A0A096N3N2_PAPAN Loading...

Telomeric repeat-binding factor 2-interacting protein 1

Acts both as a regulator of telomere function and as a transcription regulator. Involved in the regulation of telomere length and protection as a component of the shelterin complex (telosome). Does not bind DNA directly: recruited to telomeric double-stranded 5'-TTAGGG-3' repeats via its interaction with terf2. Independently of its function in telomeres, also acts as a transcription regulator: recruited to extratelomeric 5'-TTAGGG-3' sites via its association with terf2 or other factors, and regulates gene expression.

AlphaFold DB (Q4R4I0), UniProt , Accession A0A096N3N2, Species PAPAN (Papio anubis, Olive baboon), Gene TERF2IP, Length 400 aa.

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(Predicted Aligned Error values between residue pairs)

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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	38.9	Very low	45.7	Very low	249 Å²	249	150.1 Å²	150.1	100%	1.227	86%	0.859	S	S	*	*				0	113.6	0	-78.5	172	176	0	0	105.9
2	A	41	Very low	46.6	Very low	108 Å²	108	151.2 Å²	151.2	89%	0.893	86%	0.86	S	S	*	*			trans	-92.2	114.1	-174.2	0	0	0	0	0	108.7
3	E	40.1	Very low	47.4	Very low	195 Å²	195	141.5 Å²	141.5	91%	0.911	82%	0.815	S	S	*	*			trans	-102.1	113.5	160.9	-84.7	-178.6	116.5	0	0	107.2
4	A	45.3	Very low	48.5	Very low	104 Å²	104	136.4 Å²	136.4	86%	0.86	79%	0.789	S	S	*	*			trans	-68.7	125.4	178.9	0	0	0	0	0	109.6	D6	A4-D6 PolarHBondContact O-N 2.7Å
5	M	47.2	Very low	50.3	Low	176 Å²	176	132.7 Å²	132.7	87%	0.867	77%	0.769	S	S	*	*			trans	-72.4	115.8	170	-67.5	175.3	167.2	0	0	108.5	L7	M5-L7 PolarHBondContact O-N 2.95Å
6	D	47.9	Very low	52.6	Low	166 Å²	166	125.1 Å²	125.1	89%	0.888	72%	0.724	S	S	*	*			trans	-59.8	108.8	170.7	-168.5	30.5	0	0	0	108.9	A4	A4-D6 PolarHBondContact O-N 2.7Å
7	L	50.8	Low	54.9	Low	157 Å²	157	120.4 Å²	120.4	82%	0.822	70%	0.7	S	S	*	*			trans	-74.7	135.5	179.4	-92.1	106.2	0	0	0	110.3	M5 K9	M5-L7 PolarHBondContact O-N 2.95Å; L7-K9 PolarHBondContact O-N 2.75Å
8	G	43.8	Very low	56.8	Low	73 Å²	73	117.9 Å²	117.9	75%	0.753	69%	0.691	S	S	*	*			trans	-44.1	122.6	-176.6	0	0	0	0	0	114.3	D10	G8-D10 PolarHBondContact O-N 3.31Å
9	K	48.2	Very low	58.6	Low	175 Å²	175	116.3 Å²	116.3	76%	0.761	68%	0.683	S	S	*	*			trans	-79.8	98.9	172.8	-158.9	155	-173.3	169	0	108.3	L7	L7-K9 PolarHBondContact O-N 2.75Å
10	D	44.6	Very low	60.3	Low	121 Å²	121	111.1 Å²	111.1	65%	0.647	65%	0.651	S	S	*	*			trans	-54.7	124.1	168.4	-79.3	-65.5	0	0	0	108.9	G8 N12 G13	G8-D10 PolarHBondContact O-N 3.31Å; D10-N12 PolarHBondContact O-N 2.92Å; D10-G13 PolarHBondContact O-N 3.48Å
11	P	55.3	Low	61.9	Low	127 Å²	127	105.8 Å²	105.8	83%	0.825	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-9.9	-178.5	25.6	-33.7	0	0	0	113.3
12	N	56.1	Low	64.5	Low	163 Å²	163	95.6 Å²	95.6	87%	0.872	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	3.1	174	-78.9	-16.9	0	0	0	113.4	D10	D10-N12 PolarHBondContact O-N 2.92Å
13	G	57.4	Low	66.8	Low	26 Å²	26	95.7 Å²	95.7	27%	0.268	55%	0.55	S	S	.	.	S	Bend	trans	-75.5	149.6	178.1	0	0	0	0	0	111.7	D10 T15	D10-G13 PolarHBondContact O-N 3.48Å; G13-T15 WeakPolarHBondContact O-CG2 3.2Å; G13-T15 PolarHBondContact O-N 2.94Å
14	P	61.7	Low	69	Low	69 Å²	69	96.6 Å²	96.6	45%	0.448	55%	0.554	S	S	.	*			trans	-59.9	126.1	176.8	-19.8	31.7	0	0	0	111.3	H48	P14-H48 HydrophobicContact CB-CB 4Å; P14-H48 WeakPolarHBondContact CB-CD2 3.43Å; P14-H48 WeakPolarHBondContact CB-CE1 3.43Å; P14-H48 VanDerWaalsContact CB-ND1 3.27Å; P14-H48 WeakPolarHBondContact CB-ND1 3.4Å; P14-H48 WeakPolarHBondContact CB-NE2 3.22Å; P14-H48 HydrophobicContact CG-CB 4.25Å; P14-H48 WeakPolarHBondContact CG-CD2 3.49Å
15	T	76.3	Confident	71	Confident	81 Å²	81	96.9 Å²	96.9	50%	0.497	54%	0.541	S	S	.	.			trans	-94	1.4	-168.5	54.6	0	0	0	0	115	G13 V88	G13-T15 WeakPolarHBondContact O-CG2 3.2Å; G13-T15 PolarHBondContact O-N 2.94Å; T15-V88 WeakPolarHBondContact OG1-CG1 3.39Å
16	H	87.6	Confident	72.9	Confident	12 Å²	12	91 Å²	91	6%	0.056	53%	0.526	C	S	.	.	S	Bend	trans	-129.6	166.7	-168.9	65.4	-79.4	0	0	0	112.2	L20 L45 H48 G49 V88 N91	H16-L20 HydrophobicContact CB-CD2 4.02Å; H16-L20 WeakPolarHBondContact CD2-CD2 3.36Å; H16-L45 PolarHBondContact CE1-O 3.24Å; H16-L45 VanDerWaalsContact CE1-O 3.25Å; H16-L45 PolarHBondContact NE2-O 2.99Å; H16-H48 AromaticContact CE1-ND1 3.63Å; H16-H48 AromaticContact NE2-ND1 3.6Å; H16-H48 PolarHBondContact O-CE1 2.85Å; H16-H48 PolarHBondContact O-ND1 2.96Å; H16-G49 WeakPolarHBondContact NE2-CA 3.37Å; H16-G49 PolarHBondContact NE2-N 2.93Å; H16-V88 HydrophobicContact CB-CB 4.48Å; H16-V88 HydrophobicContact CB-CG1 4.21Å; H16-V88 WeakPolarHBondContact ND1-CG1 3.04Å; H16-N91 WeakPolarHBondContact CA-OD1 3.32Å; H16-N91 WeakPolarHBondContact CB-OD1 3.23Å
17	S	90.2	Very high	75	Confident	45 Å²	45	85.9 Å²	85.9	32%	0.315	50%	0.502	S	S	.	.			trans	-57.7	139.2	-179.2	179.7	0	0	0	0	111.7	T19 L20 G49 N91	S17-T19 PolarHBondContact O-N 3.39Å; S17-T19 VanDerWaalsContact O-N 3.09Å; S17-T19 PolarHBondContact OG-N 3.31Å; S17-T19 PolarHBondContact OG-OG1 3.22Å; S17-L20 WeakPolarHBondContact O-CB 3.43Å; S17-L20 PolarHBondContact O-N 3.42Å; S17-G49 WeakPolarHBondContact O-CA 3.37Å; S17-N91 WeakPolarHBondContact CB-OD1 3.35Å; S17-N91 PolarHBondContact N-OD1 3.18Å
18	S	90.4	Very high	76.9	Confident	76 Å²	76	80.8 Å²	80.8	53%	0.531	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-2.6	176.6	57.6	0	0	0	0	114.6	H48 G49 G50	S18-H48 WeakPolarHBondContact CA-O 3.25Å; S18-G49 VanDerWaalsContact C-C 3.49Å; S18-G49 CarbonylContact C-O 3.58Å; S18-G49 CarbonylContact O-C 3.32Å; S18-G50 WeakPolarHBondContact O-CA 3.13Å; S18-G50 PolarHBondContact O-N 3.05Å
19	T	90.9	Very high	79.2	Confident	87 Å²	87	77.4 Å²	77.4	53%	0.534	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	7.5	-179.7	52.5	0	0	0	0	112.9	S17 F21 V22 G49	S17-T19 PolarHBondContact O-N 3.39Å; S17-T19 VanDerWaalsContact O-N 3.09Å; S17-T19 PolarHBondContact OG-N 3.31Å; S17-T19 PolarHBondContact OG-OG1 3.22Å; T19-F21 PolarHBondContact O-N 3.44Å; T19-F21 VanDerWaalsContact O-N 3.16Å; T19-V22 PolarHBondContact O-N 3.33Å; T19-V22 VanDerWaalsContact O-N 3.08Å; T19-G49 CarbonylContact C-O 3.52Å; T19-G49 VanDerWaalsContact C-O 3.25Å; T19-G49 WeakPolarHBondContact CA-O 3.44Å
20	L	92.6	Very high	81.4	Confident	11 Å²	11	70.6 Å²	70.6	6%	0.058	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35.7	-176	-177.4	63.7	0	0	0	113.7	H16 S17 G49 C87 V88 E92 R93	H16-L20 HydrophobicContact CB-CD2 4.02Å; H16-L20 WeakPolarHBondContact CD2-CD2 3.36Å; S17-L20 WeakPolarHBondContact O-CB 3.43Å; S17-L20 PolarHBondContact O-N 3.42Å; L20-G49 PolarHBondContact N-O 3.41Å; L20-C87 HydrophobicContact CD2-CB 4.09Å; L20-C87 WeakPolarHBondContact CD2-O 3.13Å; L20-V88 HydrophobicContact CD2-CG2 4.16Å; L20-E92 VanDerWaalsContact CD1-C 3.46Å; L20-R93 HydrophobicContact CD1-CB 4.47Å
21	F	94	Very high	83.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	30.3	-178.4	-59.5	-58.1	0	0	0	112.2	T19 M29 F31 I46 G49 Y83 I84 C87 V88	T19-F21 PolarHBondContact O-N 3.44Å; T19-F21 VanDerWaalsContact O-N 3.16Å; F21-M29 HydrophobicContact CB-CB 4.45Å; F21-M29 HydrophobicContact CB-SD 4.5Å; F21-M29 HydrophobicContact CD1-SD 4.47Å; F21-M29 VanDerWaalsContact O-CB 3.27Å; F21-M29 WeakPolarHBondContact O-CB 3.44Å; F21-M29 WeakPolarHBondContact O-CG 3.38Å; F21-M29 PolarHBondContact O-N 2.79Å; F21-F31 HydrophobicContact CB-CE2 3.96Å; F21-F31 HydrophobicContact CB-CZ 4.43Å; F21-F31 AromaticContact CD1-CE2 3.98Å; F21-F31 HydrophobicContact CD1-CE2 3.98Å; F21-F31 AromaticContact CD1-CZ 3.64Å; F21-F31 HydrophobicContact CD1-CZ 3.64Å; F21-F31 HydrophobicContact CE1-CZ 4.19Å; F21-F31 HydrophobicContact CG-CE2 4Å; F21-F31 HydrophobicContact CG-CZ 4.15Å; F21-I46 HydrophobicContact CE2-CG1 4.49Å; F21-G49 PolarHBondContact N-O 3.17Å; F21-Y83 HydrophobicContact CE1-CE1 4.17Å; F21-I84 HydrophobicContact CD1-CD1 4.43Å; F21-I84 HydrophobicContact CE1-CD1 3.64Å; F21-I84 HydrophobicContact CE2-CD1 4.35Å; F21-I84 HydrophobicContact CZ-CD1 3.59Å; F21-I84 HydrophobicContact CZ-CG2 4.14Å; F21-C87 HydrophobicContact CE1-CB 4.03Å; F21-C87 HydrophobicContact CZ-CB 4.06Å; F21-V88 HydrophobicContact CE2-CG2 4.4Å; F21-V88 HydrophobicContact CZ-CG2 4.38Å
22	V	92.4	Very high	85.6	Confident	36 Å²	36	60.3 Å²	60.3	22%	0.218	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-103.1	140.1	170	-175.8	0	0	0	0	108.2	T19 G26 R93	T19-V22 PolarHBondContact O-N 3.33Å; T19-V22 VanDerWaalsContact O-N 3.08Å; V22-G26 WeakPolarHBondContact CG1-O 3.27Å; V22-R93 PolarHBondContact O-NH1 2.98Å
23	R	88.8	Confident	87.3	Confident	110 Å²	110	52.5 Å²	52.5	42%	0.415	31%	0.313	S	S	.	.			trans	-79.6	165.8	175.6	-66.2	179.1	-175.4	-156.5	1.5	110.2	D25 G26 S27 M29	R23-D25 WeakPolarHBondContact CB-OD1 3.13Å; R23-D25 PolarHBondContact O-N 3.35Å; R23-G26 PolarHBondContact O-N 3.21Å; R23-S27 WeakPolarHBondContact CB-O 3.23Å; R23-S27 PolarHBondContact N-O 3.15Å; R23-M29 HydrophobicContact CG-CG 3.78Å
24	E	87.3	Confident	88.7	Confident	213 Å²	213	52.7 Å²	52.7	100%	0.995	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-23.1	-178.8	-65.4	179.1	-179.9	0	0	113.6	G26	E24-G26 VanDerWaalsContact C-N 3.25Å; E24-G26 PolarHBondContact O-N 2.75Å
25	D	88.2	Confident	89.9	Confident	111 Å²	111	54.1 Å²	54.1	59%	0.594	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.6	174.3	67.8	-18.4	0	0	0	113.4	R23 S27	R23-D25 WeakPolarHBondContact CB-OD1 3.13Å; R23-D25 PolarHBondContact O-N 3.35Å; D25-S27 VanDerWaalsContact C-N 3.32Å; D25-S27 VanDerWaalsContact OD1-CB 3.23Å; D25-S27 WeakPolarHBondContact OD1-CB 3.4Å; D25-S27 PolarHBondContact OD1-N 3.09Å; D25-S27 PolarHBondContact OD1-OG 3.09Å; D25-S27 WeakPolarHBondContact OD2-CB 3.38Å; D25-S27 PolarHBondContact OD2-OG 3.33Å
26	G	87.3	Confident	90.2	Very high	53 Å²	53	51.5 Å²	51.5	55%	0.546	30%	0.3	S	S	.	.	S	Bend	trans	85.5	-2.3	-174.3	0	0	0	0	0	114.4	V22 R23 E24	V22-G26 WeakPolarHBondContact CG1-O 3.27Å; R23-G26 PolarHBondContact O-N 3.21Å; E24-G26 VanDerWaalsContact C-N 3.25Å; E24-G26 PolarHBondContact O-N 2.75Å
27	S	90	Very high	90	Very high	57 Å²	57	57.7 Å²	57.7	40%	0.399	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-76.5	133.9	178.5	-58.8	0	0	0	0	111	R23 D25 M29	R23-S27 WeakPolarHBondContact CB-O 3.23Å; R23-S27 PolarHBondContact N-O 3.15Å; D25-S27 VanDerWaalsContact C-N 3.32Å; D25-S27 VanDerWaalsContact OD1-CB 3.23Å; D25-S27 WeakPolarHBondContact OD1-CB 3.4Å; D25-S27 PolarHBondContact OD1-N 3.09Å; D25-S27 PolarHBondContact OD1-OG 3.09Å; D25-S27 WeakPolarHBondContact OD2-CB 3.38Å; D25-S27 PolarHBondContact OD2-OG 3.33Å; S27-M29 PolarHBondContact O-N 2.75Å
28	S	91.1	Very high	89.8	Confident	50 Å²	50	56.9 Å²	56.9	35%	0.35	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-62.1	135.6	173.3	-62.7	0	0	0	0	111.5	S30 G50	S28-S30 PolarHBondContact O-N 3.36Å; S28-G50 WeakPolarHBondContact CB-O 3.39Å; S28-G50 PolarHBondContact OG-O 2.99Å
29	M	93.3	Very high	89.8	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-69.6	128	168.2	-67.6	177.8	73	0	0	109.9	F21 R23 S27 F31 G51 T52 V62 R93 L96	F21-M29 HydrophobicContact CB-CB 4.45Å; F21-M29 HydrophobicContact CB-SD 4.5Å; F21-M29 HydrophobicContact CD1-SD 4.47Å; F21-M29 VanDerWaalsContact O-CB 3.27Å; F21-M29 WeakPolarHBondContact O-CB 3.44Å; F21-M29 WeakPolarHBondContact O-CG 3.38Å; F21-M29 PolarHBondContact O-N 2.79Å; R23-M29 HydrophobicContact CG-CG 3.78Å; S27-M29 PolarHBondContact O-N 2.75Å; M29-F31 HydrophobicContact CB-CD2 4.32Å; M29-F31 HydrophobicContact CB-CE2 3.51Å; M29-F31 HydrophobicContact CB-CZ 3.93Å; M29-F31 HydrophobicContact CE-CE1 4.38Å; M29-F31 HydrophobicContact CE-CZ 3.79Å; M29-F31 WeakPolarHBondContact O-CD2 3.43Å; M29-F31 WeakPolarHBondContact O-CE2 3.26Å; M29-F31 HydrophobicContact SD-CZ 4.16Å; M29-G51 CarbonylContact O-C 3.36Å; M29-G51 WeakPolarHBondContact O-CA 3.49Å; M29-T52 PolarHBondContact O-N 3.14Å; M29-V62 HydrophobicContact CE-CG2 4.29Å; M29-R93 PolarHBondContact SD-NE 3.07Å; M29-R93 VanDerWaalsContact SD-NE 3.42Å; M29-R93 PolarHBondContact SD-NH1 3.34Å; M29-L96 HydrophobicContact CE-CD1 4.03Å
30	S	93.7	Very high	89.8	Confident	32 Å²	32	59 Å²	59	22%	0.224	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	133	175.6	-57.3	0	0	0	0	110.9	S28 T52 A61 V62	S28-S30 PolarHBondContact O-N 3.36Å; S30-T52 WeakPolarHBondContact CA-OG1 3.41Å; S30-T52 PolarHBondContact OG-OG1 3.11Å; S30-T52 VanDerWaalsContact OG-OG1 3.11Å; S30-A61 CarbonylContact O-C 3.5Å; S30-A61 VanDerWaalsContact O-CA 3.24Å; S30-A61 WeakPolarHBondContact O-CA 3.22Å; S30-V62 PolarHBondContact O-N 3.24Å
31	F	95.3	Very high	89.8	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.4	177.7	-64.6	-92	0	0	0	110.2	F21 M29 I46 T52 V53 C54 V62 L64 Y83 I84	F21-F31 HydrophobicContact CB-CE2 3.96Å; F21-F31 HydrophobicContact CB-CZ 4.43Å; F21-F31 AromaticContact CD1-CE2 3.98Å; F21-F31 HydrophobicContact CD1-CE2 3.98Å; F21-F31 AromaticContact CD1-CZ 3.64Å; F21-F31 HydrophobicContact CD1-CZ 3.64Å; F21-F31 HydrophobicContact CE1-CZ 4.19Å; F21-F31 HydrophobicContact CG-CE2 4Å; F21-F31 HydrophobicContact CG-CZ 4.15Å; M29-F31 HydrophobicContact CB-CD2 4.32Å; M29-F31 HydrophobicContact CB-CE2 3.51Å; M29-F31 HydrophobicContact CB-CZ 3.93Å; M29-F31 HydrophobicContact CE-CE1 4.38Å; M29-F31 HydrophobicContact CE-CZ 3.79Å; M29-F31 WeakPolarHBondContact O-CD2 3.43Å; M29-F31 WeakPolarHBondContact O-CE2 3.26Å; M29-F31 HydrophobicContact SD-CZ 4.16Å; F31-I46 HydrophobicContact CB-CD1 3.91Å; F31-I46 HydrophobicContact CB-CG2 4.4Å; F31-I46 HydrophobicContact CD1-CD1 4.5Å; F31-I46 HydrophobicContact CD2-CB 4.48Å; F31-I46 HydrophobicContact CD2-CD1 4.33Å; F31-I46 HydrophobicContact CD2-CG1 4.27Å; F31-I46 HydrophobicContact CD2-CG2 3.39Å; F31-I46 HydrophobicContact CE2-CG2 3.92Å; F31-I46 HydrophobicContact CG-CD1 4Å; F31-I46 HydrophobicContact CG-CG1 4.38Å; F31-I46 HydrophobicContact CG-CG2 4.13Å; F31-T52 PolarHBondContact N-O 3.48Å; F31-V53 CarbonylContact O-C 3.25Å; F31-V53 VanDerWaalsContact O-CA 3.23Å; F31-V53 WeakPolarHBondContact O-CA 3.24Å; F31-C54 PolarHBondContact O-N 2.8Å; F31-V62 CarbonylContact C-O 3.58Å; F31-V62 WeakPolarHBondContact CA-O 3.36Å; F31-V62 HydrophobicContact CD1-CB 3.57Å; F31-V62 HydrophobicContact CD1-CG1 3.9Å; F31-V62 HydrophobicContact CD1-CG2 4.32Å; F31-V62 HydrophobicContact CE1-CB 3.8Å; F31-V62 HydrophobicContact CE1-CG1 3.98Å; F31-V62 HydrophobicContact CE1-CG2 4.11Å; F31-V62 HydrophobicContact CG-CB 4.42Å; F31-L64 HydrophobicContact CB-CD1 4.1Å; F31-L64 HydrophobicContact CD1-CD1 3.69Å; F31-L64 HydrophobicContact CD1-CD2 4.37Å; F31-L64 HydrophobicContact CD1-CG 4.05Å; F31-L64 HydrophobicContact CG-CD1 4.22Å; F31-Y83 HydrophobicContact CE1-CD1 4.32Å; F31-Y83 AromaticContact CE1-CE1 3.97Å; F31-Y83 HydrophobicContact CE1-CE1 3.97Å; F31-Y83 HydrophobicContact CZ-CE1 4.28Å; F31-I84 HydrophobicContact CD1-CD1 4.07Å; F31-I84 HydrophobicContact CE1-CD1 3.68Å; F31-I84 HydrophobicContact CZ-CD1 4Å
32	Y	93.6	Very high	89.7	Confident	32 Å²	32	66.6 Å²	66.6	13%	0.125	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.1	167.2	173.1	-99	0	0	0	109	R34 R55 V56 Q57 V62 L63 L64	Y32-R34 HydrophobicContact CE1-CG 3.82Å; Y32-R55 WeakPolarHBondContact CE2-O 3.25Å; Y32-V56 VanDerWaalsContact CD2-O 3.29Å; Y32-V56 WeakPolarHBondContact CD2-O 3.4Å; Y32-Q57 HydrophobicContact CD1-CG 3.58Å; Y32-Q57 HydrophobicContact CD2-CG 4.02Å; Y32-Q57 HydrophobicContact CE1-CG 3.52Å; Y32-Q57 HydrophobicContact CE2-CG 3.97Å; Y32-Q57 HydrophobicContact CG-CG 3.81Å; Y32-V62 PolarHBondContact N-O 3.31Å; Y32-L63 HydrophobicContact CD1-CD2 3.98Å; Y32-L63 HydrophobicContact CG-CD2 4.13Å; Y32-L64 PolarHBondContact O-N 2.82Å
33	V	91.7	Very high	89.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.4	176.9	-172	0	0	0	0	109.3	K39 L42 I46 V53 L64	V33-K39 HydrophobicContact CB-CD 4.42Å; V33-K39 HydrophobicContact CB-CG 4.07Å; V33-K39 HydrophobicContact CG1-CB 3.89Å; V33-K39 HydrophobicContact CG1-CD 4.41Å; V33-K39 HydrophobicContact CG1-CG 3.81Å; V33-K39 PolarHBondContact O-NZ 2.82Å; V33-L42 HydrophobicContact CG1-CB 4.47Å; V33-L42 HydrophobicContact CG1-CD1 4.03Å; V33-I46 HydrophobicContact CG2-CD1 3.95Å; V33-V53 HydrophobicContact CG2-CG1 4.1Å; V33-L64 HydrophobicContact CG2-CB 4.43Å; V33-L64 HydrophobicContact CG2-CD1 3.91Å
34	R	87	Confident	89.9	Confident	29 Å²	29	64.5 Å²	64.5	11%	0.109	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-54.8	143.4	174.9	-82.7	-162.7	-75.7	158.4	-18.6	111.2	Y32 S36 E69 F78	Y32-R34 HydrophobicContact CE1-CG 3.82Å; R34-S36 PolarHBondContact O-N 3.43Å; R34-S36 PolarHBondContact O-OG 2.81Å; R34-E69 IonicContact CZ-OE1 3.52Å; R34-E69 IonicContact CZ-OE2 3.79Å; R34-E69 IonicContact NE-OE1 3.43Å; R34-E69 IonicContact NE-OE2 3.71Å; R34-E69 IonicContact NH1-OE1 3.45Å; R34-E69 PolarHBondContact NH1-OE1 3.08Å; R34-E69 IonicContact NH1-OE2 3.4Å; R34-E69 PolarHBondContact NH1-OE2 2.79Å; R34-E69 IonicContact NH2-OE2 3.83Å; R34-F78 HydrophobicContact CG-CE1 4.46Å
35	P	85.4	Confident	90.2	Very high	100 Å²	100	55.4 Å²	55.4	65%	0.649	31%	0.312	S	S	*	.	S	Bend	trans	-52.8	104.3	171.5	-24.6	34.5	0	0	0	110.4
36	S	83.8	Confident	90.5	Very high	25 Å²	25	50.1 Å²	50.1	18%	0.175	28%	0.284	C	S	.	.	S	Bend	trans	-148.9	156.7	-178.5	64.2	0	0	0	0	108.7	R34 A38 K39	R34-S36 PolarHBondContact O-N 3.43Å; R34-S36 PolarHBondContact O-OG 2.81Å; S36-A38 PolarHBondContact O-N 3.16Å; S36-A38 VanDerWaalsContact O-N 3.1Å; S36-K39 WeakPolarHBondContact O-CB 3.27Å; S36-K39 PolarHBondContact O-N 3.05Å; S36-K39 PolarHBondContact OG-N 3.22Å
37	P	84	Confident	90.8	Very high	143 Å²	143	52.4 Å²	52.4	93%	0.929	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.8	175.1	-25.5	34.8	0	0	0	113.3	K39	P37-K39 VanDerWaalsContact C-N 3.32Å
38	A	85.4	Confident	90.9	Very high	27 Å²	27	53 Å²	53	22%	0.223	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-13.8	177.9	0	0	0	0	0	113.7	S36 R40 R41 L42 Q66	S36-A38 PolarHBondContact O-N 3.16Å; S36-A38 VanDerWaalsContact O-N 3.1Å; A38-R40 VanDerWaalsContact C-N 3.34Å; A38-R40 PolarHBondContact O-N 3.15Å; A38-R41 PolarHBondContact O-N 3.14Å; A38-L42 HydrophobicContact CB-CD1 4.04Å; A38-L42 HydrophobicContact CB-CG 4.48Å; A38-L42 WeakPolarHBondContact O-CG 3.41Å; A38-L42 PolarHBondContact O-N 2.88Å; A38-Q66 VanDerWaalsContact CB-NE2 3.33Å
39	K	90.2	Very high	90.9	Very high	61 Å²	61	50.6 Å²	50.6	27%	0.265	26%	0.263	S	S	.	.	H	α-helix	trans	-53.7	-48	-173	177.4	166.9	-179.1	157.4	0	112.4	V33 S36 P37 R41 L42 S43	V33-K39 HydrophobicContact CB-CD 4.42Å; V33-K39 HydrophobicContact CB-CG 4.07Å; V33-K39 HydrophobicContact CG1-CB 3.89Å; V33-K39 HydrophobicContact CG1-CD 4.41Å; V33-K39 HydrophobicContact CG1-CG 3.81Å; V33-K39 PolarHBondContact O-NZ 2.82Å; S36-K39 WeakPolarHBondContact O-CB 3.27Å; S36-K39 PolarHBondContact O-N 3.05Å; S36-K39 PolarHBondContact OG-N 3.22Å; P37-K39 VanDerWaalsContact C-N 3.32Å; K39-R41 PolarHBondContact O-N 3.35Å; K39-L42 PolarHBondContact O-N 3.38Å; K39-S43 WeakPolarHBondContact O-CB 3.35Å; K39-S43 PolarHBondContact O-N 2.95Å; K39-S43 PolarHBondContact O-OG 2.91Å
40	R	90.8	Very high	90.9	Very high	147 Å²	147	51.3 Å²	51.3	56%	0.555	27%	0.271	S	S	*	.	H	α-helix	trans	-58.3	-49.9	-179	-171.8	-176	-70.1	167.1	1.1	111.4	A38 L42 S43 T44 D329	A38-R40 VanDerWaalsContact C-N 3.34Å; A38-R40 PolarHBondContact O-N 3.15Å; R40-L42 PolarHBondContact O-N 3.05Å; R40-S43 PolarHBondContact O-N 2.77Å; R40-T44 PolarHBondContact O-N 2.94Å; R40-T44 PolarHBondContact O-OG1 2.57Å; R40-T44 VanDerWaalsContact O-OG1 3.09Å; R40-D329 IonicContact CZ-OD2 2.72Å; R40-D329 IonicContact NH1-OD2 2.79Å; R40-D329 PolarHBondContact NH1-OD2 3.21Å; R40-D329 IonicContact NH2-OD2 3.66Å
41	R	91.9	Very high	90.8	Very high	168 Å²	168	50 Å²	50	63%	0.634	26%	0.262	S	S	*	.	H	α-helix	trans	-59.8	-47.6	178.9	-177.9	179.4	173.5	-155.4	-3.3	111.4	A38 K39 T44 L45	A38-R41 PolarHBondContact O-N 3.14Å; K39-R41 PolarHBondContact O-N 3.35Å; R41-T44 PolarHBondContact O-N 3.33Å; R41-L45 HydrophobicContact CG-CD1 4.41Å; R41-L45 WeakPolarHBondContact O-CG 3.38Å; R41-L45 PolarHBondContact O-N 3.37Å; R41-L45 VanDerWaalsContact O-N 3.14Å
42	L	92.8	Very high	90.8	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-43.4	179.4	-67.8	168.2	0	0	0	111.5	V33 A38 K39 R40 T44 L45 I46 T81 I84 L85	V33-L42 HydrophobicContact CG1-CB 4.47Å; V33-L42 HydrophobicContact CG1-CD1 4.03Å; A38-L42 HydrophobicContact CB-CD1 4.04Å; A38-L42 HydrophobicContact CB-CG 4.48Å; A38-L42 WeakPolarHBondContact O-CG 3.41Å; A38-L42 PolarHBondContact O-N 2.88Å; K39-L42 PolarHBondContact O-N 3.38Å; R40-L42 PolarHBondContact O-N 3.05Å; L42-T44 PolarHBondContact O-N 3.02Å; L42-L45 PolarHBondContact O-N 3.12Å; L42-I46 HydrophobicContact CB-CD1 4.48Å; L42-I46 WeakPolarHBondContact O-CB 3.32Å; L42-I46 WeakPolarHBondContact O-CD1 3.33Å; L42-I46 VanDerWaalsContact O-CG1 3.22Å; L42-I46 WeakPolarHBondContact O-CG1 3.33Å; L42-I46 PolarHBondContact O-N 2.98Å; L42-T81 HydrophobicContact CD1-CG2 3.43Å; L42-T81 VanDerWaalsContact CD1-CG2 3.43Å; L42-I84 HydrophobicContact CD2-CB 3.9Å; L42-I84 HydrophobicContact CD2-CG1 4.44Å; L42-I84 HydrophobicContact CD2-CG2 3.91Å; L42-L85 HydrophobicContact CD2-CD2 4.32Å; L42-L85 HydrophobicContact CD2-CG 4.5Å
43	S	92.9	Very high	90.8	Very high	19 Å²	19	52.9 Å²	52.9	13%	0.133	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-42.4	177.9	-64.1	0	0	0	0	112.1	K39 R40 L45 I46 L47	K39-S43 WeakPolarHBondContact O-CB 3.35Å; K39-S43 PolarHBondContact O-N 2.95Å; K39-S43 PolarHBondContact O-OG 2.91Å; R40-S43 PolarHBondContact O-N 2.77Å; S43-L45 VanDerWaalsContact C-N 3.34Å; S43-L45 PolarHBondContact O-N 2.76Å; S43-I46 PolarHBondContact O-N 3.23Å; S43-L47 VanDerWaalsContact O-CB 3.32Å; S43-L47 WeakPolarHBondContact O-CB 3.2Å; S43-L47 WeakPolarHBondContact O-CG 3.3Å; S43-L47 PolarHBondContact O-N 3.48Å
44	T	92.5	Very high	90.8	Very high	82 Å²	82	53.3 Å²	53.3	50%	0.503	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-44.2	174.8	-57.9	0	0	0	0	111.7	R40 R41 L42 H48	R40-T44 PolarHBondContact O-N 2.94Å; R40-T44 PolarHBondContact O-OG1 2.57Å; R40-T44 VanDerWaalsContact O-OG1 3.09Å; R41-T44 PolarHBondContact O-N 3.33Å; L42-T44 PolarHBondContact O-N 3.02Å; T44-H48 VanDerWaalsContact O-CB 3.28Å; T44-H48 WeakPolarHBondContact O-CB 3.21Å; T44-H48 PolarHBondContact O-N 3.17Å
45	L	93.8	Very high	90.9	Very high	22 Å²	22	63 Å²	63	12%	0.115	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-45.1	178.1	-68.1	175.5	0	0	0	112	H16 R41 L42 S43 H48 G49 I84 L85 V88	H16-L45 PolarHBondContact CE1-O 3.24Å; H16-L45 VanDerWaalsContact CE1-O 3.25Å; H16-L45 PolarHBondContact NE2-O 2.99Å; R41-L45 HydrophobicContact CG-CD1 4.41Å; R41-L45 WeakPolarHBondContact O-CG 3.38Å; R41-L45 PolarHBondContact O-N 3.37Å; R41-L45 VanDerWaalsContact O-N 3.14Å; L42-L45 PolarHBondContact O-N 3.12Å; S43-L45 VanDerWaalsContact C-N 3.34Å; S43-L45 PolarHBondContact O-N 2.76Å; L45-H48 PolarHBondContact O-N 2.87Å; L45-G49 PolarHBondContact O-N 3.18Å; L45-I84 HydrophobicContact CB-CG2 4.04Å; L45-I84 HydrophobicContact CD1-CG2 4.32Å; L45-L85 HydrophobicContact CD1-CD2 4.08Å; L45-V88 HydrophobicContact CB-CG2 4.11Å; L45-V88 HydrophobicContact CD1-CG2 4.26Å; L45-V88 HydrophobicContact CD2-CG1 3.99Å; L45-V88 HydrophobicContact CD2-CG2 4.2Å; L45-V88 HydrophobicContact CG-CG2 4.41Å
46	I	94	Very high	90.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-49.5	179.8	-68.9	160	0	0	0	111.2	F21 F31 V33 L42 S43 H48 G49 G50 G51 V53 L64 I84	F21-I46 HydrophobicContact CE2-CG1 4.49Å; F31-I46 HydrophobicContact CB-CD1 3.91Å; F31-I46 HydrophobicContact CB-CG2 4.4Å; F31-I46 HydrophobicContact CD1-CD1 4.5Å; F31-I46 HydrophobicContact CD2-CB 4.48Å; F31-I46 HydrophobicContact CD2-CD1 4.33Å; F31-I46 HydrophobicContact CD2-CG1 4.27Å; F31-I46 HydrophobicContact CD2-CG2 3.39Å; F31-I46 HydrophobicContact CE2-CG2 3.92Å; F31-I46 HydrophobicContact CG-CD1 4Å; F31-I46 HydrophobicContact CG-CG1 4.38Å; F31-I46 HydrophobicContact CG-CG2 4.13Å; V33-I46 HydrophobicContact CG2-CD1 3.95Å; L42-I46 HydrophobicContact CB-CD1 4.48Å; L42-I46 WeakPolarHBondContact O-CB 3.32Å; L42-I46 WeakPolarHBondContact O-CD1 3.33Å; L42-I46 VanDerWaalsContact O-CG1 3.22Å; L42-I46 WeakPolarHBondContact O-CG1 3.33Å; L42-I46 PolarHBondContact O-N 2.98Å; S43-I46 PolarHBondContact O-N 3.23Å; I46-H48 VanDerWaalsContact C-N 3.32Å; I46-H48 PolarHBondContact O-N 2.71Å; I46-G49 PolarHBondContact O-N 3.07Å; I46-G50 PolarHBondContact O-N 3.26Å; I46-G51 WeakPolarHBondContact O-CA 3.44Å; I46-G51 PolarHBondContact O-N 2.71Å; I46-V53 HydrophobicContact CB-CG2 3.97Å; I46-V53 HydrophobicContact CD1-CG2 4.13Å; I46-V53 HydrophobicContact CG2-CG2 3.71Å; I46-L64 HydrophobicContact CD1-CD1 3.71Å; I46-I84 HydrophobicContact CD1-CD1 4.14Å; I46-I84 HydrophobicContact CD1-CG1 4.21Å; I46-I84 HydrophobicContact CG1-CD1 3.76Å; I46-I84 HydrophobicContact CG1-CG1 4.17Å; I46-I84 HydrophobicContact CG1-CG2 4.14Å
