A0A087XJ27_POEFO Loading...

Zinc finger and BTB domain-containing protein 46

Functions as a transcriptional repressor for PRDM1.

AlphaFold DB , UniProt , Accession A0A087XJ27, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 670 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	42.5	Very low	45.2	Very low	234 Å²	234	159.4 Å²	159.4	100%	1.153	78%	0.782	S	S	*	*				0	176.5	0	-69.5	161.2	76	0	0	108.5
2	N	39.7	Very low	47.3	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	75%	0.748	S	S	*	*			trans	65	83.2	-177.4	-60.1	5.6	0	0	0	115.2
3	N	38.5	Very low	49.7	Very low	162 Å²	162	149 Å²	149	87%	0.866	74%	0.737	S	S	*	*			trans	-134	44.3	153.8	-154.3	8	0	0	0	109.7	K5	N3-K5 PolarHBondContact O-N 2.89Å
4	R	42.3	Very low	51.9	Low	207 Å²	207	148.2 Å²	148.2	78%	0.781	72%	0.723	S	S	*	*			trans	-80.8	92.7	175.4	-77.9	-139.8	-174.1	179.8	1.1	109.1	E6	R4-E6 VanDerWaalsContact C-N 3.32Å; R4-E6 HydrophobicContact CB-CG 4.29Å; R4-E6 WeakPolarHBondContact CD-OE1 3.31Å; R4-E6 IonicContact CZ-OE1 3.4Å; R4-E6 IonicContact NE-OE1 3.73Å; R4-E6 IonicContact NH1-OE1 2.79Å; R4-E6 PolarHBondContact NH1-OE1 3.44Å; R4-E6 PolarHBondContact O-N 3.29Å
5	K	42.9	Very low	53.8	Low	171 Å²	171	148.3 Å²	148.3	74%	0.743	71%	0.712	S	S	*	*			trans	-87.9	73.8	174.2	-168.1	-177.8	-179.3	-173.2	0	109.3	N3 D7	N3-K5 PolarHBondContact O-N 2.89Å; K5-D7 PolarHBondContact O-N 2.85Å
6	E	49.4	Very low	55.7	Low	147 Å²	147	144.7 Å²	144.7	69%	0.687	69%	0.694	S	S	*	*			trans	-77.1	57.2	-177.1	-70.2	175.1	177.1	0	0	111.8	R4	R4-E6 VanDerWaalsContact C-N 3.32Å; R4-E6 HydrophobicContact CB-CG 4.29Å; R4-E6 WeakPolarHBondContact CD-OE1 3.31Å; R4-E6 IonicContact CZ-OE1 3.4Å; R4-E6 IonicContact NE-OE1 3.73Å; R4-E6 IonicContact NH1-OE1 2.79Å; R4-E6 PolarHBondContact NH1-OE1 3.44Å; R4-E6 PolarHBondContact O-N 3.29Å
7	D	38.8	Very low	57.6	Low	118 Å²	118	141.1 Å²	141.1	63%	0.631	68%	0.679	S	S	*	*			trans	-114.1	113.6	177.4	-80.7	-53.8	0	0	0	111.2	K5	K5-D7 PolarHBondContact O-N 2.85Å
8	M	45.3	Very low	59.3	Low	179 Å²	179	133.8 Å²	133.8	88%	0.882	65%	0.645	S	S	*	*			trans	64	71	155	-57.6	-178.5	2.3	0	0	120.2
9	E	47.9	Very low	60.7	Low	147 Å²	147	134.4 Å²	134.4	69%	0.687	64%	0.639	S	S	*	*			trans	-121.2	7.7	162.4	-76.5	-129.7	95	0	0	115.4	S11 S12 H13	E9-S11 PolarHBondContact O-N 2.79Å; E9-S11 VanDerWaalsContact O-N 3.13Å; E9-S12 PolarHBondContact O-N 2.78Å; E9-S12 VanDerWaalsContact O-N 3.15Å; E9-S12 PolarHBondContact O-OG 3.24Å; E9-S12 PolarHBondContact OE1-OG 3.5Å; E9-H13 PolarHBondContact O-N 2.85Å
10	I	49.9	Very low	62.1	Low	151 Å²	151	131.8 Å²	131.8	77%	0.774	63%	0.626	S	S	*	*	H	α-helix	trans	-59.2	-32.5	-179.4	-57.8	174.4	0	0	0	112	Y14	I10-Y14 PolarHBondContact O-N 3.3Å; I10-Y14 VanDerWaalsContact O-N 3.12Å
11	S	59.6	Low	63.5	Low	82 Å²	82	127 Å²	127	57%	0.573	61%	0.605	S	S	*	*	H	α-helix	trans	-79.8	-25.8	-179.7	-167.8	0	0	0	0	114	E9 R15	E9-S11 PolarHBondContact O-N 2.79Å; E9-S11 VanDerWaalsContact O-N 3.13Å; S11-R15 WeakPolarHBondContact O-CG 3.49Å
12	S	70.5	Confident	65.7	Low	52 Å²	52	117.6 Å²	117.6	36%	0.364	56%	0.559	S	S	.	*	H	α-helix	trans	-75.4	-44	168.9	36.6	0	0	0	0	110.3	E9 Y14 R15 Q16	E9-S12 PolarHBondContact O-N 2.78Å; E9-S12 VanDerWaalsContact O-N 3.15Å; E9-S12 PolarHBondContact O-OG 3.24Å; E9-S12 PolarHBondContact OE1-OG 3.5Å; S12-Y14 PolarHBondContact O-N 3.02Å; S12-R15 PolarHBondContact O-N 3.5Å; S12-R15 VanDerWaalsContact O-N 3.16Å; S12-Q16 PolarHBondContact O-N 3.33Å
13	H	79.1	Confident	68.1	Low	132 Å²	132	115 Å²	115	61%	0.611	54%	0.542	S	S	*	.	H	α-helix	trans	-56.8	-47.6	177.1	-173.7	-94.8	0	0	0	113.1	E9 R15 Q16 L17	E9-H13 PolarHBondContact O-N 2.85Å; H13-R15 VanDerWaalsContact C-N 3.3Å; H13-R15 PolarHBondContact O-N 2.7Å; H13-Q16 WeakPolarHBondContact O-CB 3.43Å; H13-Q16 PolarHBondContact O-N 2.98Å; H13-Q16 VanDerWaalsContact O-N 3.12Å; H13-L17 PolarHBondContact O-N 3.29Å
14	Y	80.4	Confident	70.6	Confident	138 Å²	138	109.2 Å²	109.2	54%	0.541	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-34.4	178	-176.6	-111	0	0	0	113.1	I10 S12 L18	I10-Y14 PolarHBondContact O-N 3.3Å; I10-Y14 VanDerWaalsContact O-N 3.12Å; S12-Y14 PolarHBondContact O-N 3.02Å; Y14-L18 HydrophobicContact CD1-CD1 4.05Å; Y14-L18 HydrophobicContact CE1-CD1 3.49Å; Y14-L18 VanDerWaalsContact CE1-CD1 3.49Å; Y14-L18 HydrophobicContact CE1-CG 4.13Å; Y14-L18 HydrophobicContact CE2-CG 4.43Å; Y14-L18 PolarHBondContact O-N 2.85Å
15	R	80	Confident	72.9	Confident	149 Å²	149	100.7 Å²	100.7	56%	0.562	48%	0.477	S	S	*	.	H	α-helix	trans	-71.3	-32.6	173.7	-73.3	176.1	175.4	172.4	-0.2	112.6	S11 S12 H13 R19	S11-R15 WeakPolarHBondContact O-CG 3.49Å; S12-R15 PolarHBondContact O-N 3.5Å; S12-R15 VanDerWaalsContact O-N 3.16Å; H13-R15 VanDerWaalsContact C-N 3.3Å; H13-R15 PolarHBondContact O-N 2.7Å; R15-R19 WeakPolarHBondContact O-CG 3.39Å; R15-R19 PolarHBondContact O-N 3.31Å; R15-R19 VanDerWaalsContact O-N 3.16Å
16	Q	85.1	Confident	75.1	Confident	91 Å²	91	98.9 Å²	98.9	43%	0.425	47%	0.472	S	S	.	.	H	α-helix	trans	-65.1	-47.8	172.3	-175.3	59.6	23.1	0	0	110.8	S12 H13 L18 R19 E20	S12-Q16 PolarHBondContact O-N 3.33Å; H13-Q16 WeakPolarHBondContact O-CB 3.43Å; H13-Q16 PolarHBondContact O-N 2.98Å; H13-Q16 VanDerWaalsContact O-N 3.12Å; Q16-L18 VanDerWaalsContact C-N 3.33Å; Q16-L18 PolarHBondContact O-N 3.09Å; Q16-R19 PolarHBondContact O-N 3.24Å; Q16-R19 VanDerWaalsContact O-N 3.16Å; Q16-E20 PolarHBondContact O-N 3.23Å
17	L	87.8	Confident	76.9	Confident	83 Å²	83	99 Å²	99	44%	0.435	47%	0.472	S	S	.	.	H	α-helix	trans	-60.7	-39.4	177.6	-176.8	63.8	0	0	0	112.5	H13 L21	H13-L17 PolarHBondContact O-N 3.29Å; L17-L21 HydrophobicContact CD1-CD1 4.35Å; L17-L21 HydrophobicContact CD1-CG 4.44Å; L17-L21 HydrophobicContact CG-CD1 4.05Å; L17-L21 WeakPolarHBondContact O-CB 2.94Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.44Å; L17-L21 PolarHBondContact O-N 3.21Å
