64.5	142.6	0.3	112.5	V516 T517 M518 G522	V516-R520 PolarHBondContact O-N 2.9Å; T517-R520 WeakPolarHBondContact O-CB 3.38Å; T517-R520 PolarHBondContact O-N 3.17Å; M518-R520 VanDerWaalsContact C-N 3.34Å; M518-R520 PolarHBondContact O-N 3.47Å; R520-G522 PolarHBondContact O-N 3.22Å
521	L	91.3	Very high	91.5	Very high	57 Å²	57	33.9 Å²	33.9	30%	0.298	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	1	175.2	-67.1	166.4	0	0	0	113.6	L483 E484 V487 T517 M518 C519	L483-L521 HydrophobicContact CB-CD1 4.36Å; E484-L521 HydrophobicContact CB-CD1 4.08Å; E484-L521 HydrophobicContact CB-CD2 4.29Å; E484-L521 HydrophobicContact CG-CD2 4.3Å; V487-L521 HydrophobicContact CB-CB 4.33Å; V487-L521 HydrophobicContact CG1-CB 4.03Å; V487-L521 HydrophobicContact CG2-CB 4.28Å; V487-L521 HydrophobicContact CG2-CD1 4.19Å; T517-L521 HydrophobicContact CG2-CD1 4.29Å; T517-L521 WeakPolarHBondContact O-CG 3.44Å; T517-L521 PolarHBondContact O-N 3.41Å; M518-L521 PolarHBondContact O-N 2.8Å; C519-L521 PolarHBondContact O-N 3.08Å
522	G	90.4	Very high	91.6	Very high	21 Å²	21	39.9 Å²	39.9	22%	0.216	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	13.9	177.1	0	0	0	0	0	115	M518 C519 R520 L524 E525 I526	M518-G522 PolarHBondContact O-N 2.88Å; C519-G522 PolarHBondContact O-N 3.26Å; R520-G522 PolarHBondContact O-N 3.22Å; G522-L524 VanDerWaalsContact C-N 3.26Å; G522-L524 PolarHBondContact O-N 3.27Å; G522-E525 WeakPolarHBondContact CA-OE2 3.24Å; G522-E525 PolarHBondContact O-N 3.09Å; G522-I526 WeakPolarHBondContact O-CD1 3.37Å; G522-I526 VanDerWaalsContact O-CG1 3.26Å; G522-I526 WeakPolarHBondContact O-CG1 3.42Å; G522-I526 PolarHBondContact O-N 3.45Å; G522-I526 VanDerWaalsContact O-N 3.17Å
523	A	93.6	Very high	91.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-35.2	-174.7	0	0	0	0	0	113.3	V487 L490 M518 L527 L548	V487-A523 HydrophobicContact CG1-CB 4.01Å; V487-A523 HydrophobicContact CG2-CB 3.98Å; L490-A523 HydrophobicContact CD1-CB 4.19Å; M518-A523 HydrophobicContact CB-CB 4.12Å; M518-A523 WeakPolarHBondContact O-CB 3.47Å; M518-A523 PolarHBondContact O-N 2.8Å; M518-A523 VanDerWaalsContact O-N 3.09Å; A523-L527 WeakPolarHBondContact O-CB 3.39Å; A523-L527 WeakPolarHBondContact O-CD1 3.28Å; A523-L527 WeakPolarHBondContact O-CG 3.34Å; A523-L527 PolarHBondContact O-N 2.97Å; A523-L548 HydrophobicContact CB-CD1 4.04Å
524	L	90.7	Very high	91.6	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-70.1	-40.3	-179	-79.6	176.3	0	0	0	112.3	C519 G522 L527 Q528 T545 L548 L549 V555	C519-L524 HydrophobicContact CB-CD1 4.43Å; C519-L524 WeakPolarHBondContact SG-CD1 3.41Å; G522-L524 VanDerWaalsContact C-N 3.26Å; G522-L524 PolarHBondContact O-N 3.27Å; L524-L527 PolarHBondContact O-N 2.75Å; L524-Q528 WeakPolarHBondContact O-CB 3.43Å; L524-Q528 VanDerWaalsContact O-CG 3.22Å; L524-Q528 WeakPolarHBondContact O-CG 3.49Å; L524-Q528 PolarHBondContact O-N 2.86Å; L524-T545 HydrophobicContact CD2-CG2 4.25Å; L524-L548 HydrophobicContact CD2-CB 3.76Å; L524-L548 HydrophobicContact CD2-CD1 3.85Å; L524-L548 HydrophobicContact CD2-CG 4.48Å; L524-L548 HydrophobicContact CG-CB 4.37Å; L524-L548 HydrophobicContact CG-CD1 4.16Å; L524-L549 HydrophobicContact CD1-CD2 4.01Å; L524-L549 HydrophobicContact CD2-CD2 4.13Å; L524-L549 HydrophobicContact CD2-CG 4.19Å; L524-V555 HydrophobicContact CD1-CG1 3.29Å
525	E	89.4	Confident	91.3	Very high	32 Å²	32	46.8 Å²	46.8	15%	0.15	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-46.2	178.3	-65.2	67.7	-151	0	0	109.4	G522 L527 Q528 E529 R559	G522-E525 WeakPolarHBondContact CA-OE2 3.24Å; G522-E525 PolarHBondContact O-N 3.09Å; E525-L527 PolarHBondContact O-N 3.3Å; E525-Q528 WeakPolarHBondContact O-CB 3.35Å; E525-Q528 PolarHBondContact O-N 2.89Å; E525-E529 WeakPolarHBondContact O-CG 3.41Å; E525-E529 PolarHBondContact O-N 2.95Å; E525-R559 IonicContact OE1-CZ 2.63Å; E525-R559 IonicContact OE1-NH2 3.1Å; E525-R559 PolarHBondContact OE1-NH2 3.34Å
526	I	93.6	Very high	91.2	Very high	14 Å²	14	49.7 Å²	49.7	7%	0.072	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-45.7	176.5	-57.8	158.7	0	0	0	110.7	V487 L490 H491 G522 Q528 E529 I530	V487-I526 HydrophobicContact CG1-CD1 3.98Å; L490-I526 HydrophobicContact CB-CB 4.49Å; L490-I526 HydrophobicContact CB-CG2 3.61Å; H491-I526 WeakPolarHBondContact CE1-CD1 3.48Å; G522-I526 WeakPolarHBondContact O-CD1 3.37Å; G522-I526 VanDerWaalsContact O-CG1 3.26Å; G522-I526 WeakPolarHBondContact O-CG1 3.42Å; G522-I526 PolarHBondContact O-N 3.45Å; G522-I526 VanDerWaalsContact O-N 3.17Å; I526-Q528 VanDerWaalsContact C-N 3.35Å; I526-Q528 PolarHBondContact O-N 2.8Å; I526-E529 PolarHBondContact O-N 3.25Å; I526-I530 HydrophobicContact CG2-CD1 3.84Å; I526-I530 WeakPolarHBondContact O-CD1 3.45Å; I526-I530 VanDerWaalsContact O-CG1 3.25Å; I526-I530 WeakPolarHBondContact O-CG1 3.41Å; I526-I530 PolarHBondContact O-N 3.14Å
527	L	93.9	Very high	91.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-34	178.3	-74.3	168.3	0	0	0	113	L490 A523 L524 E525 I530 N531 A544 T545 L548	L490-L527 HydrophobicContact CD1-CD2 4.38Å; L490-L527 HydrophobicContact CD1-CG 4.12Å; L490-L527 HydrophobicContact CD2-CD2 4.15Å; A523-L527 WeakPolarHBondContact O-CB 3.39Å; A523-L527 WeakPolarHBondContact O-CD1 3.28Å; A523-L527 WeakPolarHBondContact O-CG 3.34Å; A523-L527 PolarHBondContact O-N 2.97Å; L524-L527 PolarHBondContact O-N 2.75Å; E525-L527 PolarHBondContact O-N 3.3Å; L527-I530 HydrophobicContact CD2-CD1 4.13Å; L527-I530 PolarHBondContact O-N 2.83Å; L527-N531 VanDerWaalsContact O-CB 3.3Å; L527-N531 WeakPolarHBondContact O-CB 3.43Å; L527-N531 PolarHBondContact O-N 2.87Å; L527-N531 PolarHBondContact O-ND2 3.28Å; L527-N531 VanDerWaalsContact O-ND2 3.1Å; L527-A544 HydrophobicContact CD1-CB 3.86Å; L527-A544 HydrophobicContact CD2-CB 4.14Å; L527-T545 WeakPolarHBondContact CB-OG1 3.34Å; L527-L548 HydrophobicContact CD1-CD1 3.58Å
528	Q	90.6	Very high	91.4	Very high	57 Å²	57	55.2 Å²	55.2	27%	0.266	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-45.2	172.8	-77.4	173.1	7.3	0	0	111.1	L524 E525 I526 N531 Q532	L524-Q528 WeakPolarHBondContact O-CB 3.43Å; L524-Q528 VanDerWaalsContact O-CG 3.22Å; L524-Q528 WeakPolarHBondContact O-CG 3.49Å; L524-Q528 PolarHBondContact O-N 2.86Å; E525-Q528 WeakPolarHBondContact O-CB 3.35Å; E525-Q528 PolarHBondContact O-N 2.89Å; I526-Q528 VanDerWaalsContact C-N 3.35Å; I526-Q528 PolarHBondContact O-N 2.8Å; Q528-N531 PolarHBondContact O-N 2.82Å; Q528-Q532 VanDerWaalsContact O-CG 3.27Å; Q528-Q532 WeakPolarHBondContact O-CG 3.48Å; Q528-Q532 PolarHBondContact O-N 3.41Å
529	E	91.8	Very high	91.4	Very high	124 Å²	124	58.8 Å²	58.8	58%	0.579	31%	0.306	S	S	*	.	H	α-helix	trans	-61.4	-43	174.7	-69.1	178.7	-176.4	0	0	111.9	E525 I526 N531 Q532 S533	E525-E529 WeakPolarHBondContact O-CG 3.41Å; E525-E529 PolarHBondContact O-N 2.95Å; I526-E529 PolarHBondContact O-N 3.25Å; E529-N531 PolarHBondContact O-N 3.2Å; E529-Q532 PolarHBondContact O-N 3.45Å; E529-S533 PolarHBondContact O-N 3.02Å; E529-S533 VanDerWaalsContact O-N 3.14Å
530	I	94	Very high	91.6	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-47.4	174.9	-70.1	159.7	0	0	0	110.8	L490 L498 I526 L527 Q532 S533 R536 R537	L490-I530 HydrophobicContact CB-CD1 4.26Å; L498-I530 HydrophobicContact CD1-CD1 3.87Å; L498-I530 HydrophobicContact CD2-CG2 4.35Å; I526-I530 HydrophobicContact CG2-CD1 3.84Å; I526-I530 WeakPolarHBondContact O-CD1 3.45Å; I526-I530 VanDerWaalsContact O-CG1 3.25Å; I526-I530 WeakPolarHBondContact O-CG1 3.41Å; I526-I530 PolarHBondContact O-N 3.14Å; L527-I530 HydrophobicContact CD2-CD1 4.13Å; L527-I530 PolarHBondContact O-N 2.83Å; I530-Q532 VanDerWaalsContact C-N 3.29Å; I530-Q532 PolarHBondContact O-N 3.49Å; I530-S533 WeakPolarHBondContact O-CB 3.31Å; I530-S533 PolarHBondContact O-N 3Å; I530-S533 VanDerWaalsContact O-N 3.11Å; I530-R536 HydrophobicContact CG2-CB 4.05Å; I530-R536 WeakPolarHBondContact CG2-O 3.44Å; I530-R537 PolarHBondContact O-N 3.31Å
531	N	93.3	Very high	92	Very high	34 Å²	34	54.2 Å²	54.2	18%	0.182	29%	0.29	C	S	.	.	H	α-helix	trans	-71.6	-22.5	-177	-73.4	-32.2	0	0	0	113.3	L527 Q528 E529 R537 S541 T545	L527-N531 VanDerWaalsContact O-CB 3.3Å; L527-N531 WeakPolarHBondContact O-CB 3.43Å; L527-N531 PolarHBondContact O-N 2.87Å; L527-N531 PolarHBondContact O-ND2 3.28Å; L527-N531 VanDerWaalsContact O-ND2 3.1Å; Q528-N531 PolarHBondContact O-N 2.82Å; E529-N531 PolarHBondContact O-N 3.2Å; N531-R537 WeakPolarHBondContact O-CD 3.13Å; N531-S541 PolarHBondContact ND2-O 3.11Å; N531-S541 VanDerWaalsContact OD1-CB 3.31Å; N531-S541 WeakPolarHBondContact OD1-CB 3.44Å; N531-S541 PolarHBondContact OD1-OG 3.21Å; N531-T545 PolarHBondContact ND2-OG1 2.91Å
532	Q	92.6	Very high	92.1	Very high	154 Å²	154	55 Å²	55	72%	0.72	29%	0.292	S	S	*	.	H	α-helix	trans	-79.6	-22.6	170.6	-71.3	173.4	17.6	0	0	112.6	Q528 E529 I530	Q528-Q532 VanDerWaalsContact O-CG 3.27Å; Q528-Q532 WeakPolarHBondContact O-CG 3.48Å; Q528-Q532 PolarHBondContact O-N 3.41Å; E529-Q532 PolarHBondContact O-N 3.45Å; I530-Q532 VanDerWaalsContact C-N 3.29Å; I530-Q532 PolarHBondContact O-N 3.49Å
533	S	91.9	Very high	92.4	Very high	38 Å²	38	58.2 Å²	58.2	27%	0.266	30%	0.304	S	S	.	.			trans	-78	125.5	178.9	-178.5	0	0	0	0	112	E529 I530 N535 R536 R537	E529-S533 PolarHBondContact O-N 3.02Å; E529-S533 VanDerWaalsContact O-N 3.14Å; I530-S533 WeakPolarHBondContact O-CB 3.31Å; I530-S533 PolarHBondContact O-N 3Å; I530-S533 VanDerWaalsContact O-N 3.11Å; S533-N535 PolarHBondContact O-N 3.23Å; S533-N535 PolarHBondContact OG-N 3.5Å; S533-R536 PolarHBondContact OG-N 3.39Å; S533-R537 VanDerWaalsContact O-CB 3.24Å; S533-R537 WeakPolarHBondContact O-CB 3.13Å; S533-R537 PolarHBondContact O-N 3.3Å
534	A	87.1	Confident	92.5	Very high	100 Å²	100	58.2 Å²	58.2	83%	0.826	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.9	176.4	0	0	0	0	0	113.6
535	N	87.6	Confident	92.7	Very high	135 Å²	135	59.1 Å²	59.1	72%	0.722	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-21.7	-173.4	-67.5	-23.4	0	0	0	113.9	S533	S533-N535 PolarHBondContact O-N 3.23Å; S533-N535 PolarHBondContact OG-N 3.5Å
536	R	90.1	Very high	92.9	Very high	60 Å²	60	60.9 Å²	60.9	23%	0.226	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-22.4	-175.8	-58.2	-179.3	70.8	-149.9	-0.9	113.4	L490 S492 L498 I530 S533	L490-R536 PolarHBondContact O-NH2 3.14Å; S492-R536 PolarHBondContact O-NH2 3.36Å; L498-R536 HydrophobicContact CD2-CB 4.14Å; I530-R536 HydrophobicContact CG2-CB 4.05Å; I530-R536 WeakPolarHBondContact CG2-O 3.44Å; S533-R536 PolarHBondContact OG-N 3.39Å
537	R	92.6	Very high	92.9	Very high	149 Å²	149	61.1 Å²	61.1	56%	0.562	33%	0.325	S	S	*	.			trans	-58.6	138.1	179	178.5	-176.9	175.5	-175.9	-1.9	111.7	I530 N531 S533 E542	I530-R537 PolarHBondContact O-N 3.31Å; N531-R537 WeakPolarHBondContact O-CD 3.13Å; S533-R537 VanDerWaalsContact O-CB 3.24Å; S533-R537 WeakPolarHBondContact O-CB 3.13Å; S533-R537 PolarHBondContact O-N 3.3Å; R537-E542 IonicContact CZ-OE1 3.79Å; R537-E542 IonicContact NE-OE1 3.9Å; R537-E542 PolarHBondContact NE-OE1 2.62Å; R537-E542 IonicContact NH2-OE1 2.84Å; R537-E542 PolarHBondContact NH2-OE1 3.31Å
538	S	92.8	Very high	92.9	Very high	35 Å²	35	61.1 Å²	61.1	25%	0.245	33%	0.325	C	S	.	.			trans	-145	167.4	172.9	67.8	0	0	0	0	111.3	F540 S541 E542	S538-F540 PolarHBondContact O-N 3.07Å; S538-F540 PolarHBondContact OG-N 3.16Å; S538-S541 PolarHBondContact N-OG 3.13Å; S538-S541 PolarHBondContact O-N 3.46Å; S538-S541 PolarHBondContact O-OG 3.34Å; S538-S541 PolarHBondContact OG-N 3.09Å; S538-S541 PolarHBondContact OG-OG 3.06Å; S538-E542 PolarHBondContact O-N 3.17Å
539	S	94.1	Very high	93	Very high	75 Å²	75	59.1 Å²	59.1	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-59.5	-33.8	170.7	52.6	0	0	0	0	111.9	E542 L543	S539-E542 PolarHBondContact O-N 3.46Å; S539-L543 WeakPolarHBondContact O-CB 3.18Å; S539-L543 VanDerWaalsContact O-CG 3.27Å; S539-L543 WeakPolarHBondContact O-CG 3.36Å; S539-L543 PolarHBondContact O-N 2.96Å
540	F	94.5	Very high	92.9	Very high	52 Å²	52	56.9 Å²	56.9	23%	0.228	31%	0.309	C	S	.	.	H	α-helix	trans	-66.9	-38.6	178.2	-65	-83.8	0	0	0	112.4	R499 C502 F503 S538 L543 A544	R499-F540 HydrophobicContact CG-CD2 3.51Å; R499-F540 HydrophobicContact CG-CE2 3.68Å; R499-F540 HydrophobicContact CG-CG 4.12Å; R499-F540 HydrophobicContact CG-CZ 4.42Å; C502-F540 HydrophobicContact CB-CB 3.76Å; F503-F540 HydrophobicContact CB-CD1 3.82Å; F503-F540 HydrophobicContact CB-CE1 4.21Å; F503-F540 HydrophobicContact CD2-CD1 4.15Å; F503-F540 HydrophobicContact CD2-CE1 4.16Å; F503-F540 HydrophobicContact CG-CD1 4.18Å; F503-F540 HydrophobicContact CG-CE1 4.18Å; S538-F540 PolarHBondContact O-N 3.07Å; S538-F540 PolarHBondContact OG-N 3.16Å; F540-L543 PolarHBondContact O-N 2.97Å; F540-A544 WeakPolarHBondContact O-CB 3.24Å; F540-A544 PolarHBondContact O-N 3.29Å
541	S	95.3	Very high	92.8	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-69.8	-32.6	177.5	59.3	0	0	0	0	112.6	N531 S538 T545	N531-S541 PolarHBondContact ND2-O 3.11Å; N531-S541 VanDerWaalsContact OD1-CB 3.31Å; N531-S541 WeakPolarHBondContact OD1-CB 3.44Å; N531-S541 PolarHBondContact OD1-OG 3.21Å; S538-S541 PolarHBondContact N-OG 3.13Å; S538-S541 PolarHBondContact O-N 3.46Å; S538-S541 PolarHBondContact O-OG 3.34Å; S538-S541 PolarHBondContact OG-N 3.09Å; S538-S541 PolarHBondContact OG-OG 3.06Å; S541-T545 PolarHBondContact O-N 3.45Å; S541-T545 VanDerWaalsContact O-N 3.1Å; S541-T545 PolarHBondContact O-OG1 3.27Å
542	E	94.6	Very high	92.6	Very high	73 Å²	73	56.8 Å²	56.8	34%	0.341	31%	0.31	S	S	.	.	H	α-helix	trans	-68.6	-43.7	171.8	-68.8	177.1	-165.9	0	0	112.2	R537 S538 S539 T545 T546	R537-E542 IonicContact CZ-OE1 3.79Å; R537-E542 IonicContact NE-OE1 3.9Å; R537-E542 PolarHBondContact NE-OE1 2.62Å; R537-E542 IonicContact NH2-OE1 2.84Å; R537-E542 PolarHBondContact NH2-OE1 3.31Å; S538-E542 PolarHBondContact O-N 3.17Å; S539-E542 PolarHBondContact O-N 3.46Å; E542-T545 PolarHBondContact O-N 2.93Å; E542-T546 WeakPolarHBondContact O-CB 3.18Å; E542-T546 PolarHBondContact O-N 3.23Å; E542-T546 PolarHBondContact O-OG1 2.84Å
543	L	95.5	Very high	92.6	Very high	90 Å²	90	50.5 Å²	50.5	47%	0.471	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-44.6	176	-72.3	173	0	0	0	111.4	N506 S539 F540 T545 T546 S547	N506-L543 PolarHBondContact OD1-O 2.87Å; S539-L543 WeakPolarHBondContact O-CB 3.18Å; S539-L543 VanDerWaalsContact O-CG 3.27Å; S539-L543 WeakPolarHBondContact O-CG 3.36Å; S539-L543 PolarHBondContact O-N 2.96Å; F540-L543 PolarHBondContact O-N 2.97Å; L543-T545 VanDerWaalsContact C-N 3.33Å; L543-T545 PolarHBondContact O-N 3.37Å; L543-T546 PolarHBondContact O-N 3.16Å; L543-T546 VanDerWaalsContact O-N 3.16Å; L543-S547 WeakPolarHBondContact O-CB 3.43Å; L543-S547 PolarHBondContact O-N 2.86Å
544	A	96.4	Very high	92.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.5	-45.4	175	0	0	0	0	0	111.9	C502 V505 N506 L527 F540 T546 S547 L548	C502-A544 HydrophobicContact CB-CB 4.4Å; C502-A544 WeakPolarHBondContact O-CB 3.47Å; V505-A544 HydrophobicContact CB-CB 4.4Å; V505-A544 HydrophobicContact CG1-CB 4.07Å; N506-A544 HydrophobicContact CB-CB 4.25Å; L527-A544 HydrophobicContact CD1-CB 3.86Å; L527-A544 HydrophobicContact CD2-CB 4.14Å; F540-A544 WeakPolarHBondContact O-CB 3.24Å; F540-A544 PolarHBondContact O-N 3.29Å; A544-T546 VanDerWaalsContact C-N 3.34Å; A544-T546 PolarHBondContact O-N 2.91Å; A544-S547 PolarHBondContact O-N 3.41Å; A544-L548 WeakPolarHBondContact O-CB 3.3Å; A544-L548 WeakPolarHBondContact O-CG 3.45Å; A544-L548 PolarHBondContact O-N 3.09Å
545	T	94.6	Very high	92.7	Very high	19 Å²	19	44.8 Å²	44.8	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-45.7	175.9	-55.4	0	0	0	0	111	L524 L527 N531 S541 E542 L543 L548 L549	L524-T545 HydrophobicContact CD2-CG2 4.25Å; L527-T545 WeakPolarHBondContact CB-OG1 3.34Å; N531-T545 PolarHBondContact ND2-OG1 2.91Å; S541-T545 PolarHBondContact O-N 3.45Å; S541-T545 VanDerWaalsContact O-N 3.1Å; S541-T545 PolarHBondContact O-OG1 3.27Å; E542-T545 PolarHBondContact O-N 2.93Å; L543-T545 VanDerWaalsContact C-N 3.33Å; L543-T545 PolarHBondContact O-N 3.37Å; T545-L548 PolarHBondContact O-N 3.3Å; T545-L549 HydrophobicContact CG2-CD1 3.99Å; T545-L549 VanDerWaalsContact O-CG 3.24Å; T545-L549 WeakPolarHBondContact O-CG 3.42Å; T545-L549 PolarHBondContact O-N 3.4Å; T545-L549 VanDerWaalsContact O-N 3.09Å
546	T	93.4	Very high	92.9	Very high	70 Å²	70	39.1 Å²	39.1	43%	0.429	20%	0.204	S	C	.	.	H	α-helix	trans	-64.2	-43.4	-179.1	-58.4	0	0	0	0	111.6	E542 L543 A544 L549 N550	E542-T546 WeakPolarHBondContact O-CB 3.18Å; E542-T546 PolarHBondContact O-N 3.23Å; E542-T546 PolarHBondContact O-OG1 2.84Å; L543-T546 PolarHBondContact O-N 3.16Å; L543-T546 VanDerWaalsContact O-N 3.16Å; A544-T546 VanDerWaalsContact C-N 3.34Å; A544-T546 PolarHBondContact O-N 2.91Å; T546-L549 PolarHBondContact O-N 3.03Å; T546-N550 WeakPolarHBondContact CG2-ND2 3.41Å; T546-N550 WeakPolarHBondContact O-CB 3.19Å; T546-N550 PolarHBondContact O-N 3.46Å; T546-N550 PolarHBondContact O-ND2 3.31Å
547	S	94.5	Very high	93	Very high	18 Å²	18	36.3 Å²	36.3	13%	0.126	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-47	178.6	-169.3	0	0	0	0	111.5	N506 A509 L543 A544 L549 N550 S551	N506-S547 PolarHBondContact O-OG 2.62Å; N506-S547 VanDerWaalsContact OD1-CB 3.26Å; N506-S547 WeakPolarHBondContact OD1-CB 3.38Å; A509-S547 WeakPolarHBondContact CB-OG 3.44Å; L543-S547 WeakPolarHBondContact O-CB 3.43Å; L543-S547 PolarHBondContact O-N 2.86Å; A544-S547 PolarHBondContact O-N 3.41Å; S547-L549 VanDerWaalsContact C-N 3.31Å; S547-L549 PolarHBondContact O-N 3.42Å; S547-N550 PolarHBondContact O-N 3.04Å; S547-S551 WeakPolarHBondContact O-CB 3.36Å; S547-S551 PolarHBondContact O-N 3.19Å; S547-S551 PolarHBondContact O-OG 2.91Å
548	L	93.8	Very high	92.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.5	-42.4	175.5	-75.6	170.6	0	0	0	112.6	V505 A509 A515 M518 A523 L524 L527 A544 T545 N552	V505-L548 HydrophobicContact CG1-CD1 4.03Å; V505-L548 HydrophobicContact CG1-CG 4.29Å; A509-L548 HydrophobicContact CB-CD2 3.73Å; A509-L548 HydrophobicContact CB-CG 3.96Å; A515-L548 HydrophobicContact CB-CD2 4.25Å; M518-L548 HydrophobicContact CB-CD2 3.88Å; M518-L548 HydrophobicContact CE-CD2 3.79Å; M518-L548 HydrophobicContact SD-CD2 4.46Å; A523-L548 HydrophobicContact CB-CD1 4.04Å; L524-L548 HydrophobicContact CD2-CB 3.76Å; L524-L548 HydrophobicContact CD2-CD1 3.85Å; L524-L548 HydrophobicContact CD2-CG 4.48Å; L524-L548 HydrophobicContact CG-CB 4.37Å; L524-L548 HydrophobicContact CG-CD1 4.16Å; L527-L548 HydrophobicContact CD1-CD1 3.58Å; A544-L548 WeakPolarHBondContact O-CB 3.3Å; A544-L548 WeakPolarHBondContact O-CG 3.45Å; A544-L548 PolarHBondContact O-N 3.09Å; T545-L548 PolarHBondContact O-N 3.3Å; L548-N552 VanDerWaalsContact O-CB 3.32Å; L548-N552 WeakPolarHBondContact O-CB 3.38Å; L548-N552 PolarHBondContact O-N 3.21Å
549	L	91.9	Very high	92.6	Very high	16 Å²	16	29.4 Å²	29.4	8%	0.084	16%	0.163	C	C	.	.	H	α-helix	trans	-71.3	-44.1	178.7	-65.5	171.5	0	0	0	111.6	L524 T545 T546 S547 S551 N552 V555 K556 L560	L524-L549 HydrophobicContact CD1-CD2 4.01Å; L524-L549 HydrophobicContact CD2-CD2 4.13Å; L524-L549 HydrophobicContact CD2-CG 4.19Å; T545-L549 HydrophobicContact CG2-CD1 3.99Å; T545-L549 VanDerWaalsContact O-CG 3.24Å; T545-L549 WeakPolarHBondContact O-CG 3.42Å; T545-L549 PolarHBondContact O-N 3.4Å; T545-L549 VanDerWaalsContact O-N 3.09Å; T546-L549 PolarHBondContact O-N 3.03Å; S547-L549 VanDerWaalsContact C-N 3.31Å; S547-L549 PolarHBondContact O-N 3.42Å; L549-S551 VanDerWaalsContact C-N 3.31Å; L549-S551 PolarHBondContact O-N 2.88Å; L549-N552 CarbonylContact O-C 3.44Å; L549-N552 VanDerWaalsContact O-C 3.28Å; L549-N552 PolarHBondContact O-N 2.91Å; L549-V555 HydrophobicContact CD2-CG1 4.14Å; L549-K556 HydrophobicContact CB-CB 4.07Å; L549-K556 HydrophobicContact CB-CD 4.26Å; L549-K556 HydrophobicContact CB-CG 4.07Å; L549-K556 HydrophobicContact CD2-CB 4.37Å; L549-K556 WeakPolarHBondContact O-CB 3.34Å; L549-L560 HydrophobicContact CD1-CD1 4.23Å
550	N	91	Very high	92.3	Very high	77 Å²	77	30.8 Å²	30.8	41%	0.412	16%	0.163	S	C	.	.	H	α-helix	trans	-64.8	-35.8	-178.6	-72.8	-15.1	0	0	0	112.6	T546 S547 N552 L553 K556	T546-N550 WeakPolarHBondContact CG2-ND2 3.41Å; T546-N550 WeakPolarHBondContact O-CB 3.19Å; T546-N550 PolarHBondContact O-N 3.46Å; T546-N550 PolarHBondContact O-ND2 3.31Å; S547-N550 PolarHBondContact O-N 3.04Å; N550-N552 VanDerWaalsContact C-N 3.33Å; N550-L553 WeakPolarHBondContact O-CD2 3.32Å; N550-K556 PolarHBondContact OD1-NZ 3.42Å
551	S	90.7	Very high	92.2	Very high	24 Å²	24	28.5 Å²	28.5	17%	0.168	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-6.7	179	-58.8	0	0	0	0	113.8	A509 T512 S547 L549	A509-S551 WeakPolarHBondContact O-CB 3.1Å; A509-S551 PolarHBondContact O-OG 3.21Å; T512-S551 WeakPolarHBondContact CG2-O 3.49Å; T512-S551 PolarHBondContact OG1-O 3.41Å; S547-S551 WeakPolarHBondContact O-CB 3.36Å; S547-S551 PolarHBondContact O-N 3.19Å; S547-S551 PolarHBondContact O-OG 2.91Å; L549-S551 VanDerWaalsContact C-N 3.31Å; L549-S551 PolarHBondContact O-N 2.88Å
552	N	90.1	Very high	92.1	Very high	7 Å²	7	33.1 Å²	33.1	4%	0.037	17%	0.172	C	C	.	.			trans	-133.6	75.7	177.7	-166.7	-19.8	0	0	0	110.9	A515 V516 L548 L549 N550 P554 V555 K556	A515-N552 HydrophobicContact CB-CB 4.45Å; V516-N552 WeakPolarHBondContact CG2-ND2 3.37Å; L548-N552 VanDerWaalsContact O-CB 3.32Å; L548-N552 WeakPolarHBondContact O-CB 3.38Å; L548-N552 PolarHBondContact O-N 3.21Å; L549-N552 CarbonylContact O-C 3.44Å; L549-N552 VanDerWaalsContact O-C 3.28Å; L549-N552 PolarHBondContact O-N 2.91Å; N550-N552 VanDerWaalsContact C-N 3.33Å; N552-P554 WeakPolarHBondContact OD1-CD 3.22Å; N552-V555 HydrophobicContact CB-CB 4.27Å; N552-V555 HydrophobicContact CB-CG2 4.22Å; N552-V555 WeakPolarHBondContact ND2-CG2 3.46Å; N552-V555 WeakPolarHBondContact O-CB 3.33Å; N552-V555 PolarHBondContact O-N 3.41Å; N552-V555 VanDerWaalsContact O-N 3.07Å; N552-V555 VanDerWaalsContact OD1-CG2 3.3Å; N552-V555 WeakPolarHBondContact OD1-CG2 3.44Å; N552-V555 PolarHBondContact OD1-N 3.29Å; N552-K556 PolarHBondContact O-N 3.1Å
