X2JDV1_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JDV1, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG3726, Length 682 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	62.2	Low	86.1	Confident	238 Å²	238	159.5 Å²	159.5	100%	1.172	76%	0.762	S	S	*	*				0	137.6	0	-61	-54.2	-167.7	0	0	108.4
2	L	80.9	Confident	86.6	Confident	123 Å²	123	154.7 Å²	154.7	64%	0.644	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-76.6	150.3	162	-78.1	147.3	0	0	0	108.9	Q4 I682	L2-Q4 PolarHBondContact O-N 3.08Å; L2-I682 HydrophobicContact CD1-CG2 3.63Å; L2-I682 HydrophobicContact CD2-CD1 4.11Å; L2-I682 HydrophobicContact CD2-CG2 4.32Å
3	P	85	Confident	87.1	Confident	107 Å²	107	150.8 Å²	150.8	70%	0.695	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-66.9	129.2	178.9	27.2	-33.6	0	0	0	110.7	Q5	P3-Q5 PolarHBondContact O-N 3.22Å
4	Q	86.8	Confident	87.2	Confident	145 Å²	145	148.6 Å²	148.6	68%	0.678	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-66.1	116.4	178	-178.6	61.2	61.8	0	0	110.2	L2 Y6	L2-Q4 PolarHBondContact O-N 3.08Å; Q4-Y6 HydrophobicContact CB-CE2 4.12Å; Q4-Y6 HydrophobicContact CG-CD2 4.38Å; Q4-Y6 HydrophobicContact CG-CE1 4.13Å; Q4-Y6 HydrophobicContact CG-CE2 3.68Å; Q4-Y6 WeakPolarHBondContact O-CD2 3.41Å; Q4-Y6 WeakPolarHBondContact O-CE2 3.46Å
5	Q	88.5	Confident	87.6	Confident	166 Å²	166	141.9 Å²	141.9	78%	0.776	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-87	150.3	173	-64.7	-173.6	-4.9	0	0	111	P3	P3-Q5 PolarHBondContact O-N 3.22Å
6	Y	90	Very high	87.9	Confident	191 Å²	191	136.9 Å²	136.9	75%	0.749	66%	0.656	S	S	*	*			trans	-131.8	132.5	-179.9	-63	-89.7	0	0	0	109.9	Q4	Q4-Y6 HydrophobicContact CB-CE2 4.12Å; Q4-Y6 HydrophobicContact CG-CD2 4.38Å; Q4-Y6 HydrophobicContact CG-CE1 4.13Å; Q4-Y6 HydrophobicContact CG-CE2 3.68Å; Q4-Y6 WeakPolarHBondContact O-CD2 3.41Å; Q4-Y6 WeakPolarHBondContact O-CE2 3.46Å
7	C	90.3	Very high	88.1	Confident	126 Å²	126	133.1 Å²	133.1	85%	0.851	64%	0.639	S	S	*	*			trans	-102.6	126.3	175.9	-178.2	0	0	0	0	110.4
8	L	91.9	Very high	88.3	Confident	165 Å²	165	129.2 Å²	129.2	86%	0.864	62%	0.62	S	S	*	*			trans	-113.5	108.5	-178.1	-59.3	179.6	0	0	0	110.4
9	R	90.8	Very high	88.6	Confident	195 Å²	195	125.6 Å²	125.6	74%	0.736	61%	0.607	S	S	*	*			trans	-101.4	113	178.8	-172.9	163.4	76.6	154	-1	111.7	K11 D249	R9-K11 PolarHBondContact O-N 3Å; R9-D249 IonicContact NH1-OD1 2.59Å; R9-D249 IonicContact NH1-OD2 3.21Å; R9-D249 PolarHBondContact NH1-OD2 2.8Å
10	W	92	Very high	88.8	Confident	142 Å²	142	123.1 Å²	123.1	54%	0.538	60%	0.595	S	S	.	*			trans	-76.8	106.8	170.1	174.2	17.4	0	0	0	110.3	Y12 H13 N16	W10-Y12 PolarHBondContact O-N 3.36Å; W10-H13 HydrophobicContact CB-CB 4.16Å; W10-H13 HydrophobicContact CD2-CB 3.9Å; W10-H13 HydrophobicContact CE3-CB 3.83Å; W10-H13 AromaticContact CE3-CD2 3.57Å; W10-H13 HydrophobicContact CG-CB 4.09Å; W10-H13 AromaticContact CZ3-CD2 3.68Å; W10-H13 PolarHBondContact O-N 3.06Å; W10-H13 VanDerWaalsContact O-N 3.13Å; W10-N16 HydrophobicContact CH2-CB 3.81Å; W10-N16 VanDerWaalsContact CH2-CG 3.47Å; W10-N16 HydrophobicContact CZ2-CB 3.69Å
11	K	88.8	Confident	89	Confident	157 Å²	157	120 Å²	120	68%	0.683	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.4	-31	-176	-175.5	-179.6	175.4	-161.5	0	115.5	R9	R9-K11 PolarHBondContact O-N 3Å
12	Y	92.2	Very high	90.5	Very high	101 Å²	101	109.8 Å²	109.8	40%	0.396	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	16.4	-172.8	-59.5	-74.1	0	0	0	113.5	W10 H14 S15 N16	W10-Y12 PolarHBondContact O-N 3.36Å; Y12-H14 VanDerWaalsContact C-N 3.34Å; Y12-H14 PolarHBondContact O-N 3.3Å; Y12-S15 PolarHBondContact O-N 3.33Å; Y12-N16 VanDerWaalsContact O-CB 3.32Å; Y12-N16 WeakPolarHBondContact O-CB 3.41Å; Y12-N16 PolarHBondContact O-N 3.2Å
13	H	92.6	Very high	91.1	Very high	104 Å²	104	107.9 Å²	107.9	48%	0.481	52%	0.519	S	S	.	.	H	α-helix	trans	-52.7	-47.7	-177.7	177	-122.1	0	0	0	113.2	W10 N16 L17	W10-H13 HydrophobicContact CB-CB 4.16Å; W10-H13 HydrophobicContact CD2-CB 3.9Å; W10-H13 HydrophobicContact CE3-CB 3.83Å; W10-H13 AromaticContact CE3-CD2 3.57Å; W10-H13 HydrophobicContact CG-CB 4.09Å; W10-H13 AromaticContact CZ3-CD2 3.68Å; W10-H13 PolarHBondContact O-N 3.06Å; W10-H13 VanDerWaalsContact O-N 3.13Å; H13-N16 PolarHBondContact O-N 3.4Å; H13-L17 WeakPolarHBondContact O-CB 3.28Å; H13-L17 PolarHBondContact O-N 2.99Å
14	H	89.5	Confident	91.6	Very high	121 Å²	121	105.1 Å²	105.1	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-65.7	-49.8	-178	-178.3	68.1	0	0	0	112.6	Y12 N16 L17 Q18	Y12-H14 VanDerWaalsContact C-N 3.34Å; Y12-H14 PolarHBondContact O-N 3.3Å; H14-N16 VanDerWaalsContact C-N 3.31Å; H14-N16 PolarHBondContact O-N 3.37Å; H14-L17 WeakPolarHBondContact O-CB 3.34Å; H14-L17 PolarHBondContact O-N 3.47Å; H14-L17 VanDerWaalsContact O-N 3.12Å; H14-Q18 WeakPolarHBondContact O-CB 3.29Å; H14-Q18 PolarHBondContact O-N 3.47Å
15	S	92.1	Very high	91.9	Very high	47 Å²	47	100 Å²	100	33%	0.329	47%	0.474	S	S	.	.	H	α-helix	trans	-63.7	-34.7	176.6	170.6	0	0	0	0	112.3	Y12 T19	Y12-S15 PolarHBondContact O-N 3.33Å; S15-T19 WeakPolarHBondContact O-CB 3.4Å; S15-T19 PolarHBondContact O-N 2.89Å; S15-T19 PolarHBondContact O-OG1 3.12Å
16	N	92.3	Very high	92.2	Very high	63 Å²	63	98.2 Å²	98.2	34%	0.337	47%	0.47	S	S	.	.	H	α-helix	trans	-63	-48.4	170.8	-174.8	101	0	0	0	110.8	W10 Y12 H13 H14 T19 M20	W10-N16 HydrophobicContact CH2-CB 3.81Å; W10-N16 VanDerWaalsContact CH2-CG 3.47Å; W10-N16 HydrophobicContact CZ2-CB 3.69Å; Y12-N16 VanDerWaalsContact O-CB 3.32Å; Y12-N16 WeakPolarHBondContact O-CB 3.41Å; Y12-N16 PolarHBondContact O-N 3.2Å; H13-N16 PolarHBondContact O-N 3.4Å; H14-N16 VanDerWaalsContact C-N 3.31Å; H14-N16 PolarHBondContact O-N 3.37Å; N16-T19 WeakPolarHBondContact O-CB 3.21Å; N16-T19 PolarHBondContact O-N 3.33Å; N16-M20 WeakPolarHBondContact ND2-CG 3.39Å; N16-M20 VanDerWaalsContact O-CG 3.25Å; N16-M20 WeakPolarHBondContact O-CG 3.36Å; N16-M20 PolarHBondContact O-N 3.18Å
17	L	92.5	Very high	92.3	Very high	71 Å²	71	97.9 Å²	97.9	37%	0.372	47%	0.468	S	S	.	.	H	α-helix	trans	-60.1	-46.6	179.8	178.4	149.1	0	0	0	112.1	H13 H14 T19 M20 F21	H13-L17 WeakPolarHBondContact O-CB 3.28Å; H13-L17 PolarHBondContact O-N 2.99Å; H14-L17 WeakPolarHBondContact O-CB 3.34Å; H14-L17 PolarHBondContact O-N 3.47Å; H14-L17 VanDerWaalsContact O-N 3.12Å; L17-T19 VanDerWaalsContact C-N 3.35Å; L17-T19 PolarHBondContact O-N 3.41Å; L17-M20 PolarHBondContact O-N 3.2Å; L17-F21 HydrophobicContact CD1-CE2 4.29Å; L17-F21 HydrophobicContact CD2-CD2 3.66Å; L17-F21 HydrophobicContact CD2-CE2 3.76Å; L17-F21 HydrophobicContact CG-CD2 3.86Å; L17-F21 HydrophobicContact CG-CE2 3.77Å; L17-F21 WeakPolarHBondContact O-CD2 3.44Å; L17-F21 PolarHBondContact O-N 3.32Å
18	Q	91.6	Very high	92.4	Very high	64 Å²	64	93.1 Å²	93.1	30%	0.299	44%	0.44	S	S	.	.	H	α-helix	trans	-54.5	-47.3	171.7	-179	-170	4.4	0	0	111.8	H14 S22 K90	H14-Q18 WeakPolarHBondContact O-CB 3.29Å; H14-Q18 PolarHBondContact O-N 3.47Å; Q18-S22 PolarHBondContact O-N 3.38Å; Q18-S22 VanDerWaalsContact O-N 3.12Å; Q18-S22 PolarHBondContact O-OG 3.48Å; Q18-K90 PolarHBondContact NE2-O 2.81Å
19	T	92.9	Very high	92.4	Very high	60 Å²	60	87.7 Å²	87.7	37%	0.368	42%	0.415	S	S	.	.	H	α-helix	trans	-63.3	-43.2	176.8	-53.9	0	0	0	0	112.1	S15 N16 L17 S22 Q23	S15-T19 WeakPolarHBondContact O-CB 3.4Å; S15-T19 PolarHBondContact O-N 2.89Å; S15-T19 PolarHBondContact O-OG1 3.12Å; N16-T19 WeakPolarHBondContact O-CB 3.21Å; N16-T19 PolarHBondContact O-N 3.33Å; L17-T19 VanDerWaalsContact C-N 3.35Å; L17-T19 PolarHBondContact O-N 3.41Å; T19-S22 PolarHBondContact O-N 2.79Å; T19-Q23 WeakPolarHBondContact O-CG 3.47Å; T19-Q23 PolarHBondContact O-N 3.03Å
20	M	93.1	Very high	92.4	Very high	76 Å²	76	86.3 Å²	86.3	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-66.8	-45.6	179.8	-67.6	-63.2	94.9	0	0	111.5	N16 L17 S22 Q23 L24	N16-M20 WeakPolarHBondContact ND2-CG 3.39Å; N16-M20 VanDerWaalsContact O-CG 3.25Å; N16-M20 WeakPolarHBondContact O-CG 3.36Å; N16-M20 PolarHBondContact O-N 3.18Å; L17-M20 PolarHBondContact O-N 3.2Å; M20-S22 VanDerWaalsContact C-N 3.31Å; M20-S22 PolarHBondContact O-N 3.45Å; M20-Q23 VanDerWaalsContact CE-OE1 3.25Å; M20-Q23 CarbonylContact O-C 3.57Å; M20-Q23 PolarHBondContact O-N 3.16Å; M20-Q23 VanDerWaalsContact O-N 3.16Å; M20-L24 WeakPolarHBondContact O-CG 3.35Å; M20-L24 PolarHBondContact O-N 3.14Å
21	F	93.7	Very high	92.5	Very high	59 Å²	59	79.7 Å²	79.7	26%	0.259	39%	0.39	S	S	.	.	H	α-helix	trans	-62	-38.7	177.3	-85.7	-66.1	0	0	0	112.5	L17 L24 L25 V47 V48 Y89	L17-F21 HydrophobicContact CD1-CE2 4.29Å; L17-F21 HydrophobicContact CD2-CD2 3.66Å; L17-F21 HydrophobicContact CD2-CE2 3.76Å; L17-F21 HydrophobicContact CG-CD2 3.86Å; L17-F21 HydrophobicContact CG-CE2 3.77Å; L17-F21 WeakPolarHBondContact O-CD2 3.44Å; L17-F21 PolarHBondContact O-N 3.32Å; F21-L24 HydrophobicContact CD1-CD1 4.38Å; F21-L24 PolarHBondContact O-N 2.91Å; F21-L25 PolarHBondContact O-N 3.4Å; F21-V47 HydrophobicContact CE1-CG1 4.3Å; F21-V48 HydrophobicContact CD1-CG2 3.94Å; F21-V48 HydrophobicContact CE1-CG2 4.2Å; F21-V48 HydrophobicContact CG-CG2 4.34Å; F21-Y89 HydrophobicContact CB-CD1 4.12Å; F21-Y89 HydrophobicContact CB-CE1 4.38Å; F21-Y89 WeakPolarHBondContact O-CD1 3.44Å
22	S	93.5	Very high	92.7	Very high	22 Å²	22	74.9 Å²	74.9	15%	0.154	37%	0.372	C	S	.	.	H	α-helix	trans	-58.6	-49.9	171.7	-57.9	0	0	0	0	111	Q18 T19 M20 L24 L25 D26 Y89	Q18-S22 PolarHBondContact O-N 3.38Å; Q18-S22 VanDerWaalsContact O-N 3.12Å; Q18-S22 PolarHBondContact O-OG 3.48Å; T19-S22 PolarHBondContact O-N 2.79Å; M20-S22 VanDerWaalsContact C-N 3.31Å; M20-S22 PolarHBondContact O-N 3.45Å; S22-L24 VanDerWaalsContact C-N 3.29Å; S22-L24 PolarHBondContact O-N 3.16Å; S22-L25 WeakPolarHBondContact O-CB 3.34Å; S22-L25 PolarHBondContact O-N 2.92Å; S22-L25 VanDerWaalsContact O-N 3.16Å; S22-D26 VanDerWaalsContact O-CG 3.26Å; S22-D26 PolarHBondContact O-N 2.86Å; S22-Y89 PolarHBondContact OG-O 3.29Å
23	Q	93.5	Very high	92.8	Very high	84 Å²	84	70 Å²	70	39%	0.393	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-25.2	178	-71.1	176.7	7.3	0	0	114.5	T19 M20 R27	T19-Q23 WeakPolarHBondContact O-CG 3.47Å; T19-Q23 PolarHBondContact O-N 3.03Å; M20-Q23 VanDerWaalsContact CE-OE1 3.25Å; M20-Q23 CarbonylContact O-C 3.57Å; M20-Q23 PolarHBondContact O-N 3.16Å; M20-Q23 VanDerWaalsContact O-N 3.16Å; Q23-R27 WeakPolarHBondContact O-CB 3.34Å; Q23-R27 WeakPolarHBondContact O-CD 3.48Å; Q23-R27 WeakPolarHBondContact O-CG 3.13Å; Q23-R27 PolarHBondContact O-N 3.21Å
24	L	94.9	Very high	92.9	Very high	49 Å²	49	65.9 Å²	65.9	26%	0.257	34%	0.335	S	S	.	.	H	α-helix	trans	-74	-40.8	172.9	-71.1	177.7	0	0	0	111.3	M20 F21 S22 R27 G28 C29 F30	M20-L24 WeakPolarHBondContact O-CG 3.35Å; M20-L24 PolarHBondContact O-N 3.14Å; F21-L24 HydrophobicContact CD1-CD1 4.38Å; F21-L24 PolarHBondContact O-N 2.91Å; S22-L24 VanDerWaalsContact C-N 3.29Å; S22-L24 PolarHBondContact O-N 3.16Å; L24-R27 CarbonylContact O-C 3.57Å; L24-R27 PolarHBondContact O-N 3.42Å; L24-G28 PolarHBondContact O-N 3.26Å; L24-C29 HydrophobicContact CD2-CB 4.04Å; L24-C29 PolarHBondContact O-N 2.98Å; L24-F30 HydrophobicContact CD1-CD2 4.29Å; L24-F30 HydrophobicContact CD2-CD2 3.93Å; L24-F30 HydrophobicContact CD2-CE2 4.07Å
25	L	94.2	Very high	93.1	Very high	36 Å²	36	60.1 Å²	60.1	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-63.1	-47.9	175	-174.6	71.7	0	0	0	111.2	F21 S22 R27 G28 R43 A44 I85 Y89	F21-L25 PolarHBondContact O-N 3.4Å; S22-L25 WeakPolarHBondContact O-CB 3.34Å; S22-L25 PolarHBondContact O-N 2.92Å; S22-L25 VanDerWaalsContact O-N 3.16Å; L25-R27 PolarHBondContact O-N 3.26Å; L25-G28 PolarHBondContact O-N 2.89Å; L25-R43 VanDerWaalsContact CD1-O 3.3Å; L25-R43 WeakPolarHBondContact CD1-O 3.42Å; L25-A44 HydrophobicContact CD1-CB 4.34Å; L25-I85 HydrophobicContact CD2-CG2 3.75Å; L25-Y89 HydrophobicContact CB-CD1 3.91Å; L25-Y89 HydrophobicContact CB-CE1 3.77Å; L25-Y89 HydrophobicContact CD1-CE1 4.19Å; L25-Y89 HydrophobicContact CD1-CE2 4.44Å; L25-Y89 HydrophobicContact CD2-CD1 3.9Å; L25-Y89 HydrophobicContact CD2-CD2 3.91Å; L25-Y89 HydrophobicContact CD2-CE1 4.06Å; L25-Y89 HydrophobicContact CD2-CE2 4.07Å; L25-Y89 HydrophobicContact CD2-CG 3.83Å; L25-Y89 HydrophobicContact CG-CD1 4.43Å; L25-Y89 HydrophobicContact CG-CE1 4.23Å
26	D	93.2	Very high	93.2	Very high	129 Å²	129	58.7 Å²	58.7	69%	0.69	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.9	176.5	-65.5	-29.2	0	0	0	112.8	S22	S22-D26 VanDerWaalsContact O-CG 3.26Å; S22-D26 PolarHBondContact O-N 2.86Å
27	R	93.1	Very high	93.3	Very high	184 Å²	184	55.8 Å²	55.8	69%	0.694	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	0.9	178.6	-66.5	175.2	179.2	-164.9	-0.2	114.1	Q23 L24 L25 C29	Q23-R27 WeakPolarHBondContact O-CB 3.34Å; Q23-R27 WeakPolarHBondContact O-CD 3.48Å; Q23-R27 WeakPolarHBondContact O-CG 3.13Å; Q23-R27 PolarHBondContact O-N 3.21Å; L24-R27 CarbonylContact O-C 3.57Å; L24-R27 PolarHBondContact O-N 3.42Å; L25-R27 PolarHBondContact O-N 3.26Å; R27-C29 HydrophobicContact CB-CB 4.29Å; R27-C29 PolarHBondContact O-N 3.13Å; R27-C29 PolarHBondContact O-SG 3.47Å
28	G	91.9	Very high	93.2	Very high	27 Å²	27	58.7 Å²	58.7	28%	0.278	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	20.3	-174.1	0	0	0	0	0	115.1	L24 L25 R43	L24-G28 PolarHBondContact O-N 3.26Å; L25-G28 PolarHBondContact O-N 2.89Å; G28-R43 PolarHBondContact O-NH1 3.42Å
29	C	92.5	Very high	93.2	Very high	50 Å²	50	59.7 Å²	59.7	34%	0.338	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	130.7	-172.8	-72.5	0	0	0	0	110.3	L24 R27 C31 H45	L24-C29 HydrophobicContact CD2-CB 4.04Å; L24-C29 PolarHBondContact O-N 2.98Å; R27-C29 HydrophobicContact CB-CB 4.29Å; R27-C29 PolarHBondContact O-N 3.13Å; R27-C29 PolarHBondContact O-SG 3.47Å; C29-C31 PolarHBondContact O-N 3.23Å; C29-H45 PolarHBondContact O-NE2 3.07Å
30	F	90.7	Very high	93.2	Very high	167 Å²	167	61.6 Å²	61.6	73%	0.732	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	14.9	-175.8	-45.6	-76.2	0	0	0	115.9	L24 D32 H45	L24-F30 HydrophobicContact CD1-CD2 4.29Å; L24-F30 HydrophobicContact CD2-CD2 3.93Å; L24-F30 HydrophobicContact CD2-CE2 4.07Å; F30-D32 PolarHBondContact O-N 2.84Å; F30-D32 VanDerWaalsContact O-N 3.15Å; F30-H45 PolarHBondContact O-CD2 3.47Å; F30-H45 VanDerWaalsContact O-CD2 3.29Å
31	C	93.9	Very high	93.2	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.014	34%	0.339	C	S	.	.			trans	-71.5	105.3	172.9	-63.7	0	0	0	0	111.5	C29 R43 A44	C29-C31 PolarHBondContact O-N 3.23Å; C31-R43 HydrophobicContact CB-CB 3.77Å; C31-R43 PolarHBondContact O-NH2 3.4Å; C31-A44 CarbonylContact C-O 3.55Å; C31-A44 WeakPolarHBondContact CA-O 3.34Å; C31-A44 WeakPolarHBondContact CB-O 3.42Å
32	D	92.8	Very high	93.3	Very high	56 Å²	56	61.8 Å²	61.8	30%	0.299	33%	0.332	S	S	.	.			trans	-103.9	13.2	-173.5	62.3	-23.2	0	0	0	113.7	F30 A44 H45 R46 P69	F30-D32 PolarHBondContact O-N 2.84Å; F30-D32 VanDerWaalsContact O-N 3.15Å; D32-A44 PolarHBondContact N-O 3.02Å; D32-A44 VanDerWaalsContact N-O 3.12Å; D32-H45 VanDerWaalsContact OD1-CA 3.25Å; D32-H45 WeakPolarHBondContact OD1-CA 3.38Å; D32-R46 WeakPolarHBondContact O-CD 3.28Å; D32-R46 WeakPolarHBondContact OD1-CG 3.43Å; D32-R46 PolarHBondContact OD1-N 2.85Å; D32-R46 WeakPolarHBondContact OD2-CB 3.45Å; D32-R46 VanDerWaalsContact OD2-CD 3.26Å; D32-R46 WeakPolarHBondContact OD2-CD 3.21Å; D32-R46 WeakPolarHBondContact OD2-CG 3.32Å; D32-P69 WeakPolarHBondContact O-CD 3.08Å
33	V	93.7	Very high	93.4	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.6	171	52.5	0	0	0	0	110.7	L35 R43 A44 R46 L49 L60 P69 I71	V33-L35 HydrophobicContact CG2-CD2 4.24Å; V33-R43 WeakPolarHBondContact O-CA 3.5Å; V33-A44 HydrophobicContact CG1-CB 4.29Å; V33-A44 WeakPolarHBondContact CG1-O 3.49Å; V33-A44 PolarHBondContact N-O 3.11Å; V33-A44 VanDerWaalsContact N-O 3.14Å; V33-A44 PolarHBondContact O-N 3.25Å; V33-R46 HydrophobicContact CB-CG 3.64Å; V33-R46 HydrophobicContact CG1-CB 4.4Å; V33-R46 HydrophobicContact CG1-CG 3.67Å; V33-L49 HydrophobicContact CG1-CD1 3.75Å; V33-L49 HydrophobicContact CG1-CG 4.45Å; V33-L49 HydrophobicContact CG2-CD1 4.35Å; V33-L60 HydrophobicContact CG2-CD2 4.17Å; V33-P69 HydrophobicContact CB-CG 4.25Å; V33-P69 HydrophobicContact CG2-CG 4.17Å; V33-I71 HydrophobicContact CG2-CD1 4.25Å; V33-I71 HydrophobicContact CG2-CG1 4.39Å
34	T	94.6	Very high	93.5	Very high	16 Å²	16	62.6 Å²	62.6	10%	0.098	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.7	173.4	-55.6	0	0	0	0	110.4	L41 I42 P69 I70 I71	T34-L41 HydrophobicContact CG2-CB 3.87Å; T34-L41 HydrophobicContact CG2-CD1 4.42Å; T34-L41 HydrophobicContact CG2-CD2 4.09Å; T34-L41 HydrophobicContact CG2-CG 4.35Å; T34-I42 CarbonylContact C-O 3.58Å; T34-I42 WeakPolarHBondContact CA-O 3.45Å; T34-P69 PolarHBondContact N-O 2.81Å; T34-I70 CarbonylContact O-C 3.6Å; T34-I70 VanDerWaalsContact O-CA 3.31Å; T34-I70 WeakPolarHBondContact O-CA 3.37Å; T34-I71 PolarHBondContact O-N 3.25Å
35	L	95	Very high	93.5	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.9	174.7	-56.1	-177.4	0	0	0	109	V33 L41 I42 L49 F56 I71 M73 V81 I85	V33-L35 HydrophobicContact CG2-CD2 4.24Å; L35-L41 CarbonylContact O-C 3.56Å; L35-L41 WeakPolarHBondContact O-CA 3.38Å; L35-I42 HydrophobicContact CB-CB 4.43Å; L35-I42 PolarHBondContact N-O 3.47Å; L35-I42 PolarHBondContact O-N 3.06Å; L35-L49 HydrophobicContact CD1-CD1 4.25Å; L35-L49 HydrophobicContact CD2-CD1 4.09Å; L35-L49 HydrophobicContact CG-CD1 4.48Å; L35-F56 HydrophobicContact CD1-CZ 4.36Å; L35-F56 HydrophobicContact CD2-CE1 4.1Å; L35-F56 HydrophobicContact CD2-CZ 4.33Å; L35-I71 WeakPolarHBondContact CA-O 3.37Å; L35-I71 HydrophobicContact CD2-CB 3.85Å; L35-I71 HydrophobicContact CD2-CD1 4.03Å; L35-I71 HydrophobicContact CD2-CG1 4.26Å; L35-M73 HydrophobicContact CB-CE 4.06Å; L35-M73 HydrophobicContact CD1-CE 4.1Å; L35-M73 HydrophobicContact CD2-CE 4.47Å; L35-M73 HydrophobicContact CG-CE 4.44Å; L35-V81 HydrophobicContact CD1-CG1 4.23Å; L35-I85 HydrophobicContact CD1-CD1 3.79Å; L35-I85 HydrophobicContact CD1-CG1 4.25Å
36	A	94.5	Very high	93.4	Very high	17 Å²	17	61.5 Å²	61.5	14%	0.14	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.9	-177.3	0	0	0	0	0	110.8	Q40 L41 I70 I71 I72 M73	A36-Q40 WeakPolarHBondContact CA-O 3.49Å; A36-L41 HydrophobicContact CB-CD2 3.48Å; A36-L41 VanDerWaalsContact CB-CD2 3.48Å; A36-I70 HydrophobicContact CB-CG2 4.05Å; A36-I71 PolarHBondContact N-O 2.98Å; A36-I72 HydrophobicContact CB-CG1 4.16Å; A36-M73 PolarHBondContact O-N 3.44Å
37	C	93.4	Very high	93.4	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	129	-169.1	-33.7	0	0	0	0	108.7	G39 Q40 M73 V81	C37-G39 PolarHBondContact O-N 3.18Å; C37-Q40 PolarHBondContact N-O 2.94Å; C37-Q40 PolarHBondContact O-N 3.22Å; C37-M73 VanDerWaalsContact SG-CE 3.55Å; C37-V81 HydrophobicContact CB-CG2 4.24Å
38	E	91.4	Very high	93.5	Very high	132 Å²	132	51.7 Å²	51.7	62%	0.617	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	32.4	-179.8	-59.9	-170.8	123.9	0	0	115.2	Q40 T77 F78	E38-Q40 VanDerWaalsContact C-N 3.26Å; E38-Q40 PolarHBondContact O-N 3.02Å; E38-T77 VanDerWaalsContact OE2-CA 3.32Å; E38-T77 WeakPolarHBondContact OE2-CA 3.18Å; E38-F78 HydrophobicContact CB-CB 4.43Å; E38-F78 PolarHBondContact OE2-N 3.32Å
39	G	89.9	Confident	93.7	Very high	84 Å²	84	50.4 Å²	50.4	87%	0.866	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-2.8	-177.4	0	0	0	0	0	115.2	C37	C37-G39 PolarHBondContact O-N 3.18Å
40	Q	93.9	Very high	93.8	Very high	100 Å²	100	49.2 Å²	49.2	47%	0.467	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	156.3	175	-55.9	-168.6	-79	0	0	111.3	A36 C37 E38 F78	A36-Q40 WeakPolarHBondContact CA-O 3.49Å; C37-Q40 PolarHBondContact N-O 2.94Å; C37-Q40 PolarHBondContact O-N 3.22Å; E38-Q40 VanDerWaalsContact C-N 3.26Å; E38-Q40 PolarHBondContact O-N 3.02Å; Q40-F78 HydrophobicContact CB-CD2 3.51Å; Q40-F78 HydrophobicContact CB-CE2 3.53Å; Q40-F78 HydrophobicContact CB-CG 4.34Å; Q40-F78 HydrophobicContact CB-CZ 4.42Å; Q40-F78 HydrophobicContact CG-CD2 4.24Å; Q40-F78 HydrophobicContact CG-CE2 4.4Å; Q40-F78 VanDerWaalsContact OE1-CD1 3.23Å
41	L	94	Very high	93.9	Very high	116 Å²	116	44.2 Å²	44.2	61%	0.607	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.9	-177.9	-59.1	-178.7	0	0	0	110.8	T34 L35 A36	T34-L41 HydrophobicContact CG2-CB 3.87Å; T34-L41 HydrophobicContact CG2-CD1 4.42Å; T34-L41 HydrophobicContact CG2-CD2 4.09Å; T34-L41 HydrophobicContact CG2-CG 4.35Å; L35-L41 CarbonylContact O-C 3.56Å; L35-L41 WeakPolarHBondContact O-CA 3.38Å; A36-L41 HydrophobicContact CB-CD2 3.48Å; A36-L41 VanDerWaalsContact CB-CD2 3.48Å
42	I	94.8	Very high	93.9	Very high	24 Å²	24	45.6 Å²	45.6	12%	0.123	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.6	173.8	-55.2	175.8	0	0	0	108.4	T34 L35 F78 V81	T34-I42 CarbonylContact C-O 3.58Å; T34-I42 WeakPolarHBondContact CA-O 3.45Å; L35-I42 HydrophobicContact CB-CB 4.43Å; L35-I42 PolarHBondContact N-O 3.47Å; L35-I42 PolarHBondContact O-N 3.06Å; I42-F78 HydrophobicContact CD1-CD2 3.96Å; I42-F78 HydrophobicContact CD1-CE2 3.6Å; I42-F78 HydrophobicContact CD1-CZ 4.15Å; I42-F78 HydrophobicContact CG1-CD2 4.13Å; I42-F78 HydrophobicContact CG1-CE2 3.41Å; I42-F78 VanDerWaalsContact CG1-CE2 3.41Å; I42-F78 HydrophobicContact CG1-CZ 4.07Å; I42-V81 HydrophobicContact CD1-CB 4.33Å; I42-V81 HydrophobicContact CD1-CG1 3.87Å
43	R	94.8	Very high	94	Very high	123 Å²	123	43 Å²	43	46%	0.464	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	134	172.7	-68.5	-174	68.8	-148.4	2.1	110.3	L25 G28 C31 V33	L25-R43 VanDerWaalsContact CD1-O 3.3Å; L25-R43 WeakPolarHBondContact CD1-O 3.42Å; G28-R43 PolarHBondContact O-NH1 3.42Å; C31-R43 HydrophobicContact CB-CB 3.77Å; C31-R43 PolarHBondContact O-NH2 3.4Å; V33-R43 WeakPolarHBondContact O-CA 3.5Å
44	A	95.5	Very high	94	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	176.2	-179.7	0	0	0	0	0	111.4	L25 C31 D32 V33 L49	L25-A44 HydrophobicContact CD1-CB 4.34Å; C31-A44 CarbonylContact C-O 3.55Å; C31-A44 WeakPolarHBondContact CA-O 3.34Å; C31-A44 WeakPolarHBondContact CB-O 3.42Å; D32-A44 PolarHBondContact N-O 3.02Å; D32-A44 VanDerWaalsContact N-O 3.12Å; V33-A44 HydrophobicContact CG1-CB 4.29Å; V33-A44 WeakPolarHBondContact CG1-O 3.49Å; V33-A44 PolarHBondContact N-O 3.11Å; V33-A44 VanDerWaalsContact N-O 3.14Å; V33-A44 PolarHBondContact O-N 3.25Å; A44-L49 HydrophobicContact CB-CD1 4.46Å; A44-L49 HydrophobicContact CB-CD2 4.35Å
45	H	94.8	Very high	93.9	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.028	28%	0.28	C	S	.	.			trans	-97.8	126.2	175.8	-50	79.8	0	0	0	111.5	C29 F30 D32 V47 V48 L49 Y89	C29-H45 PolarHBondContact O-NE2 3.07Å; F30-H45 PolarHBondContact O-CD2 3.47Å; F30-H45 VanDerWaalsContact O-CD2 3.29Å; D32-H45 VanDerWaalsContact OD1-CA 3.25Å; D32-H45 WeakPolarHBondContact OD1-CA 3.38Å; H45-V47 VanDerWaalsContact C-N 3.27Å; H45-V47 HydrophobicContact CB-CG1 4.13Å; H45-V47 PolarHBondContact O-N 2.77Å; H45-V48 HydrophobicContact CB-CG2 4.14Å; H45-V48 PolarHBondContact O-N 2.88Å; H45-V48 VanDerWaalsContact O-N 3.12Å; H45-L49 PolarHBondContact O-N 3.16Å; H45-Y89 WeakPolarHBondContact CB-OH 3.2Å; H45-Y89 PolarHBondContact N-OH 2.99Å; H45-Y89 AromaticContact ND1-CE1 3.53Å; H45-Y89 AromaticContact ND1-CZ 3.65Å; H45-Y89 PolarHBondContact ND1-OH 3.19Å
46	R	93.4	Very high	93.9	Very high	55 Å²	55	49.5 Å²	49.5	21%	0.208	28%	0.28	C	S	.	.	H	α-helix	trans	-53.8	-44.6	178.1	-68.1	172.1	69.3	169.9	1.1	111.3	D32 V33 V48 L49 C50 L60 Y63	D32-R46 WeakPolarHBondContact O-CD 3.28Å; D32-R46 WeakPolarHBondContact OD1-CG 3.43Å; D32-R46 PolarHBondContact OD1-N 2.85Å; D32-R46 WeakPolarHBondContact OD2-CB 3.45Å; D32-R46 VanDerWaalsContact OD2-CD 3.26Å; D32-R46 WeakPolarHBondContact OD2-CD 3.21Å; D32-R46 WeakPolarHBondContact OD2-CG 3.32Å; V33-R46 HydrophobicContact CB-CG 3.64Å; V33-R46 HydrophobicContact CG1-CB 4.4Å; V33-R46 HydrophobicContact CG1-CG 3.67Å; R46-V48 VanDerWaalsContact C-N 3.26Å; R46-V48 PolarHBondContact O-N 3.1Å; R46-L49 PolarHBondContact O-N 3.25Å; R46-L49 VanDerWaalsContact O-N 3.14Å; R46-C50 PolarHBondContact O-N 2.98Å; R46-C50 PolarHBondContact O-SG 3.45Å; R46-L60 HydrophobicContact CB-CD1 4.2Å; R46-L60 HydrophobicContact CG-CD1 4.11Å; R46-L60 HydrophobicContact CG-CD2 4.2Å; R46-L60 PolarHBondContact NH2-O 2.99Å; R46-Y63 PolarHBondContact NH2-O 2.85Å
47	V	93.6	Very high	93.8	Very high	93 Å²	93	52.1 Å²	52.1	56%	0.564	29%	0.292	S	S	*	.	H	α-helix	trans	-57.4	-35.5	-179.4	66.4	0	0	0	0	113.2	F21 H45 A51	F21-V47 HydrophobicContact CE1-CG1 4.3Å; H45-V47 VanDerWaalsContact C-N 3.27Å; H45-V47 HydrophobicContact CB-CG1 4.13Å; H45-V47 PolarHBondContact O-N 2.77Å; V47-A51 WeakPolarHBondContact O-CB 3.38Å; V47-A51 PolarHBondContact O-N 2.76Å
48	V	94.9	Very high	93.7	Very high	15 Å²	15	54.6 Å²	54.6	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-77.8	-41.7	177.4	-177.2	0	0	0	0	110.5	F21 H45 R46 A51 C52 M88 Y89	F21-V48 HydrophobicContact CD1-CG2 3.94Å; F21-V48 HydrophobicContact CE1-CG2 4.2Å; F21-V48 HydrophobicContact CG-CG2 4.34Å; H45-V48 HydrophobicContact CB-CG2 4.14Å; H45-V48 PolarHBondContact O-N 2.88Å; H45-V48 VanDerWaalsContact O-N 3.12Å; R46-V48 VanDerWaalsContact C-N 3.26Å; R46-V48 PolarHBondContact O-N 3.1Å; V48-A51 PolarHBondContact O-N 3.36Å; V48-C52 WeakPolarHBondContact O-CB 3.14Å; V48-C52 PolarHBondContact O-N 2.83Å; V48-C52 PolarHBondContact O-SG 3.11Å; V48-M88 HydrophobicContact CG1-CB 4.18Å; V48-Y89 HydrophobicContact CB-CE1 4.34Å; V48-Y89 HydrophobicContact CB-CE2 4.01Å; V48-Y89 HydrophobicContact CG1-CD2 3.87Å; V48-Y89 HydrophobicContact CG1-CE1 4.27Å; V48-Y89 HydrophobicContact CG1-CE2 3.55Å; V48-Y89 HydrophobicContact CG1-CG 4.36Å; V48-Y89 HydrophobicContact CG2-CE1 3.97Å
49	L	95.2	Very high	93.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-47.9	178.1	-58.8	-168.2	0	0	0	112	V33 L35 A44 H45 R46 A51 C52 S53 F56 L60 I85 M88	V33-L49 HydrophobicContact CG1-CD1 3.75Å; V33-L49 HydrophobicContact CG1-CG 4.45Å; V33-L49 HydrophobicContact CG2-CD1 4.35Å; L35-L49 HydrophobicContact CD1-CD1 4.25Å; L35-L49 HydrophobicContact CD2-CD1 4.09Å; L35-L49 HydrophobicContact CG-CD1 4.48Å; A44-L49 HydrophobicContact CB-CD1 4.46Å; A44-L49 HydrophobicContact CB-CD2 4.35Å; H45-L49 PolarHBondContact O-N 3.16Å; R46-L49 PolarHBondContact O-N 3.25Å; R46-L49 VanDerWaalsContact O-N 3.14Å; L49-A51 PolarHBondContact O-N 3.04Å; L49-C52 PolarHBondContact O-N 3.17Å; L49-S53 PolarHBondContact O-N 3.38Å; L49-F56 HydrophobicContact CB-CB 3.79Å; L49-F56 HydrophobicContact CB-CD2 3.88Å; L49-F56 HydrophobicContact CB-CG 3.97Å; L49-F56 HydrophobicContact CD1-CD1 4.48Å; L49-F56 HydrophobicContact CD1-CD2 4.29Å; L49-F56 HydrophobicContact CD1-CG 4.3Å; L49-F56 HydrophobicContact CD2-CD2 4.34Å; L49-F56 HydrophobicContact CD2-CE2 4.45Å; L49-F56 HydrophobicContact CG-CD2 4.39Å; L49-L60 HydrophobicContact CB-CD1 4.18Å; L49-L60 HydrophobicContact CD1-CD1 4.27Å; L49-I85 HydrophobicContact CD2-CD1 3.5Å; L49-I85 VanDerWaalsContact CD2-CD1 3.5Å; L49-M88 HydrophobicContact CD2-SD 3.62Å
50	C	94.1	Very high	93.7	Very high	24 Å²	24	47.3 Å²	47.3	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-39.1	175.9	-60.7	0	0	0	0	112.2	R46 C52 D57 K113	R46-C50 PolarHBondContact O-N 2.98Å; R46-C50 PolarHBondContact O-SG 3.45Å; C50-C52 VanDerWaalsContact C-N 3.31Å; C50-C52 PolarHBondContact O-N 3.33Å; C50-D57 HydrophobicContact CB-CB 4.06Å; C50-K113 PolarHBondContact O-NZ 3.41Å
51	A	93.6	Very high	93.3	Very high	62 Å²	62	46.3 Å²	46.3	51%	0.512	26%	0.264	S	S	.	.	H	α-helix	trans	-62.3	-39.1	176.6	0	0	0	0	0	111.9	V47 V48 L49 K113	V47-A51 WeakPolarHBondContact O-CB 3.38Å; V47-A51 PolarHBondContact O-N 2.76Å; V48-A51 PolarHBondContact O-N 3.36Å; L49-A51 PolarHBondContact O-N 3.04Å; A51-K113 WeakPolarHBondContact O-CD 3.31Å; A51-K113 PolarHBondContact O-NZ 3.49Å
52	C	94.4	Very high	92.6	Very high	32 Å²	32	47.2 Å²	47.2	22%	0.216	27%	0.27	C	S	.	.	H	α-helix	trans	-93.8	-22.9	-174.8	-66.6	0	0	0	0	115.4	V48 L49 C50 M88 K113	V48-C52 WeakPolarHBondContact O-CB 3.14Å; V48-C52 PolarHBondContact O-N 2.83Å; V48-C52 PolarHBondContact O-SG 3.11Å; L49-C52 PolarHBondContact O-N 3.17Å; C50-C52 VanDerWaalsContact C-N 3.31Å; C50-C52 PolarHBondContact O-N 3.33Å; C52-M88 HydrophobicContact CB-CB 4.08Å; C52-M88 HydrophobicContact CB-CE 4.22Å; C52-M88 HydrophobicContact CB-CG 3.52Å; C52-M88 HydrophobicContact CB-SD 3.64Å; C52-K113 WeakPolarHBondContact O-CB 3.34Å; C52-K113 WeakPolarHBondContact O-CG 3.48Å; C52-K113 PolarHBondContact O-N 2.78Å