18	L	87.2	Confident	79	Confident	11 Å²	11	94.1 Å²	94.1	6%	0.058	45%	0.45	C	S	.	.	H	α-helix	trans	-65.6	-37.4	174.8	-80.2	179.6	0	0	0	113	Y14 Q16 N22 Y94	Y14-L18 HydrophobicContact CD1-CD1 4.05Å; Y14-L18 HydrophobicContact CE1-CD1 3.49Å; Y14-L18 VanDerWaalsContact CE1-CD1 3.49Å; Y14-L18 HydrophobicContact CE1-CG 4.13Å; Y14-L18 HydrophobicContact CE2-CG 4.43Å; Y14-L18 PolarHBondContact O-N 2.85Å; Q16-L18 VanDerWaalsContact C-N 3.33Å; Q16-L18 PolarHBondContact O-N 3.09Å; L18-N22 WeakPolarHBondContact O-CB 3.21Å; L18-N22 PolarHBondContact O-N 2.88Å; L18-Y94 CarbonylContact C-O 3.59Å
19	R	86.3	Confident	80.8	Confident	144 Å²	144	89.9 Å²	89.9	54%	0.543	43%	0.43	S	S	.	.	H	α-helix	trans	-63.4	-49.8	173.6	-74.8	-168.1	-69.4	-174.6	-2	111.7	R15 Q16 L21 N22 E23	R15-R19 WeakPolarHBondContact O-CG 3.39Å; R15-R19 PolarHBondContact O-N 3.31Å; R15-R19 VanDerWaalsContact O-N 3.16Å; Q16-R19 PolarHBondContact O-N 3.24Å; Q16-R19 VanDerWaalsContact O-N 3.16Å; R19-L21 PolarHBondContact O-N 3.42Å; R19-N22 CarbonylContact O-C 3.53Å; R19-N22 WeakPolarHBondContact O-CA 3.3Å; R19-N22 WeakPolarHBondContact O-CB 3.19Å; R19-N22 PolarHBondContact O-N 2.98Å; R19-E23 PolarHBondContact O-N 2.61Å
20	E	89.5	Confident	82.5	Confident	82 Å²	82	88.5 Å²	88.5	38%	0.383	43%	0.426	S	S	.	.	H	α-helix	trans	-53.5	-51.3	175.8	-179	61.9	-133.7	0	0	111.4	Q16 N22 E23 Q24	Q16-E20 PolarHBondContact O-N 3.23Å; E20-N22 PolarHBondContact O-N 3.1Å; E20-E23 PolarHBondContact O-N 3.21Å; E20-E23 VanDerWaalsContact O-N 3.15Å; E20-Q24 WeakPolarHBondContact O-CG 3.37Å; E20-Q24 PolarHBondContact O-N 3.04Å; E20-Q24 PolarHBondContact OE1-NE2 2.75Å
21	L	90.6	Very high	84.3	Confident	33 Å²	33	82.1 Å²	82.1	17%	0.173	40%	0.395	C	S	.	.	H	α-helix	trans	-62.9	-27.1	175.7	-71.3	169.9	0	0	0	113.2	L17 R19 R25 H45 V48 Y94	L17-L21 HydrophobicContact CD1-CD1 4.35Å; L17-L21 HydrophobicContact CD1-CG 4.44Å; L17-L21 HydrophobicContact CG-CD1 4.05Å; L17-L21 WeakPolarHBondContact O-CB 2.94Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.44Å; L17-L21 PolarHBondContact O-N 3.21Å; R19-L21 PolarHBondContact O-N 3.42Å; L21-R25 WeakPolarHBondContact O-CB 3.46Å; L21-R25 PolarHBondContact O-N 3.14Å; L21-H45 PolarHBondContact O-CE1 3.08Å; L21-H45 VanDerWaalsContact O-CE1 3.24Å; L21-V48 HydrophobicContact CD1-CG2 4.16Å; L21-Y94 HydrophobicContact CB-CD1 4.17Å; L21-Y94 HydrophobicContact CB-CE1 4.02Å; L21-Y94 WeakPolarHBondContact O-CE1 3.45Å
22	N	90	Very high	85.7	Confident	35 Å²	35	81.8 Å²	81.8	19%	0.187	39%	0.387	C	S	.	.	H	α-helix	trans	-78	-32.9	175.6	-165.8	47.2	0	0	0	112.4	L18 R19 E20 R25 Q26 Y94	L18-N22 WeakPolarHBondContact O-CB 3.21Å; L18-N22 PolarHBondContact O-N 2.88Å; R19-N22 CarbonylContact O-C 3.53Å; R19-N22 WeakPolarHBondContact O-CA 3.3Å; R19-N22 WeakPolarHBondContact O-CB 3.19Å; R19-N22 PolarHBondContact O-N 2.98Å; E20-N22 PolarHBondContact O-N 3.1Å; N22-R25 PolarHBondContact OD1-NH1 3.26Å; N22-Q26 PolarHBondContact ND2-NE2 2.83Å; N22-Q26 VanDerWaalsContact O-CG 3.29Å; N22-Q26 WeakPolarHBondContact O-CG 3.48Å; N22-Q26 PolarHBondContact O-N 3.29Å; N22-Q26 PolarHBondContact O-NE2 3.22Å; N22-Y94 HydrophobicContact CB-CD1 4.06Å; N22-Y94 HydrophobicContact CB-CG 4.41Å; N22-Y94 VanDerWaalsContact OD1-CB 3.27Å; N22-Y94 WeakPolarHBondContact OD1-CB 3.27Å
23	E	89.9	Confident	86.6	Confident	102 Å²	102	79.3 Å²	79.3	48%	0.477	37%	0.369	S	S	.	.	H	α-helix	trans	-71.4	-47.2	174.5	-71.8	167	-143.1	0	0	109.7	R19 E20 R25 Q26 H27	R19-E23 PolarHBondContact O-N 2.61Å; E20-E23 PolarHBondContact O-N 3.21Å; E20-E23 VanDerWaalsContact O-N 3.15Å; E23-R25 VanDerWaalsContact C-N 3.31Å; E23-R25 PolarHBondContact O-N 3.12Å; E23-Q26 PolarHBondContact O-N 3.32Å; E23-H27 PolarHBondContact O-CD2 3.04Å; E23-H27 PolarHBondContact O-N 3.41Å
24	Q	90.7	Very high	87.1	Confident	39 Å²	39	74 Å²	74	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-55.4	-44	170.9	-67.5	173.9	11.7	0	0	112.1	E20 Q26 H27 G28 I29	E20-Q24 WeakPolarHBondContact O-CG 3.37Å; E20-Q24 PolarHBondContact O-N 3.04Å; E20-Q24 PolarHBondContact OE1-NE2 2.75Å; Q24-Q26 PolarHBondContact O-N 3.02Å; Q24-H27 CarbonylContact O-C 3.49Å; Q24-H27 PolarHBondContact O-N 3.35Å; Q24-G28 PolarHBondContact O-N 2.92Å; Q24-I29 HydrophobicContact CB-CB 4.44Å; Q24-I29 PolarHBondContact O-N 2.84Å
25	R	90.8	Very high	87.7	Confident	28 Å²	28	67.4 Å²	67.4	11%	0.106	32%	0.321	C	S	.	.	H	α-helix	trans	-58.1	-43.1	173	168.2	-176	164.9	-123.5	-2.6	112.8	L21 N22 E23 G28 D91 Y94	L21-R25 WeakPolarHBondContact O-CB 3.46Å; L21-R25 PolarHBondContact O-N 3.14Å; N22-R25 PolarHBondContact OD1-NH1 3.26Å; E23-R25 VanDerWaalsContact C-N 3.31Å; E23-R25 PolarHBondContact O-N 3.12Å; R25-G28 PolarHBondContact O-N 2.92Å; R25-G28 VanDerWaalsContact O-N 3.14Å; R25-D91 IonicContact CZ-OD1 2.81Å; R25-D91 VanDerWaalsContact CZ-OD1 3.26Å; R25-D91 IonicContact NH1-OD1 3.08Å; R25-D91 PolarHBondContact NH1-OD1 3.11Å; R25-D91 IonicContact NH2-OD1 2.65Å; R25-D91 PolarHBondContact NH2-OD1 3.36Å; R25-Y94 HydrophobicContact CB-CD1 4.42Å; R25-Y94 HydrophobicContact CB-CE1 4.06Å
26	Q	87.9	Confident	88.2	Confident	134 Å²	134	61.9 Å²	61.9	63%	0.626	30%	0.302	S	S	*	.	H	α-helix	trans	-68.8	-38.8	-179.3	-78.2	167.5	93.2	0	0	112.2	N22 E23 Q24 G28	N22-Q26 PolarHBondContact ND2-NE2 2.83Å; N22-Q26 VanDerWaalsContact O-CG 3.29Å; N22-Q26 WeakPolarHBondContact O-CG 3.48Å; N22-Q26 PolarHBondContact O-N 3.29Å; N22-Q26 PolarHBondContact O-NE2 3.22Å; E23-Q26 PolarHBondContact O-N 3.32Å; Q24-Q26 PolarHBondContact O-N 3.02Å; Q26-G28 PolarHBondContact O-N 3.3Å
27	H	86.8	Confident	88.6	Confident	149 Å²	149	57.6 Å²	57.6	69%	0.69	28%	0.282	S	S	*	.	H	α-helix	trans	-75.8	-10.2	170.9	-65.7	-66.6	0	0	0	113.1	E23 Q24 I29	E23-H27 PolarHBondContact O-CD2 3.04Å; E23-H27 PolarHBondContact O-N 3.41Å; Q24-H27 CarbonylContact O-C 3.49Å; Q24-H27 PolarHBondContact O-N 3.35Å; H27-I29 VanDerWaalsContact C-N 3.29Å; H27-I29 HydrophobicContact CB-CD1 3.68Å; H27-I29 HydrophobicContact CB-CG1 3.92Å; H27-I29 PolarHBondContact O-N 2.88Å