47	L	93.6	Very high	91.2	Very high	102 Å²	102	65.7 Å²	65.7	53%	0.534	33%	0.33	S	S	.	.	H	α-helix	trans	-63.5	-40.2	-179.5	-71.1	169.8	0	0	0	111.3	S43 G49 G50 V53	S43-L47 VanDerWaalsContact O-CB 3.32Å; S43-L47 WeakPolarHBondContact O-CB 3.2Å; S43-L47 WeakPolarHBondContact O-CG 3.3Å; S43-L47 PolarHBondContact O-N 3.48Å; L47-G49 VanDerWaalsContact C-N 3.33Å; L47-G49 PolarHBondContact O-N 3.17Å; L47-G50 PolarHBondContact O-N 3.35Å; L47-G50 VanDerWaalsContact O-N 3.17Å; L47-V53 HydrophobicContact CG-CG2 4.4Å
48	H	91.5	Very high	91.2	Very high	68 Å²	68	63.1 Å²	63.1	32%	0.315	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-43.8	175.6	-177.7	-92.2	0	0	0	111.7	P14 H16 S18 T44 L45 I46 G50	P14-H48 HydrophobicContact CB-CB 4Å; P14-H48 WeakPolarHBondContact CB-CD2 3.43Å; P14-H48 WeakPolarHBondContact CB-CE1 3.43Å; P14-H48 VanDerWaalsContact CB-ND1 3.27Å; P14-H48 WeakPolarHBondContact CB-ND1 3.4Å; P14-H48 WeakPolarHBondContact CB-NE2 3.22Å; P14-H48 HydrophobicContact CG-CB 4.25Å; P14-H48 WeakPolarHBondContact CG-CD2 3.49Å; H16-H48 AromaticContact CE1-ND1 3.63Å; H16-H48 AromaticContact NE2-ND1 3.6Å; H16-H48 PolarHBondContact O-CE1 2.85Å; H16-H48 PolarHBondContact O-ND1 2.96Å; S18-H48 WeakPolarHBondContact CA-O 3.25Å; T44-H48 VanDerWaalsContact O-CB 3.28Å; T44-H48 WeakPolarHBondContact O-CB 3.21Å; T44-H48 PolarHBondContact O-N 3.17Å; L45-H48 PolarHBondContact O-N 2.87Å; I46-H48 VanDerWaalsContact C-N 3.32Å; I46-H48 PolarHBondContact O-N 2.71Å; H48-G50 PolarHBondContact O-N 3.09Å; H48-G50 VanDerWaalsContact O-N 3.07Å
49	G	92.1	Very high	91.1	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	8.5	177.5	0	0	0	0	0	115.1	H16 S17 S18 T19 L20 F21 L45 I46 L47 G51	H16-G49 WeakPolarHBondContact NE2-CA 3.37Å; H16-G49 PolarHBondContact NE2-N 2.93Å; S17-G49 WeakPolarHBondContact O-CA 3.37Å; S18-G49 VanDerWaalsContact C-C 3.49Å; S18-G49 CarbonylContact C-O 3.58Å; S18-G49 CarbonylContact O-C 3.32Å; T19-G49 CarbonylContact C-O 3.52Å; T19-G49 VanDerWaalsContact C-O 3.25Å; T19-G49 WeakPolarHBondContact CA-O 3.44Å; L20-G49 PolarHBondContact N-O 3.41Å; F21-G49 PolarHBondContact N-O 3.17Å; L45-G49 PolarHBondContact O-N 3.18Å; I46-G49 PolarHBondContact O-N 3.07Å; L47-G49 VanDerWaalsContact C-N 3.33Å; L47-G49 PolarHBondContact O-N 3.17Å; G49-G51 VanDerWaalsContact C-N 3.34Å
50	G	92.2	Very high	90.9	Very high	18 Å²	18	68.4 Å²	68.4	19%	0.186	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	82	9	178.4	0	0	0	0	0	114.5	S18 S28 I46 L47 H48	S18-G50 WeakPolarHBondContact O-CA 3.13Å; S18-G50 PolarHBondContact O-N 3.05Å; S28-G50 WeakPolarHBondContact CB-O 3.39Å; S28-G50 PolarHBondContact OG-O 2.99Å; I46-G50 PolarHBondContact O-N 3.26Å; L47-G50 PolarHBondContact O-N 3.35Å; L47-G50 VanDerWaalsContact O-N 3.17Å; H48-G50 PolarHBondContact O-N 3.09Å; H48-G50 VanDerWaalsContact O-N 3.07Å
51	G	93.5	Very high	90.8	Very high	4 Å²	4	62 Å²	62	4%	0.041	33%	0.333	C	S	.	.			trans	-82.6	168.4	172.7	0	0	0	0	0	112.2	M29 I46 G49	M29-G51 CarbonylContact O-C 3.36Å; M29-G51 WeakPolarHBondContact O-CA 3.49Å; I46-G51 WeakPolarHBondContact O-CA 3.44Å; I46-G51 PolarHBondContact O-N 2.71Å; G49-G51 VanDerWaalsContact C-N 3.34Å
52	T	93.8	Very high	90.9	Very high	54 Å²	54	55 Å²	55	33%	0.331	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.1	174.5	53	0	0	0	0	110.5	M29 S30 F31	M29-T52 PolarHBondContact O-N 3.14Å; S30-T52 WeakPolarHBondContact CA-OG1 3.41Å; S30-T52 PolarHBondContact OG-OG1 3.11Å; S30-T52 VanDerWaalsContact OG-OG1 3.11Å; F31-T52 PolarHBondContact N-O 3.48Å
53	V	93.8	Very high	90.8	Very high	38 Å²	38	55.8 Å²	55.8	23%	0.23	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.6	177.1	-176.3	0	0	0	0	110.1	F31 V33 I46 L47	F31-V53 CarbonylContact O-C 3.25Å; F31-V53 VanDerWaalsContact O-CA 3.23Å; F31-V53 WeakPolarHBondContact O-CA 3.24Å; V33-V53 HydrophobicContact CG2-CG1 4.1Å; I46-V53 HydrophobicContact CB-CG2 3.97Å; I46-V53 HydrophobicContact CD1-CG2 4.13Å; I46-V53 HydrophobicContact CG2-CG2 3.71Å; L47-V53 HydrophobicContact CG-CG2 4.4Å
54	C	92	Very high	90.8	Very high	9 Å²	9	54.9 Å²	54.9	6%	0.061	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	142.5	-179.8	-52.6	0	0	0	0	110.9	F31 V56 E58	F31-C54 PolarHBondContact O-N 2.8Å; C54-V56 WeakPolarHBondContact CB-O 3.22Å; C54-E58 HydrophobicContact CB-CG 4.25Å; C54-E58 PolarHBondContact SG-OE2 3.45Å
55	R	88.1	Confident	90.6	Very high	233 Å²	233	51 Å²	51	88%	0.879	28%	0.283	S	S	*	.	S	Bend	trans	-76.6	-31.2	175	-65.7	-175	-179	-166.3	1.9	111.9	Y32	Y32-R55 WeakPolarHBondContact CE2-O 3.25Å
56	V	87.1	Confident	90.3	Very high	91 Å²	91	52.6 Å²	52.6	55%	0.552	29%	0.29	S	S	*	.	S	Bend	trans	-120	165	178.5	-64.4	0	0	0	0	109.9	Y32 C54 E58	Y32-V56 VanDerWaalsContact CD2-O 3.29Å; Y32-V56 WeakPolarHBondContact CD2-O 3.4Å; C54-V56 WeakPolarHBondContact CB-O 3.22Å; V56-E58 HydrophobicContact CG2-CG 3.99Å; V56-E58 PolarHBondContact O-N 2.83Å
57	Q	88.5	Confident	89.6	Confident	90 Å²	90	55.7 Å²	55.7	42%	0.421	31%	0.31	S	S	.	.			trans	-73.9	109.4	175.4	-63.3	-177.5	25.7	0	0	108.5	Y32 L63	Y32-Q57 HydrophobicContact CD1-CG 3.58Å; Y32-Q57 HydrophobicContact CD2-CG 4.02Å; Y32-Q57 HydrophobicContact CE1-CG 3.52Å; Y32-Q57 HydrophobicContact CE2-CG 3.97Å; Y32-Q57 HydrophobicContact CG-CG 3.81Å; Q57-L63 HydrophobicContact CB-CD2 4.13Å; Q57-L63 HydrophobicContact CG-CD2 3.95Å
58	E	84.9	Confident	88.6	Confident	89 Å²	89	54.9 Å²	54.9	42%	0.416	33%	0.326	S	S	.	.			trans	-103.8	145.9	-178.6	-69.7	172.7	-168.6	0	0	110.9	C54 V56 G60 A61	C54-E58 HydrophobicContact CB-CG 4.25Å; C54-E58 PolarHBondContact SG-OE2 3.45Å; V56-E58 HydrophobicContact CG2-CG 3.99Å; V56-E58 PolarHBondContact O-N 2.83Å; E58-G60 PolarHBondContact O-N 2.79Å; E58-A61 HydrophobicContact CB-CB 4.3Å; E58-A61 WeakPolarHBondContact O-CB 3.41Å; E58-A61 PolarHBondContact O-N 2.89Å
59	P	83.7	Confident	87.6	Confident	140 Å²	140	54.7 Å²	54.7	91%	0.909	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	123.5	173.4	-23.6	33.6	0	0	0	111.4
60	G	84.9	Confident	86.1	Confident	59 Å²	59	58.4 Å²	58.4	61%	0.608	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	-4	-179	0	0	0	0	0	115.3	E58	E58-G60 PolarHBondContact O-N 2.79Å
61	A	90.2	Very high	84.7	Confident	14 Å²	14	60.3 Å²	60.3	12%	0.116	36%	0.362	C	S	.	.			trans	-77.6	137.3	170.4	0	0	0	0	0	111.3	S30 E58 L63	S30-A61 CarbonylContact O-C 3.5Å; S30-A61 VanDerWaalsContact O-CA 3.24Å; S30-A61 WeakPolarHBondContact O-CA 3.22Å; E58-A61 HydrophobicContact CB-CB 4.3Å; E58-A61 WeakPolarHBondContact O-CB 3.41Å; E58-A61 PolarHBondContact O-N 2.89Å; A61-L63 PolarHBondContact O-N 3.32Å
62	V	92.3	Very high	82.8	Confident	21 Å²	21	64.8 Å²	64.8	13%	0.127	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	116.3	173.6	177.3	0	0	0	0	108.8	M29 S30 F31 Y32 L64 I79 L96	M29-V62 HydrophobicContact CE-CG2 4.29Å; S30-V62 PolarHBondContact O-N 3.24Å; F31-V62 CarbonylContact C-O 3.58Å; F31-V62 WeakPolarHBondContact CA-O 3.36Å; F31-V62 HydrophobicContact CD1-CB 3.57Å; F31-V62 HydrophobicContact CD1-CG1 3.9Å; F31-V62 HydrophobicContact CD1-CG2 4.32Å; F31-V62 HydrophobicContact CE1-CB 3.8Å; F31-V62 HydrophobicContact CE1-CG1 3.98Å; F31-V62 HydrophobicContact CE1-CG2 4.11Å; F31-V62 HydrophobicContact CG-CB 4.42Å; Y32-V62 PolarHBondContact N-O 3.31Å; V62-L64 HydrophobicContact CG1-CD2 4.15Å; V62-L64 PolarHBondContact O-N 3.23Å; V62-I79 HydrophobicContact CG1-CB 3.88Å; V62-I79 HydrophobicContact CG1-CG1 3.66Å; V62-I79 HydrophobicContact CG1-CG2 4.38Å; V62-L96 HydrophobicContact CG1-CD2 3.83Å; V62-L96 HydrophobicContact CG2-CD1 4.07Å; V62-L96 HydrophobicContact CG2-CD2 4.04Å
63	L	92.2	Very high	81.1	Confident	18 Å²	18	71.4 Å²	71.4	9%	0.094	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	109	-177.4	-53.4	-176.5	0	0	0	110.3	Y32 Q57 A61 F78 I79	Y32-L63 HydrophobicContact CD1-CD2 3.98Å; Y32-L63 HydrophobicContact CG-CD2 4.13Å; Q57-L63 HydrophobicContact CB-CD2 4.13Å; Q57-L63 HydrophobicContact CG-CD2 3.95Å; A61-L63 PolarHBondContact O-N 3.32Å; L63-F78 HydrophobicContact CB-CD1 3.69Å; L63-F78 HydrophobicContact CB-CE1 3.81Å; L63-F78 HydrophobicContact CB-CG 4.43Å; L63-F78 HydrophobicContact CD1-CE1 4.29Å; L63-F78 HydrophobicContact CD1-CZ 4.28Å; L63-F78 CarbonylContact O-C 3.55Å; L63-F78 WeakPolarHBondContact O-CA 3.22Å; L63-I79 PolarHBondContact O-N 3.01Å
64	L	92.2	Very high	79.3	Confident	1 Å²	1	71 Å²	71	1%	0.005	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.7	-177.8	-65.4	173.6	0	0	0	112.3	F31 Y32 V33 I46 V62 I79 T81 I84	F31-L64 HydrophobicContact CB-CD1 4.1Å; F31-L64 HydrophobicContact CD1-CD1 3.69Å; F31-L64 HydrophobicContact CD1-CD2 4.37Å; F31-L64 HydrophobicContact CD1-CG 4.05Å; F31-L64 HydrophobicContact CG-CD1 4.22Å; Y32-L64 PolarHBondContact O-N 2.82Å; V33-L64 HydrophobicContact CG2-CB 4.43Å; V33-L64 HydrophobicContact CG2-CD1 3.91Å; I46-L64 HydrophobicContact CD1-CD1 3.71Å; V62-L64 HydrophobicContact CG1-CD2 4.15Å; V62-L64 PolarHBondContact O-N 3.23Å; L64-I79 CarbonylContact C-O 3.6Å; L64-I79 WeakPolarHBondContact CA-O 3.49Å; L64-I79 HydrophobicContact CD2-CB 4.17Å; L64-I79 HydrophobicContact CD2-CG2 4.16Å; L64-T81 HydrophobicContact CB-CG2 4.17Å; L64-I84 HydrophobicContact CD1-CD1 4.06Å; L64-I84 HydrophobicContact CD1-CG1 3.57Å; L64-I84 HydrophobicContact CD2-CG1 4.16Å
65	A	88.8	Confident	78	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	141	-178.1	0	0	0	0	0	111.7	L71 F78 I79 S80 T81 L101	A65-L71 HydrophobicContact CB-CD1 4.22Å; A65-F78 HydrophobicContact CB-CB 3.93Å; A65-F78 HydrophobicContact CB-CD1 3.65Å; A65-F78 HydrophobicContact CB-CG 4.02Å; A65-I79 PolarHBondContact N-O 2.77Å; A65-S80 CarbonylContact O-C 3.59Å; A65-S80 WeakPolarHBondContact O-CA 3.48Å; A65-T81 PolarHBondContact O-N 3.43Å; A65-L101 HydrophobicContact CB-CD1 3.78Å; A65-L101 WeakPolarHBondContact O-CD1 3.31Å
66	Q	86.5	Confident	77.2	Confident	56 Å²	56	67.2 Å²	67.2	26%	0.262	44%	0.441	S	S	.	.			trans	-71.2	137.2	173.7	-76.7	-74.1	-19.1	0	0	110.1	A38 G68 E69 T81	A38-Q66 VanDerWaalsContact CB-NE2 3.33Å; Q66-G68 PolarHBondContact O-N 2.9Å; Q66-E69 HydrophobicContact CB-CB 4.18Å; Q66-E69 PolarHBondContact N-OE2 3.43Å; Q66-E69 WeakPolarHBondContact O-CB 3.23Å; Q66-E69 PolarHBondContact O-N 3.06Å; Q66-T81 HydrophobicContact CG-CG2 4.19Å; Q66-T81 PolarHBondContact NE2-OG1 2.8Å; Q66-T81 PolarHBondContact OE1-OG1 3.42Å
67	P	79.6	Confident	77.1	Confident	64 Å²	64	68 Å²	68	42%	0.416	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	124.9	169.6	-25.6	34.7	0	0	0	110.9	S80 Q82	P67-S80 VanDerWaalsContact CG-OG 3.22Å; P67-S80 WeakPolarHBondContact CG-OG 3.22Å; P67-Q82 HydrophobicContact CG-CG 4.24Å
68	G	73.2	Confident	77.1	Confident	85 Å²	85	63.7 Å²	63.7	88%	0.876	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	-7.9	-179.9	0	0	0	0	0	115.3	Q66 A70	Q66-G68 PolarHBondContact O-N 2.9Å; G68-A70 PolarHBondContact O-N 2.92Å
69	E	70.5	Confident	77.4	Confident	64 Å²	64	59.8 Å²	59.8	30%	0.299	40%	0.404	S	S	.	.	S	Bend	trans	-67.8	128.6	167.6	-158.4	-177.1	159.8	0	0	108.4	R34 Q66 L71	R34-E69 IonicContact CZ-OE1 3.52Å; R34-E69 IonicContact CZ-OE2 3.79Å; R34-E69 IonicContact NE-OE1 3.43Å; R34-E69 IonicContact NE-OE2 3.71Å; R34-E69 IonicContact NH1-OE1 3.45Å; R34-E69 PolarHBondContact NH1-OE1 3.08Å; R34-E69 IonicContact NH1-OE2 3.4Å; R34-E69 PolarHBondContact NH1-OE2 2.79Å; R34-E69 IonicContact NH2-OE2 3.83Å; Q66-E69 HydrophobicContact CB-CB 4.18Å; Q66-E69 PolarHBondContact N-OE2 3.43Å; Q66-E69 WeakPolarHBondContact O-CB 3.23Å; Q66-E69 PolarHBondContact O-N 3.06Å; E69-L71 PolarHBondContact O-N 3.36Å
70	A	59.4	Low	77.8	Confident	79 Å²	79	53.5 Å²	53.5	65%	0.653	36%	0.363	S	S	*	.			trans	-51.2	104.4	-176.3	0	0	0	0	0	110	G68 A72	G68-A70 PolarHBondContact O-N 2.92Å; A70-A72 PolarHBondContact O-N 2.88Å
71	L	63.6	Low	78.2	Confident	57 Å²	57	50.7 Å²	50.7	30%	0.298	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-70.9	-9.2	177.7	-132.1	81.1	0	0	0	111.4	A65 E69 E73 A74 F78 L101	A65-L71 HydrophobicContact CB-CD1 4.22Å; E69-L71 PolarHBondContact O-N 3.36Å; L71-E73 PolarHBondContact O-N 3.19Å; L71-E73 VanDerWaalsContact O-N 3.12Å; L71-A74 PolarHBondContact O-N 3.18Å; L71-F78 HydrophobicContact CD1-CB 4.11Å; L71-F78 HydrophobicContact CD1-CD2 4.16Å; L71-F78 HydrophobicContact CD1-CG 4.16Å; L71-F78 HydrophobicContact CD2-CB 4.48Å; L71-F78 HydrophobicContact CD2-CD2 4.14Å; L71-F78 HydrophobicContact CG-CD2 3.93Å; L71-F78 HydrophobicContact CG-CG 4.43Å; L71-L101 HydrophobicContact CD1-CB 4.17Å; L71-L101 HydrophobicContact CD1-CD1 4.41Å; L71-L101 HydrophobicContact CD2-CB 4.38Å; L71-L101 VanDerWaalsContact CD2-O 3.23Å; L71-L101 WeakPolarHBondContact CD2-O 3.41Å
72	A	54.1	Low	78.2	Confident	98 Å²	98	53.6 Å²	53.6	81%	0.81	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.9	-18.1	-164.1	0	0	0	0	0	115	A70	A70-A72 PolarHBondContact O-N 2.88Å
73	E	56.8	Low	78.3	Confident	193 Å²	193	52.6 Å²	52.6	90%	0.902	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-101.7	-6.4	-176	-64.8	-163.7	174.3	0	0	114.6	L71	L71-E73 PolarHBondContact O-N 3.19Å; L71-E73 VanDerWaalsContact O-N 3.12Å
74	A	57.6	Low	78.4	Confident	31 Å²	31	51.7 Å²	51.7	26%	0.256	34%	0.335	S	S	.	.			trans	-124.8	119	-178.3	0	0	0	0	0	111.2	L71 G76 F78	L71-A74 PolarHBondContact O-N 3.18Å; A74-G76 PolarHBondContact O-N 3.02Å; A74-F78 HydrophobicContact CB-CE2 3.59Å; A74-F78 HydrophobicContact CB-CZ 3.41Å; A74-F78 VanDerWaalsContact CB-CZ 3.41Å; A74-F78 WeakPolarHBondContact O-CE2 3.47Å
75	S	63.5	Low	78.4	Confident	127 Å²	127	53.3 Å²	53.3	89%	0.888	34%	0.343	S	S	*	.			trans	-74.2	111.5	165.7	-61.6	0	0	0	0	108.3
76	G	72	Confident	78.6	Confident	35 Å²	35	55.3 Å²	55.3	36%	0.361	35%	0.354	S	S	.	.	S	Bend	trans	176.5	153	178.5	0	0	0	0	0	112.3	A74 F78	A74-G76 PolarHBondContact O-N 3.02Å; G76-F78 WeakPolarHBondContact O-CD2 3.36Å; G76-F78 PolarHBondContact O-N 2.84Å; G76-F78 VanDerWaalsContact O-N 3.09Å
77	D	84.6	Confident	79	Confident	106 Å²	106	52.6 Å²	52.6	57%	0.567	34%	0.341	S	S	*	.			trans	-78	91.5	173.4	-79.4	-30.7	0	0	0	109.6	R100	D77-R100 IonicContact OD1-NH1 2.95Å; D77-R100 PolarHBondContact OD1-NH1 2.97Å; D77-R100 IonicContact OD2-CZ 3.79Å; D77-R100 IonicContact OD2-NH1 2.7Å; D77-R100 PolarHBondContact OD2-NH1 2.93Å
78	F	88.4	Confident	79.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	138.3	-179.7	-73.1	-80.3	0	0	0	111.7	R34 L63 A65 L71 A74 G76 R100 L101	R34-F78 HydrophobicContact CG-CE1 4.46Å; L63-F78 HydrophobicContact CB-CD1 3.69Å; L63-F78 HydrophobicContact CB-CE1 3.81Å; L63-F78 HydrophobicContact CB-CG 4.43Å; L63-F78 HydrophobicContact CD1-CE1 4.29Å; L63-F78 HydrophobicContact CD1-CZ 4.28Å; L63-F78 CarbonylContact O-C 3.55Å; L63-F78 WeakPolarHBondContact O-CA 3.22Å; A65-F78 HydrophobicContact CB-CB 3.93Å; A65-F78 HydrophobicContact CB-CD1 3.65Å; A65-F78 HydrophobicContact CB-CG 4.02Å; L71-F78 HydrophobicContact CD1-CB 4.11Å; L71-F78 HydrophobicContact CD1-CD2 4.16Å; L71-F78 HydrophobicContact CD1-CG 4.16Å; L71-F78 HydrophobicContact CD2-CB 4.48Å; L71-F78 HydrophobicContact CD2-CD2 4.14Å; L71-F78 HydrophobicContact CG-CD2 3.93Å; L71-F78 HydrophobicContact CG-CG 4.43Å; A74-F78 HydrophobicContact CB-CE2 3.59Å; A74-F78 HydrophobicContact CB-CZ 3.41Å; A74-F78 VanDerWaalsContact CB-CZ 3.41Å; A74-F78 WeakPolarHBondContact O-CE2 3.47Å; G76-F78 WeakPolarHBondContact O-CD2 3.36Å; G76-F78 PolarHBondContact O-N 2.84Å; G76-F78 VanDerWaalsContact O-N 3.09Å; F78-R100 CarbonylContact O-C 3.54Å; F78-R100 WeakPolarHBondContact O-CA 3.48Å; F78-L101 HydrophobicContact CB-CB 4.2Å; F78-L101 PolarHBondContact O-N 3.43Å
79	I	91.5	Very high	80.4	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.041	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	136.1	170	-59	-50	0	0	0	108.3	V62 L63 L64 A65 T81 Y83 L96 R100	V62-I79 HydrophobicContact CG1-CB 3.88Å; V62-I79 HydrophobicContact CG1-CG1 3.66Å; V62-I79 HydrophobicContact CG1-CG2 4.38Å; L63-I79 PolarHBondContact O-N 3.01Å; L64-I79 CarbonylContact C-O 3.6Å; L64-I79 WeakPolarHBondContact CA-O 3.49Å; L64-I79 HydrophobicContact CD2-CB 4.17Å; L64-I79 HydrophobicContact CD2-CG2 4.16Å; A65-I79 PolarHBondContact N-O 2.77Å; I79-T81 PolarHBondContact O-N 3.07Å; I79-Y83 HydrophobicContact CG2-CD1 4.46Å; I79-Y83 HydrophobicContact CG2-CG 3.99Å; I79-L96 WeakPolarHBondContact CD1-O 3.34Å; I79-L96 HydrophobicContact CG1-CD2 4.47Å; I79-L96 HydrophobicContact CG2-CD2 4.39Å; I79-R100 HydrophobicContact CD1-CB 3.96Å; I79-R100 HydrophobicContact CD1-CG 4.28Å
80	S	91.7	Very high	81.3	Confident	7 Å²	7	58.3 Å²	58.3	5%	0.049	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	135.7	175.1	172.7	0	0	0	0	110.4	A65 P67 Q82 Y83 Y99	A65-S80 CarbonylContact O-C 3.59Å; A65-S80 WeakPolarHBondContact O-CA 3.48Å; P67-S80 VanDerWaalsContact CG-OG 3.22Å; P67-S80 WeakPolarHBondContact CG-OG 3.22Å; S80-Q82 PolarHBondContact O-N 3.22Å; S80-Q82 WeakPolarHBondContact OG-CB 3.4Å; S80-Q82 WeakPolarHBondContact OG-CG 3.36Å; S80-Q82 PolarHBondContact OG-N 3.4Å; S80-Y83 WeakPolarHBondContact O-CB 3.34Å; S80-Y83 PolarHBondContact O-N 3.35Å; S80-Y99 WeakPolarHBondContact CB-O 3.34Å; S80-Y99 PolarHBondContact N-O 3.42Å
81	T	92.7	Very high	82.8	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.006	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.4	172.7	50.2	0	0	0	0	113.5	L42 L64 A65 Q66 I79 Y83 I84	L42-T81 HydrophobicContact CD1-CG2 3.43Å; L42-T81 VanDerWaalsContact CD1-CG2 3.43Å; L64-T81 HydrophobicContact CB-CG2 4.17Å; A65-T81 PolarHBondContact O-N 3.43Å; Q66-T81 HydrophobicContact CG-CG2 4.19Å; Q66-T81 PolarHBondContact NE2-OG1 2.8Å; Q66-T81 PolarHBondContact OE1-OG1 3.42Å; I79-T81 PolarHBondContact O-N 3.07Å; T81-Y83 PolarHBondContact O-N 3.48Å; T81-I84 PolarHBondContact O-N 3.23Å
82	Q	92.2	Very high	84.1	Confident	74 Å²	74	60.6 Å²	60.6	35%	0.346	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-29.1	171.9	-64	-59.8	-31	0	0	112	P67 S80 I84 L85 D86 Y99	P67-Q82 HydrophobicContact CG-CG 4.24Å; S80-Q82 PolarHBondContact O-N 3.22Å; S80-Q82 WeakPolarHBondContact OG-CB 3.4Å; S80-Q82 WeakPolarHBondContact OG-CG 3.36Å; S80-Q82 PolarHBondContact OG-N 3.4Å; Q82-I84 VanDerWaalsContact C-N 3.27Å; Q82-I84 PolarHBondContact O-N 3.27Å; Q82-L85 PolarHBondContact O-N 3.45Å; Q82-D86 WeakPolarHBondContact O-CB 3.46Å; Q82-D86 VanDerWaalsContact O-CG 3.31Å; Q82-D86 PolarHBondContact O-N 3.47Å; Q82-Y99 HydrophobicContact CB-CD1 4.02Å; Q82-Y99 HydrophobicContact CB-CE1 3.95Å
83	Y	94.3	Very high	85.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-49.5	-49.5	174.8	174.4	-105.4	0	0	0	112.1	F21 F31 I79 S80 T81 C87 L94 L96 Y99	F21-Y83 HydrophobicContact CE1-CE1 4.17Å; F31-Y83 HydrophobicContact CE1-CD1 4.32Å; F31-Y83 AromaticContact CE1-CE1 3.97Å; F31-Y83 HydrophobicContact CE1-CE1 3.97Å; F31-Y83 HydrophobicContact CZ-CE1 4.28Å; I79-Y83 HydrophobicContact CG2-CD1 4.46Å; I79-Y83 HydrophobicContact CG2-CG 3.99Å; S80-Y83 WeakPolarHBondContact O-CB 3.34Å; S80-Y83 PolarHBondContact O-N 3.35Å; T81-Y83 PolarHBondContact O-N 3.48Å; Y83-C87 VanDerWaalsContact CE2-SG 3.51Å; Y83-C87 VanDerWaalsContact CZ-SG 3.53Å; Y83-C87 VanDerWaalsContact O-CB 3.27Å; Y83-C87 WeakPolarHBondContact O-CB 3.39Å; Y83-C87 PolarHBondContact O-N 3.06Å; Y83-C87 PolarHBondContact O-SG 3.39Å; Y83-L94 HydrophobicContact CD2-CB 4.45Å; Y83-L94 HydrophobicContact CE2-CB 4.07Å; Y83-L94 VanDerWaalsContact CE2-O 3.25Å; Y83-L94 WeakPolarHBondContact CE2-O 3.37Å; Y83-L94 PolarHBondContact OH-O 3.48Å; Y83-L96 HydrophobicContact CD1-CD2 3.85Å; Y83-L96 HydrophobicContact CD2-CD2 4.08Å; Y83-L96 HydrophobicContact CE1-CD2 3.41Å; Y83-L96 VanDerWaalsContact CE1-CD2 3.41Å; Y83-L96 HydrophobicContact CE1-CG 4.42Å; Y83-L96 HydrophobicContact CE2-CD2 3.63Å; Y83-L96 HydrophobicContact CE2-CG 4Å; Y83-L96 HydrophobicContact CG-CD2 4.17Å; Y83-Y99 AromaticContact CD2-CD2 3.65Å; Y83-Y99 HydrophobicContact CD2-CD2 3.65Å; Y83-Y99 HydrophobicContact CD2-CE2 4.05Å; Y83-Y99 HydrophobicContact CD2-CG 4.11Å; Y83-Y99 HydrophobicContact CG-CD2 4.41Å; Y83-Y99 HydrophobicContact CG-CG 4.45Å; Y83-Y99 VanDerWaalsContact N-CD1 3.35Å
84	I	93.7	Very high	87.5	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.9	-42	-179.7	-60.6	-60.4	0	0	0	111	F21 F31 L42 L45 I46 L64 T81 Q82 V88	F21-I84 HydrophobicContact CD1-CD1 4.43Å; F21-I84 HydrophobicContact CE1-CD1 3.64Å; F21-I84 HydrophobicContact CE2-CD1 4.35Å; F21-I84 HydrophobicContact CZ-CD1 3.59Å; F21-I84 HydrophobicContact CZ-CG2 4.14Å; F31-I84 HydrophobicContact CD1-CD1 4.07Å; F31-I84 HydrophobicContact CE1-CD1 3.68Å; F31-I84 HydrophobicContact CZ-CD1 4Å; L42-I84 HydrophobicContact CD2-CB 3.9Å; L42-I84 HydrophobicContact CD2-CG1 4.44Å; L42-I84 HydrophobicContact CD2-CG2 3.91Å; L45-I84 HydrophobicContact CB-CG2 4.04Å; L45-I84 HydrophobicContact CD1-CG2 4.32Å; I46-I84 HydrophobicContact CD1-CD1 4.14Å; I46-I84 HydrophobicContact CD1-CG1 4.21Å; I46-I84 HydrophobicContact CG1-CD1 3.76Å; I46-I84 HydrophobicContact CG1-CG1 4.17Å; I46-I84 HydrophobicContact CG1-CG2 4.14Å; L64-I84 HydrophobicContact CD1-CD1 4.06Å; L64-I84 HydrophobicContact CD1-CG1 3.57Å; L64-I84 HydrophobicContact CD2-CG1 4.16Å; T81-I84 PolarHBondContact O-N 3.23Å; Q82-I84 VanDerWaalsContact C-N 3.27Å; Q82-I84 PolarHBondContact O-N 3.27Å; I84-V88 HydrophobicContact CG2-CG2 4.39Å; I84-V88 WeakPolarHBondContact O-CB 3.41Å; I84-V88 WeakPolarHBondContact O-CG2 3.39Å; I84-V88 PolarHBondContact O-N 2.93Å
85	L	92.3	Very high	89.1	Confident	34 Å²	34	58.1 Å²	58.1	18%	0.178	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-45.7	-178.4	-62.2	177.8	0	0	0	110.9	L42 L45 Q82 V88 E89	L42-L85 HydrophobicContact CD2-CD2 4.32Å; L42-L85 HydrophobicContact CD2-CG 4.5Å; L45-L85 HydrophobicContact CD1-CD2 4.08Å; Q82-L85 PolarHBondContact O-N 3.45Å; L85-V88 PolarHBondContact O-N 3.39Å; L85-E89 WeakPolarHBondContact O-CB 3.29Å; L85-E89 PolarHBondContact O-N 3Å
86	D	92.7	Very high	90.3	Very high	42 Å²	42	53.7 Å²	53.7	23%	0.225	26%	0.26	C	S	.	.	H	α-helix	trans	-71.6	-38.6	-178.8	-64.2	3.3	0	0	0	111.3	Q82 V88 E89 R90 L94 Y99	Q82-D86 WeakPolarHBondContact O-CB 3.46Å; Q82-D86 VanDerWaalsContact O-CG 3.31Å; Q82-D86 PolarHBondContact O-N 3.47Å; D86-V88 VanDerWaalsContact C-N 3.29Å; D86-V88 PolarHBondContact O-N 3.47Å; D86-E89 PolarHBondContact O-N 2.88Å; D86-R90 WeakPolarHBondContact O-CB 3.33Å; D86-R90 WeakPolarHBondContact O-CG 3.21Å; D86-R90 PolarHBondContact O-N 3Å; D86-L94 HydrophobicContact CB-CD1 3.47Å; D86-L94 VanDerWaalsContact CB-CD1 3.47Å; D86-Y99 HydrophobicContact CB-CE1 4.41Å; D86-Y99 VanDerWaalsContact CB-OH 3.3Å; D86-Y99 WeakPolarHBondContact CB-OH 3.47Å; D86-Y99 WeakPolarHBondContact OD2-CE1 3.47Å; D86-Y99 VanDerWaalsContact OD2-CZ 3.3Å; D86-Y99 PolarHBondContact OD2-OH 2.88Å
87	C	93.7	Very high	91	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.3	-41.3	173.1	-72.4	0	0	0	0	111.4	L20 F21 Y83 N91 E92 L94	L20-C87 HydrophobicContact CD2-CB 4.09Å; L20-C87 WeakPolarHBondContact CD2-O 3.13Å; F21-C87 HydrophobicContact CE1-CB 4.03Å; F21-C87 HydrophobicContact CZ-CB 4.06Å; Y83-C87 VanDerWaalsContact CE2-SG 3.51Å; Y83-C87 VanDerWaalsContact CZ-SG 3.53Å; Y83-C87 VanDerWaalsContact O-CB 3.27Å; Y83-C87 WeakPolarHBondContact O-CB 3.39Å; Y83-C87 PolarHBondContact O-N 3.06Å; Y83-C87 PolarHBondContact O-SG 3.39Å; C87-N91 WeakPolarHBondContact O-CA 3.33Å; C87-N91 PolarHBondContact O-N 3.08Å; C87-E92 VanDerWaalsContact CA-O 3.26Å; C87-E92 WeakPolarHBondContact CA-O 3.28Å; C87-E92 WeakPolarHBondContact CB-O 3.37Å; C87-E92 PolarHBondContact O-N 3.14Å; C87-E92 VanDerWaalsContact O-N 3.14Å; C87-L94 PolarHBondContact SG-N 2.81Å