553	L	91.8	Very high	92.2	Very high	22 Å²	22	29.7 Å²	29.7	12%	0.115	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-38.6	-176.5	-58.5	-174	0	0	0	114.7	N550 V555 K556 Y557 L563 D567 I568 F573	N550-L553 WeakPolarHBondContact O-CD2 3.32Å; L553-V555 VanDerWaalsContact C-N 3.32Å; L553-V555 PolarHBondContact O-N 3.35Å; L553-K556 HydrophobicContact CD2-CD 4.18Å; L553-K556 PolarHBondContact O-N 2.88Å; L553-Y557 PolarHBondContact O-N 3.43Å; L553-L563 HydrophobicContact CB-CD2 4.43Å; L553-L563 HydrophobicContact CD2-CD2 4.35Å; L553-D567 HydrophobicContact CD1-CB 4.24Å; L553-D567 HydrophobicContact CD2-CB 3.88Å; L553-D567 WeakPolarHBondContact CD2-OD1 3.32Å; L553-I568 WeakPolarHBondContact CD1-O 3.46Å; L553-F573 HydrophobicContact CB-CD2 4.01Å; L553-F573 HydrophobicContact CB-CE2 3.93Å
554	P	91.6	Very high	92.1	Very high	19 Å²	19	27.5 Å²	27.5	12%	0.123	15%	0.147	C	C	.	.	H	α-helix	trans	-55.9	-45.4	172.9	-29.6	37.9	0	0	0	112.6	N552 N558 F573 F574 F585	N552-P554 WeakPolarHBondContact OD1-CD 3.22Å; P554-N558 WeakPolarHBondContact O-CB 3.28Å; P554-N558 PolarHBondContact O-N 2.8Å; P554-F573 HydrophobicContact CG-CD2 3.81Å; P554-F573 HydrophobicContact CG-CE2 4.23Å; P554-F573 HydrophobicContact CG-CG 4.39Å; P554-F574 HydrophobicContact CB-CD1 4.08Å; P554-F574 HydrophobicContact CB-CE1 3.89Å; P554-F574 HydrophobicContact CB-CE2 4.48Å; P554-F574 HydrophobicContact CB-CG 4.48Å; P554-F574 HydrophobicContact CB-CZ 4.14Å; P554-F574 HydrophobicContact CG-CD1 4.16Å; P554-F574 HydrophobicContact CG-CE1 4.17Å; P554-F585 HydrophobicContact CB-CZ 3.97Å
555	V	89.9	Confident	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66	-43.7	175.9	-179.5	0	0	0	0	111	L524 L549 N552 L553 Y557 N558 R559 F585	L524-V555 HydrophobicContact CD1-CG1 3.29Å; L549-V555 HydrophobicContact CD2-CG1 4.14Å; N552-V555 HydrophobicContact CB-CB 4.27Å; N552-V555 HydrophobicContact CB-CG2 4.22Å; N552-V555 WeakPolarHBondContact ND2-CG2 3.46Å; N552-V555 WeakPolarHBondContact O-CB 3.33Å; N552-V555 PolarHBondContact O-N 3.41Å; N552-V555 VanDerWaalsContact O-N 3.07Å; N552-V555 VanDerWaalsContact OD1-CG2 3.3Å; N552-V555 WeakPolarHBondContact OD1-CG2 3.44Å; N552-V555 PolarHBondContact OD1-N 3.29Å; L553-V555 VanDerWaalsContact C-N 3.32Å; L553-V555 PolarHBondContact O-N 3.35Å; V555-Y557 VanDerWaalsContact C-N 3.35Å; V555-Y557 PolarHBondContact O-N 3.47Å; V555-N558 PolarHBondContact O-N 3.19Å; V555-R559 HydrophobicContact CG1-CG 4.01Å; V555-R559 WeakPolarHBondContact O-CB 3.49Å; V555-R559 WeakPolarHBondContact O-CG 3.33Å; V555-R559 PolarHBondContact O-N 3.42Å; V555-F585 HydrophobicContact CB-CD2 4.28Å; V555-F585 HydrophobicContact CB-CE2 4.17Å; V555-F585 HydrophobicContact CB-CZ 4.35Å; V555-F585 HydrophobicContact CG1-CD2 4.41Å; V555-F585 HydrophobicContact CG2-CB 4.38Å; V555-F585 HydrophobicContact CG2-CD1 3.41Å; V555-F585 VanDerWaalsContact CG2-CD1 3.41Å; V555-F585 HydrophobicContact CG2-CD2 3.61Å; V555-F585 HydrophobicContact CG2-CE1 3.33Å; V555-F585 HydrophobicContact CG2-CE2 3.53Å; V555-F585 HydrophobicContact CG2-CG 3.53Å; V555-F585 HydrophobicContact CG2-CZ 3.37Å
556	K	91.4	Very high	91.7	Very high	15 Å²	15	34.9 Å²	34.9	7%	0.065	19%	0.189	C	C	.	.	H	α-helix	trans	-57.3	-47.5	177.8	-175.4	174.2	177.7	175	0	112.2	L549 N550 N552 L553 R559 L560 L563 D567	L549-K556 HydrophobicContact CB-CB 4.07Å; L549-K556 HydrophobicContact CB-CD 4.26Å; L549-K556 HydrophobicContact CB-CG 4.07Å; L549-K556 HydrophobicContact CD2-CB 4.37Å; L549-K556 WeakPolarHBondContact O-CB 3.34Å; N550-K556 PolarHBondContact OD1-NZ 3.42Å; N552-K556 PolarHBondContact O-N 3.1Å; L553-K556 HydrophobicContact CD2-CD 4.18Å; L553-K556 PolarHBondContact O-N 2.88Å; K556-R559 PolarHBondContact O-N 3.33Å; K556-L560 HydrophobicContact CG-CD1 4Å; K556-L560 WeakPolarHBondContact O-CB 3.25Å; K556-L560 PolarHBondContact O-N 2.91Å; K556-L563 HydrophobicContact CB-CD2 4.19Å; K556-L563 HydrophobicContact CD-CD2 4.03Å; K556-L563 HydrophobicContact CG-CD2 4.01Å; K556-D567 WeakPolarHBondContact CE-OD2 3.37Å; K556-D567 IonicContact NZ-OD1 3.02Å; K556-D567 PolarHBondContact NZ-OD1 2.94Å; K556-D567 IonicContact NZ-OD2 3.99Å; K556-D567 PolarHBondContact NZ-OD2 2.83Å
557	Y	92.5	Very high	91.7	Very high	1 Å²	1	32 Å²	32	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-69.2	-37.7	178.2	-170.6	-126.8	0	0	0	112.3	L553 V555 R559 G561 L563 F573 D575 L826 R828	L553-Y557 PolarHBondContact O-N 3.43Å; V555-Y557 VanDerWaalsContact C-N 3.35Å; V555-Y557 PolarHBondContact O-N 3.47Å; Y557-R559 VanDerWaalsContact C-N 3.32Å; Y557-R559 PolarHBondContact O-N 3.01Å; Y557-G561 WeakPolarHBondContact CE2-O 3.47Å; Y557-G561 VanDerWaalsContact O-CA 3.23Å; Y557-G561 WeakPolarHBondContact O-CA 3.46Å; Y557-G561 PolarHBondContact O-N 2.88Å; Y557-L563 HydrophobicContact CD2-CD1 4.46Å; Y557-L563 HydrophobicContact CD2-CG 3.92Å; Y557-L563 HydrophobicContact CG-CD1 4.36Å; Y557-L563 HydrophobicContact CG-CG 4.15Å; Y557-F573 HydrophobicContact CD1-CZ 4.06Å; Y557-F573 HydrophobicContact CG-CZ 4.37Å; Y557-D575 HydrophobicContact CD1-CB 4.47Å; Y557-D575 HydrophobicContact CE1-CB 4.44Å; Y557-L826 HydrophobicContact CD1-CD2 4.2Å; Y557-L826 HydrophobicContact CD2-CD2 4.16Å; Y557-L826 HydrophobicContact CD2-CG 4.35Å; Y557-L826 HydrophobicContact CE1-CD2 3.71Å; Y557-L826 HydrophobicContact CE1-CG 4.34Å; Y557-L826 HydrophobicContact CE2-CB 4.45Å; Y557-L826 HydrophobicContact CE2-CD2 3.73Å; Y557-L826 HydrophobicContact CE2-CG 3.6Å; Y557-L826 HydrophobicContact CG-CD2 4.4Å; Y557-L826 VanDerWaalsContact CZ-CD2 3.49Å; Y557-R828 HydrophobicContact CE2-CB 4.22Å
558	N	89.8	Confident	91.5	Very high	12 Å²	12	35.1 Å²	35.1	6%	0.064	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-34	175.5	170.6	-93.1	0	0	0	113.2	P554 V555 G577 Q578 A579 F585	P554-N558 WeakPolarHBondContact O-CB 3.28Å; P554-N558 PolarHBondContact O-N 2.8Å; V555-N558 PolarHBondContact O-N 3.19Å; N558-G577 WeakPolarHBondContact CA-O 3.2Å; N558-G577 PolarHBondContact ND2-O 2.64Å; N558-Q578 WeakPolarHBondContact O-CA 3.37Å; N558-Q578 VanDerWaalsContact O-CD 3.23Å; N558-Q578 PolarHBondContact O-NE2 3.29Å; N558-Q578 VanDerWaalsContact O-NE2 3.1Å; N558-Q578 PolarHBondContact O-OE1 2.88Å; N558-A579 PolarHBondContact ND2-N 3.4Å; N558-A579 PolarHBondContact O-N 3.01Å; N558-A579 VanDerWaalsContact O-N 3.07Å; N558-A579 WeakPolarHBondContact OD1-CB 3.36Å; N558-F585 HydrophobicContact CB-CD2 4.43Å; N558-F585 HydrophobicContact CB-CE2 4.14Å
559	R	86.8	Confident	91.4	Very high	28 Å²	28	35.4 Å²	35.4	11%	0.106	19%	0.188	C	C	.	.	H	α-helix	trans	-91.6	-45.4	-178	-68.7	-64.1	-168.9	-159.6	-6	113.6	E525 V555 K556 Y557 Q578 C580 E583	E525-R559 IonicContact OE1-CZ 2.63Å; E525-R559 IonicContact OE1-NH2 3.1Å; E525-R559 PolarHBondContact OE1-NH2 3.34Å; V555-R559 HydrophobicContact CG1-CG 4.01Å; V555-R559 WeakPolarHBondContact O-CB 3.49Å; V555-R559 WeakPolarHBondContact O-CG 3.33Å; V555-R559 PolarHBondContact O-N 3.42Å; K556-R559 PolarHBondContact O-N 3.33Å; Y557-R559 VanDerWaalsContact C-N 3.32Å; Y557-R559 PolarHBondContact O-N 3.01Å; R559-Q578 PolarHBondContact O-NE2 3.5Å; R559-C580 PolarHBondContact NH1-O 2.8Å; R559-E583 PolarHBondContact NH1-O 2.77Å; R559-E583 PolarHBondContact NH2-O 3.07Å
560	L	88.9	Confident	91.1	Very high	103 Å²	103	39.2 Å²	39.2	54%	0.539	21%	0.212	S	C	.	.	H	α-helix	trans	-95.2	-15	-174.3	-57.5	-175.4	0	0	0	113.3	L549 K556 R562	L549-L560 HydrophobicContact CD1-CD1 4.23Å; K556-L560 HydrophobicContact CG-CD1 4Å; K556-L560 WeakPolarHBondContact O-CB 3.25Å; K556-L560 PolarHBondContact O-N 2.91Å; L560-R562 PolarHBondContact O-N 3.41Å; L560-R562 VanDerWaalsContact O-N 3.08Å
561	G	91.3	Very high	90.9	Very high	5 Å²	5	37.5 Å²	37.5	5%	0.052	21%	0.205	C	C	.	.	S	Bend	trans	63.9	9.1	-171.6	0	0	0	0	0	113.3	Y557 R828	Y557-G561 WeakPolarHBondContact CE2-O 3.47Å; Y557-G561 VanDerWaalsContact O-CA 3.23Å; Y557-G561 WeakPolarHBondContact O-CA 3.46Å; Y557-G561 PolarHBondContact O-N 2.88Å; G561-R828 VanDerWaalsContact O-CB 3.29Å; G561-R828 WeakPolarHBondContact O-CB 3.49Å; G561-R828 PolarHBondContact O-N 3.38Å
562	R	93.8	Very high	90.6	Very high	97 Å²	97	40.6 Å²	40.6	37%	0.366	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	131.1	-174.8	-171.5	167	-166.7	-86.4	2.1	112.8	L560 L826 V827 E837	L560-R562 PolarHBondContact O-N 3.41Å; L560-R562 VanDerWaalsContact O-N 3.08Å; R562-L826 CarbonylContact C-O 3.5Å; R562-L826 VanDerWaalsContact CA-O 3.29Å; R562-L826 WeakPolarHBondContact CA-O 3.45Å; R562-V827 HydrophobicContact CG-CG2 4.16Å; R562-E837 IonicContact CZ-OE2 3.85Å; R562-E837 IonicContact NE-OE2 3.76Å; R562-E837 IonicContact NH2-OE2 2.69Å; R562-E837 PolarHBondContact NH2-OE2 2.98Å
563	L	95.6	Very high	90.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135	162.8	-60.7	179.8	0	0	0	109	L553 K556 Y557 D567 I569 F573 T825 L826	L553-L563 HydrophobicContact CB-CD2 4.43Å; L553-L563 HydrophobicContact CD2-CD2 4.35Å; K556-L563 HydrophobicContact CB-CD2 4.19Å; K556-L563 HydrophobicContact CD-CD2 4.03Å; K556-L563 HydrophobicContact CG-CD2 4.01Å; Y557-L563 HydrophobicContact CD2-CD1 4.46Å; Y557-L563 HydrophobicContact CD2-CG 3.92Å; Y557-L563 HydrophobicContact CG-CD1 4.36Å; Y557-L563 HydrophobicContact CG-CG 4.15Å; L563-D567 HydrophobicContact CB-CB 3.94Å; L563-D567 HydrophobicContact CD2-CB 4.17Å; L563-I569 HydrophobicContact CD1-CD1 3.97Å; L563-I569 HydrophobicContact CD1-CG1 4.06Å; L563-F573 HydrophobicContact CD1-CE2 3.85Å; L563-F573 HydrophobicContact CD1-CZ 3.97Å; L563-T825 WeakPolarHBondContact O-CA 3.27Å; L563-T825 WeakPolarHBondContact O-CB 3.09Å; L563-L826 HydrophobicContact CB-CB 4.2Å; L563-L826 HydrophobicContact CD1-CD2 4.26Å; L563-L826 PolarHBondContact N-O 3.39Å; L563-L826 PolarHBondContact O-N 3.39Å
564	T	94	Very high	90.7	Very high	45 Å²	45	40 Å²	40	28%	0.276	22%	0.217	S	C	.	.			trans	-78.3	171.5	176.3	71.2	0	0	0	0	110.9	N566 D567	T564-N566 PolarHBondContact O-N 2.96Å; T564-N566 PolarHBondContact OG1-N 3.39Å; T564-D567 WeakPolarHBondContact CA-OD2 3.3Å; T564-D567 WeakPolarHBondContact CB-OD2 3.31Å; T564-D567 PolarHBondContact N-OD2 3.49Å; T564-D567 PolarHBondContact O-N 3.05Å; T564-D567 VanDerWaalsContact O-N 3.17Å; T564-D567 PolarHBondContact OG1-OD2 2.73Å
565	A	91.4	Very high	90.8	Very high	30 Å²	30	39.3 Å²	39.3	25%	0.248	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.5	175	0	0	0	0	0	113.5	C824	A565-C824 WeakPolarHBondContact CA-O 3.33Å
566	N	91.4	Very high	90.7	Very high	143 Å²	143	40.9 Å²	40.9	77%	0.765	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-12.4	179.4	-62.8	-23.1	0	0	0	113.2	T564 I568	T564-N566 PolarHBondContact O-N 2.96Å; T564-N566 PolarHBondContact OG1-N 3.39Å; N566-I568 PolarHBondContact O-N 3.45Å
567	D	92.9	Very high	90.5	Very high	11 Å²	11	40.4 Å²	40.4	6%	0.059	22%	0.224	C	C	.	.			trans	-82.2	96.9	177.4	-65.8	-56.6	0	0	0	108.4	L553 K556 L563 T564 K814	L553-D567 HydrophobicContact CD1-CB 4.24Å; L553-D567 HydrophobicContact CD2-CB 3.88Å; L553-D567 WeakPolarHBondContact CD2-OD1 3.32Å; K556-D567 WeakPolarHBondContact CE-OD2 3.37Å; K556-D567 IonicContact NZ-OD1 3.02Å; K556-D567 PolarHBondContact NZ-OD1 2.94Å; K556-D567 IonicContact NZ-OD2 3.99Å; K556-D567 PolarHBondContact NZ-OD2 2.83Å; L563-D567 HydrophobicContact CB-CB 3.94Å; L563-D567 HydrophobicContact CD2-CB 4.17Å; T564-D567 WeakPolarHBondContact CA-OD2 3.3Å; T564-D567 WeakPolarHBondContact CB-OD2 3.31Å; T564-D567 PolarHBondContact N-OD2 3.49Å; T564-D567 PolarHBondContact O-N 3.05Å; T564-D567 VanDerWaalsContact O-N 3.17Å; T564-D567 PolarHBondContact OG1-OD2 2.73Å; D567-K814 WeakPolarHBondContact O-CE 3.37Å; D567-K814 PolarHBondContact O-NZ 2.96Å
568	I	91.6	Very high	90.1	Very high	83 Å²	83	44.9 Å²	44.9	43%	0.426	25%	0.245	S	C	.	.			trans	-88	114.3	-176.9	-53.1	-54.7	0	0	0	109.7	L553 N566 T570 D818	L553-I568 WeakPolarHBondContact CD1-O 3.46Å; N566-I568 PolarHBondContact O-N 3.45Å; I568-T570 PolarHBondContact O-N 2.78Å; I568-D818 HydrophobicContact CG2-CB 3.99Å
569	I	91.3	Very high	89.6	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.031	25%	0.25	C	C	.	.			trans	-69.5	124	176	-67.2	-175.2	0	0	0	109.7	L563 F573 F605 L811 K814 D818	L563-I569 HydrophobicContact CD1-CD1 3.97Å; L563-I569 HydrophobicContact CD1-CG1 4.06Å; I569-F573 HydrophobicContact CB-CG 4.47Å; I569-F573 HydrophobicContact CD1-CD1 4.01Å; I569-F573 HydrophobicContact CD1-CD2 4.23Å; I569-F573 HydrophobicContact CD1-CE1 3.93Å; I569-F573 HydrophobicContact CD1-CE2 4.12Å; I569-F573 HydrophobicContact CD1-CG 4.18Å; I569-F573 HydrophobicContact CD1-CZ 3.97Å; I569-F573 HydrophobicContact CG1-CD2 4.01Å; I569-F573 HydrophobicContact CG1-CE2 4.18Å; I569-F573 HydrophobicContact CG1-CG 4.21Å; I569-F573 HydrophobicContact CG2-CB 3.47Å; I569-F573 VanDerWaalsContact CG2-CB 3.47Å; I569-F573 HydrophobicContact CG2-CD1 4.04Å; I569-F573 HydrophobicContact CG2-CD2 4.16Å; I569-F573 HydrophobicContact CG2-CG 3.62Å; I569-F605 HydrophobicContact CG2-CD1 3.71Å; I569-F605 HydrophobicContact CG2-CE1 4.13Å; I569-F605 HydrophobicContact CG2-CG 4.25Å; I569-L811 HydrophobicContact CD1-CD1 4.17Å; I569-K814 HydrophobicContact CD1-CB 4.38Å; I569-K814 HydrophobicContact CD1-CG 3.56Å; I569-K814 HydrophobicContact CG1-CG 4.17Å; I569-D818 WeakPolarHBondContact CB-OD2 3.45Å; I569-D818 PolarHBondContact N-OD2 3.07Å
570	T	86.4	Confident	88.9	Confident	96 Å²	96	47.7 Å²	47.7	59%	0.589	27%	0.27	S	S	*	.			trans	-111.4	172.7	174.1	58.7	0	0	0	0	110.9	I568 F573 F605	I568-T570 PolarHBondContact O-N 2.78Å; T570-F573 WeakPolarHBondContact O-CB 3.47Å; T570-F573 PolarHBondContact O-N 2.87Å; T570-F605 WeakPolarHBondContact O-CD1 3.27Å
571	S	85.2	Confident	87.8	Confident	40 Å²	40	49.5 Å²	49.5	28%	0.28	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	146.3	177.9	-162.1	0	0	0	0	111.5	F573 N606 V607	S571-F573 VanDerWaalsContact C-N 3.31Å; S571-N606 PolarHBondContact OG-OD1 2.98Å; S571-N606 VanDerWaalsContact OG-OD1 3.06Å; S571-V607 PolarHBondContact OG-N 3.1Å; S571-V607 PolarHBondContact OG-O 3.11Å
572	N	85.5	Confident	86.4	Confident	89 Å²	89	52.1 Å²	52.1	48%	0.476	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	5.9	-171.9	-52.9	-46.1	0	0	0	115.7	L588 F605 N606	N572-L588 HydrophobicContact CB-CD2 4.43Å; N572-F605 PolarHBondContact N-O 3.45Å; N572-N606 PolarHBondContact OD1-OD1 2.79Å
573	F	91.6	Very high	85.4	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	140.4	166.2	179.6	-84.5	0	0	0	110.6	L553 P554 Y557 L563 I569 T570 S571 F605 L811	L553-F573 HydrophobicContact CB-CD2 4.01Å; L553-F573 HydrophobicContact CB-CE2 3.93Å; P554-F573 HydrophobicContact CG-CD2 3.81Å; P554-F573 HydrophobicContact CG-CE2 4.23Å; P554-F573 HydrophobicContact CG-CG 4.39Å; Y557-F573 HydrophobicContact CD1-CZ 4.06Å; Y557-F573 HydrophobicContact CG-CZ 4.37Å; L563-F573 HydrophobicContact CD1-CE2 3.85Å; L563-F573 HydrophobicContact CD1-CZ 3.97Å; I569-F573 HydrophobicContact CB-CG 4.47Å; I569-F573 HydrophobicContact CD1-CD1 4.01Å; I569-F573 HydrophobicContact CD1-CD2 4.23Å; I569-F573 HydrophobicContact CD1-CE1 3.93Å; I569-F573 HydrophobicContact CD1-CE2 4.12Å; I569-F573 HydrophobicContact CD1-CG 4.18Å; I569-F573 HydrophobicContact CD1-CZ 3.97Å; I569-F573 HydrophobicContact CG1-CD2 4.01Å; I569-F573 HydrophobicContact CG1-CE2 4.18Å; I569-F573 HydrophobicContact CG1-CG 4.21Å; I569-F573 HydrophobicContact CG2-CB 3.47Å; I569-F573 VanDerWaalsContact CG2-CB 3.47Å; I569-F573 HydrophobicContact CG2-CD1 4.04Å; I569-F573 HydrophobicContact CG2-CD2 4.16Å; I569-F573 HydrophobicContact CG2-CG 3.62Å; T570-F573 WeakPolarHBondContact O-CB 3.47Å; T570-F573 PolarHBondContact O-N 2.87Å; S571-F573 VanDerWaalsContact C-N 3.31Å; F573-F605 HydrophobicContact CB-CB 4.42Å; F573-F605 PolarHBondContact N-O 3.47Å; F573-F605 PolarHBondContact O-N 3.05Å; F573-L811 HydrophobicContact CD1-CD1 4.19Å; F573-L811 HydrophobicContact CE1-CD1 3.56Å; F573-L811 HydrophobicContact CZ-CD1 4.42Å
574	F	92.3	Very high	84.3	Confident	12 Å²	12	57.3 Å²	57.3	5%	0.053	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.5	175.2	65.7	-86.4	0	0	0	112.1	P554 A576 F585 L586 L588 L591 I602 I603 V604	P554-F574 HydrophobicContact CB-CD1 4.08Å; P554-F574 HydrophobicContact CB-CE1 3.89Å; P554-F574 HydrophobicContact CB-CE2 4.48Å; P554-F574 HydrophobicContact CB-CG 4.48Å; P554-F574 HydrophobicContact CB-CZ 4.14Å; P554-F574 HydrophobicContact CG-CD1 4.16Å; P554-F574 HydrophobicContact CG-CE1 4.17Å; F574-A576 HydrophobicContact CD2-CB 4.35Å; F574-A576 HydrophobicContact CE2-CB 4.33Å; F574-F585 HydrophobicContact CE1-CZ 4.2Å; F574-F585 HydrophobicContact CE2-CE2 4.23Å; F574-F585 AromaticContact CE2-CZ 3.73Å; F574-F585 HydrophobicContact CE2-CZ 3.73Å; F574-F585 AromaticContact CZ-CE1 3.77Å; F574-F585 HydrophobicContact CZ-CE1 3.77Å; F574-F585 HydrophobicContact CZ-CE2 4.23Å; F574-F585 AromaticContact CZ-CZ 3.29Å; F574-F585 HydrophobicContact CZ-CZ 3.29Å; F574-L586 WeakPolarHBondContact CZ-O 3.4Å; F574-L588 HydrophobicContact CB-CD1 4.16Å; F574-L588 HydrophobicContact CD1-CB 3.86Å; F574-L588 HydrophobicContact CD1-CD1 4.06Å; F574-L588 HydrophobicContact CD1-CD2 4.39Å; F574-L588 HydrophobicContact CD1-CG 4.32Å; F574-L588 HydrophobicContact CE1-CB 3.74Å; F574-L588 HydrophobicContact CG-CD1 4.06Å; F574-L588 HydrophobicContact CZ-CB 4.39Å; F574-L591 HydrophobicContact CD2-CD1 3.8Å; F574-L591 HydrophobicContact CE2-CD1 3.32Å; F574-L591 HydrophobicContact CZ-CD1 4.02Å; F574-I602 HydrophobicContact CB-CG2 4.16Å; F574-I602 HydrophobicContact CD2-CG2 3.97Å; F574-I602 HydrophobicContact CG-CG2 4.44Å; F574-I603 CarbonylContact C-O 3.54Å; F574-I603 WeakPolarHBondContact CA-O 3.43Å; F574-V604 HydrophobicContact CB-CB 4.31Å; F574-V604 HydrophobicContact CB-CG2 4.22Å
575	D	92.7	Very high	83.6	Confident	3 Å²	3	56 Å²	56	2%	0.016	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	100.4	175.9	177	22	0	0	0	110.8	Y557 G577 R600 I603 L811 R828	Y557-D575 HydrophobicContact CD1-CB 4.47Å; Y557-D575 HydrophobicContact CE1-CB 4.44Å; D575-G577 VanDerWaalsContact C-N 3.32Å; D575-G577 WeakPolarHBondContact OD1-CA 3.43Å; D575-G577 PolarHBondContact OD1-N 3.31Å; D575-R600 PolarHBondContact O-NH1 3.41Å; D575-R600 IonicContact OD1-NH1 3.47Å; D575-R600 IonicContact OD2-CZ 3.21Å; D575-R600 IonicContact OD2-NH1 2.65Å; D575-R600 IonicContact OD2-NH2 3.59Å; D575-R600 PolarHBondContact OD2-NH2 3.28Å; D575-I603 PolarHBondContact N-O 3.33Å; D575-I603 PolarHBondContact O-N 3.33Å; D575-I603 VanDerWaalsContact O-N 3.11Å; D575-L811 HydrophobicContact CB-CD2 3.94Å; D575-R828 IonicContact OD1-CZ 2.73Å; D575-R828 IonicContact OD1-NH2 2.67Å; D575-R828 PolarHBondContact OD1-NH2 2.99Å; D575-R828 IonicContact OD2-CZ 2.93Å; D575-R828 IonicContact OD2-NH1 2.7Å; D575-R828 IonicContact OD2-NH2 3.81Å; D575-R828 PolarHBondContact OD2-NH2 3.32Å
576	A	88.1	Confident	83.2	Confident	33 Å²	33	57.6 Å²	57.6	27%	0.273	34%	0.344	S	S	.	.			trans	-82.7	-6.6	172.7	0	0	0	0	0	113.4	F574 L591 R600 I602	F574-A576 HydrophobicContact CD2-CB 4.35Å; F574-A576 HydrophobicContact CE2-CB 4.33Å; A576-L591 HydrophobicContact CB-CD1 4.22Å; A576-R600 PolarHBondContact O-NH1 3.41Å; A576-I602 HydrophobicContact CB-CG1 4.23Å
577	G	87.1	Confident	82.9	Confident	5 Å²	5	52 Å²	52	5%	0.052	31%	0.314	C	S	.	.			trans	107.7	-172.2	-176.6	0	0	0	0	0	111.6	N558 D575 R600	N558-G577 WeakPolarHBondContact CA-O 3.2Å; N558-G577 PolarHBondContact ND2-O 2.64Å; D575-G577 VanDerWaalsContact C-N 3.32Å; D575-G577 WeakPolarHBondContact OD1-CA 3.43Å; D575-G577 PolarHBondContact OD1-N 3.31Å; G577-R600 VanDerWaalsContact CA-NH1 3.32Å
578	Q	85.1	Confident	82.5	Confident	95 Å²	95	52.3 Å²	52.3	44%	0.444	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-83.8	123.2	174	-175.9	68.6	38.2	0	0	109	N558 R559	N558-Q578 WeakPolarHBondContact O-CA 3.37Å; N558-Q578 VanDerWaalsContact O-CD 3.23Å; N558-Q578 PolarHBondContact O-NE2 3.29Å; N558-Q578 VanDerWaalsContact O-NE2 3.1Å; N558-Q578 PolarHBondContact O-OE1 2.88Å; R559-Q578 PolarHBondContact O-NE2 3.5Å
579	A	79.5	Confident	82.2	Confident	20 Å²	20	55.7 Å²	55.7	17%	0.165	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-74.8	146.4	177.9	0	0	0	0	0	112	N558	N558-A579 PolarHBondContact ND2-N 3.4Å; N558-A579 PolarHBondContact O-N 3.01Å; N558-A579 VanDerWaalsContact O-N 3.07Å; N558-A579 WeakPolarHBondContact OD1-CB 3.36Å
580	C	71.4	Confident	81.9	Confident	79 Å²	79	58.8 Å²	58.8	53%	0.534	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-71.9	152.3	166.2	-68.7	0	0	0	0	110.5	R559 G582 E583	R559-C580 PolarHBondContact NH1-O 2.8Å; C580-G582 PolarHBondContact O-N 3.01Å; C580-E583 HydrophobicContact CB-CG 4.05Å; C580-E583 PolarHBondContact N-OE2 3.32Å; C580-E583 PolarHBondContact O-N 3.09Å
581	V	65.3	Low	82	Confident	141 Å²	141	54.7 Å²	54.7	86%	0.855	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	125.5	177.2	-178	0	0	0	0	108.9
582	G	63	Low	82.1	Confident	60 Å²	60	54.3 Å²	54.3	62%	0.619	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-2.2	179.4	0	0	0	0	0	116.2	C580	C580-G582 PolarHBondContact O-N 3.01Å
583	E	72.3	Confident	82.1	Confident	106 Å²	106	54.5 Å²	54.5	50%	0.495	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-81	133	171.1	-71	-173.6	152.7	0	0	111	R559 C580	R559-E583 PolarHBondContact NH1-O 2.77Å; R559-E583 PolarHBondContact NH2-O 3.07Å; C580-E583 HydrophobicContact CB-CG 4.05Å; C580-E583 PolarHBondContact N-OE2 3.32Å; C580-E583 PolarHBondContact O-N 3.09Å
584	P	71.8	Confident	82	Confident	100 Å²	100	56.6 Å²	56.6	65%	0.649	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-68	144.9	177.3	28.6	-34.2	0	0	0	111.1