28	G	83.1	Confident	88.6	Confident	16 Å²	16	58.4 Å²	58.4	17%	0.165	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	23.5	180	0	0	0	0	0	114.3	Q24 R25 Q26 K43	Q24-G28 PolarHBondContact O-N 2.92Å; R25-G28 PolarHBondContact O-N 2.92Å; R25-G28 VanDerWaalsContact O-N 3.14Å; Q26-G28 PolarHBondContact O-N 3.3Å; G28-K43 VanDerWaalsContact CA-CD 3.48Å; G28-K43 PolarHBondContact O-NZ 3.04Å
29	I	83.8	Confident	88.5	Confident	90 Å²	90	61.1 Å²	61.1	46%	0.462	32%	0.318	S	S	.	.			trans	-82.7	144.3	178	-66	170.8	0	0	0	108.7	Q24 H27 C31 H45	Q24-I29 HydrophobicContact CB-CB 4.44Å; Q24-I29 PolarHBondContact O-N 2.84Å; H27-I29 VanDerWaalsContact C-N 3.29Å; H27-I29 HydrophobicContact CB-CD1 3.68Å; H27-I29 HydrophobicContact CB-CG1 3.92Å; H27-I29 PolarHBondContact O-N 2.88Å; I29-C31 PolarHBondContact O-N 2.87Å; I29-C31 PolarHBondContact O-SG 2.88Å; I29-H45 PolarHBondContact O-NE2 3.36Å
30	L	84.1	Confident	88.8	Confident	118 Å²	118	60 Å²	60	62%	0.618	32%	0.317	S	S	*	.	S	Bend	trans	52.1	22.2	177.3	-63.3	169.9	0	0	0	116	D32 H45	L30-D32 PolarHBondContact O-N 3.1Å; L30-H45 PolarHBondContact O-CD2 3.47Å
31	C	88	Confident	88.8	Confident	16 Å²	16	61.8 Å²	61.8	11%	0.108	33%	0.328	C	S	.	.			trans	-88.9	91.6	-175	-72.5	0	0	0	0	113.3	I29 A33 K43 A44	I29-C31 PolarHBondContact O-N 2.87Å; I29-C31 PolarHBondContact O-SG 2.88Å; C31-A33 PolarHBondContact O-N 3.32Å; C31-K43 HydrophobicContact CB-CB 3.89Å; C31-K43 HydrophobicContact CB-CD 4.39Å; C31-K43 HydrophobicContact CB-CG 4.44Å; C31-A44 CarbonylContact C-O 3.52Å
32	D	88.8	Confident	88.9	Confident	76 Å²	76	61.5 Å²	61.5	41%	0.406	33%	0.325	S	S	.	.			trans	-71.4	-6	-179.8	-28.3	-65.4	0	0	0	115.3	L30 K46 T73 T74	L30-D32 PolarHBondContact O-N 3.1Å; D32-K46 HydrophobicContact CB-CB 4.25Å; D32-T73 CarbonylContact O-C 3.59Å; D32-T73 WeakPolarHBondContact O-CA 3.2Å; D32-T74 PolarHBondContact O-N 3.22Å; D32-T74 PolarHBondContact O-OG1 3.25Å
33	A	88.6	Confident	89	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141	-176.9	0	0	0	0	0	112.5	C31 A44 K46 L49 T74	C31-A33 PolarHBondContact O-N 3.32Å; A33-A44 WeakPolarHBondContact CA-O 3.45Å; A33-A44 WeakPolarHBondContact CB-O 3.1Å; A33-A44 PolarHBondContact N-O 3.31Å; A33-A44 PolarHBondContact O-N 3.14Å; A33-A44 VanDerWaalsContact O-O 3.08Å; A33-K46 HydrophobicContact CB-CB 4.43Å; A33-L49 HydrophobicContact CB-CD1 3.81Å; A33-T74 WeakPolarHBondContact CA-O 3.27Å
34	C	90.8	Very high	89.2	Confident	20 Å²	20	59.8 Å²	59.8	14%	0.135	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.2	173.7	-73.4	0	0	0	0	108.8	I41 T74 V75 T76	C34-I41 HydrophobicContact CB-CG2 4.33Å; C34-T74 PolarHBondContact N-O 3.27Å; C34-V75 HydrophobicContact CB-CG2 4.34Å; C34-V75 CarbonylContact O-C 3.58Å; C34-V75 WeakPolarHBondContact O-CA 3.49Å; C34-T76 PolarHBondContact O-N 3.43Å; C34-T76 PolarHBondContact O-OG1 3.3Å; C34-T76 VanDerWaalsContact O-OG1 3.1Å
35	V	91.4	Very high	89.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.3	175.7	-163.8	0	0	0	0	108.4	V37 F42 L49 F56 T76 L78 F86	V35-V37 HydrophobicContact CG1-CG2 3.9Å; V35-F42 HydrophobicContact CB-CB 4.41Å; V35-F42 PolarHBondContact N-O 3.3Å; V35-F42 PolarHBondContact O-N 3.01Å; V35-L49 HydrophobicContact CG2-CD1 4.11Å; V35-F56 HydrophobicContact CG1-CZ 4.25Å; V35-F56 HydrophobicContact CG2-CE1 4.34Å; V35-F56 HydrophobicContact CG2-CZ 4.19Å; V35-T76 CarbonylContact C-O 3.58Å; V35-T76 WeakPolarHBondContact CA-O 3.23Å; V35-L78 HydrophobicContact CG1-CD1 3.66Å; V35-L78 HydrophobicContact CG1-CD2 4.26Å; V35-L78 HydrophobicContact CG1-CG 4.45Å; V35-F86 HydrophobicContact CB-CE1 3.88Å; V35-F86 HydrophobicContact CB-CZ 3.81Å; V35-F86 HydrophobicContact CG1-CE1 3.93Å; V35-F86 HydrophobicContact CG1-CE2 4.16Å; V35-F86 HydrophobicContact CG1-CZ 3.62Å; V35-F86 HydrophobicContact CG2-CE1 4.37Å; V35-F86 HydrophobicContact CG2-CZ 3.94Å
36	I	91.4	Very high	89.2	Confident	33 Å²	33	60.1 Å²	60.1	17%	0.169	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.8	-178.7	-56.5	-173.7	0	0	0	108.4	K40 I41 V75 T76 L78	I36-K40 WeakPolarHBondContact CA-O 3.49Å; I36-I41 HydrophobicContact CD1-CG1 4.41Å; I36-I41 HydrophobicContact CG1-CG1 4.27Å; I36-V75 HydrophobicContact CD1-CG1 3.72Å; I36-V75 HydrophobicContact CG1-CG1 4.16Å; I36-T76 PolarHBondContact N-O 3.41Å; I36-L78 PolarHBondContact O-N 3.15Å
37	V	93.1	Very high	89.2	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	122.9	-172.5	-164.6	0	0	0	0	108.4	V35 G39 K40 F42 L78 V81 A83 F86	V35-V37 HydrophobicContact CG1-CG2 3.9Å; V37-G39 PolarHBondContact O-N 3.24Å; V37-G39 VanDerWaalsContact O-N 3.16Å; V37-K40 PolarHBondContact N-O 3.08Å; V37-K40 WeakPolarHBondContact O-CA 3.36Å; V37-K40 WeakPolarHBondContact O-CB 3.22Å; V37-K40 PolarHBondContact O-N 3.19Å; V37-F42 HydrophobicContact CB-CD2 4.31Å; V37-F42 HydrophobicContact CB-CE2 4Å; V37-F42 HydrophobicContact CG2-CD2 4.03Å; V37-F42 HydrophobicContact CG2-CE2 4.17Å; V37-L78 HydrophobicContact CG2-CB 4.21Å; V37-V81 HydrophobicContact CG1-CB 4.41Å; V37-V81 WeakPolarHBondContact CG1-O 3.36Å; V37-A83 HydrophobicContact CB-CB 4.25Å; V37-A83 HydrophobicContact CG1-CB 4.18Å; V37-F86 HydrophobicContact CG1-CB 4.09Å; V37-F86 HydrophobicContact CG2-CB 4.22Å; V37-F86 HydrophobicContact CG2-CD1 3.65Å; V37-F86 HydrophobicContact CG2-CD2 4.42Å; V37-F86 HydrophobicContact CG2-CE1 4.14Å; V37-F86 HydrophobicContact CG2-CG 3.82Å
38	D	88.3	Confident	89.4	Confident	99 Å²	99	53.4 Å²	53.4	53%	0.529	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	39	-169.7	-54.2	-32.9	0	0	0	113.6	K40 T82 A83	D38-K40 PolarHBondContact O-N 2.87Å; D38-K40 VanDerWaalsContact O-N 3.17Å; D38-T82 WeakPolarHBondContact OD2-CA 3.49Å; D38-A83 HydrophobicContact CB-CB 4.01Å; D38-A83 WeakPolarHBondContact OD2-CB 3.43Å; D38-A83 PolarHBondContact OD2-N 3.45Å