88	V	92.7	Very high	91.3	Very high	11 Å²	11	55.9 Å²	55.9	7%	0.067	27%	0.272	C	S	.	.	H	α-helix	trans	-69.9	-40.6	178.8	165.7	0	0	0	0	111.6	T15 H16 L20 F21 L45 I84 L85 D86 N91	T15-V88 WeakPolarHBondContact OG1-CG1 3.39Å; H16-V88 HydrophobicContact CB-CB 4.48Å; H16-V88 HydrophobicContact CB-CG1 4.21Å; H16-V88 WeakPolarHBondContact ND1-CG1 3.04Å; L20-V88 HydrophobicContact CD2-CG2 4.16Å; F21-V88 HydrophobicContact CE2-CG2 4.4Å; F21-V88 HydrophobicContact CZ-CG2 4.38Å; L45-V88 HydrophobicContact CB-CG2 4.11Å; L45-V88 HydrophobicContact CD1-CG2 4.26Å; L45-V88 HydrophobicContact CD2-CG1 3.99Å; L45-V88 HydrophobicContact CD2-CG2 4.2Å; L45-V88 HydrophobicContact CG-CG2 4.41Å; I84-V88 HydrophobicContact CG2-CG2 4.39Å; I84-V88 WeakPolarHBondContact O-CB 3.41Å; I84-V88 WeakPolarHBondContact O-CG2 3.39Å; I84-V88 PolarHBondContact O-N 2.93Å; L85-V88 PolarHBondContact O-N 3.39Å; D86-V88 VanDerWaalsContact C-N 3.29Å; D86-V88 PolarHBondContact O-N 3.47Å; V88-N91 PolarHBondContact O-N 3.25Å
89	E	90.7	Very high	91.4	Very high	160 Å²	160	58 Å²	58	75%	0.748	28%	0.28	S	S	*	.	H	α-helix	trans	-67.1	-43.4	179.1	-177.7	170.2	-163.5	0	0	111.7	L85 D86 N91	L85-E89 WeakPolarHBondContact O-CB 3.29Å; L85-E89 PolarHBondContact O-N 3Å; D86-E89 PolarHBondContact O-N 2.88Å; E89-N91 VanDerWaalsContact C-N 3.31Å
90	R	89	Confident	91.3	Very high	161 Å²	161	61.4 Å²	61.4	61%	0.608	29%	0.292	S	S	*	.	H	α-helix	trans	-83.1	-10	178.6	-63.7	176.7	61.6	118.2	0.2	113.3	D86 E92	D86-R90 WeakPolarHBondContact O-CB 3.33Å; D86-R90 WeakPolarHBondContact O-CG 3.21Å; D86-R90 PolarHBondContact O-N 3Å; R90-E92 HydrophobicContact CB-CB 4.25Å; R90-E92 IonicContact NE-OE2 3.38Å; R90-E92 IonicContact NH2-OE2 2.94Å; R90-E92 PolarHBondContact O-N 3.22Å
91	N	91	Very high	90.7	Very high	83 Å²	83	63 Å²	63	44%	0.444	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	37.7	-172.6	-168.9	37.8	0	0	0	112.6	H16 S17 C87 V88 E89	H16-N91 WeakPolarHBondContact CA-OD1 3.32Å; H16-N91 WeakPolarHBondContact CB-OD1 3.23Å; S17-N91 WeakPolarHBondContact CB-OD1 3.35Å; S17-N91 PolarHBondContact N-OD1 3.18Å; C87-N91 WeakPolarHBondContact O-CA 3.33Å; C87-N91 PolarHBondContact O-N 3.08Å; V88-N91 PolarHBondContact O-N 3.25Å; E89-N91 VanDerWaalsContact C-N 3.31Å
92	E	91.5	Very high	89.4	Confident	101 Å²	101	66.4 Å²	66.4	47%	0.472	34%	0.335	S	S	.	.	S	Bend	trans	-141.6	138.9	-173.5	-179.1	179.9	-156.5	0	0	108.4	L20 C87 R90 L94	L20-E92 VanDerWaalsContact CD1-C 3.46Å; C87-E92 VanDerWaalsContact CA-O 3.26Å; C87-E92 WeakPolarHBondContact CA-O 3.28Å; C87-E92 WeakPolarHBondContact CB-O 3.37Å; C87-E92 PolarHBondContact O-N 3.14Å; C87-E92 VanDerWaalsContact O-N 3.14Å; R90-E92 HydrophobicContact CB-CB 4.25Å; R90-E92 IonicContact NE-OE2 3.38Å; R90-E92 IonicContact NH2-OE2 2.94Å; R90-E92 PolarHBondContact O-N 3.22Å; E92-L94 PolarHBondContact O-N 3.27Å; E92-L94 VanDerWaalsContact O-N 3.15Å
93	R	90.3	Very high	87.5	Confident	105 Å²	105	67.4 Å²	67.4	40%	0.396	35%	0.35	S	S	.	.			trans	-77.5	103.4	176.9	-178.2	175.5	164.5	176.2	-5.6	109.2	L20 V22 M29	L20-R93 HydrophobicContact CD1-CB 4.47Å; V22-R93 PolarHBondContact O-NH1 2.98Å; M29-R93 PolarHBondContact SD-NE 3.07Å; M29-R93 VanDerWaalsContact SD-NE 3.42Å; M29-R93 PolarHBondContact SD-NH1 3.34Å
94	L	90.9	Very high	84.9	Confident	28 Å²	28	72 Å²	72	15%	0.147	39%	0.388	C	S	.	.			trans	-72.8	166	178.2	-56.9	174.3	0	0	0	111.4	Y83 D86 C87 E92 Y99	Y83-L94 HydrophobicContact CD2-CB 4.45Å; Y83-L94 HydrophobicContact CE2-CB 4.07Å; Y83-L94 VanDerWaalsContact CE2-O 3.25Å; Y83-L94 WeakPolarHBondContact CE2-O 3.37Å; Y83-L94 PolarHBondContact OH-O 3.48Å; D86-L94 HydrophobicContact CB-CD1 3.47Å; D86-L94 VanDerWaalsContact CB-CD1 3.47Å; C87-L94 PolarHBondContact SG-N 2.81Å; E92-L94 PolarHBondContact O-N 3.27Å; E92-L94 VanDerWaalsContact O-N 3.15Å; L94-Y99 HydrophobicContact CB-CE2 4.16Å; L94-Y99 HydrophobicContact CD1-CE2 4.08Å; L94-Y99 VanDerWaalsContact CD1-OH 3.25Å; L94-Y99 WeakPolarHBondContact CD1-OH 3.27Å
95	E	90.8	Very high	82.3	Confident	138 Å²	138	78 Å²	78	65%	0.645	43%	0.43	S	S	*	.			trans	-71.6	126.8	174.7	-170.4	170.3	-150.9	0	0	110.2	E97 Y99	E95-E97 VanDerWaalsContact C-N 3.3Å; E95-E97 HydrophobicContact CG-CB 4.25Å; E95-E97 WeakPolarHBondContact CG-OE2 3.28Å; E95-E97 PolarHBondContact O-N 3.3Å; E95-Y99 WeakPolarHBondContact O-CD2 3.29Å
96	L	89.5	Confident	79.9	Confident	33 Å²	33	81.4 Å²	81.4	17%	0.173	46%	0.463	C	S	.	.	S	Bend	trans	-67.5	-35.4	-174.1	-76.3	161.8	0	0	0	111.4	M29 V62 I79 Y83 A98 Y99	M29-L96 HydrophobicContact CE-CD1 4.03Å; V62-L96 HydrophobicContact CG1-CD2 3.83Å; V62-L96 HydrophobicContact CG2-CD1 4.07Å; V62-L96 HydrophobicContact CG2-CD2 4.04Å; I79-L96 WeakPolarHBondContact CD1-O 3.34Å; I79-L96 HydrophobicContact CG1-CD2 4.47Å; I79-L96 HydrophobicContact CG2-CD2 4.39Å; Y83-L96 HydrophobicContact CD1-CD2 3.85Å; Y83-L96 HydrophobicContact CD2-CD2 4.08Å; Y83-L96 HydrophobicContact CE1-CD2 3.41Å; Y83-L96 VanDerWaalsContact CE1-CD2 3.41Å; Y83-L96 HydrophobicContact CE1-CG 4.42Å; Y83-L96 HydrophobicContact CE2-CD2 3.63Å; Y83-L96 HydrophobicContact CE2-CG 4Å; Y83-L96 HydrophobicContact CG-CD2 4.17Å; L96-A98 VanDerWaalsContact C-N 3.28Å; L96-A98 PolarHBondContact O-N 2.98Å; L96-Y99 PolarHBondContact O-N 2.86Å; L96-Y99 VanDerWaalsContact O-N 3.09Å
97	E	87.4	Confident	77.3	Confident	108 Å²	108	84.1 Å²	84.1	51%	0.505	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-61.9	-35	-174.2	-69.7	66.6	-152.2	0	0	112.1	E95 Y99 R100	E95-E97 VanDerWaalsContact C-N 3.3Å; E95-E97 HydrophobicContact CG-CB 4.25Å; E95-E97 WeakPolarHBondContact CG-OE2 3.28Å; E95-E97 PolarHBondContact O-N 3.3Å; E97-Y99 PolarHBondContact O-N 3.21Å; E97-Y99 VanDerWaalsContact O-N 3.15Å; E97-R100 WeakPolarHBondContact O-CB 3.37Å; E97-R100 PolarHBondContact O-N 3.17Å
98	A	89.2	Confident	74.9	Confident	80 Å²	80	91.6 Å²	91.6	66%	0.661	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-62.3	-21	177.7	0	0	0	0	0	113.1	L96	L96-A98 VanDerWaalsContact C-N 3.28Å; L96-A98 PolarHBondContact O-N 2.98Å
99	Y	91	Very high	72.3	Confident	45 Å²	45	98 Å²	98	18%	0.176	57%	0.571	C	S	.	*	G	3₁₀ helix	trans	-105.8	7.4	-176.4	-68.6	-92.4	0	0	0	113	S80 Q82 Y83 D86 L94 E95 L96 E97 L101	S80-Y99 WeakPolarHBondContact CB-O 3.34Å; S80-Y99 PolarHBondContact N-O 3.42Å; Q82-Y99 HydrophobicContact CB-CD1 4.02Å; Q82-Y99 HydrophobicContact CB-CE1 3.95Å; Y83-Y99 AromaticContact CD2-CD2 3.65Å; Y83-Y99 HydrophobicContact CD2-CD2 3.65Å; Y83-Y99 HydrophobicContact CD2-CE2 4.05Å; Y83-Y99 HydrophobicContact CD2-CG 4.11Å; Y83-Y99 HydrophobicContact CG-CD2 4.41Å; Y83-Y99 HydrophobicContact CG-CG 4.45Å; Y83-Y99 VanDerWaalsContact N-CD1 3.35Å; D86-Y99 HydrophobicContact CB-CE1 4.41Å; D86-Y99 VanDerWaalsContact CB-OH 3.3Å; D86-Y99 WeakPolarHBondContact CB-OH 3.47Å; D86-Y99 WeakPolarHBondContact OD2-CE1 3.47Å; D86-Y99 VanDerWaalsContact OD2-CZ 3.3Å; D86-Y99 PolarHBondContact OD2-OH 2.88Å; L94-Y99 HydrophobicContact CB-CE2 4.16Å; L94-Y99 HydrophobicContact CD1-CE2 4.08Å; L94-Y99 VanDerWaalsContact CD1-OH 3.25Å; L94-Y99 WeakPolarHBondContact CD1-OH 3.27Å; E95-Y99 WeakPolarHBondContact O-CD2 3.29Å; L96-Y99 PolarHBondContact O-N 2.86Å; L96-Y99 VanDerWaalsContact O-N 3.09Å; E97-Y99 PolarHBondContact O-N 3.21Å; E97-Y99 VanDerWaalsContact O-N 3.15Å; Y99-L101 PolarHBondContact O-N 3.06Å
100	R	89.7	Confident	69.6	Low	79 Å²	79	94.1 Å²	94.1	30%	0.298	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.2	116.8	-174.7	-171.8	178.6	-73.2	-112.6	-2	112.5	D77 F78 I79 E97 G102	D77-R100 IonicContact OD1-NH1 2.95Å; D77-R100 PolarHBondContact OD1-NH1 2.97Å; D77-R100 IonicContact OD2-CZ 3.79Å; D77-R100 IonicContact OD2-NH1 2.7Å; D77-R100 PolarHBondContact OD2-NH1 2.93Å; F78-R100 CarbonylContact O-C 3.54Å; F78-R100 WeakPolarHBondContact O-CA 3.48Å; I79-R100 HydrophobicContact CD1-CB 3.96Å; I79-R100 HydrophobicContact CD1-CG 4.28Å; E97-R100 WeakPolarHBondContact O-CB 3.37Å; E97-R100 PolarHBondContact O-N 3.17Å; R100-G102 PolarHBondContact O-N 3.48Å
101	L	79.4	Confident	67.4	Low	41 Å²	41	92.2 Å²	92.2	22%	0.215	59%	0.586	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.2	95.5	170.9	-62	176.2	0	0	0	108.1	A65 L71 F78 Y99	A65-L101 HydrophobicContact CB-CD1 3.78Å; A65-L101 WeakPolarHBondContact O-CD1 3.31Å; L71-L101 HydrophobicContact CD1-CB 4.17Å; L71-L101 HydrophobicContact CD1-CD1 4.41Å; L71-L101 HydrophobicContact CD2-CB 4.38Å; L71-L101 VanDerWaalsContact CD2-O 3.23Å; L71-L101 WeakPolarHBondContact CD2-O 3.41Å; F78-L101 HydrophobicContact CB-CB 4.2Å; F78-L101 PolarHBondContact O-N 3.43Å; Y99-L101 PolarHBondContact O-N 3.06Å
102	G	64.5	Low	65.2	Low	72 Å²	72	97.4 Å²	97.4	74%	0.742	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	145.3	-8.6	172.5	0	0	0	0	0	117.5	R100	R100-G102 PolarHBondContact O-N 3.48Å
103	S	52.9	Low	62.6	Low	94 Å²	94	97 Å²	97	66%	0.657	62%	0.621	S	S	*	*	S	Bend	trans	-131.8	24.1	-175.3	-166.2	0	0	0	0	115.6
104	A	40.9	Very low	60.3	Low	96 Å²	96	101.6 Å²	101.6	79%	0.793	64%	0.644	S	S	*	*	S	Bend	trans	-115.3	27.4	-174.6	0	0	0	0	0	115.4
105	S	38.4	Very low	57.6	Low	126 Å²	126	106.6 Å²	106.6	88%	0.881	68%	0.678	S	S	*	*	S	Bend	trans	-153.2	22.1	173.7	-147.8	0	0	0	0	117.4
106	A	40.7	Very low	55.1	Low	106 Å²	106	103.6 Å²	103.6	88%	0.876	69%	0.685	S	S	*	*	S	Bend	trans	-130.7	2.8	-179	0	0	0	0	0	116.5
107	A	39.3	Very low	52.7	Low	100 Å²	100	106.4 Å²	106.4	83%	0.826	71%	0.713	S	S	*	*	S	Bend	trans	-134.9	12.1	-170.8	0	0	0	0	0	116.8
108	D	43.2	Very low	50.4	Low	156 Å²	156	109.6 Å²	109.6	83%	0.834	73%	0.732	S	S	*	*	S	Bend	trans	-139.9	74.6	-179.9	-148.4	11.4	0	0	0	112.5
109	T	38.9	Very low	48	Very low	146 Å²	146	110.7 Å²	110.7	90%	0.896	74%	0.741	S	S	*	*			trans	175.2	54.3	146.7	26.4	0	0	0	0	110.2
110	G	33.8	Very low	45.4	Very low	79 Å²	79	118.4 Å²	118.4	81%	0.814	78%	0.779	S	S	*	*			trans	-98	70	159.7	0	0	0	0	0	109.1
111	S	43.1	Very low	42.9	Very low	121 Å²	121	118.1 Å²	118.1	85%	0.846	80%	0.8	S	S	*	*			trans	-148.5	115.8	162.2	-89.8	0	0	0	0	110.7
112	E	44	Very low	40.7	Very low	191 Å²	191	121.3 Å²	121.3	89%	0.893	83%	0.833	S	S	*	*			trans	-34.8	145.3	177.2	-81.1	166.5	64.4	0	0	117.8
113	A	37.7	Very low	39.6	Very low	93 Å²	93	122.5 Å²	122.5	77%	0.769	84%	0.835	S	S	*	*			trans	80	99.7	132.5	0	0	0	0	0	119.9
114	K	40.4	Very low	39.3	Very low	202 Å²	202	127 Å²	127	88%	0.878	85%	0.846	S	S	*	*				122.4	126.6	109.9	-159.6	169.4	-176.5	173.9	0	114
115	P	35.3	Very low	39.2	Very low	132 Å²	132	128.4 Å²	128.4	86%	0.857	85%	0.847	S	S	*	*			trans	-90.6	145.8	-171.1	36.2	-32.4	0	0	0	111.9
116	G	38.5	Very low	39.6	Very low	76 Å²	76	130.6 Å²	130.6	78%	0.784	84%	0.843	S	S	*	*			trans	179.9	110.1	171.5	0	0	0	0	0	115
117	A	38.2	Very low	39.8	Very low	92 Å²	92	131.4 Å²	131.4	76%	0.76	84%	0.84	S	S	*	*			trans	78.3	104.2	146.9	0	0	0	0	0	120.4
118	L	39	Very low	39.8	Very low	175 Å²	175	134.7 Å²	134.7	92%	0.916	84%	0.838	S	S	*	*				52.2	107.2	119.4	-64.7	161.6	0	0	0	118.5
119	A	39.3	Very low	39.6	Very low	103 Å²	103	139 Å²	139	85%	0.851	84%	0.843	S	S	*	*			trans	-163.7	117.5	133.9	0	0	0	0	0	110.6
120	E	35.9	Very low	39.9	Very low	206 Å²	206	139.4 Å²	139.4	96%	0.963	84%	0.838	S	S	*	*			trans	-61.9	140.4	167.3	-69.8	169.8	98.8	0	0	111
121	G	36.6	Very low	40	Very low	73 Å²	73	141 Å²	141	75%	0.753	84%	0.844	S	S	*	*			trans	178.3	85.3	176	0	0	0	0	0	113.2
122	A	34.1	Very low	40.4	Very low	108 Å²	108	137.7 Å²	137.7	89%	0.893	83%	0.829	S	S	*	*			trans	15.9	103.3	152.2	0	0	0	0	0	118.8
123	A	41.5	Very low	41	Very low	97 Å²	97	140.9 Å²	140.9	80%	0.802	83%	0.833	S	S	*	*			trans	-158.7	133.3	147.2	0	0	0	0	0	108.6
124	E	46.4	Very low	42.5	Very low	189 Å²	189	140.3 Å²	140.3	88%	0.883	82%	0.816	S	S	*	*			trans	-51.5	134.1	179.5	-74.6	-171.9	89.1	0	0	112.1	E126	E124-E126 PolarHBondContact O-N 3.42Å
125	P	39.3	Very low	44.4	Very low	126 Å²	126	134.3 Å²	134.3	82%	0.818	80%	0.804	S	S	*	*			trans	-83	104.3	177.4	31.8	-28.3	0	0	0	109.3
126	E	47.4	Very low	46.7	Very low	171 Å²	171	130.8 Å²	130.8	80%	0.799	78%	0.776	S	S	*	*			trans	-54.1	140.3	157.9	-69	-158.5	107.3	0	0	109.3	E124 Q128	E124-E126 PolarHBondContact O-N 3.42Å; E126-Q128 VanDerWaalsContact C-N 3.29Å; E126-Q128 PolarHBondContact O-N 2.88Å
127	P	44.9	Very low	48.9	Very low	123 Å²	123	130.5 Å²	130.5	80%	0.799	76%	0.759	S	S	*	*			trans	-69.9	90.7	-178.3	28	-31.7	0	0	0	109.2	R129	P127-R129 PolarHBondContact O-N 3.33Å
128	Q	37.6	Very low	51	Low	170 Å²	170	131.8 Å²	131.8	79%	0.794	75%	0.753	S	S	*	*			trans	-50.2	109.3	164.7	-69.8	177.1	-30.8	0	0	107.4	E126 L130	E126-Q128 VanDerWaalsContact C-N 3.29Å; E126-Q128 PolarHBondContact O-N 2.88Å; Q128-L130 VanDerWaalsContact C-N 3.25Å; Q128-L130 PolarHBondContact O-N 2.74Å
129	R	40.1	Very low	53.2	Low	247 Å²	247	126.9 Å²	126.9	93%	0.932	74%	0.737	S	S	*	*			trans	-62.4	91.8	173.4	-65.5	-172.3	-170.6	168.9	3.9	107.7	P127 A131	P127-R129 PolarHBondContact O-N 3.33Å; R129-A131 PolarHBondContact O-N 3.3Å
130	L	44.9	Very low	55.5	Low	153 Å²	153	122.8 Å²	122.8	80%	0.801	70%	0.701	S	S	*	*			trans	-62.3	107.3	175	-71.7	172.1	0	0	0	108.2	Q128 G132	Q128-L130 VanDerWaalsContact C-N 3.25Å; Q128-L130 PolarHBondContact O-N 2.74Å; L130-G132 PolarHBondContact O-N 2.75Å
131	A	35.9	Very low	58	Low	112 Å²	112	113 Å²	113	93%	0.926	66%	0.656	S	S	*	*			trans	-59.1	99.8	173.2	0	0	0	0	0	109.9	R129	R129-A131 PolarHBondContact O-N 3.3Å
132	G	50.6	Low	60.3	Low	53 Å²	53	112.5 Å²	112.5	55%	0.546	64%	0.638	S	S	.	*	S	Bend	trans	-172.7	136	173.1	0	0	0	0	0	108	L130 I134	L130-G132 PolarHBondContact O-N 2.75Å; G132-I134 PolarHBondContact O-N 2.85Å
133	R	57.5	Low	62.8	Low	258 Å²	258	108.4 Å²	108.4	97%	0.974	60%	0.604	S	S	*	*			trans	-56	101.6	-179.5	-165.5	179.1	-166.5	177.3	4	109.2	A135	R133-A135 PolarHBondContact O-N 3.18Å
134	I	69.8	Low	65	Low	81 Å²	81	103.8 Å²	103.8	42%	0.415	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-62.9	119.2	178.3	-52.1	171.8	0	0	0	106.8	G132 Q174 H175	G132-I134 PolarHBondContact O-N 2.85Å; I134-Q174 HydrophobicContact CD1-CB 3.8Å; I134-H175 PolarHBondContact O-CE1 3.02Å
135	A	79.4	Confident	67	Low	76 Å²	76	95.3 Å²	95.3	63%	0.628	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-75.5	144.8	175	0	0	0	0	0	109.5	R133 T137	R133-A135 PolarHBondContact O-N 3.18Å; A135-T137 PolarHBondContact O-N 3.07Å
136	F	83.5	Confident	69.2	Low	57 Å²	57	92.2 Å²	92.2	25%	0.25	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-64.6	126	171.4	-74.7	-84	0	0	0	110.2	D140 I144 H175 S179 L180 R183	F136-D140 HydrophobicContact CD1-CB 4.22Å; F136-I144 HydrophobicContact CD1-CD1 4.39Å; F136-I144 HydrophobicContact CE1-CD1 4.22Å; F136-H175 AromaticContact CD1-CD2 3.72Å; F136-H175 AromaticContact CD1-NE2 3.7Å; F136-H175 HydrophobicContact CE1-CB 4.09Å; F136-H175 AromaticContact CE1-CD2 3.66Å; F136-H175 AromaticContact CE1-CG 3.63Å; F136-H175 AromaticContact CE1-ND1 3.97Å; F136-H175 HydrophobicContact CZ-CB 4.35Å; F136-S179 WeakPolarHBondContact CZ-O 3.44Å; F136-L180 HydrophobicContact CE1-CD2 4.34Å; F136-R183 HydrophobicContact CD1-CB 4.17Å; F136-R183 HydrophobicContact CD1-CG 3.68Å; F136-R183 HydrophobicContact CD2-CG 4.31Å; F136-R183 HydrophobicContact CE1-CB 3.64Å; F136-R183 HydrophobicContact CE1-CG 3.69Å; F136-R183 HydrophobicContact CE2-CB 4.08Å; F136-R183 HydrophobicContact CE2-CG 4.31Å; F136-R183 HydrophobicContact CG-CG 4Å; F136-R183 HydrophobicContact CZ-CB 3.59Å; F136-R183 HydrophobicContact CZ-CG 4.01Å
137	T	85.2	Confident	71.1	Confident	71 Å²	71	85.4 Å²	85.4	44%	0.436	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-93.1	160.2	172.8	64.4	0	0	0	0	110.8	A135 A139 D140 D141	A135-T137 PolarHBondContact O-N 3.07Å; T137-A139 PolarHBondContact O-N 3.25Å; T137-D140 PolarHBondContact N-OD2 3.01Å; T137-D140 WeakPolarHBondContact O-CB 3.5Å; T137-D140 PolarHBondContact O-N 3.09Å; T137-D140 PolarHBondContact OG1-N 3.18Å; T137-D140 PolarHBondContact OG1-OD2 3.42Å; T137-D141 PolarHBondContact O-N 3.26Å; T137-D141 VanDerWaalsContact O-N 3.07Å
138	D	82.4	Confident	73.1	Confident	119 Å²	119	79.8 Å²	79.8	64%	0.636	44%	0.436	S	S	*	.	H	α-helix	trans	-60.7	-29.8	174.3	-66	-28.1	0	0	0	111.6	D141 V142	D138-D141 PolarHBondContact O-N 3.46Å; D138-V142 WeakPolarHBondContact O-CG2 3.35Å; D138-V142 PolarHBondContact O-N 3.43Å
139	A	85	Confident	75.2	Confident	71 Å²	71	79.8 Å²	79.8	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-65.5	-40.2	172.8	0	0	0	0	0	112	T137 V142 A143	T137-A139 PolarHBondContact O-N 3.25Å; A139-V142 PolarHBondContact O-N 3.19Å; A139-A143 WeakPolarHBondContact O-CB 3.3Å; A139-A143 PolarHBondContact O-N 3.1Å
140	D	87.5	Confident	77.3	Confident	18 Å²	18	75 Å²	75	10%	0.096	42%	0.422	C	S	.	.	H	α-helix	trans	-61.6	-44.9	172.9	-62.6	-53.2	0	0	0	110.6	F136 T137 V142 A143 I144 T173 H175	F136-D140 HydrophobicContact CD1-CB 4.22Å; T137-D140 PolarHBondContact N-OD2 3.01Å; T137-D140 WeakPolarHBondContact O-CB 3.5Å; T137-D140 PolarHBondContact O-N 3.09Å; T137-D140 PolarHBondContact OG1-N 3.18Å; T137-D140 PolarHBondContact OG1-OD2 3.42Å; D140-V142 PolarHBondContact O-N 3.28Å; D140-A143 PolarHBondContact O-N 3.38Å; D140-I144 WeakPolarHBondContact O-CD1 3.18Å; D140-I144 WeakPolarHBondContact O-CG1 3.35Å; D140-I144 PolarHBondContact O-N 3.33Å; D140-T173 HydrophobicContact CB-CG2 4.11Å; D140-T173 WeakPolarHBondContact OD1-CB 3.36Å; D140-T173 WeakPolarHBondContact OD1-CG2 3.18Å; D140-H175 VanDerWaalsContact CG-CD2 3.49Å; D140-H175 VanDerWaalsContact CG-NE2 3.32Å; D140-H175 IonicContact OD1-CD2 2.88Å; D140-H175 IonicContact OD1-NE2 3.82Å; D140-H175 IonicContact OD2-CD2 3.88Å; D140-H175 IonicContact OD2-NE2 2.77Å; D140-H175 PolarHBondContact OD2-NE2 3.38Å
141	D	88	Confident	79.1	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-62.3	-42	179.6	-72.6	-19.5	0	0	0	112	T137 D138 I144 L145 R183 L188 Y195	T137-D141 PolarHBondContact O-N 3.26Å; T137-D141 VanDerWaalsContact O-N 3.07Å; D138-D141 PolarHBondContact O-N 3.46Å; D141-I144 PolarHBondContact O-N 3.08Å; D141-L145 WeakPolarHBondContact O-CG 3.3Å; D141-L145 PolarHBondContact O-N 2.96Å; D141-R183 IonicContact OD1-CZ 3.54Å; D141-R183 IonicContact OD1-NE 2.96Å; D141-R183 PolarHBondContact OD1-NE 3.35Å; D141-R183 IonicContact OD1-NH2 3.62Å; D141-R183 PolarHBondContact OD1-NH2 2.91Å; D141-R183 IonicContact OD2-CZ 3.7Å; D141-R183 IonicContact OD2-NE 3.3Å; D141-R183 IonicContact OD2-NH2 3.59Å; D141-R183 PolarHBondContact OD2-NH2 3.44Å; D141-L188 HydrophobicContact CB-CD1 4.4Å; D141-L188 HydrophobicContact CB-CD2 3.84Å; D141-Y195 HydrophobicContact CB-CD1 3.83Å; D141-Y195 HydrophobicContact CB-CE1 3.5Å; D141-Y195 VanDerWaalsContact CB-CE1 3.5Å; D141-Y195 WeakPolarHBondContact OD2-CE1 3.41Å; D141-Y195 VanDerWaalsContact OD2-CZ 3.24Å; D141-Y195 PolarHBondContact OD2-OH 3.09Å
142	V	85.7	Confident	81.2	Confident	63 Å²	63	67 Å²	67	38%	0.382	37%	0.367	S	S	.	.	H	α-helix	trans	-65.5	-41.4	174.5	172.9	0	0	0	0	111.4	D138 A139 D140 L145 T146	D138-V142 WeakPolarHBondContact O-CG2 3.35Å; D138-V142 PolarHBondContact O-N 3.43Å; A139-V142 PolarHBondContact O-N 3.19Å; D140-V142 PolarHBondContact O-N 3.28Å; V142-L145 PolarHBondContact O-N 2.72Å; V142-T146 VanDerWaalsContact O-CB 3.31Å; V142-T146 WeakPolarHBondContact O-CB 3.45Å; V142-T146 PolarHBondContact O-N 3.4Å; V142-T146 PolarHBondContact O-OG1 2.94Å
143	A	86.7	Confident	82.2	Confident	21 Å²	21	76.1 Å²	76.1	17%	0.174	39%	0.385	C	S	.	.	H	α-helix	trans	-62.9	-42.1	176.3	0	0	0	0	0	111.5	A139 D140 Y147 M167 T173	A139-A143 WeakPolarHBondContact O-CB 3.3Å; A139-A143 PolarHBondContact O-N 3.1Å; D140-A143 PolarHBondContact O-N 3.38Å; A143-Y147 VanDerWaalsContact O-CB 3.23Å; A143-Y147 WeakPolarHBondContact O-CB 3.41Å; A143-Y147 PolarHBondContact O-N 2.96Å; A143-M167 HydrophobicContact CB-CE 4.36Å; A143-T173 HydrophobicContact CB-CG2 4.04Å
144	I	88.1	Confident	82.6	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-52.2	174.7	-66.4	161.9	0	0	0	110.6	F136 D140 D141 T146 Y147 V148 W164 M167 L180 R183 Y184 L188	F136-I144 HydrophobicContact CD1-CD1 4.39Å; F136-I144 HydrophobicContact CE1-CD1 4.22Å; D140-I144 WeakPolarHBondContact O-CD1 3.18Å; D140-I144 WeakPolarHBondContact O-CG1 3.35Å; D140-I144 PolarHBondContact O-N 3.33Å; D141-I144 PolarHBondContact O-N 3.08Å; I144-T146 PolarHBondContact O-N 2.97Å; I144-Y147 PolarHBondContact O-N 3.29Å; I144-V148 HydrophobicContact CG2-CG2 4.29Å; I144-V148 WeakPolarHBondContact O-CB 3.38Å; I144-V148 WeakPolarHBondContact O-CG2 3.07Å; I144-V148 PolarHBondContact O-N 3.31Å; I144-W164 HydrophobicContact CG2-CH2 4.38Å; I144-W164 HydrophobicContact CG2-CZ3 4Å; I144-M167 HydrophobicContact CB-CE 4.17Å; I144-M167 HydrophobicContact CG1-CE 3.69Å; I144-M167 HydrophobicContact CG1-SD 4.28Å; I144-L180 HydrophobicContact CD1-CD2 3.62Å; I144-L180 HydrophobicContact CG1-CD2 3.53Å; I144-R183 HydrophobicContact CD1-CB 4.26Å; I144-R183 HydrophobicContact CD1-CG 3.9Å; I144-Y184 HydrophobicContact CG2-CD2 3.86Å; I144-Y184 HydrophobicContact CG2-CG 4.37Å; I144-L188 HydrophobicContact CB-CD1 3.75Å; I144-L188 HydrophobicContact CD1-CD1 3.93Å; I144-L188 HydrophobicContact CG1-CD1 4.46Å; I144-L188 HydrophobicContact CG2-CD1 3.5Å; I144-L188 VanDerWaalsContact CG2-CD1 3.5Å
145	L	87.4	Confident	82.4	Confident	12 Å²	12	67.5 Å²	67.5	6%	0.063	37%	0.369	C	S	.	.	H	α-helix	trans	-61.6	-44	-178.6	-74.9	173.5	0	0	0	112.4	D141 V142 K149 Y184 L188 E192 Y195	D141-L145 WeakPolarHBondContact O-CG 3.3Å; D141-L145 PolarHBondContact O-N 2.96Å; V142-L145 PolarHBondContact O-N 2.72Å; L145-K149 WeakPolarHBondContact O-CB 3.43Å; L145-K149 PolarHBondContact O-N 2.98Å; L145-Y184 HydrophobicContact CD2-CE2 4.12Å; L145-L188 HydrophobicContact CD1-CD2 4.5Å; L145-L188 HydrophobicContact CD2-CB 3.97Å; L145-L188 HydrophobicContact CG-CB 4.47Å; L145-L188 HydrophobicContact CG-CD1 4.32Å; L145-E192 HydrophobicContact CD2-CB 4.03Å; L145-E192 HydrophobicContact CD2-CG 3.67Å; L145-Y195 VanDerWaalsContact CD1-CB 3.44Å; L145-Y195 HydrophobicContact CD1-CD2 4.03Å; L145-Y195 HydrophobicContact CD1-CG 3.92Å
146	T	85.3	Confident	81.6	Confident	60 Å²	60	66.9 Å²	66.9	37%	0.368	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-48.2	178.7	-54.5	0	0	0	0	110.2	V142 I144 V148 K149 E150	V142-T146 VanDerWaalsContact O-CB 3.31Å; V142-T146 WeakPolarHBondContact O-CB 3.45Å; V142-T146 PolarHBondContact O-N 3.4Å; V142-T146 PolarHBondContact O-OG1 2.94Å; I144-T146 PolarHBondContact O-N 2.97Å; T146-V148 PolarHBondContact O-N 3.44Å; T146-K149 PolarHBondContact O-N 2.72Å; T146-E150 WeakPolarHBondContact O-CG 3.39Å; T146-E150 PolarHBondContact O-N 3.14Å
147	Y	86.9	Confident	80.9	Confident	28 Å²	28	66.1 Å²	66.1	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-43.4	-179.6	-167.8	-92.3	0	0	0	112.4	A143 I144 E150 N151 L163 A166 M167 L172	A143-Y147 VanDerWaalsContact O-CB 3.23Å; A143-Y147 WeakPolarHBondContact O-CB 3.41Å; A143-Y147 PolarHBondContact O-N 2.96Å; I144-Y147 PolarHBondContact O-N 3.29Å; Y147-E150 PolarHBondContact O-N 2.92Å; Y147-N151 HydrophobicContact CD1-CB 4.37Å; Y147-N151 HydrophobicContact CE1-CB 4.08Å; Y147-N151 VanDerWaalsContact O-CB 3.3Å; Y147-N151 WeakPolarHBondContact O-CB 3.43Å; Y147-N151 PolarHBondContact O-N 3.34Å; Y147-N151 PolarHBondContact O-ND2 3.38Å; Y147-L163 HydrophobicContact CD1-CD1 4.12Å; Y147-L163 HydrophobicContact CD1-CG 4.48Å; Y147-L163 HydrophobicContact CE1-CD1 3.8Å; Y147-L163 HydrophobicContact CE1-CG 4.28Å; Y147-L163 WeakPolarHBondContact CE1-O 3.47Å; Y147-A166 VanDerWaalsContact OH-C 3.26Å; Y147-A166 WeakPolarHBondContact OH-CB 3.18Å; Y147-M167 HydrophobicContact CD1-CB 3.71Å; Y147-M167 HydrophobicContact CD1-CG 3.72Å; Y147-M167 HydrophobicContact CD1-SD 4Å; Y147-M167 HydrophobicContact CD2-CG 4.16Å; Y147-M167 HydrophobicContact CE1-CB 3.56Å; Y147-M167 HydrophobicContact CE1-CG 4.05Å; Y147-M167 HydrophobicContact CE2-CB 4.44Å; Y147-M167 HydrophobicContact CE2-CG 4.43Å; Y147-M167 HydrophobicContact CG-CB 4.23Å; Y147-M167 HydrophobicContact CG-CG 3.77Å; Y147-M167 HydrophobicContact CG-SD 4.1Å; Y147-M167 PolarHBondContact OH-N 2.93Å; Y147-L172 HydrophobicContact CD2-CD1 3.29Å; Y147-L172 HydrophobicContact CE2-CD1 3.76Å; Y147-L172 HydrophobicContact CG-CD1 4.15Å