585	F	80	Confident	81.7	Confident	19 Å²	19	61.2 Å²	61.2	8%	0.083	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-77.3	130.1	174.4	-177.8	-95.1	0	0	0	110.9	P554 V555 N558 F574	P554-F585 HydrophobicContact CB-CZ 3.97Å; V555-F585 HydrophobicContact CB-CD2 4.28Å; V555-F585 HydrophobicContact CB-CE2 4.17Å; V555-F585 HydrophobicContact CB-CZ 4.35Å; V555-F585 HydrophobicContact CG1-CD2 4.41Å; V555-F585 HydrophobicContact CG2-CB 4.38Å; V555-F585 HydrophobicContact CG2-CD1 3.41Å; V555-F585 VanDerWaalsContact CG2-CD1 3.41Å; V555-F585 HydrophobicContact CG2-CD2 3.61Å; V555-F585 HydrophobicContact CG2-CE1 3.33Å; V555-F585 HydrophobicContact CG2-CE2 3.53Å; V555-F585 HydrophobicContact CG2-CG 3.53Å; V555-F585 HydrophobicContact CG2-CZ 3.37Å; N558-F585 HydrophobicContact CB-CD2 4.43Å; N558-F585 HydrophobicContact CB-CE2 4.14Å; F574-F585 HydrophobicContact CE1-CZ 4.2Å; F574-F585 HydrophobicContact CE2-CE2 4.23Å; F574-F585 AromaticContact CE2-CZ 3.73Å; F574-F585 HydrophobicContact CE2-CZ 3.73Å; F574-F585 AromaticContact CZ-CE1 3.77Å; F574-F585 HydrophobicContact CZ-CE1 3.77Å; F574-F585 HydrophobicContact CZ-CE2 4.23Å; F574-F585 AromaticContact CZ-CZ 3.29Å; F574-F585 HydrophobicContact CZ-CZ 3.29Å
586	L	83.2	Confident	81.5	Confident	63 Å²	63	65.5 Å²	65.5	33%	0.33	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-95.9	135.7	176.9	-60.7	177.3	0	0	0	110.6	F574 E590 L591	F574-L586 WeakPolarHBondContact CZ-O 3.4Å; L586-E590 HydrophobicContact CB-CB 4.43Å; L586-L591 HydrophobicContact CB-CD1 4.4Å; L586-L591 HydrophobicContact CB-CD2 3.79Å; L586-L591 HydrophobicContact CB-CG 3.79Å; L586-L591 HydrophobicContact CD1-CD2 3.73Å; L586-L591 HydrophobicContact CG-CD2 4.42Å
587	T	84.4	Confident	81.5	Confident	24 Å²	24	66 Å²	66	15%	0.147	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-67.7	160.4	172.8	62.9	0	0	0	0	111.3	V516 E589 E590 L591	V516-T587 HydrophobicContact CG1-CG2 4.12Å; T587-E589 PolarHBondContact O-N 3.1Å; T587-E590 PolarHBondContact N-OE2 3.48Å; T587-E590 PolarHBondContact O-N 2.92Å; T587-E590 WeakPolarHBondContact OG1-CB 3.49Å; T587-E590 VanDerWaalsContact OG1-CG 3.23Å; T587-E590 WeakPolarHBondContact OG1-CG 2.96Å; T587-E590 PolarHBondContact OG1-N 2.98Å; T587-E590 PolarHBondContact OG1-OE2 3.37Å; T587-L591 WeakPolarHBondContact O-CB 3.26Å; T587-L591 VanDerWaalsContact O-CG 3.27Å; T587-L591 WeakPolarHBondContact O-CG 3.41Å; T587-L591 PolarHBondContact O-N 3.06Å
588	L	85.2	Confident	81.3	Confident	19 Å²	19	75.4 Å²	75.4	10%	0.099	43%	0.426	C	S	.	.	H	α-helix	trans	-57.8	-38.4	176.3	-176.1	57.5	0	0	0	111.8	N572 F574 L591 I592 V604 I728 V795	N572-L588 HydrophobicContact CB-CD2 4.43Å; F574-L588 HydrophobicContact CB-CD1 4.16Å; F574-L588 HydrophobicContact CD1-CB 3.86Å; F574-L588 HydrophobicContact CD1-CD1 4.06Å; F574-L588 HydrophobicContact CD1-CD2 4.39Å; F574-L588 HydrophobicContact CD1-CG 4.32Å; F574-L588 HydrophobicContact CE1-CB 3.74Å; F574-L588 HydrophobicContact CG-CD1 4.06Å; F574-L588 HydrophobicContact CZ-CB 4.39Å; L588-L591 PolarHBondContact O-N 3Å; L588-I592 HydrophobicContact CD1-CD1 4.15Å; L588-I592 HydrophobicContact CD1-CG1 4.32Å; L588-I592 HydrophobicContact CG-CD1 3.86Å; L588-I592 HydrophobicContact CG-CG1 4.48Å; L588-I592 WeakPolarHBondContact O-CB 3.34Å; L588-I592 WeakPolarHBondContact O-CD1 3.46Å; L588-I592 WeakPolarHBondContact O-CG1 3.43Å; L588-I592 PolarHBondContact O-N 2.93Å; L588-V604 HydrophobicContact CD1-CG2 4.24Å; L588-V604 HydrophobicContact CD2-CG2 4.01Å; L588-I728 HydrophobicContact CD2-CD1 4.09Å; L588-V795 HydrophobicContact CD1-CG1 4.29Å
589	E	84.4	Confident	81.2	Confident	154 Å²	154	77 Å²	77	72%	0.72	43%	0.433	S	S	*	.	H	α-helix	trans	-65.1	-43.3	178.5	-64	-179.4	177.6	0	0	112.4	T587 L591 I592 S593	T587-E589 PolarHBondContact O-N 3.1Å; E589-L591 VanDerWaalsContact C-N 3.35Å; E589-I592 PolarHBondContact O-N 3.4Å; E589-S593 WeakPolarHBondContact O-CB 3.22Å; E589-S593 PolarHBondContact O-N 2.9Å; E589-S593 VanDerWaalsContact O-N 3.07Å; E589-S593 PolarHBondContact O-OG 3.17Å
590	E	86.4	Confident	81.5	Confident	71 Å²	71	80 Å²	80	33%	0.332	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-41.9	175.2	-72.5	162.2	156.5	0	0	111	L586 T587 S593 Q594	L586-E590 HydrophobicContact CB-CB 4.43Å; T587-E590 PolarHBondContact N-OE2 3.48Å; T587-E590 PolarHBondContact O-N 2.92Å; T587-E590 WeakPolarHBondContact OG1-CB 3.49Å; T587-E590 VanDerWaalsContact OG1-CG 3.23Å; T587-E590 WeakPolarHBondContact OG1-CG 2.96Å; T587-E590 PolarHBondContact OG1-N 2.98Å; T587-E590 PolarHBondContact OG1-OE2 3.37Å; E590-S593 PolarHBondContact O-N 2.89Å; E590-Q594 WeakPolarHBondContact O-CG 3.13Å; E590-Q594 PolarHBondContact O-N 2.8Å
591	L	87.4	Confident	82.3	Confident	10 Å²	10	76.2 Å²	76.2	5%	0.052	42%	0.415	C	S	.	.	H	α-helix	trans	-65.2	-38.8	177.8	-71.9	172	0	0	0	112.7	F574 A576 L586 T587 L588 E589 S593 Q594 I602	F574-L591 HydrophobicContact CD2-CD1 3.8Å; F574-L591 HydrophobicContact CE2-CD1 3.32Å; F574-L591 HydrophobicContact CZ-CD1 4.02Å; A576-L591 HydrophobicContact CB-CD1 4.22Å; L586-L591 HydrophobicContact CB-CD1 4.4Å; L586-L591 HydrophobicContact CB-CD2 3.79Å; L586-L591 HydrophobicContact CB-CG 3.79Å; L586-L591 HydrophobicContact CD1-CD2 3.73Å; L586-L591 HydrophobicContact CG-CD2 4.42Å; T587-L591 WeakPolarHBondContact O-CB 3.26Å; T587-L591 VanDerWaalsContact O-CG 3.27Å; T587-L591 WeakPolarHBondContact O-CG 3.41Å; T587-L591 PolarHBondContact O-N 3.06Å; L588-L591 PolarHBondContact O-N 3Å; E589-L591 VanDerWaalsContact C-N 3.35Å; L591-S593 VanDerWaalsContact C-N 3.3Å; L591-Q594 PolarHBondContact O-N 2.95Å; L591-I602 HydrophobicContact CB-CD1 4.09Å; L591-I602 HydrophobicContact CD1-CG1 4.3Å; L591-I602 HydrophobicContact CD1-CG2 4.21Å; L591-I602 HydrophobicContact CD2-CD1 3.88Å; L591-I602 HydrophobicContact CD2-CG1 4.28Å; L591-I602 HydrophobicContact CG-CD1 4.38Å
592	I	86.5	Confident	83.5	Confident	31 Å²	31	69.9 Å²	69.9	16%	0.159	38%	0.376	C	S	.	.	H	α-helix	trans	-65.6	-36.2	174.8	-71.1	164.8	0	0	0	111.1	L588 E589 Q594 P726 I728 V795	L588-I592 HydrophobicContact CD1-CD1 4.15Å; L588-I592 HydrophobicContact CD1-CG1 4.32Å; L588-I592 HydrophobicContact CG-CD1 3.86Å; L588-I592 HydrophobicContact CG-CG1 4.48Å; L588-I592 WeakPolarHBondContact O-CB 3.34Å; L588-I592 WeakPolarHBondContact O-CD1 3.46Å; L588-I592 WeakPolarHBondContact O-CG1 3.43Å; L588-I592 PolarHBondContact O-N 2.93Å; E589-I592 PolarHBondContact O-N 3.4Å; I592-Q594 PolarHBondContact O-N 3.44Å; I592-P726 HydrophobicContact CG2-CB 3.93Å; I592-P726 HydrophobicContact CG2-CG 3.71Å; I592-I728 HydrophobicContact CD1-CD1 3.45Å; I592-I728 VanDerWaalsContact CD1-CD1 3.45Å; I592-I728 HydrophobicContact CD1-CG1 3.69Å; I592-V795 HydrophobicContact CG1-CB 4.37Å; I592-V795 HydrophobicContact CG1-CG2 3.75Å
593	S	86.6	Confident	85	Confident	93 Å²	93	67 Å²	67	65%	0.65	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-9.1	-177	-58	0	0	0	0	113.7	E589 E590 L591	E589-S593 WeakPolarHBondContact O-CB 3.22Å; E589-S593 PolarHBondContact O-N 2.9Å; E589-S593 VanDerWaalsContact O-N 3.07Å; E589-S593 PolarHBondContact O-OG 3.17Å; E590-S593 PolarHBondContact O-N 2.89Å; L591-S593 VanDerWaalsContact C-N 3.3Å
594	Q	88.4	Confident	85.9	Confident	50 Å²	50	62 Å²	62	23%	0.234	32%	0.323	C	S	.	.	S	Bend	trans	-71.4	139.9	179.5	-68.3	-176.4	-3.2	0	0	112.2	E590 L591 I592 N597 N794	E590-Q594 WeakPolarHBondContact O-CG 3.13Å; E590-Q594 PolarHBondContact O-N 2.8Å; L591-Q594 PolarHBondContact O-N 2.95Å; I592-Q594 PolarHBondContact O-N 3.44Å; Q594-N597 PolarHBondContact OE1-ND2 3.29Å; Q594-N794 PolarHBondContact O-ND2 3.23Å
595	P	87.3	Confident	86.8	Confident	109 Å²	109	57.4 Å²	57.4	71%	0.708	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-63.2	153	171.4	28.7	-34.8	0	0	0	110.5	N597 N794	P595-N597 PolarHBondContact O-N 3.24Å; P595-N597 VanDerWaalsContact O-N 3.12Å; P595-N794 PolarHBondContact O-ND2 3.28Å
596	L	87.9	Confident	87.1	Confident	94 Å²	94	57.3 Å²	57.3	49%	0.492	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-53.3	121.5	177.2	-171.2	75.5	0	0	0	110	R788 N794	L596-R788 HydrophobicContact CD1-CB 3.83Å; L596-N794 WeakPolarHBondContact CA-OD1 3.34Å
597	N	87.8	Confident	86.9	Confident	43 Å²	43	55.6 Å²	55.6	23%	0.23	29%	0.285	C	S	.	.			trans	-127.3	-179.8	-173.8	67.8	37.4	0	0	0	111.5	Q594 P595 Q599 R788 N794	Q594-N597 PolarHBondContact OE1-ND2 3.29Å; P595-N597 PolarHBondContact O-N 3.24Å; P595-N597 VanDerWaalsContact O-N 3.12Å; N597-Q599 PolarHBondContact ND2-OE1 2.59Å; N597-Q599 VanDerWaalsContact OD1-CB 3.28Å; N597-Q599 WeakPolarHBondContact OD1-CB 3.24Å; N597-Q599 PolarHBondContact OD1-N 3Å; N597-R788 PolarHBondContact O-NH2 2.94Å; N597-R788 PolarHBondContact OD1-NH2 3.38Å; N597-N794 PolarHBondContact N-OD1 3.12Å; N597-N794 PolarHBondContact ND2-ND2 3.34Å
598	Q	82.4	Confident	86	Confident	202 Å²	202	56.1 Å²	56.1	94%	0.944	29%	0.29	S	S	*	.	S	Bend	trans	-95.6	5.1	177.6	-65.7	-176.2	-7.5	0	0	113.3
599	Q	83.6	Confident	84.5	Confident	129 Å²	129	61 Å²	61	60%	0.603	32%	0.319	S	S	*	.	S	Bend	trans	-72.4	168.3	178.5	-59.8	179	-32.8	0	0	110.9	N597 R788	N597-Q599 PolarHBondContact ND2-OE1 2.59Å; N597-Q599 VanDerWaalsContact OD1-CB 3.28Å; N597-Q599 WeakPolarHBondContact OD1-CB 3.24Å; N597-Q599 PolarHBondContact OD1-N 3Å; Q599-R788 PolarHBondContact O-NH1 3.19Å; Q599-R788 PolarHBondContact O-NH2 3.45Å
600	R	85.7	Confident	82.7	Confident	82 Å²	82	62.6 Å²	62.6	31%	0.309	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-53.2	138.6	176.6	-178.4	-178	176.7	-94.9	4.2	110.3	D575 A576 G577	D575-R600 PolarHBondContact O-NH1 3.41Å; D575-R600 IonicContact OD1-NH1 3.47Å; D575-R600 IonicContact OD2-CZ 3.21Å; D575-R600 IonicContact OD2-NH1 2.65Å; D575-R600 IonicContact OD2-NH2 3.59Å; D575-R600 PolarHBondContact OD2-NH2 3.28Å; A576-R600 PolarHBondContact O-NH1 3.41Å; G577-R600 VanDerWaalsContact CA-NH1 3.32Å
601	A	88.1	Confident	80.7	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.008	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-62.2	137	173.1	0	0	0	0	0	110.9	I603 I796	A601-I603 HydrophobicContact CB-CD1 4.11Å; A601-I796 HydrophobicContact CB-CD1 3.54Å; A601-I796 HydrophobicContact CB-CG1 4.13Å
602	I	92.1	Very high	78.3	Confident	8 Å²	8	71 Å²	71	4%	0.041	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.4	173.5	-61.5	121	0	0	0	107.7	F574 A576 L591 N794 V795 I796	F574-I602 HydrophobicContact CB-CG2 4.16Å; F574-I602 HydrophobicContact CD2-CG2 3.97Å; F574-I602 HydrophobicContact CG-CG2 4.44Å; A576-I602 HydrophobicContact CB-CG1 4.23Å; L591-I602 HydrophobicContact CB-CD1 4.09Å; L591-I602 HydrophobicContact CD1-CG1 4.3Å; L591-I602 HydrophobicContact CD1-CG2 4.21Å; L591-I602 HydrophobicContact CD2-CD1 3.88Å; L591-I602 HydrophobicContact CD2-CG1 4.28Å; L591-I602 HydrophobicContact CG-CD1 4.38Å; I602-N794 HydrophobicContact CD1-CB 3.96Å; I602-N794 PolarHBondContact N-O 3.02Å; I602-V795 HydrophobicContact CB-CG2 4.1Å; I602-V795 HydrophobicContact CD1-CG2 4.17Å; I602-V795 HydrophobicContact CG2-CG1 4.45Å; I602-V795 HydrophobicContact CG2-CG2 4.28Å; I602-V795 CarbonylContact O-C 2.97Å; I602-V795 WeakPolarHBondContact O-CA 3.33Å; I602-I796 PolarHBondContact O-N 3.39Å
603	I	92.8	Very high	75.8	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.7	-178.5	-49.9	-47.9	0	0	0	108.6	F574 D575 A601 I796 I798 I801 L811	F574-I603 CarbonylContact C-O 3.54Å; F574-I603 WeakPolarHBondContact CA-O 3.43Å; D575-I603 PolarHBondContact N-O 3.33Å; D575-I603 PolarHBondContact O-N 3.33Å; D575-I603 VanDerWaalsContact O-N 3.11Å; A601-I603 HydrophobicContact CB-CD1 4.11Å; I603-I796 WeakPolarHBondContact CA-O 3.33Å; I603-I796 HydrophobicContact CD1-CB 4.24Å; I603-I798 HydrophobicContact CG2-CB 3.82Å; I603-I798 HydrophobicContact CG2-CD1 4.15Å; I603-I798 HydrophobicContact CG2-CG1 3.91Å; I603-I801 HydrophobicContact CD1-CD1 3.78Å; I603-I801 HydrophobicContact CG1-CD1 4.41Å; I603-I801 HydrophobicContact CG2-CD1 4.06Å; I603-L811 HydrophobicContact CB-CD2 4.05Å; I603-L811 HydrophobicContact CG2-CD2 3.8Å
604	V	92.5	Very high	73.1	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.1	-179.1	69.7	0	0	0	0	111.1	F574 L588 N606 V795 I796 P797 I798	F574-V604 HydrophobicContact CB-CB 4.31Å; F574-V604 HydrophobicContact CB-CG2 4.22Å; L588-V604 HydrophobicContact CD1-CG2 4.24Å; L588-V604 HydrophobicContact CD2-CG2 4.01Å; V604-N606 HydrophobicContact CG2-CB 4.23Å; V604-V795 HydrophobicContact CB-CG1 3.8Å; V604-V795 HydrophobicContact CG1-CG1 3.6Å; V604-I796 PolarHBondContact N-O 3.44Å; V604-P797 HydrophobicContact CG1-CB 4.41Å; V604-P797 HydrophobicContact CG1-CG 4.44Å; V604-I798 PolarHBondContact O-N 3.2Å
605	F	90	Very high	70.7	Confident	4 Å²	4	86.4 Å²	86.4	2%	0.018	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	104.6	166	175.4	-99.8	0	0	0	108	I569 T570 N572 F573 V607 L734 I738 I798 C815 T819	I569-F605 HydrophobicContact CG2-CD1 3.71Å; I569-F605 HydrophobicContact CG2-CE1 4.13Å; I569-F605 HydrophobicContact CG2-CG 4.25Å; T570-F605 WeakPolarHBondContact O-CD1 3.27Å; N572-F605 PolarHBondContact N-O 3.45Å; F573-F605 HydrophobicContact CB-CB 4.42Å; F573-F605 PolarHBondContact N-O 3.47Å; F573-F605 PolarHBondContact O-N 3.05Å; F605-V607 HydrophobicContact CE1-CG2 4.04Å; F605-V607 HydrophobicContact CE2-CG2 4.12Å; F605-V607 HydrophobicContact CZ-CG2 3.66Å; F605-L734 HydrophobicContact CD2-CD1 4.16Å; F605-L734 HydrophobicContact CD2-CD2 3.49Å; F605-L734 VanDerWaalsContact CD2-CD2 3.49Å; F605-L734 HydrophobicContact CD2-CG 4.38Å; F605-L734 HydrophobicContact CE2-CD1 3.94Å; F605-L734 HydrophobicContact CE2-CD2 3.56Å; F605-L734 HydrophobicContact CE2-CG 4.13Å; F605-L734 HydrophobicContact CG-CD2 4.38Å; F605-L734 HydrophobicContact CZ-CD2 4.49Å; F605-I738 HydrophobicContact CE2-CD1 4.45Å; F605-I738 HydrophobicContact CZ-CD1 4.48Å; F605-I798 HydrophobicContact CD2-CG2 4.22Å; F605-C815 HydrophobicContact CD2-CB 3.46Å; F605-C815 VanDerWaalsContact CD2-CB 3.46Å; F605-C815 HydrophobicContact CE2-CB 3.49Å; F605-C815 VanDerWaalsContact CE2-CB 3.49Å; F605-C815 HydrophobicContact CG-CB 4.1Å; F605-C815 HydrophobicContact CZ-CB 4.16Å; F605-T819 HydrophobicContact CZ-CG2 3.82Å
606	N	86.1	Confident	68.1	Low	17 Å²	17	86.9 Å²	86.9	9%	0.091	44%	0.442	C	S	.	.			trans	-133	113.1	-178.8	-174.7	16.2	0	0	0	110.6	S571 N572 V604 I728 D731	S571-N606 PolarHBondContact OG-OD1 2.98Å; S571-N606 VanDerWaalsContact OG-OD1 3.06Å; N572-N606 PolarHBondContact OD1-OD1 2.79Å; V604-N606 HydrophobicContact CG2-CB 4.23Å; N606-I728 HydrophobicContact CB-CG2 4.47Å; N606-I728 WeakPolarHBondContact ND2-CG2 3.45Å; N606-D731 WeakPolarHBondContact O-CB 3.49Å
607	V	78.4	Confident	65.2	Low	26 Å²	26	90 Å²	90	16%	0.158	46%	0.459	C	S	.	.			trans	-100.8	119.7	173.6	-176	0	0	0	0	107.8	S571 F605 L734 L735 I738	S571-V607 PolarHBondContact OG-N 3.1Å; S571-V607 PolarHBondContact OG-O 3.11Å; F605-V607 HydrophobicContact CE1-CG2 4.04Å; F605-V607 HydrophobicContact CE2-CG2 4.12Å; F605-V607 HydrophobicContact CZ-CG2 3.66Å; V607-L734 HydrophobicContact CG2-CD2 4.06Å; V607-L735 HydrophobicContact CG1-CD2 3.63Å; V607-I738 HydrophobicContact CG2-CD1 3.6Å
608	P	66.1	Low	62.7	Low	36 Å²	36	93.2 Å²	93.2	23%	0.234	49%	0.485	C	S	.	.			trans	-65.6	138.8	-179	26.4	-33.7	0	0	0	111.5	E610 L735	P608-E610 PolarHBondContact O-N 3.43Å; P608-E610 VanDerWaalsContact O-N 3.09Å; P608-L735 HydrophobicContact CG-CD1 3.74Å; P608-L735 HydrophobicContact CG-CG 4.38Å
609	V	54.5	Low	59.9	Low	120 Å²	120	89.5 Å²	89.5	73%	0.727	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-63.7	-19.1	-168.1	-169.5	0	0	0	0	113.7	F611 C612	V609-F611 VanDerWaalsContact C-N 3.28Å; V609-F611 PolarHBondContact O-N 3.07Å; V609-C612 PolarHBondContact O-N 2.94Å
610	E	46.5	Very low	57.2	Low	188 Å²	188	94.4 Å²	94.4	88%	0.879	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-71.5	-10.8	-175.6	-69.3	-174.5	165.6	0	0	115.3	P608	P608-E610 PolarHBondContact O-N 3.43Å; P608-E610 VanDerWaalsContact O-N 3.09Å
611	F	43.2	Very low	54.5	Low	158 Å²	158	96.6 Å²	96.6	69%	0.693	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-99.4	-1	178.9	-103.5	-91.1	0	0	0	115.2	V609 F613 L735	V609-F611 VanDerWaalsContact C-N 3.28Å; V609-F611 PolarHBondContact O-N 3.07Å; F611-F613 VanDerWaalsContact C-N 3.33Å; F611-F613 PolarHBondContact O-N 2.87Å; F611-L735 HydrophobicContact CB-CD2 4.34Å; F611-L735 HydrophobicContact CD2-CD1 4.32Å
612	C	38.5	Very low	51.5	Low	99 Å²	99	101.8 Å²	101.8	67%	0.669	55%	0.552	S	S	*	*	S	Bend	trans	-82.6	-1.4	179.1	-77.3	0	0	0	0	114.8	V609	V609-C612 PolarHBondContact O-N 2.94Å
613	F	33.8	Very low	48.3	Very low	191 Å²	191	107.9 Å²	107.9	84%	0.838	59%	0.593	S	S	*	*			trans	-124.9	68.1	177.2	-70.3	-76.9	0	0	0	112.8	F611	F611-F613 VanDerWaalsContact C-N 3.33Å; F611-F613 PolarHBondContact O-N 2.87Å
614	S	30.2	Very low	45.1	Very low	107 Å²	107	112.1 Å²	112.1	75%	0.748	63%	0.628	S	S	*	*			trans	-92.1	105.2	149.7	60.6	0	0	0	0	108.7	T616	S614-T616 PolarHBondContact O-N 3.23Å
615	K	37.6	Very low	42	Very low	201 Å²	201	117.9 Å²	117.9	87%	0.874	67%	0.666	S	S	*	*			trans	-55.5	104.6	170	-78.3	175.7	174	174.3	0	110.1
616	T	32	Very low	39	Very low	118 Å²	118	126.2 Å²	126.2	72%	0.724	71%	0.71	S	S	*	*			trans	172.6	91.7	139.7	42.2	0	0	0	0	107.8	S614	S614-T616 PolarHBondContact O-N 3.23Å
617	D	27.1	Very low	36.1	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	75%	0.745	S	S	*	*				165.7	139.4	125.9	-81.2	-19.1	0	0	0	108.9	C619	D617-C619 PolarHBondContact O-N 2.95Å
618	S	34.6	Very low	33.6	Very low	110 Å²	110	143.7 Å²	143.7	77%	0.769	78%	0.779	S	S	*	*			trans	-65.3	121.4	-170.2	60.5	0	0	0	0	112
619	C	24.6	Very low	31.6	Very low	124 Å²	124	150.8 Å²	150.8	84%	0.838	81%	0.809	S	S	*	*			trans	-136.8	114.2	151.2	-87.9	0	0	0	0	108.6	D617	D617-C619 PolarHBondContact O-N 2.95Å
620	Y	27.2	Very low	30.1	Very low	233 Å²	233	150.6 Å²	150.6	91%	0.914	81%	0.813	S	S	*	*			trans	-60.3	130.8	165.7	-86.8	-99.9	0	0	0	109
621	V	27.7	Very low	29.5	Very low	128 Å²	128	147.6 Å²	147.6	78%	0.776	81%	0.809	S	S	*	*			trans	-76.5	142.1	163.2	-176.1	0	0	0	0	108.2
622	C	25.8	Very low	28.7	Very low	110 Å²	110	146.1 Å²	146.1	74%	0.743	82%	0.819	S	S	*	*			trans	132.1	117.7	146.7	-73.3	0	0	0	0	114.1
623	C	26.3	Very low	28	Very low	135 Å²	135	144.5 Å²	144.5	91%	0.912	82%	0.819	S	S	*	*			trans	3.5	119.1	137.3	-57.6	0	0	0	0	116.1
624	A	24.2	Very low	27.7	Very low	89 Å²	89	144.9 Å²	144.9	74%	0.736	82%	0.823	S	S	*	*			trans	-113	143.4	154.5	0	0	0	0	0	108.9
625	P	27.1	Very low	27.4	Very low	122 Å²	122	143.4 Å²	143.4	79%	0.792	83%	0.825	S	S	*	*			trans	-71.8	137.6	179.7	-6	22	0	0	0	111	E627	P625-E627 PolarHBondContact O-N 2.88Å; P625-E627 VanDerWaalsContact O-N 3.12Å
626	L	27.1	Very low	27	Very low	178 Å²	178	144.2 Å²	144.2	93%	0.932	82%	0.823	S	S	*	*			trans	-72.7	95.5	167.9	-82.3	157.9	0	0	0	109.6
627	E	24.8	Very low	26.7	Very low	178 Å²	178	148.2 Å²	148.2	83%	0.832	82%	0.824	S	S	*	*			trans	-69.7	127.5	160.8	-76	-174.5	165.3	0	0	110	P625	P625-E627 PolarHBondContact O-N 2.88Å; P625-E627 VanDerWaalsContact O-N 3.12Å
628	R	26.2	Very low	26.6	Very low	233 Å²	233	146.9 Å²	146.9	88%	0.879	82%	0.817	S	S	*	*			trans	-80.6	120.4	172	-66.3	179.4	-171.7	178.9	3.2	109.2
629	H	24.8	Very low	26.1	Very low	184 Å²	184	150.4 Å²	150.4	85%	0.852	82%	0.819	S	S	*	*			trans	-144.5	127.7	150.6	-87.4	-62.2	0	0	0	112.3
630	S	24.1	Very low	26	Very low	116 Å²	116	149.2 Å²	149.2	81%	0.811	81%	0.812	S	S	*	*			trans	-73.1	164.6	173.4	-37.8	0	0	0	0	111.8
631	P	33.3	Very low	25.8	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	81%	0.808	S	S	*	*			trans	-98.3	151	-152.7	36.9	-33.2	0	0	0	114.6
632	S	25.8	Very low	25.6	Very low	127 Å²	127	147.3 Å²	147.3	89%	0.888	81%	0.807	S	S	*	*			trans	-174.7	142.7	135.4	53	0	0	0	0	112.3
633	G	24.3	Very low	25.4	Very low	66 Å²	66	149.2 Å²	149.2	68%	0.68	81%	0.809	S	S	*	*			trans	108.3	81.1	148.6	0	0	0	0	0	119.3
634	H	26.4	Very low	25.3	Very low	199 Å²	199	147.7 Å²	147.7	92%	0.921	80%	0.8	S	S	*	*				50.6	120.9	129.9	-73.7	51.1	0	0	0	121
635	G	25.4	Very low	25.1	Very low	76 Å²	76	151.5 Å²	151.5	78%	0.784	81%	0.807	S	S	*	*				118.8	89.5	125.1	0	0	0	0	0	119.5
636	R	27.6	Very low	25.1	Very low	218 Å²	218	151.8 Å²	151.8	82%	0.823	81%	0.806	S	S	*	*			trans	48.4	115.7	136.7	-70.3	-176.6	177.2	178.8	0.1	121.5
637	R	26.7	Very low	25.2	Very low	202 Å²	202	148.6 Å²	148.6	76%	0.762	79%	0.794	S	S	*	*				67.5	124.3	122.6	-65	-170.1	-155.6	178.2	4.5	121.5
638	D	24.5	Very low	25.1	Very low	132 Å²	132	146.6 Å²	146.6	71%	0.706	79%	0.789	S	S	*	*				70.6	107.2	128.8	-76.5	-11.5	0	0	0	120.8
639	K	24.6	Very low	25.1	Very low	184 Å²	184	139.4 Å²	139.4	80%	0.8	79%	0.787	S	S	*	*				145.1	118.3	107.9	-92.2	166	-176.4	-174	0	113.7
640	S	22.9	Very low	25.2	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	78%	0.78	S	S	*	*				55.8	127.6	118.7	-46.4	0	0	0	0	121.2
641	L	23.2	Very low	25.2	Very low	160 Å²	160	139.1 Å²	139.1	84%	0.838	77%	0.774	S	S	*	*			trans	107.4	125.8	135.8	-71.6	151.6	0	0	0	119.9
642	E	22.8	Very low	24.9	Very low	160 Å²	160	140 Å²	140	75%	0.748	77%	0.771	S	S	*	*			trans	-28.7	145.5	157.2	-54.2	173	144.3	0	0	116.4
643	L	21.8	Very low	24.9	Very low	151 Å²	151	139.2 Å²	139.2	79%	0.791	77%	0.765	S	S	*	*				170.8	146.1	104.4	-116.9	92.8	0	0	0	110.7
644	S	23.7	Very low	24.9	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	77%	0.772	S	S	*	*			trans	-67.8	151.3	170.6	35.6	0	0	0	0	113.4
645	L	20.8	Very low	24.7	Very low	169 Å²	169	135.9 Å²	135.9	89%	0.885	77%	0.767	S	S	*	*			trans	-169.1	128.8	151.2	-105.7	154	0	0	0	111.1
646	V	27.3	Very low	25.1	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	76%	0.761	S	S	*	*			trans	-121.9	153.3	167.4	-173.7	0	0	0	0	108.1
647	V	27.6	Very low	25	Very low	110 Å²	110	134 Å²	134	67%	0.667	76%	0.759	S	S	*	*			trans	119.2	108.5	141.5	-177.8	0	0	0	0	114.7
648	N	23.9	Very low	25.2	Very low	136 Å²	136	129.7 Å²	129.7	73%	0.727	76%	0.757	S	S	*	*				167	123.9	101.2	-108.3	-31.1	0	0	0	113.6
649	G	26.3	Very low	25.2	Very low	82 Å²	82	134.7 Å²	134.7	85%	0.845	77%	0.766	S	S	*	*			trans	-165.7	53.5	168.3	0	0	0	0	0	112.3
650	K	26.6	Very low	25.3	Very low	164 Å²	164	134.6 Å²	134.6	71%	0.713	77%	0.773	S	S	*	*			trans	-44.9	159.6	173.3	-88.5	175.9	157.1	-179	0	114.3
651	L	24.7	Very low	25.3	Very low	131 Å²	131	132.8 Å²	132.8	69%	0.686	77%	0.77	S	S	*	*			cis	-179.4	163.5	25.5	-126.7	159.3	0	0	0	113.6
652	I	25.7	Very low	25.4	Very low	143 Å²	143	130.3 Å²	130.3	73%	0.733	77%	0.766	S	S	*	*			trans	99.4	132.5	146.9	-63.2	149.5	0	0	0	117.5
653	S	25.8	Very low	25.5	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	77%	0.772	S	S	*	*			cis	-179.1	155.4	-10.8	57.5	0	0	0	0	111
