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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). In contrast to other components of the shelterin complex, it is dispensible for telomere capping and does not participate in the protection of telomeres against non-homologous end-joining (NHEJ)-mediated repair. Instead, it is required to negatively regulate telomere recombination and is essential for repressing homology-directed repair (HDR), which can affect telomere length. 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. When cytoplasmic, associates with the I-kappa-B-kinase (IKK) complex and acts as a regulator of the NF-kappa-B signaling by promoting IKK-mediated phosphorylation of RELA/p65, leading to activate expression of NF-kappa-B target genes (By similarity).

AlphaFold DB , UniProt , Accession Q4R4I0, Species MACFA (Macaca fascicularis, Crab-eating macaque), 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 1959.7 ms (Link to these results)

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