148	V	87	Confident	80.3	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.03	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-44.5	177.4	173	0	0	0	0	110.5	I144 T146 E150 N151 A152 V158 L163 W164 Y184	I144-V148 HydrophobicContact CG2-CG2 4.29Å; I144-V148 WeakPolarHBondContact O-CB 3.38Å; I144-V148 WeakPolarHBondContact O-CG2 3.07Å; I144-V148 PolarHBondContact O-N 3.31Å; T146-V148 PolarHBondContact O-N 3.44Å; V148-E150 VanDerWaalsContact C-N 3.31Å; V148-E150 PolarHBondContact O-N 3.02Å; V148-N151 PolarHBondContact O-N 3.23Å; V148-A152 HydrophobicContact CG1-CB 4Å; V148-A152 WeakPolarHBondContact O-CA 3.32Å; V148-A152 WeakPolarHBondContact O-CB 3.35Å; V148-A152 PolarHBondContact O-N 3.32Å; V148-V158 HydrophobicContact CG1-CG2 3.88Å; V148-L163 HydrophobicContact CG2-CD2 4.13Å; V148-W164 HydrophobicContact CG2-CH2 3.46Å; V148-W164 VanDerWaalsContact CG2-CH2 3.46Å; V148-W164 HydrophobicContact CG2-CZ2 4.34Å; V148-W164 HydrophobicContact CG2-CZ3 3.84Å; V148-Y184 HydrophobicContact CB-CE2 4.1Å; V148-Y184 HydrophobicContact CG1-CE2 3.79Å; V148-Y184 HydrophobicContact CG2-CD2 3.95Å; V148-Y184 HydrophobicContact CG2-CE2 3.99Å
149	K	83.5	Confident	79.6	Confident	170 Å²	170	62.2 Å²	62.2	74%	0.739	34%	0.342	S	S	*	.	H	α-helix	trans	-62	-37.5	178.4	-175	179.8	177.7	-176.9	0	112.8	L145 T146	L145-K149 WeakPolarHBondContact O-CB 3.43Å; L145-K149 PolarHBondContact O-N 2.98Å; T146-K149 PolarHBondContact O-N 2.72Å
150	E	83.1	Confident	79.3	Confident	148 Å²	148	60.5 Å²	60.5	69%	0.692	33%	0.331	S	S	*	.	H	α-helix	trans	-80.2	-32.9	-178.5	-70.6	178	172.1	0	0	113.3	T146 Y147 V148	T146-E150 WeakPolarHBondContact O-CG 3.39Å; T146-E150 PolarHBondContact O-N 3.14Å; Y147-E150 PolarHBondContact O-N 2.92Å; V148-E150 VanDerWaalsContact C-N 3.31Å; V148-E150 PolarHBondContact O-N 3.02Å
151	N	83	Confident	79.1	Confident	70 Å²	70	63 Å²	63	37%	0.374	34%	0.344	S	S	.	.	H	α-helix	trans	-111.3	-18.2	-170	-65.3	-87.6	0	0	0	114	Y147 V148 R153 L163	Y147-N151 HydrophobicContact CD1-CB 4.37Å; Y147-N151 HydrophobicContact CE1-CB 4.08Å; Y147-N151 VanDerWaalsContact O-CB 3.3Å; Y147-N151 WeakPolarHBondContact O-CB 3.43Å; Y147-N151 PolarHBondContact O-N 3.34Å; Y147-N151 PolarHBondContact O-ND2 3.38Å; V148-N151 PolarHBondContact O-N 3.23Å; N151-R153 PolarHBondContact O-N 3.06Å; N151-R153 VanDerWaalsContact O-N 3.11Å; N151-L163 HydrophobicContact CB-CD1 3.38Å
152	A	80.4	Confident	79	Confident	25 Å²	25	66.8 Å²	66.8	21%	0.207	38%	0.376	C	S	.	.			trans	-80.1	94.7	174.6	0	0	0	0	0	110.3	V148 S154 V158 L163	V148-A152 HydrophobicContact CG1-CB 4Å; V148-A152 WeakPolarHBondContact O-CA 3.32Å; V148-A152 WeakPolarHBondContact O-CB 3.35Å; V148-A152 PolarHBondContact O-N 3.32Å; A152-S154 PolarHBondContact O-N 2.94Å; A152-V158 HydrophobicContact CB-CG2 3.75Å; A152-L163 HydrophobicContact CB-CD2 4.24Å
153	R	70.1	Confident	79	Confident	246 Å²	246	64.3 Å²	64.3	93%	0.928	36%	0.361	S	S	*	.	S	Bend	trans	-62.2	-20	173.5	-68.5	-172.5	-179.7	116.4	0.8	113.9	N151	N151-R153 PolarHBondContact O-N 3.06Å; N151-R153 VanDerWaalsContact O-N 3.11Å
154	S	66.3	Low	79.1	Confident	44 Å²	44	63.3 Å²	63.3	31%	0.308	35%	0.352	S	S	.	.	S	Bend	trans	-154.7	157.5	-177.6	62.2	0	0	0	0	110.5	A152 S156 S157	A152-S154 PolarHBondContact O-N 2.94Å; S154-S156 PolarHBondContact O-N 3.34Å; S154-S156 PolarHBondContact OG-OG 2.89Å; S154-S157 WeakPolarHBondContact O-CB 3.3Å; S154-S157 PolarHBondContact O-N 2.95Å; S154-S157 PolarHBondContact OG-N 3.37Å
155	P	65.3	Low	79.1	Confident	113 Å²	113	68.6 Å²	68.6	73%	0.734	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.1	172.5	22.3	-32.2	0	0	0	112.9
156	S	63.3	Low	79	Confident	63 Å²	63	69.9 Å²	69.9	44%	0.441	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-28.2	172.4	57.5	0	0	0	0	113.1	S154 V158 T159 G160	S154-S156 PolarHBondContact O-N 3.34Å; S154-S156 PolarHBondContact OG-OG 2.89Å; S156-V158 PolarHBondContact O-N 2.91Å; S156-T159 WeakPolarHBondContact O-CB 3.38Å; S156-T159 PolarHBondContact O-N 3.45Å; S156-G160 PolarHBondContact O-N 2.95Å
157	S	68.9	Low	79.1	Confident	42 Å²	42	67 Å²	67	29%	0.294	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-29	179.4	-152.3	0	0	0	0	112.8	S154 T159	S154-S157 WeakPolarHBondContact O-CB 3.3Å; S154-S157 PolarHBondContact O-N 2.95Å; S154-S157 PolarHBondContact OG-N 3.37Å; S157-T159 VanDerWaalsContact C-N 3.28Å; S157-T159 PolarHBondContact O-N 3.46Å
158	V	72.5	Confident	79.2	Confident	11 Å²	11	69.2 Å²	69.2	7%	0.067	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-25.8	175.4	-177	0	0	0	0	112.1	V148 A152 S156 L163 W164 Y184	V148-V158 HydrophobicContact CG1-CG2 3.88Å; A152-V158 HydrophobicContact CB-CG2 3.75Å; S156-V158 PolarHBondContact O-N 2.91Å; V158-L163 HydrophobicContact CG2-CD2 4.46Å; V158-W164 HydrophobicContact CG1-CZ2 3.81Å; V158-W164 PolarHBondContact O-NE1 3.24Å; V158-Y184 HydrophobicContact CG1-CD1 3.53Å; V158-Y184 HydrophobicContact CG1-CE1 3.22Å
159	T	68.1	Low	79.1	Confident	97 Å²	97	77.8 Å²	77.8	60%	0.595	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-32.5	-178.7	-54.8	0	0	0	0	111.6	S156 S157 K181	S156-T159 WeakPolarHBondContact O-CB 3.38Å; S156-T159 PolarHBondContact O-N 3.45Å; S157-T159 VanDerWaalsContact C-N 3.28Å; S157-T159 PolarHBondContact O-N 3.46Å; T159-K181 WeakPolarHBondContact O-CE 3.37Å; T159-K181 PolarHBondContact O-NZ 3.09Å
160	G	77.6	Confident	78.9	Confident	35 Å²	35	72.5 Å²	72.5	36%	0.361	40%	0.402	S	S	.	.	S	Bend	trans	-70.3	158.7	176.2	0	0	0	0	0	113.5	S156 W164	S156-G160 PolarHBondContact O-N 2.95Å; G160-W164 PolarHBondContact O-NE1 2.79Å
161	N	84.8	Confident	78.5	Confident	69 Å²	69	70 Å²	70	37%	0.369	40%	0.402	S	S	.	.	S	Bend	trans	-84.6	-14	179.4	-66.5	-17.5	0	0	0	113.5	W164 K165 W177 K181	N161-W164 PolarHBondContact O-N 2.76Å; N161-K165 WeakPolarHBondContact O-CG 3.47Å; N161-K165 PolarHBondContact O-N 2.93Å; N161-W177 HydrophobicContact CB-CH2 4.47Å; N161-W177 HydrophobicContact CB-CZ3 4.04Å; N161-K181 PolarHBondContact OD1-NZ 2.9Å
162	A	85.3	Confident	77.9	Confident	80 Å²	80	70.9 Å²	70.9	66%	0.661	41%	0.406	S	S	*	.	H	α-helix	trans	-62.5	-45.4	-174.6	0	0	0	0	0	112.5	W164 K165 A166	A162-W164 PolarHBondContact O-N 3.46Å; A162-K165 PolarHBondContact O-N 3.22Å; A162-A166 WeakPolarHBondContact O-CB 3.35Å; A162-A166 PolarHBondContact O-N 2.98Å
163	L	86.5	Confident	77.8	Confident	11 Å²	11	70.4 Å²	70.4	6%	0.058	40%	0.401	C	S	.	.	H	α-helix	trans	-56.6	-48.3	177.5	-177	71.2	0	0	0	111.6	Y147 V148 N151 A152 V158 A166 M167	Y147-L163 HydrophobicContact CD1-CD1 4.12Å; Y147-L163 HydrophobicContact CD1-CG 4.48Å; Y147-L163 HydrophobicContact CE1-CD1 3.8Å; Y147-L163 HydrophobicContact CE1-CG 4.28Å; Y147-L163 WeakPolarHBondContact CE1-O 3.47Å; V148-L163 HydrophobicContact CG2-CD2 4.13Å; N151-L163 HydrophobicContact CB-CD1 3.38Å; A152-L163 HydrophobicContact CB-CD2 4.24Å; V158-L163 HydrophobicContact CG2-CD2 4.46Å; L163-A166 PolarHBondContact O-N 3.27Å; L163-M167 PolarHBondContact O-N 3.45Å
164	W	88.8	Confident	78.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-70.8	-40.2	-175.8	-53.2	108.2	0	0	0	112.8	I144 V148 V158 G160 N161 A162 A166 M167 E168 W177 L180 K181 Y184	I144-W164 HydrophobicContact CG2-CH2 4.38Å; I144-W164 HydrophobicContact CG2-CZ3 4Å; V148-W164 HydrophobicContact CG2-CH2 3.46Å; V148-W164 VanDerWaalsContact CG2-CH2 3.46Å; V148-W164 HydrophobicContact CG2-CZ2 4.34Å; V148-W164 HydrophobicContact CG2-CZ3 3.84Å; V158-W164 HydrophobicContact CG1-CZ2 3.81Å; V158-W164 PolarHBondContact O-NE1 3.24Å; G160-W164 PolarHBondContact O-NE1 2.79Å; N161-W164 PolarHBondContact O-N 2.76Å; A162-W164 PolarHBondContact O-N 3.46Å; W164-A166 VanDerWaalsContact C-N 3.31Å; W164-M167 HydrophobicContact CE3-SD 4.49Å; W164-M167 HydrophobicContact CZ3-SD 4.49Å; W164-M167 WeakPolarHBondContact O-CB 3.27Å; W164-M167 PolarHBondContact O-N 3.35Å; W164-E168 PolarHBondContact O-N 2.87Å; W164-W177 VanDerWaalsContact C-CB 3.5Å; W164-W177 HydrophobicContact CB-CB 3.92Å; W164-W177 HydrophobicContact CB-CE3 4.12Å; W164-W177 VanDerWaalsContact O-CB 3.3Å; W164-W177 WeakPolarHBondContact O-CB 3.41Å; W164-L180 HydrophobicContact CE3-CB 3.96Å; W164-L180 HydrophobicContact CZ3-CB 4.38Å; W164-K181 HydrophobicContact CB-CB 4.45Å; W164-K181 HydrophobicContact CD2-CB 3.74Å; W164-K181 HydrophobicContact CD2-CG 4.22Å; W164-K181 HydrophobicContact CE3-CB 4.37Å; W164-K181 HydrophobicContact CG-CB 3.73Å; W164-K181 HydrophobicContact CG-CD 4.39Å; W164-K181 HydrophobicContact CG-CG 4.18Å; W164-K181 HydrophobicContact CZ2-CG 4.42Å; W164-Y184 AromaticContact CH2-CD1 3.88Å; W164-Y184 HydrophobicContact CH2-CD1 3.88Å; W164-Y184 HydrophobicContact CH2-CD2 4.05Å; W164-Y184 AromaticContact CH2-CG 3.45Å; W164-Y184 HydrophobicContact CH2-CG 3.45Å; W164-Y184 VanDerWaalsContact CH2-CG 3.45Å; W164-Y184 HydrophobicContact CZ2-CD1 4Å; W164-Y184 HydrophobicContact CZ2-CG 4.05Å; W164-Y184 HydrophobicContact CZ3-CG 4.47Å
165	K	86.9	Confident	79.2	Confident	111 Å²	111	64.9 Å²	64.9	48%	0.483	38%	0.38	S	S	.	.	H	α-helix	trans	-64.6	-37.6	174.1	-74	-176.2	176	-171.6	0	111.7	N161 A162 M167 K169 W177	N161-K165 WeakPolarHBondContact O-CG 3.47Å; N161-K165 PolarHBondContact O-N 2.93Å; A162-K165 PolarHBondContact O-N 3.22Å; K165-M167 VanDerWaalsContact C-N 3.32Å; K165-K169 WeakPolarHBondContact O-CB 3.21Å; K165-K169 PolarHBondContact O-N 3.05Å; K165-W177 HydrophobicContact CG-CB 4.38Å; K165-W177 HydrophobicContact CG-CD2 4Å; K165-W177 HydrophobicContact CG-CG 3.92Å
166	A	86.2	Confident	80.3	Confident	39 Å²	39	61.4 Å²	61.4	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-39.2	174.1	0	0	0	0	0	111.3	Y147 A162 L163 W164 K169 S170	Y147-A166 VanDerWaalsContact OH-C 3.26Å; Y147-A166 WeakPolarHBondContact OH-CB 3.18Å; A162-A166 WeakPolarHBondContact O-CB 3.35Å; A162-A166 PolarHBondContact O-N 2.98Å; L163-A166 PolarHBondContact O-N 3.27Å; W164-A166 VanDerWaalsContact C-N 3.31Å; A166-K169 PolarHBondContact O-N 3.44Å; A166-S170 PolarHBondContact O-N 3.4Å; A166-S170 PolarHBondContact O-OG 2.94Å
167	M	86.3	Confident	81.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64	-43.7	176.6	-165.2	-178.3	169.7	0	0	112.8	A143 I144 Y147 L163 W164 K165 S170 S171 L172 T173 L180	A143-M167 HydrophobicContact CB-CE 4.36Å; I144-M167 HydrophobicContact CB-CE 4.17Å; I144-M167 HydrophobicContact CG1-CE 3.69Å; I144-M167 HydrophobicContact CG1-SD 4.28Å; Y147-M167 HydrophobicContact CD1-CB 3.71Å; Y147-M167 HydrophobicContact CD1-CG 3.72Å; Y147-M167 HydrophobicContact CD1-SD 4Å; Y147-M167 HydrophobicContact CD2-CG 4.16Å; Y147-M167 HydrophobicContact CE1-CB 3.56Å; Y147-M167 HydrophobicContact CE1-CG 4.05Å; Y147-M167 HydrophobicContact CE2-CB 4.44Å; Y147-M167 HydrophobicContact CE2-CG 4.43Å; Y147-M167 HydrophobicContact CG-CB 4.23Å; Y147-M167 HydrophobicContact CG-CG 3.77Å; Y147-M167 HydrophobicContact CG-SD 4.1Å; Y147-M167 PolarHBondContact OH-N 2.93Å; L163-M167 PolarHBondContact O-N 3.45Å; W164-M167 HydrophobicContact CE3-SD 4.49Å; W164-M167 HydrophobicContact CZ3-SD 4.49Å; W164-M167 WeakPolarHBondContact O-CB 3.27Å; W164-M167 PolarHBondContact O-N 3.35Å; K165-M167 VanDerWaalsContact C-N 3.32Å; M167-S170 WeakPolarHBondContact CA-OG 3.37Å; M167-S170 PolarHBondContact O-N 3.01Å; M167-S170 PolarHBondContact O-OG 3.36Å; M167-S171 PolarHBondContact O-N 2.67Å; M167-L172 HydrophobicContact CE-CB 4.31Å; M167-L172 HydrophobicContact CG-CD1 4.26Å; M167-T173 HydrophobicContact CE-CG2 3.96Å; M167-L180 HydrophobicContact CB-CD1 4.41Å; M167-L180 HydrophobicContact CE-CD1 4.36Å; M167-L180 HydrophobicContact CE-CD2 4.16Å; M167-L180 HydrophobicContact CG-CD1 4.16Å; M167-L180 HydrophobicContact SD-CD1 3.93Å; M167-L180 HydrophobicContact SD-CD2 4.39Å
168	E	88.3	Confident	82.6	Confident	75 Å²	75	64.7 Å²	64.7	35%	0.35	36%	0.36	S	S	.	.	H	α-helix	trans	-63.2	-42.7	173.7	179.2	-175.6	-115.5	0	0	111	W164 S170 S171 S176 W177	W164-E168 PolarHBondContact O-N 2.87Å; E168-S170 VanDerWaalsContact C-N 3.28Å; E168-S170 PolarHBondContact O-N 2.83Å; E168-S171 WeakPolarHBondContact O-CA 3.45Å; E168-S171 PolarHBondContact O-N 2.83Å; E168-S176 VanDerWaalsContact OE1-CA 3.31Å; E168-S176 WeakPolarHBondContact OE1-CA 3.4Å; E168-W177 HydrophobicContact CB-CB 3.94Å; E168-W177 PolarHBondContact OE1-N 3.48Å
169	K	86.3	Confident	83.4	Confident	185 Å²	185	66.5 Å²	66.5	80%	0.804	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-35.1	176.6	-172.2	176.3	-178.7	179.7	0	112.4	K165 A166 S171	K165-K169 WeakPolarHBondContact O-CB 3.21Å; K165-K169 PolarHBondContact O-N 3.05Å; A166-K169 PolarHBondContact O-N 3.44Å; K169-S171 PolarHBondContact O-N 2.98Å
170	S	79.7	Confident	84.4	Confident	58 Å²	58	61.9 Å²	61.9	41%	0.406	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-2.6	173.4	52.2	0	0	0	0	114.1	A166 M167 E168 L172	A166-S170 PolarHBondContact O-N 3.4Å; A166-S170 PolarHBondContact O-OG 2.94Å; M167-S170 WeakPolarHBondContact CA-OG 3.37Å; M167-S170 PolarHBondContact O-N 3.01Å; M167-S170 PolarHBondContact O-OG 3.36Å; E168-S170 VanDerWaalsContact C-N 3.28Å; E168-S170 PolarHBondContact O-N 2.83Å; S170-L172 PolarHBondContact O-N 3.35Å; S170-L172 VanDerWaalsContact OG-CD1 3.3Å; S170-L172 WeakPolarHBondContact OG-CD1 3.33Å
171	S	74.7	Confident	84.9	Confident	97 Å²	97	62.1 Å²	62.1	68%	0.678	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	33.6	177	-58.9	0	0	0	0	113.9	M167 E168 K169 T173	M167-S171 PolarHBondContact O-N 2.67Å; E168-S171 WeakPolarHBondContact O-CA 3.45Å; E168-S171 PolarHBondContact O-N 2.83Å; K169-S171 PolarHBondContact O-N 2.98Å; S171-T173 PolarHBondContact O-N 2.95Å
172	L	69.9	Low	85.1	Confident	88 Å²	88	62.3 Å²	62.3	46%	0.461	34%	0.337	S	S	.	.	S	Bend	trans	-68.5	-21.1	179.5	-81	157.3	0	0	0	112.6	Y147 M167 S170	Y147-L172 HydrophobicContact CD2-CD1 3.29Å; Y147-L172 HydrophobicContact CE2-CD1 3.76Å; Y147-L172 HydrophobicContact CG-CD1 4.15Å; M167-L172 HydrophobicContact CE-CB 4.31Å; M167-L172 HydrophobicContact CG-CD1 4.26Å; S170-L172 PolarHBondContact O-N 3.35Å; S170-L172 VanDerWaalsContact OG-CD1 3.3Å; S170-L172 WeakPolarHBondContact OG-CD1 3.33Å
173	T	78.9	Confident	85.2	Confident	15 Å²	15	60.7 Å²	60.7	9%	0.092	31%	0.314	C	S	.	.	S	Bend	trans	-143.9	161.3	177.4	68.4	0	0	0	0	108.6	D140 A143 M167 S171 H175 L180	D140-T173 HydrophobicContact CB-CG2 4.11Å; D140-T173 WeakPolarHBondContact OD1-CB 3.36Å; D140-T173 WeakPolarHBondContact OD1-CG2 3.18Å; A143-T173 HydrophobicContact CB-CG2 4.04Å; M167-T173 HydrophobicContact CE-CG2 3.96Å; S171-T173 PolarHBondContact O-N 2.95Å; T173-H175 PolarHBondContact O-N 2.99Å; T173-H175 PolarHBondContact OG1-N 3.35Å; T173-L180 HydrophobicContact CG2-CD2 4.09Å; T173-L180 VanDerWaalsContact OG1-CD2 3.3Å; T173-L180 WeakPolarHBondContact OG1-CD2 3.33Å
174	Q	81.4	Confident	85.3	Confident	158 Å²	158	60.9 Å²	60.9	74%	0.738	31%	0.314	S	S	*	.	S	Bend	trans	-82.9	3.3	174.5	-63.7	-172.3	-25	0	0	113.3	I134	I134-Q174 HydrophobicContact CD1-CB 3.8Å
175	H	84.3	Confident	85.2	Confident	15 Å²	15	64.5 Å²	64.5	7%	0.069	33%	0.333	C	S	.	.	S	Bend	trans	-89.9	145.8	-175.4	-60.7	-71	0	0	0	111.2	I134 F136 D140 T173 L180	I134-H175 PolarHBondContact O-CE1 3.02Å; F136-H175 AromaticContact CD1-CD2 3.72Å; F136-H175 AromaticContact CD1-NE2 3.7Å; F136-H175 HydrophobicContact CE1-CB 4.09Å; F136-H175 AromaticContact CE1-CD2 3.66Å; F136-H175 AromaticContact CE1-CG 3.63Å; F136-H175 AromaticContact CE1-ND1 3.97Å; F136-H175 HydrophobicContact CZ-CB 4.35Å; D140-H175 VanDerWaalsContact CG-CD2 3.49Å; D140-H175 VanDerWaalsContact CG-NE2 3.32Å; D140-H175 IonicContact OD1-CD2 2.88Å; D140-H175 IonicContact OD1-NE2 3.82Å; D140-H175 IonicContact OD2-CD2 3.88Å; D140-H175 IonicContact OD2-NE2 2.77Å; D140-H175 PolarHBondContact OD2-NE2 3.38Å; T173-H175 PolarHBondContact O-N 2.99Å; T173-H175 PolarHBondContact OG1-N 3.35Å; H175-L180 HydrophobicContact CB-CD2 3.92Å; H175-L180 HydrophobicContact CB-CG 4.01Å
176	S	87.4	Confident	85.1	Confident	41 Å²	41	65.8 Å²	65.8	29%	0.287	34%	0.339	S	S	.	.			trans	-63.8	152.9	174.9	76.2	0	0	0	0	111.4	E168 Q178 S179 L180	E168-S176 VanDerWaalsContact OE1-CA 3.31Å; E168-S176 WeakPolarHBondContact OE1-CA 3.4Å; S176-Q178 PolarHBondContact O-N 3.14Å; S176-Q178 VanDerWaalsContact O-N 3.08Å; S176-S179 WeakPolarHBondContact O-CA 3.2Å; S176-S179 WeakPolarHBondContact O-CB 3.43Å; S176-S179 PolarHBondContact O-N 2.93Å; S176-S179 PolarHBondContact OG-N 3.46Å; S176-S179 VanDerWaalsContact OG-N 3.17Å; S176-S179 PolarHBondContact OG-OG 3.37Å; S176-L180 WeakPolarHBondContact O-CG 3.44Å; S176-L180 PolarHBondContact O-N 2.82Å
177	W	89.4	Confident	84.9	Confident	51 Å²	51	68.2 Å²	68.2	19%	0.193	34%	0.343	C	S	.	.	H	α-helix	trans	-54.1	-32.4	175.9	71.2	-89.6	0	0	0	113	N161 W164 K165 E168 K181	N161-W177 HydrophobicContact CB-CH2 4.47Å; N161-W177 HydrophobicContact CB-CZ3 4.04Å; W164-W177 VanDerWaalsContact C-CB 3.5Å; W164-W177 HydrophobicContact CB-CB 3.92Å; W164-W177 HydrophobicContact CB-CE3 4.12Å; W164-W177 VanDerWaalsContact O-CB 3.3Å; W164-W177 WeakPolarHBondContact O-CB 3.41Å; K165-W177 HydrophobicContact CG-CB 4.38Å; K165-W177 HydrophobicContact CG-CD2 4Å; K165-W177 HydrophobicContact CG-CG 3.92Å; E168-W177 HydrophobicContact CB-CB 3.94Å; E168-W177 PolarHBondContact OE1-N 3.48Å; W177-K181 WeakPolarHBondContact O-CB 3.34Å; W177-K181 PolarHBondContact O-N 2.94Å
178	Q	90.9	Very high	84.9	Confident	123 Å²	123	68.2 Å²	68.2	58%	0.575	34%	0.343	S	S	*	.	H	α-helix	trans	-67.4	-44.9	176.3	-65.3	177.8	-94	0	0	111.4	S176 K181 D182	S176-Q178 PolarHBondContact O-N 3.14Å; S176-Q178 VanDerWaalsContact O-N 3.08Å; Q178-K181 PolarHBondContact O-N 3.06Å; Q178-D182 WeakPolarHBondContact O-CB 3.31Å; Q178-D182 PolarHBondContact O-N 3.39Å
179	S	89	Confident	84.4	Confident	48 Å²	48	72.9 Å²	72.9	34%	0.336	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-42.4	177.2	-54.4	0	0	0	0	110.8	F136 S176 D182 R183	F136-S179 WeakPolarHBondContact CZ-O 3.44Å; S176-S179 WeakPolarHBondContact O-CA 3.2Å; S176-S179 WeakPolarHBondContact O-CB 3.43Å; S176-S179 PolarHBondContact O-N 2.93Å; S176-S179 PolarHBondContact OG-N 3.46Å; S176-S179 VanDerWaalsContact OG-N 3.17Å; S176-S179 PolarHBondContact OG-OG 3.37Å; S179-D182 PolarHBondContact O-N 2.98Å; S179-R183 VanDerWaalsContact O-CB 3.27Å; S179-R183 WeakPolarHBondContact O-CB 3.2Å; S179-R183 PolarHBondContact O-N 3.03Å
180	L	88.8	Confident	83.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-46.1	176.7	-66.2	169.3	0	0	0	112.1	F136 I144 W164 M167 T173 H175 S176 R183 Y184	F136-L180 HydrophobicContact CE1-CD2 4.34Å; I144-L180 HydrophobicContact CD1-CD2 3.62Å; I144-L180 HydrophobicContact CG1-CD2 3.53Å; W164-L180 HydrophobicContact CE3-CB 3.96Å; W164-L180 HydrophobicContact CZ3-CB 4.38Å; M167-L180 HydrophobicContact CB-CD1 4.41Å; M167-L180 HydrophobicContact CE-CD1 4.36Å; M167-L180 HydrophobicContact CE-CD2 4.16Å; M167-L180 HydrophobicContact CG-CD1 4.16Å; M167-L180 HydrophobicContact SD-CD1 3.93Å; M167-L180 HydrophobicContact SD-CD2 4.39Å; T173-L180 HydrophobicContact CG2-CD2 4.09Å; T173-L180 VanDerWaalsContact OG1-CD2 3.3Å; T173-L180 WeakPolarHBondContact OG1-CD2 3.33Å; H175-L180 HydrophobicContact CB-CD2 3.92Å; H175-L180 HydrophobicContact CB-CG 4.01Å; S176-L180 WeakPolarHBondContact O-CG 3.44Å; S176-L180 PolarHBondContact O-N 2.82Å; L180-R183 PolarHBondContact O-N 2.82Å; L180-Y184 PolarHBondContact O-N 3.36Å
181	K	89	Confident	83.2	Confident	41 Å²	41	69 Å²	69	18%	0.178	36%	0.355	C	S	.	.	H	α-helix	trans	-60.6	-48.2	175.9	-176.6	176.8	-170.2	179.8	0	111.8	T159 N161 W164 W177 Q178 Y184 L185	T159-K181 WeakPolarHBondContact O-CE 3.37Å; T159-K181 PolarHBondContact O-NZ 3.09Å; N161-K181 PolarHBondContact OD1-NZ 2.9Å; W164-K181 HydrophobicContact CB-CB 4.45Å; W164-K181 HydrophobicContact CD2-CB 3.74Å; W164-K181 HydrophobicContact CD2-CG 4.22Å; W164-K181 HydrophobicContact CE3-CB 4.37Å; W164-K181 HydrophobicContact CG-CB 3.73Å; W164-K181 HydrophobicContact CG-CD 4.39Å; W164-K181 HydrophobicContact CG-CG 4.18Å; W164-K181 HydrophobicContact CZ2-CG 4.42Å; W177-K181 WeakPolarHBondContact O-CB 3.34Å; W177-K181 PolarHBondContact O-N 2.94Å; Q178-K181 PolarHBondContact O-N 3.06Å; K181-Y184 PolarHBondContact O-N 2.89Å; K181-L185 HydrophobicContact CG-CD1 3.87Å; K181-L185 HydrophobicContact CG-CG 4.41Å; K181-L185 WeakPolarHBondContact O-CB 3.23Å; K181-L185 WeakPolarHBondContact O-CG 3.3Å; K181-L185 PolarHBondContact O-N 3.29Å
182	D	88.7	Confident	83	Confident	72 Å²	72	67.8 Å²	67.8	39%	0.385	34%	0.339	S	S	.	.	H	α-helix	trans	-62.4	-44.8	179.8	-169.5	69.6	0	0	0	111.4	Q178 S179 Y184 L185 K186	Q178-D182 WeakPolarHBondContact O-CB 3.31Å; Q178-D182 PolarHBondContact O-N 3.39Å; S179-D182 PolarHBondContact O-N 2.98Å; D182-Y184 PolarHBondContact O-N 3.42Å; D182-L185 PolarHBondContact O-N 2.74Å; D182-K186 WeakPolarHBondContact O-CB 2.99Å; D182-K186 PolarHBondContact O-N 3.34Å; D182-K186 WeakPolarHBondContact OD1-CE 3.21Å; D182-K186 IonicContact OD1-NZ 2.74Å; D182-K186 PolarHBondContact OD1-NZ 3.48Å; D182-K186 IonicContact OD2-NZ 3.47Å; D182-K186 PolarHBondContact OD2-NZ 3.46Å
183	R	88.5	Confident	82.8	Confident	46 Å²	46	70.9 Å²	70.9	17%	0.174	35%	0.35	C	S	.	.	H	α-helix	trans	-58.1	-47.2	175.8	-176.7	67.1	173.9	-169.4	-3.2	111.3	F136 D141 I144 S179 L180 H187 L188	F136-R183 HydrophobicContact CD1-CB 4.17Å; F136-R183 HydrophobicContact CD1-CG 3.68Å; F136-R183 HydrophobicContact CD2-CG 4.31Å; F136-R183 HydrophobicContact CE1-CB 3.64Å; F136-R183 HydrophobicContact CE1-CG 3.69Å; F136-R183 HydrophobicContact CE2-CB 4.08Å; F136-R183 HydrophobicContact CE2-CG 4.31Å; F136-R183 HydrophobicContact CG-CG 4Å; F136-R183 HydrophobicContact CZ-CB 3.59Å; F136-R183 HydrophobicContact CZ-CG 4.01Å; D141-R183 IonicContact OD1-CZ 3.54Å; D141-R183 IonicContact OD1-NE 2.96Å; D141-R183 PolarHBondContact OD1-NE 3.35Å; D141-R183 IonicContact OD1-NH2 3.62Å; D141-R183 PolarHBondContact OD1-NH2 2.91Å; D141-R183 IonicContact OD2-CZ 3.7Å; D141-R183 IonicContact OD2-NE 3.3Å; D141-R183 IonicContact OD2-NH2 3.59Å; D141-R183 PolarHBondContact OD2-NH2 3.44Å; I144-R183 HydrophobicContact CD1-CB 4.26Å; I144-R183 HydrophobicContact CD1-CG 3.9Å; S179-R183 VanDerWaalsContact O-CB 3.27Å; S179-R183 WeakPolarHBondContact O-CB 3.2Å; S179-R183 PolarHBondContact O-N 3.03Å; L180-R183 PolarHBondContact O-N 2.82Å; R183-H187 WeakPolarHBondContact O-CA 3.32Å; R183-H187 WeakPolarHBondContact O-CB 3.2Å; R183-H187 PolarHBondContact O-N 3.27Å; R183-L188 HydrophobicContact CG-CD1 4.29Å; R183-L188 PolarHBondContact O-N 3.33Å
184	Y	88.4	Confident	82.2	Confident	15 Å²	15	77 Å²	77	6%	0.059	38%	0.376	C	S	.	.	I	π-helix	trans	-62.6	-51.5	177.7	-178.1	-90	0	0	0	111.9	I144 L145 V148 V158 W164 L180 K181 D182 K186 L188 R189 E192	I144-Y184 HydrophobicContact CG2-CD2 3.86Å; I144-Y184 HydrophobicContact CG2-CG 4.37Å; L145-Y184 HydrophobicContact CD2-CE2 4.12Å; V148-Y184 HydrophobicContact CB-CE2 4.1Å; V148-Y184 HydrophobicContact CG1-CE2 3.79Å; V148-Y184 HydrophobicContact CG2-CD2 3.95Å; V148-Y184 HydrophobicContact CG2-CE2 3.99Å; V158-Y184 HydrophobicContact CG1-CD1 3.53Å; V158-Y184 HydrophobicContact CG1-CE1 3.22Å; W164-Y184 AromaticContact CH2-CD1 3.88Å; W164-Y184 HydrophobicContact CH2-CD1 3.88Å; W164-Y184 HydrophobicContact CH2-CD2 4.05Å; W164-Y184 AromaticContact CH2-CG 3.45Å; W164-Y184 HydrophobicContact CH2-CG 3.45Å; W164-Y184 VanDerWaalsContact CH2-CG 3.45Å; W164-Y184 HydrophobicContact CZ2-CD1 4Å; W164-Y184 HydrophobicContact CZ2-CG 4.05Å; W164-Y184 HydrophobicContact CZ3-CG 4.47Å; L180-Y184 PolarHBondContact O-N 3.36Å; K181-Y184 PolarHBondContact O-N 2.89Å; D182-Y184 PolarHBondContact O-N 3.42Å; Y184-K186 VanDerWaalsContact C-N 3.35Å; Y184-K186 PolarHBondContact O-N 3.4Å; Y184-L188 HydrophobicContact CD2-CB 3.9Å; Y184-L188 HydrophobicContact CD2-CD1 4.32Å; Y184-L188 HydrophobicContact CE2-CB 4.43Å; Y184-L188 HydrophobicContact CG-CB 4.47Å; Y184-L188 PolarHBondContact O-N 2.61Å; Y184-L188 VanDerWaalsContact O-N 3.14Å; Y184-R189 HydrophobicContact CD1-CB 4.37Å; Y184-R189 HydrophobicContact CE1-CB 4Å; Y184-R189 HydrophobicContact CE1-CG 4.17Å; Y184-R189 WeakPolarHBondContact O-CB 3.35Å; Y184-R189 PolarHBondContact O-N 2.73Å; Y184-E192 PolarHBondContact OH-OE1 3.24Å
185	L	86.2	Confident	81.4	Confident	77 Å²	77	71.7 Å²	71.7	40%	0.403	35%	0.349	S	S	.	.	I	π-helix	trans	-63.8	-37	-175.4	-71.9	175.3	0	0	0	113.2	K181 D182	K181-L185 HydrophobicContact CG-CD1 3.87Å; K181-L185 HydrophobicContact CG-CG 4.41Å; K181-L185 WeakPolarHBondContact O-CB 3.23Å; K181-L185 WeakPolarHBondContact O-CG 3.3Å; K181-L185 PolarHBondContact O-N 3.29Å; D182-L185 PolarHBondContact O-N 2.74Å
186	K	85.2	Confident	80.1	Confident	138 Å²	138	76.3 Å²	76.3	60%	0.6	37%	0.374	S	S	*	.	I	π-helix	trans	-90.4	-36.4	-177.2	-70.7	-179.2	179.5	152.4	0	114.4	D182 Y184	D182-K186 WeakPolarHBondContact O-CB 2.99Å; D182-K186 PolarHBondContact O-N 3.34Å; D182-K186 WeakPolarHBondContact OD1-CE 3.21Å; D182-K186 IonicContact OD1-NZ 2.74Å; D182-K186 PolarHBondContact OD1-NZ 3.48Å; D182-K186 IonicContact OD2-NZ 3.47Å; D182-K186 PolarHBondContact OD2-NZ 3.46Å; Y184-K186 VanDerWaalsContact C-N 3.35Å; Y184-K186 PolarHBondContact O-N 3.4Å