654	G	24.3	Very low	26	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	77%	0.768	S	S	*	*			trans	148.4	97.1	149.6	0	0	0	0	0	117.4
655	S	22.9	Very low	26	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	77%	0.773	S	S	*	*			trans	-82.6	178.4	166.6	46	0	0	0	0	111.2
656	P	34.4	Very low	26	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	77%	0.767	S	S	*	*			cis	-155	156.9	31.3	40.6	-16.5	0	0	0	122.4
657	I	24.3	Very low	25.9	Very low	153 Å²	153	129.4 Å²	129.4	79%	0.785	77%	0.769	S	S	*	*			trans	62.4	157.3	131.2	-60.9	170.6	0	0	0	119.7
658	P	32.1	Very low	25.7	Very low	110 Å²	110	130 Å²	130	71%	0.714	77%	0.772	S	S	*	*			cis	-126.7	159.5	3.7	19.2	6.8	0	0	0	115.5
659	R	23.5	Very low	25.7	Very low	237 Å²	237	130.3 Å²	130.3	89%	0.894	78%	0.779	S	S	*	*				60.3	113.1	67.8	-74.8	-159.6	-175.2	-157	2.4	117.9
660	L	25.9	Very low	25.6	Very low	183 Å²	183	129.5 Å²	129.5	96%	0.958	77%	0.77	S	S	*	*			trans	-162.6	133	137.4	-114	93.3	0	0	0	105.1
661	G	24.5	Very low	25.4	Very low	61 Å²	61	130.3 Å²	130.3	63%	0.629	78%	0.777	S	S	*	*			cis	111.1	77.1	34.6	0	0	0	0	0	108.9
662	S	24.4	Very low	25.4	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	79%	0.787	S	S	*	*				79	110.6	106.1	66.7	0	0	0	0	118.6
663	H	24.6	Very low	25.3	Very low	190 Å²	190	135.8 Å²	135.8	88%	0.88	79%	0.792	S	S	*	*			trans	72.1	158.3	134.5	-81.4	-46.9	0	0	0	122.8
664	P	32.4	Very low	25.3	Very low	106 Å²	106	136 Å²	136	69%	0.688	79%	0.791	S	S	*	*			trans	-108.1	167.8	-137.1	41.6	-34	0	0	0	113.9
665	T	23.6	Very low	25.2	Very low	137 Å²	137	142.3 Å²	142.3	84%	0.84	80%	0.796	S	S	*	*			trans	-130.1	122.2	164.3	-39.6	0	0	0	0	110.6
666	V	22.1	Very low	25.2	Very low	125 Å²	125	142.7 Å²	142.7	76%	0.758	79%	0.794	S	S	*	*			trans	-76	131.9	171.4	170.7	0	0	0	0	109
667	V	24	Very low	24.5	Very low	133 Å²	133	143.3 Å²	143.3	81%	0.806	80%	0.799	S	S	*	*			trans	-133	130.4	154.6	-178.8	0	0	0	0	109.3
668	V	22.7	Very low	24.6	Very low	123 Å²	123	144 Å²	144	75%	0.745	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.5	134.2	-175	174.5	0	0	0	0	112
669	V	24.9	Very low	24	Very low	143 Å²	143	149.6 Å²	149.6	87%	0.867	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-100.1	118.8	162.5	-179.8	0	0	0	0	108.2
670	G	24.1	Very low	24.1	Very low	64 Å²	64	146 Å²	146	66%	0.66	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-80.8	149.8	176.7	0	0	0	0	0	112.9
671	E	22.2	Very low	23.9	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.9	144.7	170.6	-57.6	176.8	140.2	0	0	111.7
672	H	25	Very low	23.9	Very low	194 Å²	194	147.7 Å²	147.7	90%	0.898	81%	0.809	S	S	*	*				-170.5	151.3	128.7	-100.8	-68.9	0	0	0	113.2
673	K	23.6	Very low	23.8	Very low	194 Å²	194	150.5 Å²	150.5	84%	0.843	81%	0.81	S	S	*	*			trans	-67.9	173.7	-166.8	-99.5	178.6	-179.4	177.4	0	117.4
674	P	26.6	Very low	23.7	Very low	115 Å²	115	148.6 Å²	148.6	75%	0.747	81%	0.806	S	S	*	*			trans	-87.6	162.7	-158.9	36.9	-35.8	0	0	0	113.8
675	F	21.7	Very low	23.3	Very low	212 Å²	212	148.5 Å²	148.5	93%	0.93	81%	0.814	S	S	*	*			trans	-131.5	143.1	172.1	-112.9	-91.4	0	0	0	113.1
676	V	22	Very low	23.3	Very low	125 Å²	125	150.7 Å²	150.7	76%	0.758	82%	0.815	S	S	*	*			trans	-89.8	151.7	-175.5	171.4	0	0	0	0	110.6
677	C	21.3	Very low	23.4	Very low	114 Å²	114	151 Å²	151	77%	0.77	81%	0.813	S	S	*	*			trans	-164.9	107.1	155.3	-137.4	0	0	0	0	107.4
678	H	24.5	Very low	23.4	Very low	167 Å²	167	155 Å²	155	77%	0.773	81%	0.813	S	S	*	*				111.7	120	70.4	-99.8	-56.1	0	0	0	110
679	R	21	Very low	23.5	Very low	228 Å²	228	158.8 Å²	158.8	86%	0.86	82%	0.819	S	S	*	*			trans	-68.3	139.5	163.2	-82.4	174.2	166.8	170.6	-4.9	109
680	D	24.2	Very low	23.5	Very low	163 Å²	163	158 Å²	158	87%	0.872	82%	0.817	S	S	*	*			trans	-124.8	123	148.1	-83.7	-38.4	0	0	0	109.8
681	T	22.3	Very low	23.5	Very low	127 Å²	127	160 Å²	160	78%	0.779	82%	0.821	S	S	*	*			trans	-90.9	132.6	168.2	39	0	0	0	0	108.9
682	V	24.9	Very low	23.7	Very low	151 Å²	151	157.3 Å²	157.3	92%	0.915	82%	0.819	S	S	*	*			trans	-130.2	132.8	157.6	-175.4	0	0	0	0	108.2
683	E	21.6	Very low	23.8	Very low	167 Å²	167	155 Å²	155	78%	0.78	82%	0.819	S	S	*	*			trans	-105.9	155.8	-171.2	-140.5	179.5	-154.7	0	0	110.2
684	L	22.6	Very low	23.9	Very low	151 Å²	151	154.4 Å²	154.4	79%	0.791	82%	0.819	S	S	*	*			trans	80.4	114.8	157.3	-56.2	167.6	0	0	0	120.1
685	A	23.6	Very low	23.8	Very low	103 Å²	103	154 Å²	154	85%	0.851	82%	0.819	S	S	*	*				-166.8	130.7	110.7	0	0	0	0	0	111.5
686	E	23.5	Very low	24	Very low	183 Å²	183	151.6 Å²	151.6	86%	0.855	81%	0.811	S	S	*	*			trans	-69.9	144.6	171.1	-60.3	172.6	134.3	0	0	111.2
687	D	24.5	Very low	24.2	Very low	133 Å²	133	150.5 Å²	150.5	71%	0.711	80%	0.8	S	S	*	*			trans	-165.9	123.9	131.9	-109	-26.7	0	0	0	113.9
688	R	24.9	Very low	24.4	Very low	216 Å²	216	152.5 Å²	152.5	82%	0.815	80%	0.795	S	S	*	*			trans	55	111.9	136.8	-67	167.3	-163.6	-147	-4.1	121.1
689	K	23.5	Very low	24.5	Very low	203 Å²	203	153.4 Å²	153.4	88%	0.883	80%	0.797	S	S	*	*			trans	-62.2	156.7	145.4	-72.3	-179.7	176	178	0	111.1
690	P	25.4	Very low	24.7	Very low	127 Å²	127	146.3 Å²	146.3	83%	0.825	79%	0.794	S	S	*	*				-133.4	151.9	111.5	31.2	-17.1	0	0	0	114.2
691	S	24	Very low	24.7	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70	158.8	176.2	47.1	0	0	0	0	114
692	P	27.8	Very low	24.8	Very low	127 Å²	127	150.1 Å²	150.1	83%	0.825	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-84.2	144.2	173.7	34	-31.1	0	0	0	112.3
693	T	26.1	Very low	24.7	Very low	144 Å²	144	148.8 Å²	148.8	88%	0.883	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-91.2	145.2	172.3	38.3	0	0	0	0	112.4
694	E	25.6	Very low	25.2	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-71.1	157	-176.6	-61.3	169.5	132.4	0	0	115.5
695	S	25.4	Very low	25.2	Very low	108 Å²	108	147 Å²	147	76%	0.755	78%	0.777	S	S	*	*			trans	-161.6	105	132.1	60	0	0	0	0	108.2
696	E	25.4	Very low	25.3	Very low	161 Å²	161	151.7 Å²	151.7	75%	0.752	77%	0.773	S	S	*	*				64.7	130.3	90.1	-75.4	-156.5	148.2	0	0	112.3
697	I	26.1	Very low	25.4	Very low	101 Å²	101	152.1 Å²	152.1	52%	0.518	77%	0.772	S	S	.	*			cis	-179.3	149.4	28.7	-123.7	168.7	0	0	0	112.3
698	K	26	Very low	25.5	Very low	156 Å²	156	157.2 Å²	157.2	68%	0.678	78%	0.781	S	S	*	*			trans	75.1	141.9	147.5	-66.8	170.5	-168.3	156.5	0	119.7
699	K	25.8	Very low	25.5	Very low	187 Å²	187	156.3 Å²	156.3	81%	0.813	79%	0.786	S	S	*	*			cis	-169.9	137.7	16.6	-125.1	164	-176.8	179	0	112.2
700	G	24.6	Very low	25.8	Very low	78 Å²	78	155.9 Å²	155.9	80%	0.804	78%	0.784	S	S	*	*			trans	72.4	140.4	138.2	0	0	0	0	0	119.4
701	R	24.3	Very low	25.9	Very low	223 Å²	223	157.7 Å²	157.7	84%	0.842	79%	0.787	S	S	*	*			cis	-170.9	129.3	26.6	-165.2	175.5	-173.7	179.3	1.8	112
702	M	24.2	Very low	26.2	Very low	147 Å²	147	162.4 Å²	162.4	72%	0.724	79%	0.794	S	S	*	*			trans	49	113.2	143.8	-60	169.5	66.2	0	0	120.2
703	T	23.7	Very low	26.2	Very low	123 Å²	123	161.5 Å²	161.5	76%	0.755	79%	0.789	S	S	*	*				55.1	138.9	66.1	76.3	0	0	0	0	116.1
704	P	31.3	Very low	26.2	Very low	107 Å²	107	162 Å²	162	70%	0.695	79%	0.786	S	S	*	*				-149.3	147.9	80.9	37.3	-18.3	0	0	0	118.5
705	K	23.9	Very low	26.4	Very low	174 Å²	174	163 Å²	163	76%	0.757	79%	0.79	S	S	*	*			trans	55.7	147.2	131.8	-65.3	176.2	179.1	170.9	0	118.6
706	R	25.1	Very low	26.5	Very low	202 Å²	202	166.5 Å²	166.5	76%	0.762	80%	0.795	S	S	*	*			cis	-179.6	146.1	6.8	-110.3	173.7	177	-174.9	-3.6	102.2
707	K	25.1	Very low	26.6	Very low	191 Å²	191	164.8 Å²	164.8	83%	0.83	80%	0.798	S	S	*	*				169.8	146.8	79.3	-123	167.2	-177.4	-169.4	0	107.7
708	R	27.4	Very low	26.8	Very low	240 Å²	240	168.9 Å²	168.9	91%	0.906	82%	0.815	S	S	*	*			trans	-70.7	148.3	171.6	-70.3	170.8	166.7	175.4	-6	111.1
709	E	25.9	Very low	26.7	Very low	198 Å²	198	168.9 Å²	168.9	93%	0.925	82%	0.822	S	S	*	*			trans	-149.5	137.9	140.2	-115.2	159.2	-159.8	0	0	109.9
710	K	29	Very low	27.1	Very low	193 Å²	193	166.2 Å²	166.2	84%	0.839	82%	0.821	S	S	*	*			trans	-78.5	143.2	175.4	-80.2	172.5	166.3	-179.5	0	107.7
711	D	28.4	Very low	27.3	Very low	165 Å²	165	169.8 Å²	169.8	88%	0.882	82%	0.821	S	S	*	*			trans	-156.4	128.5	139.3	-89.1	-33.8	0	0	0	109.9
712	K	29.2	Very low	27.5	Very low	203 Å²	203	164.3 Å²	164.3	88%	0.883	81%	0.812	S	S	*	*			trans	-85.9	140.5	157.9	-84.1	-173.7	169.8	-166.4	0	106.4
713	P	27.9	Very low	27.9	Very low	109 Å²	109	166.8 Å²	166.8	71%	0.708	82%	0.822	S	S	*	*				-143.2	173.4	101.6	24.2	-3.4	0	0	0	109.4
714	D	25.1	Very low	28.3	Very low	153 Å²	153	169.2 Å²	169.2	82%	0.818	82%	0.822	S	S	*	*			cis	-158.8	137.3	-16.1	-99	-34	0	0	0	102.3	E716	D714-E716 PolarHBondContact O-N 3.38Å
715	E	30.6	Very low	28.2	Very low	204 Å²	204	168.7 Å²	168.7	95%	0.953	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-75.9	118.6	172.6	-76	172.3	154.2	0	0	109.3
716	E	27	Very low	28.9	Very low	181 Å²	181	164.8 Å²	164.8	85%	0.846	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-103.2	148.3	158.6	-79.5	-169.4	166	0	0	110.2	D714	D714-E716 PolarHBondContact O-N 3.38Å
717	P	29	Very low	29.8	Very low	125 Å²	125	161 Å²	161	81%	0.812	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.5	140	-160.3	-9.7	26.3	0	0	0	112.4	D719	P717-D719 PolarHBondContact O-N 3.09Å
718	Q	28.7	Very low	31.1	Very low	187 Å²	187	154.7 Å²	154.7	87%	0.874	78%	0.782	S	S	*	*			trans	-57.7	113.4	165.1	-70.9	176.7	-31.2	0	0	110.2
719	D	25.3	Very low	32.5	Very low	157 Å²	157	151.6 Å²	151.6	84%	0.84	78%	0.775	S	S	*	*			trans	-79.2	114.9	157.8	-110.7	-19.4	0	0	0	108.2	P717 L721	P717-D719 PolarHBondContact O-N 3.09Å; D719-L721 VanDerWaalsContact C-N 3.32Å; D719-L721 PolarHBondContact O-N 3.5Å
720	V	33.4	Very low	34.2	Very low	131 Å²	131	143.4 Å²	143.4	79%	0.794	74%	0.744	S	S	*	*			trans	-66.6	92	171.4	177.2	0	0	0	0	107.6	T722	V720-T722 PolarHBondContact O-N 3.41Å
721	L	29.4	Very low	36.6	Very low	153 Å²	153	134.5 Å²	134.5	80%	0.801	71%	0.705	S	S	*	*			trans	-81.3	106.3	162.7	-73.5	171.8	0	0	0	107.7	D719 E723	D719-L721 VanDerWaalsContact C-N 3.32Å; D719-L721 PolarHBondContact O-N 3.5Å; L721-E723 PolarHBondContact O-N 2.84Å
722	T	27.1	Very low	39.2	Very low	107 Å²	107	131.5 Å²	131.5	66%	0.656	69%	0.693	S	S	*	*			trans	-32.5	123.1	160.7	45	0	0	0	0	111.4	V720 K724	V720-T722 PolarHBondContact O-N 3.41Å; T722-K724 PolarHBondContact O-N 2.82Å
723	E	34.2	Very low	42	Very low	200 Å²	200	124.7 Å²	124.7	94%	0.935	67%	0.671	S	S	*	*			trans	-50.8	97.9	170.1	-72.9	177.3	157.8	0	0	109.6	L721	L721-E723 PolarHBondContact O-N 2.84Å
724	K	31.1	Very low	44.9	Very low	174 Å²	174	119.5 Å²	119.5	76%	0.757	64%	0.637	S	S	*	*			trans	-87.3	122.1	158.7	-77.8	-176.7	176.5	180	0	105.8	T722	T722-K724 PolarHBondContact O-N 2.82Å
725	S	30.1	Very low	47.9	Very low	95 Å²	95	113.9 Å²	113.9	66%	0.664	61%	0.607	S	S	*	*			trans	-43.5	134.1	162.2	38.4	0	0	0	0	109.5	I727	S725-I727 PolarHBondContact O-N 2.92Å
726	P	37.5	Very low	50.7	Low	92 Å²	92	110.1 Å²	110.1	60%	0.597	59%	0.591	S	S	*	*			trans	-68.2	97.4	179.6	25.1	-29.6	0	0	0	108.6	I592 I728	I592-P726 HydrophobicContact CG2-CB 3.93Å; I592-P726 HydrophobicContact CG2-CG 3.71Å; P726-I728 PolarHBondContact O-N 3.16Å; P726-I728 VanDerWaalsContact O-N 3.15Å
727	I	44.3	Very low	53.8	Low	123 Å²	123	102.5 Å²	102.5	63%	0.631	56%	0.556	S	S	*	*			trans	-63	112.8	172.8	-60.8	167.5	0	0	0	106.6	S725 F729	S725-I727 PolarHBondContact O-N 2.92Å; I727-F729 VanDerWaalsContact C-N 3.34Å; I727-F729 PolarHBondContact O-N 3.43Å
728	I	52.1	Low	56.8	Low	58 Å²	58	97.3 Å²	97.3	30%	0.297	52%	0.521	S	S	.	.			trans	-64.9	102.7	163.5	-51.8	174.3	0	0	0	105.4	L588 I592 N606 P726 G730	L588-I728 HydrophobicContact CD2-CD1 4.09Å; I592-I728 HydrophobicContact CD1-CD1 3.45Å; I592-I728 VanDerWaalsContact CD1-CD1 3.45Å; I592-I728 HydrophobicContact CD1-CG1 3.69Å; N606-I728 HydrophobicContact CB-CG2 4.47Å; N606-I728 WeakPolarHBondContact ND2-CG2 3.45Å; P726-I728 PolarHBondContact O-N 3.16Å; P726-I728 VanDerWaalsContact O-N 3.15Å; I728-G730 PolarHBondContact O-N 2.99Å
729	F	56.3	Low	59.8	Low	175 Å²	175	94.4 Å²	94.4	77%	0.768	51%	0.506	S	S	*	.			trans	-54.4	130.1	172.3	-86.6	-93.6	0	0	0	108.5	I727 D731	I727-F729 VanDerWaalsContact C-N 3.34Å; I727-F729 PolarHBondContact O-N 3.43Å; F729-D731 PolarHBondContact O-N 2.97Å
730	G	61.8	Low	62.9	Low	26 Å²	26	91.8 Å²	91.8	27%	0.268	49%	0.488	S	S	.	.			trans	-55.9	134.7	174.1	0	0	0	0	0	110.5	I728 V732	I728-G730 PolarHBondContact O-N 2.99Å; G730-V732 PolarHBondContact O-N 3.46Å
731	D	80.3	Confident	65.7	Low	6 Å²	6	85.5 Å²	85.5	3%	0.032	45%	0.451	C	S	.	.			trans	-75.7	87.5	-177.5	-168.6	-19.5	0	0	0	110.1	N606 F729 S733 L734 L735 P797 I798 G799	N606-D731 WeakPolarHBondContact O-CB 3.49Å; F729-D731 PolarHBondContact O-N 2.97Å; D731-S733 VanDerWaalsContact C-N 3.27Å; D731-S733 PolarHBondContact O-N 2.85Å; D731-S733 PolarHBondContact OD1-N 2.68Å; D731-L734 HydrophobicContact CB-CB 3.68Å; D731-L734 HydrophobicContact CB-CD2 4.14Å; D731-L734 WeakPolarHBondContact O-CB 3.4Å; D731-L734 PolarHBondContact O-N 3.39Å; D731-L734 WeakPolarHBondContact OD1-CB 3.44Å; D731-L734 PolarHBondContact OD1-N 3.23Å; D731-L734 WeakPolarHBondContact OD2-CB 3.46Å; D731-L735 PolarHBondContact O-N 3.48Å; D731-P797 HydrophobicContact CB-CB 4.06Å; D731-P797 WeakPolarHBondContact OD2-CB 3.25Å; D731-I798 PolarHBondContact OD2-N 2.92Å; D731-G799 WeakPolarHBondContact OD1-CA 3.09Å; D731-G799 VanDerWaalsContact OD2-CA 3.31Å; D731-G799 WeakPolarHBondContact OD2-CA 3.38Å; D731-G799 PolarHBondContact OD2-N 2.9Å
732	V	83.5	Confident	68.7	Low	102 Å²	102	83 Å²	83	62%	0.618	43%	0.433	S	S	*	.	H	α-helix	trans	-61.8	-37.5	-178.8	-178.6	0	0	0	0	111.1	G730 L734 L735 M736	G730-V732 PolarHBondContact O-N 3.46Å; V732-L734 VanDerWaalsContact C-N 3.34Å; V732-L735 WeakPolarHBondContact O-CB 3.23Å; V732-L735 PolarHBondContact O-N 2.73Å; V732-M736 WeakPolarHBondContact O-CG 3.49Å; V732-M736 PolarHBondContact O-N 2.94Å; V732-M736 VanDerWaalsContact O-N 3.13Å
733	S	87.3	Confident	71.7	Confident	61 Å²	61	83 Å²	83	43%	0.427	43%	0.429	S	S	.	.	H	α-helix	trans	-63.1	-43.2	176.8	-61	0	0	0	0	111	D731 M736 L737 G799	D731-S733 VanDerWaalsContact C-N 3.27Å; D731-S733 PolarHBondContact O-N 2.85Å; D731-S733 PolarHBondContact OD1-N 2.68Å; S733-M736 PolarHBondContact O-N 2.84Å; S733-L737 WeakPolarHBondContact O-CG 3.39Å; S733-L737 PolarHBondContact O-N 2.86Å; S733-L737 VanDerWaalsContact O-N 3.1Å; S733-G799 WeakPolarHBondContact CB-O 3.34Å
734	L	89.4	Confident	74.3	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-63.5	-39.9	174.8	179.2	64.2	0	0	0	112.6	F605 V607 D731 V732 M736 L737 I738 I798 L812 L816	F605-L734 HydrophobicContact CD2-CD1 4.16Å; F605-L734 HydrophobicContact CD2-CD2 3.49Å; F605-L734 VanDerWaalsContact CD2-CD2 3.49Å; F605-L734 HydrophobicContact CD2-CG 4.38Å; F605-L734 HydrophobicContact CE2-CD1 3.94Å; F605-L734 HydrophobicContact CE2-CD2 3.56Å; F605-L734 HydrophobicContact CE2-CG 4.13Å; F605-L734 HydrophobicContact CG-CD2 4.38Å; F605-L734 HydrophobicContact CZ-CD2 4.49Å; V607-L734 HydrophobicContact CG2-CD2 4.06Å; D731-L734 HydrophobicContact CB-CB 3.68Å; D731-L734 HydrophobicContact CB-CD2 4.14Å; D731-L734 WeakPolarHBondContact O-CB 3.4Å; D731-L734 PolarHBondContact O-N 3.39Å; D731-L734 WeakPolarHBondContact OD1-CB 3.44Å; D731-L734 PolarHBondContact OD1-N 3.23Å; D731-L734 WeakPolarHBondContact OD2-CB 3.46Å; V732-L734 VanDerWaalsContact C-N 3.34Å; L734-M736 VanDerWaalsContact C-N 3.3Å; L734-M736 PolarHBondContact O-N 3.41Å; L734-L737 PolarHBondContact O-N 2.97Å; L734-I738 HydrophobicContact CD1-CD1 4.35Å; L734-I738 HydrophobicContact CD1-CG1 4.38Å; L734-I738 HydrophobicContact CG-CD1 3.95Å; L734-I738 HydrophobicContact CG-CG1 4.42Å; L734-I738 WeakPolarHBondContact O-CG1 3.46Å; L734-I738 PolarHBondContact O-N 3.42Å; L734-I798 HydrophobicContact CD1-CG2 4Å; L734-I798 HydrophobicContact CD2-CG2 4.05Å; L734-L812 HydrophobicContact CD1-CD1 3.87Å; L734-L816 HydrophobicContact CD1-CD2 4.38Å
735	L	88.4	Confident	77	Confident	35 Å²	35	67.6 Å²	67.6	18%	0.183	37%	0.365	C	S	.	.	H	α-helix	trans	-58.9	-41.8	175.1	-77	174.3	0	0	0	112.3	V607 P608 F611 D731 V732 L737 I738 K739	V607-L735 HydrophobicContact CG1-CD2 3.63Å; P608-L735 HydrophobicContact CG-CD1 3.74Å; P608-L735 HydrophobicContact CG-CG 4.38Å; F611-L735 HydrophobicContact CB-CD2 4.34Å; F611-L735 HydrophobicContact CD2-CD1 4.32Å; D731-L735 PolarHBondContact O-N 3.48Å; V732-L735 WeakPolarHBondContact O-CB 3.23Å; V732-L735 PolarHBondContact O-N 2.73Å; L735-L737 VanDerWaalsContact C-N 3.34Å; L735-I738 PolarHBondContact O-N 2.66Å; L735-K739 WeakPolarHBondContact O-CB 3.13Å; L735-K739 PolarHBondContact O-N 3.45Å
736	M	89.4	Confident	79.7	Confident	124 Å²	124	67.1 Å²	67.1	61%	0.611	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-42.2	176.3	-66.9	-63.8	-68.2	0	0	111.2	V732 S733 L734 K739 E740	V732-M736 WeakPolarHBondContact O-CG 3.49Å; V732-M736 PolarHBondContact O-N 2.94Å; V732-M736 VanDerWaalsContact O-N 3.13Å; S733-M736 PolarHBondContact O-N 2.84Å; L734-M736 VanDerWaalsContact C-N 3.3Å; L734-M736 PolarHBondContact O-N 3.41Å; M736-K739 PolarHBondContact O-N 3.28Å; M736-E740 WeakPolarHBondContact O-CB 3.31Å; M736-E740 PolarHBondContact O-N 3.47Å
737	L	91.6	Very high	82	Confident	22 Å²	22	66.9 Å²	66.9	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-65.4	-40.7	176.1	-69.2	171.7	0	0	0	112.8	S733 L734 L735 K739 E740 A741 L761 A765 L812 L816	S733-L737 WeakPolarHBondContact O-CG 3.39Å; S733-L737 PolarHBondContact O-N 2.86Å; S733-L737 VanDerWaalsContact O-N 3.1Å; L734-L737 PolarHBondContact O-N 2.97Å; L735-L737 VanDerWaalsContact C-N 3.34Å; L737-K739 VanDerWaalsContact C-N 3.33Å; L737-K739 PolarHBondContact O-N 3.43Å; L737-E740 PolarHBondContact O-N 3.23Å; L737-A741 VanDerWaalsContact O-CB 3.31Å; L737-A741 WeakPolarHBondContact O-CB 3.45Å; L737-A741 PolarHBondContact O-N 3.4Å; L737-L761 HydrophobicContact CD2-CD1 4.39Å; L737-A765 HydrophobicContact CD1-CB 3.99Å; L737-A765 HydrophobicContact CD2-CB 3.68Å; L737-L812 HydrophobicContact CD1-CD2 4.21Å; L737-L816 HydrophobicContact CB-CD2 4.28Å
738	I	91.5	Very high	84.1	Confident	16 Å²	16	63.6 Å²	63.6	8%	0.082	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-44.3	175	-69.9	166.3	0	0	0	110	F605 V607 L734 L735 A741 K742 L816 T819	F605-I738 HydrophobicContact CE2-CD1 4.45Å; F605-I738 HydrophobicContact CZ-CD1 4.48Å; V607-I738 HydrophobicContact CG2-CD1 3.6Å; L734-I738 HydrophobicContact CD1-CD1 4.35Å; L734-I738 HydrophobicContact CD1-CG1 4.38Å; L734-I738 HydrophobicContact CG-CD1 3.95Å; L734-I738 HydrophobicContact CG-CG1 4.42Å; L734-I738 WeakPolarHBondContact O-CG1 3.46Å; L734-I738 PolarHBondContact O-N 3.42Å; L735-I738 PolarHBondContact O-N 2.66Å; I738-A741 PolarHBondContact O-N 2.7Å; I738-K742 HydrophobicContact CG2-CD 4.41Å; I738-K742 WeakPolarHBondContact O-CG 3.48Å; I738-K742 PolarHBondContact O-N 3.47Å; I738-L816 HydrophobicContact CB-CD2 4.41Å; I738-L816 HydrophobicContact CG1-CD2 3.63Å; I738-T819 HydrophobicContact CD1-CG2 4.08Å; I738-T819 HydrophobicContact CG1-CG2 4.15Å
739	K	90.6	Very high	85.6	Confident	125 Å²	125	67.8 Å²	67.8	54%	0.543	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-47.8	177.1	-175.3	-177.6	176.5	-174.8	0	111.4	L735 M736 L737 A741 K742 D743	L735-K739 WeakPolarHBondContact O-CB 3.13Å; L735-K739 PolarHBondContact O-N 3.45Å; M736-K739 PolarHBondContact O-N 3.28Å; L737-K739 VanDerWaalsContact C-N 3.33Å; L737-K739 PolarHBondContact O-N 3.43Å; K739-A741 VanDerWaalsContact C-N 3.33Å; K739-A741 PolarHBondContact O-N 3.43Å; K739-K742 PolarHBondContact O-N 3.1Å; K739-D743 PolarHBondContact O-N 2.82Å
740	E	92.4	Very high	87.2	Confident	102 Å²	102	63.6 Å²	63.6	48%	0.477	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-39.1	178.6	-173.6	169.7	-175.6	0	0	112	M736 L737 D743 S744 L761	M736-E740 WeakPolarHBondContact O-CB 3.31Å; M736-E740 PolarHBondContact O-N 3.47Å; L737-E740 PolarHBondContact O-N 3.23Å; E740-D743 PolarHBondContact O-N 3.09Å; E740-S744 VanDerWaalsContact O-CB 3.27Å; E740-S744 WeakPolarHBondContact O-CB 3.38Å; E740-S744 PolarHBondContact O-N 3.23Å; E740-S744 PolarHBondContact O-OG 3.38Å; E740-L761 HydrophobicContact CB-CD1 4.41Å; E740-L761 HydrophobicContact CB-CD2 4.49Å; E740-L761 HydrophobicContact CG-CD1 3.74Å; E740-L761 HydrophobicContact CG-CD2 4.36Å
741	A	91.8	Very high	88.5	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-45.6	173.6	0	0	0	0	0	111.4	L737 I738 K739 V745 L758 L761 I820	L737-A741 VanDerWaalsContact O-CB 3.31Å; L737-A741 WeakPolarHBondContact O-CB 3.45Å; L737-A741 PolarHBondContact O-N 3.4Å; I738-A741 PolarHBondContact O-N 2.7Å; K739-A741 VanDerWaalsContact C-N 3.33Å; K739-A741 PolarHBondContact O-N 3.43Å; A741-V745 WeakPolarHBondContact O-CA 3.37Å; A741-V745 WeakPolarHBondContact O-CB 3.19Å; A741-V745 WeakPolarHBondContact O-CG2 3.35Å; A741-V745 PolarHBondContact O-N 3.01Å; A741-L758 HydrophobicContact CB-CD1 4.24Å; A741-L761 HydrophobicContact CB-CD2 3.74Å; A741-I820 HydrophobicContact CB-CG2 4.05Å
742	K	91.3	Very high	89	Confident	101 Å²	101	70.7 Å²	70.7	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-44.4	176.4	-73.4	-179.2	179.1	-169.2	0	112.3	I738 K739 L746 T819 I820	I738-K742 HydrophobicContact CG2-CD 4.41Å; I738-K742 WeakPolarHBondContact O-CG 3.48Å; I738-K742 PolarHBondContact O-N 3.47Å; K739-K742 PolarHBondContact O-N 3.1Å; K742-L746 HydrophobicContact CB-CD1 4.4Å; K742-L746 HydrophobicContact CG-CD1 4.38Å; K742-L746 WeakPolarHBondContact O-CB 3.43Å; K742-T819 WeakPolarHBondContact CE-O 3.43Å; K742-I820 HydrophobicContact CG-CG2 3.77Å
743	D	90.1	Very high	89.5	Confident	106 Å²	106	69.3 Å²	69.3	57%	0.567	36%	0.361	S	S	*	.	H	α-helix	trans	-73.6	-42.1	-175.9	-69	-16.9	0	0	0	112.1	K739 E740 S747	K739-D743 PolarHBondContact O-N 2.82Å; E740-D743 PolarHBondContact O-N 3.09Å; D743-S747 WeakPolarHBondContact O-CB 3.37Å
744	S	88.8	Confident	89.8	Confident	49 Å²	49	67.5 Å²	67.5	34%	0.343	35%	0.346	S	S	.	.	H	α-helix	trans	-90.6	-40.6	-172.9	66.4	0	0	0	0	113.6	E740 S747	E740-S744 VanDerWaalsContact O-CB 3.27Å; E740-S744 WeakPolarHBondContact O-CB 3.38Å; E740-S744 PolarHBondContact O-N 3.23Å; E740-S744 PolarHBondContact O-OG 3.38Å; S744-S747 PolarHBondContact O-OG 2.76Å