53	S	94.7	Very high	91.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-132.8	133.2	-176.1	163.5	0	0	0	0	111.7	L49 F55 F56 D57 L110	L49-S53 PolarHBondContact O-N 3.38Å; S53-F55 PolarHBondContact OG-N 2.7Å; S53-F55 VanDerWaalsContact OG-N 3.16Å; S53-F56 PolarHBondContact OG-N 3.01Å; S53-D57 WeakPolarHBondContact O-CB 3.42Å; S53-D57 PolarHBondContact O-N 3.23Å; S53-D57 VanDerWaalsContact O-N 3.1Å; S53-L110 PolarHBondContact OG-O 3.37Å
54	T	93.4	Very high	90.4	Very high	73 Å²	73	49.6 Å²	49.6	45%	0.448	30%	0.299	S	S	.	.	H	α-helix	trans	-75.8	-25	173	53.1	0	0	0	0	112.7	A58 K111	T54-A58 WeakPolarHBondContact O-CB 3.31Å; T54-A58 PolarHBondContact O-N 3.18Å; T54-K111 PolarHBondContact N-O 3.5Å; T54-K111 VanDerWaalsContact OG1-CB 3.3Å; T54-K111 WeakPolarHBondContact OG1-CB 3.46Å
55	F	93.4	Very high	89.1	Confident	79 Å²	79	52.6 Å²	52.6	35%	0.346	32%	0.321	S	S	.	.	H	α-helix	trans	-66.4	-52	172	172	-98.3	0	0	0	111	S53 D57 A58 V59 L110	S53-F55 PolarHBondContact OG-N 2.7Å; S53-F55 VanDerWaalsContact OG-N 3.16Å; F55-D57 VanDerWaalsContact C-N 3.29Å; F55-D57 PolarHBondContact O-N 2.85Å; F55-A58 PolarHBondContact O-N 3.19Å; F55-V59 HydrophobicContact CD2-CG2 4.39Å; F55-V59 HydrophobicContact CE1-CG2 4.31Å; F55-V59 HydrophobicContact CE2-CG2 4.03Å; F55-V59 HydrophobicContact CZ-CG2 3.99Å; F55-V59 WeakPolarHBondContact O-CG2 3.3Å; F55-V59 PolarHBondContact O-N 2.71Å; F55-L110 HydrophobicContact CD1-CD2 3.71Å; F55-L110 HydrophobicContact CE1-CD2 3.77Å
56	F	93.8	Very high	87.9	Confident	3 Å²	3	61.9 Å²	61.9	1%	0.013	36%	0.364	C	S	.	.	H	α-helix	trans	-64.6	-34.6	177	-69.8	-47.7	0	0	0	112	L35 L49 S53 V59 L60 I71 M73 M88 L110	L35-F56 HydrophobicContact CD1-CZ 4.36Å; L35-F56 HydrophobicContact CD2-CE1 4.1Å; L35-F56 HydrophobicContact CD2-CZ 4.33Å; L49-F56 HydrophobicContact CB-CB 3.79Å; L49-F56 HydrophobicContact CB-CD2 3.88Å; L49-F56 HydrophobicContact CB-CG 3.97Å; L49-F56 HydrophobicContact CD1-CD1 4.48Å; L49-F56 HydrophobicContact CD1-CD2 4.29Å; L49-F56 HydrophobicContact CD1-CG 4.3Å; L49-F56 HydrophobicContact CD2-CD2 4.34Å; L49-F56 HydrophobicContact CD2-CE2 4.45Å; L49-F56 HydrophobicContact CG-CD2 4.39Å; S53-F56 PolarHBondContact OG-N 3.01Å; F56-V59 PolarHBondContact O-N 2.91Å; F56-L60 HydrophobicContact CB-CD1 4.23Å; F56-L60 WeakPolarHBondContact O-CB 3.37Å; F56-L60 WeakPolarHBondContact O-CG 3.26Å; F56-L60 PolarHBondContact O-N 3.49Å; F56-I71 HydrophobicContact CD1-CD1 3.82Å; F56-I71 HydrophobicContact CE1-CD1 3.98Å; F56-M73 HydrophobicContact CE1-SD 4.1Å; F56-M73 HydrophobicContact CZ-CE 4.48Å; F56-M73 HydrophobicContact CZ-SD 3.82Å; F56-M88 HydrophobicContact CD2-CE 4.13Å; F56-M88 HydrophobicContact CE2-CE 3.99Å; F56-L110 HydrophobicContact CZ-CD1 4.31Å; F56-L110 HydrophobicContact CZ-CD2 4.17Å
57	D	93.1	Very high	87.2	Confident	71 Å²	71	69.1 Å²	69.1	38%	0.38	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-51.7	172.4	-164.3	27.2	0	0	0	111.9	C50 S53 F55 V59 L60 S61	C50-D57 HydrophobicContact CB-CB 4.06Å; S53-D57 WeakPolarHBondContact O-CB 3.42Å; S53-D57 PolarHBondContact O-N 3.23Å; S53-D57 VanDerWaalsContact O-N 3.1Å; F55-D57 VanDerWaalsContact C-N 3.29Å; F55-D57 PolarHBondContact O-N 2.85Å; D57-V59 VanDerWaalsContact C-N 3.34Å; D57-V59 PolarHBondContact O-N 3.04Å; D57-L60 PolarHBondContact O-N 2.89Å; D57-S61 WeakPolarHBondContact O-CB 2.95Å; D57-S61 PolarHBondContact O-N 2.99Å; D57-S61 PolarHBondContact O-OG 2.63Å
58	A	91.7	Very high	86.8	Confident	55 Å²	55	68.7 Å²	68.7	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-35.4	178.6	0	0	0	0	0	113.8	T54 F55 N62	T54-A58 WeakPolarHBondContact O-CB 3.31Å; T54-A58 PolarHBondContact O-N 3.18Å; F55-A58 PolarHBondContact O-N 3.19Å; A58-N62 PolarHBondContact O-ND2 2.93Å
59	V	90.5	Very high	86.6	Confident	60 Å²	60	68.2 Å²	68.2	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-77.2	-45.1	178.4	173.2	0	0	0	0	111.9	F55 F56 D57 I71	F55-V59 HydrophobicContact CD2-CG2 4.39Å; F55-V59 HydrophobicContact CE1-CG2 4.31Å; F55-V59 HydrophobicContact CE2-CG2 4.03Å; F55-V59 HydrophobicContact CZ-CG2 3.99Å; F55-V59 WeakPolarHBondContact O-CG2 3.3Å; F55-V59 PolarHBondContact O-N 2.71Å; F56-V59 PolarHBondContact O-N 2.91Å; D57-V59 VanDerWaalsContact C-N 3.34Å; D57-V59 PolarHBondContact O-N 3.04Å; V59-I71 HydrophobicContact CG1-CD1 4.23Å
60	L	89.9	Confident	86.4	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-85.1	-25.3	-172.7	-68.5	169.2	0	0	0	114	V33 R46 L49 F56 D57 N62 Y63 P69 I71	V33-L60 HydrophobicContact CG2-CD2 4.17Å; R46-L60 HydrophobicContact CB-CD1 4.2Å; R46-L60 HydrophobicContact CG-CD1 4.11Å; R46-L60 HydrophobicContact CG-CD2 4.2Å; R46-L60 PolarHBondContact NH2-O 2.99Å; L49-L60 HydrophobicContact CB-CD1 4.18Å; L49-L60 HydrophobicContact CD1-CD1 4.27Å; F56-L60 HydrophobicContact CB-CD1 4.23Å; F56-L60 WeakPolarHBondContact O-CB 3.37Å; F56-L60 WeakPolarHBondContact O-CG 3.26Å; F56-L60 PolarHBondContact O-N 3.49Å; D57-L60 PolarHBondContact O-N 2.89Å; L60-N62 VanDerWaalsContact C-N 3.33Å; L60-Y63 PolarHBondContact O-N 3.47Å; L60-P69 HydrophobicContact CD2-CB 4.19Å; L60-P69 HydrophobicContact CD2-CG 3.53Å; L60-I71 HydrophobicContact CD1-CD1 4.47Å; L60-I71 HydrophobicContact CD2-CD1 4Å; L60-I71 HydrophobicContact CG-CD1 4.18Å
61	S	85.8	Confident	86.3	Confident	79 Å²	79	73.1 Å²	73.1	55%	0.552	41%	0.406	S	S	*	.	H	α-helix	trans	-67	-33.9	176	55.9	0	0	0	0	112.6	D57 Y63	D57-S61 WeakPolarHBondContact O-CB 2.95Å; D57-S61 PolarHBondContact O-N 2.99Å; D57-S61 PolarHBondContact O-OG 2.63Å; S61-Y63 VanDerWaalsContact C-N 3.29Å; S61-Y63 PolarHBondContact O-N 3.28Å
62	N	79.8	Confident	86.3	Confident	136 Å²	136	76.8 Å²	76.8	73%	0.727	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11.5	174.7	-70.8	-64.8	0	0	0	113.3	A58 L60 A64	A58-N62 PolarHBondContact O-ND2 2.93Å; L60-N62 VanDerWaalsContact C-N 3.33Å; N62-A64 PolarHBondContact O-N 2.99Å
63	Y	79.1	Confident	86.1	Confident	94 Å²	94	76 Å²	76	37%	0.369	41%	0.41	S	S	.	.			trans	-89.7	81.1	-173.9	-157.5	-92	0	0	0	112.2	R46 L60 S61 S65 P69	R46-Y63 PolarHBondContact NH2-O 2.85Å; L60-Y63 PolarHBondContact O-N 3.47Å; S61-Y63 VanDerWaalsContact C-N 3.29Å; S61-Y63 PolarHBondContact O-N 3.28Å; Y63-S65 VanDerWaalsContact C-N 3.3Å; Y63-S65 PolarHBondContact O-N 3.35Å; Y63-P69 HydrophobicContact CD1-CB 3.73Å; Y63-P69 HydrophobicContact CD1-CG 3.84Å; Y63-P69 HydrophobicContact CE1-CB 3.64Å; Y63-P69 HydrophobicContact CE1-CG 4.09Å; Y63-P69 HydrophobicContact CE2-CB 4.45Å; Y63-P69 HydrophobicContact CG-CB 4.17Å; Y63-P69 HydrophobicContact CG-CG 4.45Å
64	A	63.4	Low	85.8	Confident	102 Å²	102	83.7 Å²	83.7	84%	0.843	44%	0.443	S	S	*	.			trans	-82.3	7.5	-176.8	0	0	0	0	0	115.3	N62	N62-A64 PolarHBondContact O-N 2.99Å
65	S	69.1	Low	85.6	Confident	64 Å²	64	86.7 Å²	86.7	45%	0.448	46%	0.456	S	S	.	.			trans	-74.7	147.2	-175.5	-49.8	0	0	0	0	113.4	Y63 R67	Y63-S65 VanDerWaalsContact C-N 3.3Å; Y63-S65 PolarHBondContact O-N 3.35Å; S65-R67 PolarHBondContact O-N 3.47Å
66	E	68.6	Low	85.5	Confident	201 Å²	201	83.9 Å²	83.9	94%	0.939	45%	0.445	S	S	*	.	S	Bend	trans	-71.8	13.5	178.1	-160	176.7	-150.5	0	0	114.6
67	R	80	Confident	85.4	Confident	206 Å²	206	86.1 Å²	86.1	78%	0.777	46%	0.459	S	S	*	.	S	Bend	trans	-126.4	142.6	179.9	-64.5	-172.5	-178.7	-165.5	0.7	110.3	S65 P69	S65-R67 PolarHBondContact O-N 3.47Å; R67-P69 VanDerWaalsContact O-CD 3.26Å; R67-P69 WeakPolarHBondContact O-CD 3.33Å; R67-P69 VanDerWaalsContact O-N 3.16Å
68	D	84	Confident	85.5	Confident	85 Å²	85	85 Å²	85	46%	0.455	45%	0.451	S	S	.	.			trans	-52.9	115.6	173.2	-59.9	-7	0	0	0	110.4
69	P	90.7	Very high	85.6	Confident	4 Å²	4	85.4 Å²	85.4	3%	0.026	46%	0.455	C	S	.	.			trans	-62.3	140.4	176.8	18.7	-29.6	0	0	0	111.9	D32 V33 T34 L60 Y63 R67	D32-P69 WeakPolarHBondContact O-CD 3.08Å; V33-P69 HydrophobicContact CB-CG 4.25Å; V33-P69 HydrophobicContact CG2-CG 4.17Å; T34-P69 PolarHBondContact N-O 2.81Å; L60-P69 HydrophobicContact CD2-CB 4.19Å; L60-P69 HydrophobicContact CD2-CG 3.53Å; Y63-P69 HydrophobicContact CD1-CB 3.73Å; Y63-P69 HydrophobicContact CD1-CG 3.84Å; Y63-P69 HydrophobicContact CE1-CB 3.64Å; Y63-P69 HydrophobicContact CE1-CG 4.09Å; Y63-P69 HydrophobicContact CE2-CB 4.45Å; Y63-P69 HydrophobicContact CG-CB 4.17Å; Y63-P69 HydrophobicContact CG-CG 4.45Å; R67-P69 VanDerWaalsContact O-CD 3.26Å; R67-P69 WeakPolarHBondContact O-CD 3.33Å; R67-P69 VanDerWaalsContact O-N 3.16Å
70	I	92	Very high	85.7	Confident	108 Å²	108	83.5 Å²	83.5	55%	0.554	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	110	167.6	-52.1	-179.2	0	0	0	107.9	T34 A36	T34-I70 CarbonylContact O-C 3.6Å; T34-I70 VanDerWaalsContact O-CA 3.31Å; T34-I70 WeakPolarHBondContact O-CA 3.37Å; A36-I70 HydrophobicContact CB-CG2 4.05Å
71	I	92.3	Very high	86	Confident	19 Å²	19	83.6 Å²	83.6	10%	0.097	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	115.4	175.2	-55.1	179.6	0	0	0	108.2	V33 T34 L35 A36 F56 V59 L60 M73	V33-I71 HydrophobicContact CG2-CD1 4.25Å; V33-I71 HydrophobicContact CG2-CG1 4.39Å; T34-I71 PolarHBondContact O-N 3.25Å; L35-I71 WeakPolarHBondContact CA-O 3.37Å; L35-I71 HydrophobicContact CD2-CB 3.85Å; L35-I71 HydrophobicContact CD2-CD1 4.03Å; L35-I71 HydrophobicContact CD2-CG1 4.26Å; A36-I71 PolarHBondContact N-O 2.98Å; F56-I71 HydrophobicContact CD1-CD1 3.82Å; F56-I71 HydrophobicContact CE1-CD1 3.98Å; V59-I71 HydrophobicContact CG1-CD1 4.23Å; L60-I71 HydrophobicContact CD1-CD1 4.47Å; L60-I71 HydrophobicContact CD2-CD1 4Å; L60-I71 HydrophobicContact CG-CD1 4.18Å; I71-M73 HydrophobicContact CG2-CG 4.13Å
72	I	93.3	Very high	86.4	Confident	139 Å²	139	84.8 Å²	84.8	71%	0.713	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	117.4	175.3	-55	174.1	0	0	0	108.5	A36	A36-I72 HydrophobicContact CB-CG1 4.16Å
73	M	90.4	Very high	87	Confident	17 Å²	17	80 Å²	80	8%	0.084	41%	0.414	C	S	.	.			trans	-103.9	108.8	176.3	-66.3	-174	-61.2	0	0	109.2	L35 A36 C37 F56 I71 V81 L110	L35-M73 HydrophobicContact CB-CE 4.06Å; L35-M73 HydrophobicContact CD1-CE 4.1Å; L35-M73 HydrophobicContact CD2-CE 4.47Å; L35-M73 HydrophobicContact CG-CE 4.44Å; A36-M73 PolarHBondContact O-N 3.44Å; C37-M73 VanDerWaalsContact SG-CE 3.55Å; F56-M73 HydrophobicContact CE1-SD 4.1Å; F56-M73 HydrophobicContact CZ-CE 4.48Å; F56-M73 HydrophobicContact CZ-SD 3.82Å; I71-M73 HydrophobicContact CG2-CG 4.13Å; M73-V81 HydrophobicContact CE-CB 4.29Å; M73-V81 HydrophobicContact CE-CG1 3.55Å; M73-V81 HydrophobicContact CE-CG2 3.64Å; M73-L110 HydrophobicContact SD-CD1 4Å; M73-L110 HydrophobicContact SD-CD2 3.79Å
74	K	88.5	Confident	87.8	Confident	160 Å²	160	75.7 Å²	75.7	70%	0.696	40%	0.398	S	S	*	.			trans	-80.9	160.7	168.3	60.9	180	-168.4	90.3	0	110.2	V76	K74-V76 PolarHBondContact O-N 2.74Å
75	D	88.2	Confident	89.3	Confident	137 Å²	137	71.3 Å²	71.3	73%	0.733	36%	0.36	S	S	*	.	S	Bend	trans	63.5	20.8	169.9	-42	-42.3	0	0	0	115
76	V	91.6	Very high	90.5	Very high	20 Å²	20	70.9 Å²	70.9	12%	0.121	35%	0.351	C	S	.	.			trans	-137.3	138.4	178.3	-173.7	0	0	0	0	110.5	K74 E80 V81 T106	K74-V76 PolarHBondContact O-N 2.74Å; V76-E80 HydrophobicContact CG1-CB 4.07Å; V76-V81 HydrophobicContact CB-CG2 4.33Å; V76-V81 HydrophobicContact CG1-CG2 3.55Å; V76-T106 HydrophobicContact CB-CG2 4.26Å; V76-T106 HydrophobicContact CG1-CG2 3.3Å; V76-T106 HydrophobicContact CG2-CG2 3.85Å
77	T	92.8	Very high	91.8	Very high	50 Å²	50	62.3 Å²	62.3	31%	0.307	31%	0.311	S	S	.	.			trans	-78.4	151.4	177.4	69.5	0	0	0	0	112.9	E38 A79 E80 V81	E38-T77 VanDerWaalsContact OE2-CA 3.32Å; E38-T77 WeakPolarHBondContact OE2-CA 3.18Å; T77-A79 PolarHBondContact O-N 3.1Å; T77-E80 WeakPolarHBondContact CB-OE2 3.46Å; T77-E80 WeakPolarHBondContact CG2-OE2 3.48Å; T77-E80 PolarHBondContact N-OE2 3.39Å; T77-E80 PolarHBondContact O-N 2.73Å; T77-E80 VanDerWaalsContact OG1-CG 3.24Å; T77-E80 WeakPolarHBondContact OG1-CG 3.45Å; T77-E80 PolarHBondContact OG1-N 3.34Å; T77-E80 PolarHBondContact OG1-OE2 3.3Å; T77-V81 WeakPolarHBondContact O-CG2 3.21Å; T77-V81 PolarHBondContact O-N 3.22Å; T77-V81 VanDerWaalsContact O-N 3.09Å
78	F	94.2	Very high	92.5	Very high	47 Å²	47	53.2 Å²	53.2	21%	0.206	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-34.5	174.4	178	-92.1	0	0	0	111.9	E38 Q40 I42 V81 K82	E38-F78 HydrophobicContact CB-CB 4.43Å; E38-F78 PolarHBondContact OE2-N 3.32Å; Q40-F78 HydrophobicContact CB-CD2 3.51Å; Q40-F78 HydrophobicContact CB-CE2 3.53Å; Q40-F78 HydrophobicContact CB-CG 4.34Å; Q40-F78 HydrophobicContact CB-CZ 4.42Å; Q40-F78 HydrophobicContact CG-CD2 4.24Å; Q40-F78 HydrophobicContact CG-CE2 4.4Å; Q40-F78 VanDerWaalsContact OE1-CD1 3.23Å; I42-F78 HydrophobicContact CD1-CD2 3.96Å; I42-F78 HydrophobicContact CD1-CE2 3.6Å; I42-F78 HydrophobicContact CD1-CZ 4.15Å; I42-F78 HydrophobicContact CG1-CD2 4.13Å; I42-F78 HydrophobicContact CG1-CE2 3.41Å; I42-F78 VanDerWaalsContact CG1-CE2 3.41Å; I42-F78 HydrophobicContact CG1-CZ 4.07Å; F78-V81 PolarHBondContact O-N 3.24Å; F78-K82 HydrophobicContact CE1-CD 4.5Å; F78-K82 VanDerWaalsContact O-CB 3.29Å; F78-K82 WeakPolarHBondContact O-CB 3.41Å; F78-K82 PolarHBondContact O-N 2.83Å
79	A	93.5	Very high	93	Very high	64 Å²	64	49.7 Å²	49.7	53%	0.529	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-47	175.8	0	0	0	0	0	111.6	T77 K82 C83	T77-A79 PolarHBondContact O-N 3.1Å; A79-K82 PolarHBondContact O-N 2.92Å; A79-C83 PolarHBondContact O-N 3.14Å; A79-C83 PolarHBondContact O-SG 2.86Å
80	E	93.9	Very high	93	Very high	19 Å²	19	53.7 Å²	53.7	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-49	176.9	-71.8	157.7	146.8	0	0	111.5	V76 T77 K82 C83 L84 S102 L103	V76-E80 HydrophobicContact CG1-CB 4.07Å; T77-E80 WeakPolarHBondContact CB-OE2 3.46Å; T77-E80 WeakPolarHBondContact CG2-OE2 3.48Å; T77-E80 PolarHBondContact N-OE2 3.39Å; T77-E80 PolarHBondContact O-N 2.73Å; T77-E80 VanDerWaalsContact OG1-CG 3.24Å; T77-E80 WeakPolarHBondContact OG1-CG 3.45Å; T77-E80 PolarHBondContact OG1-N 3.34Å; T77-E80 PolarHBondContact OG1-OE2 3.3Å; E80-K82 VanDerWaalsContact C-N 3.29Å; E80-K82 PolarHBondContact O-N 3.38Å; E80-C83 PolarHBondContact O-N 3.42Å; E80-C83 VanDerWaalsContact O-N 3.15Å; E80-L84 VanDerWaalsContact O-CG 3.31Å; E80-L84 WeakPolarHBondContact O-CG 3.31Å; E80-L84 PolarHBondContact O-N 3.16Å; E80-S102 WeakPolarHBondContact OE1-CB 3.47Å; E80-S102 PolarHBondContact OE1-OG 3.28Å; E80-L103 HydrophobicContact CB-CD1 3.83Å; E80-L103 HydrophobicContact CG-CB 4.43Å; E80-L103 HydrophobicContact CG-CD1 4Å; E80-L103 WeakPolarHBondContact O-CD1 3.26Å; E80-L103 PolarHBondContact OE1-N 2.93Å
81	V	94.4	Very high	93	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.024	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-41.8	178.7	-178.6	0	0	0	0	111.1	L35 C37 I42 M73 V76 T77 F78 L84 I85	L35-V81 HydrophobicContact CD1-CG1 4.23Å; C37-V81 HydrophobicContact CB-CG2 4.24Å; I42-V81 HydrophobicContact CD1-CB 4.33Å; I42-V81 HydrophobicContact CD1-CG1 3.87Å; M73-V81 HydrophobicContact CE-CB 4.29Å; M73-V81 HydrophobicContact CE-CG1 3.55Å; M73-V81 HydrophobicContact CE-CG2 3.64Å; V76-V81 HydrophobicContact CB-CG2 4.33Å; V76-V81 HydrophobicContact CG1-CG2 3.55Å; T77-V81 WeakPolarHBondContact O-CG2 3.21Å; T77-V81 PolarHBondContact O-N 3.22Å; T77-V81 VanDerWaalsContact O-N 3.09Å; F78-V81 PolarHBondContact O-N 3.24Å; V81-L84 PolarHBondContact O-N 3.28Å; V81-I85 HydrophobicContact CG1-CG1 4.33Å; V81-I85 WeakPolarHBondContact O-CG1 3.4Å; V81-I85 PolarHBondContact O-N 3.38Å
82	K	94.2	Very high	92.9	Very high	104 Å²	104	55.8 Å²	55.8	45%	0.452	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-47.2	176	-170	-169.7	178.1	-147	0	111.3	F78 A79 E80 L84 I85 E86	F78-K82 HydrophobicContact CE1-CD 4.5Å; F78-K82 VanDerWaalsContact O-CB 3.29Å; F78-K82 WeakPolarHBondContact O-CB 3.41Å; F78-K82 PolarHBondContact O-N 2.83Å; A79-K82 PolarHBondContact O-N 2.92Å; E80-K82 VanDerWaalsContact C-N 3.29Å; E80-K82 PolarHBondContact O-N 3.38Å; K82-L84 PolarHBondContact O-N 3.02Å; K82-I85 PolarHBondContact O-N 3.22Å; K82-E86 WeakPolarHBondContact CE-OE1 3.38Å; K82-E86 IonicContact NZ-OE1 3.77Å; K82-E86 PolarHBondContact NZ-OE1 3.31Å; K82-E86 WeakPolarHBondContact O-CG 3.33Å; K82-E86 PolarHBondContact O-N 2.88Å
83	C	94.2	Very high	93	Very high	36 Å²	36	51.2 Å²	51.2	24%	0.243	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-43.1	175.2	-74	0	0	0	0	112.1	A79 E80 I85 E86 F87 I93 L103	A79-C83 PolarHBondContact O-N 3.14Å; A79-C83 PolarHBondContact O-SG 2.86Å; E80-C83 PolarHBondContact O-N 3.42Å; E80-C83 VanDerWaalsContact O-N 3.15Å; C83-I85 PolarHBondContact O-N 2.91Å; C83-E86 PolarHBondContact O-N 2.91Å; C83-F87 PolarHBondContact O-N 3.42Å; C83-I93 HydrophobicContact CB-CD1 4.4Å; C83-I93 WeakPolarHBondContact O-CG2 3.44Å; C83-L103 HydrophobicContact CB-CD1 3.91Å; C83-L103 HydrophobicContact CB-CD2 4.32Å
84	L	95.4	Very high	93.1	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.016	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-37.7	178	-64.7	174.5	0	0	0	112.3	E80 V81 K82 F87 M88 L103 T106 A107 L110 I112 L115	E80-L84 VanDerWaalsContact O-CG 3.31Å; E80-L84 WeakPolarHBondContact O-CG 3.31Å; E80-L84 PolarHBondContact O-N 3.16Å; V81-L84 PolarHBondContact O-N 3.28Å; K82-L84 PolarHBondContact O-N 3.02Å; L84-F87 WeakPolarHBondContact O-CB 3.48Å; L84-F87 PolarHBondContact O-N 3.32Å; L84-M88 WeakPolarHBondContact O-CG 3.25Å; L84-M88 PolarHBondContact O-N 2.89Å; L84-L103 HydrophobicContact CD1-CD1 4.26Å; L84-L103 HydrophobicContact CD2-CD1 3.71Å; L84-L103 HydrophobicContact CD2-CG 4.08Å; L84-L103 HydrophobicContact CG-CD1 3.67Å; L84-T106 HydrophobicContact CD1-CG2 3.47Å; L84-T106 VanDerWaalsContact CD1-CG2 3.47Å; L84-A107 HydrophobicContact CD2-CB 3.85Å; L84-L110 HydrophobicContact CD1-CD1 4.11Å; L84-I112 HydrophobicContact CB-CD1 3.9Å; L84-I112 HydrophobicContact CD1-CD1 3.76Å; L84-I112 HydrophobicContact CD2-CD1 3.91Å; L84-I112 HydrophobicContact CG-CD1 4.04Å; L84-L115 HydrophobicContact CD2-CD1 3.61Å
85	I	95.3	Very high	93.2	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.051	29%	0.285	C	S	.	.	H	α-helix	trans	-66.3	-44.9	172.5	-67.9	-64.2	0	0	0	111.1	L25 L35 L49 V81 K82 C83 F87 M88 Y89	L25-I85 HydrophobicContact CD2-CG2 3.75Å; L35-I85 HydrophobicContact CD1-CD1 3.79Å; L35-I85 HydrophobicContact CD1-CG1 4.25Å; L49-I85 HydrophobicContact CD2-CD1 3.5Å; L49-I85 VanDerWaalsContact CD2-CD1 3.5Å; V81-I85 HydrophobicContact CG1-CG1 4.33Å; V81-I85 WeakPolarHBondContact O-CG1 3.4Å; V81-I85 PolarHBondContact O-N 3.38Å; K82-I85 PolarHBondContact O-N 3.22Å; C83-I85 PolarHBondContact O-N 2.91Å; I85-F87 PolarHBondContact O-N 3.2Å; I85-M88 HydrophobicContact CD1-SD 4.41Å; I85-M88 PolarHBondContact O-N 3.27Å; I85-M88 VanDerWaalsContact O-N 3.12Å; I85-Y89 HydrophobicContact CG2-CD2 4.15Å; I85-Y89 HydrophobicContact CG2-CE2 4.15Å; I85-Y89 VanDerWaalsContact O-CD2 3.28Å; I85-Y89 WeakPolarHBondContact O-CD2 3.39Å; I85-Y89 PolarHBondContact O-N 2.76Å
86	E	93.7	Very high	93.3	Very high	56 Å²	56	53.1 Å²	53.1	26%	0.262	28%	0.281	S	S	.	.	H	α-helix	trans	-59.1	-37.9	175.1	-71.7	-168.1	-138.4	0	0	111.5	K82 C83 Y89 K90 I93	K82-E86 WeakPolarHBondContact CE-OE1 3.38Å; K82-E86 IonicContact NZ-OE1 3.77Å; K82-E86 PolarHBondContact NZ-OE1 3.31Å; K82-E86 WeakPolarHBondContact O-CG 3.33Å; K82-E86 PolarHBondContact O-N 2.88Å; C83-E86 PolarHBondContact O-N 2.91Å; E86-Y89 PolarHBondContact O-N 2.86Å; E86-K90 HydrophobicContact CB-CD 4.38Å; E86-K90 VanDerWaalsContact O-CB 3.24Å; E86-K90 WeakPolarHBondContact O-CB 3.45Å; E86-K90 WeakPolarHBondContact O-CG 3.39Å; E86-K90 PolarHBondContact O-N 2.87Å; E86-K90 IonicContact OE2-NZ 2.66Å; E86-K90 PolarHBondContact OE2-NZ 2.63Å; E86-I93 HydrophobicContact CB-CG2 4Å
87	F	94.8	Very high	93.3	Very high	20 Å²	20	60 Å²	60	9%	0.088	31%	0.311	C	S	.	.	H	α-helix	trans	-63	-43.3	172.9	177.9	-101.7	0	0	0	113.2	C83 L84 I85 Y89 G91 I93 I112 L115 F255	C83-F87 PolarHBondContact O-N 3.42Å; L84-F87 WeakPolarHBondContact O-CB 3.48Å; L84-F87 PolarHBondContact O-N 3.32Å; I85-F87 PolarHBondContact O-N 3.2Å; F87-Y89 VanDerWaalsContact C-N 3.27Å; F87-Y89 PolarHBondContact O-N 2.84Å; F87-G91 WeakPolarHBondContact O-CA 3.44Å; F87-G91 PolarHBondContact O-N 3.04Å; F87-I93 HydrophobicContact CB-CD1 4.04Å; F87-I93 HydrophobicContact CB-CG1 4.17Å; F87-I93 HydrophobicContact CB-CG2 3.77Å; F87-I93 HydrophobicContact CD2-CG1 4.1Å; F87-I112 HydrophobicContact CD1-CG2 4.18Å; F87-I112 HydrophobicContact CE1-CG2 4.15Å; F87-L115 HydrophobicContact CB-CD1 4.45Å; F87-L115 HydrophobicContact CD1-CD1 3.54Å; F87-L115 HydrophobicContact CD1-CG 3.99Å; F87-L115 HydrophobicContact CD2-CD1 4.27Å; F87-L115 HydrophobicContact CE1-CD1 3.75Å; F87-L115 HydrophobicContact CE1-CD2 4.47Å; F87-L115 HydrophobicContact CE1-CG 3.63Å; F87-L115 HydrophobicContact CE2-CD1 4.43Å; F87-L115 HydrophobicContact CE2-CD2 4.18Å; F87-L115 HydrophobicContact CE2-CG 4.2Å; F87-L115 HydrophobicContact CG-CD1 3.83Å; F87-L115 HydrophobicContact CG-CG 4.43Å; F87-L115 HydrophobicContact CZ-CD1 4.18Å; F87-L115 HydrophobicContact CZ-CD2 4.12Å; F87-L115 HydrophobicContact CZ-CG 3.73Å; F87-F255 AromaticContact CE2-CE1 3.85Å; F87-F255 HydrophobicContact CE2-CE1 3.85Å; F87-F255 HydrophobicContact CZ-CD1 4.17Å; F87-F255 AromaticContact CZ-CE1 3.71Å; F87-F255 HydrophobicContact CZ-CE1 3.71Å
88	M	94.8	Very high	93.2	Very high	16 Å²	16	61.5 Å²	61.5	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-62.6	-32.3	179.4	-68.9	-171.8	-170.8	0	0	113.3	V48 L49 C52 F56 L84 I85 I112	V48-M88 HydrophobicContact CG1-CB 4.18Å; L49-M88 HydrophobicContact CD2-SD 3.62Å; C52-M88 HydrophobicContact CB-CB 4.08Å; C52-M88 HydrophobicContact CB-CE 4.22Å; C52-M88 HydrophobicContact CB-CG 3.52Å; C52-M88 HydrophobicContact CB-SD 3.64Å; F56-M88 HydrophobicContact CD2-CE 4.13Å; F56-M88 HydrophobicContact CE2-CE 3.99Å; L84-M88 WeakPolarHBondContact O-CG 3.25Å; L84-M88 PolarHBondContact O-N 2.89Å; I85-M88 HydrophobicContact CD1-SD 4.41Å; I85-M88 PolarHBondContact O-N 3.27Å; I85-M88 VanDerWaalsContact O-N 3.12Å; M88-I112 HydrophobicContact CE-CD1 3.52Å; M88-I112 HydrophobicContact CE-CG1 3.68Å; M88-I112 HydrophobicContact CE-CG2 4.1Å
89	Y	95	Very high	93	Very high	10 Å²	10	61.3 Å²	61.3	4%	0.039	33%	0.328	C	S	.	.	H	α-helix	trans	-93.9	-36.5	-176.4	-75.5	-109.4	0	0	0	112.9	F21 S22 L25 H45 V48 I85 E86 F87	F21-Y89 HydrophobicContact CB-CD1 4.12Å; F21-Y89 HydrophobicContact CB-CE1 4.38Å; F21-Y89 WeakPolarHBondContact O-CD1 3.44Å; S22-Y89 PolarHBondContact OG-O 3.29Å; L25-Y89 HydrophobicContact CB-CD1 3.91Å; L25-Y89 HydrophobicContact CB-CE1 3.77Å; L25-Y89 HydrophobicContact CD1-CE1 4.19Å; L25-Y89 HydrophobicContact CD1-CE2 4.44Å; L25-Y89 HydrophobicContact CD2-CD1 3.9Å; L25-Y89 HydrophobicContact CD2-CD2 3.91Å; L25-Y89 HydrophobicContact CD2-CE1 4.06Å; L25-Y89 HydrophobicContact CD2-CE2 4.07Å; L25-Y89 HydrophobicContact CD2-CG 3.83Å; L25-Y89 HydrophobicContact CG-CD1 4.43Å; L25-Y89 HydrophobicContact CG-CE1 4.23Å; H45-Y89 WeakPolarHBondContact CB-OH 3.2Å; H45-Y89 PolarHBondContact N-OH 2.99Å; H45-Y89 AromaticContact ND1-CE1 3.53Å; H45-Y89 AromaticContact ND1-CZ 3.65Å; H45-Y89 PolarHBondContact ND1-OH 3.19Å; V48-Y89 HydrophobicContact CB-CE1 4.34Å; V48-Y89 HydrophobicContact CB-CE2 4.01Å; V48-Y89 HydrophobicContact CG1-CD2 3.87Å; V48-Y89 HydrophobicContact CG1-CE1 4.27Å; V48-Y89 HydrophobicContact CG1-CE2 3.55Å; V48-Y89 HydrophobicContact CG1-CG 4.36Å; V48-Y89 HydrophobicContact CG2-CE1 3.97Å; I85-Y89 HydrophobicContact CG2-CD2 4.15Å; I85-Y89 HydrophobicContact CG2-CE2 4.15Å; I85-Y89 VanDerWaalsContact O-CD2 3.28Å; I85-Y89 WeakPolarHBondContact O-CD2 3.39Å; I85-Y89 PolarHBondContact O-N 2.76Å; E86-Y89 PolarHBondContact O-N 2.86Å; F87-Y89 VanDerWaalsContact C-N 3.27Å; F87-Y89 PolarHBondContact O-N 2.84Å
90	K	91.5	Very high	92.9	Very high	88 Å²	88	61.8 Å²	61.8	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-91.4	-27.6	-179.1	-60.5	174.4	-178	176.7	0	113.1	Q18 E86 E92	Q18-K90 PolarHBondContact NE2-O 2.81Å; E86-K90 HydrophobicContact CB-CD 4.38Å; E86-K90 VanDerWaalsContact O-CB 3.24Å; E86-K90 WeakPolarHBondContact O-CB 3.45Å; E86-K90 WeakPolarHBondContact O-CG 3.39Å; E86-K90 PolarHBondContact O-N 2.87Å; E86-K90 IonicContact OE2-NZ 2.66Å; E86-K90 PolarHBondContact OE2-NZ 2.63Å; K90-E92 HydrophobicContact CB-CG 4.39Å; K90-E92 PolarHBondContact O-N 3.07Å
91	G	91.1	Very high	92.8	Very high	26 Å²	26	64.8 Å²	64.8	27%	0.268	34%	0.343	S	S	.	.	S	Bend	trans	78.4	-3.4	-170.4	0	0	0	0	0	114.4	F87 F255	F87-G91 WeakPolarHBondContact O-CA 3.44Å; F87-G91 PolarHBondContact O-N 3.04Å; G91-F255 VanDerWaalsContact O-CE1 3.26Å; G91-F255 WeakPolarHBondContact O-CE1 3.21Å; G91-F255 VanDerWaalsContact O-CZ 3.3Å; G91-F255 WeakPolarHBondContact O-CZ 3.49Å
92	E	91.2	Very high	92.7	Very high	146 Å²	146	67 Å²	67	68%	0.682	36%	0.358	S	S	*	.			trans	-147.5	148.2	-178.4	61.1	-176.9	-163.2	0	0	110.4	K90	K90-E92 HydrophobicContact CB-CG 4.39Å; K90-E92 PolarHBondContact O-N 3.07Å
93	I	93.6	Very high	92.7	Very high	43 Å²	43	62.4 Å²	62.4	22%	0.221	34%	0.339	C	S	.	.			trans	-144.8	151	174.5	49.2	172	0	0	0	111.3	C83 E86 F87 V95 L103	C83-I93 HydrophobicContact CB-CD1 4.4Å; C83-I93 WeakPolarHBondContact O-CG2 3.44Å; E86-I93 HydrophobicContact CB-CG2 4Å; F87-I93 HydrophobicContact CB-CD1 4.04Å; F87-I93 HydrophobicContact CB-CG1 4.17Å; F87-I93 HydrophobicContact CB-CG2 3.77Å; F87-I93 HydrophobicContact CD2-CG1 4.1Å; I93-V95 HydrophobicContact CB-CG2 4.3Å; I93-V95 HydrophobicContact CD1-CG2 3.62Å; I93-V95 HydrophobicContact CG1-CG2 3.98Å; I93-L103 HydrophobicContact CD1-CD2 3.84Å
94	N	92.9	Very high	92.6	Very high	165 Å²	165	64.2 Å²	64.2	88%	0.882	35%	0.345	S	S	*	.			trans	-105.4	132.7	167.5	-64.5	-24.9	0	0	0	108.5
95	V	90.7	Very high	92.5	Very high	53 Å²	53	70.5 Å²	70.5	32%	0.321	37%	0.373	S	S	.	.			trans	-141.9	146.5	-172.5	-172	0	0	0	0	108.4	I93 L103	I93-V95 HydrophobicContact CB-CG2 4.3Å; I93-V95 HydrophobicContact CD1-CG2 3.62Å; I93-V95 HydrophobicContact CG1-CG2 3.98Å; V95-L103 HydrophobicContact CB-CD2 4.32Å; V95-L103 HydrophobicContact CG1-CD2 3.82Å; V95-L103 HydrophobicContact CG2-CD2 3.6Å
96	E	91.2	Very high	92.4	Very high	135 Å²	135	70.3 Å²	70.3	63%	0.631	37%	0.372	S	S	*	.			trans	-71.6	148.8	174.9	-158.1	-172.8	119.1	0	0	111.2	S98 S99 L100	E96-S98 PolarHBondContact O-N 2.92Å; E96-S98 WeakPolarHBondContact OE1-CB 3.22Å; E96-S98 PolarHBondContact OE1-OG 3.46Å; E96-S99 PolarHBondContact O-N 3.4Å; E96-S99 PolarHBondContact O-OG 2.87Å; E96-L100 PolarHBondContact O-N 3.19Å; E96-L100 VanDerWaalsContact O-N 3.12Å
97	H	90.6	Very high	92.4	Very high	165 Å²	165	67.6 Å²	67.6	76%	0.764	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.7	179.2	-174.1	58	0	0	0	113.3
98	S	91.9	Very high	92.4	Very high	81 Å²	81	69 Å²	69	57%	0.566	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-37.7	178.8	58	0	0	0	0	113.8	E96	E96-S98 PolarHBondContact O-N 2.92Å; E96-S98 WeakPolarHBondContact OE1-CB 3.22Å; E96-S98 PolarHBondContact OE1-OG 3.46Å
99	S	89.7	Confident	92.3	Very high	43 Å²	43	72.5 Å²	72.5	30%	0.301	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-12.1	-177.1	53.3	0	0	0	0	114.1	E96 P101 S102 L103	E96-S99 PolarHBondContact O-N 3.4Å; E96-S99 PolarHBondContact O-OG 2.87Å; S99-P101 VanDerWaalsContact C-CD 3.48Å; S99-S102 PolarHBondContact O-N 3.06Å; S99-S102 PolarHBondContact O-OG 3.3Å; S99-L103 VanDerWaalsContact O-CB 3.29Å; S99-L103 WeakPolarHBondContact O-CB 3.25Å; S99-L103 PolarHBondContact O-N 3.22Å
100	L	91.2	Very high	92.2	Very high	74 Å²	74	72.7 Å²	72.7	39%	0.387	39%	0.388	S	S	.	.	H	α-helix	trans	-52.4	-43.2	174.6	-178.1	155.8	0	0	0	114	E96 L104	E96-L100 PolarHBondContact O-N 3.19Å; E96-L100 VanDerWaalsContact O-N 3.12Å; L100-L104 HydrophobicContact CD2-CD1 3.64Å; L100-L104 HydrophobicContact CD2-CG 4.29Å; L100-L104 HydrophobicContact CG-CD1 4.38Å; L100-L104 WeakPolarHBondContact O-CB 3.33Å; L100-L104 WeakPolarHBondContact O-CG 3.18Å; L100-L104 PolarHBondContact O-N 3.49Å
101	P	92.1	Very high	92.3	Very high	83 Å²	83	72.3 Å²	72.3	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-38.7	-178.4	-21.4	34.3	0	0	0	113.7	S99 K105	S99-P101 VanDerWaalsContact C-CD 3.48Å; P101-K105 PolarHBondContact O-N 3.29Å