187	H	81.8	Confident	78.4	Confident	90 Å²	90	81.5 Å²	81.5	42%	0.417	40%	0.398	S	S	.	.	I	π-helix	trans	-117.3	-32.3	-167.1	-63.9	-78.2	0	0	0	114.2	R183 Q191	R183-H187 WeakPolarHBondContact O-CA 3.32Å; R183-H187 WeakPolarHBondContact O-CB 3.2Å; R183-H187 PolarHBondContact O-N 3.27Å; H187-Q191 PolarHBondContact O-OE1 2.93Å; H187-Q191 VanDerWaalsContact O-OE1 3.09Å
188	L	85.3	Confident	76.1	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	43%	0.425	C	S	.	.	I	π-helix	trans	-99.8	-31.4	-173.9	-54.9	174.2	0	0	0	113	D141 I144 L145 R183 Y184 G190 Q191 E192 Y195	D141-L188 HydrophobicContact CB-CD1 4.4Å; D141-L188 HydrophobicContact CB-CD2 3.84Å; I144-L188 HydrophobicContact CB-CD1 3.75Å; I144-L188 HydrophobicContact CD1-CD1 3.93Å; I144-L188 HydrophobicContact CG1-CD1 4.46Å; I144-L188 HydrophobicContact CG2-CD1 3.5Å; I144-L188 VanDerWaalsContact CG2-CD1 3.5Å; L145-L188 HydrophobicContact CD1-CD2 4.5Å; L145-L188 HydrophobicContact CD2-CB 3.97Å; L145-L188 HydrophobicContact CG-CB 4.47Å; L145-L188 HydrophobicContact CG-CD1 4.32Å; R183-L188 HydrophobicContact CG-CD1 4.29Å; R183-L188 PolarHBondContact O-N 3.33Å; Y184-L188 HydrophobicContact CD2-CB 3.9Å; Y184-L188 HydrophobicContact CD2-CD1 4.32Å; Y184-L188 HydrophobicContact CE2-CB 4.43Å; Y184-L188 HydrophobicContact CG-CB 4.47Å; Y184-L188 PolarHBondContact O-N 2.61Å; Y184-L188 VanDerWaalsContact O-N 3.14Å; L188-G190 PolarHBondContact O-N 2.81Å; L188-Q191 CarbonylContact O-C 3.5Å; L188-Q191 PolarHBondContact O-N 2.96Å; L188-E192 PolarHBondContact O-N 3.28Å; L188-Y195 HydrophobicContact CD2-CD2 3.89Å; L188-Y195 HydrophobicContact CD2-CE2 3.43Å; L188-Y195 VanDerWaalsContact CD2-CE2 3.43Å
189	R	78.6	Confident	73.4	Confident	173 Å²	173	84.4 Å²	84.4	65%	0.653	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	111	-179.6	-168.6	176.3	-173.7	-116.6	1.3	110.2	Y184 Q191	Y184-R189 HydrophobicContact CD1-CB 4.37Å; Y184-R189 HydrophobicContact CE1-CB 4Å; Y184-R189 HydrophobicContact CE1-CG 4.17Å; Y184-R189 WeakPolarHBondContact O-CB 3.35Å; Y184-R189 PolarHBondContact O-N 2.73Å; R189-Q191 VanDerWaalsContact C-N 3.34Å
190	G	73.1	Confident	70.9	Confident	72 Å²	72	86.1 Å²	86.1	74%	0.742	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-5.3	-175.7	0	0	0	0	0	115.3	L188	L188-G190 PolarHBondContact O-N 2.81Å
191	Q	68	Low	68.5	Low	90 Å²	90	91.8 Å²	91.8	42%	0.421	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	12.7	171.4	-62.5	-163.6	-14.2	0	0	112.7	H187 L188 R189 H193 K194	H187-Q191 PolarHBondContact O-OE1 2.93Å; H187-Q191 VanDerWaalsContact O-OE1 3.09Å; L188-Q191 CarbonylContact O-C 3.5Å; L188-Q191 PolarHBondContact O-N 2.96Å; R189-Q191 VanDerWaalsContact C-N 3.34Å; Q191-H193 PolarHBondContact O-N 3.46Å; Q191-K194 HydrophobicContact CB-CB 4.49Å; Q191-K194 WeakPolarHBondContact O-CB 3.33Å; Q191-K194 PolarHBondContact O-N 3.38Å
192	E	69.5	Low	66.2	Low	70 Å²	70	96.7 Å²	96.7	33%	0.327	53%	0.525	S	S	.	.	H	α-helix	trans	-53.2	-33.6	-177.5	-49.5	-173.1	146	0	0	111.7	L145 Y184 L188 K194 Y195 L196	L145-E192 HydrophobicContact CD2-CB 4.03Å; L145-E192 HydrophobicContact CD2-CG 3.67Å; Y184-E192 PolarHBondContact OH-OE1 3.24Å; L188-E192 PolarHBondContact O-N 3.28Å; E192-K194 VanDerWaalsContact C-N 3.26Å; E192-K194 PolarHBondContact O-N 3.44Å; E192-Y195 PolarHBondContact O-N 2.94Å; E192-L196 WeakPolarHBondContact O-CG 3.37Å; E192-L196 PolarHBondContact O-N 2.97Å
193	H	66	Low	63.7	Low	153 Å²	153	98.6 Å²	98.6	71%	0.708	54%	0.544	S	S	*	.	H	α-helix	trans	-68.7	-21.7	178.7	-54.8	-176	0	0	0	113.1	Q191 Y195 L197	Q191-H193 PolarHBondContact O-N 3.46Å; H193-Y195 VanDerWaalsContact C-N 3.35Å; H193-L197 WeakPolarHBondContact O-CB 3.41Å
194	K	67.6	Low	61.3	Low	145 Å²	145	102.7 Å²	102.7	63%	0.63	58%	0.577	S	S	*	*	H	α-helix	trans	-74.4	-28.7	179.4	-169.7	-177.7	174.6	-167.5	0	112.1	Q191 E192	Q191-K194 HydrophobicContact CB-CB 4.49Å; Q191-K194 WeakPolarHBondContact O-CB 3.33Å; Q191-K194 PolarHBondContact O-N 3.38Å; E192-K194 VanDerWaalsContact C-N 3.26Å; E192-K194 PolarHBondContact O-N 3.44Å
195	Y	63	Low	58.9	Low	46 Å²	46	107.1 Å²	107.1	18%	0.18	61%	0.61	C	S	.	*	H	α-helix	trans	-100.3	-20.4	-177	-67.3	-88.8	0	0	0	112.9	D141 L145 L188 E192 H193	D141-Y195 HydrophobicContact CB-CD1 3.83Å; D141-Y195 HydrophobicContact CB-CE1 3.5Å; D141-Y195 VanDerWaalsContact CB-CE1 3.5Å; D141-Y195 WeakPolarHBondContact OD2-CE1 3.41Å; D141-Y195 VanDerWaalsContact OD2-CZ 3.24Å; D141-Y195 PolarHBondContact OD2-OH 3.09Å; L145-Y195 VanDerWaalsContact CD1-CB 3.44Å; L145-Y195 HydrophobicContact CD1-CD2 4.03Å; L145-Y195 HydrophobicContact CD1-CG 3.92Å; L188-Y195 HydrophobicContact CD2-CD2 3.89Å; L188-Y195 HydrophobicContact CD2-CE2 3.43Å; L188-Y195 VanDerWaalsContact CD2-CE2 3.43Å; E192-Y195 PolarHBondContact O-N 2.94Å; H193-Y195 VanDerWaalsContact C-N 3.35Å
196	L	58.3	Low	56.7	Low	112 Å²	112	107.6 Å²	107.6	59%	0.586	62%	0.62	S	S	*	*	H	α-helix	trans	-85.1	-9	173.1	-65.6	-179.1	0	0	0	113.7	E192	E192-L196 WeakPolarHBondContact O-CG 3.37Å; E192-L196 PolarHBondContact O-N 2.97Å
197	L	51.4	Low	54.7	Low	150 Å²	150	109.4 Å²	109.4	79%	0.785	63%	0.63	S	S	*	*			trans	-105.9	54.9	-175.3	-150.1	74.6	0	0	0	111.1	H193	H193-L197 WeakPolarHBondContact O-CB 3.41Å
198	G	39.9	Very low	52.6	Low	74 Å²	74	114.4 Å²	114.4	76%	0.763	65%	0.651	S	S	*	*			trans	-98.3	3.1	178.9	0	0	0	0	0	115.1
199	D	35.9	Very low	50.6	Low	161 Å²	161	122.1 Å²	122.1	86%	0.861	69%	0.691	S	S	*	*	S	Bend	trans	-96.6	100.9	175.8	-125.7	-64.3	0	0	0	110.9
200	A	35.4	Very low	48.6	Very low	84 Å²	84	123.3 Å²	123.3	69%	0.694	70%	0.701	S	S	*	*			trans	71.7	136.2	159.9	0	0	0	0	0	121
201	P	38.4	Very low	47.2	Very low	119 Å²	119	131.6 Å²	131.6	77%	0.773	71%	0.71	S	S	*	*			trans	-91.6	134.1	-173.7	35.8	-30.3	0	0	0	111.9
202	V	41	Very low	45.7	Very low	144 Å²	144	136.2 Å²	136.2	87%	0.873	73%	0.729	S	S	*	*			trans	-160.5	113.5	150.8	-106.5	0	0	0	0	112.7
203	S	37	Very low	44.2	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	75%	0.75	S	S	*	*			trans	64.4	116.2	147.3	-75.4	0	0	0	0	121.8
204	P	36.5	Very low	42.8	Very low	133 Å²	133	138.3 Å²	138.3	86%	0.864	76%	0.755	S	S	*	*			trans	-92.1	116.2	160.4	34.9	-24.2	0	0	0	110.1
205	S	38	Very low	41.5	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	77%	0.767	S	S	*	*			trans	-167.8	134.3	167.8	-163.1	0	0	0	0	107.4
206	S	41.7	Very low	40.4	Very low	87 Å²	87	145.6 Å²	145.6	61%	0.608	80%	0.798	S	S	*	*			cis	-166.8	148.5	-4.8	-93.6	0	0	0	0	105.6
207	Q	43.4	Very low	40	Very low	175 Å²	175	145.2 Å²	145.2	82%	0.818	80%	0.802	S	S	*	*			trans	63.6	113.5	140.3	-66.5	170.6	-13	0	0	120.6
208	K	37.6	Very low	39.5	Very low	196 Å²	196	147.4 Å²	147.4	85%	0.852	81%	0.808	S	S	*	*				32.3	122.2	124.4	-85.6	172	170.5	173.9	0	116.5
209	L	43	Very low	39.6	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	81%	0.805	S	S	*	*				-169.2	117.7	120.3	-98.4	147.7	0	0	0	111.6
210	K	36.8	Very low	39.8	Very low	198 Å²	198	145 Å²	145	86%	0.861	80%	0.804	S	S	*	*			trans	-59.5	141.4	159.3	-71.5	171.4	166.8	-178.5	0	109.6
211	R	43.3	Very low	40	Very low	247 Å²	247	148.1 Å²	148.1	93%	0.932	81%	0.809	S	S	*	*			trans	-171.6	160.2	134.7	-105.3	162.7	170.1	141.3	-2.8	111.9
212	K	35.8	Very low	40	Very low	187 Å²	187	147.9 Å²	147.9	81%	0.813	81%	0.809	S	S	*	*			trans	-131.4	137.3	-148.9	179.4	-167.7	-179.6	-161	0	106.6
213	A	38.1	Very low	39.9	Very low	94 Å²	94	144.8 Å²	144.8	78%	0.777	81%	0.807	S	S	*	*			trans	176.6	119.1	160.9	0	0	0	0	0	105.6
214	E	36.7	Very low	39.9	Very low	172 Å²	172	148.7 Å²	148.7	80%	0.804	81%	0.813	S	S	*	*			cis	69.1	98.9	43.8	-149.7	179.5	156.4	0	0	113.6
215	E	40.9	Very low	40.1	Very low	192 Å²	192	147.5 Å²	147.5	90%	0.897	81%	0.805	S	S	*	*			trans	-179.4	99.9	148.7	-118.1	175.3	98.3	0	0	106.7
216	D	40.2	Very low	40.5	Very low	153 Å²	153	151 Å²	151	82%	0.818	81%	0.81	S	S	*	*				92.6	130.9	78.9	-154.9	-60.7	0	0	0	112.5
217	P	48.7	Very low	40.3	Very low	103 Å²	103	154.5 Å²	154.5	67%	0.669	82%	0.822	S	S	*	*			trans	-112.9	150.7	-165.6	38.8	-25.1	0	0	0	114.8
218	E	40.6	Very low	40.5	Very low	197 Å²	197	155.2 Å²	155.2	92%	0.921	82%	0.822	S	S	*	*			trans	-176.8	165.9	144	-120.6	-170.2	104.6	0	0	115
219	A	42.1	Very low	40.8	Very low	84 Å²	84	156.8 Å²	156.8	69%	0.694	82%	0.822	S	S	*	*			trans	81.1	96.7	166.1	0	0	0	0	0	116.9
220	A	40	Very low	40.8	Very low	101 Å²	101	154.9 Å²	154.9	84%	0.835	82%	0.818	S	S	*	*				73	114.1	77.8	0	0	0	0	0	112.9
221	D	41.3	Very low	41.2	Very low	149 Å²	149	150.5 Å²	150.5	80%	0.797	81%	0.81	S	S	*	*				167.1	128.7	113	-167.5	27.5	0	0	0	113
222	S	38.4	Very low	40.7	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	80%	0.802	S	S	*	*			trans	6.5	143.6	158.2	-50.4	0	0	0	0	123.4
223	G	37.9	Very low	41.2	Very low	80 Å²	80	144.8 Å²	144.8	83%	0.825	81%	0.806	S	S	*	*			trans	154.3	94.5	141.3	0	0	0	0	0	117.2
224	E	37.9	Very low	41.2	Very low	193 Å²	193	145.1 Å²	145.1	90%	0.902	80%	0.8	S	S	*	*			trans	-70.9	178.8	178.8	-115.8	-168.1	65.1	0	0	115.9
225	P	40.4	Very low	41.4	Very low	107 Å²	107	146.2 Å²	146.2	70%	0.695	81%	0.805	S	S	*	*			trans	-112.9	171.6	-138.6	23.2	2.6	0	0	0	113.7
226	Q	45.6	Very low	41.5	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	80%	0.803	S	S	*	*			trans	-128.3	106.6	170.7	-69	-160.2	-56	0	0	112.8
227	N	37.8	Very low	41.5	Very low	160 Å²	160	146.8 Å²	146.8	86%	0.856	80%	0.803	S	S	*	*			trans	-57.4	139.9	158.7	-91.7	-28.9	0	0	0	112.1
228	K	47.4	Very low	41.1	Very low	190 Å²	190	151.8 Å²	151.8	83%	0.826	81%	0.81	S	S	*	*			trans	-156.9	132.5	144.5	-64.9	-163.9	-178.3	174.7	0	113.7
229	R	43.6	Very low	41.2	Very low	228 Å²	228	146.9 Å²	146.9	86%	0.86	79%	0.793	S	S	*	*			trans	84.2	102.6	153.2	-77.7	-177.4	158.7	160.7	-5.8	119.1
230	T	42.8	Very low	41.3	Very low	121 Å²	121	150.9 Å²	150.9	74%	0.742	79%	0.794	S	S	*	*				73.3	154.3	71.2	60.8	0	0	0	0	115.2
231	P	45.5	Very low	41.4	Very low	107 Å²	107	153.2 Å²	153.2	70%	0.695	79%	0.788	S	S	*	*			cis	-145.9	172.7	-27	36.1	-15.6	0	0	0	116.8
232	D	32.8	Very low	41.6	Very low	144 Å²	144	152.9 Å²	152.9	77%	0.77	78%	0.782	S	S	*	*			trans	72.4	111.1	144.9	-107.8	70.5	0	0	0	121.9
233	L	45.7	Very low	42.1	Very low	170 Å²	170	152.1 Å²	152.1	89%	0.89	77%	0.768	S	S	*	*				-174.7	138.8	124.4	-97.4	149.6	0	0	0	110.8
234	P	38.6	Very low	42.9	Very low	101 Å²	101	154.2 Å²	154.2	66%	0.656	76%	0.756	S	S	*	*			trans	-100.9	138.2	-173	36.4	-26.4	0	0	0	111.7
235	E	41.2	Very low	43.6	Very low	194 Å²	194	151.8 Å²	151.8	91%	0.907	75%	0.745	S	S	*	*			trans	172.1	71.1	157.9	-98.5	167.2	-143.6	0	0	109.9
236	E	42.4	Very low	44.5	Very low	183 Å²	183	148.9 Å²	148.9	86%	0.855	72%	0.723	S	S	*	*			trans	-131	7.5	175.2	-81.4	-147	158.6	0	0	115.2
237	E	41.4	Very low	45.4	Very low	175 Å²	175	143.5 Å²	143.5	82%	0.818	70%	0.698	S	S	*	*	S	Bend	trans	-97.9	-17.5	-175.7	-147.6	166.6	-171.2	0	0	113.9
238	Y	40.2	Very low	47	Very low	208 Å²	208	142 Å²	142	82%	0.816	69%	0.686	S	S	*	*	S	Bend	trans	-89.7	-17.9	-176.3	-114.4	-97.1	0	0	0	115.2
239	V	42.1	Very low	48	Very low	94 Å²	94	133 Å²	133	57%	0.57	65%	0.648	S	S	*	*	H	α-helix	trans	-88	-19.8	-173.5	-179.3	0	0	0	0	112.3	I243	V239-I243 HydrophobicContact CG1-CD1 3.7Å; V239-I243 HydrophobicContact CG1-CG1 4.36Å; V239-I243 WeakPolarHBondContact O-CD1 3.5Å; V239-I243 VanDerWaalsContact O-CG1 3.25Å; V239-I243 WeakPolarHBondContact O-CG1 3.49Å; V239-I243 PolarHBondContact O-N 3.3Å
240	K	44.5	Very low	49.2	Very low	167 Å²	167	122.2 Å²	122.2	73%	0.726	61%	0.607	S	S	*	*	H	α-helix	trans	-79.1	-31.8	-173.1	-148.5	173.4	-175.2	178.6	0	113.2
241	E	43	Very low	50.8	Low	150 Å²	150	119.8 Å²	119.8	70%	0.701	59%	0.586	S	S	*	*	H	α-helix	trans	-74.7	-40.3	177.2	-69.4	-174.3	160.8	0	0	111.7	I243 Q244 E245	E241-I243 VanDerWaalsContact C-N 3.32Å; E241-I243 PolarHBondContact O-N 3.39Å; E241-Q244 PolarHBondContact O-N 3.02Å; E241-E245 PolarHBondContact O-N 3.07Å
242	E	44.4	Very low	52.2	Low	143 Å²	143	116.2 Å²	116.2	67%	0.668	56%	0.559	S	S	*	*	H	α-helix	trans	-69.7	-26.8	-178.5	-156.4	178.9	152.4	0	0	113	N246	E242-N246 WeakPolarHBondContact O-CB 3.33Å
243	I	49	Very low	54.2	Low	96 Å²	96	110.9 Å²	110.9	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-74.7	-35.3	175.9	-67.2	169.6	0	0	0	111.4	V239 E241 N246 E247	V239-I243 HydrophobicContact CG1-CD1 3.7Å; V239-I243 HydrophobicContact CG1-CG1 4.36Å; V239-I243 WeakPolarHBondContact O-CD1 3.5Å; V239-I243 VanDerWaalsContact O-CG1 3.25Å; V239-I243 WeakPolarHBondContact O-CG1 3.49Å; V239-I243 PolarHBondContact O-N 3.3Å; E241-I243 VanDerWaalsContact C-N 3.32Å; E241-I243 PolarHBondContact O-N 3.39Å; I243-N246 PolarHBondContact O-N 3.04Å; I243-E247 PolarHBondContact O-N 3.41Å
244	Q	54.3	Low	55.3	Low	124 Å²	124	102.9 Å²	102.9	58%	0.579	49%	0.489	S	S	*	.	H	α-helix	trans	-74.1	-41	-175.7	-162.4	167.8	5.8	0	0	111.6	E241 N246 E247 E248	E241-Q244 PolarHBondContact O-N 3.02Å; Q244-N246 PolarHBondContact O-N 3.2Å; Q244-E247 PolarHBondContact O-N 3.4Å; Q244-E248 PolarHBondContact O-N 3.11Å
245	E	52.2	Low	56.6	Low	143 Å²	143	98.9 Å²	98.9	67%	0.668	46%	0.462	S	S	*	.	H	α-helix	trans	-61.1	-34.4	174.9	-167.6	179.2	177.7	0	0	111.9	E241 A249	E241-E245 PolarHBondContact O-N 3.07Å; E245-A249 WeakPolarHBondContact O-CB 3.22Å; E245-A249 PolarHBondContact O-N 3.13Å
246	N	59.8	Low	57.6	Low	45 Å²	45	93.9 Å²	93.9	24%	0.241	44%	0.439	C	S	.	.	H	α-helix	trans	-77.1	-24.1	-179	-160.1	12.6	0	0	0	113.3	E242 I243 Q244 V250 A314 I318	E242-N246 WeakPolarHBondContact O-CB 3.33Å; I243-N246 PolarHBondContact O-N 3.04Å; Q244-N246 PolarHBondContact O-N 3.2Å; N246-V250 WeakPolarHBondContact O-CG2 3.47Å; N246-V250 PolarHBondContact O-N 2.91Å; N246-A314 WeakPolarHBondContact OD1-CB 3.14Å; N246-I318 HydrophobicContact CB-CD1 4.24Å; N246-I318 VanDerWaalsContact ND2-CD1 3.26Å; N246-I318 WeakPolarHBondContact ND2-CD1 3.44Å; N246-I318 WeakPolarHBondContact OD1-CD1 3.38Å
247	E	64.7	Low	58.3	Low	70 Å²	70	87.6 Å²	87.6	33%	0.327	42%	0.418	S	S	.	.	H	α-helix	trans	-74.3	-43.2	175	-173.8	172.3	-171	0	0	111.5	I243 Q244 A249 V250 K251 E343	I243-E247 PolarHBondContact O-N 3.41Å; Q244-E247 PolarHBondContact O-N 3.4Å; E247-A249 VanDerWaalsContact C-N 3.26Å; E247-A249 PolarHBondContact O-N 3Å; E247-V250 PolarHBondContact O-N 3.4Å; E247-K251 PolarHBondContact O-N 3.5Å; E247-K251 VanDerWaalsContact O-N 3.08Å; E247-E343 WeakPolarHBondContact OE1-CA 3.21Å
248	E	71.9	Confident	59.1	Low	129 Å²	129	82.1 Å²	82.1	60%	0.603	40%	0.396	S	S	*	.	H	α-helix	trans	-61.9	-38	175.1	-66.6	-171.4	164.2	0	0	111.5	Q244 V250 K251 K252	Q244-E248 PolarHBondContact O-N 3.11Å; E248-V250 PolarHBondContact O-N 3.22Å; E248-K251 VanDerWaalsContact O-CB 3.28Å; E248-K251 WeakPolarHBondContact O-CB 3.11Å; E248-K251 PolarHBondContact O-N 3.41Å; E248-K251 VanDerWaalsContact O-N 3.15Å; E248-K252 PolarHBondContact O-N 2.95Å
249	A	68.8	Low	59.9	Low	2 Å²	2	79.6 Å²	79.6	2%	0.017	39%	0.385	C	S	.	.	H	α-helix	trans	-59	-45.8	176.1	0	0	0	0	0	114	E245 E247 K251 K252 M253 E311 A314	E245-A249 WeakPolarHBondContact O-CB 3.22Å; E245-A249 PolarHBondContact O-N 3.13Å; E247-A249 VanDerWaalsContact C-N 3.26Å; E247-A249 PolarHBondContact O-N 3Å; A249-K251 VanDerWaalsContact C-N 3.31Å; A249-K252 PolarHBondContact O-N 3.36Å; A249-M253 PolarHBondContact O-N 3.02Å; A249-E311 VanDerWaalsContact CB-CA 3.46Å; A249-E311 HydrophobicContact CB-CB 3.54Å; A249-E311 HydrophobicContact CB-CG 3.73Å; A249-E311 WeakPolarHBondContact CB-O 3.4Å; A249-A314 HydrophobicContact CB-CB 4.1Å
250	V	68.3	Low	60.4	Low	1 Å²	1	82.5 Å²	82.5	1%	0.006	39%	0.393	C	S	.	.	H	α-helix	trans	-64.3	-41.1	174.9	174.8	0	0	0	0	110.7	N246 E247 E248 K252 L254 A315 I318 F337	N246-V250 WeakPolarHBondContact O-CG2 3.47Å; N246-V250 PolarHBondContact O-N 2.91Å; E247-V250 PolarHBondContact O-N 3.4Å; E248-V250 PolarHBondContact O-N 3.22Å; V250-K252 VanDerWaalsContact C-N 3.34Å; V250-K252 PolarHBondContact O-N 3.47Å; V250-L254 WeakPolarHBondContact O-CB 3.39Å; V250-L254 PolarHBondContact O-N 2.89Å; V250-A315 HydrophobicContact CB-CB 4.31Å; V250-A315 HydrophobicContact CG2-CB 3.82Å; V250-I318 HydrophobicContact CG2-CB 4.13Å; V250-I318 HydrophobicContact CG2-CD1 3.42Å; V250-I318 VanDerWaalsContact CG2-CD1 3.42Å; V250-I318 HydrophobicContact CG2-CG1 4.34Å; V250-I318 HydrophobicContact CG2-CG2 4.14Å; V250-F337 HydrophobicContact CG1-CD1 3.62Å; V250-F337 HydrophobicContact CG1-CD2 4.49Å; V250-F337 HydrophobicContact CG1-CE1 3.63Å; V250-F337 HydrophobicContact CG1-CG 4.07Å; V250-F337 HydrophobicContact CG1-CZ 4.1Å
251	K	75.5	Confident	60.7	Low	69 Å²	69	83.8 Å²	83.8	30%	0.3	40%	0.399	S	S	.	.	H	α-helix	trans	-59	-45.7	178.7	-161.9	-174.8	175.9	-171.7	0	110.9	E247 E248 A249 V255 F397	E247-K251 PolarHBondContact O-N 3.5Å; E247-K251 VanDerWaalsContact O-N 3.08Å; E248-K251 VanDerWaalsContact O-CB 3.28Å; E248-K251 WeakPolarHBondContact O-CB 3.11Å; E248-K251 PolarHBondContact O-N 3.41Å; E248-K251 VanDerWaalsContact O-N 3.15Å; A249-K251 VanDerWaalsContact C-N 3.31Å; K251-V255 WeakPolarHBondContact O-CG2 3.5Å; K251-F397 HydrophobicContact CD-CD2 4.3Å; K251-F397 HydrophobicContact CG-CD2 3.51Å; K251-F397 HydrophobicContact CG-CE2 3.84Å
252	K	75.2	Confident	61	Low	32 Å²	32	82.8 Å²	82.8	14%	0.139	39%	0.394	C	S	.	.	H	α-helix	trans	-68.9	-46.8	-177.6	-133.9	-170.2	163.5	170.9	0	112.8	E248 A249 V250 L254 V255 E305 K306 V307 E311	E248-K252 PolarHBondContact O-N 2.95Å; A249-K252 PolarHBondContact O-N 3.36Å; V250-K252 VanDerWaalsContact C-N 3.34Å; V250-K252 PolarHBondContact O-N 3.47Å; K252-L254 VanDerWaalsContact C-N 3.26Å; K252-L254 PolarHBondContact O-N 3.29Å; K252-V255 PolarHBondContact O-N 3.31Å; K252-E305 VanDerWaalsContact CE-O 3.28Å; K252-E305 WeakPolarHBondContact CE-O 3.35Å; K252-E305 IonicContact NZ-OE1 2.64Å; K252-E305 PolarHBondContact NZ-OE1 2.64Å; K252-K306 PolarHBondContact NZ-O 2.57Å; K252-V307 HydrophobicContact CB-CG1 4.21Å; K252-V307 HydrophobicContact CB-CG2 3.97Å; K252-V307 HydrophobicContact CD-CB 4.13Å; K252-V307 HydrophobicContact CD-CG1 4.15Å; K252-V307 HydrophobicContact CD-CG2 3.72Å; K252-V307 HydrophobicContact CG-CB 4.5Å; K252-V307 HydrophobicContact CG-CG1 4.48Å; K252-V307 HydrophobicContact CG-CG2 3.62Å; K252-E311 WeakPolarHBondContact CB-OE2 3.44Å; K252-E311 WeakPolarHBondContact CD-OE2 3.47Å; K252-E311 IonicContact NZ-OE1 3.96Å
253	M	75	Confident	61.1	Low	33 Å²	33	82.8 Å²	82.8	16%	0.163	39%	0.394	C	S	.	.	H	α-helix	trans	-60.2	-35.8	180	-170.8	-158.1	67.8	0	0	112.6	A249 A257 V312 A315 I316 I319	A249-M253 PolarHBondContact O-N 3.02Å; M253-A257 PolarHBondContact O-N 2.85Å; M253-V312 HydrophobicContact CG-CG1 4.17Å; M253-V312 HydrophobicContact CG-CG2 4.4Å; M253-V312 HydrophobicContact SD-CG1 4.15Å; M253-A315 HydrophobicContact CB-CB 4.03Å; M253-A315 HydrophobicContact CE-CB 3.97Å; M253-A315 HydrophobicContact CG-CB 4.41Å; M253-A315 HydrophobicContact SD-CB 3.62Å; M253-I316 HydrophobicContact SD-CG1 4.35Å; M253-I319 HydrophobicContact CE-CD1 3.35Å
254	L	68.8	Low	60.7	Low	2 Å²	2	83.8 Å²	83.8	1%	0.01	40%	0.404	C	S	.	.	H	α-helix	trans	-76.6	-26.8	-174	-164.4	61.7	0	0	0	113.6	V250 K252 T334 F337 L338 F397	V250-L254 WeakPolarHBondContact O-CB 3.39Å; V250-L254 PolarHBondContact O-N 2.89Å; K252-L254 VanDerWaalsContact C-N 3.26Å; K252-L254 PolarHBondContact O-N 3.29Å; L254-T334 HydrophobicContact CD1-CG2 3.43Å; L254-T334 VanDerWaalsContact CD1-CG2 3.43Å; L254-F337 HydrophobicContact CD2-CB 3.33Å; L254-L338 HydrophobicContact CD1-CD1 4.4Å; L254-L338 HydrophobicContact CD1-CD2 4.02Å; L254-L338 HydrophobicContact CD1-CG 3.79Å; L254-L338 HydrophobicContact CD2-CB 4.29Å; L254-L338 HydrophobicContact CD2-CD2 3.81Å; L254-L338 HydrophobicContact CD2-CG 3.74Å; L254-L338 HydrophobicContact CG-CD2 3.5Å; L254-L338 VanDerWaalsContact CG-CD2 3.5Å; L254-L338 HydrophobicContact CG-CG 3.71Å; L254-F397 HydrophobicContact CB-CZ 4.37Å; L254-F397 HydrophobicContact CD2-CZ 3.94Å; L254-F397 HydrophobicContact CG-CZ 4.26Å
255	V	65.5	Low	60.2	Low	16 Å²	16	84.3 Å²	84.3	10%	0.097	42%	0.416	C	S	.	.	H	α-helix	trans	-70.6	-42.5	176.1	174.9	0	0	0	0	110.7	K251 K252 A257 T258 R259 F397 K400	K251-V255 WeakPolarHBondContact O-CG2 3.5Å; K252-V255 PolarHBondContact O-N 3.31Å; V255-A257 VanDerWaalsContact C-N 3.32Å; V255-A257 PolarHBondContact O-N 3.38Å; V255-T258 PolarHBondContact O-N 3.13Å; V255-T258 VanDerWaalsContact O-N 3.11Å; V255-T258 PolarHBondContact O-OG1 3.07Å; V255-R259 PolarHBondContact O-N 3.4Å; V255-F397 HydrophobicContact CG2-CD2 4.11Å; V255-F397 HydrophobicContact CG2-CE2 3.77Å; V255-F397 HydrophobicContact CG2-CZ 4.12Å; V255-F397 WeakPolarHBondContact CG2-O 2.87Å; V255-K400 HydrophobicContact CG1-CB 3.79Å; V255-K400 VanDerWaalsContact CG1-OXT 3.23Å; V255-K400 WeakPolarHBondContact CG1-OXT 3.25Å
256	E	61.9	Low	59.9	Low	90 Å²	90	82.5 Å²	82.5	42%	0.421	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-39.7	175	-74.6	-170.4	158.9	0	0	112.3	T258 R259 E260 V307	E256-T258 PolarHBondContact O-N 2.69Å; E256-T258 VanDerWaalsContact O-N 3.14Å; E256-R259 WeakPolarHBondContact O-CB 3.17Å; E256-R259 PolarHBondContact O-N 3.38Å; E256-E260 PolarHBondContact O-N 2.93Å; E256-V307 HydrophobicContact CG-CG2 3.65Å; E256-V307 WeakPolarHBondContact OE1-CG2 3.45Å; E256-V307 WeakPolarHBondContact OE2-CG2 3.47Å
257	A	58	Low	59	Low	50 Å²	50	87 Å²	87	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-63.8	-20.1	178.1	0	0	0	0	0	114	M253 V255	M253-A257 PolarHBondContact O-N 2.85Å; V255-A257 VanDerWaalsContact C-N 3.32Å; V255-A257 PolarHBondContact O-N 3.38Å
258	T	58	Low	58	Low	60 Å²	60	92 Å²	92	37%	0.368	46%	0.462	S	S	.	.	H	α-helix	trans	-85.5	-25.8	173.1	46.1	0	0	0	0	113.7	V255 E256 L338	V255-T258 PolarHBondContact O-N 3.13Å; V255-T258 VanDerWaalsContact O-N 3.11Å; V255-T258 PolarHBondContact O-OG1 3.07Å; E256-T258 PolarHBondContact O-N 2.69Å; E256-T258 VanDerWaalsContact O-N 3.14Å; T258-L338 HydrophobicContact CG2-CD1 4.31Å; T258-L338 HydrophobicContact CG2-CD2 3.55Å
259	R	56.8	Low	56.8	Low	155 Å²	155	90.2 Å²	90.2	59%	0.585	46%	0.464	S	S	*	.	H	α-helix	trans	-69	-42	177	-178.7	175.9	168.2	167.5	-4.7	111.7	V255 E256 F261 E262	V255-R259 PolarHBondContact O-N 3.4Å; E256-R259 WeakPolarHBondContact O-CB 3.17Å; E256-R259 PolarHBondContact O-N 3.38Å; R259-F261 PolarHBondContact O-N 3.15Å; R259-E262 PolarHBondContact O-N 3.33Å
260	E	53.2	Low	56.2	Low	156 Å²	156	95.8 Å²	95.8	73%	0.729	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-10.5	-178.5	-64	-172.8	163.6	0	0	114.5	E256	E256-E260 PolarHBondContact O-N 2.93Å
261	F	50	Low	54.9	Low	193 Å²	193	101.3 Å²	101.3	85%	0.846	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-8.3	178.9	-102.9	-90.9	0	0	0	114.7	R259	R259-F261 PolarHBondContact O-N 3.15Å
262	E	50.5	Low	53.2	Low	130 Å²	130	104.5 Å²	104.5	61%	0.607	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-4	-179.2	-149.5	152.8	-161.9	0	0	112.5	R259 R365	R259-E262 PolarHBondContact O-N 3.33Å; E262-R365 IonicContact OE1-NH2 3.8Å
263	E	45.9	Very low	51.6	Low	142 Å²	142	112.8 Å²	112.8	66%	0.664	59%	0.592	S	S	*	*	S	Bend	trans	-104.6	24.6	-179.4	-151.4	177	165	0	0	114.4
264	V	40.4	Very low	50.1	Low	117 Å²	117	119.5 Å²	119.5	71%	0.709	62%	0.623	S	S	*	*			trans	-117.4	67.9	167	-177	0	0	0	0	108.8	V266	V264-V266 HydrophobicContact CG1-CG2 4.22Å
265	V	44	Very low	49	Very low	135 Å²	135	127.5 Å²	127.5	82%	0.818	66%	0.664	S	S	*	*			trans	-109.1	94.9	156.8	-177.7	0	0	0	0	105.8	D267	V265-D267 PolarHBondContact O-N 3.23Å
266	V	45.3	Very low	47.7	Very low	106 Å²	106	134.7 Å²	134.7	64%	0.642	70%	0.696	S	S	*	*			trans	-64.3	112.8	175.8	175.9	0	0	0	0	108.2	V264 E268	V264-V266 HydrophobicContact CG1-CG2 4.22Å; V266-E268 VanDerWaalsContact C-N 3.34Å; V266-E268 HydrophobicContact CG1-CG 3.71Å; V266-E268 PolarHBondContact O-N 2.99Å; V266-E268 VanDerWaalsContact O-N 3.09Å
267	D	40.7	Very low	46.8	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	72%	0.717	S	S	*	*			trans	-64.9	90.4	160.7	179.5	33.2	0	0	0	108.6	V265 S269	V265-D267 PolarHBondContact O-N 3.23Å; D267-S269 PolarHBondContact OD1-OG 3.09Å
268	E	43.9	Very low	46	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	72%	0.723	S	S	*	*			trans	-95.2	86.2	161.1	-76	-142.4	123.9	0	0	108.7	V266	V266-E268 VanDerWaalsContact C-N 3.34Å; V266-E268 HydrophobicContact CG1-CG 3.71Å; V266-E268 PolarHBondContact O-N 2.99Å; V266-E268 VanDerWaalsContact O-N 3.09Å