745	V	89.1	Confident	90.1	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.006	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-48	-173.4	-176.8	0	0	0	0	111.2	A741 S747 L748 Q754 A757 L758 I820	A741-V745 WeakPolarHBondContact O-CA 3.37Å; A741-V745 WeakPolarHBondContact O-CB 3.19Å; A741-V745 WeakPolarHBondContact O-CG2 3.35Å; A741-V745 PolarHBondContact O-N 3.01Å; V745-S747 PolarHBondContact O-N 2.92Å; V745-L748 WeakPolarHBondContact O-CB 3.48Å; V745-L748 PolarHBondContact O-N 3.41Å; V745-L748 VanDerWaalsContact O-N 3.11Å; V745-Q754 HydrophobicContact CG1-CB 3.81Å; V745-Q754 HydrophobicContact CG1-CG 4.19Å; V745-Q754 VanDerWaalsContact CG1-O 3.23Å; V745-Q754 WeakPolarHBondContact CG1-O 3.48Å; V745-A757 HydrophobicContact CG2-CB 4.25Å; V745-L758 HydrophobicContact CG1-CB 4.41Å; V745-L758 HydrophobicContact CG2-CB 4.17Å; V745-L758 HydrophobicContact CG2-CD1 4.4Å; V745-I820 HydrophobicContact CB-CD1 4.14Å; V745-I820 HydrophobicContact CG1-CD1 3.86Å
746	L	85	Confident	90.4	Very high	85 Å²	85	66.3 Å²	66.3	45%	0.445	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.1	-178.6	-63.7	174.6	0	0	0	113.2	K742 L748 I820	K742-L746 HydrophobicContact CB-CD1 4.4Å; K742-L746 HydrophobicContact CG-CD1 4.38Å; K742-L746 WeakPolarHBondContact O-CB 3.43Å; L746-L748 PolarHBondContact O-N 3.41Å; L746-I820 HydrophobicContact CD1-CB 4.49Å; L746-I820 HydrophobicContact CD2-CB 4.31Å; L746-I820 HydrophobicContact CG-CB 4.43Å
747	S	85.9	Confident	90.7	Very high	88 Å²	88	61.1 Å²	61.1	62%	0.615	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.1	174.6	76.4	0	0	0	0	113.7	D743 S744 V745	D743-S747 WeakPolarHBondContact O-CB 3.37Å; S744-S747 PolarHBondContact O-OG 2.76Å; V745-S747 PolarHBondContact O-N 2.92Å
748	L	89.4	Confident	91	Very high	53 Å²	53	60 Å²	60	28%	0.277	31%	0.311	S	S	.	.			trans	-85.9	142.2	-178.3	-58.3	166.3	0	0	0	110.7	V745 L746 E753 Q754 A757	V745-L748 WeakPolarHBondContact O-CB 3.48Å; V745-L748 PolarHBondContact O-N 3.41Å; V745-L748 VanDerWaalsContact O-N 3.11Å; L746-L748 PolarHBondContact O-N 3.41Å; L748-E753 HydrophobicContact CD1-CG 4.14Å; L748-Q754 HydrophobicContact CB-CG 3.87Å; L748-Q754 PolarHBondContact O-NE2 2.78Å; L748-A757 HydrophobicContact CD1-CB 3.51Å
749	T	84	Confident	91.2	Very high	147 Å²	147	59.3 Å²	59.3	90%	0.902	31%	0.307	S	S	*	.	S	Bend	trans	-90.3	-27.7	-178.8	54.2	0	0	0	0	113.8
750	D	89.2	Confident	91.5	Very high	87 Å²	87	57.8 Å²	57.8	47%	0.465	30%	0.298	S	S	.	.			trans	-87.7	121.9	-180	173.5	29.1	0	0	0	110.4	R752 E753 Q754	D750-R752 VanDerWaalsContact C-N 3.26Å; D750-R752 PolarHBondContact O-N 2.78Å; D750-R752 PolarHBondContact OD1-N 3.32Å; D750-R752 VanDerWaalsContact OD1-N 3.14Å; D750-R752 WeakPolarHBondContact OD2-CB 3.28Å; D750-E753 HydrophobicContact CB-CB 4.01Å; D750-E753 PolarHBondContact O-N 3.24Å; D750-E753 PolarHBondContact OD2-N 3.1Å; D750-Q754 WeakPolarHBondContact O-CG 3.29Å; D750-Q754 PolarHBondContact O-N 3.26Å
751	E	89.4	Confident	91.7	Very high	72 Å²	72	53.7 Å²	53.7	34%	0.336	28%	0.28	S	S	.	.	H	α-helix	trans	-63.1	-33.9	-179.5	-177.9	166.7	-135.8	0	0	112.4	Q754 Y755 K822 L840	E751-Q754 WeakPolarHBondContact O-CB 3.37Å; E751-Q754 PolarHBondContact O-N 2.73Å; E751-Y755 HydrophobicContact CG-CD2 4.06Å; E751-Y755 HydrophobicContact CG-CE2 3.66Å; E751-Y755 VanDerWaalsContact O-CD2 3.23Å; E751-Y755 WeakPolarHBondContact O-CD2 3.39Å; E751-Y755 PolarHBondContact O-N 3.31Å; E751-K822 IonicContact OE1-NZ 2.63Å; E751-K822 PolarHBondContact OE1-NZ 3.47Å; E751-L840 HydrophobicContact CB-CD2 4.34Å; E751-L840 HydrophobicContact CG-CD2 3.64Å
752	R	91.8	Very high	92	Very high	109 Å²	109	53.7 Å²	53.7	41%	0.411	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-46.4	176.1	-164.5	-178.5	-162.2	142.2	9	110.8	D750 Q754 Y755 A756 L840 L867	D750-R752 VanDerWaalsContact C-N 3.26Å; D750-R752 PolarHBondContact O-N 2.78Å; D750-R752 PolarHBondContact OD1-N 3.32Å; D750-R752 VanDerWaalsContact OD1-N 3.14Å; D750-R752 WeakPolarHBondContact OD2-CB 3.28Å; R752-Q754 VanDerWaalsContact C-N 3.32Å; R752-Y755 PolarHBondContact O-N 3.18Å; R752-A756 PolarHBondContact O-N 2.92Å; R752-A756 VanDerWaalsContact O-N 3.08Å; R752-L840 HydrophobicContact CB-CD1 4.26Å; R752-L840 HydrophobicContact CG-CD1 4.01Å; R752-L867 HydrophobicContact CG-CD1 3.54Å
753	E	93.4	Very high	92.2	Very high	73 Å²	73	48.9 Å²	48.9	34%	0.341	26%	0.259	S	S	.	.	H	α-helix	trans	-68.3	-30.7	177.3	-169	52.8	-148.2	0	0	112.4	L748 D750 A756 A757 R760	L748-E753 HydrophobicContact CD1-CG 4.14Å; D750-E753 HydrophobicContact CB-CB 4.01Å; D750-E753 PolarHBondContact O-N 3.24Å; D750-E753 PolarHBondContact OD2-N 3.1Å; E753-A756 PolarHBondContact O-N 3.34Å; E753-A757 VanDerWaalsContact O-CB 3.27Å; E753-A757 WeakPolarHBondContact O-CB 3.42Å; E753-A757 PolarHBondContact O-N 3.27Å; E753-R760 IonicContact OE1-CZ 3.56Å; E753-R760 IonicContact OE1-NH1 3.42Å; E753-R760 PolarHBondContact OE1-NH1 2.71Å; E753-R760 IonicContact OE1-NH2 3.84Å; E753-R760 PolarHBondContact OE1-NH2 2.85Å
754	Q	94	Very high	92.4	Very high	22 Å²	22	49.2 Å²	49.2	10%	0.103	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-49.8	172.3	-73.2	173.5	-17.6	0	0	111.6	V745 L748 D750 E751 R752 A756 A757 L758	V745-Q754 HydrophobicContact CG1-CB 3.81Å; V745-Q754 HydrophobicContact CG1-CG 4.19Å; V745-Q754 VanDerWaalsContact CG1-O 3.23Å; V745-Q754 WeakPolarHBondContact CG1-O 3.48Å; L748-Q754 HydrophobicContact CB-CG 3.87Å; L748-Q754 PolarHBondContact O-NE2 2.78Å; D750-Q754 WeakPolarHBondContact O-CG 3.29Å; D750-Q754 PolarHBondContact O-N 3.26Å; E751-Q754 WeakPolarHBondContact O-CB 3.37Å; E751-Q754 PolarHBondContact O-N 2.73Å; R752-Q754 VanDerWaalsContact C-N 3.32Å; Q754-A756 VanDerWaalsContact C-N 3.32Å; Q754-A756 PolarHBondContact O-N 2.93Å; Q754-A757 PolarHBondContact O-N 2.7Å; Q754-L758 WeakPolarHBondContact O-CB 3.47Å; Q754-L758 PolarHBondContact O-N 3.02Å
755	Y	95.4	Very high	92.7	Very high	5 Å²	5	48.4 Å²	48.4	2%	0.02	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-38.2	175.8	-72.4	-65.2	0	0	0	112.2	E751 R752 L758 A759 F813 K822 S823 V838 L840	E751-Y755 HydrophobicContact CG-CD2 4.06Å; E751-Y755 HydrophobicContact CG-CE2 3.66Å; E751-Y755 VanDerWaalsContact O-CD2 3.23Å; E751-Y755 WeakPolarHBondContact O-CD2 3.39Å; E751-Y755 PolarHBondContact O-N 3.31Å; R752-Y755 PolarHBondContact O-N 3.18Å; Y755-L758 PolarHBondContact O-N 2.84Å; Y755-A759 WeakPolarHBondContact O-CB 3.29Å; Y755-A759 PolarHBondContact O-N 2.81Å; Y755-F813 HydrophobicContact CD1-CE1 4.47Å; Y755-F813 AromaticContact CD1-CZ 3.93Å; Y755-F813 HydrophobicContact CD1-CZ 3.93Å; Y755-K822 HydrophobicContact CE1-CB 3.97Å; Y755-K822 HydrophobicContact CE1-CG 4.49Å; Y755-S823 PolarHBondContact OH-N 3.01Å; Y755-S823 PolarHBondContact OH-O 2.86Å; Y755-S823 VanDerWaalsContact OH-O 3.05Å; Y755-V838 HydrophobicContact CD1-CB 4.37Å; Y755-V838 HydrophobicContact CD1-CG1 3.65Å; Y755-V838 HydrophobicContact CD2-CB 4.39Å; Y755-V838 HydrophobicContact CD2-CG2 4.46Å; Y755-V838 HydrophobicContact CE1-CB 4.2Å; Y755-V838 HydrophobicContact CE1-CG1 3.55Å; Y755-V838 HydrophobicContact CE2-CB 4.24Å; Y755-V838 HydrophobicContact CE2-CG1 4.45Å; Y755-V838 HydrophobicContact CG-CB 4.46Å; Y755-V838 HydrophobicContact CG-CG1 4.14Å; Y755-V838 HydrophobicContact CG-CG2 4.5Å; Y755-L840 HydrophobicContact CD2-CD2 3.88Å; Y755-L840 HydrophobicContact CE2-CD2 3.71Å
756	A	94.9	Very high	92.9	Very high	6 Å²	6	48.4 Å²	48.4	5%	0.05	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-40.9	177.3	0	0	0	0	0	112.5	R752 E753 Q754 A759 R760 G865	R752-A756 PolarHBondContact O-N 2.92Å; R752-A756 VanDerWaalsContact O-N 3.08Å; E753-A756 PolarHBondContact O-N 3.34Å; Q754-A756 VanDerWaalsContact C-N 3.32Å; Q754-A756 PolarHBondContact O-N 2.93Å; A756-A759 PolarHBondContact O-N 3.46Å; A756-R760 WeakPolarHBondContact O-CG 3.25Å; A756-R760 PolarHBondContact O-N 3.31Å; A756-R760 VanDerWaalsContact O-N 3.11Å; A756-G865 WeakPolarHBondContact CB-O 3.43Å
757	A	95.8	Very high	93.2	Very high	14 Å²	14	46.9 Å²	46.9	12%	0.116	26%	0.261	C	S	.	.	H	α-helix	trans	-65.9	-43.6	175.9	0	0	0	0	0	111.8	V745 L748 E753 Q754 A759 R760 L761	V745-A757 HydrophobicContact CG2-CB 4.25Å; L748-A757 HydrophobicContact CD1-CB 3.51Å; E753-A757 VanDerWaalsContact O-CB 3.27Å; E753-A757 WeakPolarHBondContact O-CB 3.42Å; E753-A757 PolarHBondContact O-N 3.27Å; Q754-A757 PolarHBondContact O-N 2.7Å; A757-A759 VanDerWaalsContact C-N 3.31Å; A757-A759 PolarHBondContact O-N 3.2Å; A757-R760 PolarHBondContact O-N 3.49Å; A757-L761 PolarHBondContact O-N 2.74Å
758	L	96.8	Very high	93.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-41.6	175.4	-176.7	62.3	0	0	0	111.7	A741 V745 Q754 Y755 R760 L761 V762 F813 L816 A817 I820	A741-L758 HydrophobicContact CB-CD1 4.24Å; V745-L758 HydrophobicContact CG1-CB 4.41Å; V745-L758 HydrophobicContact CG2-CB 4.17Å; V745-L758 HydrophobicContact CG2-CD1 4.4Å; Q754-L758 WeakPolarHBondContact O-CB 3.47Å; Q754-L758 PolarHBondContact O-N 3.02Å; Y755-L758 PolarHBondContact O-N 2.84Å; L758-R760 PolarHBondContact O-N 3.08Å; L758-L761 PolarHBondContact O-N 3.13Å; L758-V762 WeakPolarHBondContact O-CG2 3.33Å; L758-V762 PolarHBondContact O-N 2.94Å; L758-F813 HydrophobicContact CB-CE2 3.94Å; L758-F813 HydrophobicContact CD2-CD2 4Å; L758-F813 HydrophobicContact CD2-CE1 4.38Å; L758-F813 HydrophobicContact CD2-CE2 3.7Å; L758-F813 HydrophobicContact CD2-CG 4.48Å; L758-F813 HydrophobicContact CD2-CZ 3.93Å; L758-F813 HydrophobicContact CG-CD2 3.85Å; L758-F813 HydrophobicContact CG-CE2 3.69Å; L758-F813 HydrophobicContact CG-CZ 4.4Å; L758-L816 HydrophobicContact CD1-CB 3.83Å; L758-L816 HydrophobicContact CD1-CD1 4.19Å; L758-A817 HydrophobicContact CD2-CB 3.81Å; L758-I820 HydrophobicContact CD1-CD1 4.39Å; L758-I820 HydrophobicContact CD2-CD1 4.18Å
759	A	97.1	Very high	93.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.5	-40.9	177.4	0	0	0	0	0	112.7	Y755 A756 A757 S763 F813 V858 L860	Y755-A759 WeakPolarHBondContact O-CB 3.29Å; Y755-A759 PolarHBondContact O-N 2.81Å; A756-A759 PolarHBondContact O-N 3.46Å; A757-A759 VanDerWaalsContact C-N 3.31Å; A757-A759 PolarHBondContact O-N 3.2Å; A759-S763 WeakPolarHBondContact O-CB 3.16Å; A759-S763 PolarHBondContact O-N 3.13Å; A759-F813 HydrophobicContact CB-CD2 4.49Å; A759-F813 HydrophobicContact CB-CE2 4.04Å; A759-V858 HydrophobicContact CB-CG1 3.59Å; A759-L860 HydrophobicContact CB-CD2 3.59Å
760	R	96.9	Very high	94.1	Very high	94 Å²	94	37.4 Å²	37.4	36%	0.355	21%	0.211	S	C	.	.	H	α-helix	trans	-64.7	-45.2	174.5	-70.8	-176	-59.8	-100	5.1	111.5	E753 A756 A757 L758 V762 S763 D764 P864	E753-R760 IonicContact OE1-CZ 3.56Å; E753-R760 IonicContact OE1-NH1 3.42Å; E753-R760 PolarHBondContact OE1-NH1 2.71Å; E753-R760 IonicContact OE1-NH2 3.84Å; E753-R760 PolarHBondContact OE1-NH2 2.85Å; A756-R760 WeakPolarHBondContact O-CG 3.25Å; A756-R760 PolarHBondContact O-N 3.31Å; A756-R760 VanDerWaalsContact O-N 3.11Å; A757-R760 PolarHBondContact O-N 3.49Å; L758-R760 PolarHBondContact O-N 3.08Å; R760-V762 PolarHBondContact O-N 3.47Å; R760-S763 WeakPolarHBondContact O-CB 3.48Å; R760-S763 PolarHBondContact O-N 3.24Å; R760-S763 VanDerWaalsContact O-N 3.16Å; R760-D764 WeakPolarHBondContact O-CB 3.38Å; R760-D764 VanDerWaalsContact O-CG 3.27Å; R760-D764 PolarHBondContact O-N 3.29Å; R760-P864 HydrophobicContact CG-CB 4.23Å; R760-P864 WeakPolarHBondContact CG-O 3.33Å
761	L	96.2	Very high	94.1	Very high	15 Å²	15	35.9 Å²	35.9	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-47.7	176.3	-179	65.3	0	0	0	112	L737 E740 A741 A757 L758 S763 D764 A765	L737-L761 HydrophobicContact CD2-CD1 4.39Å; E740-L761 HydrophobicContact CB-CD1 4.41Å; E740-L761 HydrophobicContact CB-CD2 4.49Å; E740-L761 HydrophobicContact CG-CD1 3.74Å; E740-L761 HydrophobicContact CG-CD2 4.36Å; A741-L761 HydrophobicContact CB-CD2 3.74Å; A757-L761 PolarHBondContact O-N 2.74Å; L758-L761 PolarHBondContact O-N 3.13Å; L761-S763 VanDerWaalsContact C-N 3.34Å; L761-S763 PolarHBondContact O-N 3.21Å; L761-D764 PolarHBondContact O-N 3.36Å; L761-A765 WeakPolarHBondContact O-CB 3.02Å; L761-A765 PolarHBondContact O-N 3.3Å
762	V	97	Very high	93.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-43.8	176	168.9	0	0	0	0	111.4	L758 R760 M766 R809 L812 F813 L816 L860	L758-V762 WeakPolarHBondContact O-CG2 3.33Å; L758-V762 PolarHBondContact O-N 2.94Å; R760-V762 PolarHBondContact O-N 3.47Å; V762-M766 PolarHBondContact O-N 3.18Å; V762-R809 HydrophobicContact CG1-CB 3.97Å; V762-R809 HydrophobicContact CG1-CG 4.33Å; V762-R809 WeakPolarHBondContact CG1-O 3.4Å; V762-L812 HydrophobicContact CG1-CB 4.33Å; V762-L812 HydrophobicContact CG1-CD2 4.24Å; V762-L812 HydrophobicContact CG1-CG 4.44Å; V762-L812 HydrophobicContact CG2-CD2 4.39Å; V762-L812 HydrophobicContact CG2-CG 4.25Å; V762-F813 HydrophobicContact CG1-CB 4.42Å; V762-F813 HydrophobicContact CG2-CB 4.05Å; V762-F813 HydrophobicContact CG2-CD2 4.11Å; V762-L816 HydrophobicContact CG2-CD1 3.87Å; V762-L860 HydrophobicContact CG1-CD2 4.42Å
763	S	96.1	Very high	93.6	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-47.8	178.8	168.8	0	0	0	0	111.7	A759 R760 L761 A765 M766 G767 G768 A769 R809 P864	A759-S763 WeakPolarHBondContact O-CB 3.16Å; A759-S763 PolarHBondContact O-N 3.13Å; R760-S763 WeakPolarHBondContact O-CB 3.48Å; R760-S763 PolarHBondContact O-N 3.24Å; R760-S763 VanDerWaalsContact O-N 3.16Å; L761-S763 VanDerWaalsContact C-N 3.34Å; L761-S763 PolarHBondContact O-N 3.21Å; S763-A765 VanDerWaalsContact C-N 3.35Å; S763-A765 PolarHBondContact O-N 2.99Å; S763-M766 CarbonylContact O-C 3.43Å; S763-M766 PolarHBondContact O-N 3.1Å; S763-M766 VanDerWaalsContact O-N 3.11Å; S763-G767 PolarHBondContact O-N 3.1Å; S763-G768 WeakPolarHBondContact O-CA 3.48Å; S763-G768 PolarHBondContact O-N 3.42Å; S763-G768 PolarHBondContact OG-O 3.3Å; S763-A769 PolarHBondContact OG-N 3.42Å; S763-R809 VanDerWaalsContact CA-NH1 3.34Å; S763-R809 PolarHBondContact OG-NH1 2.85Å; S763-P864 VanDerWaalsContact CB-CG 3.47Å; S763-P864 WeakPolarHBondContact OG-CG 3.44Å
764	D	95.3	Very high	93.3	Very high	114 Å²	114	39.6 Å²	39.6	61%	0.61	23%	0.228	S	C	*	.	H	α-helix	trans	-64.1	-40	-178.7	-69.5	-16.1	0	0	0	111.5	R760 L761 M766	R760-D764 WeakPolarHBondContact O-CB 3.38Å; R760-D764 VanDerWaalsContact O-CG 3.27Å; R760-D764 PolarHBondContact O-N 3.29Å; L761-D764 PolarHBondContact O-N 3.36Å; D764-M766 PolarHBondContact O-N 3.4Å
765	A	93.9	Very high	92.8	Very high	32 Å²	32	41.3 Å²	41.3	26%	0.264	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-29.8	174.1	0	0	0	0	0	113.3	L737 L761 S763 L812	L737-A765 HydrophobicContact CD1-CB 3.99Å; L737-A765 HydrophobicContact CD2-CB 3.68Å; L761-A765 WeakPolarHBondContact O-CB 3.02Å; L761-A765 PolarHBondContact O-N 3.3Å; S763-A765 VanDerWaalsContact C-N 3.35Å; S763-A765 PolarHBondContact O-N 2.99Å; A765-L812 HydrophobicContact CB-CD2 4.43Å
766	M	94.5	Very high	92.1	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	24.5	-173.3	-68.4	-161.6	163.6	0	0	114.4	V762 S763 D764 I798 I801 N802 G804 H808 R809 L812	V762-M766 PolarHBondContact O-N 3.18Å; S763-M766 CarbonylContact O-C 3.43Å; S763-M766 PolarHBondContact O-N 3.1Å; S763-M766 VanDerWaalsContact O-N 3.11Å; D764-M766 PolarHBondContact O-N 3.4Å; M766-I798 HydrophobicContact CE-CG1 3.94Å; M766-I801 HydrophobicContact CE-CB 4.17Å; M766-I801 HydrophobicContact CE-CG2 4.32Å; M766-I801 WeakPolarHBondContact CG-O 3.41Å; M766-N802 CarbonylContact C-O 3.49Å; M766-G804 PolarHBondContact O-N 3.13Å; M766-H808 HydrophobicContact CE-CB 3.95Å; M766-H808 HydrophobicContact SD-CB 3.8Å; M766-R809 HydrophobicContact CB-CG 3.96Å; M766-R809 HydrophobicContact CG-CG 4.3Å; M766-R809 PolarHBondContact O-NH2 3.38Å; M766-R809 HydrophobicContact SD-CB 4.24Å; M766-R809 HydrophobicContact SD-CG 3.52Å; M766-R809 VanDerWaalsContact SD-CG 3.52Å; M766-L812 HydrophobicContact CE-CB 3.77Å; M766-L812 HydrophobicContact CE-CD2 3.68Å; M766-L812 HydrophobicContact CE-CG 4.28Å; M766-L812 HydrophobicContact CG-CD2 4.22Å; M766-L812 HydrophobicContact SD-CB 4.48Å; M766-L812 HydrophobicContact SD-CD2 4.28Å
767	G	90.4	Very high	91.6	Very high	52 Å²	52	53.3 Å²	53.3	54%	0.536	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.1	12.1	169.6	0	0	0	0	0	115.6	S763 N802	S763-G767 PolarHBondContact O-N 3.1Å; G767-N802 WeakPolarHBondContact CA-O 3.35Å; G767-N802 PolarHBondContact N-O 3.27Å; G767-N802 VanDerWaalsContact N-O 3.09Å
768	G	93.1	Very high	91	Very high	16 Å²	16	54.2 Å²	54.2	17%	0.165	30%	0.296	C	S	.	.	S	Bend	trans	77.2	-173.7	176.8	0	0	0	0	0	114.1	S763 R809	S763-G768 WeakPolarHBondContact O-CA 3.48Å; S763-G768 PolarHBondContact O-N 3.42Å; S763-G768 PolarHBondContact OG-O 3.3Å; G768-R809 PolarHBondContact O-NH1 3.45Å; G768-R809 PolarHBondContact O-NH2 2.88Å
769	A	92.9	Very high	90.5	Very high	59 Å²	59	58.7 Å²	58.7	49%	0.488	32%	0.319	S	S	.	.			trans	-69.1	133.3	177.9	0	0	0	0	0	111.4	S763 M861 P864	S763-A769 PolarHBondContact OG-N 3.42Å; A769-M861 CarbonylContact C-O 3.6Å; A769-M861 WeakPolarHBondContact CA-O 3.44Å; A769-P864 HydrophobicContact CB-CG 3.82Å
770	V	91.9	Very high	90	Very high	14 Å²	14	62.1 Å²	62.1	9%	0.085	33%	0.332	C	S	.	.			trans	-116.4	111.1	-179.4	-176.5	0	0	0	0	109	L775 M861 H862	V770-L775 HydrophobicContact CG1-CD1 4.37Å; V770-M861 HydrophobicContact CB-CE 4.25Å; V770-M861 HydrophobicContact CG2-CE 4.43Å; V770-M861 PolarHBondContact N-O 3.21Å; V770-H862 WeakPolarHBondContact O-CA 3.43Å; V770-H862 PolarHBondContact O-CD2 2.7Å; V770-H862 VanDerWaalsContact O-CD2 3.28Å
771	P	89.1	Confident	89.6	Confident	56 Å²	56	61.4 Å²	61.4	36%	0.364	34%	0.339	S	S	.	.			trans	-59.5	148	173.6	-23.2	33.7	0	0	0	111.8	E773 K774 L775	P771-E773 WeakPolarHBondContact CB-OE2 3.46Å; P771-E773 PolarHBondContact O-N 2.73Å; P771-E773 VanDerWaalsContact O-N 3.16Å; P771-K774 HydrophobicContact CG-CD 4.33Å; P771-K774 PolarHBondContact O-N 3.21Å; P771-L775 PolarHBondContact O-N 2.83Å
772	L	85.4	Confident	89.2	Confident	82 Å²	82	65.7 Å²	65.7	43%	0.429	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-56.8	-35.8	-176.8	-172.8	70.7	0	0	0	111.9	K774 H862	L772-K774 VanDerWaalsContact C-N 3.25Å; L772-K774 PolarHBondContact O-N 3.47Å; L772-H862 VanDerWaalsContact CD1-NE2 3.33Å; L772-H862 WeakPolarHBondContact CD1-NE2 3.47Å
773	E	86.1	Confident	88.9	Confident	144 Å²	144	66.8 Å²	66.8	67%	0.673	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-69.7	-24	-180	-50.5	85.5	-176.5	0	0	112.8	P771 H776	P771-E773 WeakPolarHBondContact CB-OE2 3.46Å; P771-E773 PolarHBondContact O-N 2.73Å; P771-E773 VanDerWaalsContact O-N 3.16Å; E773-H776 PolarHBondContact O-CE1 3.49Å; E773-H776 PolarHBondContact O-ND1 2.97Å
774	K	86.3	Confident	88.7	Confident	105 Å²	105	67.5 Å²	67.5	46%	0.457	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-100.2	7.2	-175	-64.7	-171.5	174.6	-171	0	113.8	P771 L772 H776 E777	P771-K774 HydrophobicContact CG-CD 4.33Å; P771-K774 PolarHBondContact O-N 3.21Å; L772-K774 VanDerWaalsContact C-N 3.25Å; L772-K774 PolarHBondContact O-N 3.47Å; K774-H776 PolarHBondContact O-N 3.33Å; K774-H776 VanDerWaalsContact O-N 3.11Å; K774-E777 HydrophobicContact CB-CG 4.48Å; K774-E777 WeakPolarHBondContact O-CB 3.45Å; K774-E777 PolarHBondContact O-N 3.3Å
775	L	82.8	Confident	88.4	Confident	58 Å²	58	64.9 Å²	64.9	30%	0.304	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-57	-32.2	-178.4	-149.8	93	0	0	0	112.8	V770 P771 E777 L778 Y806 M861	V770-L775 HydrophobicContact CG1-CD1 4.37Å; P771-L775 PolarHBondContact O-N 2.83Å; L775-E777 VanDerWaalsContact C-N 3.28Å; L775-E777 PolarHBondContact O-N 2.94Å; L775-L778 WeakPolarHBondContact O-CB 3.06Å; L775-L778 PolarHBondContact O-N 3.32Å; L775-Y806 HydrophobicContact CD1-CE2 3.93Å; L775-Y806 WeakPolarHBondContact CD1-OH 3.35Å; L775-Y806 HydrophobicContact CD2-CE2 4.33Å; L775-M861 HydrophobicContact CD1-CE 3.9Å
776	H	81.9	Confident	88.2	Confident	150 Å²	150	67 Å²	67	69%	0.694	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-73	-16.7	178.8	68	-83.1	0	0	0	114	E773 K774 L778	E773-H776 PolarHBondContact O-CE1 3.49Å; E773-H776 PolarHBondContact O-ND1 2.97Å; K774-H776 PolarHBondContact O-N 3.33Å; K774-H776 VanDerWaalsContact O-N 3.11Å; H776-L778 VanDerWaalsContact C-N 3.29Å
777	E	84.2	Confident	88	Confident	114 Å²	114	67.4 Å²	67.4	53%	0.533	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-83.2	-7.3	176.6	-56.5	178.3	175.3	0	0	111.9	K774 L775 D779	K774-E777 HydrophobicContact CB-CG 4.48Å; K774-E777 WeakPolarHBondContact O-CB 3.45Å; K774-E777 PolarHBondContact O-N 3.3Å; L775-E777 VanDerWaalsContact C-N 3.28Å; L775-E777 PolarHBondContact O-N 2.94Å; E777-D779 PolarHBondContact O-N 3Å; E777-D779 VanDerWaalsContact O-N 3.13Å
778	L	83.4	Confident	88	Confident	32 Å²	32	66.1 Å²	66.1	17%	0.168	35%	0.348	C	S	.	.			trans	-78.9	94.3	-179.6	-171.8	71.6	0	0	0	110.8	L775 H776 W780 K803 M861	L775-L778 WeakPolarHBondContact O-CB 3.06Å; L775-L778 PolarHBondContact O-N 3.32Å; H776-L778 VanDerWaalsContact C-N 3.29Å; L778-W780 HydrophobicContact CG-CB 4.35Å; L778-W780 VanDerWaalsContact O-CD1 3.27Å; L778-W780 PolarHBondContact O-N 2.84Å; L778-K803 HydrophobicContact CD1-CB 4.42Å; L778-M861 HydrophobicContact CD2-CE 4.47Å
779	D	85.3	Confident	87.8	Confident	94 Å²	94	72.7 Å²	72.7	50%	0.503	37%	0.372	S	S	.	.			trans	-72.6	50.8	177.8	-67	-39.4	0	0	0	114.1	E777 V781 H783	E777-D779 PolarHBondContact O-N 3Å; E777-D779 VanDerWaalsContact O-N 3.13Å; D779-V781 VanDerWaalsContact C-N 3.33Å; D779-V781 PolarHBondContact O-N 2.88Å; D779-H783 PolarHBondContact O-N 3.17Å
780	W	87.4	Confident	87.6	Confident	72 Å²	72	76.4 Å²	76.4	27%	0.273	38%	0.379	S	S	.	.	H	α-helix	trans	-66.9	-32.2	-177.1	67.7	-92.5	0	0	0	112.9	L778 H783 Q784 T805	L778-W780 HydrophobicContact CG-CB 4.35Å; L778-W780 VanDerWaalsContact O-CD1 3.27Å; L778-W780 PolarHBondContact O-N 2.84Å; W780-H783 PolarHBondContact O-N 3.4Å; W780-Q784 HydrophobicContact CE3-CG 4.5Å; W780-Q784 WeakPolarHBondContact O-CG 3.37Å; W780-Q784 PolarHBondContact O-N 3.09Å; W780-T805 HydrophobicContact CB-CG2 4.06Å; W780-T805 HydrophobicContact CD2-CG2 3.63Å; W780-T805 HydrophobicContact CE3-CG2 4.27Å; W780-T805 HydrophobicContact CG-CG2 3.51Å