102	S	92.1	Very high	92.4	Very high	50 Å²	50	71.1 Å²	71.1	35%	0.35	37%	0.374	S	S	.	.	H	α-helix	trans	-74.5	-41.4	178.7	65.1	0	0	0	0	110.9	E80 S99 L104 K105 T106	E80-S102 WeakPolarHBondContact OE1-CB 3.47Å; E80-S102 PolarHBondContact OE1-OG 3.28Å; S99-S102 PolarHBondContact O-N 3.06Å; S99-S102 PolarHBondContact O-OG 3.3Å; S102-L104 VanDerWaalsContact C-N 3.33Å; S102-L104 PolarHBondContact O-N 3.12Å; S102-K105 WeakPolarHBondContact O-CB 3.47Å; S102-K105 PolarHBondContact O-N 3.27Å; S102-K105 VanDerWaalsContact O-N 3.1Å; S102-T106 PolarHBondContact O-N 3.12Å; S102-T106 PolarHBondContact O-OG1 3.49Å
103	L	93.4	Very high	92.4	Very high	8 Å²	8	68.9 Å²	68.9	4%	0.042	36%	0.362	C	S	.	.	H	α-helix	trans	-56.3	-43.2	172.8	-174.9	73.1	0	0	0	112.7	E80 C83 L84 I93 V95 S99 T106 A107	E80-L103 HydrophobicContact CB-CD1 3.83Å; E80-L103 HydrophobicContact CG-CB 4.43Å; E80-L103 HydrophobicContact CG-CD1 4Å; E80-L103 WeakPolarHBondContact O-CD1 3.26Å; E80-L103 PolarHBondContact OE1-N 2.93Å; C83-L103 HydrophobicContact CB-CD1 3.91Å; C83-L103 HydrophobicContact CB-CD2 4.32Å; L84-L103 HydrophobicContact CD1-CD1 4.26Å; L84-L103 HydrophobicContact CD2-CD1 3.71Å; L84-L103 HydrophobicContact CD2-CG 4.08Å; L84-L103 HydrophobicContact CG-CD1 3.67Å; I93-L103 HydrophobicContact CD1-CD2 3.84Å; V95-L103 HydrophobicContact CB-CD2 4.32Å; V95-L103 HydrophobicContact CG1-CD2 3.82Å; V95-L103 HydrophobicContact CG2-CD2 3.6Å; S99-L103 VanDerWaalsContact O-CB 3.29Å; S99-L103 WeakPolarHBondContact O-CB 3.25Å; S99-L103 PolarHBondContact O-N 3.22Å; L103-T106 PolarHBondContact O-N 3.14Å; L103-A107 WeakPolarHBondContact O-CB 3.41Å; L103-A107 PolarHBondContact O-N 2.9Å
104	L	93.3	Very high	92.2	Very high	73 Å²	73	68.6 Å²	68.6	38%	0.382	37%	0.369	S	S	.	.	H	α-helix	trans	-67.5	-37.2	176.9	-75.3	-178.8	0	0	0	112.2	L100 S102 A107 D108 L115	L100-L104 HydrophobicContact CD2-CD1 3.64Å; L100-L104 HydrophobicContact CD2-CG 4.29Å; L100-L104 HydrophobicContact CG-CD1 4.38Å; L100-L104 WeakPolarHBondContact O-CB 3.33Å; L100-L104 WeakPolarHBondContact O-CG 3.18Å; L100-L104 PolarHBondContact O-N 3.49Å; S102-L104 VanDerWaalsContact C-N 3.33Å; S102-L104 PolarHBondContact O-N 3.12Å; L104-A107 PolarHBondContact O-N 3.29Å; L104-D108 PolarHBondContact O-N 2.72Å; L104-L115 HydrophobicContact CD2-CB 4.4Å; L104-L115 HydrophobicContact CD2-CD2 4.21Å
105	K	92.9	Very high	92	Very high	135 Å²	135	62.5 Å²	62.5	59%	0.587	34%	0.337	S	S	*	.	H	α-helix	trans	-61.4	-51	172.8	-171.3	-153.9	165.7	-154	0	110.6	P101 S102 A107 D108 D109	P101-K105 PolarHBondContact O-N 3.29Å; S102-K105 WeakPolarHBondContact O-CB 3.47Å; S102-K105 PolarHBondContact O-N 3.27Å; S102-K105 VanDerWaalsContact O-N 3.1Å; K105-A107 VanDerWaalsContact C-N 3.25Å; K105-A107 PolarHBondContact O-N 3.15Å; K105-D108 PolarHBondContact O-N 2.79Å; K105-D109 WeakPolarHBondContact CE-OD2 3.44Å; K105-D109 IonicContact NZ-OD2 3.63Å; K105-D109 PolarHBondContact O-N 2.85Å
106	T	93.2	Very high	91.4	Very high	6 Å²	6	60.6 Å²	60.6	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-56.8	-38.9	174.6	-58.7	0	0	0	0	112.2	V76 L84 S102 L103 D108 D109 L110	V76-T106 HydrophobicContact CB-CG2 4.26Å; V76-T106 HydrophobicContact CG1-CG2 3.3Å; V76-T106 HydrophobicContact CG2-CG2 3.85Å; L84-T106 HydrophobicContact CD1-CG2 3.47Å; L84-T106 VanDerWaalsContact CD1-CG2 3.47Å; S102-T106 PolarHBondContact O-N 3.12Å; S102-T106 PolarHBondContact O-OG1 3.49Å; L103-T106 PolarHBondContact O-N 3.14Å; T106-D108 VanDerWaalsContact C-N 3.3Å; T106-D108 PolarHBondContact O-N 2.85Å; T106-D109 PolarHBondContact O-N 3.39Å; T106-L110 HydrophobicContact CG2-CD1 4.02Å; T106-L110 WeakPolarHBondContact O-CB 3.47Å; T106-L110 WeakPolarHBondContact O-CG 3.42Å; T106-L110 PolarHBondContact O-N 2.75Å
107	A	94.1	Very high	90.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-33.2	177.9	0	0	0	0	0	112.7	L84 L103 L104 K105 L110 K111 I112 L115	L84-A107 HydrophobicContact CD2-CB 3.85Å; L103-A107 WeakPolarHBondContact O-CB 3.41Å; L103-A107 PolarHBondContact O-N 2.9Å; L104-A107 PolarHBondContact O-N 3.29Å; K105-A107 VanDerWaalsContact C-N 3.25Å; K105-A107 PolarHBondContact O-N 3.15Å; A107-L110 CarbonylContact O-C 3.58Å; A107-K111 PolarHBondContact O-N 2.87Å; A107-I112 HydrophobicContact CB-CB 4.45Å; A107-I112 HydrophobicContact CB-CD1 4.44Å; A107-I112 PolarHBondContact O-N 3.36Å; A107-L115 HydrophobicContact CB-CB 3.57Å; A107-L115 HydrophobicContact CB-CD1 4.14Å
108	D	93.7	Very high	88	Confident	49 Å²	49	56 Å²	56	26%	0.262	31%	0.312	S	S	.	.	H	α-helix	trans	-76.3	-41.7	172.2	-168.4	54.3	0	0	0	112.6	L104 K105 T106 L110 K111 A116	L104-D108 PolarHBondContact O-N 2.72Å; K105-D108 PolarHBondContact O-N 2.79Å; T106-D108 VanDerWaalsContact C-N 3.3Å; T106-D108 PolarHBondContact O-N 2.85Å; D108-L110 PolarHBondContact O-N 2.96Å; D108-K111 WeakPolarHBondContact O-CA 3.47Å; D108-K111 WeakPolarHBondContact O-CD 3.4Å; D108-K111 WeakPolarHBondContact O-CE 3.03Å; D108-K111 WeakPolarHBondContact O-CG 3.32Å; D108-K111 PolarHBondContact O-N 3.02Å; D108-K111 PolarHBondContact O-NZ 3.27Å; D108-K111 IonicContact OD1-NZ 3.26Å; D108-K111 PolarHBondContact OD1-NZ 3.2Å; D108-K111 IonicContact OD2-NZ 3.41Å; D108-K111 PolarHBondContact OD2-NZ 3.25Å; D108-A116 HydrophobicContact CB-CB 4.35Å
109	D	92.7	Very high	85.5	Confident	89 Å²	89	56.6 Å²	56.6	48%	0.476	31%	0.312	S	S	.	.	H	α-helix	trans	-56.2	-38.6	172.8	-71.7	-37.2	0	0	0	111.1	K105 T106	K105-D109 WeakPolarHBondContact CE-OD2 3.44Å; K105-D109 IonicContact NZ-OD2 3.63Å; K105-D109 PolarHBondContact O-N 2.85Å; T106-D109 PolarHBondContact O-N 3.39Å
110	L	93.2	Very high	83.1	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.073	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	6.8	174	-63.6	177.1	0	0	0	114.3	S53 F55 F56 M73 L84 T106 A107 D108 I112	S53-L110 PolarHBondContact OG-O 3.37Å; F55-L110 HydrophobicContact CD1-CD2 3.71Å; F55-L110 HydrophobicContact CE1-CD2 3.77Å; F56-L110 HydrophobicContact CZ-CD1 4.31Å; F56-L110 HydrophobicContact CZ-CD2 4.17Å; M73-L110 HydrophobicContact SD-CD1 4Å; M73-L110 HydrophobicContact SD-CD2 3.79Å; L84-L110 HydrophobicContact CD1-CD1 4.11Å; T106-L110 HydrophobicContact CG2-CD1 4.02Å; T106-L110 WeakPolarHBondContact O-CB 3.47Å; T106-L110 WeakPolarHBondContact O-CG 3.42Å; T106-L110 PolarHBondContact O-N 2.75Å; A107-L110 CarbonylContact O-C 3.58Å; D108-L110 PolarHBondContact O-N 2.96Å; L110-I112 VanDerWaalsContact C-N 3.32Å; L110-I112 HydrophobicContact CB-CD1 3.97Å; L110-I112 HydrophobicContact CB-CG1 3.88Å; L110-I112 HydrophobicContact CD1-CD1 4.36Å; L110-I112 PolarHBondContact O-N 3.41Å
111	K	93.1	Very high	80.4	Confident	81 Å²	81	72.4 Å²	72.4	35%	0.352	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.1	52.6	179.2	-58.8	-68.1	161.1	-164.3	0	113.9	T54 A107 D108	T54-K111 PolarHBondContact N-O 3.5Å; T54-K111 VanDerWaalsContact OG1-CB 3.3Å; T54-K111 WeakPolarHBondContact OG1-CB 3.46Å; A107-K111 PolarHBondContact O-N 2.87Å; D108-K111 WeakPolarHBondContact O-CA 3.47Å; D108-K111 WeakPolarHBondContact O-CD 3.4Å; D108-K111 WeakPolarHBondContact O-CE 3.03Å; D108-K111 WeakPolarHBondContact O-CG 3.32Å; D108-K111 PolarHBondContact O-N 3.02Å; D108-K111 PolarHBondContact O-NZ 3.27Å; D108-K111 IonicContact OD1-NZ 3.26Å; D108-K111 PolarHBondContact OD1-NZ 3.2Å; D108-K111 IonicContact OD2-NZ 3.41Å; D108-K111 PolarHBondContact OD2-NZ 3.25Å
112	I	94.1	Very high	77.7	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-82.7	119.2	-177	-60.5	177.2	0	0	0	110.7	L84 F87 M88 A107 L110 G114 L115 A116	L84-I112 HydrophobicContact CB-CD1 3.9Å; L84-I112 HydrophobicContact CD1-CD1 3.76Å; L84-I112 HydrophobicContact CD2-CD1 3.91Å; L84-I112 HydrophobicContact CG-CD1 4.04Å; F87-I112 HydrophobicContact CD1-CG2 4.18Å; F87-I112 HydrophobicContact CE1-CG2 4.15Å; M88-I112 HydrophobicContact CE-CD1 3.52Å; M88-I112 HydrophobicContact CE-CG1 3.68Å; M88-I112 HydrophobicContact CE-CG2 4.1Å; A107-I112 HydrophobicContact CB-CB 4.45Å; A107-I112 HydrophobicContact CB-CD1 4.44Å; A107-I112 PolarHBondContact O-N 3.36Å; L110-I112 VanDerWaalsContact C-N 3.32Å; L110-I112 HydrophobicContact CB-CD1 3.97Å; L110-I112 HydrophobicContact CB-CG1 3.88Å; L110-I112 HydrophobicContact CD1-CD1 4.36Å; L110-I112 PolarHBondContact O-N 3.41Å; I112-G114 PolarHBondContact O-N 3.11Å; I112-L115 HydrophobicContact CG2-CD1 4.45Å; I112-L115 PolarHBondContact O-N 3.08Å; I112-L115 VanDerWaalsContact O-N 3.15Å; I112-A116 VanDerWaalsContact O-CB 3.25Å; I112-A116 WeakPolarHBondContact O-CB 3.49Å; I112-A116 PolarHBondContact O-N 3.36Å
113	K	91.7	Very high	75.4	Confident	100 Å²	100	80 Å²	80	44%	0.435	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	123.1	-177.7	-61.9	163.8	-163.2	166.7	0	110.2	C50 A51 C52	C50-K113 PolarHBondContact O-NZ 3.41Å; A51-K113 WeakPolarHBondContact O-CD 3.31Å; A51-K113 PolarHBondContact O-NZ 3.49Å; C52-K113 WeakPolarHBondContact O-CB 3.34Å; C52-K113 WeakPolarHBondContact O-CG 3.48Å; C52-K113 PolarHBondContact O-N 2.78Å
114	G	88	Confident	73.1	Confident	36 Å²	36	88.5 Å²	88.5	37%	0.371	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	-11	179.3	0	0	0	0	0	115.5	I112	I112-G114 PolarHBondContact O-N 3.11Å
115	L	88.3	Confident	70.8	Confident	37 Å²	37	91.7 Å²	91.7	19%	0.194	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-44.2	172.1	-67	177.9	0	0	0	112.1	L84 F87 L104 A107 I112	L84-L115 HydrophobicContact CD2-CD1 3.61Å; F87-L115 HydrophobicContact CB-CD1 4.45Å; F87-L115 HydrophobicContact CD1-CD1 3.54Å; F87-L115 HydrophobicContact CD1-CG 3.99Å; F87-L115 HydrophobicContact CD2-CD1 4.27Å; F87-L115 HydrophobicContact CE1-CD1 3.75Å; F87-L115 HydrophobicContact CE1-CD2 4.47Å; F87-L115 HydrophobicContact CE1-CG 3.63Å; F87-L115 HydrophobicContact CE2-CD1 4.43Å; F87-L115 HydrophobicContact CE2-CD2 4.18Å; F87-L115 HydrophobicContact CE2-CG 4.2Å; F87-L115 HydrophobicContact CG-CD1 3.83Å; F87-L115 HydrophobicContact CG-CG 4.43Å; F87-L115 HydrophobicContact CZ-CD1 4.18Å; F87-L115 HydrophobicContact CZ-CD2 4.12Å; F87-L115 HydrophobicContact CZ-CG 3.73Å; L104-L115 HydrophobicContact CD2-CB 4.4Å; L104-L115 HydrophobicContact CD2-CD2 4.21Å; A107-L115 HydrophobicContact CB-CB 3.57Å; A107-L115 HydrophobicContact CB-CD1 4.14Å; I112-L115 HydrophobicContact CG2-CD1 4.45Å; I112-L115 PolarHBondContact O-N 3.08Å; I112-L115 VanDerWaalsContact O-N 3.15Å
116	A	79.4	Confident	68.6	Low	13 Å²	13	87.6 Å²	87.6	11%	0.107	45%	0.446	C	S	.	.	S	Bend	trans	-59.8	137.1	168	0	0	0	0	0	110.2	D108 I112 V118	D108-A116 HydrophobicContact CB-CB 4.35Å; I112-A116 VanDerWaalsContact O-CB 3.25Å; I112-A116 WeakPolarHBondContact O-CB 3.49Å; I112-A116 PolarHBondContact O-N 3.36Å; A116-V118 PolarHBondContact O-N 3.44Å
117	E	63.7	Low	66.8	Low	107 Å²	107	93.5 Å²	93.5	50%	0.5	48%	0.484	S	S	.	.			trans	-70.1	124.2	174.3	-68	-136.4	143.8	0	0	109.8	T119 R258	E117-T119 VanDerWaalsContact C-N 3.29Å; E117-T119 PolarHBondContact O-N 2.79Å; E117-R258 IonicContact OE1-CZ 3.36Å; E117-R258 IonicContact OE1-NE 3.4Å; E117-R258 PolarHBondContact OE1-NE 2.88Å; E117-R258 IonicContact OE1-NH2 2.73Å; E117-R258 PolarHBondContact OE1-NH2 2.99Å; E117-R258 IonicContact OE2-CZ 2.76Å; E117-R258 IonicContact OE2-NH1 3.83Å; E117-R258 IonicContact OE2-NH2 2.74Å; E117-R258 PolarHBondContact OE2-NH2 3.3Å
118	V	47.2	Very low	65	Low	97 Å²	97	98.9 Å²	98.9	59%	0.588	52%	0.519	S	S	*	.			trans	-77.4	84.2	-179.7	-179	0	0	0	0	109.3	A116 W120	A116-V118 PolarHBondContact O-N 3.44Å; V118-W120 HydrophobicContact CG1-CB 4.26Å; V118-W120 HydrophobicContact CG1-CD2 4.39Å; V118-W120 HydrophobicContact CG1-CG 3.68Å; V118-W120 PolarHBondContact O-N 3.36Å
119	T	38.8	Very low	63.3	Low	94 Å²	94	101.4 Å²	101.4	58%	0.577	54%	0.538	S	S	*	.			trans	-72.7	58.5	167	46.4	0	0	0	0	111.3	E117 R121	E117-T119 VanDerWaalsContact C-N 3.29Å; E117-T119 PolarHBondContact O-N 2.79Å; T119-R121 PolarHBondContact O-N 3.33Å
120	W	38.8	Very low	61.5	Low	235 Å²	235	103.5 Å²	103.5	89%	0.89	56%	0.557	S	S	*	*			trans	-76.3	54.4	154.5	-65.9	138.9	0	0	0	109.8	V118	V118-W120 HydrophobicContact CG1-CB 4.26Å; V118-W120 HydrophobicContact CG1-CD2 4.39Å; V118-W120 HydrophobicContact CG1-CG 3.68Å; V118-W120 PolarHBondContact O-N 3.36Å
121	R	34.7	Very low	59.2	Low	214 Å²	214	110.5 Å²	110.5	81%	0.808	59%	0.591	S	S	*	*	S	Bend	trans	-148.5	131.7	166.4	-79.4	-157.5	159.3	-176.8	-9.3	108.2	T119 D123	T119-R121 PolarHBondContact O-N 3.33Å; R121-D123 PolarHBondContact O-N 3.19Å
122	D	35.7	Very low	57	Low	130 Å²	130	111.4 Å²	111.4	70%	0.695	61%	0.613	S	S	*	*			trans	-83.2	111.1	-163.3	-46.9	-98.8	0	0	0	110.2	E124 D125	D122-E124 PolarHBondContact O-N 2.63Å; D122-D125 HydrophobicContact CB-CB 4.41Å; D122-D125 PolarHBondContact O-N 2.66Å
123	D	42.4	Very low	54.2	Low	162 Å²	162	115.8 Å²	115.8	87%	0.866	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	69.2	160.7	-75	-58.3	0	0	0	109.1	R121	R121-D123 PolarHBondContact O-N 3.19Å
124	E	45.4	Very low	51.8	Low	186 Å²	186	115.2 Å²	115.2	87%	0.869	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.2	-25.3	159.5	-103.5	-69.3	80.8	0	0	112	D122	D122-E124 PolarHBondContact O-N 2.63Å
125	D	45.2	Very low	49.6	Very low	140 Å²	140	120.6 Å²	120.6	75%	0.749	68%	0.679	S	S	*	*			trans	-105.2	102.4	-179	-110.4	-48.5	0	0	0	112.1	D122	D122-D125 HydrophobicContact CB-CB 4.41Å; D122-D125 PolarHBondContact O-N 2.66Å
126	G	47.4	Very low	47	Very low	50 Å²	50	128.3 Å²	128.3	52%	0.515	71%	0.711	S	S	.	*	P	Polyproline II helix	trans	-63.1	168.8	173.7	0	0	0	0	0	113.1	P128	G126-P128 VanDerWaalsContact O-CD 3.31Å; G126-P128 WeakPolarHBondContact O-CD 3.34Å
127	P	54.9	Low	45.3	Very low	130 Å²	130	135 Å²	135	84%	0.844	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-57.4	116.4	-179.5	24.7	-33.8	0	0	0	110
128	P	55.6	Low	44.1	Very low	112 Å²	112	133.5 Å²	133.5	73%	0.727	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-62.4	139.3	-173.7	23.2	-33.3	0	0	0	109.6	G126	G126-P128 VanDerWaalsContact O-CD 3.31Å; G126-P128 WeakPolarHBondContact O-CD 3.34Å
129	P	59.7	Low	44	Very low	103 Å²	103	134.4 Å²	134.4	67%	0.669	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-57.8	149.9	177.5	25.9	-34.6	0	0	0	109.8	M131	P129-M131 VanDerWaalsContact C-N 3.28Å; P129-M131 PolarHBondContact O-N 2.86Å
130	P	54.6	Low	44.3	Very low	133 Å²	133	134.4 Å²	134.4	86%	0.864	75%	0.751	S	S	*	*			trans	-68.7	82.9	-173.9	28.4	-35.8	0	0	0	111.4	A132	P130-A132 PolarHBondContact O-N 3.15Å
131	M	45.2	Very low	44.7	Very low	161 Å²	161	131.8 Å²	131.8	79%	0.793	74%	0.741	S	S	*	*			trans	-61	119.2	172.4	-70.3	-155	-62.4	0	0	108.9	P129 A133	P129-M131 VanDerWaalsContact C-N 3.28Å; P129-M131 PolarHBondContact O-N 2.86Å; M131-A133 PolarHBondContact O-N 3.27Å
132	A	46	Very low	45.7	Very low	99 Å²	99	125.2 Å²	125.2	82%	0.818	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	120.3	-178.2	0	0	0	0	0	110.7	P130 A134	P130-A132 PolarHBondContact O-N 3.15Å; A132-A134 PolarHBondContact O-N 3.3Å
133	A	36.6	Very low	46.6	Very low	93 Å²	93	124.8 Å²	124.8	77%	0.769	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	32.6	60.4	162.8	0	0	0	0	0	115.5	M131 E135	M131-A133 PolarHBondContact O-N 3.27Å; A133-E135 PolarHBondContact O-N 3.03Å
134	A	40.6	Very low	47.2	Very low	87 Å²	87	120.5 Å²	120.5	72%	0.719	71%	0.712	S	S	*	*			trans	-60.5	99.7	167.9	0	0	0	0	0	108.8	A132 F136	A132-A134 PolarHBondContact O-N 3.3Å; A134-F136 PolarHBondContact O-N 2.9Å
135	E	40.7	Very low	47.8	Very low	150 Å²	150	115.4 Å²	115.4	70%	0.701	69%	0.688	S	S	*	*			trans	-57.1	139.2	-174.4	-65.4	-175.2	122.3	0	0	110.5	A133 H137	A133-E135 PolarHBondContact O-N 3.03Å; E135-H137 PolarHBondContact O-N 2.86Å; E135-H137 PolarHBondContact O-ND1 3.1Å; E135-H137 IonicContact OE2-CE1 3.42Å; E135-H137 PolarHBondContact OE2-CE1 3.46Å
136	F	34	Very low	48.7	Very low	199 Å²	199	111 Å²	111	87%	0.873	67%	0.668	S	S	*	*			trans	-71.5	69.8	-179.5	-167.2	-94	0	0	0	110.8	A134 S138	A134-F136 PolarHBondContact O-N 2.9Å; F136-S138 VanDerWaalsContact C-N 3.3Å; F136-S138 PolarHBondContact O-N 3.21Å
137	H	44.7	Very low	49.3	Very low	152 Å²	152	116.4 Å²	116.4	70%	0.704	67%	0.674	S	S	*	*			trans	-67.4	90.2	170.1	-82.6	83.9	0	0	0	108.2	E135	E135-H137 PolarHBondContact O-N 2.86Å; E135-H137 PolarHBondContact O-ND1 3.1Å; E135-H137 IonicContact OE2-CE1 3.42Å; E135-H137 PolarHBondContact OE2-CE1 3.46Å
138	S	37.6	Very low	50	Low	76 Å²	76	112.5 Å²	112.5	53%	0.531	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-50.9	131.9	162.1	49.3	0	0	0	0	108.1	F136	F136-S138 VanDerWaalsContact C-N 3.3Å; F136-S138 PolarHBondContact O-N 3.21Å
139	P	44.7	Very low	50.5	Low	116 Å²	116	113.5 Å²	113.5	75%	0.753	65%	0.648	S	S	*	*	S	Bend	trans	-51.2	133.8	-176.3	20.9	-33	0	0	0	109.3	R141	P139-R141 PolarHBondContact O-N 3.35Å
140	P	45.4	Very low	51	Low	95 Å²	95	113.7 Å²	113.7	62%	0.617	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-58	117.9	-158.2	20.4	-33	0	0	0	110.4	S142 L143	P140-S142 PolarHBondContact O-N 3.01Å; P140-L143 PolarHBondContact O-N 3.18Å
141	R	47.3	Very low	51.7	Low	180 Å²	180	113.1 Å²	113.1	68%	0.679	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-23.1	-170	-147.9	178.7	-172.6	-139.9	9.4	112.4	P139 L143 A144 E145	P139-R141 PolarHBondContact O-N 3.35Å; R141-L143 VanDerWaalsContact C-N 3.26Å; R141-L143 PolarHBondContact O-N 3.12Å; R141-L143 VanDerWaalsContact O-N 3.16Å; R141-A144 PolarHBondContact O-N 3.02Å; R141-A144 VanDerWaalsContact O-N 3.11Å; R141-E145 VanDerWaalsContact CB-OE2 3.28Å; R141-E145 WeakPolarHBondContact CB-OE2 3.36Å; R141-E145 WeakPolarHBondContact CD-OE1 3.24Å; R141-E145 VanDerWaalsContact CG-CD 3.49Å; R141-E145 HydrophobicContact CG-CG 4.28Å; R141-E145 WeakPolarHBondContact CG-OE2 3.28Å; R141-E145 IonicContact CZ-OE1 2.72Å; R141-E145 VanDerWaalsContact CZ-OE1 3.26Å; R141-E145 IonicContact NE-OE1 2.72Å; R141-E145 PolarHBondContact NE-OE1 3.3Å; R141-E145 IonicContact NH1-OE1 2.72Å; R141-E145 PolarHBondContact NH1-OE1 2.9Å; R141-E145 WeakPolarHBondContact O-CB 3.44Å; R141-E145 PolarHBondContact O-N 3.47Å
142	S	56.1	Low	52.7	Low	76 Å²	76	110.4 Å²	110.4	53%	0.531	62%	0.62	S	S	.	*	H	α-helix	trans	-51.3	-28.9	174.8	56.2	0	0	0	0	115.7	P140 S146	P140-S142 PolarHBondContact O-N 3.01Å; S142-S146 WeakPolarHBondContact O-CA 3.44Å; S142-S146 WeakPolarHBondContact O-CB 3.33Å; S142-S146 PolarHBondContact O-N 3.38Å; S142-S146 PolarHBondContact O-OG 3.33Å
143	L	54.1	Low	53.9	Low	120 Å²	120	110.7 Å²	110.7	63%	0.628	61%	0.607	S	S	*	*	H	α-helix	trans	-78.1	-33.4	177	-96.3	172.8	0	0	0	113.4	P140 R141 S146	P140-L143 PolarHBondContact O-N 3.18Å; R141-L143 VanDerWaalsContact C-N 3.26Å; R141-L143 PolarHBondContact O-N 3.12Å; R141-L143 VanDerWaalsContact O-N 3.16Å; L143-S146 PolarHBondContact O-OG 2.64Å
144	A	54.5	Low	55.4	Low	72 Å²	72	113 Å²	113	60%	0.595	60%	0.602	S	S	*	*	H	α-helix	trans	-77.6	-35.7	171.4	0	0	0	0	0	110.8	R141 A148	R141-A144 PolarHBondContact O-N 3.02Å; R141-A144 VanDerWaalsContact O-N 3.11Å; A144-A148 WeakPolarHBondContact O-CB 3.47Å; A144-A148 PolarHBondContact O-N 2.93Å; A144-A148 VanDerWaalsContact O-N 3.1Å
145	E	58.5	Low	56.6	Low	79 Å²	79	114 Å²	114	37%	0.369	59%	0.592	S	S	.	*	H	α-helix	trans	-76.3	-24.8	178.3	-72.5	166.2	159.4	0	0	112.4	R141 Q149	R141-E145 VanDerWaalsContact CB-OE2 3.28Å; R141-E145 WeakPolarHBondContact CB-OE2 3.36Å; R141-E145 WeakPolarHBondContact CD-OE1 3.24Å; R141-E145 VanDerWaalsContact CG-CD 3.49Å; R141-E145 HydrophobicContact CG-CG 4.28Å; R141-E145 WeakPolarHBondContact CG-OE2 3.28Å; R141-E145 IonicContact CZ-OE1 2.72Å; R141-E145 VanDerWaalsContact CZ-OE1 3.26Å; R141-E145 IonicContact NE-OE1 2.72Å; R141-E145 PolarHBondContact NE-OE1 3.3Å; R141-E145 IonicContact NH1-OE1 2.72Å; R141-E145 PolarHBondContact NH1-OE1 2.9Å; R141-E145 WeakPolarHBondContact O-CB 3.44Å; R141-E145 PolarHBondContact O-N 3.47Å; E145-Q149 WeakPolarHBondContact O-CB 3.29Å; E145-Q149 WeakPolarHBondContact O-CG 3.32Å; E145-Q149 PolarHBondContact O-N 2.98Å
146	S	64.5	Low	57.7	Low	48 Å²	48	112.7 Å²	112.7	34%	0.336	59%	0.586	S	S	.	*	H	α-helix	trans	-70.1	-46.3	171.4	68.1	0	0	0	0	112	S142 L143 A148 Q149 D150	S142-S146 WeakPolarHBondContact O-CA 3.44Å; S142-S146 WeakPolarHBondContact O-CB 3.33Å; S142-S146 PolarHBondContact O-N 3.38Å; S142-S146 PolarHBondContact O-OG 3.33Å; L143-S146 PolarHBondContact O-OG 2.64Å; S146-A148 VanDerWaalsContact C-N 3.29Å; S146-A148 PolarHBondContact O-N 2.86Å; S146-Q149 PolarHBondContact O-N 3.15Å; S146-Q149 VanDerWaalsContact O-N 3.16Å; S146-D150 PolarHBondContact O-N 3.41Å
147	Y	60.4	Low	59.1	Low	164 Å²	164	111.4 Å²	111.4	64%	0.643	58%	0.582	S	S	*	*	H	α-helix	trans	-64.7	-33.7	174.1	-92.3	-83.6	0	0	0	112.3	L151	Y147-L151 WeakPolarHBondContact O-CD1 3.37Å; Y147-L151 PolarHBondContact O-N 3.49Å
148	A	69.1	Low	59.7	Low	48 Å²	48	111.6 Å²	111.6	40%	0.397	58%	0.584	S	S	.	*	H	α-helix	trans	-67.2	-40.9	171.2	0	0	0	0	0	111.9	A144 S146 I152	A144-A148 WeakPolarHBondContact O-CB 3.47Å; A144-A148 PolarHBondContact O-N 2.93Å; A144-A148 VanDerWaalsContact O-N 3.1Å; S146-A148 VanDerWaalsContact C-N 3.29Å; S146-A148 PolarHBondContact O-N 2.86Å; A148-I152 WeakPolarHBondContact O-CB 3.3Å; A148-I152 WeakPolarHBondContact O-CD1 3.31Å; A148-I152 WeakPolarHBondContact O-CG1 3.46Å; A148-I152 PolarHBondContact O-N 3.09Å
149	Q	66.9	Low	60.6	Low	133 Å²	133	114.6 Å²	114.6	62%	0.621	59%	0.589	S	S	*	*	H	α-helix	trans	-64.9	-42	175.4	-82.4	-178	-20.8	0	0	112.4	E145 S146 L151 I152 L153	E145-Q149 WeakPolarHBondContact O-CB 3.29Å; E145-Q149 WeakPolarHBondContact O-CG 3.32Å; E145-Q149 PolarHBondContact O-N 2.98Å; S146-Q149 PolarHBondContact O-N 3.15Å; S146-Q149 VanDerWaalsContact O-N 3.16Å; Q149-L151 PolarHBondContact O-N 2.94Å; Q149-I152 CarbonylContact O-C 3.5Å; Q149-I152 PolarHBondContact O-N 2.9Å; Q149-I152 VanDerWaalsContact O-N 3.16Å; Q149-L153 WeakPolarHBondContact O-CB 3.38Å; Q149-L153 PolarHBondContact O-N 3.2Å
150	D	68.8	Low	61	Low	107 Å²	107	113.9 Å²	113.9	57%	0.572	58%	0.576	S	S	*	*	H	α-helix	trans	-61.2	-44	177.6	-106.8	-12.5	0	0	0	112.1	S146 I152 L153 Q154	S146-D150 PolarHBondContact O-N 3.41Å; D150-I152 VanDerWaalsContact C-N 3.34Å; D150-I152 PolarHBondContact O-N 3.32Å; D150-L153 PolarHBondContact O-N 3.22Å; D150-Q154 WeakPolarHBondContact O-CB 3.5Å; D150-Q154 PolarHBondContact O-N 3.16Å
151	L	69	Low	61.1	Low	120 Å²	120	118.6 Å²	118.6	63%	0.628	59%	0.589	S	S	*	*	H	α-helix	trans	-64.4	-37.7	174.2	-97.1	76	0	0	0	112.3	Y147 Q149 H155	Y147-L151 WeakPolarHBondContact O-CD1 3.37Å; Y147-L151 PolarHBondContact O-N 3.49Å; Q149-L151 PolarHBondContact O-N 2.94Å; L151-H155 WeakPolarHBondContact O-CB 3.3Å; L151-H155 PolarHBondContact O-N 3.03Å
152	I	67.7	Low	60.9	Low	104 Å²	104	113.2 Å²	113.2	53%	0.533	59%	0.59	S	S	.	*	H	α-helix	trans	-69.3	-39.3	177.5	-70.5	166.1	0	0	0	111	A148 Q149 D150 H155 Q156	A148-I152 WeakPolarHBondContact O-CB 3.3Å; A148-I152 WeakPolarHBondContact O-CD1 3.31Å; A148-I152 WeakPolarHBondContact O-CG1 3.46Å; A148-I152 PolarHBondContact O-N 3.09Å; Q149-I152 CarbonylContact O-C 3.5Å; Q149-I152 PolarHBondContact O-N 2.9Å; Q149-I152 VanDerWaalsContact O-N 3.16Å; D150-I152 VanDerWaalsContact C-N 3.34Å; D150-I152 PolarHBondContact O-N 3.32Å; I152-H155 PolarHBondContact O-N 2.75Å; I152-Q156 WeakPolarHBondContact O-CB 3.26Å; I152-Q156 PolarHBondContact O-N 3.25Å
153	L	69.6	Low	60.3	Low	106 Å²	106	116 Å²	116	56%	0.555	61%	0.607	S	S	*	*	H	α-helix	trans	-64.2	-47.9	175.3	-125.3	70.2	0	0	0	110.9	Q149 D150 H155 Q156 Q157	Q149-L153 WeakPolarHBondContact O-CB 3.38Å; Q149-L153 PolarHBondContact O-N 3.2Å; D150-L153 PolarHBondContact O-N 3.22Å; L153-H155 VanDerWaalsContact C-N 3.31Å; L153-H155 PolarHBondContact O-N 2.99Å; L153-Q156 PolarHBondContact O-N 3.07Å; L153-Q157 WeakPolarHBondContact O-CB 3.21Å; L153-Q157 PolarHBondContact O-N 3.32Å
154	Q	68.6	Low	59.4	Low	141 Å²	141	115.4 Å²	115.4	66%	0.659	62%	0.619	S	S	*	*	H	α-helix	trans	-61.3	-38.9	177.8	-172	176.1	100.6	0	0	111.8	D150	D150-Q154 WeakPolarHBondContact O-CB 3.5Å; D150-Q154 PolarHBondContact O-N 3.16Å
155	H	67.1	Low	59	Low	109 Å²	109	116.3 Å²	116.3	51%	0.505	63%	0.626	S	S	.	*	H	α-helix	trans	-72.3	-40.6	177	-167.6	63.7	0	0	0	112.9	L151 I152 L153 Q157 Q158 Q159	L151-H155 WeakPolarHBondContact O-CB 3.3Å; L151-H155 PolarHBondContact O-N 3.03Å; I152-H155 PolarHBondContact O-N 2.75Å; L153-H155 VanDerWaalsContact C-N 3.31Å; L153-H155 PolarHBondContact O-N 2.99Å; H155-Q157 VanDerWaalsContact C-N 3.29Å; H155-Q157 PolarHBondContact O-N 3.04Å; H155-Q158 PolarHBondContact O-N 3.49Å; H155-Q159 PolarHBondContact NE2-NE2 2.89Å
156	Q	63.7	Low	58.5	Low	122 Å²	122	118.2 Å²	118.2	57%	0.57	65%	0.645	S	S	*	*	H	α-helix	trans	-64.5	-36	178.4	-164.3	-177.5	115.3	0	0	111.6	I152 L153 Q158 Q159	I152-Q156 WeakPolarHBondContact O-CB 3.26Å; I152-Q156 PolarHBondContact O-N 3.25Å; L153-Q156 PolarHBondContact O-N 3.07Å; Q156-Q158 PolarHBondContact O-N 3.06Å; Q156-Q159 PolarHBondContact O-N 2.96Å
157	Q	62.5	Low	57.4	Low	171 Å²	171	121 Å²	121	80%	0.799	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-14.1	179.8	-155.9	168.3	96.6	0	0	113.7	L153 H155	L153-Q157 WeakPolarHBondContact O-CB 3.21Å; L153-Q157 PolarHBondContact O-N 3.32Å; H155-Q157 VanDerWaalsContact C-N 3.29Å; H155-Q157 PolarHBondContact O-N 3.04Å
158	Q	57.2	Low	56.3	Low	157 Å²	157	121.4 Å²	121.4	73%	0.734	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-11.2	174.9	-73.6	-172	-15.3	0	0	114.9	H155 Q156	H155-Q158 PolarHBondContact O-N 3.49Å; Q156-Q158 PolarHBondContact O-N 3.06Å
159	Q	56.1	Low	54.6	Low	139 Å²	139	124.8 Å²	124.8	65%	0.65	69%	0.686	S	S	*	*	S	Bend	trans	-99.2	-2.3	-171.1	-65.4	-162.9	14.4	0	0	116.1	H155 Q156	H155-Q159 PolarHBondContact NE2-NE2 2.89Å; Q156-Q159 PolarHBondContact O-N 2.96Å
160	Q	54.3	Low	53.1	Low	101 Å²	101	126.4 Å²	126.4	47%	0.472	70%	0.698	S	S	.	*			trans	-113.7	22.7	-175.8	-71.2	-173	27.5	0	0	115.6
161	Q	46.9	Very low	51.6	Low	193 Å²	193	129.6 Å²	129.6	90%	0.902	71%	0.709	S	S	*	*			trans	-108.1	82.1	163.6	-69.2	-165	-2.3	0	0	110.8
162	G	43	Very low	50.3	Low	67 Å²	67	128.3 Å²	128.3	69%	0.691	71%	0.71	S	S	*	*			trans	-68.7	174.1	168.3	0	0	0	0	0	113.4
163	P	43.7	Very low	49.2	Very low	136 Å²	136	128.2 Å²	128.2	88%	0.883	72%	0.719	S	S	*	*			trans	-106.5	137.5	-136.8	36.1	-34.2	0	0	0	116.1
164	A	36.3	Very low	48.2	Very low	106 Å²	106	126.5 Å²	126.5	88%	0.876	72%	0.72	S	S	*	*			trans	-145.7	113	151	0	0	0	0	0	109
165	A	44.6	Very low	47.4	Very low	91 Å²	91	122.3 Å²	122.3	75%	0.752	71%	0.71	S	S	*	*			trans	-111.1	-178.3	179	0	0	0	0	0	109.4
166	P	47.8	Very low	46.7	Very low	119 Å²	119	122.1 Å²	122.1	77%	0.773	71%	0.712	S	S	*	*			cis	-128.5	-138	-5	29.8	-3.7	0	0	0	110.6
167	P	43.1	Very low	46.3	Very low	107 Å²	107	121.7 Å²	121.7	70%	0.695	71%	0.713	S	S	*	*				-128.1	149.9	-91.4	38.5	-23.4	0	0	0	114.9
168	L	35.5	Very low	46	Very low	173 Å²	173	119.7 Å²	119.7	91%	0.906	70%	0.703	S	S	*	*			trans	-143.8	97.7	149.4	-85.1	-171.2	0	0	0	113.3
169	N	33.8	Very low	46.3	Very low	119 Å²	119	119.8 Å²	119.8	64%	0.636	70%	0.697	S	S	*	*			trans	43.1	101.4	132.2	-164.9	26.3	0	0	0	119.7	H171	N169-H171 PolarHBondContact OD1-ND1 3.14Å; N169-H171 VanDerWaalsContact OD1-ND1 3.08Å
170	L	35.6	Very low	46.7	Very low	166 Å²	166	116.3 Å²	116.3	87%	0.869	68%	0.683	S	S	*	*			trans	-140.1	54.7	157.1	-149.6	80.1	0	0	0	112.8	S172	L170-S172 PolarHBondContact O-N 3.4Å
171	H	37.7	Very low	47.1	Very low	175 Å²	175	118.7 Å²	118.7	81%	0.81	69%	0.687	S	S	*	*			trans	-75.8	98.6	174.4	-62.3	95.6	0	0	0	111.2	N169	N169-H171 PolarHBondContact OD1-ND1 3.14Å; N169-H171 VanDerWaalsContact OD1-ND1 3.08Å
172	S	40.9	Very low	48.2	Very low	93 Å²	93	115 Å²	115	65%	0.65	67%	0.67	S	S	*	*			trans	-154	-29.3	172.4	-146.2	0	0	0	0	116.7	L170	L170-S172 PolarHBondContact O-N 3.4Å
173	S	45.6	Very low	49.3	Very low	102 Å²	102	118.1 Å²	118.1	71%	0.713	66%	0.661	S	S	*	*	S	Bend	trans	-82.9	-35.8	-166.8	-47.2	0	0	0	0	116.1
174	A	48.4	Very low	50.2	Low	69 Å²	69	117 Å²	117	57%	0.57	64%	0.644	S	S	*	*	H	α-helix	trans	-77	-45.2	-176.6	0	0	0	0	0	112.6	L176 L177 E178	A174-L176 PolarHBondContact O-N 3.26Å; A174-L177 PolarHBondContact O-N 3.25Å; A174-E178 PolarHBondContact O-N 2.98Å
175	A	51.5	Low	51.5	Low	54 Å²	54	120.3 Å²	120.3	45%	0.446	63%	0.634	S	S	.	*	H	α-helix	trans	-63.8	-11.4	-174.5	0	0	0	0	0	114.8	R179	A175-R179 VanDerWaalsContact O-CB 3.28Å; A175-R179 WeakPolarHBondContact O-CB 3.29Å; A175-R179 VanDerWaalsContact O-CG 3.29Å; A175-R179 WeakPolarHBondContact O-CG 3.34Å; A175-R179 PolarHBondContact O-N 3.35Å