269	S	46.9	Very low	45.8	Very low	92 Å²	92	144.9 Å²	144.9	64%	0.643	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-71.8	123.7	161.6	-78.6	0	0	0	0	109.9	D267	D267-S269 PolarHBondContact OD1-OG 3.09Å
270	P	56.4	Low	45.3	Very low	119 Å²	119	142.8 Å²	142.8	77%	0.773	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-83.1	142.6	175.4	31.2	-29.6	0	0	0	111.2
271	P	41.2	Very low	45	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-83.1	132	-179.6	32.7	-31.1	0	0	0	112.3
272	D	39.2	Very low	45	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	75%	0.749	S	S	*	*				58.8	107.2	127.9	-138.9	10.6	0	0	0	119.8
273	F	41.2	Very low	45.1	Very low	206 Å²	206	140.2 Å²	140.2	90%	0.904	76%	0.755	S	S	*	*			trans	-146	120.8	145.5	-72.7	-73.2	0	0	0	111
274	E	45.3	Very low	45.9	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.813	76%	0.758	S	S	*	*			trans	-50.4	138.3	179.7	-58.3	164.4	135.5	0	0	115.1
275	I	44.1	Very low	46.6	Very low	170 Å²	170	138.4 Å²	138.4	87%	0.872	76%	0.758	S	S	*	*			trans	-146.7	110.6	139.1	-34.7	171.3	0	0	0	110.7
276	H	38.5	Very low	46.9	Very low	167 Å²	167	138.6 Å²	138.6	77%	0.773	76%	0.759	S	S	*	*			trans	-61.5	130.7	172.1	-119.4	-70.1	0	0	0	112.9
277	I	43.9	Very low	47.1	Very low	167 Å²	167	138.4 Å²	138.4	86%	0.856	76%	0.761	S	S	*	*			trans	-139.7	118.2	147.9	-56.9	-177.4	0	0	0	109.6
278	T	40.9	Very low	47.5	Very low	88 Å²	88	140 Å²	140	54%	0.54	76%	0.763	S	S	.	*			trans	-71.6	152.6	178	48.1	0	0	0	0	113.8
279	M	52.7	Low	47.8	Very low	160 Å²	160	139.9 Å²	139.9	79%	0.788	76%	0.763	S	S	*	*				164.4	147.9	117.5	-81.2	-51.1	169.7	0	0	111.7
280	C	47.9	Very low	47.9	Very low	110 Å²	110	141.8 Å²	141.8	74%	0.743	77%	0.766	S	S	*	*			trans	84.1	92.8	179.5	-49.9	0	0	0	0	113.4
281	D	46.6	Very low	47.6	Very low	147 Å²	147	141 Å²	141	79%	0.786	76%	0.764	S	S	*	*				52.4	122.6	76.6	-56	-58.5	0	0	0	109.9
282	D	49.7	Very low	48	Very low	140 Å²	140	144.4 Å²	144.4	75%	0.749	77%	0.769	S	S	*	*			cis	-170.7	143.9	37	-161	-130.6	0	0	0	108.5
283	D	51.7	Low	48.1	Very low	138 Å²	138	144 Å²	144	74%	0.738	77%	0.772	S	S	*	*			trans	54.2	122.7	159.1	-92.5	-51.7	0	0	0	124.6
284	P	62.7	Low	48.4	Very low	112 Å²	112	142.7 Å²	142.7	73%	0.727	77%	0.769	S	S	*	*			trans	-109.1	-154.6	174.6	45.4	-33.8	0	0	0	112.4
285	P	55.6	Low	48.7	Very low	109 Å²	109	139.8 Å²	139.8	71%	0.708	77%	0.765	S	S	*	*				-117.2	-175.6	-109.2	35.9	-15.2	0	0	0	112.7
286	T	50.7	Low	48.7	Very low	139 Å²	139	139.4 Å²	139.4	85%	0.853	76%	0.764	S	S	*	*			trans	177.4	155.9	133.3	26.2	0	0	0	0	111.3
287	P	50.3	Low	49.2	Very low	103 Å²	103	139.9 Å²	139.9	67%	0.669	77%	0.767	S	S	*	*			trans	-117.7	-159.1	-142.6	41.6	-26.8	0	0	0	112.7
288	E	48.9	Very low	49.4	Very low	170 Å²	170	140.4 Å²	140.4	79%	0.794	77%	0.766	S	S	*	*			trans	116.4	139.5	159.5	-55.3	-74.2	129.9	0	0	114.1
289	E	50.4	Low	49.6	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	78%	0.78	S	S	*	*			trans	102.8	96.7	160.4	-49.8	-154.4	136.4	0	0	119
290	D	47.8	Very low	49.3	Very low	131 Å²	131	145.2 Å²	145.2	70%	0.701	78%	0.78	S	S	*	*				86.1	100.7	125.3	-84.1	-38.9	0	0	0	121.9
291	S	50.3	Low	49.2	Very low	104 Å²	104	148.2 Å²	148.2	73%	0.727	78%	0.783	S	S	*	*				46.1	92.2	112.1	-48.8	0	0	0	0	118.6
292	E	50.5	Low	49.1	Very low	186 Å²	186	149.8 Å²	149.8	87%	0.869	79%	0.786	S	S	*	*			trans	-142.5	105.1	145.5	-77.3	-162.6	110.9	0	0	111.4
293	T	41.1	Very low	49	Very low	127 Å²	127	152 Å²	152	78%	0.779	79%	0.792	S	S	*	*			trans	51	96.4	133.6	-34.8	0	0	0	0	118.9
294	Q	46.8	Very low	49	Very low	180 Å²	180	151.9 Å²	151.9	84%	0.841	79%	0.787	S	S	*	*			trans	-69.6	137.2	155.8	-84	179.8	-40.1	0	0	110.4
295	P	52	Low	48.9	Very low	112 Å²	112	152.5 Å²	152.5	73%	0.727	78%	0.78	S	S	*	*			trans	-77.7	138.9	160.2	32.3	-28.2	0	0	0	109.5	E297	P295-E297 PolarHBondContact O-N 3.5Å; P295-E297 VanDerWaalsContact O-N 3.17Å
296	D	43.6	Very low	49.4	Very low	162 Å²	162	154.7 Å²	154.7	87%	0.866	78%	0.779	S	S	*	*			trans	-47.7	114.2	174.8	-65.7	-64.7	0	0	0	111.4	E298	D296-E298 PolarHBondContact O-N 3.23Å
297	E	50	Low	50.5	Low	178 Å²	178	149.1 Å²	149.1	83%	0.832	74%	0.744	S	S	*	*			trans	-78.3	103.8	160.4	-70.5	-180	170.6	0	0	106	P295 E299	P295-E297 PolarHBondContact O-N 3.5Å; P295-E297 VanDerWaalsContact O-N 3.17Å; E297-E299 VanDerWaalsContact C-N 3.31Å; E297-E299 PolarHBondContact O-N 2.88Å
298	E	47.9	Very low	52.1	Low	177 Å²	177	146.2 Å²	146.2	83%	0.827	73%	0.727	S	S	*	*			trans	-58.6	100	163	-68.7	179	167.8	0	0	106.7	D296 E300	D296-E298 PolarHBondContact O-N 3.23Å; E298-E300 PolarHBondContact O-N 3.11Å
299	E	45.1	Very low	53.8	Low	177 Å²	177	146.4 Å²	146.4	83%	0.827	73%	0.727	S	S	*	*			trans	-59.8	89.2	164.3	-72.8	-179.6	164.1	0	0	107.2	E297 E301	E297-E299 VanDerWaalsContact C-N 3.31Å; E297-E299 PolarHBondContact O-N 2.88Å; E299-E301 PolarHBondContact O-N 3.22Å
300	E	45.4	Very low	55.6	Low	172 Å²	172	142.8 Å²	142.8	80%	0.804	72%	0.719	S	S	*	*			trans	-61.6	92.6	155.4	-72.1	-172.9	167	0	0	105.9	E298 E302	E298-E300 PolarHBondContact O-N 3.11Å; E300-E302 VanDerWaalsContact C-N 3.28Å; E300-E302 PolarHBondContact O-N 3.05Å
301	E	45.4	Very low	57.5	Low	173 Å²	173	138.4 Å²	138.4	81%	0.808	69%	0.694	S	S	*	*			trans	-53.8	98	165.5	-72.1	-176	166.2	0	0	107.2	E299 E303	E299-E301 PolarHBondContact O-N 3.22Å; E301-E303 VanDerWaalsContact C-N 3.35Å; E301-E303 PolarHBondContact O-N 2.93Å
302	E	46	Very low	59.4	Low	180 Å²	180	135.6 Å²	135.6	84%	0.841	67%	0.672	S	S	*	*			trans	-56.4	103.9	165.6	-72.3	-172.7	161.7	0	0	106.5	E300 E304	E300-E302 VanDerWaalsContact C-N 3.28Å; E300-E302 PolarHBondContact O-N 3.05Å; E302-E304 PolarHBondContact O-N 3.49Å
303	E	46.9	Very low	61.4	Low	187 Å²	187	128.1 Å²	128.1	87%	0.874	65%	0.646	S	S	*	*			trans	-58	90	171.3	-71.6	-169.9	161.1	0	0	108.1	E301 E305	E301-E303 VanDerWaalsContact C-N 3.35Å; E301-E303 PolarHBondContact O-N 2.93Å; E303-E305 PolarHBondContact O-N 3.1Å
304	E	52.1	Low	63.9	Low	136 Å²	136	123.1 Å²	123.1	64%	0.636	62%	0.617	S	S	*	*			trans	-55.5	104.6	165.8	-78.8	-168	150.8	0	0	106.9	E302 K306	E302-E304 PolarHBondContact O-N 3.49Å; E304-K306 PolarHBondContact O-N 2.58Å
305	E	59.7	Low	66.1	Low	125 Å²	125	114.6 Å²	114.6	58%	0.584	58%	0.577	S	S	*	*			trans	-70.7	70.5	-175.9	-161.5	-158.8	133.9	0	0	110.2	K252 E303 V307 K400	K252-E305 VanDerWaalsContact CE-O 3.28Å; K252-E305 WeakPolarHBondContact CE-O 3.35Å; K252-E305 IonicContact NZ-OE1 2.64Å; K252-E305 PolarHBondContact NZ-OE1 2.64Å; E303-E305 PolarHBondContact O-N 3.1Å; E305-V307 PolarHBondContact O-N 3.39Å; E305-K400 IonicContact OE1-NZ 2.79Å; E305-K400 PolarHBondContact OE1-NZ 3.36Å; E305-K400 IonicContact OE2-NZ 2.85Å; E305-K400 PolarHBondContact OE2-NZ 3.26Å
306	K	66.4	Low	68.2	Low	155 Å²	155	112.7 Å²	112.7	67%	0.674	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-54.1	137.2	-179.3	-71.7	174.8	-175.8	177.4	0	109.9	K252 E304 S308	K252-K306 PolarHBondContact NZ-O 2.57Å; E304-K306 PolarHBondContact O-N 2.58Å; K306-S308 PolarHBondContact O-N 2.86Å
307	V	74	Confident	70.7	Confident	22 Å²	22	111.8 Å²	111.8	13%	0.133	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-59	126.7	173.2	179.9	0	0	0	0	109.2	K252 E256 E305 E311 V312	K252-V307 HydrophobicContact CB-CG1 4.21Å; K252-V307 HydrophobicContact CB-CG2 3.97Å; K252-V307 HydrophobicContact CD-CB 4.13Å; K252-V307 HydrophobicContact CD-CG1 4.15Å; K252-V307 HydrophobicContact CD-CG2 3.72Å; K252-V307 HydrophobicContact CG-CB 4.5Å; K252-V307 HydrophobicContact CG-CG1 4.48Å; K252-V307 HydrophobicContact CG-CG2 3.62Å; E256-V307 HydrophobicContact CG-CG2 3.65Å; E256-V307 WeakPolarHBondContact OE1-CG2 3.45Å; E256-V307 WeakPolarHBondContact OE2-CG2 3.47Å; E305-V307 PolarHBondContact O-N 3.39Å; V307-E311 HydrophobicContact CG1-CB 4.37Å; V307-V312 HydrophobicContact CB-CG2 4.46Å; V307-V312 HydrophobicContact CG1-CG2 3.45Å; V307-V312 VanDerWaalsContact CG1-CG2 3.45Å
308	S	84.6	Confident	72.9	Confident	42 Å²	42	103.5 Å²	103.5	29%	0.294	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-74.6	139.9	-179.9	78	0	0	0	0	109.6	K306 P310 E311 V312	K306-S308 PolarHBondContact O-N 2.86Å; S308-P310 VanDerWaalsContact C-N 3.29Å; S308-E311 WeakPolarHBondContact CB-OE1 3.21Å; S308-E311 WeakPolarHBondContact O-CB 3.15Å; S308-E311 PolarHBondContact O-N 2.8Å; S308-E311 VanDerWaalsContact O-N 3.08Å; S308-E311 WeakPolarHBondContact OG-CG 3.46Å; S308-E311 PolarHBondContact OG-OE1 2.98Å; S308-V312 PolarHBondContact O-N 3.25Å
309	Q	84	Confident	75.3	Confident	174 Å²	174	95.5 Å²	95.5	81%	0.813	47%	0.473	S	S	*	.	H	α-helix	trans	-55	-35.9	177.4	-70.7	-169.7	-7.7	0	0	114.4	E311 V312 G313	Q309-E311 VanDerWaalsContact C-N 3.3Å; Q309-E311 PolarHBondContact O-N 2.77Å; Q309-V312 PolarHBondContact O-N 3.24Å; Q309-G313 PolarHBondContact O-N 3.17Å
310	P	88.3	Confident	77.7	Confident	98 Å²	98	95.4 Å²	95.4	64%	0.636	47%	0.465	S	S	*	.	H	α-helix	trans	-57.3	-42.5	173.9	-27	36.2	0	0	0	113	S308 G313 A314	S308-P310 VanDerWaalsContact C-N 3.29Å; P310-G313 PolarHBondContact O-N 3.21Å; P310-A314 WeakPolarHBondContact O-CB 3.19Å; P310-A314 PolarHBondContact O-N 3.37Å
311	E	87.7	Confident	80.1	Confident	39 Å²	39	93.4 Å²	93.4	18%	0.182	46%	0.456	C	S	.	.	H	α-helix	trans	-64.1	-46.9	178.9	-73.1	169	-120.1	0	0	111.6	A249 K252 V307 S308 Q309 G313 A314 A315	A249-E311 VanDerWaalsContact CB-CA 3.46Å; A249-E311 HydrophobicContact CB-CB 3.54Å; A249-E311 HydrophobicContact CB-CG 3.73Å; A249-E311 WeakPolarHBondContact CB-O 3.4Å; K252-E311 WeakPolarHBondContact CB-OE2 3.44Å; K252-E311 WeakPolarHBondContact CD-OE2 3.47Å; K252-E311 IonicContact NZ-OE1 3.96Å; V307-E311 HydrophobicContact CG1-CB 4.37Å; S308-E311 WeakPolarHBondContact CB-OE1 3.21Å; S308-E311 WeakPolarHBondContact O-CB 3.15Å; S308-E311 PolarHBondContact O-N 2.8Å; S308-E311 VanDerWaalsContact O-N 3.08Å; S308-E311 WeakPolarHBondContact OG-CG 3.46Å; S308-E311 PolarHBondContact OG-OE1 2.98Å; Q309-E311 VanDerWaalsContact C-N 3.3Å; Q309-E311 PolarHBondContact O-N 2.77Å; E311-G313 PolarHBondContact O-N 3.11Å; E311-A314 PolarHBondContact O-N 3.41Å; E311-A314 VanDerWaalsContact O-N 3.14Å; E311-A315 WeakPolarHBondContact O-CB 3.49Å; E311-A315 PolarHBondContact O-N 3.42Å
312	V	90.8	Very high	82.6	Confident	45 Å²	45	85.7 Å²	85.7	27%	0.273	42%	0.42	S	S	.	.	H	α-helix	trans	-57.4	-43	174.3	-177.1	0	0	0	0	110.6	M253 V307 S308 Q309 A314 A315 I316	M253-V312 HydrophobicContact CG-CG1 4.17Å; M253-V312 HydrophobicContact CG-CG2 4.4Å; M253-V312 HydrophobicContact SD-CG1 4.15Å; V307-V312 HydrophobicContact CB-CG2 4.46Å; V307-V312 HydrophobicContact CG1-CG2 3.45Å; V307-V312 VanDerWaalsContact CG1-CG2 3.45Å; S308-V312 PolarHBondContact O-N 3.25Å; Q309-V312 PolarHBondContact O-N 3.24Å; V312-A314 VanDerWaalsContact C-N 3.35Å; V312-A314 PolarHBondContact O-N 2.93Å; V312-A315 PolarHBondContact O-N 2.74Å; V312-I316 HydrophobicContact CG1-CD1 3.83Å; V312-I316 HydrophobicContact CG1-CG1 4.36Å; V312-I316 WeakPolarHBondContact O-CB 3.36Å; V312-I316 VanDerWaalsContact O-CG1 3.23Å; V312-I316 WeakPolarHBondContact O-CG1 3.23Å; V312-I316 PolarHBondContact O-N 3.25Å
313	G	91.7	Very high	85	Confident	30 Å²	30	79.6 Å²	79.6	31%	0.309	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-40.6	177.6	0	0	0	0	0	113.2	Q309 P310 E311 K317	Q309-G313 PolarHBondContact O-N 3.17Å; P310-G313 PolarHBondContact O-N 3.21Å; E311-G313 PolarHBondContact O-N 3.11Å; G313-K317 WeakPolarHBondContact O-CG 3.46Å; G313-K317 PolarHBondContact O-N 3.27Å
314	A	92.9	Very high	87.4	Confident	22 Å²	22	78.6 Å²	78.6	18%	0.182	39%	0.387	C	S	.	.	H	α-helix	trans	-69.2	-43.2	178.2	0	0	0	0	0	111.2	N246 A249 P310 E311 V312 I316 K317 I318	N246-A314 WeakPolarHBondContact OD1-CB 3.14Å; A249-A314 HydrophobicContact CB-CB 4.1Å; P310-A314 WeakPolarHBondContact O-CB 3.19Å; P310-A314 PolarHBondContact O-N 3.37Å; E311-A314 PolarHBondContact O-N 3.41Å; E311-A314 VanDerWaalsContact O-N 3.14Å; V312-A314 VanDerWaalsContact C-N 3.35Å; V312-A314 PolarHBondContact O-N 2.93Å; A314-I316 PolarHBondContact O-N 3.26Å; A314-K317 WeakPolarHBondContact O-CB 3.42Å; A314-K317 PolarHBondContact O-N 3.46Å; A314-K317 VanDerWaalsContact O-N 3.16Å; A314-I318 PolarHBondContact O-N 3.14Å
315	A	94	Very high	89.5	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-42.6	175.3	0	0	0	0	0	113	V250 M253 E311 V312 K317 I318 I319	V250-A315 HydrophobicContact CB-CB 4.31Å; V250-A315 HydrophobicContact CG2-CB 3.82Å; M253-A315 HydrophobicContact CB-CB 4.03Å; M253-A315 HydrophobicContact CE-CB 3.97Å; M253-A315 HydrophobicContact CG-CB 4.41Å; M253-A315 HydrophobicContact SD-CB 3.62Å; E311-A315 WeakPolarHBondContact O-CB 3.49Å; E311-A315 PolarHBondContact O-N 3.42Å; V312-A315 PolarHBondContact O-N 2.74Å; A315-K317 VanDerWaalsContact C-N 3.3Å; A315-K317 PolarHBondContact O-N 2.99Å; A315-I318 PolarHBondContact O-N 3.33Å; A315-I319 WeakPolarHBondContact O-CB 3.35Å; A315-I319 WeakPolarHBondContact O-CG1 3.29Å; A315-I319 PolarHBondContact O-N 3.18Å
316	I	95.1	Very high	91.2	Very high	73 Å²	73	75.4 Å²	75.4	37%	0.374	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-41.6	174.9	-71.9	168	0	0	0	110.9	M253 V312 A314 I319 R320	M253-I316 HydrophobicContact SD-CG1 4.35Å; V312-I316 HydrophobicContact CG1-CD1 3.83Å; V312-I316 HydrophobicContact CG1-CG1 4.36Å; V312-I316 WeakPolarHBondContact O-CB 3.36Å; V312-I316 VanDerWaalsContact O-CG1 3.23Å; V312-I316 WeakPolarHBondContact O-CG1 3.23Å; V312-I316 PolarHBondContact O-N 3.25Å; A314-I316 PolarHBondContact O-N 3.26Å; I316-I319 PolarHBondContact O-N 3.18Å; I316-R320 HydrophobicContact CG2-CG 4.47Å; I316-R320 WeakPolarHBondContact O-CB 3.43Å; I316-R320 VanDerWaalsContact O-CG 3.29Å; I316-R320 WeakPolarHBondContact O-CG 3.48Å; I316-R320 PolarHBondContact O-N 3.39Å
317	K	96.6	Very high	92.5	Very high	143 Å²	143	75 Å²	75	62%	0.622	38%	0.375	S	S	*	.	H	α-helix	trans	-62.4	-47.6	177.2	-72.1	172.5	-175.2	172.9	0	111	G313 A314 A315 R320 Q321	G313-K317 WeakPolarHBondContact O-CG 3.46Å; G313-K317 PolarHBondContact O-N 3.27Å; A314-K317 WeakPolarHBondContact O-CB 3.42Å; A314-K317 PolarHBondContact O-N 3.46Å; A314-K317 VanDerWaalsContact O-N 3.16Å; A315-K317 VanDerWaalsContact C-N 3.3Å; A315-K317 PolarHBondContact O-N 2.99Å; K317-R320 PolarHBondContact O-N 2.91Å; K317-Q321 WeakPolarHBondContact O-CG 3.23Å; K317-Q321 PolarHBondContact O-N 3.49Å
318	I	96.7	Very high	93.6	Very high	4 Å²	4	76.6 Å²	76.6	2%	0.021	38%	0.382	C	S	.	.	H	α-helix	trans	-58.4	-49.8	177.2	-75.1	175.5	0	0	0	111.2	N246 V250 A314 A315 R320 Q321 L322 F337 L344	N246-I318 HydrophobicContact CB-CD1 4.24Å; N246-I318 VanDerWaalsContact ND2-CD1 3.26Å; N246-I318 WeakPolarHBondContact ND2-CD1 3.44Å; N246-I318 WeakPolarHBondContact OD1-CD1 3.38Å; V250-I318 HydrophobicContact CG2-CB 4.13Å; V250-I318 HydrophobicContact CG2-CD1 3.42Å; V250-I318 VanDerWaalsContact CG2-CD1 3.42Å; V250-I318 HydrophobicContact CG2-CG1 4.34Å; V250-I318 HydrophobicContact CG2-CG2 4.14Å; A314-I318 PolarHBondContact O-N 3.14Å; A315-I318 PolarHBondContact O-N 3.33Å; I318-R320 VanDerWaalsContact C-N 3.32Å; I318-R320 PolarHBondContact O-N 3.3Å; I318-Q321 WeakPolarHBondContact O-CB 3.33Å; I318-Q321 PolarHBondContact O-N 2.91Å; I318-L322 HydrophobicContact CG2-CD1 4.1Å; I318-L322 PolarHBondContact O-N 2.85Å; I318-F337 HydrophobicContact CG2-CE1 4.49Å; I318-F337 HydrophobicContact CG2-CE2 4.23Å; I318-F337 HydrophobicContact CG2-CZ 3.57Å; I318-L344 HydrophobicContact CD1-CD2 3.96Å; I318-L344 HydrophobicContact CG2-CD1 3.53Å
319	I	96.8	Very high	94.1	Very high	9 Å²	9	77.4 Å²	77.4	5%	0.046	38%	0.383	C	S	.	.	H	α-helix	trans	-60.9	-44.7	-177	-72.7	170.2	0	0	0	110.2	M253 A315 I316 Q321 L322 M323 L330 V333 F337	M253-I319 HydrophobicContact CE-CD1 3.35Å; A315-I319 WeakPolarHBondContact O-CB 3.35Å; A315-I319 WeakPolarHBondContact O-CG1 3.29Å; A315-I319 PolarHBondContact O-N 3.18Å; I316-I319 PolarHBondContact O-N 3.18Å; I319-Q321 PolarHBondContact O-N 3.02Å; I319-L322 PolarHBondContact O-N 3.03Å; I319-M323 HydrophobicContact CG2-CG 4.32Å; I319-M323 HydrophobicContact CG2-SD 3.85Å; I319-M323 WeakPolarHBondContact O-CB 3.49Å; I319-M323 VanDerWaalsContact O-CG 3.22Å; I319-M323 WeakPolarHBondContact O-CG 3.38Å; I319-M323 PolarHBondContact O-N 3.4Å; I319-L330 HydrophobicContact CG2-CD1 3.54Å; I319-V333 HydrophobicContact CB-CG1 4.49Å; I319-V333 HydrophobicContact CG1-CG1 4.42Å; I319-V333 HydrophobicContact CG2-CG1 4.1Å; I319-F337 HydrophobicContact CG1-CD2 4.32Å; I319-F337 HydrophobicContact CG1-CE2 3.94Å
320	R	96.5	Very high	94.7	Very high	175 Å²	175	73.8 Å²	73.8	66%	0.66	37%	0.369	S	S	*	.	H	α-helix	trans	-60.6	-43.2	175.9	-74.1	177.6	175.6	-141.3	0.8	112.3	I316 K317 I318 L322 M323 E324	I316-R320 HydrophobicContact CG2-CG 4.47Å; I316-R320 WeakPolarHBondContact O-CB 3.43Å; I316-R320 VanDerWaalsContact O-CG 3.29Å; I316-R320 WeakPolarHBondContact O-CG 3.48Å; I316-R320 PolarHBondContact O-N 3.39Å; K317-R320 PolarHBondContact O-N 2.91Å; I318-R320 VanDerWaalsContact C-N 3.32Å; I318-R320 PolarHBondContact O-N 3.3Å; R320-L322 PolarHBondContact O-N 2.79Å; R320-M323 PolarHBondContact O-N 2.74Å; R320-E324 PolarHBondContact O-N 3.06Å
321	Q	96.6	Very high	95.1	Very high	130 Å²	130	71.9 Å²	71.9	61%	0.607	36%	0.358	S	S	*	.	H	α-helix	trans	-61.1	-42.6	177	-75.1	174.9	-8.4	0	0	112.1	K317 I318 I319 E324 K325	K317-Q321 WeakPolarHBondContact O-CG 3.23Å; K317-Q321 PolarHBondContact O-N 3.49Å; I318-Q321 WeakPolarHBondContact O-CB 3.33Å; I318-Q321 PolarHBondContact O-N 2.91Å; I319-Q321 PolarHBondContact O-N 3.02Å; Q321-E324 PolarHBondContact O-N 3.15Å; Q321-K325 WeakPolarHBondContact O-CB 3.1Å; Q321-K325 PolarHBondContact O-N 3.42Å
322	L	96.2	Very high	95.5	Very high	10 Å²	10	72.6 Å²	72.6	5%	0.052	37%	0.365	C	S	.	.	H	α-helix	trans	-70.5	-38.2	177.9	-69.2	175.8	0	0	0	112.4	I318 I319 R320 E324 K325 F326 V333 F337 L344 T347 L351	I318-L322 HydrophobicContact CG2-CD1 4.1Å; I318-L322 PolarHBondContact O-N 2.85Å; I319-L322 PolarHBondContact O-N 3.03Å; R320-L322 PolarHBondContact O-N 2.79Å; L322-E324 VanDerWaalsContact C-N 3.32Å; L322-E324 PolarHBondContact O-N 3Å; L322-K325 PolarHBondContact O-N 3.16Å; L322-F326 HydrophobicContact CD2-CD2 4.09Å; L322-F326 HydrophobicContact CD2-CE2 3.71Å; L322-F326 PolarHBondContact O-N 3.24Å; L322-V333 HydrophobicContact CB-CG1 3.9Å; L322-V333 HydrophobicContact CB-CG2 4.48Å; L322-V333 HydrophobicContact CD1-CG1 4.2Å; L322-F337 HydrophobicContact CD1-CE1 4.46Å; L322-F337 HydrophobicContact CD1-CE2 3.48Å; L322-F337 VanDerWaalsContact CD1-CE2 3.48Å; L322-F337 HydrophobicContact CD1-CZ 3.34Å; L322-L344 HydrophobicContact CD1-CD1 4.04Å; L322-T347 HydrophobicContact CD1-CG2 4.47Å; L322-L351 HydrophobicContact CB-CD1 4.44Å; L322-L351 HydrophobicContact CD1-CD1 4.46Å
323	M	97.1	Very high	95.8	Very high	53 Å²	53	70.5 Å²	70.5	26%	0.261	35%	0.352	S	S	.	.	H	α-helix	trans	-57.7	-45.8	173.2	-73.5	172.4	63.5	0	0	111.1	I319 R320 N327 L328 L330 V333	I319-M323 HydrophobicContact CG2-CG 4.32Å; I319-M323 HydrophobicContact CG2-SD 3.85Å; I319-M323 WeakPolarHBondContact O-CB 3.49Å; I319-M323 VanDerWaalsContact O-CG 3.22Å; I319-M323 WeakPolarHBondContact O-CG 3.38Å; I319-M323 PolarHBondContact O-N 3.4Å; R320-M323 PolarHBondContact O-N 2.74Å; M323-N327 CarbonylContact O-C 3.09Å; M323-N327 WeakPolarHBondContact O-CA 3.47Å; M323-N327 PolarHBondContact O-N 3.1Å; M323-L328 WeakPolarHBondContact CB-O 3.38Å; M323-L328 PolarHBondContact O-N 2.98Å; M323-L330 HydrophobicContact CE-CB 4.04Å; M323-L330 HydrophobicContact SD-CB 4.02Å; M323-L330 HydrophobicContact SD-CD1 4.05Å; M323-V333 HydrophobicContact CB-CG2 4.49Å; M323-V333 HydrophobicContact CG-CB 4.19Å; M323-V333 HydrophobicContact CG-CG2 3.68Å
324	E	96.9	Very high	96.1	Very high	166 Å²	166	70.5 Å²	70.5	78%	0.776	35%	0.347	S	S	*	.	H	α-helix	trans	-68.7	-49.1	177.9	-174	175.5	-175.8	0	0	111.8	R320 Q321 L322 F326 N327	R320-E324 PolarHBondContact O-N 3.06Å; Q321-E324 PolarHBondContact O-N 3.15Å; L322-E324 VanDerWaalsContact C-N 3.32Å; L322-E324 PolarHBondContact O-N 3Å; E324-F326 VanDerWaalsContact C-N 3.34Å; E324-F326 PolarHBondContact O-N 3.19Å; E324-N327 PolarHBondContact O-N 3.33Å
325	K	96.3	Very high	96.2	Very high	144 Å²	144	74.7 Å²	74.7	63%	0.626	36%	0.362	S	S	*	.	H	α-helix	trans	-60	-40.3	-176.9	-179	176.2	179.4	179.1	0	113.2	Q321 L322	Q321-K325 WeakPolarHBondContact O-CB 3.1Å; Q321-K325 PolarHBondContact O-N 3.42Å; L322-K325 PolarHBondContact O-N 3.16Å
326	F	95.2	Very high	96.4	Very high	49 Å²	49	75 Å²	75	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-105.2	0.1	-176.8	-63.7	-70	0	0	0	113.6	L322 E324 L328 L351 A352	L322-F326 HydrophobicContact CD2-CD2 4.09Å; L322-F326 HydrophobicContact CD2-CE2 3.71Å; L322-F326 PolarHBondContact O-N 3.24Å; E324-F326 VanDerWaalsContact C-N 3.34Å; E324-F326 PolarHBondContact O-N 3.19Å; F326-L328 HydrophobicContact CB-CD1 3.81Å; F326-L328 HydrophobicContact CB-CG 3.93Å; F326-L328 PolarHBondContact O-N 2.84Å; F326-L351 HydrophobicContact CD1-CB 4.35Å; F326-L351 HydrophobicContact CD2-CB 3.81Å; F326-L351 HydrophobicContact CD2-CD1 3.95Å; F326-L351 HydrophobicContact CE1-CB 4.4Å; F326-L351 HydrophobicContact CE2-CB 3.85Å; F326-L351 HydrophobicContact CE2-CD1 4.32Å; F326-L351 HydrophobicContact CG-CB 4.06Å; F326-L351 HydrophobicContact CZ-CB 4.15Å; F326-A352 HydrophobicContact CE1-CB 3.68Å; F326-A352 HydrophobicContact CZ-CB 3.87Å
327	N	94.9	Very high	96.5	Very high	148 Å²	148	71.6 Å²	71.6	79%	0.791	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	52.3	-177.1	-167.5	76.9	0	0	0	112.3	M323 E324	M323-N327 CarbonylContact O-C 3.09Å; M323-N327 WeakPolarHBondContact O-CA 3.47Å; M323-N327 PolarHBondContact O-N 3.1Å; E324-N327 PolarHBondContact O-N 3.33Å
328	L	95.7	Very high	96.5	Very high	55 Å²	55	66.7 Å²	66.7	29%	0.288	33%	0.328	S	S	.	.			trans	-115.9	156.6	-178	-64.3	176.7	0	0	0	111.1	M323 F326 T332 V333 L351	M323-L328 WeakPolarHBondContact CB-O 3.38Å; M323-L328 PolarHBondContact O-N 2.98Å; F326-L328 HydrophobicContact CB-CD1 3.81Å; F326-L328 HydrophobicContact CB-CG 3.93Å; F326-L328 PolarHBondContact O-N 2.84Å; L328-T332 HydrophobicContact CD1-CG2 4.07Å; L328-T332 HydrophobicContact CD2-CG2 4.25Å; L328-V333 HydrophobicContact CB-CG2 3.88Å; L328-V333 HydrophobicContact CD1-CG2 4.4Å; L328-L351 HydrophobicContact CD1-CD1 4.31Å; L328-L351 HydrophobicContact CD1-CD2 3.6Å; L328-L351 HydrophobicContact CD1-CG 4.4Å
329	D	96.5	Very high	96.6	Very high	59 Å²	59	68.6 Å²	68.6	32%	0.316	34%	0.336	S	S	.	.			trans	-78.9	164.5	174	69.7	18.4	0	0	0	112	R40 S331 T332 V333	R40-D329 IonicContact CZ-OD2 2.72Å; R40-D329 IonicContact NH1-OD2 2.79Å; R40-D329 PolarHBondContact NH1-OD2 3.21Å; R40-D329 IonicContact NH2-OD2 3.66Å; D329-S331 VanDerWaalsContact C-N 3.27Å; D329-S331 PolarHBondContact O-N 3.48Å; D329-S331 PolarHBondContact OD1-N 3.48Å; D329-T332 PolarHBondContact O-N 3Å; D329-T332 WeakPolarHBondContact OD1-CB 3.28Å; D329-T332 PolarHBondContact OD1-N 3.35Å; D329-T332 PolarHBondContact OD1-OG1 3.03Å; D329-V333 PolarHBondContact O-N 3.48Å
330	L	96.8	Very high	96.6	Very high	97 Å²	97	68.2 Å²	68.2	51%	0.508	33%	0.334	S	S	.	.	H	α-helix	trans	-53.8	-47	178.7	176.1	60.6	0	0	0	111.2	I319 M323 T332 V333 T334	I319-L330 HydrophobicContact CG2-CD1 3.54Å; M323-L330 HydrophobicContact CE-CB 4.04Å; M323-L330 HydrophobicContact SD-CB 4.02Å; M323-L330 HydrophobicContact SD-CD1 4.05Å; L330-T332 VanDerWaalsContact C-N 3.31Å; L330-T332 PolarHBondContact O-N 2.67Å; L330-V333 PolarHBondContact O-N 3.04Å; L330-T334 WeakPolarHBondContact O-CB 3.18Å; L330-T334 PolarHBondContact O-N 3.47Å; L330-T334 PolarHBondContact O-OG1 3.21Å
331	S	96.2	Very high	96.6	Very high	59 Å²	59	60 Å²	60	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-57.9	-41.9	-178.1	-176.2	0	0	0	0	112.6	D329 Q335	D329-S331 VanDerWaalsContact C-N 3.27Å; D329-S331 PolarHBondContact O-N 3.48Å; D329-S331 PolarHBondContact OD1-N 3.48Å; S331-Q335 WeakPolarHBondContact O-CB 3.18Å; S331-Q335 PolarHBondContact O-N 3.29Å
332	T	96.2	Very high	96.5	Very high	54 Å²	54	53.9 Å²	53.9	33%	0.331	28%	0.275	S	S	.	.	H	α-helix	trans	-70.5	-42.6	-177.4	-55.5	0	0	0	0	110.6	L328 D329 L330 Q335 A336	L328-T332 HydrophobicContact CD1-CG2 4.07Å; L328-T332 HydrophobicContact CD2-CG2 4.25Å; D329-T332 PolarHBondContact O-N 3Å; D329-T332 WeakPolarHBondContact OD1-CB 3.28Å; D329-T332 PolarHBondContact OD1-N 3.35Å; D329-T332 PolarHBondContact OD1-OG1 3.03Å; L330-T332 VanDerWaalsContact C-N 3.31Å; L330-T332 PolarHBondContact O-N 2.67Å; T332-Q335 PolarHBondContact O-N 2.95Å; T332-A336 WeakPolarHBondContact O-CB 3.19Å; T332-A336 PolarHBondContact O-N 3.48Å