39	G	85.4	Confident	89.8	Confident	69 Å²	69	52.6 Å²	52.6	71%	0.711	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	-1.5	-175.2	0	0	0	0	0	115.7	V37	V37-G39 PolarHBondContact O-N 3.24Å; V37-G39 VanDerWaalsContact O-N 3.16Å
40	K	91.3	Very high	90.1	Very high	120 Å²	120	50.4 Å²	50.4	52%	0.522	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.8	176.6	-58.2	178.9	-169.1	167.1	0	110.1	I36 V37 D38 F42 A83	I36-K40 WeakPolarHBondContact CA-O 3.49Å; V37-K40 PolarHBondContact N-O 3.08Å; V37-K40 WeakPolarHBondContact O-CA 3.36Å; V37-K40 WeakPolarHBondContact O-CB 3.22Å; V37-K40 PolarHBondContact O-N 3.19Å; D38-K40 PolarHBondContact O-N 2.87Å; D38-K40 VanDerWaalsContact O-N 3.17Å; K40-F42 HydrophobicContact CB-CE2 3.88Å; K40-F42 HydrophobicContact CB-CZ 4.38Å; K40-F42 WeakPolarHBondContact O-CD2 3.45Å; K40-A83 HydrophobicContact CB-CB 4.45Å; K40-A83 HydrophobicContact CD-CB 3.85Å; K40-A83 HydrophobicContact CG-CB 4.48Å
41	I	90.8	Very high	90.3	Very high	119 Å²	119	48 Å²	48	61%	0.61	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	124.1	-177.7	-50.8	177.9	0	0	0	109.7	C34 I36	C34-I41 HydrophobicContact CB-CG2 4.33Å; I36-I41 HydrophobicContact CD1-CG1 4.41Å; I36-I41 HydrophobicContact CG1-CG1 4.27Å
42	F	92.7	Very high	90.4	Very high	27 Å²	27	49.6 Å²	49.6	12%	0.118	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.8	175.7	-64.7	-91.4	0	0	0	109.9	V35 V37 K40 A83 F86 K87 L90	V35-F42 HydrophobicContact CB-CB 4.41Å; V35-F42 PolarHBondContact N-O 3.3Å; V35-F42 PolarHBondContact O-N 3.01Å; V37-F42 HydrophobicContact CB-CD2 4.31Å; V37-F42 HydrophobicContact CB-CE2 4Å; V37-F42 HydrophobicContact CG2-CD2 4.03Å; V37-F42 HydrophobicContact CG2-CE2 4.17Å; K40-F42 HydrophobicContact CB-CE2 3.88Å; K40-F42 HydrophobicContact CB-CZ 4.38Å; K40-F42 WeakPolarHBondContact O-CD2 3.45Å; F42-A83 HydrophobicContact CE2-CB 4.06Å; F42-A83 HydrophobicContact CZ-CB 4.11Å; F42-F86 HydrophobicContact CB-CD1 4.4Å; F42-F86 HydrophobicContact CB-CE1 3.85Å; F42-F86 HydrophobicContact CD1-CD1 4.26Å; F42-F86 HydrophobicContact CD1-CE1 4.41Å; F42-F86 AromaticContact CD2-CD1 3.75Å; F42-F86 HydrophobicContact CD2-CD1 3.75Å; F42-F86 HydrophobicContact CD2-CE1 4.02Å; F42-F86 HydrophobicContact CE1-CD1 4.48Å; F42-F86 HydrophobicContact CE2-CD1 4.02Å; F42-F86 AromaticContact CG-CD1 3.88Å; F42-F86 HydrophobicContact CG-CD1 3.88Å; F42-F86 AromaticContact CG-CE1 3.84Å; F42-F86 HydrophobicContact CG-CE1 3.84Å; F42-F86 HydrophobicContact CZ-CD1 4.37Å; F42-K87 HydrophobicContact CE1-CB 3.8Å; F42-K87 HydrophobicContact CE1-CG 4.13Å; F42-K87 HydrophobicContact CZ-CB 4.18Å; F42-L90 HydrophobicContact CB-CD2 3.92Å; F42-L90 HydrophobicContact CD1-CD2 4.21Å; F42-L90 HydrophobicContact CG-CD2 4.42Å
43	K	92	Very high	90.6	Very high	101 Å²	101	46.1 Å²	46.1	44%	0.439	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	142.8	170.1	-70.3	-174.5	173.1	-172	0	110.8	G28 C31	G28-K43 VanDerWaalsContact CA-CD 3.48Å; G28-K43 PolarHBondContact O-NZ 3.04Å; C31-K43 HydrophobicContact CB-CB 3.89Å; C31-K43 HydrophobicContact CB-CD 4.39Å; C31-K43 HydrophobicContact CB-CG 4.44Å
44	A	92.6	Very high	90.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	156.3	175	0	0	0	0	0	112.5	C31 A33 L49 L90	C31-A44 CarbonylContact C-O 3.52Å; A33-A44 WeakPolarHBondContact CA-O 3.45Å; A33-A44 WeakPolarHBondContact CB-O 3.1Å; A33-A44 PolarHBondContact N-O 3.31Å; A33-A44 PolarHBondContact O-N 3.14Å; A33-A44 VanDerWaalsContact O-O 3.08Å; A44-L49 HydrophobicContact CB-CD1 4.06Å; A44-L49 HydrophobicContact CB-CD2 4.04Å; A44-L49 HydrophobicContact CB-CG 4.05Å; A44-L90 HydrophobicContact CB-CD1 4.32Å
45	H	91.8	Very high	90.8	Very high	12 Å²	12	54.2 Å²	54.2	6%	0.056	30%	0.296	C	S	.	.			trans	-76	129	166.6	-51.4	86.7	0	0	0	110.5	L21 I29 L30 N47 V48 L49 Y94	L21-H45 PolarHBondContact O-CE1 3.08Å; L21-H45 VanDerWaalsContact O-CE1 3.24Å; I29-H45 PolarHBondContact O-NE2 3.36Å; L30-H45 PolarHBondContact O-CD2 3.47Å; H45-N47 VanDerWaalsContact C-N 3.26Å; H45-N47 PolarHBondContact O-N 2.73Å; H45-V48 HydrophobicContact CB-CG2 4.15Å; H45-V48 PolarHBondContact O-N 3.15Å; H45-L49 PolarHBondContact O-N 3.14Å; H45-Y94 WeakPolarHBondContact CB-OH 3.39Å; H45-Y94 PolarHBondContact N-OH 3.04Å; H45-Y94 AromaticContact ND1-CE1 3.53Å; H45-Y94 AromaticContact ND1-CZ 3.74Å; H45-Y94 PolarHBondContact ND1-OH 3.45Å
46	K	90.1	Very high	90.8	Very high	62 Å²	62	54.2 Å²	54.2	27%	0.27	30%	0.296	S	S	.	.	H	α-helix	trans	-59.7	-36.6	-177.4	-166.8	170.7	-173.2	167.9	0	112.4	D32 A33 V48 L49 L50 Y60	D32-K46 HydrophobicContact CB-CB 4.25Å; A33-K46 HydrophobicContact CB-CB 4.43Å; K46-V48 PolarHBondContact O-N 2.96Å; K46-L49 PolarHBondContact O-N 3.02Å; K46-L50 HydrophobicContact CG-CD1 4.25Å; K46-L50 WeakPolarHBondContact O-CB 3.35Å; K46-L50 VanDerWaalsContact O-CG 3.25Å; K46-L50 WeakPolarHBondContact O-CG 3.11Å; K46-L50 PolarHBondContact O-N 3.36Å; K46-Y60 HydrophobicContact CG-CD2 4.17Å; K46-Y60 HydrophobicContact CG-CE2 4.3Å; K46-Y60 HydrophobicContact CG-CG 4.46Å
47	N	88.9	Confident	90.7	Very high	124 Å²	124	58.6 Å²	58.6	66%	0.663	31%	0.313	S	S	*	.	H	α-helix	trans	-64.7	-35.4	179.5	-67.1	-25.1	0	0	0	113.4	H45 G51	H45-N47 VanDerWaalsContact C-N 3.26Å; H45-N47 PolarHBondContact O-N 2.73Å; N47-G51 PolarHBondContact O-N 2.97Å
48	V	90.6	Very high	90.4	Very high	18 Å²	18	61.8 Å²	61.8	11%	0.109	33%	0.333	C	S	.	.	H	α-helix	trans	-71.7	-41.2	175.3	-177.8	0	0	0	0	110.4	L21 H45 K46 L50 G51 S52 M93 Y94	L21-V48 HydrophobicContact CD1-CG2 4.16Å; H45-V48 HydrophobicContact CB-CG2 4.15Å; H45-V48 PolarHBondContact O-N 3.15Å; K46-V48 PolarHBondContact O-N 2.96Å; V48-L50 PolarHBondContact O-N 3.46Å; V48-G51 PolarHBondContact O-N 2.85Å; V48-S52 PolarHBondContact O-N 3.03Å; V48-S52 PolarHBondContact O-OG 2.85Å; V48-M93 HydrophobicContact CG1-CB 4.38Å; V48-M93 HydrophobicContact CG1-CE 4.42Å; V48-Y94 HydrophobicContact CB-CE1 4.38Å; V48-Y94 HydrophobicContact CB-CE2 4.04Å; V48-Y94 HydrophobicContact CG1-CD2 3.98Å; V48-Y94 HydrophobicContact CG1-CE1 4.28Å; V48-Y94 HydrophobicContact CG1-CE2 3.57Å; V48-Y94 HydrophobicContact CG1-CG 4.49Å; V48-Y94 HydrophobicContact CG2-CE1 4.03Å