176	L	52.6	Low	52.6	Low	105 Å²	105	122 Å²	122	55%	0.55	63%	0.626	S	S	.	*	H	α-helix	trans	-79.1	-44.7	173.3	-163.1	153.3	0	0	0	111.1	A174 E178 R179 D180	A174-L176 PolarHBondContact O-N 3.26Å; L176-E178 VanDerWaalsContact C-N 3.3Å; L176-E178 PolarHBondContact O-N 3.12Å; L176-R179 PolarHBondContact O-N 2.57Å; L176-D180 WeakPolarHBondContact CD2-OD2 3.47Å; L176-D180 PolarHBondContact O-N 3.49Å
177	L	55.5	Low	53.3	Low	112 Å²	112	123.2 Å²	123.2	59%	0.586	62%	0.616	S	S	*	*	H	α-helix	trans	-69.2	-24.6	177.5	-78.6	166.5	0	0	0	113.7	A174	A174-L177 PolarHBondContact O-N 3.25Å
178	E	55.6	Low	54	Low	129 Å²	129	123.4 Å²	123.4	60%	0.603	61%	0.611	S	S	*	*	H	α-helix	trans	-80.9	-44.2	170.9	-73.7	175.6	131.3	0	0	111.3	A174 L176 D180 R181 E182	A174-E178 PolarHBondContact O-N 2.98Å; L176-E178 VanDerWaalsContact C-N 3.3Å; L176-E178 PolarHBondContact O-N 3.12Å; E178-D180 VanDerWaalsContact C-N 3.3Å; E178-D180 PolarHBondContact O-N 2.92Å; E178-R181 PolarHBondContact O-N 3.14Å; E178-R181 VanDerWaalsContact O-N 3.13Å; E178-E182 WeakPolarHBondContact O-CG 3.25Å; E178-E182 PolarHBondContact O-N 3.45Å
179	R	63.8	Low	55.3	Low	160 Å²	160	125.1 Å²	125.1	60%	0.604	61%	0.605	S	S	*	*	H	α-helix	trans	-57.8	-39	174.8	-87.9	179.2	164.2	156.1	-1.2	113.8	A175 L176 E182 R183	A175-R179 VanDerWaalsContact O-CB 3.28Å; A175-R179 WeakPolarHBondContact O-CB 3.29Å; A175-R179 VanDerWaalsContact O-CG 3.29Å; A175-R179 WeakPolarHBondContact O-CG 3.34Å; A175-R179 PolarHBondContact O-N 3.35Å; L176-R179 PolarHBondContact O-N 2.57Å; R179-E182 PolarHBondContact O-N 3.31Å; R179-R183 WeakPolarHBondContact O-CB 3.43Å; R179-R183 WeakPolarHBondContact O-CD 3.37Å; R179-R183 WeakPolarHBondContact O-CG 3.24Å; R179-R183 PolarHBondContact O-N 3.43Å
180	D	64	Low	56.3	Low	66 Å²	66	127 Å²	127	35%	0.353	61%	0.61	S	S	.	*	H	α-helix	trans	-74	-31.4	179.2	-69.5	-22.8	0	0	0	112.1	L176 E178 R183 E184	L176-D180 WeakPolarHBondContact CD2-OD2 3.47Å; L176-D180 PolarHBondContact O-N 3.49Å; E178-D180 VanDerWaalsContact C-N 3.3Å; E178-D180 PolarHBondContact O-N 2.92Å; D180-R183 PolarHBondContact O-N 2.9Å; D180-R183 WeakPolarHBondContact OD1-CD 3.41Å; D180-R183 IonicContact OD1-CZ 3.82Å; D180-R183 IonicContact OD1-NH1 2.8Å; D180-R183 PolarHBondContact OD1-NH1 3.43Å; D180-E184 PolarHBondContact O-N 3.12Å; D180-E184 VanDerWaalsContact O-N 3.12Å
181	R	63.8	Low	57.2	Low	150 Å²	150	129.3 Å²	129.3	57%	0.566	61%	0.607	S	S	*	*	H	α-helix	trans	-68.9	-31.6	168.8	-81	-170.9	169.6	96.8	-1.2	113.7	E178 R185	E178-R181 PolarHBondContact O-N 3.14Å; E178-R181 VanDerWaalsContact O-N 3.13Å; R181-R185 WeakPolarHBondContact O-CG 3.48Å; R181-R185 PolarHBondContact O-N 3.4Å
182	E	69.4	Low	57.7	Low	117 Å²	117	128.1 Å²	128.1	55%	0.547	61%	0.606	S	S	.	*	H	α-helix	trans	-72.1	-44.2	172.6	-71	-177	139	0	0	110.9	E178 R179 E184 R185 E186	E178-E182 WeakPolarHBondContact O-CG 3.25Å; E178-E182 PolarHBondContact O-N 3.45Å; R179-E182 PolarHBondContact O-N 3.31Å; E182-E184 VanDerWaalsContact C-N 3.26Å; E182-E184 PolarHBondContact O-N 2.82Å; E182-R185 PolarHBondContact O-N 2.9Å; E182-R185 VanDerWaalsContact O-N 3.11Å; E182-E186 WeakPolarHBondContact O-CB 3.48Å; E182-E186 PolarHBondContact O-N 3.29Å
183	R	65.6	Low	57.6	Low	131 Å²	131	128.4 Å²	128.4	49%	0.494	61%	0.608	S	S	.	*	H	α-helix	trans	-61.7	-26.3	176	-75.6	164.2	169.4	169.1	-6.7	114.6	R179 D180 R187	R179-R183 WeakPolarHBondContact O-CB 3.43Å; R179-R183 WeakPolarHBondContact O-CD 3.37Å; R179-R183 WeakPolarHBondContact O-CG 3.24Å; R179-R183 PolarHBondContact O-N 3.43Å; D180-R183 PolarHBondContact O-N 2.9Å; D180-R183 WeakPolarHBondContact OD1-CD 3.41Å; D180-R183 IonicContact OD1-CZ 3.82Å; D180-R183 IonicContact OD1-NH1 2.8Å; D180-R183 PolarHBondContact OD1-NH1 3.43Å; R183-R187 WeakPolarHBondContact O-CB 3.45Å; R183-R187 WeakPolarHBondContact O-CG 3.36Å; R183-R187 PolarHBondContact O-N 3.32Å; R183-R187 PolarHBondContact O-NE 2.83Å
184	E	63	Low	57.5	Low	114 Å²	114	129.7 Å²	129.7	53%	0.533	61%	0.614	S	S	.	*	H	α-helix	trans	-71.1	-52	169.7	-73.8	-179.1	150.9	0	0	110.8	D180 E182 E186 R187 D188	D180-E184 PolarHBondContact O-N 3.12Å; D180-E184 VanDerWaalsContact O-N 3.12Å; E182-E184 VanDerWaalsContact C-N 3.26Å; E182-E184 PolarHBondContact O-N 2.82Å; E184-E186 PolarHBondContact O-N 3.28Å; E184-R187 PolarHBondContact O-N 3.23Å; E184-D188 PolarHBondContact O-N 2.92Å
185	R	63.2	Low	56.8	Low	175 Å²	175	130.1 Å²	130.1	66%	0.66	63%	0.625	S	S	*	*	H	α-helix	trans	-59.1	-33.3	177.2	-68.4	171.1	176.9	152.4	-1.4	113.7	R181 E182 R189	R181-R185 WeakPolarHBondContact O-CG 3.48Å; R181-R185 PolarHBondContact O-N 3.4Å; E182-R185 PolarHBondContact O-N 2.9Å; E182-R185 VanDerWaalsContact O-N 3.11Å; R185-R189 WeakPolarHBondContact O-CB 3.14Å; R185-R189 PolarHBondContact O-N 3.3Å
186	E	67.4	Low	56.3	Low	126 Å²	126	135.6 Å²	135.6	59%	0.589	64%	0.643	S	S	*	*	H	α-helix	trans	-73.7	-41.1	179.1	-159.3	157.5	-122.3	0	0	111.2	E182 E184 D188 R189 E190	E182-E186 WeakPolarHBondContact O-CB 3.48Å; E182-E186 PolarHBondContact O-N 3.29Å; E184-E186 PolarHBondContact O-N 3.28Å; E186-D188 PolarHBondContact O-N 3.46Å; E186-R189 WeakPolarHBondContact O-CB 3.35Å; E186-R189 PolarHBondContact O-N 3.44Å; E186-E190 PolarHBondContact O-N 2.92Å
187	R	63	Low	55.7	Low	145 Å²	145	139.6 Å²	139.6	55%	0.547	66%	0.659	S	S	.	*	H	α-helix	trans	-66.4	-33.2	173.9	-77.5	178.5	-69.8	177.3	2.7	113.5	R183 E184 R189 R191	R183-R187 WeakPolarHBondContact O-CB 3.45Å; R183-R187 WeakPolarHBondContact O-CG 3.36Å; R183-R187 PolarHBondContact O-N 3.32Å; R183-R187 PolarHBondContact O-NE 2.83Å; E184-R187 PolarHBondContact O-N 3.23Å; R187-R189 VanDerWaalsContact C-N 3.28Å; R187-R191 PolarHBondContact O-N 3.24Å
188	D	58.1	Low	54.7	Low	110 Å²	110	137.8 Å²	137.8	59%	0.588	67%	0.667	S	S	*	*	H	α-helix	trans	-69	-28.3	171.2	-73.9	-27	0	0	0	112.2	E184 E186	E184-D188 PolarHBondContact O-N 2.92Å; E186-D188 PolarHBondContact O-N 3.46Å
189	R	63.1	Low	54	Low	209 Å²	209	138.8 Å²	138.8	79%	0.789	68%	0.682	S	S	*	*	H	α-helix	trans	-79.1	-40.3	178	-160.9	176.2	-170	120	2.4	112.6	R185 E186 R187 R191 L192	R185-R189 WeakPolarHBondContact O-CB 3.14Å; R185-R189 PolarHBondContact O-N 3.3Å; E186-R189 WeakPolarHBondContact O-CB 3.35Å; E186-R189 PolarHBondContact O-N 3.44Å; R187-R189 VanDerWaalsContact C-N 3.28Å; R189-R191 VanDerWaalsContact C-N 3.28Å; R189-R191 PolarHBondContact O-N 3.2Å; R189-L192 PolarHBondContact O-N 2.95Å
190	E	54.4	Low	52.9	Low	158 Å²	158	139.6 Å²	139.6	74%	0.738	70%	0.697	S	S	*	*	H	α-helix	trans	-68.9	-23	177.8	-70.8	-167.2	130.5	0	0	113.5	E186 L192	E186-E190 PolarHBondContact O-N 2.92Å; E190-L192 PolarHBondContact O-N 3.46Å
191	R	53.7	Low	51.7	Low	215 Å²	215	140 Å²	140	81%	0.811	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-4.4	175	-81.2	-179.5	171.2	-98.8	-0.9	114.7	R187 R189	R187-R191 PolarHBondContact O-N 3.24Å; R189-R191 VanDerWaalsContact C-N 3.28Å; R189-R191 PolarHBondContact O-N 3.2Å
192	L	49.3	Very low	50.6	Low	151 Å²	151	144.4 Å²	144.4	79%	0.791	73%	0.734	S	S	*	*	S	Bend	trans	-120.5	54.5	-173.3	-68.8	173.8	0	0	0	113.2	R189 E190	R189-L192 PolarHBondContact O-N 2.95Å; E190-L192 PolarHBondContact O-N 3.46Å
193	S	38.3	Very low	49.1	Very low	98 Å²	98	147.8 Å²	147.8	69%	0.685	75%	0.752	S	S	*	*			trans	-149.9	111.5	164.2	-164.8	0	0	0	0	112.9
194	P	43	Very low	48.5	Very low	130 Å²	130	147.1 Å²	147.1	84%	0.844	77%	0.765	S	S	*	*			trans	-74.5	131.1	162.7	31.2	-30.7	0	0	0	109.4
195	G	35	Very low	47.5	Very low	77 Å²	77	147.9 Å²	147.9	79%	0.794	78%	0.777	S	S	*	*			trans	-85.2	162.3	-165.3	0	0	0	0	0	116.3
196	M	41.4	Very low	46.5	Very low	170 Å²	170	147.8 Å²	147.8	84%	0.837	79%	0.786	S	S	*	*			trans	-154	168.8	157.1	57.5	-179.5	-177	0	0	109.8
197	E	38.5	Very low	45.3	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	79%	0.793	S	S	*	*			trans	70.2	143.8	177.3	-53.6	-171.2	144.6	0	0	117.2
198	G	34.9	Very low	44.7	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	80%	0.8	S	S	*	*			trans	-165	143.7	177.4	0	0	0	0	0	111.7
199	V	41.3	Very low	43.8	Very low	150 Å²	150	147.8 Å²	147.8	91%	0.909	81%	0.81	S	S	*	*			trans	-140.7	155.8	178.3	162.2	0	0	0	0	109.3
200	L	41.1	Very low	42.4	Very low	177 Å²	177	144.4 Å²	144.4	93%	0.927	81%	0.813	S	S	*	*			trans	-94.4	145.6	-165.6	-57.6	162.2	0	0	0	113.5
201	G	39	Very low	41.7	Very low	76 Å²	76	140.5 Å²	140.5	78%	0.784	82%	0.816	S	S	*	*			trans	142.5	93.3	144.5	0	0	0	0	0	122.5
202	R	40.1	Very low	41	Very low	241 Å²	241	135.1 Å²	135.1	91%	0.909	82%	0.817	S	S	*	*				70.4	84.1	120.5	-157.2	-178.4	-169.3	175	3.5	123.8
203	M	38.6	Very low	40.5	Very low	189 Å²	189	133.8 Å²	133.8	93%	0.931	82%	0.82	S	S	*	*				65.8	157.4	125.9	-75.6	-176.9	157.2	0	0	125.6
204	P	52.4	Low	40.5	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	83%	0.826	S	S	*	*			trans	-131.9	-172.3	-163.7	45.1	-28.2	0	0	0	116.9
205	V	42	Very low	40.3	Very low	130 Å²	130	132.7 Å²	132.7	79%	0.788	83%	0.828	S	S	*	*			trans	-178	131.7	151.7	132.2	0	0	0	0	117.6
206	M	41.4	Very low	40.4	Very low	173 Å²	173	133.7 Å²	133.7	85%	0.852	83%	0.829	S	S	*	*			trans	55.3	156.6	146.1	-65.7	-167	158.9	0	0	126.5
207	T	42.7	Very low	40.1	Very low	118 Å²	118	129.7 Å²	129.7	72%	0.724	83%	0.831	S	S	*	*			cis	-158.2	-144.9	-38.1	-29.3	0	0	0	0	112.7
208	P	49.6	Very low	40.1	Very low	108 Å²	108	128.1 Å²	128.1	70%	0.701	83%	0.834	S	S	*	*			trans	-134.9	-143.9	-150.9	48	-23.5	0	0	0	118.6
209	L	38.9	Very low	40	Very low	154 Å²	154	128.4 Å²	128.4	81%	0.806	84%	0.837	S	S	*	*			trans	101.4	158.7	172.1	-54	173.7	0	0	0	116.3
210	T	35.3	Very low	39.7	Very low	139 Å²	139	126.9 Å²	126.9	85%	0.853	83%	0.833	S	S	*	*			cis	-159.6	161.1	5.3	-14.1	0	0	0	0	113.9
211	G	39.5	Very low	39.4	Very low	76 Å²	76	124.7 Å²	124.7	78%	0.784	83%	0.826	S	S	*	*			trans	89.4	-178.2	157.9	0	0	0	0	0	118.8
212	A	39.7	Very low	39.2	Very low	101 Å²	101	126.7 Å²	126.7	84%	0.835	83%	0.829	S	S	*	*			cis	174.3	158	-34.7	0	0	0	0	0	110.1
213	S	38.6	Very low	38.9	Very low	123 Å²	123	119.4 Å²	119.4	86%	0.86	83%	0.829	S	S	*	*			cis	-169.1	158.5	-31	54.7	0	0	0	0	111.9
214	G	37	Very low	38.8	Very low	78 Å²	78	113.6 Å²	113.6	80%	0.804	82%	0.817	S	S	*	*			trans	103.5	152.8	172.9	0	0	0	0	0	116.7
215	S	39.6	Very low	37.9	Very low	127 Å²	127	115 Å²	115	89%	0.888	82%	0.823	S	S	*	*			cis	106.1	135.2	-1.7	-164.4	0	0	0	0	117.2
216	A	36.6	Very low	37.5	Very low	99 Å²	99	113.3 Å²	113.3	82%	0.818	82%	0.817	S	S	*	*			cis	-172.8	166.2	-21.3	0	0	0	0	0	112
217	G	35.5	Very low	37.2	Very low	85 Å²	85	111.3 Å²	111.3	88%	0.876	81%	0.81	S	S	*	*			trans	171.5	149.3	171.8	0	0	0	0	0	118.3
218	V	37.6	Very low	36.7	Very low	156 Å²	156	113.4 Å²	113.4	95%	0.945	81%	0.811	S	S	*	*			trans	-98.3	161.8	-170	-78	0	0	0	0	116.8
219	G	33.4	Very low	36.2	Very low	79 Å²	79	111.1 Å²	111.1	81%	0.814	81%	0.807	S	S	*	*			trans	157.8	101.1	151	0	0	0	0	0	122.4
220	S	35.1	Very low	36.1	Very low	119 Å²	119	110.5 Å²	110.5	83%	0.832	81%	0.809	S	S	*	*			trans	30.8	116.7	147.4	-79.7	0	0	0	0	127
221	V	35.4	Very low	36.4	Very low	130 Å²	130	108 Å²	108	79%	0.788	80%	0.803	S	S	*	*			trans	32.1	141.8	130.6	-53.6	0	0	0	0	126.3
222	S	34.4	Very low	36.7	Very low	119 Å²	119	109.8 Å²	109.8	83%	0.832	80%	0.801	S	S	*	*				117.8	128.4	127.1	73.2	0	0	0	0	121.3
223	G	34.1	Very low	36.7	Very low	88 Å²	88	111 Å²	111	91%	0.907	80%	0.797	S	S	*	*			trans	75.7	151.2	165.6	0	0	0	0	0	118
224	G	36.2	Very low	36.6	Very low	66 Å²	66	113.7 Å²	113.7	68%	0.68	80%	0.796	S	S	*	*			cis	157	120.1	-14.2	0	0	0	0	0	114.6
225	T	33.6	Very low	36.5	Very low	147 Å²	147	117.5 Å²	117.5	90%	0.902	79%	0.793	S	S	*	*			trans	60.8	141.2	173.6	59.9	0	0	0	0	118
226	S	33.6	Very low	36.3	Very low	95 Å²	95	121.6 Å²	121.6	66%	0.664	80%	0.795	S	S	*	*			cis	103.3	108.3	5.7	-173.3	0	0	0	0	117.4
227	L	35.5	Very low	36.4	Very low	131 Å²	131	124.3 Å²	124.3	69%	0.686	80%	0.795	S	S	*	*			trans	176.8	142.3	137.3	-122.2	70.4	0	0	0	115.3
228	E	32.1	Very low	36.4	Very low	161 Å²	161	123.2 Å²	123.2	75%	0.752	78%	0.784	S	S	*	*			trans	45.2	156.2	145.7	-71.8	176	155.6	0	0	123.8
229	G	37.8	Very low	36.5	Very low	60 Å²	60	122.1 Å²	122.1	62%	0.619	78%	0.78	S	S	*	*			cis	173.6	-162.8	0.4	0	0	0	0	0	113.9
230	V	37.2	Very low	36.5	Very low	141 Å²	141	128.7 Å²	128.7	86%	0.855	79%	0.786	S	S	*	*			trans	74.8	124.3	172.9	-170	0	0	0	0	116.3
231	A	42	Very low	36.5	Very low	87 Å²	87	134.6 Å²	134.6	72%	0.719	79%	0.79	S	S	*	*			cis	91.7	170.2	15.6	0	0	0	0	0	116
232	P	45.9	Very low	36.6	Very low	113 Å²	113	138.4 Å²	138.4	73%	0.734	80%	0.796	S	S	*	*			cis	-135.7	-149.7	-28.1	22.3	5.1	0	0	0	113.2
233	V	40	Very low	36.6	Very low	126 Å²	126	144.9 Å²	144.9	76%	0.764	80%	0.802	S	S	*	*			trans	87.7	136.5	152.9	-179.6	0	0	0	0	116.9
234	E	36.3	Very low	36.6	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	79%	0.792	S	S	*	*			cis	-122.6	178.6	11.7	-88.9	-146.1	138.2	0	0	116
235	H	35.7	Very low	36.5	Very low	159 Å²	159	151.3 Å²	151.3	74%	0.736	80%	0.799	S	S	*	*			trans	-103.8	160.9	178.5	-73.5	-125.3	0	0	0	114.2
236	F	34.5	Very low	36.7	Very low	213 Å²	213	149.6 Å²	149.6	93%	0.934	79%	0.791	S	S	*	*			trans	-152.8	150.5	133.3	-122.3	-82.8	0	0	0	112
237	L	39	Very low	37.1	Very low	156 Å²	156	151.2 Å²	151.2	82%	0.817	80%	0.799	S	S	*	*			trans	-116.6	138.2	-169.9	-84.2	161.7	0	0	0	113.7
238	G	35.4	Very low	37.4	Very low	62 Å²	62	150.9 Å²	150.9	64%	0.639	80%	0.797	S	S	*	*			trans	-116.9	151.1	172.1	0	0	0	0	0	113.2
239	P	38.8	Very low	37.9	Very low	133 Å²	133	148.5 Å²	148.5	86%	0.864	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73	133.9	-165.4	-21.8	35.2	0	0	0	116.3	R241	P239-R241 PolarHBondContact O-N 3.49Å
240	K	33.1	Very low	38.2	Very low	216 Å²	216	153.2 Å²	153.2	94%	0.939	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-60.2	121.9	173.6	-65.3	174.6	179.7	173.7	0	111.9
241	R	36	Very low	38.7	Very low	244 Å²	244	150.2 Å²	150.2	92%	0.921	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-97.4	136.6	158.3	-59	-175.5	94.1	116	-2.3	108.8	P239	P239-R241 PolarHBondContact O-N 3.49Å
242	K	38.4	Very low	38.5	Very low	210 Å²	210	154 Å²	154	91%	0.913	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.1	144.4	-180	-74	-172.6	174.5	-174.1	0	110.8	G244	K242-G244 PolarHBondContact O-N 3.12Å
243	R	33.9	Very low	38.4	Very low	255 Å²	255	153.4 Å²	153.4	96%	0.962	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-58.6	126.1	158	-74.6	-176.1	173.2	-173.3	-2.8	108.4
244	G	33.2	Very low	38.6	Very low	67 Å²	67	151.6 Å²	151.6	69%	0.691	77%	0.767	S	S	*	*			trans	-141.6	164	168.6	0	0	0	0	0	108	K242	K242-G244 PolarHBondContact O-N 3.12Å
245	R	34.2	Very low	39.1	Very low	222 Å²	222	148.6 Å²	148.6	84%	0.838	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-52.8	147.7	176.5	-84.2	-177.8	167.1	-122.7	2.7	110.7
246	P	39.1	Very low	39.5	Very low	111 Å²	111	144.6 Å²	144.6	72%	0.721	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-55.1	147.3	158.9	28.2	-34.5	0	0	0	108.8	L248	P246-L248 PolarHBondContact O-N 3.41Å
247	P	40.6	Very low	40.5	Very low	128 Å²	128	139.8 Å²	139.8	83%	0.831	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-53.2	126.9	172	-23.4	33.9	0	0	0	109.4
248	L	42.1	Very low	40.9	Very low	124 Å²	124	139.2 Å²	139.2	65%	0.649	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-67.5	137.1	167.1	-157.2	67.1	0	0	0	106.3	P246 D250	P246-L248 PolarHBondContact O-N 3.41Å; L248-D250 VanDerWaalsContact C-N 3.33Å; L248-D250 PolarHBondContact O-N 3.31Å
249	D	43.9	Very low	41.5	Very low	112 Å²	112	139.9 Å²	139.9	60%	0.599	70%	0.695	S	S	*	*			trans	-69	94.7	175	-98	-49.8	0	0	0	107.5	R9 A251	R9-D249 IonicContact NH1-OD1 2.59Å; R9-D249 IonicContact NH1-OD2 3.21Å; R9-D249 PolarHBondContact NH1-OD2 2.8Å; D249-A251 PolarHBondContact O-N 3.06Å
250	D	42.5	Very low	42.1	Very low	159 Å²	159	140 Å²	140	85%	0.85	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	17.8	177.7	-67.5	-41.9	0	0	0	113.8	L248	L248-D250 VanDerWaalsContact C-N 3.33Å; L248-D250 PolarHBondContact O-N 3.31Å
251	A	48.5	Very low	43.5	Very low	77 Å²	77	132.4 Å²	132.4	64%	0.636	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-17	-179	0	0	0	0	0	113.8	D249	D249-A251 PolarHBondContact O-N 3.06Å
252	Y	38.5	Very low	44.5	Very low	167 Å²	167	127 Å²	127	66%	0.655	65%	0.651	S	S	*	*			trans	-144.7	72	-179	-83.6	-87.1	0	0	0	112.1	V254	Y252-V254 HydrophobicContact CD1-CG2 4.23Å
253	D	41.9	Very low	45.1	Very low	101 Å²	101	124.2 Å²	124.2	54%	0.54	64%	0.636	S	S	.	*			trans	-97.4	43.8	161.5	-164.3	34.4	0	0	0	110.3	K259	D253-K259 IonicContact OD2-NZ 2.63Å; D253-K259 PolarHBondContact OD2-NZ 3.16Å
254	V	45.9	Very low	46.5	Very low	88 Å²	88	114.6 Å²	114.6	53%	0.533	61%	0.611	S	S	.	*			trans	-75.7	160.3	163.5	-175.7	0	0	0	0	107.6	Y252	Y252-V254 HydrophobicContact CD1-CG2 4.23Å
255	F	46	Very low	48	Very low	117 Å²	117	114.1 Å²	114.1	51%	0.513	60%	0.6	S	S	.	*	S	Bend	trans	72.9	27.5	-174.1	-49.1	-72.4	0	0	0	116.5	F87 G91	F87-F255 AromaticContact CE2-CE1 3.85Å; F87-F255 HydrophobicContact CE2-CE1 3.85Å; F87-F255 HydrophobicContact CZ-CD1 4.17Å; F87-F255 AromaticContact CZ-CE1 3.71Å; F87-F255 HydrophobicContact CZ-CE1 3.71Å; G91-F255 VanDerWaalsContact O-CE1 3.26Å; G91-F255 WeakPolarHBondContact O-CE1 3.21Å; G91-F255 VanDerWaalsContact O-CZ 3.3Å; G91-F255 WeakPolarHBondContact O-CZ 3.49Å
256	N	44.9	Very low	49.6	Very low	74 Å²	74	110.1 Å²	110.1	40%	0.396	60%	0.596	S	S	.	*			trans	-122	67.6	160.5	-151.4	-33.3	0	0	0	111.8	R258 K259 L260	N256-R258 PolarHBondContact O-N 3.31Å; N256-K259 HydrophobicContact CB-CB 3.8Å; N256-K259 HydrophobicContact CB-CD 4.17Å; N256-K259 VanDerWaalsContact CG-CB 3.43Å; N256-K259 WeakPolarHBondContact O-CB 3.37Å; N256-K259 PolarHBondContact O-N 2.87Å; N256-K259 VanDerWaalsContact OD1-CB 3.31Å; N256-K259 WeakPolarHBondContact OD1-CB 3.33Å; N256-K259 PolarHBondContact OD1-N 3.06Å; N256-K259 VanDerWaalsContact OD1-N 3.14Å; N256-L260 PolarHBondContact O-N 2.96Å
257	V	53.7	Low	51.1	Low	112 Å²	112	107 Å²	107	68%	0.679	57%	0.572	S	S	*	*	H	α-helix	trans	-54.4	-39.1	179.7	-177.5	0	0	0	0	111.3	L260 A261	V257-L260 PolarHBondContact O-N 2.8Å; V257-A261 WeakPolarHBondContact O-CB 3.13Å; V257-A261 PolarHBondContact O-N 2.62Å
258	R	47.4	Very low	52.5	Low	144 Å²	144	106.6 Å²	106.6	54%	0.543	56%	0.56	S	S	.	*	H	α-helix	trans	-63.1	-40.3	174.7	-78.3	179.1	165.3	-171.4	-14.1	113.1	E117 N256 A261 Q262	E117-R258 IonicContact OE1-CZ 3.36Å; E117-R258 IonicContact OE1-NE 3.4Å; E117-R258 PolarHBondContact OE1-NE 2.88Å; E117-R258 IonicContact OE1-NH2 2.73Å; E117-R258 PolarHBondContact OE1-NH2 2.99Å; E117-R258 IonicContact OE2-CZ 2.76Å; E117-R258 IonicContact OE2-NH1 3.83Å; E117-R258 IonicContact OE2-NH2 2.74Å; E117-R258 PolarHBondContact OE2-NH2 3.3Å; N256-R258 PolarHBondContact O-N 3.31Å; R258-A261 PolarHBondContact O-N 3.44Å; R258-Q262 WeakPolarHBondContact O-CB 3.32Å; R258-Q262 WeakPolarHBondContact O-CG 3.37Å; R258-Q262 PolarHBondContact O-N 2.83Å
259	K	49.9	Very low	53.8	Low	76 Å²	76	105 Å²	105	33%	0.33	56%	0.556	S	S	.	*	H	α-helix	trans	-65.8	-40.1	175.4	-167	-179.6	-174.1	-175.3	0	111.2	D253 N256 Q262 Y263	D253-K259 IonicContact OD2-NZ 2.63Å; D253-K259 PolarHBondContact OD2-NZ 3.16Å; N256-K259 HydrophobicContact CB-CB 3.8Å; N256-K259 HydrophobicContact CB-CD 4.17Å; N256-K259 VanDerWaalsContact CG-CB 3.43Å; N256-K259 WeakPolarHBondContact O-CB 3.37Å; N256-K259 PolarHBondContact O-N 2.87Å; N256-K259 VanDerWaalsContact OD1-CB 3.31Å; N256-K259 WeakPolarHBondContact OD1-CB 3.33Å; N256-K259 PolarHBondContact OD1-N 3.06Å; N256-K259 VanDerWaalsContact OD1-N 3.14Å; K259-Q262 PolarHBondContact O-N 3.31Å; K259-Y263 HydrophobicContact CG-CD2 4.28Å; K259-Y263 HydrophobicContact CG-CE2 3.84Å; K259-Y263 WeakPolarHBondContact O-CD2 3.36Å; K259-Y263 PolarHBondContact O-N 3.46Å
260	L	51.2	Low	54.9	Low	137 Å²	137	103 Å²	103	72%	0.717	56%	0.556	S	S	*	*	H	α-helix	trans	-66.2	-42.9	174.2	-144.8	105.4	0	0	0	111.9	N256 V257 Y263 A264	N256-L260 PolarHBondContact O-N 2.96Å; V257-L260 PolarHBondContact O-N 2.8Å; L260-Y263 PolarHBondContact O-N 2.97Å; L260-A264 WeakPolarHBondContact O-CB 3.32Å; L260-A264 PolarHBondContact O-N 3.37Å
261	A	60.9	Low	56	Low	56 Å²	56	100.4 Å²	100.4	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-37.8	175	0	0	0	0	0	112.4	V257 R258 A264 A265	V257-A261 WeakPolarHBondContact O-CB 3.13Å; V257-A261 PolarHBondContact O-N 2.62Å; R258-A261 PolarHBondContact O-N 3.44Å; A261-A264 PolarHBondContact O-N 2.82Å; A261-A265 VanDerWaalsContact O-CB 3.27Å; A261-A265 WeakPolarHBondContact O-CB 3.44Å; A261-A265 PolarHBondContact O-N 3.4Å
262	Q	57.4	Low	56.9	Low	129 Å²	129	101.6 Å²	101.6	60%	0.603	53%	0.526	S	S	*	.	H	α-helix	trans	-68.8	-36.4	173.6	-78.5	179.4	-22.5	0	0	112.5	R258 K259 A265 N266	R258-Q262 WeakPolarHBondContact O-CB 3.32Å; R258-Q262 WeakPolarHBondContact O-CG 3.37Å; R258-Q262 PolarHBondContact O-N 2.83Å; K259-Q262 PolarHBondContact O-N 3.31Å; Q262-A265 PolarHBondContact O-N 3.03Å; Q262-N266 WeakPolarHBondContact O-CB 3.41Å; Q262-N266 PolarHBondContact O-N 3.13Å; Q262-N266 PolarHBondContact O-ND2 3.46Å
263	Y	52	Low	58.4	Low	153 Å²	153	96.2 Å²	96.2	60%	0.6	52%	0.516	S	S	*	.	H	α-helix	trans	-67.2	-40.6	170.7	-75.4	-54.9	0	0	0	111.8	K259 L260 A265 N266 L267	K259-Y263 HydrophobicContact CG-CD2 4.28Å; K259-Y263 HydrophobicContact CG-CE2 3.84Å; K259-Y263 WeakPolarHBondContact O-CD2 3.36Å; K259-Y263 PolarHBondContact O-N 3.46Å; L260-Y263 PolarHBondContact O-N 2.97Å; Y263-A265 VanDerWaalsContact C-N 3.32Å; Y263-A265 PolarHBondContact O-N 3Å; Y263-N266 PolarHBondContact O-N 2.97Å; Y263-L267 WeakPolarHBondContact O-CB 3.32Å; Y263-L267 WeakPolarHBondContact O-CD1 3.37Å; Y263-L267 PolarHBondContact O-N 2.78Å; Y263-L267 VanDerWaalsContact O-N 3.12Å
264	A	62.7	Low	59.5	Low	53 Å²	53	99.1 Å²	99.1	44%	0.438	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-34.2	173.3	0	0	0	0	0	112.8	L260 A261 R272	L260-A264 WeakPolarHBondContact O-CB 3.32Å; L260-A264 PolarHBondContact O-N 3.37Å; A261-A264 PolarHBondContact O-N 2.82Å; A264-R272 PolarHBondContact O-NE 2.75Å; A264-R272 PolarHBondContact O-NH2 2.64Å; A264-R272 VanDerWaalsContact O-NH2 3.08Å
265	A	65.6	Low	60.4	Low	57 Å²	57	99.8 Å²	99.8	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-43.1	176.1	0	0	0	0	0	112.2	A261 Q262 Y263 R272	A261-A265 VanDerWaalsContact O-CB 3.27Å; A261-A265 WeakPolarHBondContact O-CB 3.44Å; A261-A265 PolarHBondContact O-N 3.4Å; Q262-A265 PolarHBondContact O-N 3.03Å; Y263-A265 VanDerWaalsContact C-N 3.32Å; Y263-A265 PolarHBondContact O-N 3Å; A265-R272 PolarHBondContact O-NH1 3.27Å; A265-R272 PolarHBondContact O-NH2 2.95Å
266	N	66.1	Low	61.2	Low	138 Å²	138	99.6 Å²	99.6	74%	0.738	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	5.9	-177.7	-67.7	-62.5	0	0	0	114.3	Q262 Y263	Q262-N266 WeakPolarHBondContact O-CB 3.41Å; Q262-N266 PolarHBondContact O-N 3.13Å; Q262-N266 PolarHBondContact O-ND2 3.46Å; Y263-N266 PolarHBondContact O-N 2.97Å
267	L	70.5	Confident	61.9	Low	44 Å²	44	100.4 Å²	100.4	23%	0.23	53%	0.529	C	S	.	.	S	Bend	trans	-75.3	133.8	-180	-135	74.4	0	0	0	110.9	Y263 Q271 R272 L275	Y263-L267 WeakPolarHBondContact O-CB 3.32Å; Y263-L267 WeakPolarHBondContact O-CD1 3.37Å; Y263-L267 PolarHBondContact O-N 2.78Å; Y263-L267 VanDerWaalsContact O-N 3.12Å; L267-Q271 HydrophobicContact CD2-CB 3.81Å; L267-Q271 HydrophobicContact CG-CB 3.75Å; L267-R272 HydrophobicContact CB-CG 4.14Å; L267-R272 PolarHBondContact O-NH1 2.57Å; L267-L275 HydrophobicContact CD2-CD1 3.57Å
268	E	71	Confident	61.9	Low	121 Å²	121	98.3 Å²	98.3	57%	0.565	52%	0.523	S	S	*	.			trans	-53.1	144	177.5	-112	-77.3	124	0	0	111	A270 Q271 R272	E268-A270 PolarHBondContact O-N 2.89Å; E268-A270 VanDerWaalsContact O-N 3.14Å; E268-Q271 HydrophobicContact CB-CB 4.21Å; E268-Q271 HydrophobicContact CB-CG 3.81Å; E268-Q271 WeakPolarHBondContact O-CA 3.49Å; E268-Q271 WeakPolarHBondContact O-CB 3.27Å; E268-Q271 PolarHBondContact O-N 2.68Å; E268-R272 PolarHBondContact O-N 3.44Å
269	P	68.4	Low	61.8	Low	89 Å²	89	101.4 Å²	101.4	58%	0.578	54%	0.535	S	S	*	.	H	α-helix	trans	-55.1	-36.5	-179	-27.9	36.5	0	0	0	113.3	Q271 R272 A273	P269-Q271 VanDerWaalsContact C-N 3.3Å; P269-Q271 PolarHBondContact O-N 3Å; P269-R272 PolarHBondContact O-N 3.28Å; P269-A273 PolarHBondContact O-N 3.19Å; P269-A273 VanDerWaalsContact O-N 3.1Å
270	A	68.4	Low	61.5	Low	71 Å²	71	105.6 Å²	105.6	59%	0.587	56%	0.556	S	S	*	*	H	α-helix	trans	-66.5	-28.1	174	0	0	0	0	0	113.6	E268 Y274	E268-A270 PolarHBondContact O-N 2.89Å; E268-A270 VanDerWaalsContact O-N 3.14Å; A270-Y274 PolarHBondContact O-N 3.41Å
271	Q	65.4	Low	60.9	Low	105 Å²	105	108.1 Å²	108.1	49%	0.491	56%	0.561	S	S	.	*	H	α-helix	trans	-80.1	-35.8	176.6	-64.4	179.4	-30.4	0	0	111.8	L267 E268 P269 Y274 L275	L267-Q271 HydrophobicContact CD2-CB 3.81Å; L267-Q271 HydrophobicContact CG-CB 3.75Å; E268-Q271 HydrophobicContact CB-CB 4.21Å; E268-Q271 HydrophobicContact CB-CG 3.81Å; E268-Q271 WeakPolarHBondContact O-CA 3.49Å; E268-Q271 WeakPolarHBondContact O-CB 3.27Å; E268-Q271 PolarHBondContact O-N 2.68Å; P269-Q271 VanDerWaalsContact C-N 3.3Å; P269-Q271 PolarHBondContact O-N 3Å; Q271-Y274 PolarHBondContact O-N 3.06Å; Q271-L275 PolarHBondContact O-N 3.47Å
272	R	68.2	Low	59.8	Low	102 Å²	102	111.6 Å²	111.6	39%	0.385	58%	0.577	S	S	.	*	H	α-helix	trans	-59.1	-55.1	169.9	-72.9	176.9	155.7	112	-19.4	110.9	A264 A265 L267 E268 P269 Y274 L275 E276	A264-R272 PolarHBondContact O-NE 2.75Å; A264-R272 PolarHBondContact O-NH2 2.64Å; A264-R272 VanDerWaalsContact O-NH2 3.08Å; A265-R272 PolarHBondContact O-NH1 3.27Å; A265-R272 PolarHBondContact O-NH2 2.95Å; L267-R272 HydrophobicContact CB-CG 4.14Å; L267-R272 PolarHBondContact O-NH1 2.57Å; E268-R272 PolarHBondContact O-N 3.44Å; P269-R272 PolarHBondContact O-N 3.28Å; R272-Y274 PolarHBondContact O-N 3.12Å; R272-Y274 VanDerWaalsContact O-N 3.1Å; R272-L275 WeakPolarHBondContact O-CA 3.46Å; R272-L275 PolarHBondContact O-N 3.42Å; R272-E276 PolarHBondContact O-N 2.78Å
273	A	68.3	Low	58.7	Low	53 Å²	53	114.5 Å²	114.5	44%	0.438	59%	0.59	S	S	.	*	H	α-helix	trans	-55.8	-32.7	179.7	0	0	0	0	0	113.7	P269 T277	P269-A273 PolarHBondContact O-N 3.19Å; P269-A273 VanDerWaalsContact O-N 3.1Å; A273-T277 PolarHBondContact O-N 2.62Å; A273-T277 PolarHBondContact O-OG1 3.41Å
274	Y	66.6	Low	57.8	Low	163 Å²	163	116.4 Å²	116.4	64%	0.639	61%	0.605	S	S	*	*	H	α-helix	trans	-72.1	-28.9	175.8	-161.2	-91.6	0	0	0	113.4	A270 Q271 R272 T277 A278	A270-Y274 PolarHBondContact O-N 3.41Å; Q271-Y274 PolarHBondContact O-N 3.06Å; R272-Y274 PolarHBondContact O-N 3.12Å; R272-Y274 VanDerWaalsContact O-N 3.1Å; Y274-T277 WeakPolarHBondContact CA-OG1 3.27Å; Y274-T277 PolarHBondContact O-OG1 3.49Å; Y274-A278 WeakPolarHBondContact O-CB 3.42Å; Y274-A278 PolarHBondContact O-N 2.99Å
275	L	65	Low	56.8	Low	101 Å²	101	119 Å²	119	53%	0.529	62%	0.617	S	S	.	*	H	α-helix	trans	-83.8	-35.8	173.6	-67.2	173.6	0	0	0	112.1	L267 Q271 R272 A278 R279	L267-L275 HydrophobicContact CD2-CD1 3.57Å; Q271-L275 PolarHBondContact O-N 3.47Å; R272-L275 WeakPolarHBondContact O-CA 3.46Å; R272-L275 PolarHBondContact O-N 3.42Å; L275-A278 PolarHBondContact O-N 2.9Å; L275-R279 PolarHBondContact O-N 3.08Å
276	E	61.8	Low	55.5	Low	114 Å²	114	122.4 Å²	122.4	53%	0.533	63%	0.634	S	S	.	*	H	α-helix	trans	-55.5	-51.6	169.2	-115.6	75.2	-114.1	0	0	110.8	R272 A278 R279 H280	R272-E276 PolarHBondContact O-N 2.78Å; E276-A278 VanDerWaalsContact C-N 3.31Å; E276-A278 PolarHBondContact O-N 3Å; E276-R279 PolarHBondContact O-N 2.88Å; E276-H280 PolarHBondContact O-N 3.3Å
277	T	59.8	Low	53.8	Low	91 Å²	91	124.6 Å²	124.6	56%	0.558	65%	0.645	S	S	*	*	H	α-helix	trans	-67.6	-28.5	179.2	44.3	0	0	0	0	113.2	A273 Y274 R279 H280	A273-T277 PolarHBondContact O-N 2.62Å; A273-T277 PolarHBondContact O-OG1 3.41Å; Y274-T277 WeakPolarHBondContact CA-OG1 3.27Å; Y274-T277 PolarHBondContact O-OG1 3.49Å; T277-R279 VanDerWaalsContact C-N 3.27Å; T277-R279 PolarHBondContact O-N 3.31Å; T277-H280 PolarHBondContact O-N 2.94Å
278	A	53.3	Low	52.3	Low	67 Å²	67	127.1 Å²	127.1	55%	0.554	67%	0.673	S	S	*	*	H	α-helix	trans	-70.1	-20.5	171.9	0	0	0	0	0	113.6	Y274 L275 E276	Y274-A278 WeakPolarHBondContact O-CB 3.42Å; Y274-A278 PolarHBondContact O-N 2.99Å; L275-A278 PolarHBondContact O-N 2.9Å; E276-A278 VanDerWaalsContact C-N 3.31Å; E276-A278 PolarHBondContact O-N 3Å