333	V	97.2	Very high	96.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-48.1	178.9	177.2	0	0	0	0	110.8	I319 L322 M323 L328 D329 L330 Q335 A336 F337	I319-V333 HydrophobicContact CB-CG1 4.49Å; I319-V333 HydrophobicContact CG1-CG1 4.42Å; I319-V333 HydrophobicContact CG2-CG1 4.1Å; L322-V333 HydrophobicContact CB-CG1 3.9Å; L322-V333 HydrophobicContact CB-CG2 4.48Å; L322-V333 HydrophobicContact CD1-CG1 4.2Å; M323-V333 HydrophobicContact CB-CG2 4.49Å; M323-V333 HydrophobicContact CG-CB 4.19Å; M323-V333 HydrophobicContact CG-CG2 3.68Å; L328-V333 HydrophobicContact CB-CG2 3.88Å; L328-V333 HydrophobicContact CD1-CG2 4.4Å; D329-V333 PolarHBondContact O-N 3.48Å; L330-V333 PolarHBondContact O-N 3.04Å; V333-Q335 VanDerWaalsContact C-N 3.32Å; V333-Q335 PolarHBondContact O-N 3.46Å; V333-A336 WeakPolarHBondContact O-CB 3.43Å; V333-A336 PolarHBondContact O-N 2.87Å; V333-A336 VanDerWaalsContact O-N 3.11Å; V333-F337 HydrophobicContact CG1-CD2 3.99Å; V333-F337 HydrophobicContact CG1-CE2 3.74Å; V333-F337 VanDerWaalsContact O-CD2 3.28Å; V333-F337 WeakPolarHBondContact O-CD2 3.39Å; V333-F337 PolarHBondContact O-N 3.48Å
334	T	96.8	Very high	96.5	Very high	31 Å²	31	54.3 Å²	54.3	19%	0.19	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-43.8	175.1	-58.8	0	0	0	0	111.3	L254 L330 A336 F337 L338	L254-T334 HydrophobicContact CD1-CG2 3.43Å; L254-T334 VanDerWaalsContact CD1-CG2 3.43Å; L330-T334 WeakPolarHBondContact O-CB 3.18Å; L330-T334 PolarHBondContact O-N 3.47Å; L330-T334 PolarHBondContact O-OG1 3.21Å; T334-A336 VanDerWaalsContact C-N 3.35Å; T334-A336 PolarHBondContact O-N 2.98Å; T334-F337 PolarHBondContact O-N 2.88Å; T334-L338 WeakPolarHBondContact O-CG 3.45Å; T334-L338 PolarHBondContact O-N 2.82Å
335	Q	96.8	Very high	96.4	Very high	110 Å²	110	53.7 Å²	53.7	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-37.8	175.8	-172.5	176.5	38.7	0	0	112.2	S331 T332 V333 F337 L338 K339	S331-Q335 WeakPolarHBondContact O-CB 3.18Å; S331-Q335 PolarHBondContact O-N 3.29Å; T332-Q335 PolarHBondContact O-N 2.95Å; V333-Q335 VanDerWaalsContact C-N 3.32Å; V333-Q335 PolarHBondContact O-N 3.46Å; Q335-F337 VanDerWaalsContact C-N 3.35Å; Q335-F337 PolarHBondContact O-N 3.44Å; Q335-L338 WeakPolarHBondContact O-CB 3.31Å; Q335-L338 PolarHBondContact O-N 2.93Å; Q335-K339 HydrophobicContact CG-CG 4.32Å; Q335-K339 WeakPolarHBondContact O-CG 3.47Å; Q335-K339 PolarHBondContact O-N 3.27Å; Q335-K339 VanDerWaalsContact O-N 3.09Å
336	A	97.3	Very high	96.4	Very high	7 Å²	7	47.1 Å²	47.1	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-42.4	176.9	0	0	0	0	0	111.4	T332 V333 T334 K339 N340 T347 F350 L351	T332-A336 WeakPolarHBondContact O-CB 3.19Å; T332-A336 PolarHBondContact O-N 3.48Å; V333-A336 WeakPolarHBondContact O-CB 3.43Å; V333-A336 PolarHBondContact O-N 2.87Å; V333-A336 VanDerWaalsContact O-N 3.11Å; T334-A336 VanDerWaalsContact C-N 3.35Å; T334-A336 PolarHBondContact O-N 2.98Å; A336-K339 PolarHBondContact O-N 3.03Å; A336-N340 WeakPolarHBondContact O-CB 3.29Å; A336-N340 PolarHBondContact O-N 3.4Å; A336-N340 VanDerWaalsContact O-N 3.15Å; A336-N340 PolarHBondContact O-ND2 3.43Å; A336-T347 HydrophobicContact CB-CG2 3.8Å; A336-F350 HydrophobicContact CB-CD1 4.49Å; A336-L351 HydrophobicContact CB-CD2 3.76Å; A336-L351 HydrophobicContact CB-CG 4.26Å
337	F	97.7	Very high	96.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-42.5	172.5	-79.5	-73.6	0	0	0	112.4	V250 L254 I318 I319 L322 V333 T334 Q335 K339 N340 S341 G342 L344 T347	V250-F337 HydrophobicContact CG1-CD1 3.62Å; V250-F337 HydrophobicContact CG1-CD2 4.49Å; V250-F337 HydrophobicContact CG1-CE1 3.63Å; V250-F337 HydrophobicContact CG1-CG 4.07Å; V250-F337 HydrophobicContact CG1-CZ 4.1Å; L254-F337 HydrophobicContact CD2-CB 3.33Å; I318-F337 HydrophobicContact CG2-CE1 4.49Å; I318-F337 HydrophobicContact CG2-CE2 4.23Å; I318-F337 HydrophobicContact CG2-CZ 3.57Å; I319-F337 HydrophobicContact CG1-CD2 4.32Å; I319-F337 HydrophobicContact CG1-CE2 3.94Å; L322-F337 HydrophobicContact CD1-CE1 4.46Å; L322-F337 HydrophobicContact CD1-CE2 3.48Å; L322-F337 VanDerWaalsContact CD1-CE2 3.48Å; L322-F337 HydrophobicContact CD1-CZ 3.34Å; V333-F337 HydrophobicContact CG1-CD2 3.99Å; V333-F337 HydrophobicContact CG1-CE2 3.74Å; V333-F337 VanDerWaalsContact O-CD2 3.28Å; V333-F337 WeakPolarHBondContact O-CD2 3.39Å; V333-F337 PolarHBondContact O-N 3.48Å; T334-F337 PolarHBondContact O-N 2.88Å; Q335-F337 VanDerWaalsContact C-N 3.35Å; Q335-F337 PolarHBondContact O-N 3.44Å; F337-K339 PolarHBondContact O-N 3.34Å; F337-N340 CarbonylContact O-C 3.46Å; F337-N340 PolarHBondContact O-N 3.34Å; F337-S341 PolarHBondContact O-N 2.95Å; F337-S341 VanDerWaalsContact O-N 3.1Å; F337-G342 PolarHBondContact O-N 3.28Å; F337-L344 HydrophobicContact CE1-CD1 4.12Å; F337-L344 HydrophobicContact CZ-CD1 3.92Å; F337-T347 HydrophobicContact CD1-CG2 3.97Å; F337-T347 WeakPolarHBondContact CD1-OG1 3.15Å; F337-T347 HydrophobicContact CD2-CG2 4.09Å; F337-T347 HydrophobicContact CE1-CG2 4.06Å; F337-T347 HydrophobicContact CE2-CG2 4.18Å; F337-T347 HydrophobicContact CG-CG2 3.97Å; F337-T347 HydrophobicContact CZ-CG2 4.15Å
338	L	97	Very high	96.6	Very high	40 Å²	40	39.2 Å²	39.2	21%	0.209	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-32.3	-179.7	-81.9	169.5	0	0	0	112	L254 T258 T334 Q335 R394 F397	L254-L338 HydrophobicContact CD1-CD1 4.4Å; L254-L338 HydrophobicContact CD1-CD2 4.02Å; L254-L338 HydrophobicContact CD1-CG 3.79Å; L254-L338 HydrophobicContact CD2-CB 4.29Å; L254-L338 HydrophobicContact CD2-CD2 3.81Å; L254-L338 HydrophobicContact CD2-CG 3.74Å; L254-L338 HydrophobicContact CG-CD2 3.5Å; L254-L338 VanDerWaalsContact CG-CD2 3.5Å; L254-L338 HydrophobicContact CG-CG 3.71Å; T258-L338 HydrophobicContact CG2-CD1 4.31Å; T258-L338 HydrophobicContact CG2-CD2 3.55Å; T334-L338 WeakPolarHBondContact O-CG 3.45Å; T334-L338 PolarHBondContact O-N 2.82Å; Q335-L338 WeakPolarHBondContact O-CB 3.31Å; Q335-L338 PolarHBondContact O-N 2.93Å; L338-R394 PolarHBondContact O-NH1 3.31Å; L338-R394 PolarHBondContact O-NH2 3.46Å; L338-R394 VanDerWaalsContact O-NH2 3.16Å; L338-F397 HydrophobicContact CD2-CE1 4.38Å; L338-F397 HydrophobicContact CD2-CZ 4.29Å
339	K	97.3	Very high	96.6	Very high	45 Å²	45	37.7 Å²	37.7	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-90.1	-9	-178.1	-57.9	-72.3	156.9	-164.6	0	112.8	Q335 A336 F337 I362 W363 D368	Q335-K339 HydrophobicContact CG-CG 4.32Å; Q335-K339 WeakPolarHBondContact O-CG 3.47Å; Q335-K339 PolarHBondContact O-N 3.27Å; Q335-K339 VanDerWaalsContact O-N 3.09Å; A336-K339 PolarHBondContact O-N 3.03Å; F337-K339 PolarHBondContact O-N 3.34Å; K339-I362 HydrophobicContact CB-CB 4.21Å; K339-I362 HydrophobicContact CB-CD1 4.13Å; K339-W363 WeakPolarHBondContact CD-O 3.43Å; K339-W363 PolarHBondContact O-N 2.97Å; K339-D368 IonicContact NZ-OD2 2.72Å
340	N	97.5	Very high	96.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	23.1	174.9	-71.9	-72.8	0	0	0	112.6	A336 F337 G342 E343 A346 T347 R356 I362	A336-N340 WeakPolarHBondContact O-CB 3.29Å; A336-N340 PolarHBondContact O-N 3.4Å; A336-N340 VanDerWaalsContact O-N 3.15Å; A336-N340 PolarHBondContact O-ND2 3.43Å; F337-N340 CarbonylContact O-C 3.46Å; F337-N340 PolarHBondContact O-N 3.34Å; N340-G342 PolarHBondContact O-N 3.19Å; N340-G342 VanDerWaalsContact O-N 3.15Å; N340-E343 VanDerWaalsContact O-CB 3.31Å; N340-E343 WeakPolarHBondContact O-CB 3.27Å; N340-E343 VanDerWaalsContact O-CG 3.32Å; N340-E343 WeakPolarHBondContact O-CG 3.48Å; N340-E343 PolarHBondContact O-N 3.43Å; N340-A346 HydrophobicContact CB-CB 4.31Å; N340-T347 WeakPolarHBondContact CB-OG1 3.41Å; N340-R356 VanDerWaalsContact OD1-CD 3.29Å; N340-R356 WeakPolarHBondContact OD1-CD 3.39Å; N340-R356 VanDerWaalsContact OD1-CG 3.3Å; N340-R356 WeakPolarHBondContact OD1-CG 3.3Å; N340-I362 WeakPolarHBondContact OD1-CG2 3.47Å
341	S	96.7	Very high	96.6	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.028	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	31.5	174.9	-54.4	0	0	0	0	115.1	F337 E343 R394 F397	F337-S341 PolarHBondContact O-N 2.95Å; F337-S341 VanDerWaalsContact O-N 3.1Å; S341-E343 PolarHBondContact O-N 2.86Å; S341-R394 WeakPolarHBondContact OG-CD 3.16Å; S341-R394 PolarHBondContact OG-NH1 2.97Å; S341-F397 WeakPolarHBondContact O-CD2 3.45Å
342	G	95.4	Very high	96.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-1.8	-178.6	0	0	0	0	0	115	F337 N340 L344	F337-G342 PolarHBondContact O-N 3.28Å; N340-G342 PolarHBondContact O-N 3.19Å; N340-G342 VanDerWaalsContact O-N 3.15Å; G342-L344 PolarHBondContact O-N 3.47Å
343	E	95.7	Very high	96.5	Very high	26 Å²	26	35.3 Å²	35.3	12%	0.121	20%	0.198	C	C	.	.			trans	-71.1	120.4	-174.6	-62.8	171.7	65.2	0	0	111.8	E247 N340 S341 A346 T347 R356 R393	E247-E343 WeakPolarHBondContact OE1-CA 3.21Å; N340-E343 VanDerWaalsContact O-CB 3.31Å; N340-E343 WeakPolarHBondContact O-CB 3.27Å; N340-E343 VanDerWaalsContact O-CG 3.32Å; N340-E343 WeakPolarHBondContact O-CG 3.48Å; N340-E343 PolarHBondContact O-N 3.43Å; S341-E343 PolarHBondContact O-N 2.86Å; E343-A346 HydrophobicContact CB-CB 3.84Å; E343-T347 WeakPolarHBondContact O-CB 3.29Å; E343-T347 PolarHBondContact O-N 2.94Å; E343-T347 PolarHBondContact O-OG1 3.17Å; E343-R356 IonicContact OE1-NH2 3.1Å; E343-R356 IonicContact OE2-NH1 3.75Å; E343-R356 IonicContact OE2-NH2 3.48Å; E343-R393 IonicContact OE1-CZ 2.73Å; E343-R393 IonicContact OE1-NH1 3.58Å; E343-R393 PolarHBondContact OE1-NH1 3.26Å; E343-R393 IonicContact OE2-CZ 2.62Å; E343-R393 IonicContact OE2-NH1 3.02Å; E343-R393 PolarHBondContact OE2-NH1 3.34Å
344	L	95.6	Very high	96.3	Very high	45 Å²	45	37 Å²	37	24%	0.236	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-47.1	-177.3	177.1	58.5	0	0	0	112.3	I318 L322 F337 G342 T347 S348	I318-L344 HydrophobicContact CD1-CD2 3.96Å; I318-L344 HydrophobicContact CG2-CD1 3.53Å; L322-L344 HydrophobicContact CD1-CD1 4.04Å; F337-L344 HydrophobicContact CE1-CD1 4.12Å; F337-L344 HydrophobicContact CZ-CD1 3.92Å; G342-L344 PolarHBondContact O-N 3.47Å; L344-T347 PolarHBondContact O-N 3.3Å; L344-S348 VanDerWaalsContact O-CB 3.26Å; L344-S348 WeakPolarHBondContact O-CB 3.38Å; L344-S348 PolarHBondContact O-N 3.45Å
345	E	95.5	Very high	96.2	Very high	153 Å²	153	41.4 Å²	41.4	72%	0.715	23%	0.234	S	C	*	.	H	α-helix	trans	-66.2	-47	-177.3	-172.6	174.2	-163.9	0	0	111.3	T347 S348 A349	E345-T347 VanDerWaalsContact C-N 3.33Å; E345-T347 PolarHBondContact O-N 3.22Å; E345-S348 PolarHBondContact O-N 2.91Å; E345-A349 WeakPolarHBondContact O-CB 3.37Å; E345-A349 PolarHBondContact O-N 3.44Å
346	A	96.1	Very high	96.2	Very high	7 Å²	7	36.6 Å²	36.6	6%	0.058	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-41.5	177.3	0	0	0	0	0	111.7	N340 E343 F350 R356	N340-A346 HydrophobicContact CB-CB 4.31Å; E343-A346 HydrophobicContact CB-CB 3.84Å; A346-F350 WeakPolarHBondContact O-CB 3.4Å; A346-F350 PolarHBondContact O-N 2.98Å; A346-R356 HydrophobicContact CB-CG 4.5Å
347	T	97.5	Very high	96	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-47.2	176.4	-59.2	0	0	0	0	111.3	L322 A336 F337 N340 E343 L344 E345 A349 F350 L351	L322-T347 HydrophobicContact CD1-CG2 4.47Å; A336-T347 HydrophobicContact CB-CG2 3.8Å; F337-T347 HydrophobicContact CD1-CG2 3.97Å; F337-T347 WeakPolarHBondContact CD1-OG1 3.15Å; F337-T347 HydrophobicContact CD2-CG2 4.09Å; F337-T347 HydrophobicContact CE1-CG2 4.06Å; F337-T347 HydrophobicContact CE2-CG2 4.18Å; F337-T347 HydrophobicContact CG-CG2 3.97Å; F337-T347 HydrophobicContact CZ-CG2 4.15Å; N340-T347 WeakPolarHBondContact CB-OG1 3.41Å; E343-T347 WeakPolarHBondContact O-CB 3.29Å; E343-T347 PolarHBondContact O-N 2.94Å; E343-T347 PolarHBondContact O-OG1 3.17Å; L344-T347 PolarHBondContact O-N 3.3Å; E345-T347 VanDerWaalsContact C-N 3.33Å; E345-T347 PolarHBondContact O-N 3.22Å; T347-A349 PolarHBondContact O-N 3.4Å; T347-F350 PolarHBondContact O-N 3.26Å; T347-L351 HydrophobicContact CG2-CD1 4.07Å; T347-L351 HydrophobicContact CG2-CG 4.32Å; T347-L351 WeakPolarHBondContact O-CB 3.28Å; T347-L351 VanDerWaalsContact O-CG 3.27Å; T347-L351 WeakPolarHBondContact O-CG 3.31Å; T347-L351 PolarHBondContact O-N 2.88Å
348	S	96.2	Very high	95.9	Very high	30 Å²	30	43 Å²	43	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-44.7	178.5	-178.5	0	0	0	0	112	L344 E345 L351 A352	L344-S348 VanDerWaalsContact O-CB 3.26Å; L344-S348 WeakPolarHBondContact O-CB 3.38Å; L344-S348 PolarHBondContact O-N 3.45Å; E345-S348 PolarHBondContact O-N 2.91Å; S348-L351 PolarHBondContact O-N 3.45Å; S348-A352 WeakPolarHBondContact O-CB 3.35Å; S348-A352 PolarHBondContact O-N 3.47Å
349	A	96.1	Very high	95.7	Very high	24 Å²	24	44.1 Å²	44.1	20%	0.198	28%	0.276	C	S	.	.	H	α-helix	trans	-63.3	-41.8	175.9	0	0	0	0	0	112.2	E345 T347 A352 S353 Q355 A357	E345-A349 WeakPolarHBondContact O-CB 3.37Å; E345-A349 PolarHBondContact O-N 3.44Å; T347-A349 PolarHBondContact O-N 3.4Å; A349-A352 PolarHBondContact O-N 3.18Å; A349-S353 PolarHBondContact O-N 2.91Å; A349-S353 PolarHBondContact O-OG 3.46Å; A349-Q355 CarbonylContact C-O 3.59Å; A349-A357 HydrophobicContact CB-CB 3.97Å
350	F	97.1	Very high	95.7	Very high	51 Å²	51	46.2 Å²	46.2	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-43.5	176.9	178.2	-102.7	0	0	0	112.2	A336 A346 T347 A352 G354 Q355 I362	A336-F350 HydrophobicContact CB-CD1 4.49Å; A346-F350 WeakPolarHBondContact O-CB 3.4Å; A346-F350 PolarHBondContact O-N 2.98Å; T347-F350 PolarHBondContact O-N 3.26Å; F350-A352 VanDerWaalsContact C-N 3.3Å; F350-A352 PolarHBondContact O-N 3.39Å; F350-G354 WeakPolarHBondContact CE2-O 3.41Å; F350-G354 WeakPolarHBondContact O-CA 3.36Å; F350-G354 PolarHBondContact O-N 3.23Å; F350-Q355 VanDerWaalsContact CA-O 3.31Å; F350-Q355 WeakPolarHBondContact CA-O 3.48Å; F350-Q355 PolarHBondContact N-O 3.16Å; F350-I362 HydrophobicContact CD1-CG2 4.49Å; F350-I362 HydrophobicContact CD2-CG2 3.66Å; F350-I362 HydrophobicContact CE1-CD1 4.26Å; F350-I362 HydrophobicContact CE2-CD1 4.07Å; F350-I362 HydrophobicContact CE2-CG1 4.43Å; F350-I362 HydrophobicContact CE2-CG2 3.72Å; F350-I362 HydrophobicContact CG-CG2 4.08Å; F350-I362 HydrophobicContact CZ-CD1 3.67Å; F350-I362 HydrophobicContact CZ-CG2 4.18Å
351	L	96.6	Very high	95.7	Very high	31 Å²	31	48.7 Å²	48.7	16%	0.162	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-32.5	176.5	-68.1	-180	0	0	0	112.4	L322 F326 L328 A336 T347 S348	L322-L351 HydrophobicContact CB-CD1 4.44Å; L322-L351 HydrophobicContact CD1-CD1 4.46Å; F326-L351 HydrophobicContact CD1-CB 4.35Å; F326-L351 HydrophobicContact CD2-CB 3.81Å; F326-L351 HydrophobicContact CD2-CD1 3.95Å; F326-L351 HydrophobicContact CE1-CB 4.4Å; F326-L351 HydrophobicContact CE2-CB 3.85Å; F326-L351 HydrophobicContact CE2-CD1 4.32Å; F326-L351 HydrophobicContact CG-CB 4.06Å; F326-L351 HydrophobicContact CZ-CB 4.15Å; L328-L351 HydrophobicContact CD1-CD1 4.31Å; L328-L351 HydrophobicContact CD1-CD2 3.6Å; L328-L351 HydrophobicContact CD1-CG 4.4Å; A336-L351 HydrophobicContact CB-CD2 3.76Å; A336-L351 HydrophobicContact CB-CG 4.26Å; T347-L351 HydrophobicContact CG2-CD1 4.07Å; T347-L351 HydrophobicContact CG2-CG 4.32Å; T347-L351 WeakPolarHBondContact O-CB 3.28Å; T347-L351 VanDerWaalsContact O-CG 3.27Å; T347-L351 WeakPolarHBondContact O-CG 3.31Å; T347-L351 PolarHBondContact O-N 2.88Å; S348-L351 PolarHBondContact O-N 3.45Å
352	A	95.7	Very high	95.7	Very high	68 Å²	68	51.1 Å²	51.1	56%	0.562	31%	0.312	S	S	*	.	H	α-helix	trans	-77.8	-41.5	179.3	0	0	0	0	0	114	F326 S348 A349 F350	F326-A352 HydrophobicContact CE1-CB 3.68Å; F326-A352 HydrophobicContact CZ-CB 3.87Å; S348-A352 WeakPolarHBondContact O-CB 3.35Å; S348-A352 PolarHBondContact O-N 3.47Å; A349-A352 PolarHBondContact O-N 3.18Å; F350-A352 VanDerWaalsContact C-N 3.3Å; F350-A352 PolarHBondContact O-N 3.39Å
353	S	94.5	Very high	95.8	Very high	68 Å²	68	51.2 Å²	51.2	48%	0.476	31%	0.312	S	S	.	.	H	α-helix	trans	-117	-13.3	-168.6	73.1	0	0	0	0	114.5	A349 Q355	A349-S353 PolarHBondContact O-N 2.91Å; A349-S353 PolarHBondContact O-OG 3.46Å; S353-Q355 VanDerWaalsContact C-N 3.26Å; S353-Q355 PolarHBondContact OG-N 3.4Å; S353-Q355 PolarHBondContact OG-O 3.1Å
354	G	93.9	Very high	95.9	Very high	35 Å²	35	52.2 Å²	52.2	36%	0.361	32%	0.322	S	S	.	.	S	Bend	trans	78	4.9	-170	0	0	0	0	0	114.1	F350	F350-G354 WeakPolarHBondContact CE2-O 3.41Å; F350-G354 WeakPolarHBondContact O-CA 3.36Å; F350-G354 PolarHBondContact O-N 3.23Å
355	Q	94.5	Very high	95.9	Very high	124 Å²	124	56.5 Å²	56.5	58%	0.579	34%	0.335	S	S	*	.	S	Bend	trans	-137.7	150.4	179.9	-62.5	-65.4	-64.3	0	0	110.4	A349 F350 S353	A349-Q355 CarbonylContact C-O 3.59Å; F350-Q355 VanDerWaalsContact CA-O 3.31Å; F350-Q355 WeakPolarHBondContact CA-O 3.48Å; F350-Q355 PolarHBondContact N-O 3.16Å; S353-Q355 VanDerWaalsContact C-N 3.26Å; S353-Q355 PolarHBondContact OG-N 3.4Å; S353-Q355 PolarHBondContact OG-O 3.1Å
356	R	95.5	Very high	95.9	Very high	9 Å²	9	54 Å²	54	3%	0.034	32%	0.324	C	S	.	.			trans	-73.2	151.7	172.5	-67.4	172.4	51.3	131.5	6.2	110.4	N340 E343 A346 D358 G359 Y360 I362 N390	N340-R356 VanDerWaalsContact OD1-CD 3.29Å; N340-R356 WeakPolarHBondContact OD1-CD 3.39Å; N340-R356 VanDerWaalsContact OD1-CG 3.3Å; N340-R356 WeakPolarHBondContact OD1-CG 3.3Å; E343-R356 IonicContact OE1-NH2 3.1Å; E343-R356 IonicContact OE2-NH1 3.75Å; E343-R356 IonicContact OE2-NH2 3.48Å; A346-R356 HydrophobicContact CB-CG 4.5Å; R356-D358 VanDerWaalsContact C-N 3.25Å; R356-D358 WeakPolarHBondContact CB-OD1 3.33Å; R356-D358 IonicContact CZ-OD1 3.99Å; R356-D358 IonicContact CZ-OD2 2.69Å; R356-D358 IonicContact NE-OD1 3.96Å; R356-D358 PolarHBondContact NE-OD1 3.36Å; R356-D358 IonicContact NE-OD2 3.22Å; R356-D358 PolarHBondContact NE-OD2 3.26Å; R356-D358 IonicContact NH2-OD1 2.64Å; R356-D358 IonicContact NH2-OD2 2.99Å; R356-D358 PolarHBondContact NH2-OD2 2.98Å; R356-D358 PolarHBondContact O-N 3.07Å; R356-G359 PolarHBondContact O-N 3.1Å; R356-Y360 WeakPolarHBondContact CD-O 3.34Å; R356-I362 HydrophobicContact CG-CG2 4.13Å; R356-N390 PolarHBondContact NH2-OD1 2.88Å
357	A	94	Very high	96	Very high	78 Å²	78	54 Å²	54	65%	0.645	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-27	179.9	0	0	0	0	0	113.4	A349 G359	A349-A357 HydrophobicContact CB-CB 3.97Å; A357-G359 VanDerWaalsContact C-N 3.27Å; A357-G359 PolarHBondContact O-N 3.23Å
358	D	94.8	Very high	95.9	Very high	64 Å²	64	54.3 Å²	54.3	34%	0.342	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.5	178.9	64.3	-7.9	0	0	0	114	R356 Y360 N390	R356-D358 VanDerWaalsContact C-N 3.25Å; R356-D358 WeakPolarHBondContact CB-OD1 3.33Å; R356-D358 IonicContact CZ-OD1 3.99Å; R356-D358 IonicContact CZ-OD2 2.69Å; R356-D358 IonicContact NE-OD1 3.96Å; R356-D358 PolarHBondContact NE-OD1 3.36Å; R356-D358 IonicContact NE-OD2 3.22Å; R356-D358 PolarHBondContact NE-OD2 3.26Å; R356-D358 IonicContact NH2-OD1 2.64Å; R356-D358 IonicContact NH2-OD2 2.99Å; R356-D358 PolarHBondContact NH2-OD2 2.98Å; R356-D358 PolarHBondContact O-N 3.07Å; D358-Y360 HydrophobicContact CB-CD2 4.1Å; D358-Y360 PolarHBondContact O-N 3.35Å; D358-Y360 PolarHBondContact OD1-N 2.94Å; D358-N390 PolarHBondContact OD2-ND2 2.85Å; D358-N390 PolarHBondContact OD2-OD1 3.27Å
359	G	94.6	Very high	95.9	Very high	63 Å²	63	56.5 Å²	56.5	65%	0.649	33%	0.333	S	S	*	.	S	Bend	trans	77.2	2.1	178.2	0	0	0	0	0	115	R356 A357	R356-G359 PolarHBondContact O-N 3.1Å; A357-G359 VanDerWaalsContact C-N 3.27Å; A357-G359 PolarHBondContact O-N 3.23Å
360	Y	96.8	Very high	95.8	Very high	90 Å²	90	56.8 Å²	56.8	35%	0.353	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-89.7	155.6	176.6	-69.4	-69.7	0	0	0	111.9	R356 D358 K385 F386 N390	R356-Y360 WeakPolarHBondContact CD-O 3.34Å; D358-Y360 HydrophobicContact CB-CD2 4.1Å; D358-Y360 PolarHBondContact O-N 3.35Å; D358-Y360 PolarHBondContact OD1-N 2.94Å; Y360-K385 VanDerWaalsContact CD1-O 3.29Å; Y360-K385 WeakPolarHBondContact CD1-O 3.49Å; Y360-F386 VanDerWaalsContact CD1-O 3.3Å; Y360-F386 WeakPolarHBondContact CD1-O 3.05Å; Y360-F386 WeakPolarHBondContact CD2-O 3.28Å; Y360-F386 WeakPolarHBondContact CE1-O 2.86Å; Y360-F386 WeakPolarHBondContact CE2-O 3.39Å; Y360-N390 WeakPolarHBondContact CD2-ND2 3.28Å
361	P	96.7	Very high	95.7	Very high	52 Å²	52	55.6 Å²	55.6	34%	0.338	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-71.5	164.9	174.3	29.2	-32	0	0	0	111.8	K385 F386	P361-K385 VanDerWaalsContact CD-O 3.28Å; P361-K385 WeakPolarHBondContact CD-O 3.32Å; P361-K385 HydrophobicContact CG-CG 3.95Å; P361-F386 HydrophobicContact CB-CE1 4.32Å; P361-F386 HydrophobicContact CG-CD1 4.01Å; P361-F386 HydrophobicContact CG-CE1 3.7Å; P361-F386 HydrophobicContact CG-CZ 4.31Å; P361-F386 WeakPolarHBondContact O-CD1 3.21Å; P361-F386 VanDerWaalsContact O-CE1 3.31Å; P361-F386 WeakPolarHBondContact O-CE1 3.4Å
362	I	97.3	Very high	95.5	Very high	55 Å²	55	60.7 Å²	60.7	28%	0.282	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-77.6	158.3	168.2	62	167.1	0	0	0	111.1	K339 N340 F350 R356	K339-I362 HydrophobicContact CB-CB 4.21Å; K339-I362 HydrophobicContact CB-CD1 4.13Å; N340-I362 WeakPolarHBondContact OD1-CG2 3.47Å; F350-I362 HydrophobicContact CD1-CG2 4.49Å; F350-I362 HydrophobicContact CD2-CG2 3.66Å; F350-I362 HydrophobicContact CE1-CD1 4.26Å; F350-I362 HydrophobicContact CE2-CD1 4.07Å; F350-I362 HydrophobicContact CE2-CG1 4.43Å; F350-I362 HydrophobicContact CE2-CG2 3.72Å; F350-I362 HydrophobicContact CG-CG2 4.08Å; F350-I362 HydrophobicContact CZ-CD1 3.67Å; F350-I362 HydrophobicContact CZ-CG2 4.18Å; R356-I362 HydrophobicContact CG-CG2 4.13Å
363	W	97.9	Very high	95.4	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.008	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-72	132.4	-179.9	-70.7	85.1	0	0	0	111.8	K339 D367 L371 L382 F386 V391 R394	K339-W363 WeakPolarHBondContact CD-O 3.43Å; K339-W363 PolarHBondContact O-N 2.97Å; W363-D367 HydrophobicContact CE3-CB 3.62Å; W363-D367 HydrophobicContact CZ3-CB 4.04Å; W363-L371 HydrophobicContact CH2-CD1 4.26Å; W363-L371 HydrophobicContact CH2-CD2 4.35Å; W363-L371 HydrophobicContact CZ3-CD1 4.41Å; W363-L371 HydrophobicContact CZ3-CD2 4.17Å; W363-L382 HydrophobicContact CZ3-CD2 4.33Å; W363-F386 HydrophobicContact CD2-CE1 4.21Å; W363-F386 HydrophobicContact CD2-CE2 4.45Å; W363-F386 HydrophobicContact CD2-CZ 4.18Å; W363-F386 HydrophobicContact CE3-CE2 4.15Å; W363-F386 HydrophobicContact CE3-CZ 4.21Å; W363-F386 HydrophobicContact CG-CE1 4.34Å; W363-F386 AromaticContact CH2-CD2 3.97Å; W363-F386 HydrophobicContact CH2-CD2 3.97Å; W363-F386 HydrophobicContact CH2-CE2 4.32Å; W363-F386 HydrophobicContact CH2-CG 4.29Å; W363-F386 HydrophobicContact CZ2-CB 4.2Å; W363-F386 HydrophobicContact CZ2-CD1 4.32Å; W363-F386 HydrophobicContact CZ2-CD2 4.12Å; W363-F386 AromaticContact CZ2-CG 3.97Å; W363-F386 HydrophobicContact CZ2-CG 3.97Å; W363-F386 HydrophobicContact CZ3-CD2 4.21Å; W363-F386 HydrophobicContact CZ3-CE2 4.09Å; W363-V391 HydrophobicContact CH2-CG2 4.25Å; W363-R394 HydrophobicContact CD2-CB 4.17Å; W363-R394 HydrophobicContact CD2-CG 3.56Å; W363-R394 VanDerWaalsContact CE2-CG 3.46Å; W363-R394 HydrophobicContact CE3-CB 4.46Å; W363-R394 HydrophobicContact CE3-CG 3.66Å; W363-R394 HydrophobicContact CG-CG 4.29Å; W363-R394 HydrophobicContact CH2-CB 3.6Å; W363-R394 HydrophobicContact CH2-CG 3.63Å; W363-R394 HydrophobicContact CZ2-CB 3.21Å; W363-R394 HydrophobicContact CZ2-CG 3.52Å; W363-R394 HydrophobicContact CZ3-CB 4.21Å; W363-R394 HydrophobicContact CZ3-CG 3.7Å
364	S	96.9	Very high	95.2	Very high	48 Å²	48	67.5 Å²	67.5	34%	0.336	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-97.3	170.9	168.5	76.5	0	0	0	0	111.6	Q366 D367 D368	S364-Q366 VanDerWaalsContact C-N 3.25Å; S364-Q366 PolarHBondContact O-N 3.08Å; S364-Q366 PolarHBondContact OG-N 3.33Å; S364-D367 WeakPolarHBondContact CA-OD2 3.32Å; S364-D367 WeakPolarHBondContact CB-OD2 3.35Å; S364-D367 PolarHBondContact N-OD2 2.91Å; S364-D367 PolarHBondContact O-N 3.28Å; S364-D367 PolarHBondContact OG-N 3.04Å; S364-D367 PolarHBondContact OG-OD2 3.33Å; S364-D368 PolarHBondContact O-N 3.44Å; S364-D368 VanDerWaalsContact O-N 3.15Å