49	L	91.4	Very high	90.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59	-46.1	174.4	-61.8	-177.4	0	0	0	112.1	A33 V35 A44 H45 K46 G51 S53 F56 Y60 L90 M93	A33-L49 HydrophobicContact CB-CD1 3.81Å; V35-L49 HydrophobicContact CG2-CD1 4.11Å; A44-L49 HydrophobicContact CB-CD1 4.06Å; A44-L49 HydrophobicContact CB-CD2 4.04Å; A44-L49 HydrophobicContact CB-CG 4.05Å; H45-L49 PolarHBondContact O-N 3.14Å; K46-L49 PolarHBondContact O-N 3.02Å; L49-G51 VanDerWaalsContact C-N 3.31Å; L49-G51 PolarHBondContact O-N 3.3Å; L49-S53 PolarHBondContact O-N 2.81Å; L49-F56 HydrophobicContact CB-CB 4.03Å; L49-F56 HydrophobicContact CB-CD2 4Å; L49-F56 HydrophobicContact CB-CG 3.98Å; L49-F56 HydrophobicContact CD1-CD1 4.45Å; L49-F56 HydrophobicContact CD1-CE1 4.48Å; L49-F56 HydrophobicContact CD2-CD2 4.05Å; L49-F56 HydrophobicContact CD2-CE2 3.92Å; L49-F56 HydrophobicContact CD2-CZ 4.42Å; L49-F56 HydrophobicContact CG-CD2 4.46Å; L49-Y60 HydrophobicContact CB-CE2 4.13Å; L49-Y60 HydrophobicContact CD1-CE2 3.91Å; L49-Y60 WeakPolarHBondContact CD1-OH 3.41Å; L49-L90 HydrophobicContact CD2-CD1 3.83Å; L49-M93 HydrophobicContact CD2-CE 3.72Å
50	L	90.7	Very high	90.1	Very high	44 Å²	44	56.5 Å²	56.5	23%	0.23	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-31.5	176	-73.7	173.2	0	0	0	113.8	K46 V48 K57 Y60	K46-L50 HydrophobicContact CG-CD1 4.25Å; K46-L50 WeakPolarHBondContact O-CB 3.35Å; K46-L50 VanDerWaalsContact O-CG 3.25Å; K46-L50 WeakPolarHBondContact O-CG 3.11Å; K46-L50 PolarHBondContact O-N 3.36Å; V48-L50 PolarHBondContact O-N 3.46Å; L50-K57 HydrophobicContact CD2-CB 4.34Å; L50-K57 HydrophobicContact CD2-CG 4.49Å; L50-Y60 HydrophobicContact CD2-CD2 4.02Å; L50-Y60 HydrophobicContact CD2-CG 4.5Å; L50-Y60 HydrophobicContact CG-CD2 4.32Å
51	G	88.1	Confident	89.4	Confident	66 Å²	66	54.5 Å²	54.5	68%	0.68	29%	0.288	S	S	*	.	H	α-helix	trans	-73.8	-50.3	-177.7	0	0	0	0	0	113.1	N47 V48 L49	N47-G51 PolarHBondContact O-N 2.97Å; V48-G51 PolarHBondContact O-N 2.85Å; L49-G51 VanDerWaalsContact C-N 3.31Å; L49-G51 PolarHBondContact O-N 3.3Å
52	S	89.8	Confident	88.1	Confident	50 Å²	50	55.3 Å²	55.3	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-89.2	-22.9	-171.8	-37.9	0	0	0	0	114.7	V48	V48-S52 PolarHBondContact O-N 3.03Å; V48-S52 PolarHBondContact O-OG 2.85Å
53	S	93.1	Very high	86.4	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.021	30%	0.304	C	S	.	.			trans	-121.3	128.2	-172.2	176.6	0	0	0	0	113.7	L49 Y55 F56 K57 L115	L49-S53 PolarHBondContact O-N 2.81Å; S53-Y55 VanDerWaalsContact C-N 3.3Å; S53-Y55 WeakPolarHBondContact OG-CB 3.31Å; S53-Y55 PolarHBondContact OG-N 3.01Å; S53-Y55 VanDerWaalsContact OG-N 3.15Å; S53-F56 PolarHBondContact OG-N 3.2Å; S53-K57 WeakPolarHBondContact O-CB 3.19Å; S53-K57 PolarHBondContact O-N 2.86Å; S53-L115 PolarHBondContact OG-O 3.46Å
54	R	91.1	Very high	84.5	Confident	151 Å²	151	61.8 Å²	61.8	57%	0.57	32%	0.323	S	S	*	.	H	α-helix	trans	-70.4	-26.7	171	-61.1	-179.3	-172.8	156.7	9.9	112.5	T58 Q116	R54-T58 WeakPolarHBondContact O-CB 3.41Å; R54-T58 PolarHBondContact O-N 3.05Å; R54-T58 PolarHBondContact O-OG1 3.15Å; R54-Q116 HydrophobicContact CB-CB 4.02Å
55	Y	92.4	Very high	82.5	Confident	40 Å²	40	71.4 Å²	71.4	16%	0.157	37%	0.365	C	S	.	.	H	α-helix	trans	-64.3	-57.9	173.3	174.7	-86.7	0	0	0	110.6	S53 K57 T58 L59 L78 Y114 L115	S53-Y55 VanDerWaalsContact C-N 3.3Å; S53-Y55 WeakPolarHBondContact OG-CB 3.31Å; S53-Y55 PolarHBondContact OG-N 3.01Å; S53-Y55 VanDerWaalsContact OG-N 3.15Å; Y55-K57 VanDerWaalsContact C-N 3.29Å; Y55-K57 PolarHBondContact O-N 3.29Å; Y55-T58 WeakPolarHBondContact O-CB 3.27Å; Y55-T58 PolarHBondContact O-N 3.25Å; Y55-L59 HydrophobicContact CE1-CD1 3.66Å; Y55-L59 WeakPolarHBondContact O-CB 3.27Å; Y55-L59 PolarHBondContact O-N 2.8Å; Y55-L78 HydrophobicContact CE1-CD1 4.35Å; Y55-Y114 HydrophobicContact CD2-CD1 4.43Å; Y55-Y114 HydrophobicContact CD2-CE1 4.03Å; Y55-Y114 HydrophobicContact CE1-CE1 4.13Å; Y55-Y114 HydrophobicContact CE2-CD1 4.2Å; Y55-Y114 AromaticContact CE2-CE1 3.38Å; Y55-Y114 HydrophobicContact CE2-CE1 3.38Å; Y55-Y114 AromaticContact CE2-CZ 3.6Å; Y55-Y114 AromaticContact CZ-CE1 3.43Å; Y55-Y114 VanDerWaalsContact CZ-CE1 3.43Å; Y55-Y114 AromaticContact CZ-CZ 3.86Å; Y55-Y114 PolarHBondContact OH-OH 3.01Å; Y55-L115 HydrophobicContact CD1-CD2 3.66Å; Y55-L115 HydrophobicContact CE1-CD2 4.29Å; Y55-L115 HydrophobicContact CG-CD2 4.08Å
56	F	91.1	Very high	80.2	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.6	-36.2	179.2	-72.4	-59.3	0	0	0	112.3	V35 L49 S53 T58 L59 Y60 L78 F86 L115	V35-F56 HydrophobicContact CG1-CZ 4.25Å; V35-F56 HydrophobicContact CG2-CE1 4.34Å; V35-F56 HydrophobicContact CG2-CZ 4.19Å; L49-F56 HydrophobicContact CB-CB 4.03Å; L49-F56 HydrophobicContact CB-CD2 4Å; L49-F56 HydrophobicContact CB-CG 3.98Å; L49-F56 HydrophobicContact CD1-CD1 4.45Å; L49-F56 HydrophobicContact CD1-CE1 4.48Å; L49-F56 HydrophobicContact CD2-CD2 4.05Å; L49-F56 HydrophobicContact CD2-CE2 3.92Å; L49-F56 HydrophobicContact CD2-CZ 4.42Å; L49-F56 HydrophobicContact CG-CD2 4.46Å; S53-F56 PolarHBondContact OG-N 3.2Å; F56-T58 VanDerWaalsContact C-N 3.34Å; F56-T58 PolarHBondContact O-N 3.08Å; F56-L59 PolarHBondContact O-N 2.79Å; F56-Y60 HydrophobicContact CB-CD2 4.11Å; F56-Y60 HydrophobicContact CB-CE2 4Å; F56-Y60 AromaticContact CD1-CE2 3.77Å; F56-Y60 HydrophobicContact CD1-CE2 3.77Å; F56-Y60 HydrophobicContact CG-CE2 4.2Å; F56-Y60 VanDerWaalsContact O-CD2 3.31Å; F56-Y60 WeakPolarHBondContact O-CD2 3.45Å; F56-Y60 PolarHBondContact O-N 3.35Å; F56-L78 HydrophobicContact CE1-CD1 4.42Å; F56-L78 HydrophobicContact CZ-CD2 4.38Å; F56-F86 HydrophobicContact CE2-CE2 4.17Å; F56-F86 AromaticContact CZ-CE2 3.98Å; F56-F86 HydrophobicContact CZ-CE2 3.98Å; F56-F86 HydrophobicContact CZ-CZ 4.2Å; F56-L115 HydrophobicContact CD2-CD2 4.06Å; F56-L115 HydrophobicContact CE2-CD1 4.5Å; F56-L115 HydrophobicContact CE2-CD2 3.51Å; F56-L115 HydrophobicContact CZ-CD2 3.86Å