279	R	46.1	Very low	50.5	Low	209 Å²	209	125.7 Å²	125.7	79%	0.789	68%	0.681	S	S	*	*	H	α-helix	trans	-86	-15.2	174.6	-77.7	-178.5	161.4	-179.4	-7.6	114	L275 E276 T277 F281	L275-R279 PolarHBondContact O-N 3.08Å; E276-R279 PolarHBondContact O-N 2.88Å; T277-R279 VanDerWaalsContact C-N 3.27Å; T277-R279 PolarHBondContact O-N 3.31Å; R279-F281 VanDerWaalsContact C-N 3.29Å; R279-F281 PolarHBondContact O-N 3.24Å
280	H	43.8	Very low	48.8	Very low	165 Å²	165	130.6 Å²	130.6	76%	0.764	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	13.6	-176.1	-109.7	-68	0	0	0	115.5	E276 T277	E276-H280 PolarHBondContact O-N 3.3Å; T277-H280 PolarHBondContact O-N 2.94Å
281	F	38.1	Very low	47.2	Very low	189 Å²	189	132.4 Å²	132.4	83%	0.829	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	12.7	-175.3	-116.4	-80.9	0	0	0	114.9	R279	R279-F281 VanDerWaalsContact C-N 3.29Å; R279-F281 PolarHBondContact O-N 3.24Å
282	T	37.8	Very low	45.6	Very low	129 Å²	129	132.3 Å²	132.3	79%	0.791	73%	0.728	S	S	*	*	S	Bend	trans	-150.2	48.5	-177.5	-37.9	0	0	0	0	113.9
283	E	35.2	Very low	44.1	Very low	191 Å²	191	133.3 Å²	133.3	89%	0.893	75%	0.751	S	S	*	*			trans	-148.2	150.9	151	-78.5	-145.2	141.9	0	0	110.2
284	E	32	Very low	42.5	Very low	192 Å²	192	139.8 Å²	139.8	90%	0.897	78%	0.775	S	S	*	*			trans	-111	110.5	-174.3	-179.7	-176.6	-161.9	0	0	111.1
285	P	41.9	Very low	41.4	Very low	108 Å²	108	136.8 Å²	136.8	70%	0.701	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-92.9	144.8	171.2	34.3	-31.7	0	0	0	112
286	P	37.2	Very low	40.2	Very low	128 Å²	128	137.4 Å²	137.4	83%	0.831	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.9	161.3	-174.3	29.9	-35.8	0	0	0	114.7
287	L	32.2	Very low	39.4	Very low	184 Å²	184	137.7 Å²	137.7	96%	0.963	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65	127.1	-170.3	-60.2	167.4	0	0	0	114.6
288	A	37.8	Very low	38.7	Very low	98 Å²	98	139.4 Å²	139.4	81%	0.81	82%	0.821	S	S	*	*			trans	-145.9	105.8	166.4	0	0	0	0	0	113.7
289	A	33.3	Very low	38.1	Very low	90 Å²	90	140.5 Å²	140.5	74%	0.744	83%	0.83	S	S	*	*			trans	22.5	124.3	149.2	0	0	0	0	0	122.8
290	H	33.4	Very low	38	Very low	192 Å²	192	134.6 Å²	134.6	89%	0.889	83%	0.826	S	S	*	*			trans	46.7	108.2	135.4	-63	-81.1	0	0	0	121.5
291	A	34.7	Very low	38.2	Very low	109 Å²	109	129.5 Å²	129.5	90%	0.901	81%	0.808	S	S	*	*				-168.8	152.3	113.4	0	0	0	0	0	110.6
292	A	31.8	Very low	39.4	Very low	104 Å²	104	124 Å²	124	86%	0.86	79%	0.791	S	S	*	*			trans	-112.3	135.1	177.9	0	0	0	0	0	111.6
293	S	35.7	Very low	40.5	Very low	123 Å²	123	123.1 Å²	123.1	86%	0.86	79%	0.787	S	S	*	*			trans	-156.5	156.2	157	-164.3	0	0	0	0	111.2
294	M	34.6	Very low	41.9	Very low	189 Å²	189	122.4 Å²	122.4	93%	0.931	78%	0.781	S	S	*	*			trans	-79.7	123.6	-170.9	-65.6	-73.5	-179.2	0	0	112.4
295	A	43.3	Very low	43.8	Very low	99 Å²	99	118.4 Å²	118.4	82%	0.818	76%	0.763	S	S	*	*			trans	-150.1	146.2	166.9	0	0	0	0	0	112
296	S	40.4	Very low	45.3	Very low	114 Å²	114	121.2 Å²	121.2	80%	0.797	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-73.4	145.2	-170.4	-56.1	0	0	0	0	114.4
297	P	44.8	Very low	47.3	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-73.6	137	177.1	29.7	-34.6	0	0	0	112.7
298	P	45.7	Very low	49.4	Very low	128 Å²	128	122.7 Å²	122.7	83%	0.831	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-75.2	161.6	178.7	30.5	-35	0	0	0	113.4	A300	P298-A300 PolarHBondContact O-N 2.97Å
299	A	39.8	Very low	51.4	Low	90 Å²	90	123 Å²	123	74%	0.744	73%	0.729	S	S	*	*			trans	-90.7	101.6	-163.7	0	0	0	0	0	114.9
300	A	44.8	Very low	53.5	Low	85 Å²	85	127.5 Å²	127.5	70%	0.702	73%	0.727	S	S	*	*			trans	-129.2	75.9	169.5	0	0	0	0	0	111.8	P298	P298-A300 PolarHBondContact O-N 2.97Å
301	C	48.8	Very low	55.9	Low	58 Å²	58	124 Å²	124	39%	0.392	71%	0.71	S	S	.	*			trans	-134.2	126.5	179.9	-149.1	0	0	0	0	111
302	P	63	Low	58.4	Low	73 Å²	73	124 Å²	124	47%	0.474	69%	0.692	S	S	.	*			trans	-64	150.1	-174.6	24.7	-32.9	0	0	0	111.6	K304 Q305 R306	P302-K304 VanDerWaalsContact C-N 3.3Å; P302-K304 PolarHBondContact O-N 3.21Å; P302-K304 VanDerWaalsContact O-N 3.11Å; P302-Q305 HydrophobicContact CG-CB 3.91Å; P302-Q305 WeakPolarHBondContact O-CA 3.47Å; P302-Q305 WeakPolarHBondContact O-CB 3.38Å; P302-Q305 PolarHBondContact O-N 2.8Å; P302-R306 PolarHBondContact O-N 2.71Å
303	P	59.6	Low	61	Low	110 Å²	110	124.8 Å²	124.8	71%	0.714	68%	0.678	S	S	*	*	H	α-helix	trans	-58.3	-36.6	-164.6	18	-31.4	0	0	0	114.2	Q305 R306 Q307	P303-Q305 VanDerWaalsContact C-N 3.34Å; P303-Q305 PolarHBondContact O-N 3.21Å; P303-R306 PolarHBondContact O-N 3.42Å; P303-Q307 PolarHBondContact O-N 3.1Å
304	K	64.9	Low	63.3	Low	177 Å²	177	123.8 Å²	123.8	77%	0.77	66%	0.66	S	S	*	*	H	α-helix	trans	-66.6	-32.7	175.2	-68.4	-171.1	174.8	-173	0	113.3	P302 R308	P302-K304 VanDerWaalsContact C-N 3.3Å; P302-K304 PolarHBondContact O-N 3.21Å; P302-K304 VanDerWaalsContact O-N 3.11Å; K304-R308 PolarHBondContact O-N 2.65Å; K304-R308 VanDerWaalsContact O-N 3.11Å
305	Q	73	Confident	65.6	Low	108 Å²	108	120.3 Å²	120.3	51%	0.505	64%	0.641	S	S	.	*	H	α-helix	trans	-78.2	-39.4	177.6	-168	166.5	-18.7	0	0	110.8	P302 P303 Q307 R308 L309	P302-Q305 HydrophobicContact CG-CB 3.91Å; P302-Q305 WeakPolarHBondContact O-CA 3.47Å; P302-Q305 WeakPolarHBondContact O-CB 3.38Å; P302-Q305 PolarHBondContact O-N 2.8Å; P303-Q305 VanDerWaalsContact C-N 3.34Å; P303-Q305 PolarHBondContact O-N 3.21Å; Q305-Q307 PolarHBondContact O-N 3.23Å; Q305-R308 PolarHBondContact O-N 3.33Å; Q305-L309 PolarHBondContact O-N 2.9Å
306	R	73	Confident	67.4	Low	167 Å²	167	121.3 Å²	121.3	63%	0.63	63%	0.629	S	S	*	*	H	α-helix	trans	-58.6	-36.4	170.4	-158.2	178	-163.1	-175.5	6.9	112.1	P302 P303 R310	P302-R306 PolarHBondContact O-N 2.71Å; P303-R306 PolarHBondContact O-N 3.42Å; R306-R310 PolarHBondContact O-N 3.37Å; R306-R310 VanDerWaalsContact O-N 3.09Å
307	Q	78.4	Confident	69.3	Low	142 Å²	142	120.6 Å²	120.6	66%	0.664	61%	0.613	S	S	*	*	H	α-helix	trans	-70.8	-42.1	175	-167.4	170.6	6.2	0	0	112.8	P303 Q305 L309 R310 H311	P303-Q307 PolarHBondContact O-N 3.1Å; Q305-Q307 PolarHBondContact O-N 3.23Å; Q307-L309 PolarHBondContact O-N 3.27Å; Q307-R310 PolarHBondContact O-N 3.1Å; Q307-H311 PolarHBondContact O-N 3.42Å; Q307-H311 VanDerWaalsContact O-N 3.07Å
308	R	77.1	Confident	70.9	Confident	200 Å²	200	121.1 Å²	121.1	76%	0.755	61%	0.605	S	S	*	*	H	α-helix	trans	-59.1	-45	171.7	-75.9	-171.8	73.2	-169	2.4	111.9	K304 Q305 R310 H311 Q312	K304-R308 PolarHBondContact O-N 2.65Å; K304-R308 VanDerWaalsContact O-N 3.11Å; Q305-R308 PolarHBondContact O-N 3.33Å; R308-R310 PolarHBondContact O-N 3.12Å; R308-H311 PolarHBondContact O-N 2.98Å; R308-Q312 PolarHBondContact O-N 2.85Å
309	L	80	Confident	72.2	Confident	104 Å²	104	120 Å²	120	55%	0.545	59%	0.591	S	S	.	*	H	α-helix	trans	-62.6	-42	-179.9	-141.5	75.8	0	0	0	111.7	Q305 Q307 H311 Q312 Q313	Q305-L309 PolarHBondContact O-N 2.9Å; Q307-L309 PolarHBondContact O-N 3.27Å; L309-H311 PolarHBondContact O-N 2.91Å; L309-Q312 PolarHBondContact O-N 3.3Å; L309-Q313 WeakPolarHBondContact O-CB 3.28Å; L309-Q313 PolarHBondContact O-N 3.23Å
310	R	77.8	Confident	73.7	Confident	185 Å²	185	121.4 Å²	121.4	70%	0.698	59%	0.586	S	S	*	*	H	α-helix	trans	-61.4	-41.5	173.6	-109.9	-174.7	170.6	-173.5	-4.4	112.8	R306 Q307 R308 Q313 Q314	R306-R310 PolarHBondContact O-N 3.37Å; R306-R310 VanDerWaalsContact O-N 3.09Å; Q307-R310 PolarHBondContact O-N 3.1Å; R308-R310 PolarHBondContact O-N 3.12Å; R310-Q313 PolarHBondContact O-N 3.33Å; R310-Q314 WeakPolarHBondContact O-CG 3.42Å; R310-Q314 PolarHBondContact O-N 3.3Å
311	H	83.6	Confident	74.5	Confident	119 Å²	119	123.1 Å²	123.1	55%	0.551	58%	0.579	S	S	*	*	H	α-helix	trans	-66.8	-41.9	177.7	-121.7	38.6	0	0	0	112.1	Q307 R308 L309 Q313 Q314 Q315	Q307-H311 PolarHBondContact O-N 3.42Å; Q307-H311 VanDerWaalsContact O-N 3.07Å; R308-H311 PolarHBondContact O-N 2.98Å; L309-H311 PolarHBondContact O-N 2.91Å; H311-Q313 PolarHBondContact O-N 3Å; H311-Q314 PolarHBondContact O-N 3.27Å; H311-Q315 WeakPolarHBondContact O-CG 3.24Å; H311-Q315 PolarHBondContact O-N 3.11Å
312	Q	86.6	Confident	74.9	Confident	110 Å²	110	123.7 Å²	123.7	51%	0.514	58%	0.584	S	S	.	*	H	α-helix	trans	-62.6	-41.6	175.6	-170.7	174.5	17.5	0	0	111.9	R308 L309 Q314 Q315 Q316	R308-Q312 PolarHBondContact O-N 2.85Å; L309-Q312 PolarHBondContact O-N 3.3Å; Q312-Q314 VanDerWaalsContact C-N 3.32Å; Q312-Q314 PolarHBondContact O-N 3.42Å; Q312-Q315 PolarHBondContact O-N 3.14Å; Q312-Q316 PolarHBondContact O-N 3.31Å
313	Q	85.3	Confident	74.4	Confident	119 Å²	119	127.2 Å²	127.2	56%	0.556	59%	0.594	S	S	*	*	H	α-helix	trans	-68.9	-28.5	176.2	-165.3	177	41.4	0	0	112.8	L309 R310 H311 Q317	L309-Q313 WeakPolarHBondContact O-CB 3.28Å; L309-Q313 PolarHBondContact O-N 3.23Å; R310-Q313 PolarHBondContact O-N 3.33Å; H311-Q313 PolarHBondContact O-N 3Å; Q313-Q317 PolarHBondContact O-N 2.87Å; Q313-Q317 PolarHBondContact O-NE2 3.46Å
314	Q	84.6	Confident	73.9	Confident	103 Å²	103	126.3 Å²	126.3	48%	0.481	59%	0.59	S	S	.	*	H	α-helix	trans	-73.5	-37.7	171	-76.4	177.6	-46.9	0	0	112.2	R310 H311 Q312 Q317 Q318	R310-Q314 WeakPolarHBondContact O-CG 3.42Å; R310-Q314 PolarHBondContact O-N 3.3Å; H311-Q314 PolarHBondContact O-N 3.27Å; Q312-Q314 VanDerWaalsContact C-N 3.32Å; Q312-Q314 PolarHBondContact O-N 3.42Å; Q314-Q317 PolarHBondContact O-N 2.8Å; Q314-Q318 WeakPolarHBondContact O-CG 3.38Å; Q314-Q318 PolarHBondContact O-N 3.37Å
315	Q	82.8	Confident	72.9	Confident	116 Å²	116	122.4 Å²	122.4	54%	0.542	59%	0.585	S	S	.	*	H	α-helix	trans	-64.2	-42.5	175	-75.1	177	-26.8	0	0	112	H311 Q312 Q317 Q318 L319	H311-Q315 WeakPolarHBondContact O-CG 3.24Å; H311-Q315 PolarHBondContact O-N 3.11Å; Q312-Q315 PolarHBondContact O-N 3.14Å; Q315-Q317 PolarHBondContact O-N 3.1Å; Q315-Q318 PolarHBondContact O-N 3.41Å; Q315-L319 WeakPolarHBondContact O-CD1 3.35Å; Q315-L319 PolarHBondContact O-N 3.01Å
316	Q	81.7	Confident	71.4	Confident	120 Å²	120	124.5 Å²	124.5	56%	0.561	60%	0.6	S	S	*	*	H	α-helix	trans	-62	-40.7	174	-75.5	-178.5	-21.2	0	0	112.7	Q312 Q318 L319 L320	Q312-Q316 PolarHBondContact O-N 3.31Å; Q316-Q318 VanDerWaalsContact C-N 3.28Å; Q316-Q318 PolarHBondContact O-N 3.1Å; Q316-L319 PolarHBondContact O-N 3.39Å; Q316-L320 WeakPolarHBondContact O-CB 3.47Å; Q316-L320 WeakPolarHBondContact O-CG 3.27Å; Q316-L320 PolarHBondContact O-N 3.07Å
317	Q	80.2	Confident	69.8	Low	99 Å²	99	126.3 Å²	126.3	46%	0.463	62%	0.615	S	S	.	*	H	α-helix	trans	-66	-28.8	175	-82.5	167	90.5	0	0	113.3	Q313 Q314 Q315 Q321	Q313-Q317 PolarHBondContact O-N 2.87Å; Q313-Q317 PolarHBondContact O-NE2 3.46Å; Q314-Q317 PolarHBondContact O-N 2.8Å; Q315-Q317 PolarHBondContact O-N 3.1Å; Q317-Q321 WeakPolarHBondContact O-CB 3.48Å; Q317-Q321 VanDerWaalsContact O-CG 3.24Å; Q317-Q321 WeakPolarHBondContact O-CG 3.38Å; Q317-Q321 PolarHBondContact O-N 3.31Å; Q317-Q321 PolarHBondContact O-NE2 3.09Å
318	Q	77.8	Confident	67.8	Low	130 Å²	130	127.3 Å²	127.3	61%	0.607	62%	0.62	S	S	*	*	H	α-helix	trans	-73.8	-43.8	174	-73.9	173.4	19.4	0	0	111.6	Q314 Q315 Q316 L320 Q321 S322	Q314-Q318 WeakPolarHBondContact O-CG 3.38Å; Q314-Q318 PolarHBondContact O-N 3.37Å; Q315-Q318 PolarHBondContact O-N 3.41Å; Q316-Q318 VanDerWaalsContact C-N 3.28Å; Q316-Q318 PolarHBondContact O-N 3.1Å; Q318-L320 PolarHBondContact O-N 2.89Å; Q318-Q321 PolarHBondContact O-N 3.3Å; Q318-Q321 VanDerWaalsContact O-N 3.16Å; Q318-S322 PolarHBondContact O-N 3.18Å; Q318-S322 PolarHBondContact O-OG 3.44Å; Q318-S322 VanDerWaalsContact O-OG 3.12Å
319	L	74.2	Confident	66	Low	105 Å²	105	125.4 Å²	125.4	55%	0.55	62%	0.62	S	S	.	*	H	α-helix	trans	-56	-52.3	173.5	-94.6	73.9	0	0	0	111.1	Q315 Q316 Q321 S322 E323	Q315-L319 WeakPolarHBondContact O-CD1 3.35Å; Q315-L319 PolarHBondContact O-N 3.01Å; Q316-L319 PolarHBondContact O-N 3.39Å; L319-Q321 PolarHBondContact O-N 3.17Å; L319-Q321 VanDerWaalsContact O-N 3.09Å; L319-S322 WeakPolarHBondContact CA-OG 3.39Å; L319-S322 PolarHBondContact O-N 3.29Å; L319-S322 PolarHBondContact O-OG 3.42Å; L319-E323 WeakPolarHBondContact O-CB 3.46Å; L319-E323 WeakPolarHBondContact O-CG 3.42Å; L319-E323 PolarHBondContact O-N 2.96Å
320	L	69.9	Low	64.2	Low	119 Å²	119	125.8 Å²	125.8	62%	0.623	63%	0.628	S	S	*	*	H	α-helix	trans	-61.4	-19.1	179.5	-73.8	164	0	0	0	114.5	Q316 Q318 S324	Q316-L320 WeakPolarHBondContact O-CB 3.47Å; Q316-L320 WeakPolarHBondContact O-CG 3.27Å; Q316-L320 PolarHBondContact O-N 3.07Å; Q318-L320 PolarHBondContact O-N 2.89Å; L320-S324 PolarHBondContact O-OG 3.1Å
321	Q	62.4	Low	62.3	Low	121 Å²	121	121.7 Å²	121.7	57%	0.565	63%	0.634	S	S	*	*	H	α-helix	trans	-93.6	-30.5	174.6	-73.8	170.5	34.1	0	0	112.3	Q317 Q318 L319 S324 S325	Q317-Q321 WeakPolarHBondContact O-CB 3.48Å; Q317-Q321 VanDerWaalsContact O-CG 3.24Å; Q317-Q321 WeakPolarHBondContact O-CG 3.38Å; Q317-Q321 PolarHBondContact O-N 3.31Å; Q317-Q321 PolarHBondContact O-NE2 3.09Å; Q318-Q321 PolarHBondContact O-N 3.3Å; Q318-Q321 VanDerWaalsContact O-N 3.16Å; L319-Q321 PolarHBondContact O-N 3.17Å; L319-Q321 VanDerWaalsContact O-N 3.09Å; Q321-S324 PolarHBondContact O-OG 2.81Å; Q321-S325 PolarHBondContact O-OG 2.76Å
322	S	56.8	Low	60.2	Low	70 Å²	70	121.3 Å²	121.3	49%	0.49	65%	0.651	S	S	.	*	H	α-helix	trans	-69.6	-39	168.5	46.2	0	0	0	0	112.1	Q318 L319 S324 S325	Q318-S322 PolarHBondContact O-N 3.18Å; Q318-S322 PolarHBondContact O-OG 3.44Å; Q318-S322 VanDerWaalsContact O-OG 3.12Å; L319-S322 WeakPolarHBondContact CA-OG 3.39Å; L319-S322 PolarHBondContact O-N 3.29Å; L319-S322 PolarHBondContact O-OG 3.42Å; S322-S324 PolarHBondContact O-N 3.02Å; S322-S325 PolarHBondContact O-N 2.91Å
323	E	52.5	Low	57.9	Low	148 Å²	148	119.4 Å²	119.4	69%	0.692	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-5.3	178.5	-68.5	176.2	104.3	0	0	113.5	L319	L319-E323 WeakPolarHBondContact O-CB 3.46Å; L319-E323 WeakPolarHBondContact O-CG 3.42Å; L319-E323 PolarHBondContact O-N 2.96Å
324	S	49	Very low	55.7	Low	90 Å²	90	122.7 Å²	122.7	63%	0.629	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	13.7	178.6	75.7	0	0	0	0	114.1	L320 Q321 S322	L320-S324 PolarHBondContact O-OG 3.1Å; Q321-S324 PolarHBondContact O-OG 2.81Å; S322-S324 PolarHBondContact O-N 3.02Å
325	S	43.7	Very low	53.4	Low	95 Å²	95	123.7 Å²	123.7	66%	0.664	69%	0.685	S	S	*	*	S	Bend	trans	-117.3	-3.6	-172.8	-63.4	0	0	0	0	114.9	Q321 S322	Q321-S325 PolarHBondContact O-OG 2.76Å; S322-S325 PolarHBondContact O-N 2.91Å
326	D	42.8	Very low	51.1	Low	152 Å²	152	130 Å²	130	81%	0.813	70%	0.704	S	S	*	*	S	Bend	trans	-113	126.6	-179.3	-85.7	-61.7	0	0	0	112.2
327	Q	38.4	Very low	49	Very low	205 Å²	205	128.4 Å²	128.4	96%	0.958	71%	0.706	S	S	*	*			trans	106.5	104.2	165.2	-159.7	151.5	96.3	0	0	117.2
328	E	37.3	Very low	46.9	Very low	163 Å²	163	130.3 Å²	130.3	76%	0.762	72%	0.719	S	S	*	*			trans	-128.7	119.2	-174.3	-173.8	178	130.2	0	0	112.6
329	Q	37.8	Very low	45	Very low	161 Å²	161	131.7 Å²	131.7	75%	0.752	73%	0.73	S	S	*	*			trans	62.9	177.9	156.4	-64	-172.8	38.9	0	0	118.7
330	P	43	Very low	43.1	Very low	112 Å²	112	135 Å²	135	73%	0.727	74%	0.743	S	S	*	*				-138.7	168.4	-70	41.9	-26.9	0	0	0	114.7
331	A	38.9	Very low	42.1	Very low	98 Å²	98	133.4 Å²	133.4	81%	0.81	74%	0.74	S	S	*	*			trans	178.2	135.5	139.2	0	0	0	0	0	115.6
332	A	39.1	Very low	40.7	Very low	111 Å²	111	135.5 Å²	135.5	92%	0.917	76%	0.755	S	S	*	*			trans	28.9	133	145.3	0	0	0	0	0	123.6
333	G	37.4	Very low	39.8	Very low	70 Å²	70	135.3 Å²	135.3	72%	0.722	76%	0.764	S	S	*	*			trans	155.6	82.9	147.6	0	0	0	0	0	118.6
334	Q	39.2	Very low	38.9	Very low	189 Å²	189	134.2 Å²	134.2	88%	0.883	77%	0.773	S	S	*	*			trans	38.9	107.1	151.4	-67.8	163.2	-20.6	0	0	118.8
335	D	35.8	Very low	38.6	Very low	123 Å²	123	134.9 Å²	134.9	66%	0.658	78%	0.783	S	S	*	*				66.9	110.6	73.1	-174	22.5	0	0	0	115	S337	D335-S337 PolarHBondContact OD1-N 3.22Å
336	W	36	Very low	38.3	Very low	250 Å²	250	137.1 Å²	137.1	95%	0.947	79%	0.794	S	S	*	*			trans	-150.3	111.8	132.8	-94.2	100.1	0	0	0	109.4
337	S	36.6	Very low	38.3	Very low	85 Å²	85	135.5 Å²	135.5	59%	0.594	79%	0.791	S	S	*	*			trans	-73.8	160.1	-176.5	57.1	0	0	0	0	115.4	D335	D335-S337 PolarHBondContact OD1-N 3.22Å
338	N	36	Very low	38.2	Very low	139 Å²	139	134.9 Å²	134.9	74%	0.743	79%	0.785	S	S	*	*				-171.2	129.1	128.3	-101.4	-58.4	0	0	0	115.5
339	L	37.4	Very low	38.1	Very low	159 Å²	159	134 Å²	134	83%	0.832	79%	0.785	S	S	*	*			trans	69.7	78.7	141.9	-63.2	163.9	0	0	0	122.1
340	E	35.4	Very low	38.2	Very low	175 Å²	175	133.5 Å²	133.5	82%	0.818	79%	0.787	S	S	*	*			trans	-61.8	-174.5	138.1	-101.5	-149.3	139.8	0	0	113.9
341	P	47.8	Very low	37.9	Very low	86 Å²	86	131.7 Å²	131.7	56%	0.558	78%	0.777	S	S	*	*			cis	-144.9	-155.1	-32.5	38.4	-17.4	0	0	0	114.3
342	N	34.3	Very low	37.9	Very low	164 Å²	164	134.5 Å²	134.5	88%	0.877	78%	0.778	S	S	*	*			trans	98.5	142.9	145.8	-85.6	-26.7	0	0	0	123.1
343	G	37.1	Very low	38.1	Very low	67 Å²	67	133.1 Å²	133.1	69%	0.691	77%	0.774	S	S	*	*			trans	111	78.6	161.2	0	0	0	0	0	116.4
344	S	35	Very low	38.1	Very low	125 Å²	125	137.5 Å²	137.5	87%	0.874	78%	0.782	S	S	*	*				72.3	105.1	62.1	83.9	0	0	0	0	117.1
345	A	41.3	Very low	38.3	Very low	103 Å²	103	132.2 Å²	132.2	85%	0.851	77%	0.77	S	S	*	*			trans	-163.2	159.5	156.6	0	0	0	0	0	111.5
346	T	37.1	Very low	38.4	Very low	143 Å²	143	133.1 Å²	133.1	88%	0.877	78%	0.775	S	S	*	*			trans	-136	165.6	-166.7	33.8	0	0	0	0	114.4
347	P	43.9	Very low	38.5	Very low	117 Å²	117	128 Å²	128	76%	0.76	76%	0.759	S	S	*	*			trans	-103.9	170.3	-165.7	40.2	-37	0	0	0	115.4
348	K	35.7	Very low	38.5	Very low	192 Å²	192	132.5 Å²	132.5	84%	0.835	77%	0.771	S	S	*	*			trans	171.3	174.5	146.2	-101.6	169.2	-179.2	-178.6	0	114.7
349	L	35.8	Very low	38.4	Very low	144 Å²	144	132.1 Å²	132.1	75%	0.754	77%	0.765	S	S	*	*			trans	84.1	127	162.8	-47.3	-174.2	0	0	0	115.4
350	L	39.6	Very low	38.4	Very low	151 Å²	151	131 Å²	131	79%	0.791	76%	0.764	S	S	*	*				115.7	162.9	53.5	-84	-179.9	0	0	0	106.9
351	S	36.4	Very low	38.4	Very low	75 Å²	75	131.6 Å²	131.6	52%	0.524	77%	0.767	S	S	.	*				-162.2	164.3	-52	62.3	0	0	0	0	109.5
352	D	39.1	Very low	37.8	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	78%	0.782	S	S	*	*			trans	64.8	144.7	156.7	-44.7	-47.8	0	0	0	121.8
353	G	42.7	Very low	37.9	Very low	81 Å²	81	127.4 Å²	127.4	84%	0.835	78%	0.779	S	S	*	*			trans	170.9	121	175.8	0	0	0	0	0	111.4
354	D	38.9	Very low	37.7	Very low	163 Å²	163	131.9 Å²	131.9	87%	0.872	79%	0.787	S	S	*	*			trans	-124.6	-177.1	-154.7	-154.7	-19.6	0	0	0	114.1
355	A	42.6	Very low	37.9	Very low	77 Å²	77	133.9 Å²	133.9	64%	0.636	78%	0.782	S	S	*	*			trans	81.7	150.4	167.4	0	0	0	0	0	118.3
356	N	37.7	Very low	37.8	Very low	143 Å²	143	134.1 Å²	134.1	77%	0.765	78%	0.778	S	S	*	*			cis	-177	164	-19.2	-103.6	-41.4	0	0	0	107.8
357	K	39.2	Very low	37.6	Very low	143 Å²	143	135.1 Å²	135.1	62%	0.622	78%	0.777	S	S	*	*			cis	-162.1	-155.7	-27.3	-145.9	-156	-179.1	-148.2	0	107.8	E359	K357-E359 WeakPolarHBondContact CD-OE2 3.19Å; K357-E359 WeakPolarHBondContact CE-OE1 3.49Å; K357-E359 VanDerWaalsContact CE-OE2 3.27Å; K357-E359 WeakPolarHBondContact CE-OE2 3.32Å; K357-E359 IonicContact NZ-OE1 3.16Å; K357-E359 PolarHBondContact NZ-OE1 3.4Å; K357-E359 IonicContact NZ-OE2 3.98Å; K357-E359 PolarHBondContact NZ-OE2 3.12Å
358	Q	36.9	Very low	37.4	Very low	179 Å²	179	136.1 Å²	136.1	84%	0.836	78%	0.783	S	S	*	*			trans	71.2	114.3	175.6	-58.9	180	-41.5	0	0	115.1
359	E	32.9	Very low	37.3	Very low	130 Å²	130	131.2 Å²	131.2	61%	0.607	78%	0.779	S	S	*	*			cis	81.4	126.2	16.3	-53	174.2	138.9	0	0	118.7	K357	K357-E359 WeakPolarHBondContact CD-OE2 3.19Å; K357-E359 WeakPolarHBondContact CE-OE1 3.49Å; K357-E359 VanDerWaalsContact CE-OE2 3.27Å; K357-E359 WeakPolarHBondContact CE-OE2 3.32Å; K357-E359 IonicContact NZ-OE1 3.16Å; K357-E359 PolarHBondContact NZ-OE1 3.4Å; K357-E359 IonicContact NZ-OE2 3.98Å; K357-E359 PolarHBondContact NZ-OE2 3.12Å
360	T	38	Very low	37.3	Very low	135 Å²	135	130.8 Å²	130.8	83%	0.828	78%	0.782	S	S	*	*			trans	130.2	151.7	153.3	52.1	0	0	0	0	114.8
361	E	35.3	Very low	37	Very low	188 Å²	188	130.2 Å²	130.2	88%	0.879	78%	0.779	S	S	*	*			cis	-169.2	155.3	-49.7	-122.4	-174.5	158.9	0	0	111.4
362	G	34.9	Very low	36.7	Very low	84 Å²	84	132.3 Å²	132.3	87%	0.866	79%	0.789	S	S	*	*			trans	71.5	155.5	169.4	0	0	0	0	0	116.7
363	G	36.6	Very low	36.6	Very low	79 Å²	79	131.3 Å²	131.3	81%	0.814	79%	0.789	S	S	*	*			cis	170.3	166.8	-5.4	0	0	0	0	0	106.8
364	D	33	Very low	36.2	Very low	161 Å²	161	131.4 Å²	131.4	86%	0.861	78%	0.781	S	S	*	*			cis	-178.8	-168.5	-11.6	-170	-0.5	0	0	0	104.5
365	E	38.3	Very low	36	Very low	166 Å²	166	128.7 Å²	128.7	78%	0.776	78%	0.775	S	S	*	*			trans	78.2	93.4	163.6	-62.2	-152.5	78.5	0	0	121.1
366	S	38.9	Very low	35.8	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	78%	0.781	S	S	*	*				107.2	132.1	115.1	79.2	0	0	0	0	121.4
367	L	34.3	Very low	35.7	Very low	165 Å²	165	129.5 Å²	129.5	86%	0.864	79%	0.787	S	S	*	*			trans	-124.7	163.7	156.9	-63.8	173	0	0	0	106.7
368	P	39	Very low	35.5	Very low	137 Å²	137	126.4 Å²	126.4	89%	0.89	80%	0.796	S	S	*	*				-149.2	-176.3	102.7	37	-19.2	0	0	0	114.7
369	A	33.1	Very low	35.4	Very low	90 Å²	90	124.3 Å²	124.3	74%	0.744	80%	0.796	S	S	*	*			trans	-121.6	159.1	-171.1	0	0	0	0	0	114.9
370	V	36.2	Very low	35.5	Very low	134 Å²	134	128.1 Å²	128.1	81%	0.812	81%	0.81	S	S	*	*			trans	-142.7	107	168.2	-179.4	0	0	0	0	106.1
371	L	33.9	Very low	35.4	Very low	139 Å²	139	130.5 Å²	130.5	73%	0.728	81%	0.809	S	S	*	*				88.5	115.6	65	-82.3	169.1	0	0	0	115.1
372	T	30.2	Very low	35.5	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	81%	0.813	S	S	*	*			trans	51.8	122.3	151.5	53.4	0	0	0	0	119
373	T	35.4	Very low	35.5	Very low	136 Å²	136	134.2 Å²	134.2	83%	0.834	81%	0.809	S	S	*	*				-172.3	167	67.8	45.2	0	0	0	0	111.7
374	A	35.9	Very low	35.5	Very low	83 Å²	83	137.4 Å²	137.4	69%	0.686	80%	0.8	S	S	*	*			cis	-173.1	168	-23.6	0	0	0	0	0	111.5
375	S	34.4	Very low	35.9	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	80%	0.802	S	S	*	*			trans	48.9	104.2	149	62.6	0	0	0	0	123.8
376	S	36.7	Very low	36.1	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	80%	0.8	S	S	*	*				61.8	123.5	123.7	67.8	0	0	0	0	123.3
377	S	37.1	Very low	36.3	Very low	127 Å²	127	134.1 Å²	134.1	89%	0.888	79%	0.791	S	S	*	*				173.9	171.3	94.7	55.7	0	0	0	0	112.1
378	G	34.9	Very low	36.4	Very low	78 Å²	78	138.2 Å²	138.2	80%	0.804	80%	0.795	S	S	*	*			trans	110.5	52.8	164.1	0	0	0	0	0	118.6	K380	G378-K380 PolarHBondContact O-N 3.14Å
379	T	33.5	Very low	36.6	Very low	136 Å²	136	143.4 Å²	143.4	83%	0.834	80%	0.797	S	S	*	*			trans	-71.4	124.5	172	44.2	0	0	0	0	113
380	K	36.4	Very low	37.1	Very low	209 Å²	209	147.8 Å²	147.8	91%	0.909	80%	0.802	S	S	*	*			trans	-176.8	156.2	149.6	-101.7	143.7	-168.6	171.2	0	112.9	G378	G378-K380 PolarHBondContact O-N 3.14Å
381	K	35.8	Very low	37.3	Very low	186 Å²	186	151.5 Å²	151.5	81%	0.809	80%	0.801	S	S	*	*			trans	79.6	46	163.9	-146.1	167	-167.1	165.5	0	118.9	E383	K381-E383 PolarHBondContact O-N 2.89Å
382	L	36.5	Very low	37.4	Very low	182 Å²	182	153.7 Å²	153.7	95%	0.953	81%	0.807	S	S	*	*			trans	-72.9	57	159.4	-169.5	81.1	0	0	0	111.6
383	E	35.4	Very low	37.6	Very low	167 Å²	167	151.7 Å²	151.7	78%	0.78	81%	0.811	S	S	*	*			trans	-156.6	72.3	-177.8	-153.5	-179.4	-178.8	0	0	113.6	K381	K381-E383 PolarHBondContact O-N 2.89Å
384	K	37.5	Very low	37.9	Very low	147 Å²	147	154.5 Å²	154.5	64%	0.639	81%	0.811	S	S	*	*			trans	-156	13.6	168.6	-145.4	63.7	178.3	168.8	0	116.5	E387	K384-E387 VanDerWaalsContact CE-OE2 3.32Å; K384-E387 WeakPolarHBondContact CE-OE2 3.33Å; K384-E387 IonicContact NZ-OE2 3.78Å; K384-E387 PolarHBondContact NZ-OE2 3.49Å
385	I	41.3	Very low	37.9	Very low	175 Å²	175	158.6 Å²	158.6	90%	0.897	82%	0.821	S	S	*	*	S	Bend	trans	-91	-13.8	-173.7	-75.6	173.1	0	0	0	113.5
386	G	42.3	Very low	38	Very low	72 Å²	72	164.8 Å²	164.8	74%	0.742	83%	0.828	S	S	*	*	S	Bend	trans	-83.5	-35.3	179.5	0	0	0	0	0	116.7	R388	G386-R388 PolarHBondContact O-N 2.97Å
387	E	41.9	Very low	37.8	Very low	118 Å²	118	168.8 Å²	168.8	55%	0.551	83%	0.834	S	S	*	*	G	3₁₀ helix	trans	-77.5	-9.2	-162.6	-82.2	-175.4	95.9	0	0	116.8	K384 R389	K384-E387 VanDerWaalsContact CE-OE2 3.32Å; K384-E387 WeakPolarHBondContact CE-OE2 3.33Å; K384-E387 IonicContact NZ-OE2 3.78Å; K384-E387 PolarHBondContact NZ-OE2 3.49Å; E387-R389 VanDerWaalsContact C-N 3.27Å; E387-R389 PolarHBondContact O-N 3.16Å
388	R	37.5	Very low	37.7	Very low	252 Å²	252	167.9 Å²	167.9	95%	0.951	83%	0.834	S	S	*	*	G	3₁₀ helix	trans	-83.8	8.6	-166.3	-137.7	177.2	-167.3	175.8	3.2	115.2	G386	G386-R388 PolarHBondContact O-N 2.97Å
389	R	43.1	Very low	37.6	Very low	246 Å²	246	175.8 Å²	175.8	93%	0.928	84%	0.839	S	S	*	*	G	3₁₀ helix	trans	-114.4	-0.2	-165.3	-159.5	169	175.8	178.7	-2.1	116	E387	E387-R389 VanDerWaalsContact C-N 3.27Å; E387-R389 PolarHBondContact O-N 3.16Å
390	E	42.6	Very low	37.6	Very low	182 Å²	182	180.6 Å²	180.6	85%	0.85	84%	0.843	S	S	*	*	S	Bend	trans	-127.7	14	-167.1	-163	155.7	-149.6	0	0	116.1
391	R	41.6	Very low	37.6	Very low	212 Å²	212	178.1 Å²	178.1	80%	0.8	84%	0.838	S	S	*	*	S	Bend	trans	-110.9	141.6	176.4	-60.1	-167.5	-173.4	-161.4	3	112.1
392	H	35.2	Very low	37.5	Very low	185 Å²	185	180.6 Å²	180.6	86%	0.856	84%	0.844	S	S	*	*	S	Bend	trans	72.7	34.8	-176.9	-65.7	-81.7	0	0	0	118.2
393	G	34.6	Very low	37.4	Very low	78 Å²	78	178.9 Å²	178.9	80%	0.804	83%	0.831	S	S	*	*			trans	-89.7	20.3	159.5	0	0	0	0	0	115.5
394	K	42.1	Very low	37.3	Very low	195 Å²	195	179.2 Å²	179.2	85%	0.848	83%	0.83	S	S	*	*			trans	-140.4	88.6	-171	-66.2	-174.9	-179.7	179.8	0	113.1
395	L	36	Very low	37.2	Very low	169 Å²	169	178.2 Å²	178.2	89%	0.885	84%	0.842	S	S	*	*			trans	-156.3	49.7	163.6	-140.6	114.2	0	0	0	113.5
396	R	35.2	Very low	36.9	Very low	234 Å²	234	173.5 Å²	173.5	88%	0.883	84%	0.836	S	S	*	*	S	Bend	trans	-139.7	151.7	167	-70.1	-172.2	177.6	-104.1	-1.6	108.9
397	H	33.3	Very low	36.6	Very low	195 Å²	195	178.5 Å²	178.5	90%	0.903	84%	0.84	S	S	*	*			trans	66	91.6	-173.9	-67.4	-97	0	0	0	116.3
398	A	34.5	Very low	36.5	Very low	107 Å²	107	180.4 Å²	180.4	88%	0.884	85%	0.854	S	S	*	*			trans	-158.9	54.1	160.1	0	0	0	0	0	111.8
399	R	33.8	Very low	36.5	Very low	244 Å²	244	176.8 Å²	176.8	92%	0.921	85%	0.848	S	S	*	*			trans	-155.8	66.3	167.2	-158	177.6	-172.1	-174.6	2.1	113
400	R	33.6	Very low	36.6	Very low	238 Å²	238	171.4 Å²	171.4	90%	0.898	84%	0.842	S	S	*	*	S	Bend	trans	-146.2	147.5	159.1	-75.9	-164.8	-179.1	-170	-0	108
401	L	36.1	Very low	36.5	Very low	157 Å²	157	170.2 Å²	170.2	82%	0.822	84%	0.842	S	S	*	*			trans	58.9	104.1	172	-56.1	174.5	0	0	0	115.6
402	Y	33	Very low	37.2	Very low	238 Å²	238	165 Å²	165	93%	0.933	84%	0.836	S	S	*	*			trans	-112.2	113	137.5	-133	-95.8	0	0	0	106.4
403	E	35.6	Very low	37.5	Very low	145 Å²	145	161.4 Å²	161.4	68%	0.678	83%	0.828	S	S	*	*			trans	-65.9	168	160.1	-86.4	-174.8	102	0	0	109.9
404	K	33.7	Very low	37.6	Very low	174 Å²	174	166.4 Å²	166.4	76%	0.757	83%	0.828	S	S	*	*			cis	177.4	116.5	-10.7	160.4	-173.7	172.7	179.9	0	107.1
405	S	35.2	Very low	37.5	Very low	127 Å²	127	166.1 Å²	166.1	89%	0.888	83%	0.83	S	S	*	*			trans	174	146.8	161	48.6	0	0	0	0	110.3
406	G	34.4	Very low	37.7	Very low	75 Å²	75	166.2 Å²	166.2	77%	0.773	83%	0.825	S	S	*	*			trans	128.7	102.1	-176.9	0	0	0	0	0	110
407	E	36.7	Very low	38	Very low	177 Å²	177	159.7 Å²	159.7	83%	0.827	81%	0.813	S	S	*	*			trans	-115.7	-174.8	-169.3	-68.4	164.9	137.3	0	0	110.4
408	D	39.5	Very low	38.1	Very low	159 Å²	159	157.7 Å²	157.7	85%	0.85	81%	0.81	S	S	*	*			trans	71.2	147	175.9	-44.1	-28.7	0	0	0	118.4
409	E	36.9	Very low	38.3	Very low	176 Å²	176	161 Å²	161	82%	0.822	81%	0.807	S	S	*	*			cis	-160.4	173.9	-45.5	-170.5	156	98	0	0	108
410	V	45.1	Very low	38.3	Very low	133 Å²	133	156.7 Å²	156.7	81%	0.806	80%	0.801	S	S	*	*			trans	92.3	125.5	164.7	-168.9	0	0	0	0	116.3
411	D	39.9	Very low	38.4	Very low	156 Å²	156	150.1 Å²	150.1	83%	0.834	79%	0.789	S	S	*	*			trans	-132.1	178.5	-168.3	-128.5	0.2	0	0	0	110.6
412	P	56.3	Low	38.2	Very low	104 Å²	104	151.1 Å²	151.1	68%	0.675	79%	0.79	S	S	*	*			trans	-98.2	-157.6	-161.6	38.8	-36.8	0	0	0	114.6
413	P	42	Very low	38.5	Very low	108 Å²	108	144.6 Å²	144.6	70%	0.701	78%	0.776	S	S	*	*				-155.5	156.5	99.3	39.5	-20.6	0	0	0	119.8
414	K	36.2	Very low	38.3	Very low	183 Å²	183	143.2 Å²	143.2	80%	0.796	78%	0.778	S	S	*	*			trans	56.7	131.8	136	-66.3	171.8	-177.6	-179.1	0	124.3