365	R	95.8	Very high	95.2	Very high	134 Å²	134	69.1 Å²	69.1	51%	0.506	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-33.6	173.2	-179	61.3	174.7	-162	0.5	111.5	E262 D368 I369	E262-R365 IonicContact OE1-NH2 3.8Å; R365-D368 PolarHBondContact O-N 3.49Å; R365-I369 HydrophobicContact CG-CD1 4.17Å; R365-I369 WeakPolarHBondContact O-CG1 3.41Å; R365-I369 PolarHBondContact O-N 3.15Å
366	Q	95.8	Very high	95.2	Very high	101 Å²	101	68.8 Å²	68.8	47%	0.472	37%	0.366	S	S	.	.	H	α-helix	trans	-65.7	-41.8	176.7	-173.9	58.5	51.2	0	0	111	S364 D368 I369 D370	S364-Q366 VanDerWaalsContact C-N 3.25Å; S364-Q366 PolarHBondContact O-N 3.08Å; S364-Q366 PolarHBondContact OG-N 3.33Å; Q366-D368 VanDerWaalsContact C-N 3.29Å; Q366-D368 PolarHBondContact O-N 3.37Å; Q366-I369 WeakPolarHBondContact O-CB 3.31Å; Q366-I369 PolarHBondContact O-N 3.34Å; Q366-I369 VanDerWaalsContact O-N 3.13Å; Q366-D370 PolarHBondContact NE2-OD1 2.9Å; Q366-D370 WeakPolarHBondContact O-CB 3.48Å; Q366-D370 PolarHBondContact O-N 2.86Å
367	D	97.1	Very high	95.2	Very high	8 Å²	8	74.1 Å²	74.1	4%	0.043	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-38.8	177.2	-57.4	-54.8	0	0	0	111.7	W363 S364 I369 D370 L371 L382 K385 F386	W363-D367 HydrophobicContact CE3-CB 3.62Å; W363-D367 HydrophobicContact CZ3-CB 4.04Å; S364-D367 WeakPolarHBondContact CA-OD2 3.32Å; S364-D367 WeakPolarHBondContact CB-OD2 3.35Å; S364-D367 PolarHBondContact N-OD2 2.91Å; S364-D367 PolarHBondContact O-N 3.28Å; S364-D367 PolarHBondContact OG-N 3.04Å; S364-D367 PolarHBondContact OG-OD2 3.33Å; D367-I369 VanDerWaalsContact C-N 3.34Å; D367-D370 PolarHBondContact O-N 2.91Å; D367-L371 WeakPolarHBondContact O-CB 3.4Å; D367-L371 PolarHBondContact O-N 3.14Å; D367-L382 HydrophobicContact CB-CD2 4.24Å; D367-K385 VanDerWaalsContact CG-NZ 3.25Å; D367-K385 IonicContact OD1-NZ 3.13Å; D367-K385 PolarHBondContact OD1-NZ 3.35Å; D367-K385 IonicContact OD2-NZ 3.57Å; D367-K385 PolarHBondContact OD2-NZ 3.25Å; D367-K385 VanDerWaalsContact OD2-NZ 3.1Å; D367-F386 HydrophobicContact CB-CE2 3.9Å; D367-F386 HydrophobicContact CB-CZ 3.99Å; D367-F386 WeakPolarHBondContact OD2-CZ 3.32Å
368	D	96.6	Very high	95.2	Very high	6 Å²	6	71.7 Å²	71.7	3%	0.032	37%	0.372	C	S	.	.	H	α-helix	trans	-65.4	-35.7	174.8	-71.8	-43.7	0	0	0	112.5	K339 S364 R365 Q366 R394 R398	K339-D368 IonicContact NZ-OD2 2.72Å; S364-D368 PolarHBondContact O-N 3.44Å; S364-D368 VanDerWaalsContact O-N 3.15Å; R365-D368 PolarHBondContact O-N 3.49Å; Q366-D368 VanDerWaalsContact C-N 3.29Å; Q366-D368 PolarHBondContact O-N 3.37Å; D368-R394 VanDerWaalsContact CG-NH2 3.35Å; D368-R394 IonicContact OD1-CZ 3.8Å; D368-R394 VanDerWaalsContact OD1-CZ 3.22Å; D368-R394 IonicContact OD1-NE 3.35Å; D368-R394 PolarHBondContact OD1-NE 2.73Å; D368-R394 IonicContact OD1-NH2 2.97Å; D368-R394 PolarHBondContact OD1-NH2 3.38Å; D368-R394 IonicContact OD2-NH2 3.7Å; D368-R394 PolarHBondContact OD2-NH2 3.02Å; D368-R398 WeakPolarHBondContact OD1-CD 3.34Å; D368-R398 IonicContact OD1-CZ 3Å; D368-R398 IonicContact OD1-NH1 3.64Å; D368-R398 PolarHBondContact OD1-NH1 3.29Å; D368-R398 VanDerWaalsContact OD1-NH1 3.13Å; D368-R398 IonicContact OD2-NH1 3.8Å; D368-R398 PolarHBondContact OD2-NH1 3.33Å
369	I	95.1	Very high	95.2	Very high	76 Å²	76	75.3 Å²	75.3	39%	0.39	38%	0.381	S	S	.	.	H	α-helix	trans	-69.5	-43.3	174.5	-69.3	164.4	0	0	0	110.2	R365 Q366 D367 L371 Q372	R365-I369 HydrophobicContact CG-CD1 4.17Å; R365-I369 WeakPolarHBondContact O-CG1 3.41Å; R365-I369 PolarHBondContact O-N 3.15Å; Q366-I369 WeakPolarHBondContact O-CB 3.31Å; Q366-I369 PolarHBondContact O-N 3.34Å; Q366-I369 VanDerWaalsContact O-N 3.13Å; D367-I369 VanDerWaalsContact C-N 3.34Å; I369-L371 VanDerWaalsContact C-N 3.26Å; I369-L371 PolarHBondContact O-N 3.02Å; I369-Q372 PolarHBondContact O-N 2.94Å
370	D	95.2	Very high	95.3	Very high	29 Å²	29	78 Å²	78	16%	0.155	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-33	179.1	-69.3	-19.1	0	0	0	111.5	Q366 D367 Q372 K373 T378 L382	Q366-D370 PolarHBondContact NE2-OD1 2.9Å; Q366-D370 WeakPolarHBondContact O-CB 3.48Å; Q366-D370 PolarHBondContact O-N 2.86Å; D367-D370 PolarHBondContact O-N 2.91Å; D370-Q372 PolarHBondContact O-N 3.34Å; D370-K373 WeakPolarHBondContact O-CB 3.34Å; D370-K373 PolarHBondContact O-N 3.4Å; D370-K373 WeakPolarHBondContact OD1-CE 3.46Å; D370-K373 IonicContact OD1-NZ 2.67Å; D370-K373 PolarHBondContact OD1-NZ 3.1Å; D370-T378 HydrophobicContact CB-CG2 3.63Å; D370-T378 WeakPolarHBondContact O-CG2 3.45Å; D370-L382 HydrophobicContact CB-CD1 4.16Å; D370-L382 HydrophobicContact CB-CD2 4.43Å
371	L	94.1	Very high	95.3	Very high	27 Å²	27	76.4 Å²	76.4	14%	0.141	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-23	177.1	-167.1	67.1	0	0	0	113.6	W363 D367 I369 L382 V391 R394 I395	W363-L371 HydrophobicContact CH2-CD1 4.26Å; W363-L371 HydrophobicContact CH2-CD2 4.35Å; W363-L371 HydrophobicContact CZ3-CD1 4.41Å; W363-L371 HydrophobicContact CZ3-CD2 4.17Å; D367-L371 WeakPolarHBondContact O-CB 3.4Å; D367-L371 PolarHBondContact O-N 3.14Å; I369-L371 VanDerWaalsContact C-N 3.26Å; I369-L371 PolarHBondContact O-N 3.02Å; L371-L382 HydrophobicContact CB-CD1 4.13Å; L371-L382 HydrophobicContact CD1-CD1 3.9Å; L371-V391 HydrophobicContact CD1-CG1 3.87Å; L371-R394 HydrophobicContact CD2-CB 4.02Å; L371-R394 HydrophobicContact CD2-CG 3.51Å; L371-I395 HydrophobicContact CD1-CD1 4.22Å; L371-I395 HydrophobicContact CD1-CG1 3.8Å; L371-I395 HydrophobicContact CD2-CG1 3.95Å; L371-I395 HydrophobicContact CG-CG1 4Å
372	Q	92.7	Very high	95.3	Very high	138 Å²	138	74.2 Å²	74.2	65%	0.645	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.4	178.9	-63.2	-63.4	-32.7	0	0	113.1	I369 D370	I369-Q372 PolarHBondContact O-N 2.94Å; D370-Q372 PolarHBondContact O-N 3.34Å
373	K	93.1	Very high	95.3	Very high	99 Å²	99	74.3 Å²	74.3	43%	0.43	37%	0.371	S	S	.	.			trans	-77.9	127.9	177.7	-64.5	175.8	-179.2	165.5	0	109.2	D370 D375 T378	D370-K373 WeakPolarHBondContact O-CB 3.34Å; D370-K373 PolarHBondContact O-N 3.4Å; D370-K373 WeakPolarHBondContact OD1-CE 3.46Å; D370-K373 IonicContact OD1-NZ 2.67Å; D370-K373 PolarHBondContact OD1-NZ 3.1Å; K373-D375 HydrophobicContact CB-CB 4.24Å; K373-D375 PolarHBondContact O-N 2.83Å; K373-T378 HydrophobicContact CB-CG2 4.47Å; K373-T378 HydrophobicContact CD-CG2 4.19Å
374	D	91.1	Very high	95.3	Very high	179 Å²	179	83.1 Å²	83.1	96%	0.957	41%	0.409	S	S	*	.			trans	-78.3	61.3	168.7	-167.4	29	0	0	0	110
375	D	93.7	Very high	95.3	Very high	69 Å²	69	85.1 Å²	85.1	37%	0.369	41%	0.412	S	S	.	.			trans	-132.2	122.3	-177.1	176.7	63.3	0	0	0	110.3	K373 T378 R379	K373-D375 HydrophobicContact CB-CB 4.24Å; K373-D375 PolarHBondContact O-N 2.83Å; D375-T378 PolarHBondContact O-N 3.48Å; D375-T378 WeakPolarHBondContact OD2-CB 3.21Å; D375-T378 PolarHBondContact OD2-N 3.45Å; D375-T378 PolarHBondContact OD2-OG1 2.87Å; D375-R379 PolarHBondContact O-N 3.13Å
376	E	93.9	Very high	95.4	Very high	118 Å²	118	78.8 Å²	78.8	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-68.5	-39.5	-174	-174.2	155	-132.7	0	0	112	T378 R379 E380	E376-T378 VanDerWaalsContact C-N 3.35Å; E376-T378 PolarHBondContact O-N 2.86Å; E376-R379 PolarHBondContact O-N 2.75Å; E376-R379 IonicContact OE1-NH2 3.71Å; E376-R379 PolarHBondContact OE1-NH2 3.2Å; E376-E380 WeakPolarHBondContact O-CG 3.2Å; E376-E380 PolarHBondContact O-N 2.97Å
377	D	95.5	Very high	95.4	Very high	121 Å²	121	74.3 Å²	74.3	65%	0.647	37%	0.369	S	S	*	.	H	α-helix	trans	-62	-42.9	177	-73	-38.9	0	0	0	111.3	E380 A381	D377-E380 PolarHBondContact O-N 3.23Å; D377-A381 WeakPolarHBondContact O-CB 3.36Å; D377-A381 PolarHBondContact O-N 2.88Å
378	T	95.5	Very high	95.4	Very high	26 Å²	26	77 Å²	77	16%	0.16	39%	0.392	C	S	.	.	H	α-helix	trans	-63.2	-43.9	175.2	-61.9	0	0	0	0	111.2	D370 K373 D375 E376 A381 L382	D370-T378 HydrophobicContact CB-CG2 3.63Å; D370-T378 WeakPolarHBondContact O-CG2 3.45Å; K373-T378 HydrophobicContact CB-CG2 4.47Å; K373-T378 HydrophobicContact CD-CG2 4.19Å; D375-T378 PolarHBondContact O-N 3.48Å; D375-T378 WeakPolarHBondContact OD2-CB 3.21Å; D375-T378 PolarHBondContact OD2-N 3.45Å; D375-T378 PolarHBondContact OD2-OG1 2.87Å; E376-T378 VanDerWaalsContact C-N 3.35Å; E376-T378 PolarHBondContact O-N 2.86Å; T378-A381 PolarHBondContact O-N 2.76Å; T378-L382 HydrophobicContact CG2-CD1 4.38Å; T378-L382 WeakPolarHBondContact O-CG 3.26Å; T378-L382 PolarHBondContact O-N 3.43Å
379	R	94.1	Very high	95.4	Very high	141 Å²	141	83.9 Å²	83.9	53%	0.532	42%	0.424	S	S	.	.	H	α-helix	trans	-63.1	-44.1	177.4	-174	-179.1	64.7	156.8	-2.8	111.6	D375 E376 A381 L382 V383	D375-R379 PolarHBondContact O-N 3.13Å; E376-R379 PolarHBondContact O-N 2.75Å; E376-R379 IonicContact OE1-NH2 3.71Å; E376-R379 PolarHBondContact OE1-NH2 3.2Å; R379-A381 VanDerWaalsContact C-N 3.34Å; R379-A381 PolarHBondContact O-N 2.72Å; R379-L382 PolarHBondContact O-N 3.32Å; R379-V383 WeakPolarHBondContact O-CG2 3.3Å; R379-V383 PolarHBondContact O-N 2.87Å
380	E	96	Very high	95.5	Very high	118 Å²	118	80.4 Å²	80.4	55%	0.551	41%	0.406	S	S	*	.	H	α-helix	trans	-62.5	-40.1	175.3	-73.8	-166.9	173.8	0	0	112	E376 D377 L382 V383 K384	E376-E380 WeakPolarHBondContact O-CG 3.2Å; E376-E380 PolarHBondContact O-N 2.97Å; D377-E380 PolarHBondContact O-N 3.23Å; E380-L382 VanDerWaalsContact C-N 3.35Å; E380-L382 PolarHBondContact O-N 2.86Å; E380-V383 PolarHBondContact O-N 2.78Å; E380-K384 WeakPolarHBondContact O-CB 3.36Å; E380-K384 PolarHBondContact O-N 3.35Å
381	A	97	Very high	95.5	Very high	58 Å²	58	79.4 Å²	79.4	48%	0.479	40%	0.401	S	S	.	.	H	α-helix	trans	-62.3	-40.9	175	0	0	0	0	0	112.2	D377 T378 R379 K384 K385	D377-A381 WeakPolarHBondContact O-CB 3.36Å; D377-A381 PolarHBondContact O-N 2.88Å; T378-A381 PolarHBondContact O-N 2.76Å; R379-A381 VanDerWaalsContact C-N 3.34Å; R379-A381 PolarHBondContact O-N 2.72Å; A381-K384 PolarHBondContact O-N 2.9Å; A381-K385 WeakPolarHBondContact O-CB 3.09Å; A381-K385 PolarHBondContact O-N 3.28Å
382	L	97	Very high	95.6	Very high	6 Å²	6	80.8 Å²	80.8	3%	0.031	42%	0.417	C	S	.	.	H	α-helix	trans	-66.5	-43.8	174.9	-73.2	172.4	0	0	0	111.9	W363 D367 D370 L371 T378 R379 E380 K384 K385 F386 V391	W363-L382 HydrophobicContact CZ3-CD2 4.33Å; D367-L382 HydrophobicContact CB-CD2 4.24Å; D370-L382 HydrophobicContact CB-CD1 4.16Å; D370-L382 HydrophobicContact CB-CD2 4.43Å; L371-L382 HydrophobicContact CB-CD1 4.13Å; L371-L382 HydrophobicContact CD1-CD1 3.9Å; T378-L382 HydrophobicContact CG2-CD1 4.38Å; T378-L382 WeakPolarHBondContact O-CG 3.26Å; T378-L382 PolarHBondContact O-N 3.43Å; R379-L382 PolarHBondContact O-N 3.32Å; E380-L382 VanDerWaalsContact C-N 3.35Å; E380-L382 PolarHBondContact O-N 2.86Å; L382-K384 VanDerWaalsContact C-N 3.28Å; L382-K384 PolarHBondContact O-N 3.42Å; L382-K385 PolarHBondContact O-N 3.43Å; L382-K385 VanDerWaalsContact O-N 3.1Å; L382-F386 HydrophobicContact CD2-CD2 4.05Å; L382-F386 HydrophobicContact CD2-CE2 3.86Å; L382-F386 PolarHBondContact O-N 2.93Å; L382-V391 HydrophobicContact CB-CG2 4.22Å
383	V	97.1	Very high	95.8	Very high	57 Å²	57	78 Å²	78	35%	0.345	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-38	175.5	171.2	0	0	0	0	110.9	R379 E380 K385 G387 A388 V391	R379-V383 WeakPolarHBondContact O-CG2 3.3Å; R379-V383 PolarHBondContact O-N 2.87Å; E380-V383 PolarHBondContact O-N 2.78Å; V383-K385 VanDerWaalsContact C-N 3.35Å; V383-G387 WeakPolarHBondContact O-CA 3.45Å; V383-G387 PolarHBondContact O-N 3.34Å; V383-A388 HydrophobicContact CG1-CB 4.11Å; V383-V391 HydrophobicContact CG2-CB 4.44Å; V383-V391 HydrophobicContact CG2-CG1 4.48Å; V383-V391 HydrophobicContact CG2-CG2 4.09Å
384	K	97	Very high	95.9	Very high	187 Å²	187	73.5 Å²	73.5	81%	0.813	38%	0.38	S	S	*	.	H	α-helix	trans	-66.5	-35.9	173.9	-175.8	178	179.9	179	0	112.6	E380 A381 L382	E380-K384 WeakPolarHBondContact O-CB 3.36Å; E380-K384 PolarHBondContact O-N 3.35Å; A381-K384 PolarHBondContact O-N 2.9Å; L382-K384 VanDerWaalsContact C-N 3.28Å; L382-K384 PolarHBondContact O-N 3.42Å
385	K	97.5	Very high	96.1	Very high	90 Å²	90	68.9 Å²	68.9	39%	0.391	36%	0.355	S	S	.	.	H	α-helix	trans	-79.6	-38.2	-177.3	-178.2	174.5	171.5	-173.3	0	113.4	Y360 P361 D367 A381 L382 V383	Y360-K385 VanDerWaalsContact CD1-O 3.29Å; Y360-K385 WeakPolarHBondContact CD1-O 3.49Å; P361-K385 VanDerWaalsContact CD-O 3.28Å; P361-K385 WeakPolarHBondContact CD-O 3.32Å; P361-K385 HydrophobicContact CG-CG 3.95Å; D367-K385 VanDerWaalsContact CG-NZ 3.25Å; D367-K385 IonicContact OD1-NZ 3.13Å; D367-K385 PolarHBondContact OD1-NZ 3.35Å; D367-K385 IonicContact OD2-NZ 3.57Å; D367-K385 PolarHBondContact OD2-NZ 3.25Å; D367-K385 VanDerWaalsContact OD2-NZ 3.1Å; A381-K385 WeakPolarHBondContact O-CB 3.09Å; A381-K385 PolarHBondContact O-N 3.28Å; L382-K385 PolarHBondContact O-N 3.43Å; L382-K385 VanDerWaalsContact O-N 3.1Å; V383-K385 VanDerWaalsContact C-N 3.35Å
386	F	97.7	Very high	96.1	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-116.7	-16	-172.3	-65.4	-77.1	0	0	0	113.6	Y360 P361 W363 D367 L382 N390 V391	Y360-F386 VanDerWaalsContact CD1-O 3.3Å; Y360-F386 WeakPolarHBondContact CD1-O 3.05Å; Y360-F386 WeakPolarHBondContact CD2-O 3.28Å; Y360-F386 WeakPolarHBondContact CE1-O 2.86Å; Y360-F386 WeakPolarHBondContact CE2-O 3.39Å; P361-F386 HydrophobicContact CB-CE1 4.32Å; P361-F386 HydrophobicContact CG-CD1 4.01Å; P361-F386 HydrophobicContact CG-CE1 3.7Å; P361-F386 HydrophobicContact CG-CZ 4.31Å; P361-F386 WeakPolarHBondContact O-CD1 3.21Å; P361-F386 VanDerWaalsContact O-CE1 3.31Å; P361-F386 WeakPolarHBondContact O-CE1 3.4Å; W363-F386 HydrophobicContact CD2-CE1 4.21Å; W363-F386 HydrophobicContact CD2-CE2 4.45Å; W363-F386 HydrophobicContact CD2-CZ 4.18Å; W363-F386 HydrophobicContact CE3-CE2 4.15Å; W363-F386 HydrophobicContact CE3-CZ 4.21Å; W363-F386 HydrophobicContact CG-CE1 4.34Å; W363-F386 AromaticContact CH2-CD2 3.97Å; W363-F386 HydrophobicContact CH2-CD2 3.97Å; W363-F386 HydrophobicContact CH2-CE2 4.32Å; W363-F386 HydrophobicContact CH2-CG 4.29Å; W363-F386 HydrophobicContact CZ2-CB 4.2Å; W363-F386 HydrophobicContact CZ2-CD1 4.32Å; W363-F386 HydrophobicContact CZ2-CD2 4.12Å; W363-F386 AromaticContact CZ2-CG 3.97Å; W363-F386 HydrophobicContact CZ2-CG 3.97Å; W363-F386 HydrophobicContact CZ3-CD2 4.21Å; W363-F386 HydrophobicContact CZ3-CE2 4.09Å; D367-F386 HydrophobicContact CB-CE2 3.9Å; D367-F386 HydrophobicContact CB-CZ 3.99Å; D367-F386 WeakPolarHBondContact OD2-CZ 3.32Å; L382-F386 HydrophobicContact CD2-CD2 4.05Å; L382-F386 HydrophobicContact CD2-CE2 3.86Å; L382-F386 PolarHBondContact O-N 2.93Å; F386-N390 HydrophobicContact CB-CB 4.02Å; F386-N390 WeakPolarHBondContact O-CB 3.32Å; F386-N390 PolarHBondContact O-ND2 2.71Å; F386-V391 HydrophobicContact CB-CG2 4.18Å
387	G	96.6	Very high	96.2	Very high	8 Å²	8	65.4 Å²	65.4	8%	0.082	34%	0.336	C	S	.	.			trans	81.8	147.8	-170.3	0	0	0	0	0	112.3	V383 Q389 N390 V391	V383-G387 WeakPolarHBondContact O-CA 3.45Å; V383-G387 PolarHBondContact O-N 3.34Å; G387-Q389 VanDerWaalsContact C-N 3.29Å; G387-Q389 PolarHBondContact O-N 3.44Å; G387-N390 PolarHBondContact O-N 2.82Å; G387-V391 WeakPolarHBondContact O-CG2 3.48Å; G387-V391 PolarHBondContact O-N 3.48Å; G387-V391 VanDerWaalsContact O-N 3.13Å
388	A	96.5	Very high	96	Very high	65 Å²	65	63.4 Å²	63.4	54%	0.537	32%	0.32	S	S	.	.	H	α-helix	trans	-57.8	-38.5	-173.5	0	0	0	0	0	113.5	V383 V391 A392	V383-A388 HydrophobicContact CG1-CB 4.11Å; A388-V391 PolarHBondContact O-N 2.63Å; A388-A392 PolarHBondContact O-N 3.43Å
389	Q	96.5	Very high	95.5	Very high	150 Å²	150	69.3 Å²	69.3	70%	0.701	34%	0.343	S	S	*	.	H	α-helix	trans	-66.2	-42.1	179.7	-67.4	-178.7	-0.8	0	0	112.7	G387 A392 R393	G387-Q389 VanDerWaalsContact C-N 3.29Å; G387-Q389 PolarHBondContact O-N 3.44Å; Q389-A392 PolarHBondContact O-N 3.15Å; Q389-R393 WeakPolarHBondContact O-CB 3.44Å; Q389-R393 WeakPolarHBondContact O-CG 3.49Å; Q389-R393 PolarHBondContact O-N 3.47Å; Q389-R393 PolarHBondContact O-NE 2.89Å
390	N	97	Very high	93.9	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.011	35%	0.348	C	S	.	.	H	α-helix	trans	-68.5	-37.5	178.7	-74.8	-32.9	0	0	0	111.2	R356 D358 Y360 F386 G387 R393 R394	R356-N390 PolarHBondContact NH2-OD1 2.88Å; D358-N390 PolarHBondContact OD2-ND2 2.85Å; D358-N390 PolarHBondContact OD2-OD1 3.27Å; Y360-N390 WeakPolarHBondContact CD2-ND2 3.28Å; F386-N390 HydrophobicContact CB-CB 4.02Å; F386-N390 WeakPolarHBondContact O-CB 3.32Å; F386-N390 PolarHBondContact O-ND2 2.71Å; G387-N390 PolarHBondContact O-N 2.82Å; N390-R393 PolarHBondContact O-N 2.74Å; N390-R393 PolarHBondContact OD1-NH1 2.62Å; N390-R393 PolarHBondContact OD1-NH2 3.02Å; N390-R394 WeakPolarHBondContact O-CB 3.02Å; N390-R394 PolarHBondContact O-N 3.4Å
391	V	96.6	Very high	93.8	Very high	9 Å²	9	67.2 Å²	67.2	6%	0.055	34%	0.338	C	S	.	.	H	α-helix	trans	-61.8	-49.5	174.3	175.2	0	0	0	0	110.5	W363 L371 L382 V383 F386 G387 A388 R393 R394 I395	W363-V391 HydrophobicContact CH2-CG2 4.25Å; L371-V391 HydrophobicContact CD1-CG1 3.87Å; L382-V391 HydrophobicContact CB-CG2 4.22Å; V383-V391 HydrophobicContact CG2-CB 4.44Å; V383-V391 HydrophobicContact CG2-CG1 4.48Å; V383-V391 HydrophobicContact CG2-CG2 4.09Å; F386-V391 HydrophobicContact CB-CG2 4.18Å; G387-V391 WeakPolarHBondContact O-CG2 3.48Å; G387-V391 PolarHBondContact O-N 3.48Å; G387-V391 VanDerWaalsContact O-N 3.13Å; A388-V391 PolarHBondContact O-N 2.63Å; V391-R393 PolarHBondContact O-N 3.08Å; V391-R394 PolarHBondContact O-N 3.14Å; V391-R394 VanDerWaalsContact O-N 3.14Å; V391-I395 HydrophobicContact CG1-CD1 4.12Å; V391-I395 WeakPolarHBondContact O-CG1 3.26Å; V391-I395 PolarHBondContact O-N 3.02Å
392	A	95.7	Very high	93.6	Very high	56 Å²	56	67.6 Å²	67.6	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-58.8	-46.9	177	0	0	0	0	0	112.1	A388 Q389 R394 I395 E396	A388-A392 PolarHBondContact O-N 3.43Å; Q389-A392 PolarHBondContact O-N 3.15Å; A392-R394 VanDerWaalsContact C-N 3.27Å; A392-R394 PolarHBondContact O-N 2.92Å; A392-I395 PolarHBondContact O-N 3.43Å; A392-E396 PolarHBondContact O-N 3.36Å; A392-E396 VanDerWaalsContact O-N 3.1Å
393	R	95.7	Very high	93.4	Very high	79 Å²	79	71.1 Å²	71.1	30%	0.298	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-36	175.9	-79.4	-176.8	-89.5	132.1	-15	112.7	E343 Q389 N390 V391 F397	E343-R393 IonicContact OE1-CZ 2.73Å; E343-R393 IonicContact OE1-NH1 3.58Å; E343-R393 PolarHBondContact OE1-NH1 3.26Å; E343-R393 IonicContact OE2-CZ 2.62Å; E343-R393 IonicContact OE2-NH1 3.02Å; E343-R393 PolarHBondContact OE2-NH1 3.34Å; Q389-R393 WeakPolarHBondContact O-CB 3.44Å; Q389-R393 WeakPolarHBondContact O-CG 3.49Å; Q389-R393 PolarHBondContact O-N 3.47Å; Q389-R393 PolarHBondContact O-NE 2.89Å; N390-R393 PolarHBondContact O-N 2.74Å; N390-R393 PolarHBondContact OD1-NH1 2.62Å; N390-R393 PolarHBondContact OD1-NH2 3.02Å; V391-R393 PolarHBondContact O-N 3.08Å; R393-F397 WeakPolarHBondContact O-CB 3.5Å; R393-F397 PolarHBondContact O-N 2.93Å
394	R	97.2	Very high	93.2	Very high	4 Å²	4	71.9 Å²	71.9	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-70.2	-40.9	177.6	-171.5	68.5	172.8	173.4	0.7	112.6	L338 S341 W363 D368 L371 N390 V391 A392 E396 F397 R398	L338-R394 PolarHBondContact O-NH1 3.31Å; L338-R394 PolarHBondContact O-NH2 3.46Å; L338-R394 VanDerWaalsContact O-NH2 3.16Å; S341-R394 WeakPolarHBondContact OG-CD 3.16Å; S341-R394 PolarHBondContact OG-NH1 2.97Å; W363-R394 HydrophobicContact CD2-CB 4.17Å; W363-R394 HydrophobicContact CD2-CG 3.56Å; W363-R394 VanDerWaalsContact CE2-CG 3.46Å; W363-R394 HydrophobicContact CE3-CB 4.46Å; W363-R394 HydrophobicContact CE3-CG 3.66Å; W363-R394 HydrophobicContact CG-CG 4.29Å; W363-R394 HydrophobicContact CH2-CB 3.6Å; W363-R394 HydrophobicContact CH2-CG 3.63Å; W363-R394 HydrophobicContact CZ2-CB 3.21Å; W363-R394 HydrophobicContact CZ2-CG 3.52Å; W363-R394 HydrophobicContact CZ3-CB 4.21Å; W363-R394 HydrophobicContact CZ3-CG 3.7Å; D368-R394 VanDerWaalsContact CG-NH2 3.35Å; D368-R394 IonicContact OD1-CZ 3.8Å; D368-R394 VanDerWaalsContact OD1-CZ 3.22Å; D368-R394 IonicContact OD1-NE 3.35Å; D368-R394 PolarHBondContact OD1-NE 2.73Å; D368-R394 IonicContact OD1-NH2 2.97Å; D368-R394 PolarHBondContact OD1-NH2 3.38Å; D368-R394 IonicContact OD2-NH2 3.7Å; D368-R394 PolarHBondContact OD2-NH2 3.02Å; L371-R394 HydrophobicContact CD2-CB 4.02Å; L371-R394 HydrophobicContact CD2-CG 3.51Å; N390-R394 WeakPolarHBondContact O-CB 3.02Å; N390-R394 PolarHBondContact O-N 3.4Å; V391-R394 PolarHBondContact O-N 3.14Å; V391-R394 VanDerWaalsContact O-N 3.14Å; A392-R394 VanDerWaalsContact C-N 3.27Å; A392-R394 PolarHBondContact O-N 2.92Å; R394-E396 VanDerWaalsContact C-N 3.33Å; R394-F397 PolarHBondContact O-N 3.4Å; R394-R398 WeakPolarHBondContact O-CG 3.45Å; R394-R398 PolarHBondContact O-N 3.24Å
395	I	94.8	Very high	93	Very high	82 Å²	82	64.7 Å²	64.7	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-50.7	175.3	-67	168.3	0	0	0	109	L371 V391 A392 F397 R398 K399	L371-I395 HydrophobicContact CD1-CD1 4.22Å; L371-I395 HydrophobicContact CD1-CG1 3.8Å; L371-I395 HydrophobicContact CD2-CG1 3.95Å; L371-I395 HydrophobicContact CG-CG1 4Å; V391-I395 HydrophobicContact CG1-CD1 4.12Å; V391-I395 WeakPolarHBondContact O-CG1 3.26Å; V391-I395 PolarHBondContact O-N 3.02Å; A392-I395 PolarHBondContact O-N 3.43Å; I395-F397 VanDerWaalsContact C-N 3.31Å; I395-F397 PolarHBondContact O-N 2.64Å; I395-R398 PolarHBondContact O-N 3.17Å; I395-R398 VanDerWaalsContact O-N 3.1Å; I395-K399 PolarHBondContact O-N 3.48Å; I395-K399 VanDerWaalsContact O-N 3.17Å
396	E	94	Very high	92.7	Very high	103 Å²	103	63 Å²	63	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-39.4	176.6	-72.6	-61	139.5	0	0	112.7	A392 R394 R398 K399	A392-E396 PolarHBondContact O-N 3.36Å; A392-E396 VanDerWaalsContact O-N 3.1Å; R394-E396 VanDerWaalsContact C-N 3.33Å; E396-R398 VanDerWaalsContact C-N 3.26Å; E396-R398 PolarHBondContact O-N 2.84Å; E396-K399 PolarHBondContact O-N 3.48Å
397	F	95	Very high	92.3	Very high	11 Å²	11	67.5 Å²	67.5	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-26.5	177.3	-177.1	-106	0	0	0	113.6	K251 L254 V255 L338 S341 R393 R394 I395	K251-F397 HydrophobicContact CD-CD2 4.3Å; K251-F397 HydrophobicContact CG-CD2 3.51Å; K251-F397 HydrophobicContact CG-CE2 3.84Å; L254-F397 HydrophobicContact CB-CZ 4.37Å; L254-F397 HydrophobicContact CD2-CZ 3.94Å; L254-F397 HydrophobicContact CG-CZ 4.26Å; V255-F397 HydrophobicContact CG2-CD2 4.11Å; V255-F397 HydrophobicContact CG2-CE2 3.77Å; V255-F397 HydrophobicContact CG2-CZ 4.12Å; V255-F397 WeakPolarHBondContact CG2-O 2.87Å; L338-F397 HydrophobicContact CD2-CE1 4.38Å; L338-F397 HydrophobicContact CD2-CZ 4.29Å; S341-F397 WeakPolarHBondContact O-CD2 3.45Å; R393-F397 WeakPolarHBondContact O-CB 3.5Å; R393-F397 PolarHBondContact O-N 2.93Å; R394-F397 PolarHBondContact O-N 3.4Å; I395-F397 VanDerWaalsContact C-N 3.31Å; I395-F397 PolarHBondContact O-N 2.64Å
398	R	92.5	Very high	92	Very high	80 Å²	80	72.1 Å²	72.1	30%	0.302	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	1.3	-178.6	-66	-164	72.1	89.9	14	114.2	D368 R394 I395 E396 K400	D368-R398 WeakPolarHBondContact OD1-CD 3.34Å; D368-R398 IonicContact OD1-CZ 3Å; D368-R398 IonicContact OD1-NH1 3.64Å; D368-R398 PolarHBondContact OD1-NH1 3.29Å; D368-R398 VanDerWaalsContact OD1-NH1 3.13Å; D368-R398 IonicContact OD2-NH1 3.8Å; D368-R398 PolarHBondContact OD2-NH1 3.33Å; R394-R398 WeakPolarHBondContact O-CG 3.45Å; R394-R398 PolarHBondContact O-N 3.24Å; I395-R398 PolarHBondContact O-N 3.17Å; I395-R398 VanDerWaalsContact O-N 3.1Å; E396-R398 VanDerWaalsContact C-N 3.26Å; E396-R398 PolarHBondContact O-N 2.84Å; R398-K400 VanDerWaalsContact C-N 3.27Å; R398-K400 PolarHBondContact O-N 2.92Å
399	K	84.2	Confident	91.6	Very high	150 Å²	150	72.7 Å²	72.7	65%	0.652	34%	0.34	S	S	*	.			trans	-82	-1.1	-171.9	-155.7	-178.8	175.4	-174	0	113.8	I395 E396	I395-K399 PolarHBondContact O-N 3.48Å; I395-K399 VanDerWaalsContact O-N 3.17Å; E396-K399 PolarHBondContact O-N 3.48Å
400	K	59.9	Low	91.2	Very high	146 Å²	146	65.6 Å²	65.6	64%	0.635	31%	0.307	S	S	*	.			trans	-127.1	0	178.3	-59.4	-176.1	-178.1	-167.7	0	108.4	V255 E305 R398	V255-K400 HydrophobicContact CG1-CB 3.79Å; V255-K400 VanDerWaalsContact CG1-OXT 3.23Å; V255-K400 WeakPolarHBondContact CG1-OXT 3.25Å; E305-K400 IonicContact OE1-NZ 2.79Å; E305-K400 PolarHBondContact OE1-NZ 3.36Å; E305-K400 IonicContact OE2-NZ 2.85Å; E305-K400 PolarHBondContact OE2-NZ 3.26Å; R398-K400 VanDerWaalsContact C-N 3.27Å; R398-K400 PolarHBondContact O-N 2.92Å

Retrieved 400 of 400 residues in 64.7 ms (Link to these results)

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