781	V	87.9	Confident	87.4	Confident	80 Å²	80	78.8 Å²	78.8	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-65.7	-45.6	-179.4	-179.9	0	0	0	0	111.3	D779 Q784 S785	D779-V781 VanDerWaalsContact C-N 3.33Å; D779-V781 PolarHBondContact O-N 2.88Å; V781-Q784 PolarHBondContact O-N 3.22Å; V781-S785 WeakPolarHBondContact O-CB 3.49Å; V781-S785 PolarHBondContact O-N 3.25Å; V781-S785 PolarHBondContact O-OG 3.43Å
782	L	88.8	Confident	87.4	Confident	104 Å²	104	84.9 Å²	84.9	55%	0.545	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-46.5	177.8	-179	62	0	0	0	110.2	Q784 S785 D786	L782-Q784 PolarHBondContact O-N 2.8Å; L782-S785 WeakPolarHBondContact O-CB 3.36Å; L782-S785 PolarHBondContact O-N 2.89Å; L782-S785 VanDerWaalsContact O-N 3.09Å; L782-D786 PolarHBondContact O-N 3Å
783	H	91	Very high	87.6	Confident	23 Å²	23	82.1 Å²	82.1	11%	0.106	40%	0.4	C	S	.	.	H	α-helix	trans	-55.7	-47	176.4	-179.8	60.4	0	0	0	112.8	D779 W780 S785 D786 L787 N802 K803	D779-H783 PolarHBondContact O-N 3.17Å; W780-H783 PolarHBondContact O-N 3.4Å; H783-S785 VanDerWaalsContact C-N 3.34Å; H783-S785 PolarHBondContact O-N 3.25Å; H783-D786 PolarHBondContact O-N 3.01Å; H783-L787 VanDerWaalsContact NE2-CD1 3.34Å; H783-L787 WeakPolarHBondContact NE2-CD1 3.25Å; H783-L787 WeakPolarHBondContact O-CG 3.38Å; H783-L787 PolarHBondContact O-N 3.23Å; H783-N802 PolarHBondContact CE1-OD1 3.14Å; H783-N802 PolarHBondContact ND1-OD1 3.13Å; H783-N802 PolarHBondContact NE2-N 3.08Å; H783-N802 PolarHBondContact NE2-OD1 3.33Å; H783-K803 HydrophobicContact CB-CB 4.3Å; H783-K803 HydrophobicContact CB-CD 4.17Å
784	Q	90.1	Very high	87.8	Confident	15 Å²	15	75.3 Å²	75.3	7%	0.07	37%	0.368	C	S	.	.	H	α-helix	trans	-64.9	-37.7	176	-75.5	-167.8	-26.1	0	0	113	W780 V781 L782 L787 R788 I796 H808	W780-Q784 HydrophobicContact CE3-CG 4.5Å; W780-Q784 WeakPolarHBondContact O-CG 3.37Å; W780-Q784 PolarHBondContact O-N 3.09Å; V781-Q784 PolarHBondContact O-N 3.22Å; L782-Q784 PolarHBondContact O-N 2.8Å; Q784-L787 PolarHBondContact O-N 2.9Å; Q784-R788 VanDerWaalsContact O-CG 3.25Å; Q784-R788 WeakPolarHBondContact O-CG 3.38Å; Q784-R788 PolarHBondContact O-N 2.84Å; Q784-I796 HydrophobicContact CB-CD1 4.19Å; Q784-I796 HydrophobicContact CG-CD1 4.23Å; Q784-H808 PolarHBondContact NE2-CE1 3.04Å; Q784-H808 PolarHBondContact NE2-NE2 3.11Å
785	S	89.1	Confident	88	Confident	59 Å²	59	70.8 Å²	70.8	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-64.6	-41.9	178	-58	0	0	0	0	111.3	V781 L782 H783 R788 F789	V781-S785 WeakPolarHBondContact O-CB 3.49Å; V781-S785 PolarHBondContact O-N 3.25Å; V781-S785 PolarHBondContact O-OG 3.43Å; L782-S785 WeakPolarHBondContact O-CB 3.36Å; L782-S785 PolarHBondContact O-N 2.89Å; L782-S785 VanDerWaalsContact O-N 3.09Å; H783-S785 VanDerWaalsContact C-N 3.34Å; H783-S785 PolarHBondContact O-N 3.25Å; S785-R788 PolarHBondContact O-N 3.37Å; S785-F789 WeakPolarHBondContact O-CB 3.39Å; S785-F789 PolarHBondContact O-N 2.95Å
786	D	90.6	Very high	88.5	Confident	76 Å²	76	68 Å²	68	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-44.7	175.2	-70.3	-20.9	0	0	0	111.4	L782 H783 F789 Q790	L782-D786 PolarHBondContact O-N 3Å; H783-D786 PolarHBondContact O-N 3.01Å; D786-F789 PolarHBondContact O-N 2.8Å; D786-Q790 WeakPolarHBondContact O-CB 3.4Å; D786-Q790 WeakPolarHBondContact O-CG 3.49Å; D786-Q790 PolarHBondContact O-N 3.13Å
787	L	91	Very high	89	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.052	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-45.9	176.1	-73.9	178.3	0	0	0	112.2	H783 Q784 F789 Q790 L791 I796 M800 I801	H783-L787 VanDerWaalsContact NE2-CD1 3.34Å; H783-L787 WeakPolarHBondContact NE2-CD1 3.25Å; H783-L787 WeakPolarHBondContact O-CG 3.38Å; H783-L787 PolarHBondContact O-N 3.23Å; Q784-L787 PolarHBondContact O-N 2.9Å; L787-F789 VanDerWaalsContact C-N 3.31Å; L787-F789 PolarHBondContact O-N 2.94Å; L787-Q790 PolarHBondContact O-N 3.37Å; L787-L791 WeakPolarHBondContact O-CB 3.4Å; L787-L791 VanDerWaalsContact O-CG 3.28Å; L787-L791 WeakPolarHBondContact O-CG 3.2Å; L787-L791 PolarHBondContact O-N 3.26Å; L787-I796 HydrophobicContact CB-CD1 4.27Å; L787-I796 HydrophobicContact CB-CG2 4.43Å; L787-I796 HydrophobicContact CD1-CG2 3.84Å; L787-M800 HydrophobicContact CD1-CB 4.33Å; L787-M800 HydrophobicContact CD2-CB 4.19Å; L787-M800 HydrophobicContact CD2-CE 4.17Å; L787-I801 HydrophobicContact CD1-CG1 4.37Å
788	R	89.8	Confident	89.4	Confident	25 Å²	25	56.2 Å²	56.2	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-38.7	178	-68.7	168.8	71.2	169.1	14	112.1	L596 N597 Q599 Q784 S785 K792 S793 N794 I796	L596-R788 HydrophobicContact CD1-CB 3.83Å; N597-R788 PolarHBondContact O-NH2 2.94Å; N597-R788 PolarHBondContact OD1-NH2 3.38Å; Q599-R788 PolarHBondContact O-NH1 3.19Å; Q599-R788 PolarHBondContact O-NH2 3.45Å; Q784-R788 VanDerWaalsContact O-CG 3.25Å; Q784-R788 WeakPolarHBondContact O-CG 3.38Å; Q784-R788 PolarHBondContact O-N 2.84Å; S785-R788 PolarHBondContact O-N 3.37Å; R788-K792 WeakPolarHBondContact O-CA 3.15Å; R788-K792 PolarHBondContact O-N 2.92Å; R788-S793 WeakPolarHBondContact CA-O 3.31Å; R788-S793 WeakPolarHBondContact CB-O 3.33Å; R788-S793 PolarHBondContact O-N 3.14Å; R788-N794 PolarHBondContact NH2-OD1 2.89Å; R788-I796 HydrophobicContact CG-CD1 3.71Å; R788-I796 HydrophobicContact CG-CG1 3.94Å
789	F	88.8	Confident	89.8	Confident	155 Å²	155	55.3 Å²	55.3	68%	0.68	28%	0.28	S	S	*	.	H	α-helix	trans	-65.7	-44.3	175.7	-178.5	-98.2	0	0	0	111.8	S785 D786 L787 K792	S785-F789 WeakPolarHBondContact O-CB 3.39Å; S785-F789 PolarHBondContact O-N 2.95Å; D786-F789 PolarHBondContact O-N 2.8Å; L787-F789 VanDerWaalsContact C-N 3.31Å; L787-F789 PolarHBondContact O-N 2.94Å; F789-K792 PolarHBondContact O-N 3.11Å
790	Q	89.4	Confident	90	Very high	136 Å²	136	54 Å²	54	64%	0.636	27%	0.272	S	S	*	.	H	α-helix	trans	-64	-44.2	177.6	-72.6	171.4	20.7	0	0	112.3	D786 L787 K792	D786-Q790 WeakPolarHBondContact O-CB 3.4Å; D786-Q790 WeakPolarHBondContact O-CG 3.49Å; D786-Q790 PolarHBondContact O-N 3.13Å; L787-Q790 PolarHBondContact O-N 3.37Å; Q790-K792 VanDerWaalsContact C-N 3.3Å
791	L	87.4	Confident	90.3	Very high	64 Å²	64	50.8 Å²	50.8	34%	0.335	26%	0.26	S	S	.	.	H	α-helix	trans	-78	-14.5	179.9	-66.1	172.5	0	0	0	113.1	L787 S793 M800	L787-L791 WeakPolarHBondContact O-CB 3.4Å; L787-L791 VanDerWaalsContact O-CG 3.28Å; L787-L791 WeakPolarHBondContact O-CG 3.2Å; L787-L791 PolarHBondContact O-N 3.26Å; L791-S793 PolarHBondContact O-N 3Å; L791-M800 HydrophobicContact CD1-SD 4.14Å; L791-M800 HydrophobicContact CD2-CE 4.32Å; L791-M800 HydrophobicContact CD2-SD 4.01Å
792	K	88.9	Confident	90.5	Very high	185 Å²	185	51 Å²	51	80%	0.804	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	36.8	-170	-58.2	-178.7	179.5	-179.6	0	112.4	R788 F789 Q790	R788-K792 WeakPolarHBondContact O-CA 3.15Å; R788-K792 PolarHBondContact O-N 2.92Å; F789-K792 PolarHBondContact O-N 3.11Å; Q790-K792 VanDerWaalsContact C-N 3.3Å
793	S	89.4	Confident	90.6	Very high	23 Å²	23	50 Å²	50	16%	0.161	25%	0.249	C	C	.	.	S	Bend	trans	-144.3	150.8	-174.7	-178.1	0	0	0	0	111.2	R788 L791 V795	R788-S793 WeakPolarHBondContact CA-O 3.31Å; R788-S793 WeakPolarHBondContact CB-O 3.33Å; R788-S793 PolarHBondContact O-N 3.14Å; L791-S793 PolarHBondContact O-N 3Å; S793-V795 PolarHBondContact OG-N 3.07Å
794	N	90.4	Very high	90.6	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.244	C	C	.	.	S	Bend	trans	-79	-11.6	169.7	-60.5	-46.5	0	0	0	112.5	Q594 P595 L596 N597 I602 R788	Q594-N794 PolarHBondContact O-ND2 3.23Å; P595-N794 PolarHBondContact O-ND2 3.28Å; L596-N794 WeakPolarHBondContact CA-OD1 3.34Å; N597-N794 PolarHBondContact N-OD1 3.12Å; N597-N794 PolarHBondContact ND2-ND2 3.34Å; I602-N794 HydrophobicContact CD1-CB 3.96Å; I602-N794 PolarHBondContact N-O 3.02Å; R788-N794 PolarHBondContact NH2-OD1 2.89Å
795	V	91.4	Very high	90.8	Very high	10 Å²	10	48.6 Å²	48.6	6%	0.061	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.4	-179.6	-175.2	0	0	0	0	109.8	L588 I592 I602 V604 S793	L588-V795 HydrophobicContact CD1-CG1 4.29Å; I592-V795 HydrophobicContact CG1-CB 4.37Å; I592-V795 HydrophobicContact CG1-CG2 3.75Å; I602-V795 HydrophobicContact CB-CG2 4.1Å; I602-V795 HydrophobicContact CD1-CG2 4.17Å; I602-V795 HydrophobicContact CG2-CG1 4.45Å; I602-V795 HydrophobicContact CG2-CG2 4.28Å; I602-V795 CarbonylContact O-C 2.97Å; I602-V795 WeakPolarHBondContact O-CA 3.33Å; V604-V795 HydrophobicContact CB-CG1 3.8Å; V604-V795 HydrophobicContact CG1-CG1 3.6Å; S793-V795 PolarHBondContact OG-N 3.07Å
796	I	91.9	Very high	91	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.9	-178.6	-54.1	179.3	0	0	0	109	A601 I602 I603 V604 Q784 L787 R788 I798 I801	A601-I796 HydrophobicContact CB-CD1 3.54Å; A601-I796 HydrophobicContact CB-CG1 4.13Å; I602-I796 PolarHBondContact O-N 3.39Å; I603-I796 WeakPolarHBondContact CA-O 3.33Å; I603-I796 HydrophobicContact CD1-CB 4.24Å; V604-I796 PolarHBondContact N-O 3.44Å; Q784-I796 HydrophobicContact CB-CD1 4.19Å; Q784-I796 HydrophobicContact CG-CD1 4.23Å; L787-I796 HydrophobicContact CB-CD1 4.27Å; L787-I796 HydrophobicContact CB-CG2 4.43Å; L787-I796 HydrophobicContact CD1-CG2 3.84Å; R788-I796 HydrophobicContact CG-CD1 3.71Å; R788-I796 HydrophobicContact CG-CG1 3.94Å; I796-I798 PolarHBondContact O-N 2.92Å; I796-I801 HydrophobicContact CG2-CD1 4.28Å; I796-I801 HydrophobicContact CG2-CG1 3.91Å
797	P	92	Very high	91.1	Very high	16 Å²	16	42.6 Å²	42.6	10%	0.104	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	131.6	169	-20.7	32.7	0	0	0	111.2	V604 D731 G799 M800	V604-P797 HydrophobicContact CG1-CB 4.41Å; V604-P797 HydrophobicContact CG1-CG 4.44Å; D731-P797 HydrophobicContact CB-CB 4.06Å; D731-P797 WeakPolarHBondContact OD2-CB 3.25Å; P797-G799 PolarHBondContact O-N 3.21Å; P797-M800 HydrophobicContact CB-CG 4.29Å; P797-M800 HydrophobicContact CG-SD 4.16Å; P797-M800 PolarHBondContact O-N 3.33Å
798	I	93.8	Very high	91.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-59.6	-32.5	-172.3	-166.7	166.8	0	0	0	113.4	I603 V604 F605 D731 L734 M766 I796 M800 I801 L811 L812	I603-I798 HydrophobicContact CG2-CB 3.82Å; I603-I798 HydrophobicContact CG2-CD1 4.15Å; I603-I798 HydrophobicContact CG2-CG1 3.91Å; V604-I798 PolarHBondContact O-N 3.2Å; F605-I798 HydrophobicContact CD2-CG2 4.22Å; D731-I798 PolarHBondContact OD2-N 2.92Å; L734-I798 HydrophobicContact CD1-CG2 4Å; L734-I798 HydrophobicContact CD2-CG2 4.05Å; M766-I798 HydrophobicContact CE-CG1 3.94Å; I796-I798 PolarHBondContact O-N 2.92Å; I798-M800 PolarHBondContact O-N 3.5Å; I798-I801 PolarHBondContact O-N 3.43Å; I798-L811 HydrophobicContact CD1-CB 4.11Å; I798-L811 HydrophobicContact CD1-CD2 3.87Å; I798-L811 HydrophobicContact CD1-CG 3.67Å; I798-L812 HydrophobicContact CD1-CB 3.71Å; I798-L812 HydrophobicContact CD1-CD1 4.22Å; I798-L812 HydrophobicContact CG1-CB 4.19Å; I798-L812 HydrophobicContact CG1-CD1 4.29Å; I798-L812 HydrophobicContact CG2-CD1 4.32Å
799	G	90.4	Very high	91.5	Very high	14 Å²	14	41.3 Å²	41.3	14%	0.144	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-71	-13.6	178.5	0	0	0	0	0	114.4	D731 S733 P797	D731-G799 WeakPolarHBondContact OD1-CA 3.09Å; D731-G799 VanDerWaalsContact OD2-CA 3.31Å; D731-G799 WeakPolarHBondContact OD2-CA 3.38Å; D731-G799 PolarHBondContact OD2-N 2.9Å; S733-G799 WeakPolarHBondContact CB-O 3.34Å; P797-G799 PolarHBondContact O-N 3.21Å
800	M	91.4	Very high	91.9	Very high	67 Å²	67	34 Å²	34	33%	0.33	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-84.6	-11.2	173.9	-62.4	-170.4	77.6	0	0	113.1	L787 L791 P797 I798 N802	L787-M800 HydrophobicContact CD1-CB 4.33Å; L787-M800 HydrophobicContact CD2-CB 4.19Å; L787-M800 HydrophobicContact CD2-CE 4.17Å; L791-M800 HydrophobicContact CD1-SD 4.14Å; L791-M800 HydrophobicContact CD2-CE 4.32Å; L791-M800 HydrophobicContact CD2-SD 4.01Å; P797-M800 HydrophobicContact CB-CG 4.29Å; P797-M800 HydrophobicContact CG-SD 4.16Å; P797-M800 PolarHBondContact O-N 3.33Å; I798-M800 PolarHBondContact O-N 3.5Å; M800-N802 PolarHBondContact O-N 3.02Å
801	I	93.1	Very high	92.2	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	14%	0.139	C	C	.	.			trans	-83.3	101.7	-178.2	-57.1	174.6	0	0	0	109.4	I603 M766 L787 I796 I798 H808	I603-I801 HydrophobicContact CD1-CD1 3.78Å; I603-I801 HydrophobicContact CG1-CD1 4.41Å; I603-I801 HydrophobicContact CG2-CD1 4.06Å; M766-I801 HydrophobicContact CE-CB 4.17Å; M766-I801 HydrophobicContact CE-CG2 4.32Å; M766-I801 WeakPolarHBondContact CG-O 3.41Å; L787-I801 HydrophobicContact CD1-CG1 4.37Å; I796-I801 HydrophobicContact CG2-CD1 4.28Å; I796-I801 HydrophobicContact CG2-CG1 3.91Å; I798-I801 PolarHBondContact O-N 3.43Å; I801-H808 HydrophobicContact CG2-CB 4.38Å
802	N	91.9	Very high	92.7	Very high	85 Å²	85	24.6 Å²	24.6	46%	0.455	12%	0.123	S	C	.	.	S	Bend	trans	-96.9	-3.5	176.9	67.2	18.7	0	0	0	114.3	M766 G767 H783 M800	M766-N802 CarbonylContact C-O 3.49Å; G767-N802 WeakPolarHBondContact CA-O 3.35Å; G767-N802 PolarHBondContact N-O 3.27Å; G767-N802 VanDerWaalsContact N-O 3.09Å; H783-N802 PolarHBondContact CE1-OD1 3.14Å; H783-N802 PolarHBondContact ND1-OD1 3.13Å; H783-N802 PolarHBondContact NE2-N 3.08Å; H783-N802 PolarHBondContact NE2-OD1 3.33Å; M800-N802 PolarHBondContact O-N 3.02Å
803	K	91.5	Very high	93	Very high	82 Å²	82	15.8 Å²	15.8	36%	0.357	9%	0.085	S	C	.	.	S	Bend	trans	-127.7	87.5	172	-67.9	-176.7	-174	-179.9	0	109.4	L778 H783	L778-K803 HydrophobicContact CD1-CB 4.42Å; H783-K803 HydrophobicContact CB-CB 4.3Å; H783-K803 HydrophobicContact CB-CD 4.17Å
804	G	91.1	Very high	93.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.077	C	C	.	.			trans	-97.4	142.3	-172.4	0	0	0	0	0	114.1	M766 R809	M766-G804 PolarHBondContact O-N 3.13Å; G804-R809 PolarHBondContact O-NE 3Å
805	T	92.5	Very high	93.6	Very high	8 Å²	8	14.6 Å²	14.6	5%	0.049	8%	0.077	C	C	.	.			trans	-86.8	-179.4	167.9	62.7	0	0	0	0	110.1	W780 C807 H808 R809	W780-T805 HydrophobicContact CB-CG2 4.06Å; W780-T805 HydrophobicContact CD2-CG2 3.63Å; W780-T805 HydrophobicContact CE3-CG2 4.27Å; W780-T805 HydrophobicContact CG-CG2 3.51Å; T805-C807 VanDerWaalsContact C-N 3.26Å; T805-C807 PolarHBondContact O-N 2.69Å; T805-H808 PolarHBondContact N-ND1 2.83Å; T805-H808 PolarHBondContact O-N 2.8Å; T805-H808 PolarHBondContact OG1-CE1 3.48Å; T805-H808 PolarHBondContact OG1-ND1 3.34Å; T805-R809 WeakPolarHBondContact O-CB 3.35Å; T805-R809 WeakPolarHBondContact O-CG 3.31Å; T805-R809 PolarHBondContact O-N 3.41Å
806	Y	94.1	Very high	93.7	Very high	7 Å²	7	14.1 Å²	14.1	3%	0.027	7%	0.074	C	C	.	.	H	α-helix	trans	-51.7	-44.4	172.7	-61.1	-104.4	0	0	0	111.9	L775 A810 R833 M861 H862 Y878	L775-Y806 HydrophobicContact CD1-CE2 3.93Å; L775-Y806 WeakPolarHBondContact CD1-OH 3.35Å; L775-Y806 HydrophobicContact CD2-CE2 4.33Å; Y806-A810 WeakPolarHBondContact O-CB 3.46Å; Y806-A810 PolarHBondContact O-N 3.27Å; Y806-R833 PolarHBondContact OH-NH1 3.48Å; Y806-R833 VanDerWaalsContact OH-NH1 3.13Å; Y806-M861 HydrophobicContact CD1-CB 4.31Å; Y806-M861 HydrophobicContact CD1-CG 3.55Å; Y806-M861 HydrophobicContact CD2-CE 4.16Å; Y806-M861 HydrophobicContact CD2-CG 4.07Å; Y806-M861 HydrophobicContact CD2-SD 4.36Å; Y806-M861 HydrophobicContact CE1-CB 3.75Å; Y806-M861 HydrophobicContact CE1-CG 3.46Å; Y806-M861 VanDerWaalsContact CE1-CG 3.46Å; Y806-M861 HydrophobicContact CE2-CE 3.67Å; Y806-M861 HydrophobicContact CE2-CG 3.91Å; Y806-M861 HydrophobicContact CE2-SD 4.31Å; Y806-M861 HydrophobicContact CG-CG 3.84Å; Y806-H862 AromaticContact CZ-CE1 3.93Å; Y806-H862 PolarHBondContact OH-CE1 3.1Å; Y806-H862 PolarHBondContact OH-NE2 3.18Å; Y806-Y878 AromaticContact CD1-CE1 3.97Å; Y806-Y878 HydrophobicContact CD1-CE1 3.97Å; Y806-Y878 HydrophobicContact CD1-CE2 4.05Å; Y806-Y878 AromaticContact CD1-CZ 3.63Å; Y806-Y878 HydrophobicContact CE1-CD2 4.15Å; Y806-Y878 HydrophobicContact CE1-CE1 4.32Å; Y806-Y878 AromaticContact CE1-CE2 3.66Å; Y806-Y878 HydrophobicContact CE1-CE2 3.66Å; Y806-Y878 AromaticContact CE1-CZ 3.76Å
807	C	92.8	Very high	93.8	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.02	7%	0.074	C	C	.	.	H	α-helix	trans	-59.8	-50.3	176.4	-64.8	0	0	0	0	113.6	T805 R809 L811 N832 A834	T805-C807 VanDerWaalsContact C-N 3.26Å; T805-C807 PolarHBondContact O-N 2.69Å; C807-R809 VanDerWaalsContact C-N 3.35Å; C807-R809 PolarHBondContact O-N 2.84Å; C807-L811 VanDerWaalsContact O-CB 3.28Å; C807-L811 WeakPolarHBondContact O-CB 3.4Å; C807-L811 PolarHBondContact O-N 3.41Å; C807-N832 PolarHBondContact SG-O 2.94Å; C807-A834 HydrophobicContact CB-CB 4.37Å
808	H	94.1	Very high	93.9	Very high	8 Å²	8	14 Å²	14	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-64.6	-42.9	-177.5	-55.5	134.8	0	0	0	111.2	M766 Q784 I801 T805 L812	M766-H808 HydrophobicContact CE-CB 3.95Å; M766-H808 HydrophobicContact SD-CB 3.8Å; Q784-H808 PolarHBondContact NE2-CE1 3.04Å; Q784-H808 PolarHBondContact NE2-NE2 3.11Å; I801-H808 HydrophobicContact CG2-CB 4.38Å; T805-H808 PolarHBondContact N-ND1 2.83Å; T805-H808 PolarHBondContact O-N 2.8Å; T805-H808 PolarHBondContact OG1-CE1 3.48Å; T805-H808 PolarHBondContact OG1-ND1 3.34Å; H808-L812 WeakPolarHBondContact O-CB 3.32Å; H808-L812 PolarHBondContact O-N 2.97Å
809	R	96.1	Very high	93.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-68.2	-45.2	-179.5	-67.6	-179.3	-174.1	-132.9	-5.7	111.7	V762 S763 M766 G768 G804 T805 C807 L811 L812 F813 L860 M861	V762-R809 HydrophobicContact CG1-CB 3.97Å; V762-R809 HydrophobicContact CG1-CG 4.33Å; V762-R809 WeakPolarHBondContact CG1-O 3.4Å; S763-R809 VanDerWaalsContact CA-NH1 3.34Å; S763-R809 PolarHBondContact OG-NH1 2.85Å; M766-R809 HydrophobicContact CB-CG 3.96Å; M766-R809 HydrophobicContact CG-CG 4.3Å; M766-R809 PolarHBondContact O-NH2 3.38Å; M766-R809 HydrophobicContact SD-CB 4.24Å; M766-R809 HydrophobicContact SD-CG 3.52Å; M766-R809 VanDerWaalsContact SD-CG 3.52Å; G768-R809 PolarHBondContact O-NH1 3.45Å; G768-R809 PolarHBondContact O-NH2 2.88Å; G804-R809 PolarHBondContact O-NE 3Å; T805-R809 WeakPolarHBondContact O-CB 3.35Å; T805-R809 WeakPolarHBondContact O-CG 3.31Å; T805-R809 PolarHBondContact O-N 3.41Å; C807-R809 VanDerWaalsContact C-N 3.35Å; C807-R809 PolarHBondContact O-N 2.84Å; R809-L811 VanDerWaalsContact C-N 3.31Å; R809-L811 PolarHBondContact O-N 3.47Å; R809-L812 PolarHBondContact O-N 3.47Å; R809-F813 WeakPolarHBondContact O-CB 3.33Å; R809-F813 PolarHBondContact O-N 2.78Å; R809-L860 HydrophobicContact CB-CB 4.02Å; R809-L860 HydrophobicContact CB-CD1 4.07Å; R809-L860 VanDerWaalsContact CD-O 3.25Å; R809-L860 WeakPolarHBondContact CD-O 3.46Å; R809-L860 PolarHBondContact NH1-O 2.98Å; R809-M861 WeakPolarHBondContact CD-SD 3.34Å; R809-M861 PolarHBondContact NE-SD 3.49Å; R809-M861 VanDerWaalsContact NE-SD 3.37Å
810	A	96.9	Very high	93.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.1	-38.5	178.3	0	0	0	0	0	112.3	Y806 K814 L826 A834 N836 L860	Y806-A810 WeakPolarHBondContact O-CB 3.46Å; Y806-A810 PolarHBondContact O-N 3.27Å; A810-K814 PolarHBondContact O-N 3.39Å; A810-L826 HydrophobicContact CB-CD1 3.8Å; A810-A834 HydrophobicContact CB-CB 3.78Å; A810-N836 WeakPolarHBondContact CA-OD1 3.44Å; A810-N836 WeakPolarHBondContact CB-OD1 3.44Å; A810-N836 PolarHBondContact O-ND2 3.45Å; A810-N836 PolarHBondContact O-OD1 3.43Å; A810-L860 HydrophobicContact CB-CD1 4.31Å
811	L	95.9	Very high	93.8	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-47.4	174.5	179.6	61	0	0	0	111.4	I569 F573 D575 I603 I798 C807 R809 F813 K814 C815 L826	I569-L811 HydrophobicContact CD1-CD1 4.17Å; F573-L811 HydrophobicContact CD1-CD1 4.19Å; F573-L811 HydrophobicContact CE1-CD1 3.56Å; F573-L811 HydrophobicContact CZ-CD1 4.42Å; D575-L811 HydrophobicContact CB-CD2 3.94Å; I603-L811 HydrophobicContact CB-CD2 4.05Å; I603-L811 HydrophobicContact CG2-CD2 3.8Å; I798-L811 HydrophobicContact CD1-CB 4.11Å; I798-L811 HydrophobicContact CD1-CD2 3.87Å; I798-L811 HydrophobicContact CD1-CG 3.67Å; C807-L811 VanDerWaalsContact O-CB 3.28Å; C807-L811 WeakPolarHBondContact O-CB 3.4Å; C807-L811 PolarHBondContact O-N 3.41Å; R809-L811 VanDerWaalsContact C-N 3.31Å; R809-L811 PolarHBondContact O-N 3.47Å; L811-F813 VanDerWaalsContact C-N 3.33Å; L811-F813 PolarHBondContact O-N 3.04Å; L811-K814 PolarHBondContact O-N 3.3Å; L811-C815 PolarHBondContact O-N 2.93Å; L811-C815 PolarHBondContact O-SG 3.19Å; L811-L826 HydrophobicContact CD1-CD2 3.72Å
812	L	96	Very high	93.8	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-62.8	-41.3	177.6	-179.7	62.4	0	0	0	111.3	L734 L737 V762 A765 M766 I798 H808 R809 C815 L816	L734-L812 HydrophobicContact CD1-CD1 3.87Å; L737-L812 HydrophobicContact CD1-CD2 4.21Å; V762-L812 HydrophobicContact CG1-CB 4.33Å; V762-L812 HydrophobicContact CG1-CD2 4.24Å; V762-L812 HydrophobicContact CG1-CG 4.44Å; V762-L812 HydrophobicContact CG2-CD2 4.39Å; V762-L812 HydrophobicContact CG2-CG 4.25Å; A765-L812 HydrophobicContact CB-CD2 4.43Å; M766-L812 HydrophobicContact CE-CB 3.77Å; M766-L812 HydrophobicContact CE-CD2 3.68Å; M766-L812 HydrophobicContact CE-CG 4.28Å; M766-L812 HydrophobicContact CG-CD2 4.22Å; M766-L812 HydrophobicContact SD-CB 4.48Å; M766-L812 HydrophobicContact SD-CD2 4.28Å; I798-L812 HydrophobicContact CD1-CB 3.71Å; I798-L812 HydrophobicContact CD1-CD1 4.22Å; I798-L812 HydrophobicContact CG1-CB 4.19Å; I798-L812 HydrophobicContact CG1-CD1 4.29Å; I798-L812 HydrophobicContact CG2-CD1 4.32Å; H808-L812 WeakPolarHBondContact O-CB 3.32Å; H808-L812 PolarHBondContact O-N 2.97Å; R809-L812 PolarHBondContact O-N 3.47Å; L812-C815 PolarHBondContact O-N 3.42Å; L812-L816 HydrophobicContact CD1-CD1 4.04Å; L812-L816 HydrophobicContact CD1-CD2 4.46Å; L812-L816 HydrophobicContact CD1-CG 3.92Å; L812-L816 HydrophobicContact CD2-CD1 4.44Å; L812-L816 HydrophobicContact CG-CD1 3.97Å; L812-L816 HydrophobicContact CG-CG 4.24Å; L812-L816 WeakPolarHBondContact O-CB 3.12Å; L812-L816 WeakPolarHBondContact O-CG 3.34Å; L812-L816 PolarHBondContact O-N 2.79Å