57	K	89.2	Confident	78.2	Confident	124 Å²	124	75.1 Å²	75.1	54%	0.539	41%	0.414	S	S	.	.	H	α-helix	trans	-61.8	-37.6	171.5	-171.3	162.1	-172.6	157.8	0	113.4	L50 S53 Y55 C61	L50-K57 HydrophobicContact CD2-CB 4.34Å; L50-K57 HydrophobicContact CD2-CG 4.49Å; S53-K57 WeakPolarHBondContact O-CB 3.19Å; S53-K57 PolarHBondContact O-N 2.86Å; Y55-K57 VanDerWaalsContact C-N 3.29Å; Y55-K57 PolarHBondContact O-N 3.29Å; K57-C61 WeakPolarHBondContact O-CB 3.27Å; K57-C61 PolarHBondContact O-N 3.42Å; K57-C61 PolarHBondContact O-SG 3.12Å
58	T	88.1	Confident	76.1	Confident	68 Å²	68	75.6 Å²	75.6	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-70.7	-44.2	175.7	-57.7	0	0	0	0	111	R54 Y55 F56 Q62	R54-T58 WeakPolarHBondContact O-CB 3.41Å; R54-T58 PolarHBondContact O-N 3.05Å; R54-T58 PolarHBondContact O-OG1 3.15Å; Y55-T58 WeakPolarHBondContact O-CB 3.27Å; Y55-T58 PolarHBondContact O-N 3.25Å; F56-T58 VanDerWaalsContact C-N 3.34Å; F56-T58 PolarHBondContact O-N 3.08Å; T58-Q62 WeakPolarHBondContact O-CB 3.5Å; T58-Q62 VanDerWaalsContact O-CG 3.23Å; T58-Q62 WeakPolarHBondContact O-CG 3.37Å; T58-Q62 PolarHBondContact O-N 2.88Å
59	L	85.3	Confident	74	Confident	45 Å²	45	78.6 Å²	78.6	24%	0.236	43%	0.432	C	S	.	.	H	α-helix	trans	-64.3	-59.3	-177.4	-165	162.7	0	0	0	111.4	Y55 F56 C61 Q62 V63 T76	Y55-L59 HydrophobicContact CE1-CD1 3.66Å; Y55-L59 WeakPolarHBondContact O-CB 3.27Å; Y55-L59 PolarHBondContact O-N 2.8Å; F56-L59 PolarHBondContact O-N 2.79Å; L59-C61 PolarHBondContact O-N 3.13Å; L59-Q62 PolarHBondContact O-N 2.94Å; L59-Q62 VanDerWaalsContact O-N 3.16Å; L59-V63 HydrophobicContact CD2-CG2 4.4Å; L59-V63 PolarHBondContact O-N 3.16Å; L59-T76 HydrophobicContact CD1-CG2 4.31Å; L59-T76 HydrophobicContact CD2-CG2 3.91Å
60	Y	81.8	Confident	72	Confident	12 Å²	12	84.4 Å²	84.4	5%	0.047	47%	0.47	C	S	.	.	H	α-helix	trans	-70.4	-27.2	-175.6	-63.5	-50.9	0	0	0	113.8	K46 L49 L50 F56 K64 T76	K46-Y60 HydrophobicContact CG-CD2 4.17Å; K46-Y60 HydrophobicContact CG-CE2 4.3Å; K46-Y60 HydrophobicContact CG-CG 4.46Å; L49-Y60 HydrophobicContact CB-CE2 4.13Å; L49-Y60 HydrophobicContact CD1-CE2 3.91Å; L49-Y60 WeakPolarHBondContact CD1-OH 3.41Å; L50-Y60 HydrophobicContact CD2-CD2 4.02Å; L50-Y60 HydrophobicContact CD2-CG 4.5Å; L50-Y60 HydrophobicContact CG-CD2 4.32Å; F56-Y60 HydrophobicContact CB-CD2 4.11Å; F56-Y60 HydrophobicContact CB-CE2 4Å; F56-Y60 AromaticContact CD1-CE2 3.77Å; F56-Y60 HydrophobicContact CD1-CE2 3.77Å; F56-Y60 HydrophobicContact CG-CE2 4.2Å; F56-Y60 VanDerWaalsContact O-CD2 3.31Å; F56-Y60 WeakPolarHBondContact O-CD2 3.45Å; F56-Y60 PolarHBondContact O-N 3.35Å; Y60-K64 PolarHBondContact O-N 3Å; Y60-T76 HydrophobicContact CE1-CG2 3.66Å
61	C	75.3	Confident	70.1	Confident	78 Å²	78	90.7 Å²	90.7	53%	0.527	50%	0.497	S	S	.	.	H	α-helix	trans	-78.2	-17.8	173.3	-65.8	0	0	0	0	113.6	K57 L59	K57-C61 WeakPolarHBondContact O-CB 3.27Å; K57-C61 PolarHBondContact O-N 3.42Å; K57-C61 PolarHBondContact O-SG 3.12Å; L59-C61 PolarHBondContact O-N 3.13Å
62	Q	63.7	Low	68.8	Low	137 Å²	137	93.9 Å²	93.9	64%	0.64	50%	0.495	S	S	*	.	H	α-helix	trans	-78.8	-40.5	169.8	-77.1	174.5	11.3	0	0	111.6	T58 L59 K64 K65	T58-Q62 WeakPolarHBondContact O-CB 3.5Å; T58-Q62 VanDerWaalsContact O-CG 3.23Å; T58-Q62 WeakPolarHBondContact O-CG 3.37Å; T58-Q62 PolarHBondContact O-N 2.88Å; L59-Q62 PolarHBondContact O-N 2.94Å; L59-Q62 VanDerWaalsContact O-N 3.16Å; Q62-K64 PolarHBondContact O-N 3.42Å; Q62-K65 PolarHBondContact O-N 3.12Å
63	V	57	Low	67.7	Low	72 Å²	72	95.1 Å²	95.1	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-57.5	-34.9	176.5	174.5	0	0	0	0	111.9	L59 K65 G66	L59-V63 HydrophobicContact CD2-CG2 4.4Å; L59-V63 PolarHBondContact O-N 3.16Å; V63-K65 PolarHBondContact O-N 3.34Å; V63-G66 PolarHBondContact O-N 2.97Å
64	K	53	Low	67	Low	192 Å²	192	96.3 Å²	96.3	84%	0.835	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	8.1	178.4	-125.3	-166.7	-178.2	-161.3	0	115.8	Y60 Q62	Y60-K64 PolarHBondContact O-N 3Å; Q62-K64 PolarHBondContact O-N 3.42Å
65	K	49.8	Very low	66.6	Low	201 Å²	201	92.9 Å²	92.9	87%	0.874	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-8.7	166.8	-81.2	-156.6	166.5	-147.8	0	114.6	Q62 V63	Q62-K65 PolarHBondContact O-N 3.12Å; V63-K65 PolarHBondContact O-N 3.34Å
66	G	43.7	Very low	66.2	Low	46 Å²	46	91.6 Å²	91.6	47%	0.474	50%	0.499	S	S	.	.	S	Bend	trans	-93.3	146.8	160.3	0	0	0	0	0	109.6	V63 E68	V63-G66 PolarHBondContact O-N 2.97Å; G66-E68 PolarHBondContact O-N 2.77Å
67	A	47.6	Very low	66	Low	107 Å²	107	96.9 Å²	96.9	88%	0.884	52%	0.524	S	S	*	.			trans	-77.3	112.2	172	0	0	0	0	0	109.3
68	E	44.8	Very low	65.9	Low	134 Å²	134	91 Å²	91	63%	0.626	50%	0.498	S	S	*	.			trans	-131.8	137	176.6	-81.6	-72.6	152	0	0	108.2	G66	G66-E68 PolarHBondContact O-N 2.77Å
69	P	46.3	Very low	65.6	Low	81 Å²	81	94.1 Å²	94.1	53%	0.526	51%	0.512	S	S	.	.			trans	-66.9	148.6	-173.5	26.8	-34.2	0	0	0	112.4	H71	P69-H71 PolarHBondContact O-N 2.92Å
70	P	51.3	Low	65.5	Low	122 Å²	122	98.1 Å²	98.1	79%	0.792	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	4.2	-164.6	29.1	-37.3	0	0	0	115.9
71	H	50.8	Low	65.9	Low	176 Å²	176	97.7 Å²	97.7	82%	0.815	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	2	-171.7	-63.3	-11.8	0	0	0	114.5	P69 T73	P69-H71 PolarHBondContact O-N 2.92Å; H71-T73 PolarHBondContact O-N 3.42Å
72	Q	60.1	Low	66.6	Low	133 Å²	133	96.3 Å²	96.3	62%	0.621	52%	0.52	S	S	*	.			trans	-73.7	125.1	175.8	-159.8	80.2	19	0	0	110.5	T74	Q72-T74 PolarHBondContact O-N 3.31Å