415	E	40.4	Very low	38.6	Very low	190 Å²	190	142.9 Å²	142.9	89%	0.888	78%	0.779	S	S	*	*				179.1	121.2	110.2	-92.8	169.1	-168.6	0	0	106.3
416	E	39.6	Very low	38.3	Very low	170 Å²	170	145.3 Å²	145.3	79%	0.794	78%	0.776	S	S	*	*			cis	94.1	147.9	44.5	-71.7	-65.4	96.3	0	0	114.4
417	P	42.2	Very low	38.6	Very low	97 Å²	97	149.7 Å²	149.7	63%	0.63	78%	0.78	S	S	*	*			trans	-134	-179	-138.2	44.1	-28.2	0	0	0	116.8
418	D	35.7	Very low	38.3	Very low	154 Å²	154	149.4 Å²	149.4	82%	0.824	78%	0.779	S	S	*	*			trans	-178.8	162.3	151	-95	-31.5	0	0	0	108.7
419	E	38.4	Very low	38	Very low	176 Å²	176	148.5 Å²	148.5	82%	0.822	77%	0.774	S	S	*	*			cis	-146.3	-172.8	0.5	-142.7	-177.6	139.5	0	0	110.8
420	L	34.4	Very low	38	Very low	153 Å²	153	147.2 Å²	147.2	80%	0.801	77%	0.768	S	S	*	*			trans	-141.1	-169.4	-172.3	-91	174.8	0	0	0	109.7
421	P	36	Very low	37.7	Very low	101 Å²	101	149.9 Å²	149.9	66%	0.656	77%	0.771	S	S	*	*			cis	-138.2	-161.2	-35.4	31.7	-8.1	0	0	0	114.5
422	Q	30.8	Very low	37.5	Very low	177 Å²	177	149.1 Å²	149.1	83%	0.827	77%	0.767	S	S	*	*			trans	94.1	157.5	150.1	-64.4	-89.4	-14.3	0	0	121.2
423	P	39.8	Very low	36.6	Very low	101 Å²	101	150.1 Å²	150.1	66%	0.656	77%	0.77	S	S	*	*			trans	-127.4	-134.6	-160.2	45.5	-28.1	0	0	0	114.9
424	V	32.1	Very low	36.2	Very low	116 Å²	116	148.6 Å²	148.6	70%	0.703	77%	0.767	S	S	*	*			trans	71.5	150.1	-178.1	-136.9	0	0	0	0	112.4
425	E	38.8	Very low	36.2	Very low	167 Å²	167	146.6 Å²	146.6	78%	0.78	77%	0.765	S	S	*	*			cis	-130.4	151.8	8.1	-37.6	-133.9	102.7	0	0	109.7
426	E	29.7	Very low	35.8	Very low	178 Å²	178	147.7 Å²	147.7	83%	0.832	76%	0.761	S	S	*	*				41.1	120.6	84.3	-88.5	-179.1	-160.8	0	0	117.1
427	I	40	Very low	35.6	Very low	167 Å²	167	143.2 Å²	143.2	86%	0.856	75%	0.753	S	S	*	*			trans	-171.3	137.2	142.3	-99.7	156	0	0	0	109
428	E	31.2	Very low	35.3	Very low	172 Å²	172	147.3 Å²	147.3	80%	0.804	76%	0.764	S	S	*	*			trans	-99.6	-155.3	-175.9	-55	179.3	114.9	0	0	112.2
429	N	32.9	Very low	35.1	Very low	139 Å²	139	145.2 Å²	145.2	74%	0.743	76%	0.761	S	S	*	*			trans	91.5	109.2	170.5	-49.1	-73.6	0	0	0	115.3
430	E	35.7	Very low	35	Very low	150 Å²	150	142.2 Å²	142.2	70%	0.701	76%	0.757	S	S	*	*				82.7	93.6	60.5	-77.6	-78	116.8	0	0	113.5
431	H	40.2	Very low	34.9	Very low	189 Å²	189	146.4 Å²	146.4	88%	0.875	76%	0.762	S	S	*	*			trans	-161.7	96.5	154.4	-93.1	-72.8	0	0	0	106.7
432	L	34.7	Very low	35	Very low	140 Å²	140	147.2 Å²	147.2	73%	0.733	77%	0.767	S	S	*	*				54.9	129.6	74.9	-122.1	74.7	0	0	0	111.9
433	V	37.3	Very low	35.2	Very low	125 Å²	125	145.3 Å²	145.3	76%	0.758	77%	0.768	S	S	*	*			cis	-146.5	159.7	33.2	173.8	0	0	0	0	112.8
434	A	34.3	Very low	34.8	Very low	75 Å²	75	146.7 Å²	146.7	62%	0.62	77%	0.774	S	S	*	*			trans	-44.5	159	171.6	0	0	0	0	0	116.7
435	N	36.2	Very low	34.9	Very low	142 Å²	142	147.3 Å²	147.3	76%	0.759	78%	0.778	S	S	*	*				-175	168.8	73	-84	-79.4	0	0	0	110.6
436	R	31.3	Very low	34.7	Very low	213 Å²	213	146.4 Å²	146.4	80%	0.804	78%	0.777	S	S	*	*			cis	174.5	140.8	-28.5	170	177.3	167.1	122.8	2.6	106.5
437	A	35.5	Very low	35	Very low	76 Å²	76	143.9 Å²	143.9	63%	0.628	78%	0.776	S	S	*	*			trans	66.5	150.5	170.2	0	0	0	0	0	116.8
438	E	35.7	Very low	34.6	Very low	183 Å²	183	139.8 Å²	139.8	86%	0.855	77%	0.767	S	S	*	*			cis	-154.8	166.5	-8.2	-117.3	155.2	178.8	0	0	111.4
439	S	31.4	Very low	34.8	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	77%	0.766	S	S	*	*			trans	-93	170.1	170.1	-129.1	0	0	0	0	109.8
440	P	37.1	Very low	34.9	Very low	113 Å²	113	140.8 Å²	140.8	73%	0.734	78%	0.776	S	S	*	*			cis	-152.5	167.4	36.3	43.5	-22.4	0	0	0	120
441	R	32.1	Very low	34.8	Very low	241 Å²	241	138 Å²	138	91%	0.909	78%	0.778	S	S	*	*			trans	37.7	160.9	142.1	-77.8	-167.8	174.6	-151.3	-2.5	123.8
442	P	38.5	Very low	34.4	Very low	118 Å²	118	134.8 Å²	134.8	77%	0.766	78%	0.776	S	S	*	*			trans	-105	160.9	-151.7	40.1	-36.3	0	0	0	116.9
443	T	33.9	Very low	34.5	Very low	137 Å²	137	136.3 Å²	136.3	84%	0.84	78%	0.777	S	S	*	*			trans	-140.2	145.5	170.2	-62.7	0	0	0	0	111.3
444	V	32.1	Very low	34.4	Very low	131 Å²	131	139 Å²	139	79%	0.794	78%	0.775	S	S	*	*			trans	-80.8	132.1	177.6	175	0	0	0	0	111.6
445	V	34.8	Very low	34.4	Very low	128 Å²	128	143.3 Å²	143.3	78%	0.776	78%	0.782	S	S	*	*			trans	-143.4	132.4	163.6	-173.2	0	0	0	0	110.8
446	I	34	Very low	34.4	Very low	149 Å²	149	140.2 Å²	140.2	76%	0.764	78%	0.783	S	S	*	*			trans	-98.9	128.8	169.2	-59.8	167.2	0	0	0	108.4
447	P	36.7	Very low	34.7	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	78%	0.78	S	S	*	*			trans	-94.7	115.8	167.9	33.2	-27.7	0	0	0	111.1
448	A	31.5	Very low	34.9	Very low	80 Å²	80	135.9 Å²	135.9	66%	0.661	79%	0.787	S	S	*	*			trans	-105.5	152.1	163.6	0	0	0	0	0	110
449	S	35	Very low	35	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	79%	0.786	S	S	*	*			trans	54.3	125.2	164.7	61.8	0	0	0	0	119.5
450	F	35.9	Very low	35.3	Very low	221 Å²	221	132.7 Å²	132.7	97%	0.969	78%	0.784	S	S	*	*			trans	-145.7	150.4	133.6	-111.7	-78	0	0	0	109.5
451	A	32	Very low	35.3	Very low	90 Å²	90	131.9 Å²	131.9	74%	0.744	79%	0.787	S	S	*	*			trans	-142.6	151.3	-171.2	0	0	0	0	0	112.1
452	C	33.4	Very low	35.4	Very low	122 Å²	122	124.5 Å²	124.5	82%	0.824	79%	0.786	S	S	*	*			trans	176.7	160.3	163.4	-101.5	0	0	0	0	109.3
453	K	35.4	Very low	35.1	Very low	173 Å²	173	123 Å²	123	75%	0.752	79%	0.792	S	S	*	*			cis	-175.2	150.4	-40.7	-128.4	-170.1	177.4	-174.1	0	108.5
454	Y	34.9	Very low	35.1	Very low	182 Å²	182	120.5 Å²	120.5	71%	0.714	79%	0.793	S	S	*	*			trans	68.5	152.2	158.3	-93.1	-128.8	0	0	0	117.4
455	E	34.7	Very low	35	Very low	165 Å²	165	120.6 Å²	120.6	77%	0.771	80%	0.8	S	S	*	*			cis	-158.5	160.5	-7.3	-165.6	166.1	-153.9	0	0	112.3
456	G	37.1	Very low	35	Very low	76 Å²	76	118.4 Å²	118.4	78%	0.784	80%	0.803	S	S	*	*			trans	85.2	138.3	165.4	0	0	0	0	0	115.4
457	G	37.7	Very low	34.9	Very low	71 Å²	71	117.6 Å²	117.6	73%	0.732	81%	0.811	S	S	*	*			cis	125.8	135.9	18.6	0	0	0	0	0	108.2
458	V	39.6	Very low	34.8	Very low	127 Å²	127	115.3 Å²	115.3	77%	0.77	81%	0.81	S	S	*	*			cis	-159.3	159.1	13	-76.5	0	0	0	0	111.4
459	T	36.7	Very low	34.6	Very low	136 Å²	136	118.5 Å²	118.5	83%	0.834	82%	0.821	S	S	*	*			trans	60.8	156.3	156.4	50.9	0	0	0	0	120.1
460	A	38.6	Very low	34.4	Very low	89 Å²	89	117 Å²	117	74%	0.736	82%	0.824	S	S	*	*			cis	-177	163.3	-22.3	0	0	0	0	0	108.8
461	A	36.8	Very low	34.1	Very low	97 Å²	97	113 Å²	113	80%	0.802	82%	0.824	S	S	*	*			cis	-169.8	148.5	-30.4	0	0	0	0	0	109.5
462	G	34.1	Very low	34	Very low	86 Å²	86	111.9 Å²	111.9	89%	0.887	82%	0.82	S	S	*	*			trans	85.5	156.2	176.9	0	0	0	0	0	114.9
463	G	32	Very low	33.9	Very low	86 Å²	86	112 Å²	112	89%	0.887	82%	0.822	S	S	*	*			cis	155.7	137.8	-6.7	0	0	0	0	0	112.1
464	G	33.5	Very low	33.7	Very low	84 Å²	84	112.4 Å²	112.4	87%	0.866	83%	0.832	S	S	*	*			trans	152.8	124.9	174	0	0	0	0	0	114.5
465	S	31.5	Very low	33.6	Very low	134 Å²	134	106.9 Å²	106.9	94%	0.937	83%	0.83	S	S	*	*			trans	-97	151.8	178.5	-50.8	0	0	0	0	111.8
466	G	34.5	Very low	33.6	Very low	82 Å²	82	103.9 Å²	103.9	85%	0.845	83%	0.827	S	S	*	*			trans	-162.7	129.4	171.3	0	0	0	0	0	112.4
467	S	31.2	Very low	33.5	Very low	132 Å²	132	105.6 Å²	105.6	92%	0.923	83%	0.827	S	S	*	*			trans	-99.3	147.8	177.8	-172.9	0	0	0	0	110.8
468	G	33.7	Very low	33.8	Very low	76 Å²	76	109 Å²	109	78%	0.784	82%	0.819	S	S	*	*			trans	-171.2	116.3	178.3	0	0	0	0	0	113.4
469	T	28.2	Very low	34	Very low	147 Å²	147	109.4 Å²	109.4	90%	0.902	82%	0.816	S	S	*	*			trans	-84	141.1	176.5	51.1	0	0	0	0	112.1
470	G	31.1	Very low	34.7	Very low	82 Å²	82	108.2 Å²	108.2	85%	0.845	80%	0.804	S	S	*	*			trans	-164.6	144.1	171.3	0	0	0	0	0	112.9
471	S	29.1	Very low	36	Very low	137 Å²	137	107.3 Å²	107.3	96%	0.958	79%	0.786	S	S	*	*			trans	-115.1	156.3	179.4	-175	0	0	0	0	111.2
472	G	30.1	Very low	37.4	Very low	65 Å²	65	111.8 Å²	111.8	67%	0.67	79%	0.791	S	S	*	*			trans	123.5	104	-179.9	0	0	0	0	0	110.9
473	S	30.3	Very low	38.3	Very low	124 Å²	124	112.8 Å²	112.8	87%	0.867	77%	0.772	S	S	*	*				66.3	83.7	62.6	-172.5	0	0	0	0	113.7
474	L	32	Very low	39.2	Very low	183 Å²	183	111.4 Å²	111.4	96%	0.958	76%	0.758	S	S	*	*			trans	-171.8	136.1	160.4	-98.3	167.3	0	0	0	106.1
475	G	32.5	Very low	40.3	Very low	66 Å²	66	113.4 Å²	113.4	68%	0.68	75%	0.746	S	S	*	*			cis	179.7	109.9	-12.2	0	0	0	0	0	108.1	S477	G475-S477 PolarHBondContact O-N 2.82Å
476	S	36.2	Very low	40.9	Very low	101 Å²	101	112.6 Å²	112.6	71%	0.706	73%	0.73	S	S	*	*			trans	-77.4	109	-173.9	-158.6	0	0	0	0	110.4	Y478	S476-Y478 WeakPolarHBondContact O-CD2 3.47Å; S476-Y478 PolarHBondContact O-N 3.05Å
477	S	35.1	Very low	41.3	Very low	112 Å²	112	114.8 Å²	114.8	78%	0.783	72%	0.72	S	S	*	*			trans	-84.4	105.8	-175.4	-168.4	0	0	0	0	110.6	G475	G475-S477 PolarHBondContact O-N 2.82Å
478	Y	42.1	Very low	41.9	Very low	142 Å²	142	112.8 Å²	112.8	56%	0.557	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-82.6	130.1	174.2	-64.1	-89.4	0	0	0	110.8	S476 L486	S476-Y478 WeakPolarHBondContact O-CD2 3.47Å; S476-Y478 PolarHBondContact O-N 3.05Å; Y478-L486 VanDerWaalsContact CB-CD2 3.44Å; Y478-L486 HydrophobicContact CD1-CD2 4Å; Y478-L486 HydrophobicContact CD2-CD2 4.36Å; Y478-L486 HydrophobicContact CG-CD2 3.7Å
479	L	44.7	Very low	41.9	Very low	136 Å²	136	116.5 Å²	116.5	71%	0.712	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-81.1	124.3	169.2	-65.6	177.7	0	0	0	109.8	M487	L479-M487 PolarHBondContact O-N 3.25Å
480	I	50.9	Low	42.6	Very low	112 Å²	112	118.4 Å²	118.4	57%	0.574	71%	0.707	S	S	*	*	B	Isolated β-bridge	trans	-100.1	132.3	171.8	-70.1	170.7	0	0	0	107.7	L486	I480-L486 HydrophobicContact CG1-CD2 4.22Å; I480-L486 HydrophobicContact CG1-CG 4.45Å
481	N	66.3	Low	42.8	Very low	69 Å²	69	123.2 Å²	123.2	37%	0.369	71%	0.705	S	S	.	*	P	Polyproline II helix	trans	-81	172.6	174.2	67.1	16.9	0	0	0	111.9	H483 G484 M485	N481-H483 PolarHBondContact O-N 2.93Å; N481-H483 WeakPolarHBondContact OD1-CA 3.33Å; N481-H483 PolarHBondContact OD1-N 3.25Å; N481-H483 VanDerWaalsContact OD1-N 3.08Å; N481-G484 PolarHBondContact O-N 3.31Å; N481-G484 PolarHBondContact OD1-N 2.72Å; N481-M485 PolarHBondContact N-O 3.49Å; N481-M485 PolarHBondContact OD1-N 2.72Å; N481-M485 VanDerWaalsContact OD1-N 3.11Å
482	E	65.7	Low	43.1	Very low	191 Å²	191	121.2 Å²	121.2	89%	0.893	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	2.2	178.4	-58.9	-172.9	156.4	0	0	114.8
483	H	53.8	Low	43.4	Very low	108 Å²	108	123.4 Å²	123.4	50%	0.5	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.2	18.6	179.6	-51.8	-23.4	0	0	0	112.3	N481 M485 R655	N481-H483 PolarHBondContact O-N 2.93Å; N481-H483 WeakPolarHBondContact OD1-CA 3.33Å; N481-H483 PolarHBondContact OD1-N 3.25Å; N481-H483 VanDerWaalsContact OD1-N 3.08Å; H483-M485 VanDerWaalsContact C-N 3.3Å; H483-M485 PolarHBondContact O-N 3.22Å; H483-R655 PolarHBondContact CD2-NH1 2.8Å; H483-R655 PolarHBondContact CD2-NH2 3.27Å; H483-R655 VanDerWaalsContact CD2-NH2 3.27Å; H483-R655 PolarHBondContact CE1-NH1 3.21Å; H483-R655 VanDerWaalsContact CE1-NH1 3.25Å; H483-R655 PolarHBondContact ND1-NH1 3.42Å; H483-R655 PolarHBondContact NE2-NH1 3.05Å; H483-R655 VanDerWaalsContact NE2-NH1 3.2Å; H483-R655 PolarHBondContact NE2-NH2 3.34Å
484	G	50.5	Low	43.6	Very low	56 Å²	56	124.7 Å²	124.7	58%	0.577	70%	0.696	S	S	*	*			trans	76.6	7.6	169.8	0	0	0	0	0	115.8	N481	N481-G484 PolarHBondContact O-N 3.31Å; N481-G484 PolarHBondContact OD1-N 2.72Å
485	M	56	Low	43.9	Very low	127 Å²	127	122.9 Å²	122.9	63%	0.626	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-87.9	129.3	-176.8	-68.3	-70.4	-68.3	0	0	111.8	N481 H483	N481-M485 PolarHBondContact N-O 3.49Å; N481-M485 PolarHBondContact OD1-N 2.72Å; N481-M485 VanDerWaalsContact OD1-N 3.11Å; H483-M485 VanDerWaalsContact C-N 3.3Å; H483-M485 PolarHBondContact O-N 3.22Å
486	L	44.1	Very low	43.9	Very low	116 Å²	116	124.5 Å²	124.5	61%	0.607	70%	0.7	S	S	*	*	B	Isolated β-bridge	trans	-72.3	123.5	171.7	-83.6	157.7	0	0	0	111	Y478 I480	Y478-L486 VanDerWaalsContact CB-CD2 3.44Å; Y478-L486 HydrophobicContact CD1-CD2 4Å; Y478-L486 HydrophobicContact CD2-CD2 4.36Å; Y478-L486 HydrophobicContact CG-CD2 3.7Å; I480-L486 HydrophobicContact CG1-CD2 4.22Å; I480-L486 HydrophobicContact CG1-CG 4.45Å
487	M	43.1	Very low	43.7	Very low	128 Å²	128	125 Å²	125	63%	0.631	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-95.1	123.7	172.3	-65	-86.9	-98.2	0	0	109.9	L479	L479-M487 PolarHBondContact O-N 3.25Å
488	A	43.9	Very low	43.7	Very low	90 Å²	90	124 Å²	124	74%	0.744	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-84.6	140.8	171.5	0	0	0	0	0	111
489	H	34	Very low	43.3	Very low	155 Å²	155	122.5 Å²	122.5	72%	0.718	72%	0.719	S	S	*	*			trans	-101.2	95.4	-176	178.2	-66.6	0	0	0	110.8
490	E	42.2	Very low	42.8	Very low	187 Å²	187	120.7 Å²	120.7	87%	0.874	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-89.8	145.9	170.3	-74.2	-157.5	120.5	0	0	112.7
491	F	35.6	Very low	42.3	Very low	182 Å²	182	121.7 Å²	121.7	80%	0.798	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-82.7	135	-174.5	-82.5	-113.9	0	0	0	111.8
492	A	35.4	Very low	40.8	Very low	95 Å²	95	122.9 Å²	122.9	79%	0.785	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-84.1	149	166.2	0	0	0	0	0	111.7
493	P	37.9	Very low	39.4	Very low	112 Å²	112	118.5 Å²	118.5	73%	0.727	75%	0.751	S	S	*	*			trans	-120.2	121.8	148.5	33.9	-24.9	0	0	0	112.4
494	N	33.8	Very low	38.5	Very low	150 Å²	150	119.5 Å²	119.5	80%	0.802	76%	0.764	S	S	*	*			trans	39.2	92.8	150.1	-63.1	-13	0	0	0	120.3
495	V	39.2	Very low	37.9	Very low	145 Å²	145	120.9 Å²	120.9	88%	0.879	77%	0.77	S	S	*	*			trans	-131	70.2	139	-170.3	0	0	0	0	109.1	S497	V495-S497 PolarHBondContact O-N 3.05Å
496	A	31.8	Very low	36.9	Very low	101 Å²	101	121.7 Å²	121.7	84%	0.835	78%	0.782	S	S	*	*			trans	-91	68.1	-173.1	0	0	0	0	0	113.1
497	S	32.3	Very low	36.6	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	79%	0.79	S	S	*	*	S	Bend	trans	-171.3	106.9	160.2	-174.2	0	0	0	0	111.4	V495	V495-S497 PolarHBondContact O-N 3.05Å
498	A	35.4	Very low	36.2	Very low	91 Å²	91	118.7 Å²	118.7	75%	0.752	79%	0.794	S	S	*	*	S	Bend	trans	179.8	-43.6	163.1	0	0	0	0	0	113.3	A500	A498-A500 PolarHBondContact O-N 2.75Å
499	A	33	Very low	35.9	Very low	110 Å²	110	118.9 Å²	118.9	91%	0.909	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	40.3	-151.8	0	0	0	0	0	116
500	A	34.4	Very low	36.1	Very low	97 Å²	97	116.4 Å²	116.4	80%	0.802	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	-3.2	-172.3	0	0	0	0	0	115.8	A498	A498-A500 PolarHBondContact O-N 2.75Å
501	T	39.8	Very low	35.9	Very low	133 Å²	133	111.8 Å²	111.8	82%	0.816	80%	0.796	S	S	*	*	S	Bend	trans	-118.3	3	-162.9	7.6	0	0	0	0	116
502	A	35.4	Very low	35.9	Very low	95 Å²	95	107.5 Å²	107.5	79%	0.785	79%	0.794	S	S	*	*	S	Bend	trans	-96.3	-4.4	-171.2	0	0	0	0	0	115.8
503	A	35.1	Very low	36	Very low	99 Å²	99	110.2 Å²	110.2	82%	0.818	80%	0.8	S	S	*	*	S	Bend	trans	-93.2	6.1	-163.9	0	0	0	0	0	116.5
504	V	36.3	Very low	35.9	Very low	129 Å²	129	108.9 Å²	108.9	78%	0.782	80%	0.799	S	S	*	*	S	Bend	trans	-119.4	-12	-169.1	-176.4	0	0	0	0	113.8	V506	V504-V506 PolarHBondContact O-N 3.3Å
505	A	36.9	Very low	36.1	Very low	85 Å²	85	109.8 Å²	109.8	70%	0.702	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-75.6	-10.3	-166.7	0	0	0	0	0	116.5	A507	A505-A507 PolarHBondContact O-N 3.34Å
506	V	35.7	Very low	36.1	Very low	143 Å²	143	108 Å²	108	87%	0.867	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-81	-16.6	-167.6	-178.4	0	0	0	0	113.8	V504	V504-V506 PolarHBondContact O-N 3.3Å
507	A	36.9	Very low	36.4	Very low	94 Å²	94	108.8 Å²	108.8	78%	0.777	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-92.6	-8.7	-173.5	0	0	0	0	0	115.7	A505	A505-A507 PolarHBondContact O-N 3.34Å
508	A	36.2	Very low	36.8	Very low	87 Å²	87	108.7 Å²	108.7	72%	0.719	81%	0.809	S	S	*	*	S	Bend	trans	-94.9	-12.9	-164.8	0	0	0	0	0	115.9
509	A	37	Very low	36.9	Very low	94 Å²	94	107.8 Å²	107.8	78%	0.777	81%	0.809	S	S	*	*	G	3₁₀ helix	trans	-86.2	-10.3	-169.5	0	0	0	0	0	115.4	A511	A509-A511 PolarHBondContact O-N 3.44Å
510	A	37.7	Very low	37.2	Very low	103 Å²	103	110.7 Å²	110.7	85%	0.851	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-89.1	2.3	-167.8	0	0	0	0	0	115.7
511	A	37.2	Very low	37.3	Very low	90 Å²	90	108.6 Å²	108.6	74%	0.744	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-114.7	4.6	-165.6	0	0	0	0	0	115.7	A509	A509-A511 PolarHBondContact O-N 3.44Å
512	A	36.8	Very low	37.2	Very low	92 Å²	92	110.7 Å²	110.7	76%	0.76	80%	0.803	S	S	*	*			trans	-100	-0.6	-165.4	0	0	0	0	0	116.3
513	V	37.2	Very low	37.2	Very low	152 Å²	152	109.7 Å²	109.7	92%	0.921	80%	0.802	S	S	*	*			trans	-113.5	64.2	-173.9	-167.2	0	0	0	0	111
514	A	36.5	Very low	37.2	Very low	84 Å²	84	108.2 Å²	108.2	69%	0.694	80%	0.797	S	S	*	*			trans	-150.3	44.1	-175.3	0	0	0	0	0	114.4
515	N	37.5	Very low	37.4	Very low	169 Å²	169	110.1 Å²	110.1	90%	0.904	80%	0.798	S	S	*	*			trans	-169.1	108	162.3	-106.1	-25.1	0	0	0	112.7
516	A	39.8	Very low	37.3	Very low	108 Å²	108	112.4 Å²	112.4	89%	0.893	80%	0.798	S	S	*	*			trans	171	97.5	153	0	0	0	0	0	109
517	S	37.7	Very low	37.7	Very low	118 Å²	118	112.3 Å²	112.3	83%	0.825	80%	0.797	S	S	*	*			trans	-109	158	-178.8	53.5	0	0	0	0	113
518	A	40.9	Very low	37.5	Very low	109 Å²	109	113.5 Å²	113.5	90%	0.901	80%	0.8	S	S	*	*			trans	69.9	139.5	169.3	0	0	0	0	0	118.1
519	G	38	Very low	37.5	Very low	72 Å²	72	113.2 Å²	113.2	74%	0.742	81%	0.806	S	S	*	*			trans	170.5	14.1	173.7	0	0	0	0	0	123.8
520	N	37.6	Very low	37.4	Very low	172 Å²	172	115 Å²	115	92%	0.92	81%	0.813	S	S	*	*			trans	65.9	157.4	169.2	-127.7	39.2	0	0	0	117.4
521	G	36.2	Very low	37.3	Very low	53 Å²	53	113.3 Å²	113.3	55%	0.546	81%	0.805	S	S	.	*			cis	149.9	69.5	-13.8	0	0	0	0	0	116.6
522	N	38.4	Very low	37.3	Very low	176 Å²	176	116.3 Å²	116.3	94%	0.941	81%	0.814	S	S	*	*			trans	178.9	158.3	156.2	-107.2	-9.6	0	0	0	110.1
523	G	35.8	Very low	37.1	Very low	74 Å²	74	115.7 Å²	115.7	76%	0.763	82%	0.817	S	S	*	*			cis	145.9	113.8	-5.7	0	0	0	0	0	112.5
524	G	35.5	Very low	36.8	Very low	69 Å²	69	113.9 Å²	113.9	71%	0.711	82%	0.818	S	S	*	*			trans	134.3	91.1	-178.4	0	0	0	0	0	112.4
525	Q	40	Very low	36.8	Very low	169 Å²	169	114.4 Å²	114.4	79%	0.79	82%	0.822	S	S	*	*				70.9	105.7	84.9	-67.7	-159.8	-95.4	0	0	113.8
526	D	34.5	Very low	36.8	Very low	132 Å²	132	111.2 Å²	111.2	71%	0.706	82%	0.819	S	S	*	*				88	145	95.8	-58.2	-26.3	0	0	0	110.7
527	V	43.5	Very low	36.6	Very low	141 Å²	141	113.8 Å²	113.8	86%	0.855	82%	0.818	S	S	*	*			cis	-146.5	163.3	38	168.7	0	0	0	0	110.9
528	S	33.2	Very low	36.8	Very low	119 Å²	119	118.3 Å²	118.3	83%	0.832	82%	0.818	S	S	*	*			trans	-91.8	161.7	-177.9	52.5	0	0	0	0	115.7
529	G	36.2	Very low	37.1	Very low	82 Å²	82	118.5 Å²	118.5	85%	0.845	81%	0.811	S	S	*	*			trans	-154.5	131.7	168.3	0	0	0	0	0	111.1
530	S	35.7	Very low	37.1	Very low	132 Å²	132	121.8 Å²	121.8	92%	0.923	81%	0.811	S	S	*	*			trans	-110.7	155.6	-172.7	62.2	0	0	0	0	112.9
531	G	35.3	Very low	37.2	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	80%	0.804	S	S	*	*			trans	-176.3	71.4	-177.3	0	0	0	0	0	116.9
532	T	37.6	Very low	37.2	Very low	153 Å²	153	125 Å²	125	94%	0.939	81%	0.807	S	S	*	*			trans	42.9	134.9	145.5	60.4	0	0	0	0	122.2
533	G	32.6	Very low	37.5	Very low	79 Å²	79	125 Å²	125	81%	0.814	81%	0.807	S	S	*	*			trans	139.5	100.8	147.6	0	0	0	0	0	115.1
534	A	31.2	Very low	37.4	Very low	114 Å²	114	127.2 Å²	127.2	94%	0.942	80%	0.797	S	S	*	*			trans	-78.2	132.7	-177.6	0	0	0	0	0	113.5
535	A	35.1	Very low	37.6	Very low	95 Å²	95	131.7 Å²	131.7	79%	0.785	81%	0.805	S	S	*	*			trans	-142.3	151	155.7	0	0	0	0	0	107.8
536	A	37.2	Very low	37.6	Very low	102 Å²	102	132 Å²	132	84%	0.843	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.3	128.2	-172.9	0	0	0	0	0	112.2	Y538	A536-Y538 PolarHBondContact O-N 3.38Å
537	D	37.3	Very low	38.2	Very low	162 Å²	162	130.5 Å²	130.5	87%	0.866	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-64.4	116.5	176.3	-80.7	-48.7	0	0	0	111.9
538	Y	41.1	Very low	38.6	Very low	212 Å²	212	127.2 Å²	127.2	83%	0.831	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-75.9	140.2	145	-102	-101.5	0	0	0	107.8	A536 D540	A536-Y538 PolarHBondContact O-N 3.38Å; Y538-D540 PolarHBondContact O-N 2.72Å
539	P	47.2	Very low	39.5	Very low	114 Å²	114	124.1 Å²	124.1	74%	0.74	76%	0.761	S	S	*	*			trans	-64	107.8	174.6	26.4	-33.2	0	0	0	109.8	I541	P539-I541 PolarHBondContact O-N 2.98Å
540	D	37.7	Very low	40.4	Very low	140 Å²	140	126.8 Å²	126.8	75%	0.749	75%	0.752	S	S	*	*			trans	-64.4	115.3	174.1	-175.8	32.9	0	0	0	109.4	Y538 K542	Y538-D540 PolarHBondContact O-N 2.72Å; D540-K542 PolarHBondContact O-N 3.28Å
541	I	40.6	Very low	41.5	Very low	152 Å²	152	121.9 Å²	121.9	78%	0.779	72%	0.715	S	S	*	*			trans	-79.5	81.8	178.4	-54.6	179.1	0	0	0	107.1	P539 L543	P539-I541 PolarHBondContact O-N 2.98Å; I541-L543 PolarHBondContact O-N 3.05Å
542	K	36.4	Very low	42.6	Very low	140 Å²	140	127.6 Å²	127.6	61%	0.609	72%	0.716	S	S	*	*			trans	-46	111.3	170.9	-89.9	173.5	160	-87.6	0	109.7	D540 E544	D540-K542 PolarHBondContact O-N 3.28Å; K542-E544 WeakPolarHBondContact CD-OE2 3.36Å; K542-E544 IonicContact NZ-OE1 3.67Å; K542-E544 IonicContact NZ-OE2 2.71Å; K542-E544 PolarHBondContact NZ-OE2 3.34Å; K542-E544 PolarHBondContact O-N 3.45Å
543	L	43	Very low	44	Very low	178 Å²	178	121.8 Å²	121.8	93%	0.932	68%	0.679	S	S	*	*			trans	-82.6	54.6	176.5	-168.1	70.1	0	0	0	109.8	I541	I541-L543 PolarHBondContact O-N 3.05Å
544	E	34	Very low	45.8	Very low	120 Å²	120	121.3 Å²	121.3	56%	0.561	66%	0.66	S	S	*	*			trans	-125.1	154.8	-173.9	-64.5	175.5	145.7	0	0	108.6	K542	K542-E544 WeakPolarHBondContact CD-OE2 3.36Å; K542-E544 IonicContact NZ-OE1 3.67Å; K542-E544 IonicContact NZ-OE2 2.71Å; K542-E544 PolarHBondContact NZ-OE2 3.34Å; K542-E544 PolarHBondContact O-N 3.45Å
545	D	41.1	Very low	47.4	Very low	162 Å²	162	122.7 Å²	122.7	87%	0.866	65%	0.652	S	S	*	*			trans	59.5	50.7	178.4	-55.3	-25.9	0	0	0	117.4	D547	D545-D547 PolarHBondContact O-N 3.45Å
546	Y	40	Very low	49.2	Very low	175 Å²	175	126 Å²	126	69%	0.686	65%	0.651	S	S	*	*			trans	-74.6	102.5	153.6	-153.7	-59.2	0	0	0	108.6	A548	Y546-A548 PolarHBondContact O-N 3.24Å
547	D	45.3	Very low	50.7	Low	101 Å²	101	123.4 Å²	123.4	54%	0.54	62%	0.621	S	S	.	*			trans	-54.5	121.8	-156.9	-161.7	-22.6	0	0	0	114.9	D545 A549 E550	D545-D547 PolarHBondContact O-N 3.45Å; D547-A549 PolarHBondContact O-N 2.92Å; D547-A549 WeakPolarHBondContact OD1-CB 3.5Å; D547-A549 PolarHBondContact OD1-N 2.84Å; D547-E550 PolarHBondContact O-N 3.16Å
548	A	52.3	Low	52.2	Low	72 Å²	72	120.3 Å²	120.3	60%	0.595	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-15.7	178.7	0	0	0	0	0	113.3	Y546	Y546-A548 PolarHBondContact O-N 3.24Å
549	A	53	Low	53.8	Low	54 Å²	54	113.3 Å²	113.3	45%	0.446	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.7	-42.7	176.1	0	0	0	0	0	112.6	D547 L551 R552	D547-A549 PolarHBondContact O-N 2.92Å; D547-A549 WeakPolarHBondContact OD1-CB 3.5Å; D547-A549 PolarHBondContact OD1-N 2.84Å; A549-L551 PolarHBondContact O-N 3.36Å; A549-R552 WeakPolarHBondContact O-CB 3.05Å; A549-R552 WeakPolarHBondContact O-CG 3.49Å; A549-R552 PolarHBondContact O-N 2.71Å
550	E	55.5	Low	55.4	Low	139 Å²	139	113.2 Å²	113.2	65%	0.65	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-25.3	-176.4	-166.3	178.8	-132.7	0	0	112.6	D547	D547-E550 PolarHBondContact O-N 3.16Å
551	L	57.4	Low	57.7	Low	29 Å²	29	108 Å²	108	15%	0.152	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	0.5	177.6	-64.5	174.2	0	0	0	114.1	A549 K600 R604	A549-L551 PolarHBondContact O-N 3.36Å; L551-K600 HydrophobicContact CD1-CD 3.97Å; L551-K600 HydrophobicContact CD2-CB 3.99Å; L551-K600 HydrophobicContact CD2-CD 3.52Å; L551-K600 HydrophobicContact CD2-CG 4.44Å; L551-K600 HydrophobicContact CG-CD 4.43Å; L551-R604 VanDerWaalsContact C-NH1 3.34Å; L551-R604 PolarHBondContact O-NH1 3.1Å
552	R	59.5	Low	59.6	Low	186 Å²	186	108 Å²	108	70%	0.702	54%	0.543	S	S	*	.	S	Bend	trans	-72.9	130.5	172.7	-60.4	-177.9	81.8	103.5	-1.5	108.8	A549	A549-R552 WeakPolarHBondContact O-CB 3.05Å; A549-R552 WeakPolarHBondContact O-CG 3.49Å; A549-R552 PolarHBondContact O-N 2.71Å
553	L	65.5	Low	62	Low	32 Å²	32	105.1 Å²	105.1	17%	0.168	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-68	136.6	169.8	-76.3	144.1	0	0	0	108.6	E557 L558 K601 R604 I605	L553-E557 VanDerWaalsContact CA-OE2 3.28Å; L553-E557 WeakPolarHBondContact CA-OE2 3.34Å; L553-E557 HydrophobicContact CB-CB 4.3Å; L553-E557 HydrophobicContact CD2-CB 3.68Å; L553-E557 HydrophobicContact CD2-CG 4.43Å; L553-L558 HydrophobicContact CB-CD1 3.67Å; L553-L558 HydrophobicContact CB-CG 4.2Å; L553-K601 HydrophobicContact CD2-CB 4.09Å; L553-K601 HydrophobicContact CD2-CD 3.93Å; L553-K601 HydrophobicContact CD2-CG 4.31Å; L553-K601 HydrophobicContact CG-CB 4.41Å; L553-K601 HydrophobicContact CG-CD 4.31Å; L553-K601 HydrophobicContact CG-CG 4.39Å; L553-R604 HydrophobicContact CD1-CB 4.49Å; L553-I605 HydrophobicContact CD1-CD1 4.19Å; L553-I605 HydrophobicContact CD1-CG1 3.81Å; L553-I605 HydrophobicContact CD2-CD1 3.84Å; L553-I605 HydrophobicContact CD2-CG1 4.35Å
554	T	70.3	Confident	64.2	Low	69 Å²	69	97.5 Å²	97.5	42%	0.423	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-67.7	160.7	170.5	76.2	0	0	0	0	109.9	E556 E557 L558	T554-E556 PolarHBondContact O-N 2.95Å; T554-E556 PolarHBondContact OG1-N 3.13Å; T554-E557 PolarHBondContact N-OE2 3.03Å; T554-E557 PolarHBondContact O-N 3.37Å; T554-E557 VanDerWaalsContact O-N 3.15Å; T554-E557 WeakPolarHBondContact OG1-CG 3.16Å; T554-E557 PolarHBondContact OG1-N 3.37Å; T554-L558 PolarHBondContact O-N 3.18Å
555	N	66.3	Low	66.8	Low	143 Å²	143	95 Å²	95	77%	0.765	49%	0.485	S	S	*	.	H	α-helix	trans	-62.5	-32.2	177.2	-154.8	-32.3	0	0	0	111.2	L558 S559	N555-L558 PolarHBondContact O-N 3.22Å; N555-S559 WeakPolarHBondContact O-CB 3.36Å; N555-S559 PolarHBondContact O-N 2.59Å
556	E	71.7	Confident	69.2	Low	163 Å²	163	92.5 Å²	92.5	76%	0.762	47%	0.466	S	S	*	.	H	α-helix	trans	-67	-43	172.3	-57	177.6	144.7	0	0	112.5	T554 S559 Q560	T554-E556 PolarHBondContact O-N 2.95Å; T554-E556 PolarHBondContact OG1-N 3.13Å; E556-S559 WeakPolarHBondContact O-CB 3.45Å; E556-S559 PolarHBondContact O-N 3.23Å; E556-Q560 PolarHBondContact O-N 3.31Å; E556-Q560 VanDerWaalsContact O-N 3.15Å
557	E	69.8	Low	71.5	Confident	48 Å²	48	84.4 Å²	84.4	22%	0.224	43%	0.434	C	S	.	.	H	α-helix	trans	-62.7	-42.6	173.2	-73.2	179.3	130	0	0	111.1	L553 T554 S559 Q560 K601	L553-E557 VanDerWaalsContact CA-OE2 3.28Å; L553-E557 WeakPolarHBondContact CA-OE2 3.34Å; L553-E557 HydrophobicContact CB-CB 4.3Å; L553-E557 HydrophobicContact CD2-CB 3.68Å; L553-E557 HydrophobicContact CD2-CG 4.43Å; T554-E557 PolarHBondContact N-OE2 3.03Å; T554-E557 PolarHBondContact O-N 3.37Å; T554-E557 VanDerWaalsContact O-N 3.15Å; T554-E557 WeakPolarHBondContact OG1-CG 3.16Å; T554-E557 PolarHBondContact OG1-N 3.37Å; E557-S559 VanDerWaalsContact C-N 3.35Å; E557-Q560 PolarHBondContact O-N 3.48Å; E557-K601 IonicContact OE1-NZ 3.31Å; E557-K601 PolarHBondContact OE1-NZ 3.49Å; E557-K601 IonicContact OE2-NZ 3.25Å; E557-K601 PolarHBondContact OE2-NZ 3.09Å
558	L	67.7	Low	73.6	Confident	97 Å²	97	84.9 Å²	84.9	51%	0.508	44%	0.437	S	S	.	.	H	α-helix	trans	-60.3	-44.1	173	-94.3	122.3	0	0	0	111.7	L553 T554 N555 Q560 W561 Q562	L553-L558 HydrophobicContact CB-CD1 3.67Å; L553-L558 HydrophobicContact CB-CG 4.2Å; T554-L558 PolarHBondContact O-N 3.18Å; N555-L558 PolarHBondContact O-N 3.22Å; L558-Q560 PolarHBondContact O-N 3.41Å; L558-W561 PolarHBondContact O-N 3.29Å; L558-Q562 PolarHBondContact O-N 3.01Å
559	S	74.4	Confident	75.4	Confident	65 Å²	65	85.7 Å²	85.7	46%	0.455	43%	0.431	S	S	.	.	H	α-helix	trans	-57.8	-37.3	-179.7	-172.6	0	0	0	0	112.4	N555 E556 E557 W561 Q562	N555-S559 WeakPolarHBondContact O-CB 3.36Å; N555-S559 PolarHBondContact O-N 2.59Å; E556-S559 WeakPolarHBondContact O-CB 3.45Å; E556-S559 PolarHBondContact O-N 3.23Å; E557-S559 VanDerWaalsContact C-N 3.35Å; S559-W561 VanDerWaalsContact C-N 3.27Å; S559-W561 PolarHBondContact O-N 3.49Å; S559-Q562 PolarHBondContact O-NE2 3.07Å; S559-Q562 PolarHBondContact OG-NE2 3.12Å
560	Q	82.9	Confident	77.2	Confident	112 Å²	112	84.1 Å²	84.1	52%	0.523	41%	0.414	S	S	.	.	H	α-helix	trans	-67.1	-20.1	177.1	179	162.9	101.3	0	0	114.6	E556 E557 L558	E556-Q560 PolarHBondContact O-N 3.31Å; E556-Q560 VanDerWaalsContact O-N 3.15Å; E557-Q560 PolarHBondContact O-N 3.48Å; L558-Q560 PolarHBondContact O-N 3.41Å