813	F	97.2	Very high	93.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.2	-48.1	176.1	-175.7	-86.2	0	0	0	111.5	Y755 L758 A759 V762 R809 L811 C815 L816 A817 C824 N836 V838 V858 L860	Y755-F813 HydrophobicContact CD1-CE1 4.47Å; Y755-F813 AromaticContact CD1-CZ 3.93Å; Y755-F813 HydrophobicContact CD1-CZ 3.93Å; L758-F813 HydrophobicContact CB-CE2 3.94Å; L758-F813 HydrophobicContact CD2-CD2 4Å; L758-F813 HydrophobicContact CD2-CE1 4.38Å; L758-F813 HydrophobicContact CD2-CE2 3.7Å; L758-F813 HydrophobicContact CD2-CG 4.48Å; L758-F813 HydrophobicContact CD2-CZ 3.93Å; L758-F813 HydrophobicContact CG-CD2 3.85Å; L758-F813 HydrophobicContact CG-CE2 3.69Å; L758-F813 HydrophobicContact CG-CZ 4.4Å; A759-F813 HydrophobicContact CB-CD2 4.49Å; A759-F813 HydrophobicContact CB-CE2 4.04Å; V762-F813 HydrophobicContact CG1-CB 4.42Å; V762-F813 HydrophobicContact CG2-CB 4.05Å; V762-F813 HydrophobicContact CG2-CD2 4.11Å; R809-F813 WeakPolarHBondContact O-CB 3.33Å; R809-F813 PolarHBondContact O-N 2.78Å; L811-F813 VanDerWaalsContact C-N 3.33Å; L811-F813 PolarHBondContact O-N 3.04Å; F813-C815 PolarHBondContact O-N 3.13Å; F813-L816 PolarHBondContact O-N 2.8Å; F813-A817 WeakPolarHBondContact O-CB 3.48Å; F813-A817 PolarHBondContact O-N 2.87Å; F813-C824 HydrophobicContact CE1-CB 4.05Å; F813-N836 HydrophobicContact CD1-CB 3.72Å; F813-N836 VanDerWaalsContact CD1-CG 3.44Å; F813-N836 WeakPolarHBondContact CD1-OD1 3.16Å; F813-N836 HydrophobicContact CE1-CB 3.94Å; F813-V838 HydrophobicContact CE1-CG1 4.43Å; F813-V858 HydrophobicContact CE1-CG2 4.16Å; F813-V858 HydrophobicContact CE2-CG1 3.9Å; F813-V858 HydrophobicContact CZ-CB 4.33Å; F813-V858 HydrophobicContact CZ-CG1 3.98Å; F813-V858 HydrophobicContact CZ-CG2 3.88Å; F813-L860 HydrophobicContact CB-CD1 3.79Å; F813-L860 HydrophobicContact CB-CD2 4.35Å; F813-L860 HydrophobicContact CD2-CD1 4.45Å; F813-L860 HydrophobicContact CD2-CD2 3.58Å; F813-L860 HydrophobicContact CE2-CD2 4.14Å; F813-L860 HydrophobicContact CG-CD1 4.2Å; F813-L860 HydrophobicContact CG-CD2 4.16Å
814	K	96.4	Very high	93.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.6	-49	175.7	176.1	59.2	175.3	161.4	0	111.6	D567 I569 A810 L811 L816 A817 D818 C824 L826	D567-K814 WeakPolarHBondContact O-CE 3.37Å; D567-K814 PolarHBondContact O-NZ 2.96Å; I569-K814 HydrophobicContact CD1-CB 4.38Å; I569-K814 HydrophobicContact CD1-CG 3.56Å; I569-K814 HydrophobicContact CG1-CG 4.17Å; A810-K814 PolarHBondContact O-N 3.39Å; L811-K814 PolarHBondContact O-N 3.3Å; K814-L816 PolarHBondContact O-N 2.97Å; K814-A817 PolarHBondContact O-N 2.79Å; K814-D818 WeakPolarHBondContact CD-OD2 3.26Å; K814-D818 WeakPolarHBondContact CE-OD1 3.47Å; K814-D818 WeakPolarHBondContact CE-OD2 3.36Å; K814-D818 IonicContact NZ-OD1 2.67Å; K814-D818 PolarHBondContact NZ-OD1 3.08Å; K814-D818 IonicContact NZ-OD2 3.49Å; K814-D818 PolarHBondContact NZ-OD2 2.95Å; K814-D818 WeakPolarHBondContact O-CB 3.12Å; K814-D818 VanDerWaalsContact O-CG 3.27Å; K814-D818 PolarHBondContact O-N 2.81Å; K814-C824 WeakPolarHBondContact CD-O 3.49Å; K814-C824 WeakPolarHBondContact CD-SG 3.42Å; K814-C824 WeakPolarHBondContact CE-O 3.36Å; K814-C824 PolarHBondContact NZ-O 2.94Å; K814-L826 HydrophobicContact CB-CB 4.13Å; K814-L826 HydrophobicContact CB-CD2 4.46Å; K814-L826 HydrophobicContact CG-CB 4.01Å; K814-L826 HydrophobicContact CG-CD2 4.48Å
815	C	94.3	Very high	94.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.5	-46.6	-179.9	-65.6	0	0	0	0	112.2	F605 L811 L812 F813 T819	F605-C815 HydrophobicContact CD2-CB 3.46Å; F605-C815 VanDerWaalsContact CD2-CB 3.46Å; F605-C815 HydrophobicContact CE2-CB 3.49Å; F605-C815 VanDerWaalsContact CE2-CB 3.49Å; F605-C815 HydrophobicContact CG-CB 4.1Å; F605-C815 HydrophobicContact CZ-CB 4.16Å; L811-C815 PolarHBondContact O-N 2.93Å; L811-C815 PolarHBondContact O-SG 3.19Å; L812-C815 PolarHBondContact O-N 3.42Å; F813-C815 PolarHBondContact O-N 3.13Å; C815-T819 WeakPolarHBondContact O-CG2 3.47Å; C815-T819 PolarHBondContact O-N 3.16Å; C815-T819 VanDerWaalsContact O-N 3.13Å
816	L	94.3	Very high	94.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-68.6	-42.4	178.7	-69.1	179.2	0	0	0	111.6	L734 L737 I738 L758 V762 L812 F813 K814 D818 T819 I820	L734-L816 HydrophobicContact CD1-CD2 4.38Å; L737-L816 HydrophobicContact CB-CD2 4.28Å; I738-L816 HydrophobicContact CB-CD2 4.41Å; I738-L816 HydrophobicContact CG1-CD2 3.63Å; L758-L816 HydrophobicContact CD1-CB 3.83Å; L758-L816 HydrophobicContact CD1-CD1 4.19Å; V762-L816 HydrophobicContact CG2-CD1 3.87Å; L812-L816 HydrophobicContact CD1-CD1 4.04Å; L812-L816 HydrophobicContact CD1-CD2 4.46Å; L812-L816 HydrophobicContact CD1-CG 3.92Å; L812-L816 HydrophobicContact CD2-CD1 4.44Å; L812-L816 HydrophobicContact CG-CD1 3.97Å; L812-L816 HydrophobicContact CG-CG 4.24Å; L812-L816 WeakPolarHBondContact O-CB 3.12Å; L812-L816 WeakPolarHBondContact O-CG 3.34Å; L812-L816 PolarHBondContact O-N 2.79Å; F813-L816 PolarHBondContact O-N 2.8Å; K814-L816 PolarHBondContact O-N 2.97Å; L816-D818 VanDerWaalsContact C-N 3.31Å; L816-D818 PolarHBondContact O-N 3.4Å; L816-T819 PolarHBondContact O-N 3.44Å; L816-T819 VanDerWaalsContact O-N 3.1Å; L816-T819 PolarHBondContact O-OG1 3.28Å; L816-I820 WeakPolarHBondContact O-CG1 3.33Å; L816-I820 PolarHBondContact O-N 3.02Å; L816-I820 VanDerWaalsContact O-N 3.14Å
817	A	94.7	Very high	94.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-55.6	-47.1	175.6	0	0	0	0	0	110.9	L758 F813 K814 T819 I820 E821 K822 C824	L758-A817 HydrophobicContact CD2-CB 3.81Å; F813-A817 WeakPolarHBondContact O-CB 3.48Å; F813-A817 PolarHBondContact O-N 2.87Å; K814-A817 PolarHBondContact O-N 2.79Å; A817-T819 VanDerWaalsContact C-N 3.32Å; A817-T819 PolarHBondContact O-N 2.84Å; A817-I820 CarbonylContact O-C 3.54Å; A817-I820 WeakPolarHBondContact O-CG1 3.48Å; A817-I820 PolarHBondContact O-N 3.01Å; A817-I820 VanDerWaalsContact O-N 3.13Å; A817-E821 PolarHBondContact O-N 3.42Å; A817-E821 VanDerWaalsContact O-N 3.08Å; A817-K822 CarbonylContact C-O 3.58Å; A817-K822 HydrophobicContact CB-CB 4.1Å; A817-K822 WeakPolarHBondContact CB-O 3.44Å; A817-K822 PolarHBondContact O-N 3.15Å; A817-C824 VanDerWaalsContact CB-SG 3.54Å
818	D	94.2	Very high	94.5	Very high	13 Å²	13	19.5 Å²	19.5	7%	0.07	10%	0.101	C	C	.	.	H	α-helix	trans	-61.9	-37.7	176.7	-70.9	-18.5	0	0	0	112.1	I568 I569 K814 L816 I820 E821	I568-D818 HydrophobicContact CG2-CB 3.99Å; I569-D818 WeakPolarHBondContact CB-OD2 3.45Å; I569-D818 PolarHBondContact N-OD2 3.07Å; K814-D818 WeakPolarHBondContact CD-OD2 3.26Å; K814-D818 WeakPolarHBondContact CE-OD1 3.47Å; K814-D818 WeakPolarHBondContact CE-OD2 3.36Å; K814-D818 IonicContact NZ-OD1 2.67Å; K814-D818 PolarHBondContact NZ-OD1 3.08Å; K814-D818 IonicContact NZ-OD2 3.49Å; K814-D818 PolarHBondContact NZ-OD2 2.95Å; K814-D818 WeakPolarHBondContact O-CB 3.12Å; K814-D818 VanDerWaalsContact O-CG 3.27Å; K814-D818 PolarHBondContact O-N 2.81Å; L816-D818 VanDerWaalsContact C-N 3.31Å; L816-D818 PolarHBondContact O-N 3.4Å; D818-I820 VanDerWaalsContact C-N 3.26Å; D818-I820 PolarHBondContact O-N 3.36Å; D818-E821 PolarHBondContact O-N 3.35Å
819	T	90.9	Very high	94.3	Very high	36 Å²	36	20.1 Å²	20.1	22%	0.221	11%	0.109	C	C	.	.	H	α-helix	trans	-70	-18.4	176.9	69.1	0	0	0	0	115	F605 I738 K742 C815 L816 A817	F605-T819 HydrophobicContact CZ-CG2 3.82Å; I738-T819 HydrophobicContact CD1-CG2 4.08Å; I738-T819 HydrophobicContact CG1-CG2 4.15Å; K742-T819 WeakPolarHBondContact CE-O 3.43Å; C815-T819 WeakPolarHBondContact O-CG2 3.47Å; C815-T819 PolarHBondContact O-N 3.16Å; C815-T819 VanDerWaalsContact O-N 3.13Å; L816-T819 PolarHBondContact O-N 3.44Å; L816-T819 VanDerWaalsContact O-N 3.1Å; L816-T819 PolarHBondContact O-OG1 3.28Å; A817-T819 VanDerWaalsContact C-N 3.32Å; A817-T819 PolarHBondContact O-N 2.84Å
820	I	91.3	Very high	93.7	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.041	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	16.4	176.1	69.6	171.4	0	0	0	112.2	A741 K742 V745 L746 L758 L816 A817 D818 K822	A741-I820 HydrophobicContact CB-CG2 4.05Å; K742-I820 HydrophobicContact CG-CG2 3.77Å; V745-I820 HydrophobicContact CB-CD1 4.14Å; V745-I820 HydrophobicContact CG1-CD1 3.86Å; L746-I820 HydrophobicContact CD1-CB 4.49Å; L746-I820 HydrophobicContact CD2-CB 4.31Å; L746-I820 HydrophobicContact CG-CB 4.43Å; L758-I820 HydrophobicContact CD1-CD1 4.39Å; L758-I820 HydrophobicContact CD2-CD1 4.18Å; L816-I820 WeakPolarHBondContact O-CG1 3.33Å; L816-I820 PolarHBondContact O-N 3.02Å; L816-I820 VanDerWaalsContact O-N 3.14Å; A817-I820 CarbonylContact O-C 3.54Å; A817-I820 WeakPolarHBondContact O-CG1 3.48Å; A817-I820 PolarHBondContact O-N 3.01Å; A817-I820 VanDerWaalsContact O-N 3.13Å; D818-I820 VanDerWaalsContact C-N 3.26Å; D818-I820 PolarHBondContact O-N 3.36Å; I820-K822 VanDerWaalsContact C-N 3.32Å; I820-K822 HydrophobicContact CD1-CG 4.04Å; I820-K822 HydrophobicContact CG1-CB 4.17Å; I820-K822 HydrophobicContact CG1-CG 3.93Å; I820-K822 PolarHBondContact O-N 3.12Å
821	E	90.8	Very high	92.9	Very high	181 Å²	181	35.3 Å²	35.3	85%	0.846	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	36.3	176.7	-56.4	177.6	-172	0	0	113.9	A817 D818	A817-E821 PolarHBondContact O-N 3.42Å; A817-E821 VanDerWaalsContact O-N 3.08Å; D818-E821 PolarHBondContact O-N 3.35Å
822	K	92.1	Very high	92.1	Very high	33 Å²	33	38.9 Å²	38.9	14%	0.143	20%	0.196	C	C	.	.			trans	-105.2	128.1	175	-73	-58	-169	178.2	0	112.8	E751 Y755 A817 I820 C824	E751-K822 IonicContact OE1-NZ 2.63Å; E751-K822 PolarHBondContact OE1-NZ 3.47Å; Y755-K822 HydrophobicContact CE1-CB 3.97Å; Y755-K822 HydrophobicContact CE1-CG 4.49Å; A817-K822 CarbonylContact C-O 3.58Å; A817-K822 HydrophobicContact CB-CB 4.1Å; A817-K822 WeakPolarHBondContact CB-O 3.44Å; A817-K822 PolarHBondContact O-N 3.15Å; I820-K822 VanDerWaalsContact C-N 3.32Å; I820-K822 HydrophobicContact CD1-CG 4.04Å; I820-K822 HydrophobicContact CG1-CB 4.17Å; I820-K822 HydrophobicContact CG1-CG 3.93Å; I820-K822 PolarHBondContact O-N 3.12Å; K822-C824 PolarHBondContact O-N 2.74Å
823	S	91.4	Very high	91.8	Very high	65 Å²	65	39.7 Å²	39.7	46%	0.455	20%	0.199	S	C	.	.			trans	-81.2	112.1	-175.4	-67.5	0	0	0	0	111.9	Y755	Y755-S823 PolarHBondContact OH-N 3.01Å; Y755-S823 PolarHBondContact OH-O 2.86Å; Y755-S823 VanDerWaalsContact OH-O 3.05Å
824	C	95.3	Very high	91.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-142.8	155.3	169.8	68.4	0	0	0	0	111.8	A565 F813 K814 A817 K822 N836 E837 V838	A565-C824 WeakPolarHBondContact CA-O 3.33Å; F813-C824 HydrophobicContact CE1-CB 4.05Å; K814-C824 WeakPolarHBondContact CD-O 3.49Å; K814-C824 WeakPolarHBondContact CD-SG 3.42Å; K814-C824 WeakPolarHBondContact CE-O 3.36Å; K814-C824 PolarHBondContact NZ-O 2.94Å; A817-C824 VanDerWaalsContact CB-SG 3.54Å; K822-C824 PolarHBondContact O-N 2.74Å; C824-N836 HydrophobicContact CB-CB 4.41Å; C824-E837 WeakPolarHBondContact CA-O 3.49Å; C824-V838 HydrophobicContact CB-CG1 3.74Å
825	T	96.8	Very high	91.6	Very high	11 Å²	11	40.9 Å²	40.9	7%	0.067	20%	0.204	C	C	.	.			trans	-83.7	165.6	171.9	72.8	0	0	0	0	110.4	L563 N836 E837	L563-T825 WeakPolarHBondContact O-CA 3.27Å; L563-T825 WeakPolarHBondContact O-CB 3.09Å; T825-N836 VanDerWaalsContact O-CA 3.31Å; T825-N836 WeakPolarHBondContact O-CA 3.37Å; T825-N836 WeakPolarHBondContact O-CB 3.45Å; T825-N836 PolarHBondContact O-ND2 3.05Å; T825-E837 HydrophobicContact CG2-CB 4.07Å; T825-E837 PolarHBondContact N-O 2.96Å; T825-E837 WeakPolarHBondContact OG1-CA 3.36Å; T825-E837 WeakPolarHBondContact OG1-CB 3.36Å; T825-E837 WeakPolarHBondContact OG1-CG 3.14Å; T825-E837 PolarHBondContact OG1-N 3.17Å; T825-E837 PolarHBondContact OG1-OE2 2.63Å
826	L	97	Very high	91.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	115.2	164.9	175	64.3	0	0	0	107.7	Y557 R562 L563 A810 L811 K814	Y557-L826 HydrophobicContact CD1-CD2 4.2Å; Y557-L826 HydrophobicContact CD2-CD2 4.16Å; Y557-L826 HydrophobicContact CD2-CG 4.35Å; Y557-L826 HydrophobicContact CE1-CD2 3.71Å; Y557-L826 HydrophobicContact CE1-CG 4.34Å; Y557-L826 HydrophobicContact CE2-CB 4.45Å; Y557-L826 HydrophobicContact CE2-CD2 3.73Å; Y557-L826 HydrophobicContact CE2-CG 3.6Å; Y557-L826 HydrophobicContact CG-CD2 4.4Å; Y557-L826 VanDerWaalsContact CZ-CD2 3.49Å; R562-L826 CarbonylContact C-O 3.5Å; R562-L826 VanDerWaalsContact CA-O 3.29Å; R562-L826 WeakPolarHBondContact CA-O 3.45Å; L563-L826 HydrophobicContact CB-CB 4.2Å; L563-L826 HydrophobicContact CD1-CD2 4.26Å; L563-L826 PolarHBondContact N-O 3.39Å; L563-L826 PolarHBondContact O-N 3.39Å; A810-L826 HydrophobicContact CB-CD1 3.8Å; L811-L826 HydrophobicContact CD1-CD2 3.72Å; K814-L826 HydrophobicContact CB-CB 4.13Å; K814-L826 HydrophobicContact CB-CD2 4.46Å; K814-L826 HydrophobicContact CG-CB 4.01Å; K814-L826 HydrophobicContact CG-CD2 4.48Å
827	V	95.4	Very high	91.9	Very high	13 Å²	13	41.9 Å²	41.9	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.8	-176.5	-169.1	0	0	0	0	109.4	R562 A834 W835 E837	R562-V827 HydrophobicContact CG-CG2 4.16Å; V827-A834 CarbonylContact O-C 3.47Å; V827-A834 WeakPolarHBondContact O-CA 3.47Å; V827-A834 VanDerWaalsContact O-CB 3.25Å; V827-A834 WeakPolarHBondContact O-CB 3.45Å; V827-W835 HydrophobicContact CB-CD2 4.1Å; V827-W835 HydrophobicContact CB-CG 4.4Å; V827-W835 HydrophobicContact CB-CZ2 3.93Å; V827-W835 HydrophobicContact CG1-CD2 4.42Å; V827-W835 HydrophobicContact CG1-CH2 3.97Å; V827-W835 HydrophobicContact CG1-CZ2 3.38Å; V827-W835 PolarHBondContact N-O 2.94Å; V827-W835 PolarHBondContact O-N 2.99Å; V827-E837 HydrophobicContact CG2-CG 4.36Å
828	R	93.2	Very high	91.9	Very high	39 Å²	39	41.9 Å²	41.9	15%	0.147	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.4	172	-173.5	-178.4	-59.6	-74.4	1.6	108.8	Y557 G561 D575	Y557-R828 HydrophobicContact CE2-CB 4.22Å; G561-R828 VanDerWaalsContact O-CB 3.29Å; G561-R828 WeakPolarHBondContact O-CB 3.49Å; G561-R828 PolarHBondContact O-N 3.38Å; D575-R828 IonicContact OD1-CZ 2.73Å; D575-R828 IonicContact OD1-NH2 2.67Å; D575-R828 PolarHBondContact OD1-NH2 2.99Å; D575-R828 IonicContact OD2-CZ 2.93Å; D575-R828 IonicContact OD2-NH1 2.7Å; D575-R828 IonicContact OD2-NH2 3.81Å; D575-R828 PolarHBondContact OD2-NH2 3.32Å
829	G	89.3	Confident	91.8	Very high	20 Å²	20	45.7 Å²	45.7	21%	0.206	23%	0.229	C	C	.	.			trans	-108.5	-170.3	168.1	0	0	0	0	0	111.8	R833	G829-R833 PolarHBondContact N-O 3.43Å
830	D	83.7	Confident	91.7	Very high	127 Å²	127	44.5 Å²	44.5	68%	0.679	22%	0.221	S	C	*	.	S	Bend	trans	-75.2	161.2	179.3	-61.5	-43.2	0	0	0	112.2	N832 R833	D830-N832 PolarHBondContact O-N 2.83Å; D830-R833 VanDerWaalsContact O-CB 3.25Å; D830-R833 WeakPolarHBondContact O-CB 3.23Å; D830-R833 WeakPolarHBondContact O-CG 3.49Å; D830-R833 PolarHBondContact O-N 3.27Å
831	Y	80.6	Confident	91.3	Very high	193 Å²	193	50.5 Å²	50.5	76%	0.757	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	45.8	169.1	-55.7	-78.2	0	0	0	115.3	R833 I881	Y831-R833 VanDerWaalsContact C-N 3.27Å; Y831-R833 PolarHBondContact O-N 3.16Å; Y831-I881 HydrophobicContact CD2-CD1 4.08Å; Y831-I881 HydrophobicContact CG-CD1 3.86Å
832	N	78.9	Confident	90.3	Very high	76 Å²	76	46 Å²	46	41%	0.406	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	22.5	-176.9	-64	-43.5	0	0	0	115.1	C807 D830	C807-N832 PolarHBondContact SG-O 2.94Å; D830-N832 PolarHBondContact O-N 2.83Å
833	R	89.4	Confident	88.8	Confident	18 Å²	18	52.8 Å²	52.8	7%	0.068	26%	0.258	C	S	.	.			trans	-80	141.9	164.9	-68.2	-67.5	-161.5	-128.3	3.8	110.7	Y806 G829 D830 Y831 Y878 T880	Y806-R833 PolarHBondContact OH-NH1 3.48Å; Y806-R833 VanDerWaalsContact OH-NH1 3.13Å; G829-R833 PolarHBondContact N-O 3.43Å; D830-R833 VanDerWaalsContact O-CB 3.25Å; D830-R833 WeakPolarHBondContact O-CB 3.23Å; D830-R833 WeakPolarHBondContact O-CG 3.49Å; D830-R833 PolarHBondContact O-N 3.27Å; Y831-R833 VanDerWaalsContact C-N 3.27Å; Y831-R833 PolarHBondContact O-N 3.16Å; R833-Y878 PolarHBondContact NE-O 3.42Å; R833-T880 PolarHBondContact NE-O 2.99Å; R833-T880 PolarHBondContact NH2-O 3.46Å; R833-T880 VanDerWaalsContact NH2-O 3.14Å
834	A	94.4	Very high	87.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	155.5	164.4	0	0	0	0	0	108.9	C807 A810 V827	C807-A834 HydrophobicContact CB-CB 4.37Å; A810-A834 HydrophobicContact CB-CB 3.78Å; V827-A834 CarbonylContact O-C 3.47Å; V827-A834 WeakPolarHBondContact O-CA 3.47Å; V827-A834 VanDerWaalsContact O-CB 3.25Å; V827-A834 WeakPolarHBondContact O-CB 3.45Å
835	W	96.7	Very high	85.1	Confident	25 Å²	25	62.2 Å²	62.2	10%	0.095	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	166.6	179.9	62	92.9	0	0	0	111.4	V827 E837 I857 Y878 Q879	V827-W835 HydrophobicContact CB-CD2 4.1Å; V827-W835 HydrophobicContact CB-CG 4.4Å; V827-W835 HydrophobicContact CB-CZ2 3.93Å; V827-W835 HydrophobicContact CG1-CD2 4.42Å; V827-W835 HydrophobicContact CG1-CH2 3.97Å; V827-W835 HydrophobicContact CG1-CZ2 3.38Å; V827-W835 PolarHBondContact N-O 2.94Å; V827-W835 PolarHBondContact O-N 2.99Å; W835-E837 PolarHBondContact NE1-OE1 3.11Å; W835-E837 VanDerWaalsContact NE1-OE1 3.08Å; W835-I857 HydrophobicContact CB-CG2 3.92Å; W835-I857 HydrophobicContact CG-CD1 4.48Å; W835-I857 HydrophobicContact CG-CG2 4.28Å; W835-Y878 HydrophobicContact CB-CD1 4.21Å; W835-Y878 HydrophobicContact CB-CE1 3.87Å; W835-Q879 HydrophobicContact CD2-CG 3.88Å; W835-Q879 VanDerWaalsContact CE2-NE2 3.28Å; W835-Q879 HydrophobicContact CE3-CB 4.38Å; W835-Q879 HydrophobicContact CE3-CG 3.95Å; W835-Q879 HydrophobicContact CH2-CB 4.19Å; W835-Q879 HydrophobicContact CH2-CG 4.02Å; W835-Q879 HydrophobicContact CZ2-CG 3.94Å; W835-Q879 VanDerWaalsContact CZ2-NE2 3.3Å; W835-Q879 HydrophobicContact CZ3-CB 4.07Å; W835-Q879 HydrophobicContact CZ3-CG 4.01Å
836	N	97.4	Very high	82.9	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.336	C	S	.	.			trans	-115.8	134.8	173.2	-53.4	95.5	0	0	0	108.9	A810 F813 C824 T825 V858 L860	A810-N836 WeakPolarHBondContact CA-OD1 3.44Å; A810-N836 WeakPolarHBondContact CB-OD1 3.44Å; A810-N836 PolarHBondContact O-ND2 3.45Å; A810-N836 PolarHBondContact O-OD1 3.43Å; F813-N836 HydrophobicContact CD1-CB 3.72Å; F813-N836 VanDerWaalsContact CD1-CG 3.44Å; F813-N836 WeakPolarHBondContact CD1-OD1 3.16Å; F813-N836 HydrophobicContact CE1-CB 3.94Å; C824-N836 HydrophobicContact CB-CB 4.41Å; T825-N836 VanDerWaalsContact O-CA 3.31Å; T825-N836 WeakPolarHBondContact O-CA 3.37Å; T825-N836 WeakPolarHBondContact O-CB 3.45Å; T825-N836 PolarHBondContact O-ND2 3.05Å; N836-V858 PolarHBondContact O-N 3.38Å; N836-V858 VanDerWaalsContact O-N 3.13Å; N836-L860 WeakPolarHBondContact OD1-CD1 3.25Å
837	E	96	Very high	80.7	Confident	21 Å²	21	76.1 Å²	76.1	10%	0.098	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.5	173.6	-52.6	158.7	167.5	0	0	108.2	R562 C824 T825 V827 W835 Y856 I870	R562-E837 IonicContact CZ-OE2 3.85Å; R562-E837 IonicContact NE-OE2 3.76Å; R562-E837 IonicContact NH2-OE2 2.69Å; R562-E837 PolarHBondContact NH2-OE2 2.98Å; C824-E837 WeakPolarHBondContact CA-O 3.49Å; T825-E837 HydrophobicContact CG2-CB 4.07Å; T825-E837 PolarHBondContact N-O 2.96Å; T825-E837 WeakPolarHBondContact OG1-CA 3.36Å; T825-E837 WeakPolarHBondContact OG1-CB 3.36Å; T825-E837 WeakPolarHBondContact OG1-CG 3.14Å; T825-E837 PolarHBondContact OG1-N 3.17Å; T825-E837 PolarHBondContact OG1-OE2 2.63Å; V827-E837 HydrophobicContact CG2-CG 4.36Å; W835-E837 PolarHBondContact NE1-OE1 3.11Å; W835-E837 VanDerWaalsContact NE1-OE1 3.08Å; E837-Y856 CarbonylContact C-O 3.48Å; E837-Y856 VanDerWaalsContact CA-O 3.26Å; E837-Y856 WeakPolarHBondContact CA-O 3.23Å; E837-I870 HydrophobicContact CG-CD1 4.47Å
838	V	95	Very high	78.6	Confident	1 Å²	1	84 Å²	84	1%	0.006	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142.4	178	-62.2	0	0	0	0	109.4	Y755 F813 C824 C855 Y856 V858 L867	Y755-V838 HydrophobicContact CD1-CB 4.37Å; Y755-V838 HydrophobicContact CD1-CG1 3.65Å; Y755-V838 HydrophobicContact CD2-CB 4.39Å; Y755-V838 HydrophobicContact CD2-CG2 4.46Å; Y755-V838 HydrophobicContact CE1-CB 4.2Å; Y755-V838 HydrophobicContact CE1-CG1 3.55Å; Y755-V838 HydrophobicContact CE2-CB 4.24Å; Y755-V838 HydrophobicContact CE2-CG1 4.45Å; Y755-V838 HydrophobicContact CG-CB 4.46Å; Y755-V838 HydrophobicContact CG-CG1 4.14Å; Y755-V838 HydrophobicContact CG-CG2 4.5Å; F813-V838 HydrophobicContact CE1-CG1 4.43Å; C824-V838 HydrophobicContact CB-CG1 3.74Å; V838-C855 WeakPolarHBondContact O-CA 3.46Å; V838-Y856 PolarHBondContact N-O 2.85Å; V838-Y856 PolarHBondContact O-N 2.86Å; V838-V858 HydrophobicContact CB-CG2 4.48Å; V838-V858 HydrophobicContact CG1-CG2 3.73Å; V838-V858 HydrophobicContact CG2-CG2 3.91Å; V838-L867 HydrophobicContact CG2-CD2 4.24Å
839	L	91.9	Very high	77	Confident	93 Å²	93	91.8 Å²	91.8	49%	0.487	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.4	-179.9	-166.6	72.4	0	0	0	108.9	P853 C855	L839-P853 HydrophobicContact CD1-CB 3.79Å; L839-P853 HydrophobicContact CD1-CG 4.45Å; L839-P853 HydrophobicContact CD2-CB 3.93Å; L839-P853 HydrophobicContact CD2-CG 4.4Å; L839-P853 HydrophobicContact CG-CB 3.75Å; L839-C855 HydrophobicContact CD1-CB 4.33Å
840	L	89.2	Confident	75.6	Confident	11 Å²	11	95.4 Å²	95.4	6%	0.058	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145	179.1	-64.1	175	0	0	0	110.6	E751 R752 Y755 P853 I854 Y856 L867	E751-L840 HydrophobicContact CB-CD2 4.34Å; E751-L840 HydrophobicContact CG-CD2 3.64Å; R752-L840 HydrophobicContact CB-CD1 4.26Å; R752-L840 HydrophobicContact CG-CD1 4.01Å; Y755-L840 HydrophobicContact CD2-CD2 3.88Å; Y755-L840 HydrophobicContact CE2-CD2 3.71Å; L840-P853 CarbonylContact O-C 3.55Å; L840-P853 WeakPolarHBondContact O-CA 3.27Å; L840-I854 PolarHBondContact N-O 2.77Å; L840-I854 PolarHBondContact O-N 2.9Å; L840-Y856 HydrophobicContact CB-CD2 4.26Å; L840-Y856 HydrophobicContact CB-CE2 3.95Å; L840-Y856 HydrophobicContact CD1-CD2 4.11Å; L840-Y856 HydrophobicContact CD1-CE2 4.21Å; L840-Y856 HydrophobicContact CG-CD2 4.34Å; L840-Y856 HydrophobicContact CG-CE2 4.46Å; L840-L867 HydrophobicContact CD1-CD1 3.49Å; L840-L867 VanDerWaalsContact CD1-CD1 3.49Å
841	F	81.9	Confident	74.7	Confident	133 Å²	133	92.6 Å²	92.6	58%	0.583	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.6	171.7	-66.1	-89.5	0	0	0	109	P853	F841-P853 HydrophobicContact CD1-CB 3.96Å; F841-P853 HydrophobicContact CE1-CB 3.74Å; F841-P853 HydrophobicContact CE1-CG 4.06Å; F841-P853 HydrophobicContact CG-CB 4.5Å; F841-P853 HydrophobicContact CZ-CB 4.09Å