73	T	66.2	Low	68	Low	76 Å²	76	89.9 Å²	89.9	47%	0.466	49%	0.491	S	S	.	.			trans	-66.6	119.5	173.4	44.7	0	0	0	0	110	D32 H71 V75	D32-T73 CarbonylContact O-C 3.59Å; D32-T73 WeakPolarHBondContact O-CA 3.2Å; H71-T73 PolarHBondContact O-N 3.42Å; T73-V75 PolarHBondContact O-N 3.26Å; T73-V75 VanDerWaalsContact O-N 3.1Å
74	T	79	Confident	69.6	Low	28 Å²	28	90.2 Å²	90.2	17%	0.172	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	104	-172.1	44.7	0	0	0	0	111.9	D32 A33 C34 Q72	D32-T74 PolarHBondContact O-N 3.22Å; D32-T74 PolarHBondContact O-OG1 3.25Å; A33-T74 WeakPolarHBondContact CA-O 3.27Å; C34-T74 PolarHBondContact N-O 3.27Å; Q72-T74 PolarHBondContact O-N 3.31Å
75	V	81.9	Confident	71.4	Confident	79 Å²	79	81.1 Å²	81.1	48%	0.479	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	136.9	173.8	-173.5	0	0	0	0	110.3	C34 I36 T73	C34-V75 HydrophobicContact CB-CG2 4.34Å; C34-V75 CarbonylContact O-C 3.58Å; C34-V75 WeakPolarHBondContact O-CA 3.49Å; I36-V75 HydrophobicContact CD1-CG1 3.72Å; I36-V75 HydrophobicContact CG1-CG1 4.16Å; T73-V75 PolarHBondContact O-N 3.26Å; T73-V75 VanDerWaalsContact O-N 3.1Å
76	T	85.1	Confident	73.6	Confident	12 Å²	12	71.6 Å²	71.6	7%	0.074	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	135.2	178.5	46.3	0	0	0	0	110.3	C34 V35 I36 L59 Y60	C34-T76 PolarHBondContact O-N 3.43Å; C34-T76 PolarHBondContact O-OG1 3.3Å; C34-T76 VanDerWaalsContact O-OG1 3.1Å; V35-T76 CarbonylContact C-O 3.58Å; V35-T76 WeakPolarHBondContact CA-O 3.23Å; I36-T76 PolarHBondContact N-O 3.41Å; L59-T76 HydrophobicContact CD1-CG2 4.31Å; L59-T76 HydrophobicContact CD2-CG2 3.91Å; Y60-T76 HydrophobicContact CE1-CG2 3.66Å
77	H	86	Confident	75.9	Confident	112 Å²	112	74.4 Å²	74.4	52%	0.519	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.9	-179.4	-71.8	-109.3	0	0	0	110.6
78	L	87.9	Confident	78	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.379	C	S	.	.			trans	-124.9	87	177.4	-84	65.3	0	0	0	110	V35 I36 V37 Y55 F56 I80 V81 F86 Y114 L115	V35-L78 HydrophobicContact CG1-CD1 3.66Å; V35-L78 HydrophobicContact CG1-CD2 4.26Å; V35-L78 HydrophobicContact CG1-CG 4.45Å; I36-L78 PolarHBondContact O-N 3.15Å; V37-L78 HydrophobicContact CG2-CB 4.21Å; Y55-L78 HydrophobicContact CE1-CD1 4.35Å; F56-L78 HydrophobicContact CE1-CD1 4.42Å; F56-L78 HydrophobicContact CZ-CD2 4.38Å; L78-I80 VanDerWaalsContact C-N 3.27Å; L78-I80 PolarHBondContact O-N 2.78Å; L78-V81 HydrophobicContact CD2-CG2 4.36Å; L78-F86 HydrophobicContact CD2-CD2 4.04Å; L78-F86 HydrophobicContact CD2-CE2 4.02Å; L78-Y114 HydrophobicContact CD2-CD1 4.45Å; L78-Y114 HydrophobicContact CD2-CE1 4.25Å; L78-Y114 HydrophobicContact CG-CE1 4.01Å; L78-L115 HydrophobicContact CD2-CD2 4.05Å
79	D	81.4	Confident	80.3	Confident	134 Å²	134	64.1 Å²	64.1	72%	0.717	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	1.6	-172.8	-39.7	-61.1	0	0	0	114.2
80	I	83.1	Confident	82.5	Confident	128 Å²	128	60.2 Å²	60.2	66%	0.656	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-11.4	-174.8	-68.3	168.4	0	0	0	111.9	L78 Y114	L78-I80 VanDerWaalsContact C-N 3.27Å; L78-I80 PolarHBondContact O-N 2.78Å; I80-Y114 HydrophobicContact CB-CD2 4.22Å; I80-Y114 HydrophobicContact CB-CE2 4.04Å; I80-Y114 HydrophobicContact CD1-CE2 3.89Å; I80-Y114 HydrophobicContact CG2-CD2 3.86Å; I80-Y114 HydrophobicContact CG2-CE2 4.12Å
81	V	89.2	Confident	84.4	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.018	30%	0.298	C	S	.	.	S	Bend	trans	-112.7	134.4	-172.7	179.4	0	0	0	0	109	V37 L78 F86 A111 Y114	V37-V81 HydrophobicContact CG1-CB 4.41Å; V37-V81 WeakPolarHBondContact CG1-O 3.36Å; L78-V81 HydrophobicContact CD2-CG2 4.36Å; V81-F86 HydrophobicContact CG1-CB 3.93Å; V81-A111 HydrophobicContact CG1-CB 3.43Å; V81-A111 VanDerWaalsContact CG1-CB 3.43Å; V81-Y114 HydrophobicContact CG2-CD1 3.58Å; V81-Y114 HydrophobicContact CG2-CD2 4.5Å; V81-Y114 HydrophobicContact CG2-CE1 4.29Å; V81-Y114 HydrophobicContact CG2-CG 3.71Å
82	T	91.1	Very high	86.3	Confident	49 Å²	49	50.9 Å²	50.9	30%	0.301	27%	0.271	S	S	.	.			trans	-70.4	141.7	174.4	63.7	0	0	0	0	110.8	D38 T84 G85 F86 E107	D38-T82 WeakPolarHBondContact OD2-CA 3.49Å; T82-T84 PolarHBondContact O-N 3.44Å; T82-T84 PolarHBondContact OG1-OG1 3.49Å; T82-T84 VanDerWaalsContact OG1-OG1 3.13Å; T82-G85 PolarHBondContact O-N 3.06Å; T82-G85 VanDerWaalsContact O-N 3.11Å; T82-G85 PolarHBondContact OG1-N 2.81Å; T82-G85 VanDerWaalsContact OG1-N 3.17Å; T82-F86 PolarHBondContact O-N 3.16Å; T82-E107 PolarHBondContact OG1-OE2 3.48Å
83	A	91.6	Very high	87.8	Confident	3 Å²	3	44.9 Å²	44.9	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-24.4	178.6	0	0	0	0	0	112.8	V37 D38 K40 F42 K87	V37-A83 HydrophobicContact CB-CB 4.25Å; V37-A83 HydrophobicContact CG1-CB 4.18Å; D38-A83 HydrophobicContact CB-CB 4.01Å; D38-A83 WeakPolarHBondContact OD2-CB 3.43Å; D38-A83 PolarHBondContact OD2-N 3.45Å; K40-A83 HydrophobicContact CB-CB 4.45Å; K40-A83 HydrophobicContact CD-CB 3.85Å; K40-A83 HydrophobicContact CG-CB 4.48Å; F42-A83 HydrophobicContact CE2-CB 4.06Å; F42-A83 HydrophobicContact CZ-CB 4.11Å; A83-K87 WeakPolarHBondContact O-CB 3.17Å; A83-K87 PolarHBondContact O-N 3.34Å
84	T	91.6	Very high	88.9	Confident	79 Å²	79	41.3 Å²	41.3	49%	0.485	22%	0.221	S	C	.	.	H	α-helix	trans	-69.6	-49.8	170.7	39.4	0	0	0	0	112.1	T82 K87 A88 E107	T82-T84 PolarHBondContact O-N 3.44Å; T82-T84 PolarHBondContact OG1-OG1 3.49Å; T82-T84 VanDerWaalsContact OG1-OG1 3.13Å; T84-K87 PolarHBondContact O-N 3.07Å; T84-A88 PolarHBondContact O-N 3.5Å; T84-A88 VanDerWaalsContact O-N 3.07Å; T84-E107 VanDerWaalsContact CB-OE2 3.22Å; T84-E107 WeakPolarHBondContact CB-OE2 3.33Å; T84-E107 PolarHBondContact OG1-OE2 3.24Å
85	G	91.6	Very high	89.4	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-41.5	175	0	0	0	0	0	112.2	T82 A88 I89	T82-G85 PolarHBondContact O-N 3.06Å; T82-G85 VanDerWaalsContact O-N 3.11Å; T82-G85 PolarHBondContact OG1-N 2.81Å; T82-G85 VanDerWaalsContact OG1-N 3.17Å; G85-A88 PolarHBondContact O-N 2.89Å; G85-I89 PolarHBondContact O-N 3.48Å; G85-I89 VanDerWaalsContact O-N 3.13Å