561	W	85.7	Confident	78.7	Confident	30 Å²	30	80.9 Å²	80.9	11%	0.114	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	20	-174.9	-58.4	110.1	0	0	0	113.5	L558 S559 D563 V564 R587 V588 A591 L597 I605	L558-W561 PolarHBondContact O-N 3.29Å; S559-W561 VanDerWaalsContact C-N 3.27Å; S559-W561 PolarHBondContact O-N 3.49Å; W561-D563 PolarHBondContact O-N 3.17Å; W561-D563 VanDerWaalsContact O-N 3.17Å; W561-V564 HydrophobicContact CB-CG2 4.04Å; W561-V564 HydrophobicContact CD2-CG2 4.47Å; W561-V564 HydrophobicContact CE3-CG2 3.74Å; W561-V564 WeakPolarHBondContact O-CB 3.45Å; W561-V564 PolarHBondContact O-N 2.74Å; W561-R587 HydrophobicContact CZ3-CB 4.14Å; W561-V588 HydrophobicContact CD2-CG2 4.43Å; W561-V588 HydrophobicContact CE3-CG2 3.71Å; W561-V588 HydrophobicContact CH2-CG2 4.23Å; W561-V588 HydrophobicContact CZ3-CB 4.45Å; W561-V588 HydrophobicContact CZ3-CG2 3.58Å; W561-A591 HydrophobicContact CH2-CB 3.72Å; W561-A591 HydrophobicContact CZ2-CB 3.85Å; W561-L597 HydrophobicContact CZ2-CD2 3.88Å; W561-I605 HydrophobicContact CB-CD1 4.42Å; W561-I605 HydrophobicContact CB-CG1 4.48Å; W561-I605 HydrophobicContact CB-CG2 3.94Å; W561-I605 HydrophobicContact CG-CD1 3.93Å; W561-I605 HydrophobicContact CG-CG1 4.49Å; W561-I605 HydrophobicContact CG-CG2 4.23Å
562	Q	80.7	Confident	80.1	Confident	153 Å²	153	83.8 Å²	83.8	72%	0.715	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.2	178.2	-72.8	176.9	94.2	0	0	114.2	L558 S559 V564	L558-Q562 PolarHBondContact O-N 3.01Å; S559-Q562 PolarHBondContact O-NE2 3.07Å; S559-Q562 PolarHBondContact OG-NE2 3.12Å; Q562-V564 VanDerWaalsContact C-N 3.35Å
563	D	86.8	Confident	81	Confident	79 Å²	79	83.6 Å²	83.6	42%	0.422	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	3.2	177.5	69.6	-20.4	0	0	0	113.6	W561 I565 R587	W561-D563 PolarHBondContact O-N 3.17Å; W561-D563 VanDerWaalsContact O-N 3.17Å; D563-I565 PolarHBondContact O-N 3.4Å; D563-R587 IonicContact OD1-NH1 2.8Å; D563-R587 IonicContact OD1-NH2 2.62Å; D563-R587 IonicContact OD2-CZ 3.55Å; D563-R587 IonicContact OD2-NH1 2.65Å; D563-R587 PolarHBondContact OD2-NH1 2.71Å; D563-R587 IonicContact OD2-NH2 2.64Å; D563-R587 PolarHBondContact OD2-NH2 3.33Å
564	V	88.4	Confident	81.7	Confident	18 Å²	18	83.3 Å²	83.3	11%	0.109	44%	0.437	C	S	.	.			trans	-85.1	109.8	173.7	176.8	0	0	0	0	110.3	W561 Q562 F584 V588 I605 L606	W561-V564 HydrophobicContact CB-CG2 4.04Å; W561-V564 HydrophobicContact CD2-CG2 4.47Å; W561-V564 HydrophobicContact CE3-CG2 3.74Å; W561-V564 WeakPolarHBondContact O-CB 3.45Å; W561-V564 PolarHBondContact O-N 2.74Å; Q562-V564 VanDerWaalsContact C-N 3.35Å; V564-F584 HydrophobicContact CB-CD2 4.33Å; V564-F584 HydrophobicContact CG1-CD2 3.82Å; V564-F584 HydrophobicContact CG1-CE2 4.31Å; V564-F584 HydrophobicContact CG2-CB 4.22Å; V564-F584 HydrophobicContact CG2-CD2 4.49Å; V564-V588 HydrophobicContact CG2-CG2 3.87Å; V564-I605 HydrophobicContact CB-CG2 3.9Å; V564-I605 HydrophobicContact CG1-CG2 3.67Å; V564-I605 HydrophobicContact CG2-CG2 3.95Å; V564-L606 HydrophobicContact CG1-CD2 3.68Å; V564-L606 HydrophobicContact CG1-CG 4.39Å
565	I	89.2	Confident	82.5	Confident	69 Å²	69	89.5 Å²	89.5	35%	0.354	45%	0.453	S	S	.	.			trans	-73.3	132.3	169.9	-51.1	177.2	0	0	0	108.3	D563 D569 F579 F584	D563-I565 PolarHBondContact O-N 3.4Å; I565-D569 HydrophobicContact CG2-CB 3.84Å; I565-F579 WeakPolarHBondContact O-CE2 3.36Å; I565-F584 HydrophobicContact CB-CE1 4.17Å; I565-F584 HydrophobicContact CB-CE2 4.32Å; I565-F584 HydrophobicContact CB-CZ 3.86Å; I565-F584 HydrophobicContact CD1-CE1 4.23Å; I565-F584 HydrophobicContact CG1-CE1 4.23Å; I565-F584 HydrophobicContact CG1-CZ 4.43Å; I565-F584 WeakPolarHBondContact O-CE2 3.38Å
566	K	91.9	Very high	83.4	Confident	108 Å²	108	89.2 Å²	89.2	47%	0.47	44%	0.441	S	S	.	.			trans	-70.5	156.8	175.5	-60.2	171.2	-170.4	156.3	0	110.8	D568 D569 Y570	K566-D568 VanDerWaalsContact C-N 3.31Å; K566-D568 PolarHBondContact O-N 2.85Å; K566-D569 WeakPolarHBondContact CB-OD2 3.37Å; K566-D569 PolarHBondContact O-N 2.9Å; K566-Y570 WeakPolarHBondContact O-CB 3.38Å; K566-Y570 PolarHBondContact O-N 3.47Å
567	M	88.2	Confident	84	Confident	5 Å²	5	84.9 Å²	84.9	3%	0.025	43%	0.427	C	S	.	.	H	α-helix	trans	-50	-49.9	175.4	178.1	64.1	63.1	0	0	112.3	Y570 L571 R576 F579 W580 L606 V608	M567-Y570 PolarHBondContact O-N 3.02Å; M567-L571 HydrophobicContact CG-CD1 3.8Å; M567-L571 HydrophobicContact CG-CG 4.33Å; M567-L571 WeakPolarHBondContact O-CB 3.47Å; M567-L571 WeakPolarHBondContact O-CG 3.47Å; M567-L571 PolarHBondContact O-N 3.15Å; M567-L571 HydrophobicContact SD-CD1 3.92Å; M567-L571 HydrophobicContact SD-CD2 4.32Å; M567-L571 HydrophobicContact SD-CG 4Å; M567-R576 HydrophobicContact SD-CG 4.12Å; M567-F579 HydrophobicContact CB-CE2 4.27Å; M567-F579 HydrophobicContact CB-CZ 4.26Å; M567-F579 HydrophobicContact CE-CB 4.22Å; M567-F579 HydrophobicContact CE-CD1 3.24Å; M567-F579 HydrophobicContact CE-CD2 4.16Å; M567-F579 HydrophobicContact CE-CE1 3.49Å; M567-F579 VanDerWaalsContact CE-CE1 3.49Å; M567-F579 HydrophobicContact CE-CE2 4.36Å; M567-F579 HydrophobicContact CE-CG 3.6Å; M567-F579 HydrophobicContact CE-CZ 4.04Å; M567-F579 HydrophobicContact SD-CB 4.44Å; M567-F579 HydrophobicContact SD-CD1 4.33Å; M567-F579 HydrophobicContact SD-CD2 4.29Å; M567-F579 HydrophobicContact SD-CG 4.09Å; M567-W580 HydrophobicContact CE-CH2 4.33Å; M567-W580 HydrophobicContact CE-CZ2 3.44Å; M567-W580 VanDerWaalsContact CE-CZ2 3.44Å; M567-L606 PolarHBondContact N-O 2.9Å; M567-V608 HydrophobicContact CB-CG1 3.69Å; M567-V608 HydrophobicContact CE-CG1 3.69Å; M567-V608 HydrophobicContact CG-CG1 4.13Å
568	D	88.8	Confident	84.8	Confident	111 Å²	111	86.3 Å²	86.3	59%	0.594	43%	0.434	S	S	*	.	H	α-helix	trans	-66.4	-42.6	-174.3	-52.6	-50.9	0	0	0	111.9	K566 Y570 L571	K566-D568 VanDerWaalsContact C-N 3.31Å; K566-D568 PolarHBondContact O-N 2.85Å; D568-Y570 VanDerWaalsContact C-N 3.32Å; D568-Y570 PolarHBondContact O-N 3.15Å; D568-L571 PolarHBondContact O-N 3.27Å
569	D	89.3	Confident	86	Confident	89 Å²	89	81.7 Å²	81.7	48%	0.476	41%	0.41	S	S	.	.	H	α-helix	trans	-64.6	-34.9	175.2	-58.1	-41.4	0	0	0	112.3	I565 K566	I565-D569 HydrophobicContact CG2-CB 3.84Å; K566-D569 WeakPolarHBondContact CB-OD2 3.37Å; K566-D569 PolarHBondContact O-N 2.9Å
570	Y	90.7	Very high	86.7	Confident	22 Å²	22	79.8 Å²	79.8	9%	0.086	39%	0.393	C	S	.	.	H	α-helix	trans	-74.2	-35	176.8	-174.2	-85.2	0	0	0	112.3	K566 M567 D568 A572 K573 G574 Q578 F579 E582 F584	K566-Y570 WeakPolarHBondContact O-CB 3.38Å; K566-Y570 PolarHBondContact O-N 3.47Å; M567-Y570 PolarHBondContact O-N 3.02Å; D568-Y570 VanDerWaalsContact C-N 3.32Å; D568-Y570 PolarHBondContact O-N 3.15Å; Y570-A572 PolarHBondContact O-N 3.5Å; Y570-K573 CarbonylContact O-C 3.59Å; Y570-K573 PolarHBondContact O-N 3.4Å; Y570-G574 PolarHBondContact O-N 3.38Å; Y570-Q578 HydrophobicContact CE1-CB 4.37Å; Y570-Q578 WeakPolarHBondContact OH-CB 3.21Å; Y570-F579 HydrophobicContact CD1-CB 3.84Å; Y570-F579 AromaticContact CD1-CD2 3.86Å; Y570-F579 HydrophobicContact CD1-CD2 3.86Å; Y570-F579 HydrophobicContact CD1-CG 4.37Å; Y570-F579 HydrophobicContact CD2-CD2 4.19Å; Y570-F579 HydrophobicContact CE1-CB 3.84Å; Y570-F579 HydrophobicContact CG-CB 4.45Å; Y570-F579 AromaticContact CG-CD2 3.66Å; Y570-F579 HydrophobicContact CG-CD2 3.66Å; Y570-F579 HydrophobicContact CG-CE2 4.49Å; Y570-E582 HydrophobicContact CE2-CG 3.62Å; Y570-E582 VanDerWaalsContact CE2-OE1 3.25Å; Y570-E582 WeakPolarHBondContact CE2-OE1 3.46Å; Y570-E582 VanDerWaalsContact CZ-OE1 3.3Å; Y570-E582 PolarHBondContact OH-OE1 3.32Å; Y570-F584 HydrophobicContact CD2-CE1 4.47Å; Y570-F584 HydrophobicContact CD2-CZ 4.12Å
571	L	87.9	Confident	87	Confident	70 Å²	70	79.6 Å²	79.6	37%	0.366	39%	0.392	S	S	.	.	H	α-helix	trans	-65	-20.6	178.6	-74.2	170.1	0	0	0	113.2	M567 D568 K573 R576	M567-L571 HydrophobicContact CG-CD1 3.8Å; M567-L571 HydrophobicContact CG-CG 4.33Å; M567-L571 WeakPolarHBondContact O-CB 3.47Å; M567-L571 WeakPolarHBondContact O-CG 3.47Å; M567-L571 PolarHBondContact O-N 3.15Å; M567-L571 HydrophobicContact SD-CD1 3.92Å; M567-L571 HydrophobicContact SD-CD2 4.32Å; M567-L571 HydrophobicContact SD-CG 4Å; D568-L571 PolarHBondContact O-N 3.27Å; L571-K573 VanDerWaalsContact C-N 3.25Å; L571-K573 PolarHBondContact O-N 3.3Å; L571-R576 HydrophobicContact CD2-CB 3.68Å; L571-R576 HydrophobicContact CD2-CG 4.13Å
572	A	86.2	Confident	87.3	Confident	90 Å²	90	80.7 Å²	80.7	74%	0.744	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-16.2	168.9	0	0	0	0	0	113.8	Y570	Y570-A572 PolarHBondContact O-N 3.5Å
573	K	78	Confident	87.9	Confident	183 Å²	183	77.3 Å²	77.3	80%	0.796	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-23.9	-174.8	-62.8	-179.2	-177.9	177.3	0	114.3	Y570 L571	Y570-K573 CarbonylContact O-C 3.59Å; Y570-K573 PolarHBondContact O-N 3.4Å; L571-K573 VanDerWaalsContact C-N 3.25Å; L571-K573 PolarHBondContact O-N 3.3Å
574	G	81.7	Confident	88.1	Confident	25 Å²	25	74.1 Å²	74.1	26%	0.258	37%	0.372	S	S	.	.	S	Bend	trans	-151.6	167.8	-169.4	0	0	0	0	0	114.3	Y570	Y570-G574 PolarHBondContact O-N 3.38Å
575	R	86	Confident	88.4	Confident	200 Å²	200	73.2 Å²	73.2	76%	0.755	37%	0.367	S	S	*	.			trans	-82.4	139.5	-178.4	-62.2	-166.7	-64.8	-165.5	-2.5	111.3	P577 Q578	R575-P577 VanDerWaalsContact C-N 3.31Å; R575-P577 WeakPolarHBondContact O-CD 3.28Å; R575-Q578 VanDerWaalsContact O-CB 3.26Å; R575-Q578 WeakPolarHBondContact O-CB 3.44Å; R575-Q578 PolarHBondContact O-N 3.11Å
576	R	84.8	Confident	88.5	Confident	137 Å²	137	75 Å²	75	52%	0.517	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-31.6	-179.2	-164.5	166.5	175.2	153.1	0.6	117.6	M567 L571 W580	M567-R576 HydrophobicContact SD-CG 4.12Å; L571-R576 HydrophobicContact CD2-CB 3.68Å; L571-R576 HydrophobicContact CD2-CG 4.13Å; R576-W580 VanDerWaalsContact O-CD1 3.25Å; R576-W580 PolarHBondContact O-NE1 3.06Å
577	P	84.3	Confident	88.6	Confident	72 Å²	72	75 Å²	75	47%	0.468	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-42.9	172.6	-22.2	35.1	0	0	0	112.3	R575 F579 W580	R575-P577 VanDerWaalsContact C-N 3.31Å; R575-P577 WeakPolarHBondContact O-CD 3.28Å; P577-F579 VanDerWaalsContact C-N 3.3Å; P577-F579 PolarHBondContact O-N 2.77Å; P577-W580 PolarHBondContact O-N 2.82Å; P577-W580 VanDerWaalsContact O-N 3.11Å
578	Q	87.3	Confident	88.8	Confident	78 Å²	78	74.7 Å²	74.7	36%	0.364	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-64.1	-33.5	-170	-146.3	65.1	47.1	0	0	112.6	Y570 R575 W580 E581 E582	Y570-Q578 HydrophobicContact CE1-CB 4.37Å; Y570-Q578 WeakPolarHBondContact OH-CB 3.21Å; R575-Q578 VanDerWaalsContact O-CB 3.26Å; R575-Q578 WeakPolarHBondContact O-CB 3.44Å; R575-Q578 PolarHBondContact O-N 3.11Å; Q578-W580 PolarHBondContact O-N 3.37Å; Q578-E581 PolarHBondContact NE2-OE2 2.86Å; Q578-E581 WeakPolarHBondContact O-CA 3.34Å; Q578-E581 WeakPolarHBondContact O-CB 3.46Å; Q578-E581 PolarHBondContact O-N 3.32Å; Q578-E582 PolarHBondContact O-N 3.03Å
579	F	92.4	Very high	89	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-47.8	-33.8	172.3	-179	-89.4	0	0	0	114	I565 M567 Y570 P577 E581 F584 T585 L606	I565-F579 WeakPolarHBondContact O-CE2 3.36Å; M567-F579 HydrophobicContact CB-CE2 4.27Å; M567-F579 HydrophobicContact CB-CZ 4.26Å; M567-F579 HydrophobicContact CE-CB 4.22Å; M567-F579 HydrophobicContact CE-CD1 3.24Å; M567-F579 HydrophobicContact CE-CD2 4.16Å; M567-F579 HydrophobicContact CE-CE1 3.49Å; M567-F579 VanDerWaalsContact CE-CE1 3.49Å; M567-F579 HydrophobicContact CE-CE2 4.36Å; M567-F579 HydrophobicContact CE-CG 3.6Å; M567-F579 HydrophobicContact CE-CZ 4.04Å; M567-F579 HydrophobicContact SD-CB 4.44Å; M567-F579 HydrophobicContact SD-CD1 4.33Å; M567-F579 HydrophobicContact SD-CD2 4.29Å; M567-F579 HydrophobicContact SD-CG 4.09Å; Y570-F579 HydrophobicContact CD1-CB 3.84Å; Y570-F579 AromaticContact CD1-CD2 3.86Å; Y570-F579 HydrophobicContact CD1-CD2 3.86Å; Y570-F579 HydrophobicContact CD1-CG 4.37Å; Y570-F579 HydrophobicContact CD2-CD2 4.19Å; Y570-F579 HydrophobicContact CE1-CB 3.84Å; Y570-F579 HydrophobicContact CG-CB 4.45Å; Y570-F579 AromaticContact CG-CD2 3.66Å; Y570-F579 HydrophobicContact CG-CD2 3.66Å; Y570-F579 HydrophobicContact CG-CE2 4.49Å; P577-F579 VanDerWaalsContact C-N 3.3Å; P577-F579 PolarHBondContact O-N 2.77Å; F579-E581 VanDerWaalsContact C-N 3.35Å; F579-F584 HydrophobicContact CD2-CE2 4.28Å; F579-F584 HydrophobicContact CD2-CZ 4.12Å; F579-F584 AromaticContact CE2-CE2 3.72Å; F579-F584 HydrophobicContact CE2-CE2 3.72Å; F579-F584 AromaticContact CE2-CZ 3.95Å; F579-F584 HydrophobicContact CE2-CZ 3.95Å; F579-F584 HydrophobicContact CZ-CE2 4.03Å; F579-T585 HydrophobicContact CD1-CG2 4.18Å; F579-T585 HydrophobicContact CE1-CG2 3.94Å; F579-T585 WeakPolarHBondContact O-CB 3.21Å; F579-T585 PolarHBondContact O-OG1 3.35Å; F579-L606 HydrophobicContact CE1-CD2 4.01Å; F579-L606 HydrophobicContact CZ-CB 4.25Å; F579-L606 HydrophobicContact CZ-CD2 3.69Å
580	W	89.9	Confident	89.1	Confident	25 Å²	25	68.2 Å²	68.2	10%	0.095	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-85.2	-11.4	-178.1	-55.5	92	0	0	0	113.1	M567 R576 P577 Q578 T585 V608 T612 L613 R616	M567-W580 HydrophobicContact CE-CH2 4.33Å; M567-W580 HydrophobicContact CE-CZ2 3.44Å; M567-W580 VanDerWaalsContact CE-CZ2 3.44Å; R576-W580 VanDerWaalsContact O-CD1 3.25Å; R576-W580 PolarHBondContact O-NE1 3.06Å; P577-W580 PolarHBondContact O-N 2.82Å; P577-W580 VanDerWaalsContact O-N 3.11Å; Q578-W580 PolarHBondContact O-N 3.37Å; W580-T585 HydrophobicContact CD2-CG2 4.45Å; W580-T585 HydrophobicContact CE3-CG2 3.65Å; W580-T585 HydrophobicContact CZ3-CG2 4.05Å; W580-V608 HydrophobicContact CH2-CG1 4.17Å; W580-V608 HydrophobicContact CH2-CG2 4.44Å; W580-V608 HydrophobicContact CZ2-CG1 4.33Å; W580-T612 HydrophobicContact CH2-CG2 4.2Å; W580-T612 HydrophobicContact CZ2-CG2 3.9Å; W580-L613 HydrophobicContact CH2-CD1 4.4Å; W580-L613 HydrophobicContact CZ3-CD1 3.94Å; W580-R616 VanDerWaalsContact CD1-NH2 3.28Å; W580-R616 HydrophobicContact CD2-CB 4.32Å; W580-R616 HydrophobicContact CD2-CG 3.73Å; W580-R616 HydrophobicContact CE3-CB 3.81Å; W580-R616 HydrophobicContact CE3-CG 3.72Å; W580-R616 HydrophobicContact CG-CG 4.5Å; W580-R616 HydrophobicContact CH2-CB 4.24Å; W580-R616 HydrophobicContact CH2-CG 3.82Å; W580-R616 HydrophobicContact CZ2-CG 3.83Å; W580-R616 HydrophobicContact CZ3-CB 3.77Å; W580-R616 HydrophobicContact CZ3-CG 3.76Å
581	E	89.4	Confident	89.2	Confident	107 Å²	107	67.7 Å²	67.7	50%	0.5	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-13.1	175.2	-65.5	170.2	-150.4	0	0	111.8	Q578 F579 K586	Q578-E581 PolarHBondContact NE2-OE2 2.86Å; Q578-E581 WeakPolarHBondContact O-CA 3.34Å; Q578-E581 WeakPolarHBondContact O-CB 3.46Å; Q578-E581 PolarHBondContact O-N 3.32Å; F579-E581 VanDerWaalsContact C-N 3.35Å; E581-K586 WeakPolarHBondContact O-CE 3.34Å; E581-K586 PolarHBondContact O-NZ 3.48Å
582	E	92.5	Very high	89.4	Confident	54 Å²	54	65 Å²	65	25%	0.252	32%	0.319	S	S	.	.	S	Bend	trans	-62.5	146.7	178.1	-66.2	-61.9	163.2	0	0	113.9	Y570 Q578 F584 T585 K586	Y570-E582 HydrophobicContact CE2-CG 3.62Å; Y570-E582 VanDerWaalsContact CE2-OE1 3.25Å; Y570-E582 WeakPolarHBondContact CE2-OE1 3.46Å; Y570-E582 VanDerWaalsContact CZ-OE1 3.3Å; Y570-E582 PolarHBondContact OH-OE1 3.32Å; Q578-E582 PolarHBondContact O-N 3.03Å; E582-F584 VanDerWaalsContact C-N 3.31Å; E582-F584 HydrophobicContact CB-CD1 3.8Å; E582-F584 HydrophobicContact CB-CE1 3.5Å; E582-F584 VanDerWaalsContact CB-CE1 3.5Å; E582-F584 HydrophobicContact CB-CE2 4.49Å; E582-F584 HydrophobicContact CB-CG 4.41Å; E582-F584 HydrophobicContact CB-CZ 3.87Å; E582-F584 HydrophobicContact CG-CD1 4.42Å; E582-F584 HydrophobicContact CG-CE1 3.66Å; E582-F584 HydrophobicContact CG-CZ 3.95Å; E582-F584 PolarHBondContact O-N 2.71Å; E582-T585 PolarHBondContact O-N 3.05Å; E582-K586 WeakPolarHBondContact O-CG 3.46Å; E582-K586 PolarHBondContact O-N 3.26Å
583	P	91.5	Very high	89.6	Confident	81 Å²	81	65.7 Å²	65.7	53%	0.526	31%	0.305	S	S	.	.	H	α-helix	trans	-71.3	-22.4	-177	29.7	-34.9	0	0	0	113.5	R587	P583-R587 WeakPolarHBondContact O-CG 3.45Å; P583-R587 PolarHBondContact O-N 3.08Å; P583-R587 PolarHBondContact O-NE 3.45Å; P583-R587 VanDerWaalsContact O-NE 3.08Å
584	F	92.6	Very high	90.2	Very high	12 Å²	12	61.9 Å²	61.9	5%	0.053	29%	0.293	C	S	.	.	H	α-helix	trans	-73.2	-45.9	172.7	66.1	-99.8	0	0	0	111.1	V564 I565 Y570 F579 E582 K586 R587 V588 L606	V564-F584 HydrophobicContact CB-CD2 4.33Å; V564-F584 HydrophobicContact CG1-CD2 3.82Å; V564-F584 HydrophobicContact CG1-CE2 4.31Å; V564-F584 HydrophobicContact CG2-CB 4.22Å; V564-F584 HydrophobicContact CG2-CD2 4.49Å; I565-F584 HydrophobicContact CB-CE1 4.17Å; I565-F584 HydrophobicContact CB-CE2 4.32Å; I565-F584 HydrophobicContact CB-CZ 3.86Å; I565-F584 HydrophobicContact CD1-CE1 4.23Å; I565-F584 HydrophobicContact CG1-CE1 4.23Å; I565-F584 HydrophobicContact CG1-CZ 4.43Å; I565-F584 WeakPolarHBondContact O-CE2 3.38Å; Y570-F584 HydrophobicContact CD2-CE1 4.47Å; Y570-F584 HydrophobicContact CD2-CZ 4.12Å; F579-F584 HydrophobicContact CD2-CE2 4.28Å; F579-F584 HydrophobicContact CD2-CZ 4.12Å; F579-F584 AromaticContact CE2-CE2 3.72Å; F579-F584 HydrophobicContact CE2-CE2 3.72Å; F579-F584 AromaticContact CE2-CZ 3.95Å; F579-F584 HydrophobicContact CE2-CZ 3.95Å; F579-F584 HydrophobicContact CZ-CE2 4.03Å; E582-F584 VanDerWaalsContact C-N 3.31Å; E582-F584 HydrophobicContact CB-CD1 3.8Å; E582-F584 HydrophobicContact CB-CE1 3.5Å; E582-F584 VanDerWaalsContact CB-CE1 3.5Å; E582-F584 HydrophobicContact CB-CE2 4.49Å; E582-F584 HydrophobicContact CB-CG 4.41Å; E582-F584 HydrophobicContact CB-CZ 3.87Å; E582-F584 HydrophobicContact CG-CD1 4.42Å; E582-F584 HydrophobicContact CG-CE1 3.66Å; E582-F584 HydrophobicContact CG-CZ 3.95Å; E582-F584 PolarHBondContact O-N 2.71Å; F584-K586 VanDerWaalsContact C-N 3.34Å; F584-K586 PolarHBondContact O-N 3.3Å; F584-R587 PolarHBondContact O-N 2.69Å; F584-V588 PolarHBondContact O-N 3.17Å; F584-L606 HydrophobicContact CD2-CD2 4.27Å; F584-L606 HydrophobicContact CE2-CD2 4.31Å
585	T	93.1	Very high	90.5	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-40.1	177.1	-52.1	0	0	0	0	111.8	F579 W580 E582 V588 L589 L606	F579-T585 HydrophobicContact CD1-CG2 4.18Å; F579-T585 HydrophobicContact CE1-CG2 3.94Å; F579-T585 WeakPolarHBondContact O-CB 3.21Å; F579-T585 PolarHBondContact O-OG1 3.35Å; W580-T585 HydrophobicContact CD2-CG2 4.45Å; W580-T585 HydrophobicContact CE3-CG2 3.65Å; W580-T585 HydrophobicContact CZ3-CG2 4.05Å; E582-T585 PolarHBondContact O-N 3.05Å; T585-V588 PolarHBondContact O-N 3Å; T585-L589 HydrophobicContact CG2-CD1 4.21Å; T585-L589 WeakPolarHBondContact O-CB 3.37Å; T585-L589 WeakPolarHBondContact O-CG 3.45Å; T585-L589 PolarHBondContact O-N 3.28Å; T585-L606 HydrophobicContact CG2-CD1 4.35Å; T585-L606 HydrophobicContact CG2-CD2 4.18Å
586	K	92.5	Very high	90.6	Very high	106 Å²	106	69.3 Å²	69.3	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-44.6	173.1	-75	167.3	173.3	162.9	0	112.4	E581 E582 F584 V588 L589 D590	E581-K586 WeakPolarHBondContact O-CE 3.34Å; E581-K586 PolarHBondContact O-NZ 3.48Å; E582-K586 WeakPolarHBondContact O-CG 3.46Å; E582-K586 PolarHBondContact O-N 3.26Å; F584-K586 VanDerWaalsContact C-N 3.34Å; F584-K586 PolarHBondContact O-N 3.3Å; K586-V588 PolarHBondContact O-N 3.04Å; K586-L589 WeakPolarHBondContact O-CB 3.34Å; K586-L589 PolarHBondContact O-N 2.89Å; K586-D590 PolarHBondContact O-N 3.44Å
587	R	93.2	Very high	90.8	Very high	107 Å²	107	63.3 Å²	63.3	40%	0.404	30%	0.297	S	S	.	.	H	α-helix	trans	-62.7	-40.3	175.8	-77.6	178.8	-67.7	147.5	-3.9	113.1	W561 D563 P583 F584 D590 A591	W561-R587 HydrophobicContact CZ3-CB 4.14Å; D563-R587 IonicContact OD1-NH1 2.8Å; D563-R587 IonicContact OD1-NH2 2.62Å; D563-R587 IonicContact OD2-CZ 3.55Å; D563-R587 IonicContact OD2-NH1 2.65Å; D563-R587 PolarHBondContact OD2-NH1 2.71Å; D563-R587 IonicContact OD2-NH2 2.64Å; D563-R587 PolarHBondContact OD2-NH2 3.33Å; P583-R587 WeakPolarHBondContact O-CG 3.45Å; P583-R587 PolarHBondContact O-N 3.08Å; P583-R587 PolarHBondContact O-NE 3.45Å; P583-R587 VanDerWaalsContact O-NE 3.08Å; F584-R587 PolarHBondContact O-N 2.69Å; R587-D590 PolarHBondContact O-N 3.3Å; R587-A591 WeakPolarHBondContact O-CB 3.36Å; R587-A591 PolarHBondContact O-N 2.87Å
588	V	93.2	Very high	91.1	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-42.9	174	174.9	0	0	0	0	110.9	W561 V564 F584 T585 K586 A591 I592 L597 A602 I605 L606	W561-V588 HydrophobicContact CD2-CG2 4.43Å; W561-V588 HydrophobicContact CE3-CG2 3.71Å; W561-V588 HydrophobicContact CH2-CG2 4.23Å; W561-V588 HydrophobicContact CZ3-CB 4.45Å; W561-V588 HydrophobicContact CZ3-CG2 3.58Å; V564-V588 HydrophobicContact CG2-CG2 3.87Å; F584-V588 PolarHBondContact O-N 3.17Å; T585-V588 PolarHBondContact O-N 3Å; K586-V588 PolarHBondContact O-N 3.04Å; V588-A591 PolarHBondContact O-N 3.34Å; V588-I592 HydrophobicContact CG1-CD1 4.36Å; V588-I592 WeakPolarHBondContact O-CG1 3.38Å; V588-I592 PolarHBondContact O-N 2.98Å; V588-I592 VanDerWaalsContact O-N 3.12Å; V588-L597 HydrophobicContact CG1-CD2 4Å; V588-A602 HydrophobicContact CG1-CB 3.74Å; V588-I605 HydrophobicContact CG2-CG2 4.26Å; V588-L606 HydrophobicContact CB-CD1 4.09Å; V588-L606 HydrophobicContact CB-CD2 4.45Å; V588-L606 HydrophobicContact CB-CG 4.34Å; V588-L606 HydrophobicContact CG1-CD1 3.58Å; V588-L606 HydrophobicContact CG1-CG 3.97Å; V588-L606 HydrophobicContact CG2-CD2 4.26Å; V588-L606 HydrophobicContact CG2-CG 4.35Å
589	L	92.6	Very high	91.3	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-43.7	176.8	-79.7	172.5	0	0	0	112.8	T585 K586 I592 K593 L613 Y617 Y621	T585-L589 HydrophobicContact CG2-CD1 4.21Å; T585-L589 WeakPolarHBondContact O-CB 3.37Å; T585-L589 WeakPolarHBondContact O-CG 3.45Å; T585-L589 PolarHBondContact O-N 3.28Å; K586-L589 WeakPolarHBondContact O-CB 3.34Å; K586-L589 PolarHBondContact O-N 2.89Å; L589-I592 PolarHBondContact O-N 3.11Å; L589-K593 PolarHBondContact O-N 3.33Å; L589-K593 VanDerWaalsContact O-N 3.12Å; L589-L613 HydrophobicContact CD2-CD1 4.03Å; L589-Y617 HydrophobicContact CD2-CD2 3.95Å; L589-Y621 VanDerWaalsContact C-OH 3.31Å; L589-Y621 HydrophobicContact CB-CE2 3.88Å; L589-Y621 HydrophobicContact CD2-CE2 4.4Å
590	D	91.9	Very high	91.3	Very high	60 Å²	60	66.8 Å²	66.8	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-71.6	-29.7	175.3	-80.3	-43.8	0	0	0	112.7	K586 R587 I592 K593 N594 Y621	K586-D590 PolarHBondContact O-N 3.44Å; R587-D590 PolarHBondContact O-N 3.3Å; D590-I592 VanDerWaalsContact C-N 3.34Å; D590-K593 PolarHBondContact O-N 3.47Å; D590-K593 WeakPolarHBondContact OD1-CD 3.43Å; D590-K593 IonicContact OD1-NZ 3.4Å; D590-K593 PolarHBondContact OD1-NZ 3.47Å; D590-N594 WeakPolarHBondContact O-CB 3.45Å; D590-N594 VanDerWaalsContact O-CG 3.24Å; D590-N594 PolarHBondContact O-N 2.85Å; D590-N594 PolarHBondContact O-ND2 3.3Å; D590-N594 VanDerWaalsContact O-ND2 3.14Å; D590-Y621 PolarHBondContact N-OH 2.94Å; D590-Y621 PolarHBondContact OD1-OH 3.48Å
591	A	92.4	Very high	91.3	Very high	11 Å²	11	67 Å²	67	9%	0.091	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-36.7	173	0	0	0	0	0	112.4	W561 R587 V588 K595 R596 L597	W561-A591 HydrophobicContact CH2-CB 3.72Å; W561-A591 HydrophobicContact CZ2-CB 3.85Å; R587-A591 WeakPolarHBondContact O-CB 3.36Å; R587-A591 PolarHBondContact O-N 2.87Å; V588-A591 PolarHBondContact O-N 3.34Å; A591-K595 PolarHBondContact O-N 2.87Å; A591-R596 PolarHBondContact O-N 2.57Å; A591-L597 HydrophobicContact CB-CB 3.9Å; A591-L597 HydrophobicContact CB-CD2 4.45Å; A591-L597 PolarHBondContact O-N 2.95Å
592	I	92.6	Very high	91.5	Very high	14 Å²	14	61.9 Å²	61.9	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-48.3	171.3	-62.3	160.1	0	0	0	110.5	V588 L589 D590 N594 K595 L597 M599 A602 L613 Y617	V588-I592 HydrophobicContact CG1-CD1 4.36Å; V588-I592 WeakPolarHBondContact O-CG1 3.38Å; V588-I592 PolarHBondContact O-N 2.98Å; V588-I592 VanDerWaalsContact O-N 3.12Å; L589-I592 PolarHBondContact O-N 3.11Å; D590-I592 VanDerWaalsContact C-N 3.34Å; I592-N594 VanDerWaalsContact C-N 3.27Å; I592-N594 PolarHBondContact O-N 3.11Å; I592-K595 PolarHBondContact O-N 3.01Å; I592-L597 WeakPolarHBondContact CA-O 3.26Å; I592-M599 HydrophobicContact CD1-SD 4.04Å; I592-M599 HydrophobicContact CG2-CE 3.61Å; I592-M599 HydrophobicContact CG2-SD 4.36Å; I592-A602 HydrophobicContact CD1-CB 3.63Å; I592-A602 HydrophobicContact CG1-CB 3.86Å; I592-L613 HydrophobicContact CD1-CD1 4.48Å; I592-L613 HydrophobicContact CD1-CD2 3.99Å; I592-L613 HydrophobicContact CD1-CG 4.37Å; I592-Y617 HydrophobicContact CB-CD2 4.17Å; I592-Y617 HydrophobicContact CB-CE2 3.86Å; I592-Y617 HydrophobicContact CD1-CD2 4.41Å; I592-Y617 HydrophobicContact CG2-CD2 3.78Å; I592-Y617 HydrophobicContact CG2-CE2 3.48Å; I592-Y617 VanDerWaalsContact CG2-CE2 3.48Å
593	K	90.3	Very high	91.5	Very high	103 Å²	103	59.8 Å²	59.8	45%	0.448	28%	0.275	S	S	.	.	H	α-helix	trans	-56.7	-41.1	178.2	172.7	-172.8	168.1	-168.7	0	112.4	L589 D590 K595 Y617 Y621	L589-K593 PolarHBondContact O-N 3.33Å; L589-K593 VanDerWaalsContact O-N 3.12Å; D590-K593 PolarHBondContact O-N 3.47Å; D590-K593 WeakPolarHBondContact OD1-CD 3.43Å; D590-K593 IonicContact OD1-NZ 3.4Å; D590-K593 PolarHBondContact OD1-NZ 3.47Å; K593-K595 PolarHBondContact O-N 2.99Å; K593-Y617 VanDerWaalsContact CA-OH 3.28Å; K593-Y617 WeakPolarHBondContact CA-OH 3.38Å; K593-Y617 HydrophobicContact CB-CE2 4.21Å; K593-Y621 HydrophobicContact CB-CE2 4.43Å; K593-Y621 HydrophobicContact CD-CD1 3.89Å; K593-Y621 HydrophobicContact CD-CE1 3.61Å; K593-Y621 HydrophobicContact CD-CG 4.5Å
594	N	90.5	Very high	91.5	Very high	103 Å²	103	62.5 Å²	62.5	55%	0.551	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	9.2	178.3	-64	-29.7	0	0	0	113.6	D590 I592 R596	D590-N594 WeakPolarHBondContact O-CB 3.45Å; D590-N594 VanDerWaalsContact O-CG 3.24Å; D590-N594 PolarHBondContact O-N 2.85Å; D590-N594 PolarHBondContact O-ND2 3.3Å; D590-N594 VanDerWaalsContact O-ND2 3.14Å; I592-N594 VanDerWaalsContact C-N 3.27Å; I592-N594 PolarHBondContact O-N 3.11Å; N594-R596 HydrophobicContact CB-CG 4.34Å; N594-R596 PolarHBondContact O-N 2.91Å; N594-R596 VanDerWaalsContact O-N 3.11Å
595	K	87.9	Confident	91.4	Very high	192 Å²	192	62.8 Å²	62.8	84%	0.835	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	21	-177.9	-54	-179.8	-177.5	176	0	115	A591 I592 K593	A591-K595 PolarHBondContact O-N 2.87Å; I592-K595 PolarHBondContact O-N 3.01Å; K593-K595 PolarHBondContact O-N 2.99Å
596	R	88.9	Confident	91.4	Very high	189 Å²	189	62.8 Å²	62.8	71%	0.713	28%	0.277	S	S	*	.	S	Bend	trans	-84.1	-17.5	177.6	-68.4	-173.7	63.6	163.4	-0.9	113.1	A591 N594	A591-R596 PolarHBondContact O-N 2.57Å; N594-R596 HydrophobicContact CB-CG 4.34Å; N594-R596 PolarHBondContact O-N 2.91Å; N594-R596 VanDerWaalsContact O-N 3.11Å
597	L	88	Confident	91.4	Very high	11 Å²	11	58.9 Å²	58.9	6%	0.058	27%	0.267	C	S	.	.	S	Bend	trans	-141.9	128.6	-179.4	-176.9	64.7	0	0	0	110	W561 V588 A591 I592 K601 A602 I605	W561-L597 HydrophobicContact CZ2-CD2 3.88Å; V588-L597 HydrophobicContact CG1-CD2 4Å; A591-L597 HydrophobicContact CB-CB 3.9Å; A591-L597 HydrophobicContact CB-CD2 4.45Å; A591-L597 PolarHBondContact O-N 2.95Å; I592-L597 WeakPolarHBondContact CA-O 3.26Å; L597-K601 HydrophobicContact CD1-CB 3.78Å; L597-A602 HydrophobicContact CD2-CB 3.69Å; L597-A602 HydrophobicContact CG-CB 4Å; L597-I605 HydrophobicContact CD1-CD1 3.85Å; L597-I605 HydrophobicContact CD2-CD1 3.83Å; L597-I605 HydrophobicContact CG-CD1 4.44Å
598	E	90.9	Very high	91.4	Very high	108 Å²	108	54.7 Å²	54.7	51%	0.505	25%	0.253	S	S	.	.			trans	-67.9	144.1	176.4	-68	-151.5	128.2	0	0	112.5	K600 K601 A602	E598-K600 PolarHBondContact O-N 3.05Å; E598-K600 VanDerWaalsContact O-N 3.16Å; E598-K601 HydrophobicContact CB-CB 4.24Å; E598-K601 HydrophobicContact CB-CG 4.23Å; E598-K601 PolarHBondContact O-N 3.34Å; E598-A602 WeakPolarHBondContact O-CB 3.43Å; E598-A602 PolarHBondContact O-N 3.31Å