842	E	71.2	Confident	74.3	Confident	87 Å²	87	89.8 Å²	89.8	41%	0.407	44%	0.444	S	S	.	.			trans	-76.8	132.2	172.9	-73.1	-165.5	160.1	0	0	110.5	V844 P851 I854 Y856	E842-V844 PolarHBondContact O-N 2.93Å; E842-P851 WeakPolarHBondContact O-CB 3.46Å; E842-I854 VanDerWaalsContact CD-CD1 3.46Å; E842-I854 HydrophobicContact CG-CD1 3.89Å; E842-I854 WeakPolarHBondContact OE2-CD1 3.34Å; E842-Y856 WeakPolarHBondContact CG-OH 3.35Å; E842-Y856 PolarHBondContact OE1-OH 3.03Å
843	E	59.6	Low	74.4	Confident	176 Å²	176	89.1 Å²	89.1	82%	0.822	44%	0.444	S	S	*	.			trans	-70.6	109.3	170.3	-68.2	-171.8	166.6	0	0	109.5	H845	E843-H845 PolarHBondContact O-N 3.46Å
844	V	55.6	Low	74.4	Confident	92 Å²	92	91 Å²	91	56%	0.558	45%	0.454	S	S	*	.			trans	-78.6	111.4	175.9	-173.5	0	0	0	0	109.5	E842 E846	E842-V844 PolarHBondContact O-N 2.93Å; V844-E846 PolarHBondContact O-N 3.22Å
845	H	53.5	Low	74.2	Confident	170 Å²	170	92.7 Å²	92.7	79%	0.787	47%	0.466	S	S	*	.			trans	-72.3	108.9	163.4	-75.7	-60.4	0	0	0	109.9	E843	E843-H845 PolarHBondContact O-N 3.46Å
846	E	51.7	Low	74.1	Confident	172 Å²	172	91.7 Å²	91.7	80%	0.804	46%	0.462	S	S	*	.	S	Bend	trans	58.2	87	166.7	-62.8	-172.9	168.7	0	0	117.8	V844	V844-E846 PolarHBondContact O-N 3.22Å
847	N	49.3	Very low	74.1	Confident	132 Å²	132	91.7 Å²	91.7	71%	0.706	46%	0.462	S	S	*	.	S	Bend		151.6	114	125.8	-79.1	-51.6	0	0	0	113.1	R849	N847-R849 PolarHBondContact O-N 3Å
848	L	53	Low	74.1	Confident	178 Å²	178	90.7 Å²	90.7	93%	0.932	46%	0.457	S	S	*	.	S	Bend	trans	49.7	28.8	146.5	-78	151.4	0	0	0	121
849	R	59.4	Low	74.2	Confident	203 Å²	203	91 Å²	91	77%	0.766	46%	0.459	S	S	*	.	S	Bend	trans	-132.4	142	156.5	-73.6	-170.5	-177.1	-173	2	110.9	N847	N847-R849 PolarHBondContact O-N 3Å
850	S	59.6	Low	74.4	Confident	96 Å²	96	86.6 Å²	86.6	67%	0.671	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-55.3	138.1	168.3	44.6	0	0	0	0	109.5	E852	S850-E852 PolarHBondContact O-N 2.97Å; S850-E852 VanDerWaalsContact O-N 3.12Å
851	P	63.6	Low	74.6	Confident	67 Å²	67	86.1 Å²	86.1	44%	0.435	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-60.2	117.7	178.4	24.3	-32	0	0	0	109.3	E842	E842-P851 WeakPolarHBondContact O-CB 3.46Å
852	E	72.4	Confident	75.2	Confident	135 Å²	135	81.9 Å²	81.9	63%	0.631	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-80.4	131.4	173.2	-72.9	-179.8	-171.9	0	0	108.3	S850	S850-E852 PolarHBondContact O-N 2.97Å; S850-E852 VanDerWaalsContact O-N 3.12Å
853	P	82.6	Confident	76.3	Confident	62 Å²	62	83.8 Å²	83.8	40%	0.403	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	133	178	29.2	-33.6	0	0	0	110.2	L839 L840 F841	L839-P853 HydrophobicContact CD1-CB 3.79Å; L839-P853 HydrophobicContact CD1-CG 4.45Å; L839-P853 HydrophobicContact CD2-CB 3.93Å; L839-P853 HydrophobicContact CD2-CG 4.4Å; L839-P853 HydrophobicContact CG-CB 3.75Å; L840-P853 CarbonylContact O-C 3.55Å; L840-P853 WeakPolarHBondContact O-CA 3.27Å; F841-P853 HydrophobicContact CD1-CB 3.96Å; F841-P853 HydrophobicContact CE1-CB 3.74Å; F841-P853 HydrophobicContact CE1-CG 4.06Å; F841-P853 HydrophobicContact CG-CB 4.5Å; F841-P853 HydrophobicContact CZ-CB 4.09Å
854	I	87.7	Confident	78	Confident	57 Å²	57	76.5 Å²	76.5	29%	0.292	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.8	179	-56.5	-178.7	0	0	0	109.1	L840 E842 Y856	L840-I854 PolarHBondContact N-O 2.77Å; L840-I854 PolarHBondContact O-N 2.9Å; E842-I854 VanDerWaalsContact CD-CD1 3.46Å; E842-I854 HydrophobicContact CG-CD1 3.89Å; E842-I854 WeakPolarHBondContact OE2-CD1 3.34Å; I854-Y856 HydrophobicContact CB-CD2 4.49Å; I854-Y856 HydrophobicContact CB-CE2 3.62Å; I854-Y856 HydrophobicContact CG2-CD2 4.27Å; I854-Y856 HydrophobicContact CG2-CE1 4.17Å; I854-Y856 HydrophobicContact CG2-CE2 3.63Å; I854-Y856 WeakPolarHBondContact O-CD2 3.24Å; I854-Y856 WeakPolarHBondContact O-CE2 3.43Å
855	C	91.8	Very high	79.7	Confident	36 Å²	36	72.7 Å²	72.7	24%	0.243	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.3	177.2	-168	0	0	0	0	110.4	V838 L839 I870	V838-C855 WeakPolarHBondContact O-CA 3.46Å; L839-C855 HydrophobicContact CD1-CB 4.33Å; C855-I870 HydrophobicContact CB-CB 4.49Å; C855-I870 HydrophobicContact CB-CG2 4.26Å; C855-I870 PolarHBondContact O-N 3.36Å
856	Y	94.7	Very high	81.7	Confident	3 Å²	3	67.1 Å²	67.1	1%	0.012	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.4	179.1	-58.6	-97.7	0	0	0	111.2	E837 V838 L840 E842 I854 L867 M868 P869	E837-Y856 CarbonylContact C-O 3.48Å; E837-Y856 VanDerWaalsContact CA-O 3.26Å; E837-Y856 WeakPolarHBondContact CA-O 3.23Å; V838-Y856 PolarHBondContact N-O 2.85Å; V838-Y856 PolarHBondContact O-N 2.86Å; L840-Y856 HydrophobicContact CB-CD2 4.26Å; L840-Y856 HydrophobicContact CB-CE2 3.95Å; L840-Y856 HydrophobicContact CD1-CD2 4.11Å; L840-Y856 HydrophobicContact CD1-CE2 4.21Å; L840-Y856 HydrophobicContact CG-CD2 4.34Å; L840-Y856 HydrophobicContact CG-CE2 4.46Å; E842-Y856 WeakPolarHBondContact CG-OH 3.35Å; E842-Y856 PolarHBondContact OE1-OH 3.03Å; I854-Y856 HydrophobicContact CB-CD2 4.49Å; I854-Y856 HydrophobicContact CB-CE2 3.62Å; I854-Y856 HydrophobicContact CG2-CD2 4.27Å; I854-Y856 HydrophobicContact CG2-CE1 4.17Å; I854-Y856 HydrophobicContact CG2-CE2 3.63Å; I854-Y856 WeakPolarHBondContact O-CD2 3.24Å; I854-Y856 WeakPolarHBondContact O-CE2 3.43Å; Y856-L867 HydrophobicContact CD1-CB 3.93Å; Y856-L867 HydrophobicContact CG-CB 4.09Å; Y856-M868 CarbonylContact C-O 3.28Å; Y856-M868 VanDerWaalsContact CA-O 3.24Å; Y856-M868 WeakPolarHBondContact CA-O 3.27Å; Y856-P869 HydrophobicContact CD1-CB 4.46Å; Y856-P869 HydrophobicContact CD1-CG 4.09Å; Y856-P869 HydrophobicContact CE1-CB 4.44Å; Y856-P869 HydrophobicContact CE1-CG 3.87Å
857	I	96.5	Very high	83.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132	164.4	-60.4	-175	0	0	0	108.8	W835 M868 I870 A875 Y878 Q879	W835-I857 HydrophobicContact CB-CG2 3.92Å; W835-I857 HydrophobicContact CG-CD1 4.48Å; W835-I857 HydrophobicContact CG-CG2 4.28Å; I857-M868 HydrophobicContact CB-CE 4.19Å; I857-M868 HydrophobicContact CG2-CE 3.86Å; I857-M868 PolarHBondContact N-O 2.67Å; I857-M868 PolarHBondContact O-N 3.18Å; I857-I870 HydrophobicContact CD1-CG1 4.4Å; I857-I870 HydrophobicContact CG1-CG1 4.37Å; I857-A875 HydrophobicContact CD1-CB 3.73Å; I857-A875 HydrophobicContact CG1-CB 4.33Å; I857-Y878 HydrophobicContact CG2-CD1 3.87Å; I857-Y878 HydrophobicContact CG2-CE1 4.19Å; I857-Q879 VanDerWaalsContact CD1-CD 3.41Å; I857-Q879 HydrophobicContact CD1-CG 3.63Å
858	V	96.7	Very high	85.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	117.5	175	-170.8	0	0	0	0	109.6	A759 F813 N836 V838 L860 L867	A759-V858 HydrophobicContact CB-CG1 3.59Å; F813-V858 HydrophobicContact CE1-CG2 4.16Å; F813-V858 HydrophobicContact CE2-CG1 3.9Å; F813-V858 HydrophobicContact CZ-CB 4.33Å; F813-V858 HydrophobicContact CZ-CG1 3.98Å; F813-V858 HydrophobicContact CZ-CG2 3.88Å; N836-V858 PolarHBondContact O-N 3.38Å; N836-V858 VanDerWaalsContact O-N 3.13Å; V838-V858 HydrophobicContact CB-CG2 4.48Å; V838-V858 HydrophobicContact CG1-CG2 3.73Å; V838-V858 HydrophobicContact CG2-CG2 3.91Å; V858-L860 HydrophobicContact CG1-CD2 3.84Å; V858-L860 HydrophobicContact CG1-CG 4.34Å; V858-L860 PolarHBondContact O-N 3.1Å; V858-L867 HydrophobicContact CB-CD2 4.29Å; V858-L867 HydrophobicContact CG1-CD2 4.21Å; V858-L867 HydrophobicContact CG2-CD2 3.84Å
859	D	96.5	Very high	87.8	Confident	8 Å²	8	48.5 Å²	48.5	4%	0.043	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-72.4	121.3	169.1	-170.9	-17.4	0	0	0	109.1	M861 H862 Q863 P864 G865 T866 M868 Y878	D859-M861 PolarHBondContact OD1-N 3.39Å; D859-H862 PolarHBondContact OD1-N 2.89Å; D859-H862 IonicContact OD2-ND1 2.77Å; D859-Q863 WeakPolarHBondContact CB-O 3.42Å; D859-Q863 PolarHBondContact OD1-N 3.48Å; D859-Q863 PolarHBondContact OD2-N 3.12Å; D859-P864 VanDerWaalsContact O-CA 3.27Å; D859-P864 WeakPolarHBondContact O-CA 3.38Å; D859-G865 PolarHBondContact O-N 2.83Å; D859-T866 PolarHBondContact N-O 3.02Å; D859-M868 HydrophobicContact CB-CE 3.86Å; D859-Y878 HydrophobicContact CB-CE2 4.28Å; D859-Y878 WeakPolarHBondContact OD1-CE2 3.37Å
860	L	96.3	Very high	89.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.234	C	C	.	.			trans	-113.5	-2.5	177.2	-60.2	175	0	0	0	112.5	A759 V762 R809 A810 F813 N836 V858 Y878	A759-L860 HydrophobicContact CB-CD2 3.59Å; V762-L860 HydrophobicContact CG1-CD2 4.42Å; R809-L860 HydrophobicContact CB-CB 4.02Å; R809-L860 HydrophobicContact CB-CD1 4.07Å; R809-L860 VanDerWaalsContact CD-O 3.25Å; R809-L860 WeakPolarHBondContact CD-O 3.46Å; R809-L860 PolarHBondContact NH1-O 2.98Å; A810-L860 HydrophobicContact CB-CD1 4.31Å; F813-L860 HydrophobicContact CB-CD1 3.79Å; F813-L860 HydrophobicContact CB-CD2 4.35Å; F813-L860 HydrophobicContact CD2-CD1 4.45Å; F813-L860 HydrophobicContact CD2-CD2 3.58Å; F813-L860 HydrophobicContact CE2-CD2 4.14Å; F813-L860 HydrophobicContact CG-CD1 4.2Å; F813-L860 HydrophobicContact CG-CD2 4.16Å; N836-L860 WeakPolarHBondContact OD1-CD1 3.25Å; V858-L860 HydrophobicContact CG1-CD2 3.84Å; V858-L860 HydrophobicContact CG1-CG 4.34Å; V858-L860 PolarHBondContact O-N 3.1Å; L860-Y878 PolarHBondContact N-OH 3.12Å; L860-Y878 VanDerWaalsContact N-OH 3.15Å
861	M	93.8	Very high	90.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.239	C	C	.	.	S	Bend	trans	-117.9	-60.3	-168.8	-75.1	-68.9	-61.7	0	0	112.4	A769 V770 L775 L778 Y806 R809 D859 Y878	A769-M861 CarbonylContact C-O 3.6Å; A769-M861 WeakPolarHBondContact CA-O 3.44Å; V770-M861 HydrophobicContact CB-CE 4.25Å; V770-M861 HydrophobicContact CG2-CE 4.43Å; V770-M861 PolarHBondContact N-O 3.21Å; L775-M861 HydrophobicContact CD1-CE 3.9Å; L778-M861 HydrophobicContact CD2-CE 4.47Å; Y806-M861 HydrophobicContact CD1-CB 4.31Å; Y806-M861 HydrophobicContact CD1-CG 3.55Å; Y806-M861 HydrophobicContact CD2-CE 4.16Å; Y806-M861 HydrophobicContact CD2-CG 4.07Å; Y806-M861 HydrophobicContact CD2-SD 4.36Å; Y806-M861 HydrophobicContact CE1-CB 3.75Å; Y806-M861 HydrophobicContact CE1-CG 3.46Å; Y806-M861 VanDerWaalsContact CE1-CG 3.46Å; Y806-M861 HydrophobicContact CE2-CE 3.67Å; Y806-M861 HydrophobicContact CE2-CG 3.91Å; Y806-M861 HydrophobicContact CE2-SD 4.31Å; Y806-M861 HydrophobicContact CG-CG 3.84Å; R809-M861 WeakPolarHBondContact CD-SD 3.34Å; R809-M861 PolarHBondContact NE-SD 3.49Å; R809-M861 VanDerWaalsContact NE-SD 3.37Å; D859-M861 PolarHBondContact OD1-N 3.39Å; M861-Y878 HydrophobicContact CB-CE2 4.23Å
862	H	93.6	Very high	91.8	Very high	44 Å²	44	41.3 Å²	41.3	20%	0.204	23%	0.226	C	C	.	.	S	Bend	trans	-93.7	-48.4	-168.3	-45.8	107.4	0	0	0	111.9	V770 L772 Y806 D859 Y878	V770-H862 WeakPolarHBondContact O-CA 3.43Å; V770-H862 PolarHBondContact O-CD2 2.7Å; V770-H862 VanDerWaalsContact O-CD2 3.28Å; L772-H862 VanDerWaalsContact CD1-NE2 3.33Å; L772-H862 WeakPolarHBondContact CD1-NE2 3.47Å; Y806-H862 AromaticContact CZ-CE1 3.93Å; Y806-H862 PolarHBondContact OH-CE1 3.1Å; Y806-H862 PolarHBondContact OH-NE2 3.18Å; D859-H862 PolarHBondContact OD1-N 2.89Å; D859-H862 IonicContact OD2-ND1 2.77Å; H862-Y878 AromaticContact ND1-CD2 3.94Å
863	Q	93.9	Very high	92.7	Very high	127 Å²	127	39.9 Å²	39.9	59%	0.593	23%	0.229	S	C	*	.	S	Bend	trans	-128	75.9	174.5	-62.9	-174.9	-4.3	0	0	109.5	D859 G865 T866	D859-Q863 WeakPolarHBondContact CB-O 3.42Å; D859-Q863 PolarHBondContact OD1-N 3.48Å; D859-Q863 PolarHBondContact OD2-N 3.12Å; Q863-G865 PolarHBondContact O-N 3.18Å; Q863-T866 WeakPolarHBondContact CB-OG1 3.2Å; Q863-T866 WeakPolarHBondContact O-CB 3.47Å; Q863-T866 PolarHBondContact O-N 3.11Å; Q863-T866 PolarHBondContact O-OG1 3.31Å
864	P	95.2	Very high	93	Very high	24 Å²	24	39.1 Å²	39.1	16%	0.156	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	121.3	-175.5	-28.2	35	0	0	0	113.4	R760 S763 A769 D859	R760-P864 HydrophobicContact CG-CB 4.23Å; R760-P864 WeakPolarHBondContact CG-O 3.33Å; S763-P864 VanDerWaalsContact CB-CG 3.47Å; S763-P864 WeakPolarHBondContact OG-CG 3.44Å; A769-P864 HydrophobicContact CB-CG 3.82Å; D859-P864 VanDerWaalsContact O-CA 3.27Å; D859-P864 WeakPolarHBondContact O-CA 3.38Å
865	G	91.9	Very high	93.2	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	-4.2	-179.7	0	0	0	0	0	115.5	A756 D859 Q863 L867	A756-G865 WeakPolarHBondContact CB-O 3.43Å; D859-G865 PolarHBondContact O-N 2.83Å; Q863-G865 PolarHBondContact O-N 3.18Å; G865-L867 PolarHBondContact O-N 2.74Å
866	T	95.6	Very high	93.1	Very high	54 Å²	54	40 Å²	40	33%	0.331	23%	0.227	S	C	.	.			trans	-68.1	126.2	167.2	-63.9	0	0	0	0	109.9	D859 Q863 M868	D859-T866 PolarHBondContact N-O 3.02Å; Q863-T866 WeakPolarHBondContact CB-OG1 3.2Å; Q863-T866 WeakPolarHBondContact O-CB 3.47Å; Q863-T866 PolarHBondContact O-N 3.11Å; Q863-T866 PolarHBondContact O-OG1 3.31Å; T866-M868 HydrophobicContact CG2-CG 4.15Å
867	L	94.6	Very high	92.9	Very high	17 Å²	17	45.6 Å²	45.6	9%	0.089	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.3	175.3	-59.2	-173.6	0	0	0	110.1	R752 V838 L840 Y856 V858 G865	R752-L867 HydrophobicContact CG-CD1 3.54Å; V838-L867 HydrophobicContact CG2-CD2 4.24Å; L840-L867 HydrophobicContact CD1-CD1 3.49Å; L840-L867 VanDerWaalsContact CD1-CD1 3.49Å; Y856-L867 HydrophobicContact CD1-CB 3.93Å; Y856-L867 HydrophobicContact CG-CB 4.09Å; V858-L867 HydrophobicContact CB-CD2 4.29Å; V858-L867 HydrophobicContact CG1-CD2 4.21Å; V858-L867 HydrophobicContact CG2-CD2 3.84Å; G865-L867 PolarHBondContact O-N 2.74Å
868	M	94.6	Very high	92.6	Very high	15 Å²	15	45.9 Å²	45.9	7%	0.074	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.2	-176.5	-61.5	173.6	-69.3	0	0	109.7	Y856 I857 D859 T866 I870 A874 A875 Y878	Y856-M868 CarbonylContact C-O 3.28Å; Y856-M868 VanDerWaalsContact CA-O 3.24Å; Y856-M868 WeakPolarHBondContact CA-O 3.27Å; I857-M868 HydrophobicContact CB-CE 4.19Å; I857-M868 HydrophobicContact CG2-CE 3.86Å; I857-M868 PolarHBondContact N-O 2.67Å; I857-M868 PolarHBondContact O-N 3.18Å; D859-M868 HydrophobicContact CB-CE 3.86Å; T866-M868 HydrophobicContact CG2-CG 4.15Å; M868-I870 PolarHBondContact O-N 2.8Å; M868-A874 HydrophobicContact CG-CB 4.19Å; M868-A874 HydrophobicContact SD-CB 3.79Å; M868-A875 HydrophobicContact CB-CB 4.17Å; M868-Y878 HydrophobicContact CE-CD1 4.35Å; M868-Y878 HydrophobicContact CE-CD2 3.87Å; M868-Y878 HydrophobicContact CE-CG 3.77Å
869	P	92.9	Very high	92.2	Very high	58 Å²	58	48 Å²	48	38%	0.377	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	135.9	172.8	-23.2	31.8	0	0	0	110.2	Y856 D871 S872 A875	Y856-P869 HydrophobicContact CD1-CB 4.46Å; Y856-P869 HydrophobicContact CD1-CG 4.09Å; Y856-P869 HydrophobicContact CE1-CB 4.44Å; Y856-P869 HydrophobicContact CE1-CG 3.87Å; P869-D871 PolarHBondContact O-N 3.32Å; P869-D871 VanDerWaalsContact O-N 3.1Å; P869-S872 WeakPolarHBondContact O-CB 3.37Å; P869-S872 PolarHBondContact O-N 3.41Å; P869-S872 PolarHBondContact O-OG 3.08Å; P869-A875 VanDerWaalsContact O-CB 3.25Å; P869-A875 WeakPolarHBondContact O-CB 3.34Å
870	I	88.9	Confident	91.6	Very high	49 Å²	49	51.5 Å²	51.5	25%	0.251	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.1	-170.3	-162.5	165.9	0	0	0	113.5	E837 C855 I857 M868 S872 A875	E837-I870 HydrophobicContact CG-CD1 4.47Å; C855-I870 HydrophobicContact CB-CB 4.49Å; C855-I870 HydrophobicContact CB-CG2 4.26Å; C855-I870 PolarHBondContact O-N 3.36Å; I857-I870 HydrophobicContact CD1-CG1 4.4Å; I857-I870 HydrophobicContact CG1-CG1 4.37Å; M868-I870 PolarHBondContact O-N 2.8Å; I870-S872 VanDerWaalsContact C-N 3.33Å; I870-S872 PolarHBondContact O-N 3.17Å; I870-A875 WeakPolarHBondContact O-CB 3.33Å
871	D	86	Confident	90.5	Very high	143 Å²	143	59.3 Å²	59.3	77%	0.765	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	2.9	179.6	-59.8	-48.2	0	0	0	114	P869	P869-D871 PolarHBondContact O-N 3.32Å; P869-D871 VanDerWaalsContact O-N 3.1Å
872	S	92.6	Very high	90.3	Very high	23 Å²	23	62.3 Å²	62.3	16%	0.161	34%	0.342	C	S	.	.	S	Bend	trans	-76.7	150.9	-178.9	70.6	0	0	0	0	112.2	P869 I870 A874 A875 Q876	P869-S872 WeakPolarHBondContact O-CB 3.37Å; P869-S872 PolarHBondContact O-N 3.41Å; P869-S872 PolarHBondContact O-OG 3.08Å; I870-S872 VanDerWaalsContact C-N 3.33Å; I870-S872 PolarHBondContact O-N 3.17Å; S872-A874 PolarHBondContact O-N 3.24Å; S872-A875 WeakPolarHBondContact O-CB 3.42Å; S872-A875 PolarHBondContact O-N 3.02Å; S872-A875 VanDerWaalsContact O-N 3.1Å; S872-A875 WeakPolarHBondContact OG-CB 3.42Å; S872-A875 PolarHBondContact OG-N 2.86Å; S872-Q876 PolarHBondContact O-N 3.36Å; S872-Q876 VanDerWaalsContact O-N 3.12Å
873	P	90.9	Very high	90.1	Very high	106 Å²	106	63.2 Å²	63.2	69%	0.688	35%	0.349	S	S	*	.	H	α-helix	trans	-56.7	-32.1	172.7	-25.9	34.6	0	0	0	113.2	Q876 Q877	P873-Q876 PolarHBondContact O-N 3.29Å; P873-Q877 WeakPolarHBondContact O-CB 3.49Å; P873-Q877 PolarHBondContact O-N 3.42Å
874	A	89.3	Confident	89.9	Confident	46 Å²	46	59.7 Å²	59.7	38%	0.38	34%	0.336	S	S	.	.	H	α-helix	trans	-66.9	-42.4	177	0	0	0	0	0	112	M868 S872 Q877 Y878	M868-A874 HydrophobicContact CG-CB 4.19Å; M868-A874 HydrophobicContact SD-CB 3.79Å; S872-A874 PolarHBondContact O-N 3.24Å; A874-Q877 PolarHBondContact O-N 3.14Å; A874-Y878 WeakPolarHBondContact O-CB 3.39Å; A874-Y878 PolarHBondContact O-N 3.42Å
875	A	91	Very high	89.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-45.2	174.2	0	0	0	0	0	111.8	I857 M868 P869 I870 S872 Q877 Y878 Q879	I857-A875 HydrophobicContact CD1-CB 3.73Å; I857-A875 HydrophobicContact CG1-CB 4.33Å; M868-A875 HydrophobicContact CB-CB 4.17Å; P869-A875 VanDerWaalsContact O-CB 3.25Å; P869-A875 WeakPolarHBondContact O-CB 3.34Å; I870-A875 WeakPolarHBondContact O-CB 3.33Å; S872-A875 WeakPolarHBondContact O-CB 3.42Å; S872-A875 PolarHBondContact O-N 3.02Å; S872-A875 VanDerWaalsContact O-N 3.1Å; S872-A875 WeakPolarHBondContact OG-CB 3.42Å; S872-A875 PolarHBondContact OG-N 2.86Å; A875-Q877 VanDerWaalsContact C-N 3.34Å; A875-Q877 PolarHBondContact O-N 2.91Å; A875-Y878 WeakPolarHBondContact O-CB 3.42Å; A875-Y878 PolarHBondContact O-N 3.22Å; A875-Y878 VanDerWaalsContact O-N 3.12Å; A875-Q879 WeakPolarHBondContact O-CG 3.5Å; A875-Q879 PolarHBondContact O-N 2.69Å
876	Q	89.7	Confident	89.5	Confident	112 Å²	112	64.9 Å²	64.9	52%	0.523	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-41.8	176.8	-69.3	-180	-5.6	0	0	112.5	S872 P873 Y878 Q879 T880	S872-Q876 PolarHBondContact O-N 3.36Å; S872-Q876 VanDerWaalsContact O-N 3.12Å; P873-Q876 PolarHBondContact O-N 3.29Å; Q876-Y878 VanDerWaalsContact C-N 3.3Å; Q876-Y878 PolarHBondContact O-N 3.21Å; Q876-Q879 PolarHBondContact O-N 3.31Å; Q876-T880 PolarHBondContact O-N 3.03Å; Q876-T880 VanDerWaalsContact O-N 3.07Å; Q876-T880 PolarHBondContact O-OG1 3.27Å
877	Q	89.6	Confident	89.1	Confident	120 Å²	120	65.7 Å²	65.7	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-66.4	-32.6	176	-172.8	179.1	6	0	0	112.2	P873 A874 A875	P873-Q877 WeakPolarHBondContact O-CB 3.49Å; P873-Q877 PolarHBondContact O-N 3.42Å; A874-Q877 PolarHBondContact O-N 3.14Å; A875-Q877 VanDerWaalsContact C-N 3.34Å; A875-Q877 PolarHBondContact O-N 2.91Å
878	Y	90.1	Very high	88.7	Confident	6 Å²	6	69.1 Å²	69.1	2%	0.024	38%	0.382	C	S	.	.	H	α-helix	trans	-70.5	-37.4	176.1	-168	-92.1	0	0	0	112.2	Y806 R833 W835 I857 D859 L860 M861 H862 M868 A874 A875 Q876	Y806-Y878 AromaticContact CD1-CE1 3.97Å; Y806-Y878 HydrophobicContact CD1-CE1 3.97Å; Y806-Y878 HydrophobicContact CD1-CE2 4.05Å; Y806-Y878 AromaticContact CD1-CZ 3.63Å; Y806-Y878 HydrophobicContact CE1-CD2 4.15Å; Y806-Y878 HydrophobicContact CE1-CE1 4.32Å; Y806-Y878 AromaticContact CE1-CE2 3.66Å; Y806-Y878 HydrophobicContact CE1-CE2 3.66Å; Y806-Y878 AromaticContact CE1-CZ 3.76Å; R833-Y878 PolarHBondContact NE-O 3.42Å; W835-Y878 HydrophobicContact CB-CD1 4.21Å; W835-Y878 HydrophobicContact CB-CE1 3.87Å; I857-Y878 HydrophobicContact CG2-CD1 3.87Å; I857-Y878 HydrophobicContact CG2-CE1 4.19Å; D859-Y878 HydrophobicContact CB-CE2 4.28Å; D859-Y878 WeakPolarHBondContact OD1-CE2 3.37Å; L860-Y878 PolarHBondContact N-OH 3.12Å; L860-Y878 VanDerWaalsContact N-OH 3.15Å; M861-Y878 HydrophobicContact CB-CE2 4.23Å; H862-Y878 AromaticContact ND1-CD2 3.94Å; M868-Y878 HydrophobicContact CE-CD1 4.35Å; M868-Y878 HydrophobicContact CE-CD2 3.87Å; M868-Y878 HydrophobicContact CE-CG 3.77Å; A874-Y878 WeakPolarHBondContact O-CB 3.39Å; A874-Y878 PolarHBondContact O-N 3.42Å; A875-Y878 WeakPolarHBondContact O-CB 3.42Å; A875-Y878 PolarHBondContact O-N 3.22Å; A875-Y878 VanDerWaalsContact O-N 3.12Å; Q876-Y878 VanDerWaalsContact C-N 3.3Å; Q876-Y878 PolarHBondContact O-N 3.21Å
879	Q	89.8	Confident	88.2	Confident	43 Å²	43	73.3 Å²	73.3	20%	0.201	41%	0.406	C	S	.	.	H	α-helix	trans	-77	-28.7	-178.6	-69.5	174.1	-44	0	0	113.3	W835 I857 A875 Q876	W835-Q879 HydrophobicContact CD2-CG 3.88Å; W835-Q879 VanDerWaalsContact CE2-NE2 3.28Å; W835-Q879 HydrophobicContact CE3-CB 4.38Å; W835-Q879 HydrophobicContact CE3-CG 3.95Å; W835-Q879 HydrophobicContact CH2-CB 4.19Å; W835-Q879 HydrophobicContact CH2-CG 4.02Å; W835-Q879 HydrophobicContact CZ2-CG 3.94Å; W835-Q879 VanDerWaalsContact CZ2-NE2 3.3Å; W835-Q879 HydrophobicContact CZ3-CB 4.07Å; W835-Q879 HydrophobicContact CZ3-CG 4.01Å; I857-Q879 VanDerWaalsContact CD1-CD 3.41Å; I857-Q879 HydrophobicContact CD1-CG 3.63Å; A875-Q879 WeakPolarHBondContact O-CG 3.5Å; A875-Q879 PolarHBondContact O-N 2.69Å; Q876-Q879 PolarHBondContact O-N 3.31Å
880	T	82.9	Confident	87.8	Confident	83 Å²	83	74.6 Å²	74.6	51%	0.509	41%	0.409	S	S	.	.			trans	-110	175.2	-174	62.4	0	0	0	0	112.6	R833 Q876	R833-T880 PolarHBondContact NE-O 2.99Å; R833-T880 PolarHBondContact NH2-O 3.46Å; R833-T880 VanDerWaalsContact NH2-O 3.14Å; Q876-T880 PolarHBondContact O-N 3.03Å; Q876-T880 VanDerWaalsContact O-N 3.07Å; Q876-T880 PolarHBondContact O-OG1 3.27Å
881	I	73.5	Confident	87.8	Confident	164 Å²	164	76.9 Å²	76.9	84%	0.841	42%	0.423	S	S	*	.			trans	-114.5	0	174.2	-66.8	-171.7	0	0	0	108.9	Y831	Y831-I881 HydrophobicContact CD2-CD1 4.08Å; Y831-I881 HydrophobicContact CG-CD1 3.86Å

Retrieved 881 of 881 residues in 222.4 ms (Link to these results)

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