599	M	90.9	Very high	91.4	Very high	17 Å²	17	58.1 Å²	58.1	8%	0.084	28%	0.277	C	S	.	.	H	α-helix	trans	-55	-33.4	172.9	-169.9	74.4	69.8	0	0	112.9	I592 A603 Y610 L613 Y614 Y617 L624	I592-M599 HydrophobicContact CD1-SD 4.04Å; I592-M599 HydrophobicContact CG2-CE 3.61Å; I592-M599 HydrophobicContact CG2-SD 4.36Å; M599-A603 WeakPolarHBondContact O-CB 3.2Å; M599-A603 PolarHBondContact O-N 3.49Å; M599-A603 VanDerWaalsContact O-N 3.13Å; M599-Y610 HydrophobicContact CB-CD2 4.39Å; M599-Y610 HydrophobicContact CB-CE2 3.75Å; M599-Y610 HydrophobicContact CG-CD2 3.78Å; M599-Y610 HydrophobicContact CG-CE2 3.32Å; M599-L613 HydrophobicContact SD-CB 4.36Å; M599-L613 HydrophobicContact SD-CD2 3.86Å; M599-L613 HydrophobicContact SD-CG 3.72Å; M599-Y614 HydrophobicContact CE-CD2 4.19Å; M599-Y617 HydrophobicContact CE-CD1 4.19Å; M599-Y617 HydrophobicContact CE-CD2 4.01Å; M599-Y617 HydrophobicContact CE-CG 3.78Å; M599-L624 HydrophobicContact CE-CD2 3.81Å
600	K	92.3	Very high	91.4	Very high	99 Å²	99	63.5 Å²	63.5	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-69.1	-44.4	174.9	-71.2	179.9	178.5	176.3	0	112.2	L551 E598 Y610	L551-K600 HydrophobicContact CD1-CD 3.97Å; L551-K600 HydrophobicContact CD2-CB 3.99Å; L551-K600 HydrophobicContact CD2-CD 3.52Å; L551-K600 HydrophobicContact CD2-CG 4.44Å; L551-K600 HydrophobicContact CG-CD 4.43Å; E598-K600 PolarHBondContact O-N 3.05Å; E598-K600 VanDerWaalsContact O-N 3.16Å; K600-Y610 HydrophobicContact CG-CD2 4.23Å; K600-Y610 HydrophobicContact CG-CE2 4.22Å
601	K	90.9	Very high	91.3	Very high	29 Å²	29	63 Å²	63	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-67	-45.2	175.9	-70.4	-168.3	179.8	-165.6	0	111.4	L553 E557 L597 E598 A603 R604 I605	L553-K601 HydrophobicContact CD2-CB 4.09Å; L553-K601 HydrophobicContact CD2-CD 3.93Å; L553-K601 HydrophobicContact CD2-CG 4.31Å; L553-K601 HydrophobicContact CG-CB 4.41Å; L553-K601 HydrophobicContact CG-CD 4.31Å; L553-K601 HydrophobicContact CG-CG 4.39Å; E557-K601 IonicContact OE1-NZ 3.31Å; E557-K601 PolarHBondContact OE1-NZ 3.49Å; E557-K601 IonicContact OE2-NZ 3.25Å; E557-K601 PolarHBondContact OE2-NZ 3.09Å; L597-K601 HydrophobicContact CD1-CB 3.78Å; E598-K601 HydrophobicContact CB-CB 4.24Å; E598-K601 HydrophobicContact CB-CG 4.23Å; E598-K601 PolarHBondContact O-N 3.34Å; K601-A603 VanDerWaalsContact C-N 3.33Å; K601-A603 PolarHBondContact O-N 3.2Å; K601-R604 WeakPolarHBondContact O-CB 3.25Å; K601-R604 PolarHBondContact O-N 3.07Å; K601-R604 VanDerWaalsContact O-N 3.12Å; K601-I605 PolarHBondContact O-N 3.4Å
602	A	92.2	Very high	91.3	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.4	-37.1	177.9	0	0	0	0	0	113.8	V588 I592 L597 E598 R604 I605 L606 L613	V588-A602 HydrophobicContact CG1-CB 3.74Å; I592-A602 HydrophobicContact CD1-CB 3.63Å; I592-A602 HydrophobicContact CG1-CB 3.86Å; L597-A602 HydrophobicContact CD2-CB 3.69Å; L597-A602 HydrophobicContact CG-CB 4Å; E598-A602 WeakPolarHBondContact O-CB 3.43Å; E598-A602 PolarHBondContact O-N 3.31Å; A602-R604 VanDerWaalsContact C-N 3.32Å; A602-R604 PolarHBondContact O-N 3.47Å; A602-I605 PolarHBondContact O-N 2.92Å; A602-L606 PolarHBondContact O-N 3.25Å; A602-L613 HydrophobicContact CB-CD2 3.66Å
603	A	93.1	Very high	91.3	Very high	9 Å²	9	63.9 Å²	63.9	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-39.6	174.6	0	0	0	0	0	112.2	M599 K601 G607 V608 L613	M599-A603 WeakPolarHBondContact O-CB 3.2Å; M599-A603 PolarHBondContact O-N 3.49Å; M599-A603 VanDerWaalsContact O-N 3.13Å; K601-A603 VanDerWaalsContact C-N 3.33Å; K601-A603 PolarHBondContact O-N 3.2Å; A603-G607 PolarHBondContact O-N 3.44Å; A603-V608 CarbonylContact C-O 3.34Å; A603-V608 WeakPolarHBondContact CB-O 3.21Å; A603-V608 PolarHBondContact O-N 3.31Å; A603-V608 VanDerWaalsContact O-O 3.08Å; A603-L613 HydrophobicContact CB-CD2 4.15Å
604	R	91	Very high	91.4	Very high	138 Å²	138	62.2 Å²	62.2	52%	0.521	30%	0.303	S	S	.	.	H	α-helix	trans	-66.9	-41.5	174.3	-67.7	178.1	170.3	-177	-7.1	112	L551 L553 K601 A602 G607	L551-R604 VanDerWaalsContact C-NH1 3.34Å; L551-R604 PolarHBondContact O-NH1 3.1Å; L553-R604 HydrophobicContact CD1-CB 4.49Å; K601-R604 WeakPolarHBondContact O-CB 3.25Å; K601-R604 PolarHBondContact O-N 3.07Å; K601-R604 VanDerWaalsContact O-N 3.12Å; A602-R604 VanDerWaalsContact C-N 3.32Å; A602-R604 PolarHBondContact O-N 3.47Å; R604-G607 PolarHBondContact O-N 2.89Å
605	I	91.6	Very high	91.4	Very high	19 Å²	19	58.6 Å²	58.6	10%	0.097	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-50.7	177.6	-73.1	158.1	0	0	0	111.6	L553 W561 V564 V588 L597 K601 A602 G607	L553-I605 HydrophobicContact CD1-CD1 4.19Å; L553-I605 HydrophobicContact CD1-CG1 3.81Å; L553-I605 HydrophobicContact CD2-CD1 3.84Å; L553-I605 HydrophobicContact CD2-CG1 4.35Å; W561-I605 HydrophobicContact CB-CD1 4.42Å; W561-I605 HydrophobicContact CB-CG1 4.48Å; W561-I605 HydrophobicContact CB-CG2 3.94Å; W561-I605 HydrophobicContact CG-CD1 3.93Å; W561-I605 HydrophobicContact CG-CG1 4.49Å; W561-I605 HydrophobicContact CG-CG2 4.23Å; V564-I605 HydrophobicContact CB-CG2 3.9Å; V564-I605 HydrophobicContact CG1-CG2 3.67Å; V564-I605 HydrophobicContact CG2-CG2 3.95Å; V588-I605 HydrophobicContact CG2-CG2 4.26Å; L597-I605 HydrophobicContact CD1-CD1 3.85Å; L597-I605 HydrophobicContact CD2-CD1 3.83Å; L597-I605 HydrophobicContact CG-CD1 4.44Å; K601-I605 PolarHBondContact O-N 3.4Å; A602-I605 PolarHBondContact O-N 2.92Å; I605-G607 VanDerWaalsContact C-N 3.26Å; I605-G607 PolarHBondContact O-N 3.24Å
606	L	92.7	Very high	91.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-5	-177.6	-73.8	168.3	0	0	0	114.2	V564 M567 F579 F584 T585 V588 A602 V608 L613	V564-L606 HydrophobicContact CG1-CD2 3.68Å; V564-L606 HydrophobicContact CG1-CG 4.39Å; M567-L606 PolarHBondContact N-O 2.9Å; F579-L606 HydrophobicContact CE1-CD2 4.01Å; F579-L606 HydrophobicContact CZ-CB 4.25Å; F579-L606 HydrophobicContact CZ-CD2 3.69Å; F584-L606 HydrophobicContact CD2-CD2 4.27Å; F584-L606 HydrophobicContact CE2-CD2 4.31Å; T585-L606 HydrophobicContact CG2-CD1 4.35Å; T585-L606 HydrophobicContact CG2-CD2 4.18Å; V588-L606 HydrophobicContact CB-CD1 4.09Å; V588-L606 HydrophobicContact CB-CD2 4.45Å; V588-L606 HydrophobicContact CB-CG 4.34Å; V588-L606 HydrophobicContact CG1-CD1 3.58Å; V588-L606 HydrophobicContact CG1-CG 3.97Å; V588-L606 HydrophobicContact CG2-CD2 4.26Å; V588-L606 HydrophobicContact CG2-CG 4.35Å; A602-L606 PolarHBondContact O-N 3.25Å; L606-V608 HydrophobicContact CB-CG1 4.47Å; L606-V608 HydrophobicContact CB-CG2 3.85Å; L606-L613 HydrophobicContact CD1-CD1 3.67Å; L606-L613 HydrophobicContact CD1-CD2 4.37Å
607	G	92.1	Very high	91.6	Very high	24 Å²	24	44.7 Å²	44.7	25%	0.247	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	39.6	-174.5	0	0	0	0	0	113.1	A603 R604 I605	A603-G607 PolarHBondContact O-N 3.44Å; R604-G607 PolarHBondContact O-N 2.89Å; I605-G607 VanDerWaalsContact C-N 3.26Å; I605-G607 PolarHBondContact O-N 3.24Å
608	V	93.1	Very high	91.7	Very high	18 Å²	18	49.7 Å²	49.7	11%	0.109	25%	0.25	C	S	.	.			trans	-128.5	150.5	-178.2	-64.9	0	0	0	0	111.6	M567 W580 A603 L606 L613	M567-V608 HydrophobicContact CB-CG1 3.69Å; M567-V608 HydrophobicContact CE-CG1 3.69Å; M567-V608 HydrophobicContact CG-CG1 4.13Å; W580-V608 HydrophobicContact CH2-CG1 4.17Å; W580-V608 HydrophobicContact CH2-CG2 4.44Å; W580-V608 HydrophobicContact CZ2-CG1 4.33Å; A603-V608 CarbonylContact C-O 3.34Å; A603-V608 WeakPolarHBondContact CB-O 3.21Å; A603-V608 PolarHBondContact O-N 3.31Å; A603-V608 VanDerWaalsContact O-O 3.08Å; L606-V608 HydrophobicContact CB-CG1 4.47Å; L606-V608 HydrophobicContact CB-CG2 3.85Å; V608-L613 HydrophobicContact CG2-CB 3.87Å
609	S	93	Very high	91.4	Very high	73 Å²	73	50.9 Å²	50.9	51%	0.51	26%	0.256	S	S	.	.			trans	-62.1	144	171.7	79.9	0	0	0	0	110.9	G611 T612 L613	S609-G611 PolarHBondContact O-N 2.99Å; S609-G611 VanDerWaalsContact O-N 3.16Å; S609-T612 WeakPolarHBondContact O-CA 3.5Å; S609-T612 WeakPolarHBondContact O-CB 3.39Å; S609-T612 PolarHBondContact O-N 2.94Å; S609-T612 PolarHBondContact OG-N 3.49Å; S609-T612 PolarHBondContact OG-OG1 3.21Å; S609-L613 PolarHBondContact O-N 3.46Å; S609-L613 VanDerWaalsContact O-N 3.1Å
610	Y	92.4	Very high	91.2	Very high	116 Å²	116	54.2 Å²	54.2	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-50.2	-41.8	176.7	175.6	-84.5	0	0	0	111.9	M599 K600 T612 L613 Y614	M599-Y610 HydrophobicContact CB-CD2 4.39Å; M599-Y610 HydrophobicContact CB-CE2 3.75Å; M599-Y610 HydrophobicContact CG-CD2 3.78Å; M599-Y610 HydrophobicContact CG-CE2 3.32Å; K600-Y610 HydrophobicContact CG-CD2 4.23Å; K600-Y610 HydrophobicContact CG-CE2 4.22Å; Y610-T612 PolarHBondContact O-N 3.49Å; Y610-L613 PolarHBondContact O-N 2.84Å; Y610-Y614 HydrophobicContact CE1-CG 4.38Å; Y610-Y614 WeakPolarHBondContact O-CB 3.36Å; Y610-Y614 PolarHBondContact O-N 3.22Å
611	G	90.9	Very high	90.7	Very high	50 Å²	50	53 Å²	53	52%	0.515	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-34.9	177.4	0	0	0	0	0	113.9	S609 G615	S609-G611 PolarHBondContact O-N 2.99Å; S609-G611 VanDerWaalsContact O-N 3.16Å; G611-G615 PolarHBondContact O-N 3.47Å
612	T	91.5	Very high	89.9	Confident	43 Å²	43	52.4 Å²	52.4	26%	0.264	27%	0.272	S	S	.	.	H	α-helix	trans	-66.8	-48.6	173.9	-55	0	0	0	0	111.1	W580 S609 Y610 G615 R616	W580-T612 HydrophobicContact CH2-CG2 4.2Å; W580-T612 HydrophobicContact CZ2-CG2 3.9Å; S609-T612 WeakPolarHBondContact O-CA 3.5Å; S609-T612 WeakPolarHBondContact O-CB 3.39Å; S609-T612 PolarHBondContact O-N 2.94Å; S609-T612 PolarHBondContact OG-N 3.49Å; S609-T612 PolarHBondContact OG-OG1 3.21Å; Y610-T612 PolarHBondContact O-N 3.49Å; T612-G615 PolarHBondContact O-N 2.96Å; T612-R616 PolarHBondContact O-N 3.47Å
613	L	93.6	Very high	88.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-43.2	179.3	-174.1	58.8	0	0	0	111.8	W580 L589 I592 M599 A602 A603 L606 V608 S609 Y610 G615 R616 Y617	W580-L613 HydrophobicContact CH2-CD1 4.4Å; W580-L613 HydrophobicContact CZ3-CD1 3.94Å; L589-L613 HydrophobicContact CD2-CD1 4.03Å; I592-L613 HydrophobicContact CD1-CD1 4.48Å; I592-L613 HydrophobicContact CD1-CD2 3.99Å; I592-L613 HydrophobicContact CD1-CG 4.37Å; M599-L613 HydrophobicContact SD-CB 4.36Å; M599-L613 HydrophobicContact SD-CD2 3.86Å; M599-L613 HydrophobicContact SD-CG 3.72Å; A602-L613 HydrophobicContact CB-CD2 3.66Å; A603-L613 HydrophobicContact CB-CD2 4.15Å; L606-L613 HydrophobicContact CD1-CD1 3.67Å; L606-L613 HydrophobicContact CD1-CD2 4.37Å; V608-L613 HydrophobicContact CG2-CB 3.87Å; S609-L613 PolarHBondContact O-N 3.46Å; S609-L613 VanDerWaalsContact O-N 3.1Å; Y610-L613 PolarHBondContact O-N 2.84Å; L613-G615 VanDerWaalsContact C-N 3.33Å; L613-G615 PolarHBondContact O-N 3.39Å; L613-R616 PolarHBondContact O-N 3.06Å; L613-Y617 WeakPolarHBondContact O-CB 3.48Å; L613-Y617 PolarHBondContact O-N 3.18Å
614	Y	92.4	Very high	86.2	Confident	69 Å²	69	57.6 Å²	57.6	27%	0.271	30%	0.303	S	S	.	.	H	α-helix	trans	-63.1	-37.6	176.3	-175.7	-109.9	0	0	0	112.3	M599 Y610 R618 L624	M599-Y614 HydrophobicContact CE-CD2 4.19Å; Y610-Y614 HydrophobicContact CE1-CG 4.38Å; Y610-Y614 WeakPolarHBondContact O-CB 3.36Å; Y610-Y614 PolarHBondContact O-N 3.22Å; Y614-R618 VanDerWaalsContact CE1-CD 3.43Å; Y614-R618 HydrophobicContact CE1-CG 4.48Å; Y614-R618 HydrophobicContact CE2-CG 4.44Å; Y614-R618 WeakPolarHBondContact O-CB 3.44Å; Y614-R618 VanDerWaalsContact O-CG 3.27Å; Y614-R618 WeakPolarHBondContact O-CG 3.24Å; Y614-R618 PolarHBondContact O-N 3.47Å; Y614-R618 VanDerWaalsContact O-N 3.09Å; Y614-L624 HydrophobicContact CE2-CB 4.39Å
615	G	90	Very high	83.8	Confident	26 Å²	26	60.4 Å²	60.4	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-59.4	-53.1	171.3	0	0	0	0	0	111.9	G611 T612 L613 R618 E619	G611-G615 PolarHBondContact O-N 3.47Å; T612-G615 PolarHBondContact O-N 2.96Å; L613-G615 VanDerWaalsContact C-N 3.33Å; L613-G615 PolarHBondContact O-N 3.39Å; G615-R618 WeakPolarHBondContact O-CB 3.37Å; G615-R618 PolarHBondContact O-N 3.29Å; G615-E619 WeakPolarHBondContact O-CG 3.4Å; G615-E619 PolarHBondContact O-N 2.95Å
616	R	89.9	Confident	81.4	Confident	77 Å²	77	65.9 Å²	65.9	29%	0.291	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-42.5	179.9	-68.8	-56.8	-139	-177.4	9.7	113.5	W580 T612 L613 R618 E619 V620	W580-R616 VanDerWaalsContact CD1-NH2 3.28Å; W580-R616 HydrophobicContact CD2-CB 4.32Å; W580-R616 HydrophobicContact CD2-CG 3.73Å; W580-R616 HydrophobicContact CE3-CB 3.81Å; W580-R616 HydrophobicContact CE3-CG 3.72Å; W580-R616 HydrophobicContact CG-CG 4.5Å; W580-R616 HydrophobicContact CH2-CB 4.24Å; W580-R616 HydrophobicContact CH2-CG 3.82Å; W580-R616 HydrophobicContact CZ2-CG 3.83Å; W580-R616 HydrophobicContact CZ3-CB 3.77Å; W580-R616 HydrophobicContact CZ3-CG 3.76Å; T612-R616 PolarHBondContact O-N 3.47Å; L613-R616 PolarHBondContact O-N 3.06Å; R616-R618 PolarHBondContact O-N 3.04Å; R616-E619 WeakPolarHBondContact CD-OE2 3.46Å; R616-E619 IonicContact CZ-OE2 2.69Å; R616-E619 IonicContact NE-OE2 3.9Å; R616-E619 IonicContact NH1-OE2 2.62Å; R616-E619 PolarHBondContact NH1-OE2 3.01Å; R616-E619 WeakPolarHBondContact O-CB 3.47Å; R616-E619 PolarHBondContact O-N 3.36Å; R616-E619 VanDerWaalsContact O-N 3.1Å; R616-V620 WeakPolarHBondContact O-CG2 3.39Å; R616-V620 PolarHBondContact O-N 2.88Å
617	Y	92.1	Very high	78.5	Confident	12 Å²	12	71.3 Å²	71.3	5%	0.047	38%	0.379	C	S	.	.	H	α-helix	trans	-57	-39.6	173.7	-174.5	-78.4	0	0	0	111.3	L589 I592 K593 M599 L613 V620 Y621 L624	L589-Y617 HydrophobicContact CD2-CD2 3.95Å; I592-Y617 HydrophobicContact CB-CD2 4.17Å; I592-Y617 HydrophobicContact CB-CE2 3.86Å; I592-Y617 HydrophobicContact CD1-CD2 4.41Å; I592-Y617 HydrophobicContact CG2-CD2 3.78Å; I592-Y617 HydrophobicContact CG2-CE2 3.48Å; I592-Y617 VanDerWaalsContact CG2-CE2 3.48Å; K593-Y617 VanDerWaalsContact CA-OH 3.28Å; K593-Y617 WeakPolarHBondContact CA-OH 3.38Å; K593-Y617 HydrophobicContact CB-CE2 4.21Å; M599-Y617 HydrophobicContact CE-CD1 4.19Å; M599-Y617 HydrophobicContact CE-CD2 4.01Å; M599-Y617 HydrophobicContact CE-CG 3.78Å; L613-Y617 WeakPolarHBondContact O-CB 3.48Å; L613-Y617 PolarHBondContact O-N 3.18Å; Y617-V620 PolarHBondContact O-N 3.3Å; Y617-Y621 HydrophobicContact CD1-CD2 4.24Å; Y617-Y621 AromaticContact CD2-CD2 3.63Å; Y617-Y621 HydrophobicContact CD2-CD2 3.63Å; Y617-Y621 AromaticContact CD2-CE2 3.86Å; Y617-Y621 HydrophobicContact CD2-CE2 3.86Å; Y617-Y621 AromaticContact CE1-CD2 4Å; Y617-Y621 HydrophobicContact CE1-CD2 4Å; Y617-Y621 AromaticContact CE2-CD2 3.38Å; Y617-Y621 HydrophobicContact CE2-CD2 3.38Å; Y617-Y621 AromaticContact CE2-CE2 3.64Å; Y617-Y621 HydrophobicContact CE2-CE2 3.64Å; Y617-Y621 HydrophobicContact CE2-CG 4.43Å; Y617-Y621 HydrophobicContact CG-CD2 4.04Å; Y617-Y621 AromaticContact CZ-CD2 3.57Å; Y617-Y621 PolarHBondContact O-N 3.12Å; Y617-L624 HydrophobicContact CD1-CB 4.16Å; Y617-L624 HydrophobicContact CD1-CD2 4.49Å; Y617-L624 HydrophobicContact CE1-CB 3.85Å; Y617-L624 HydrophobicContact CE1-CD1 4.06Å; Y617-L624 HydrophobicContact CE1-CD2 4.22Å; Y617-L624 HydrophobicContact CE1-CG 4.26Å
618	R	88.4	Confident	75.7	Confident	117 Å²	117	80 Å²	80	44%	0.442	41%	0.406	S	S	.	.	H	α-helix	trans	-71.8	-28.4	176.5	-76.4	178.8	61.2	-158.6	0.6	114.6	Y614 G615 R616 G622	Y614-R618 VanDerWaalsContact CE1-CD 3.43Å; Y614-R618 HydrophobicContact CE1-CG 4.48Å; Y614-R618 HydrophobicContact CE2-CG 4.44Å; Y614-R618 WeakPolarHBondContact O-CB 3.44Å; Y614-R618 VanDerWaalsContact O-CG 3.27Å; Y614-R618 WeakPolarHBondContact O-CG 3.24Å; Y614-R618 PolarHBondContact O-N 3.47Å; Y614-R618 VanDerWaalsContact O-N 3.09Å; G615-R618 WeakPolarHBondContact O-CB 3.37Å; G615-R618 PolarHBondContact O-N 3.29Å; R616-R618 PolarHBondContact O-N 3.04Å; R618-G622 WeakPolarHBondContact CA-O 3.49Å; R618-G622 VanDerWaalsContact O-CA 3.24Å; R618-G622 WeakPolarHBondContact O-CA 3.42Å; R618-G622 PolarHBondContact O-N 3.16Å
619	E	85.6	Confident	72.7	Confident	132 Å²	132	84.5 Å²	84.5	62%	0.617	44%	0.438	S	S	*	.	H	α-helix	trans	-71.6	-39.5	171.8	-71	167.9	-176.7	0	0	111.2	G615 R616	G615-E619 WeakPolarHBondContact O-CG 3.4Å; G615-E619 PolarHBondContact O-N 2.95Å; R616-E619 WeakPolarHBondContact CD-OE2 3.46Å; R616-E619 IonicContact CZ-OE2 2.69Å; R616-E619 IonicContact NE-OE2 3.9Å; R616-E619 IonicContact NH1-OE2 2.62Å; R616-E619 PolarHBondContact NH1-OE2 3.01Å; R616-E619 WeakPolarHBondContact O-CB 3.47Å; R616-E619 PolarHBondContact O-N 3.36Å; R616-E619 VanDerWaalsContact O-N 3.1Å
620	V	85.6	Confident	69.8	Low	88 Å²	88	84.1 Å²	84.1	53%	0.533	45%	0.446	S	S	.	.	H	α-helix	trans	-82.4	-47.3	-175.1	176.3	0	0	0	0	113.3	R616 Y617	R616-V620 WeakPolarHBondContact O-CG2 3.39Å; R616-V620 PolarHBondContact O-N 2.88Å; Y617-V620 PolarHBondContact O-N 3.3Å
621	Y	82.8	Confident	67	Low	74 Å²	74	84.9 Å²	84.9	29%	0.29	46%	0.463	S	S	.	.	H	α-helix	trans	-114.8	1.3	-174.9	-50.6	-71.3	0	0	0	114.4	L589 D590 K593 Y617	L589-Y621 VanDerWaalsContact C-OH 3.31Å; L589-Y621 HydrophobicContact CB-CE2 3.88Å; L589-Y621 HydrophobicContact CD2-CE2 4.4Å; D590-Y621 PolarHBondContact N-OH 2.94Å; D590-Y621 PolarHBondContact OD1-OH 3.48Å; K593-Y621 HydrophobicContact CB-CE2 4.43Å; K593-Y621 HydrophobicContact CD-CD1 3.89Å; K593-Y621 HydrophobicContact CD-CE1 3.61Å; K593-Y621 HydrophobicContact CD-CG 4.5Å; Y617-Y621 HydrophobicContact CD1-CD2 4.24Å; Y617-Y621 AromaticContact CD2-CD2 3.63Å; Y617-Y621 HydrophobicContact CD2-CD2 3.63Å; Y617-Y621 AromaticContact CD2-CE2 3.86Å; Y617-Y621 HydrophobicContact CD2-CE2 3.86Å; Y617-Y621 AromaticContact CE1-CD2 4Å; Y617-Y621 HydrophobicContact CE1-CD2 4Å; Y617-Y621 AromaticContact CE2-CD2 3.38Å; Y617-Y621 HydrophobicContact CE2-CD2 3.38Å; Y617-Y621 AromaticContact CE2-CE2 3.64Å; Y617-Y621 HydrophobicContact CE2-CE2 3.64Å; Y617-Y621 HydrophobicContact CE2-CG 4.43Å; Y617-Y621 HydrophobicContact CG-CD2 4.04Å; Y617-Y621 AromaticContact CZ-CD2 3.57Å; Y617-Y621 PolarHBondContact O-N 3.12Å
622	G	73.4	Confident	64.2	Low	15 Å²	15	86.9 Å²	86.9	16%	0.155	47%	0.474	C	S	.	.			trans	80.1	-167	-175.8	0	0	0	0	0	114.3	R618 L624	R618-G622 WeakPolarHBondContact CA-O 3.49Å; R618-G622 VanDerWaalsContact O-CA 3.24Å; R618-G622 WeakPolarHBondContact O-CA 3.42Å; R618-G622 PolarHBondContact O-N 3.16Å; G622-L624 PolarHBondContact O-N 3.38Å; G622-L624 VanDerWaalsContact O-N 3.1Å
623	C	55.1	Low	61.4	Low	74 Å²	74	94.8 Å²	94.8	50%	0.5	51%	0.506	S	S	.	.			trans	-78.9	101.5	-163.7	-66.9	0	0	0	0	113.4	K625	C623-K625 PolarHBondContact O-N 3.29Å
624	L	53.5	Low	58.4	Low	44 Å²	44	105.5 Å²	105.5	23%	0.23	55%	0.546	C	S	.	.			trans	-63.3	93.3	168.9	-169.7	70.4	0	0	0	110.9	M599 Y614 Y617 G622 H626	M599-L624 HydrophobicContact CE-CD2 3.81Å; Y614-L624 HydrophobicContact CE2-CB 4.39Å; Y617-L624 HydrophobicContact CD1-CB 4.16Å; Y617-L624 HydrophobicContact CD1-CD2 4.49Å; Y617-L624 HydrophobicContact CE1-CB 3.85Å; Y617-L624 HydrophobicContact CE1-CD1 4.06Å; Y617-L624 HydrophobicContact CE1-CD2 4.22Å; Y617-L624 HydrophobicContact CE1-CG 4.26Å; G622-L624 PolarHBondContact O-N 3.38Å; G622-L624 VanDerWaalsContact O-N 3.1Å; L624-H626 VanDerWaalsContact C-N 3.33Å; L624-H626 PolarHBondContact O-N 3.09Å
625	K	40.1	Very low	55.4	Low	197 Å²	197	109.7 Å²	109.7	86%	0.857	57%	0.573	S	S	*	*			trans	-79.7	73.5	-177.4	-169.8	-162	173.5	-170.1	0	111.8	C623	C623-K625 PolarHBondContact O-N 3.29Å
626	H	41	Very low	52.7	Low	135 Å²	135	113.6 Å²	113.6	63%	0.625	60%	0.597	S	S	*	*			trans	-85.3	129.6	155.1	-71.3	-74.5	0	0	0	109.3	L624 Y628	L624-H626 VanDerWaalsContact C-N 3.33Å; L624-H626 PolarHBondContact O-N 3.09Å; H626-Y628 PolarHBondContact O-N 3.39Å
627	P	33	Very low	50	Low	114 Å²	114	112.9 Å²	112.9	74%	0.74	61%	0.613	S	S	*	*			trans	-75.3	123.4	169.4	31	-30.8	0	0	0	109.2
628	Y	31.9	Very low	47.2	Very low	206 Å²	206	117.4 Å²	117.4	81%	0.808	65%	0.647	S	S	*	*			trans	-132.8	92	162.1	-131.2	-93.4	0	0	0	108.7	H626 G630	H626-Y628 PolarHBondContact O-N 3.39Å; Y628-G630 VanDerWaalsContact C-N 3.29Å; Y628-G630 PolarHBondContact O-N 3.42Å; Y628-G630 VanDerWaalsContact O-N 3.1Å
629	S	30.8	Very low	44.7	Very low	112 Å²	112	118 Å²	118	78%	0.783	66%	0.663	S	S	*	*			trans	-83.1	73.8	177.6	-176.2	0	0	0	0	109.8
630	G	33	Very low	42.4	Very low	66 Å²	66	116.8 Å²	116.8	68%	0.68	67%	0.669	S	S	*	*			trans	-96.7	83.9	174.6	0	0	0	0	0	111.4	Y628 A632	Y628-G630 VanDerWaalsContact C-N 3.29Å; Y628-G630 PolarHBondContact O-N 3.42Å; Y628-G630 VanDerWaalsContact O-N 3.1Å; G630-A632 PolarHBondContact O-N 3.03Å
631	T	32.8	Very low	40	Very low	131 Å²	131	118.4 Å²	118.4	80%	0.804	68%	0.68	S	S	*	*			trans	-80.3	100	-178	47	0	0	0	0	112.3
632	A	31.3	Very low	37.9	Very low	92 Å²	92	120.1 Å²	120.1	76%	0.76	70%	0.703	S	S	*	*			trans	-152.3	86	166.2	0	0	0	0	0	112.7	G630	G630-A632 PolarHBondContact O-N 3.03Å
633	F	32.9	Very low	36.1	Very low	210 Å²	210	127.5 Å²	127.5	92%	0.921	73%	0.733	S	S	*	*			trans	-139.7	115.5	144.1	-135.2	-86.7	0	0	0	109.4
634	R	31.1	Very low	35.1	Very low	224 Å²	224	132.4 Å²	132.4	85%	0.845	75%	0.751	S	S	*	*			trans	-75.3	138.2	177.6	-64.2	179.6	177.5	-168	-0.6	108.9
635	N	30.1	Very low	34.2	Very low	157 Å²	157	134 Å²	134	84%	0.84	78%	0.778	S	S	*	*			trans	-133.4	95.1	147.2	-170	79.5	0	0	0	108	G637	N635-G637 PolarHBondContact O-N 2.73Å
636	S	32.2	Very low	34.2	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	78%	0.779	S	S	*	*			trans	-67.8	124.8	-176.5	-57.4	0	0	0	0	110.6
637	G	33.5	Very low	33.7	Very low	62 Å²	62	133.6 Å²	133.6	64%	0.639	79%	0.789	S	S	*	*			trans	-147.2	92.9	-178.2	0	0	0	0	0	112.6	N635	N635-G637 PolarHBondContact O-N 2.73Å
638	S	33.7	Very low	34	Very low	107 Å²	107	133.1 Å²	133.1	75%	0.748	79%	0.786	S	S	*	*			trans	46.3	103	155.6	59	0	0	0	0	120.1
639	T	35.1	Very low	34.1	Very low	128 Å²	128	134.3 Å²	134.3	79%	0.785	79%	0.789	S	S	*	*				63.7	110.9	129.9	52.9	0	0	0	0	122.3
640	S	37.3	Very low	34.2	Very low	107 Å²	107	138 Å²	138	75%	0.748	79%	0.792	S	S	*	*				105.5	131.7	115.2	75	0	0	0	0	121.5
641	T	34.7	Very low	34.2	Very low	122 Å²	122	142 Å²	142	75%	0.748	80%	0.797	S	S	*	*			trans	80.8	96.6	147.9	-48.8	0	0	0	0	119.9
642	S	38.6	Very low	34.3	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	79%	0.79	S	S	*	*			trans	56.1	145.8	133.4	-57.1	0	0	0	0	121.9
643	Q	36.8	Very low	34.2	Very low	169 Å²	169	140.9 Å²	140.9	79%	0.79	79%	0.792	S	S	*	*			cis	-166.9	166.5	-21.7	-161.4	-177.9	31.9	0	0	106.8
644	M	34.7	Very low	34.3	Very low	177 Å²	177	139.8 Å²	139.8	87%	0.872	79%	0.787	S	S	*	*			trans	71.2	117.2	170.1	-54.2	-66.6	-111.7	0	0	117.4
645	G	34.5	Very low	34.4	Very low	79 Å²	79	138.3 Å²	138.3	81%	0.814	78%	0.781	S	S	*	*			trans	-167.5	136.9	169.9	0	0	0	0	0	110.4
646	V	39.9	Very low	34.7	Very low	145 Å²	145	139.1 Å²	139.1	88%	0.879	79%	0.786	S	S	*	*			trans	-109.1	144.5	-164.7	-178.9	0	0	0	0	112.4
647	Q	30.6	Very low	34.8	Very low	177 Å²	177	137.1 Å²	137.1	83%	0.827	78%	0.782	S	S	*	*			trans	-72.9	140.1	177.5	-71.9	-79	9.6	0	0	113.4
648	P	38.9	Very low	34.9	Very low	105 Å²	105	137.7 Å²	137.7	68%	0.682	79%	0.788	S	S	*	*			trans	-108.4	128.1	159.8	34.6	-25.3	0	0	0	112.1
649	R	33.5	Very low	35.1	Very low	230 Å²	230	139.8 Å²	139.8	87%	0.868	80%	0.796	S	S	*	*			trans	-110.1	123.3	172.5	172.7	-174.5	179.7	169.5	1.1	109
650	F	32.8	Very low	35.2	Very low	190 Å²	190	141 Å²	141	83%	0.833	80%	0.797	S	S	*	*			trans	-136.8	124.5	166.6	-81.4	-76.9	0	0	0	110.9
651	D	32.6	Very low	35.4	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	80%	0.799	S	S	*	*			trans	-143.4	128	171	-163.9	-9.7	0	0	0	105.9
652	L	34.8	Very low	35.5	Very low	123 Å²	123	140.4 Å²	140.4	64%	0.644	80%	0.8	S	S	*	*			trans	-142.3	82.8	-169	-88.7	173.6	0	0	0	110.7	F654	L652-F654 HydrophobicContact CD2-CE2 4.16Å
653	G	29.9	Very low	35.4	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	80%	0.802	S	S	*	*			trans	-81.3	110	162.2	0	0	0	0	0	110.6
654	F	34.2	Very low	35.3	Very low	186 Å²	186	142.1 Å²	142.1	82%	0.816	80%	0.8	S	S	*	*			trans	-83.6	124.5	169.3	-85.7	-86.9	0	0	0	110.9	L652	L652-F654 HydrophobicContact CD2-CE2 4.16Å
655	R	34.9	Very low	35.2	Very low	194 Å²	194	142 Å²	142	73%	0.732	80%	0.797	S	S	*	*			trans	-102.6	150.3	163.9	-111.4	-179.1	173.9	-117.2	1.9	109.1	H483	H483-R655 PolarHBondContact CD2-NH1 2.8Å; H483-R655 PolarHBondContact CD2-NH2 3.27Å; H483-R655 VanDerWaalsContact CD2-NH2 3.27Å; H483-R655 PolarHBondContact CE1-NH1 3.21Å; H483-R655 VanDerWaalsContact CE1-NH1 3.25Å; H483-R655 PolarHBondContact ND1-NH1 3.42Å; H483-R655 PolarHBondContact NE2-NH1 3.05Å; H483-R655 VanDerWaalsContact NE2-NH1 3.2Å; H483-R655 PolarHBondContact NE2-NH2 3.34Å
656	N	35	Very low	35	Very low	174 Å²	174	147 Å²	147	93%	0.93	80%	0.804	S	S	*	*			trans	-114.5	161.3	-166.6	-168.6	32.5	0	0	0	113.8
657	G	34.9	Very low	34.9	Very low	66 Å²	66	143 Å²	143	68%	0.68	79%	0.792	S	S	*	*			trans	142	121.2	-177	0	0	0	0	0	107.3
658	G	36.3	Very low	35.4	Very low	75 Å²	75	144.2 Å²	144.2	77%	0.773	80%	0.795	S	S	*	*			cis	100.8	127.2	43.8	0	0	0	0	0	107.3
659	V	37.1	Very low	35.3	Very low	150 Å²	150	146.9 Å²	146.9	91%	0.909	80%	0.803	S	S	*	*			cis	-146.5	167.9	19.9	179.4	0	0	0	0	110.5
660	L	36.4	Very low	35.5	Very low	155 Å²	155	145.3 Å²	145.3	81%	0.812	80%	0.802	S	S	*	*			trans	-83	-157	174.3	-52.3	168.7	0	0	0	111.3
661	P	41.7	Very low	35.8	Very low	121 Å²	121	144.5 Å²	144.5	79%	0.786	80%	0.798	S	S	*	*			cis	-132.7	164.1	-26.3	24.6	-2.4	0	0	0	115.7
662	A	37.7	Very low	36.3	Very low	95 Å²	95	143 Å²	143	79%	0.785	79%	0.79	S	S	*	*			trans	-165.3	111.1	147.2	0	0	0	0	0	108.5
663	Q	35.3	Very low	36.7	Very low	172 Å²	172	144.4 Å²	144.4	80%	0.804	80%	0.798	S	S	*	*				76.9	124.1	79.8	-157.4	-161.9	-70.9	0	0	114.7
664	L	34.7	Very low	37.5	Very low	143 Å²	143	145.2 Å²	145.2	75%	0.749	79%	0.791	S	S	*	*			trans	119.2	138.5	157.6	-69	169.9	0	0	0	118.9
665	E	32.8	Very low	38	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.813	79%	0.786	S	S	*	*			trans	63.7	97.3	155.1	-64.3	-65.3	86.9	0	0	120.8	G667	E665-G667 PolarHBondContact O-N 2.85Å
666	L	31.9	Very low	38.3	Very low	185 Å²	185	141.5 Å²	141.5	97%	0.969	79%	0.788	S	S	*	*			trans	-75	110	167.2	-176.5	82.1	0	0	0	111.1
667	G	36.2	Very low	38.4	Very low	61 Å²	61	144.7 Å²	144.7	63%	0.629	79%	0.788	S	S	*	*			trans	-168.9	118.2	175.7	0	0	0	0	0	116.6	E665	E665-G667 PolarHBondContact O-N 2.85Å
668	K	42.4	Very low	38.9	Very low	202 Å²	202	146.6 Å²	146.6	88%	0.878	79%	0.786	S	S	*	*			trans	63.6	90	164.7	-48.2	163.1	-171	165.4	0	116.2
669	L	35.6	Very low	39	Very low	162 Å²	162	154.2 Å²	154.2	85%	0.848	79%	0.792	S	S	*	*				-155.8	147.4	113.9	-129.4	68.8	0	0	0	110.5
670	K	38.2	Very low	39.1	Very low	197 Å²	197	152.3 Å²	152.3	86%	0.857	78%	0.782	S	S	*	*			trans	-151	120.3	-178.9	-179.8	175.4	-178	174.5	0	105.9
671	K	39.7	Very low	39.1	Very low	172 Å²	172	153.9 Å²	153.9	75%	0.748	79%	0.786	S	S	*	*			trans	73	136.9	-137.6	-49.4	164.9	-176.3	-178.6	0	109.7
672	D	41.6	Very low	39.5	Very low	117 Å²	117	157.1 Å²	157.1	63%	0.626	79%	0.794	S	S	*	*			cis	-126.5	126.4	12.6	-64.2	-74.2	0	0	0	112.3
673	L	43.2	Very low	39.6	Very low	154 Å²	154	160.3 Å²	160.3	81%	0.806	80%	0.795	S	S	*	*	S	Bend	trans	-134.9	1.5	172.7	-102.8	168.9	0	0	0	113.3
674	S	46.8	Very low	39.8	Very low	95 Å²	95	159.6 Å²	159.6	66%	0.664	79%	0.794	S	S	*	*	S	Bend	trans	-86.7	-13.1	-178.2	41.3	0	0	0	0	114.5
675	E	45	Very low	40.1	Very low	153 Å²	153	160.6 Å²	160.6	72%	0.715	80%	0.797	S	S	*	*	S	Bend	trans	-92.9	-19.8	-169	-58	-149.2	134.8	0	0	114.8	W677	E675-W677 PolarHBondContact O-N 3.37Å
676	L	41.1	Very low	40.5	Very low	148 Å²	148	159.8 Å²	159.8	78%	0.775	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-2.1	-175.9	-83.9	166.9	0	0	0	115.4
677	W	37.1	Very low	41.1	Very low	241 Å²	241	158.2 Å²	158.2	91%	0.913	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	32.1	-176.4	-71.6	81.2	0	0	0	114	E675	E675-W677 PolarHBondContact O-N 3.37Å
678	T	45.5	Very low	41.4	Very low	106 Å²	106	164.7 Å²	164.7	65%	0.65	80%	0.796	S	S	*	*			trans	-140	141	173.1	-29.4	0	0	0	0	114.8
679	R	38.6	Very low	41.3	Very low	236 Å²	236	162 Å²	162	89%	0.891	79%	0.79	S	S	*	*			trans	74.5	161.7	168.7	-57.9	-173.8	170.8	-159.1	-1.5	117.2
680	P	39.6	Very low	41.8	Very low	110 Å²	110	162 Å²	162	71%	0.714	79%	0.785	S	S	*	*			cis	-108.2	161.9	-12.9	9.9	12.8	0	0	0	113
681	Q	35.9	Very low	42.1	Very low	188 Å²	188	159.1 Å²	159.1	88%	0.879	78%	0.779	S	S	*	*			trans	-78.2	142.4	154.9	-75.8	-164.7	-104.5	0	0	109.6
682	I	50.9	Low	42.3	Very low	189 Å²	189	157.9 Å²	157.9	97%	0.969	78%	0.782	S	S	*	*			trans	-130.8	0	157.3	-63.9	-176.4	0	0	0	105.9	L2	L2-I682 HydrophobicContact CD1-CG2 3.63Å; L2-I682 HydrophobicContact CD2-CD1 4.11Å; L2-I682 HydrophobicContact CD2-CG2 4.32Å

Retrieved 682 of 682 residues in 616.6 ms (Link to these results)

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