86	F	94.3	Very high	89.5	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-44.5	174.7	-172.3	-104	0	0	0	112.5	V35 V37 F42 F56 L78 V81 T82 A88 I89 L90 L115	V35-F86 HydrophobicContact CB-CE1 3.88Å; V35-F86 HydrophobicContact CB-CZ 3.81Å; V35-F86 HydrophobicContact CG1-CE1 3.93Å; V35-F86 HydrophobicContact CG1-CE2 4.16Å; V35-F86 HydrophobicContact CG1-CZ 3.62Å; V35-F86 HydrophobicContact CG2-CE1 4.37Å; V35-F86 HydrophobicContact CG2-CZ 3.94Å; V37-F86 HydrophobicContact CG1-CB 4.09Å; V37-F86 HydrophobicContact CG2-CB 4.22Å; V37-F86 HydrophobicContact CG2-CD1 3.65Å; V37-F86 HydrophobicContact CG2-CD2 4.42Å; V37-F86 HydrophobicContact CG2-CE1 4.14Å; V37-F86 HydrophobicContact CG2-CG 3.82Å; F42-F86 HydrophobicContact CB-CD1 4.4Å; F42-F86 HydrophobicContact CB-CE1 3.85Å; F42-F86 HydrophobicContact CD1-CD1 4.26Å; F42-F86 HydrophobicContact CD1-CE1 4.41Å; F42-F86 AromaticContact CD2-CD1 3.75Å; F42-F86 HydrophobicContact CD2-CD1 3.75Å; F42-F86 HydrophobicContact CD2-CE1 4.02Å; F42-F86 HydrophobicContact CE1-CD1 4.48Å; F42-F86 HydrophobicContact CE2-CD1 4.02Å; F42-F86 AromaticContact CG-CD1 3.88Å; F42-F86 HydrophobicContact CG-CD1 3.88Å; F42-F86 AromaticContact CG-CE1 3.84Å; F42-F86 HydrophobicContact CG-CE1 3.84Å; F42-F86 HydrophobicContact CZ-CD1 4.37Å; F56-F86 HydrophobicContact CE2-CE2 4.17Å; F56-F86 AromaticContact CZ-CE2 3.98Å; F56-F86 HydrophobicContact CZ-CE2 3.98Å; F56-F86 HydrophobicContact CZ-CZ 4.2Å; L78-F86 HydrophobicContact CD2-CD2 4.04Å; L78-F86 HydrophobicContact CD2-CE2 4.02Å; V81-F86 HydrophobicContact CG1-CB 3.93Å; T82-F86 PolarHBondContact O-N 3.16Å; F86-A88 PolarHBondContact O-N 3.06Å; F86-I89 PolarHBondContact O-N 3.21Å; F86-L90 HydrophobicContact CE1-CB 4.31Å; F86-L90 HydrophobicContact CE1-CD2 3.86Å; F86-L90 HydrophobicContact CZ-CD1 4.45Å; F86-L90 HydrophobicContact CZ-CD2 4.34Å; F86-L90 WeakPolarHBondContact O-CB 3.25Å; F86-L90 PolarHBondContact O-N 3.47Å; F86-L115 HydrophobicContact CD2-CD1 3.95Å; F86-L115 HydrophobicContact CE2-CD1 3.95Å
87	K	92.9	Very high	89.5	Confident	105 Å²	105	46.9 Å²	46.9	46%	0.457	25%	0.253	S	S	.	.	H	α-helix	trans	-57.8	-48.4	176.1	-175.7	-177.9	-174.4	-61.8	0	111.4	F42 A83 T84 I89 L90 D91	F42-K87 HydrophobicContact CE1-CB 3.8Å; F42-K87 HydrophobicContact CE1-CG 4.13Å; F42-K87 HydrophobicContact CZ-CB 4.18Å; A83-K87 WeakPolarHBondContact O-CB 3.17Å; A83-K87 PolarHBondContact O-N 3.34Å; T84-K87 PolarHBondContact O-N 3.07Å; K87-I89 VanDerWaalsContact C-N 3.26Å; K87-I89 PolarHBondContact O-N 3.25Å; K87-L90 PolarHBondContact O-N 3.33Å; K87-D91 WeakPolarHBondContact CG-OD2 3.34Å; K87-D91 IonicContact NZ-OD2 2.72Å; K87-D91 PolarHBondContact NZ-OD2 3.32Å; K87-D91 WeakPolarHBondContact O-CB 3.43Å; K87-D91 PolarHBondContact O-N 2.99Å
88	A	91.5	Very high	89.7	Confident	25 Å²	25	43.9 Å²	43.9	21%	0.207	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-35.7	179.6	0	0	0	0	0	112.6	T84 G85 F86 F92 V108	T84-A88 PolarHBondContact O-N 3.5Å; T84-A88 VanDerWaalsContact O-N 3.07Å; G85-A88 PolarHBondContact O-N 2.89Å; F86-A88 PolarHBondContact O-N 3.06Å; A88-F92 PolarHBondContact O-N 3.25Å; A88-F92 VanDerWaalsContact O-N 3.08Å; A88-V108 HydrophobicContact CB-CG2 3.86Å
89	I	93.6	Very high	89.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69.3	-47.2	172.9	-83.5	170.4	0	0	0	112.4	G85 F86 K87 D91 F92 M93 A111 A112 L115 M117	G85-I89 PolarHBondContact O-N 3.48Å; G85-I89 VanDerWaalsContact O-N 3.13Å; F86-I89 PolarHBondContact O-N 3.21Å; K87-I89 VanDerWaalsContact C-N 3.26Å; K87-I89 PolarHBondContact O-N 3.25Å; I89-D91 VanDerWaalsContact C-N 3.28Å; I89-D91 PolarHBondContact O-N 3.23Å; I89-F92 CarbonylContact O-C 3.59Å; I89-F92 WeakPolarHBondContact O-CA 3.41Å; I89-F92 WeakPolarHBondContact O-CB 3.36Å; I89-F92 PolarHBondContact O-N 3.45Å; I89-F92 VanDerWaalsContact O-N 3.12Å; I89-M93 HydrophobicContact CG2-CG 4.48Å; I89-M93 HydrophobicContact CG2-SD 3.9Å; I89-M93 WeakPolarHBondContact O-CG 3.48Å; I89-M93 PolarHBondContact O-N 3.26Å; I89-A111 VanDerWaalsContact CD1-C 3.46Å; I89-A111 HydrophobicContact CD1-CB 3.39Å; I89-A112 HydrophobicContact CD1-CB 3.87Å; I89-A112 VanDerWaalsContact CD1-N 3.27Å; I89-L115 HydrophobicContact CD1-CD1 4.15Å; I89-L115 HydrophobicContact CG2-CD1 3.72Å; I89-M117 HydrophobicContact CB-CE 4.17Å; I89-M117 HydrophobicContact CD1-CE 3.67Å; I89-M117 HydrophobicContact CG1-CE 3.82Å; I89-M117 HydrophobicContact CG2-CE 3.33Å; I89-M117 HydrophobicContact CG2-SD 4.48Å
90	L	92.5	Very high	90	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-37.4	-178	-168	62.8	0	0	0	110.2	F42 A44 L49 F86 K87 M93 Y94	F42-L90 HydrophobicContact CB-CD2 3.92Å; F42-L90 HydrophobicContact CD1-CD2 4.21Å; F42-L90 HydrophobicContact CG-CD2 4.42Å; A44-L90 HydrophobicContact CB-CD1 4.32Å; L49-L90 HydrophobicContact CD2-CD1 3.83Å; F86-L90 HydrophobicContact CE1-CB 4.31Å; F86-L90 HydrophobicContact CE1-CD2 3.86Å; F86-L90 HydrophobicContact CZ-CD1 4.45Å; F86-L90 HydrophobicContact CZ-CD2 4.34Å; F86-L90 WeakPolarHBondContact O-CB 3.25Å; F86-L90 PolarHBondContact O-N 3.47Å; K87-L90 PolarHBondContact O-N 3.33Å; L90-M93 HydrophobicContact CD1-SD 4.42Å; L90-M93 PolarHBondContact O-N 3.16Å; L90-Y94 HydrophobicContact CD1-CD2 4.15Å; L90-Y94 HydrophobicContact CD1-CE2 3.84Å; L90-Y94 HydrophobicContact CG-CD2 4.39Å; L90-Y94 HydrophobicContact CG-CE2 4.4Å; L90-Y94 VanDerWaalsContact O-CD2 3.3Å; L90-Y94 WeakPolarHBondContact O-CD2 3.4Å; L90-Y94 PolarHBondContact O-N 3.02Å
91	D	90.5	Very high	90.3	Very high	44 Å²	44	39.9 Å²	39.9	24%	0.235	23%	0.234	C	C	.	.	H	α-helix	trans	-66.9	-35.6	172.7	-63.6	-16.3	0	0	0	112.1	R25 K87 I89 Y94 S95	R25-D91 IonicContact CZ-OD1 2.81Å; R25-D91 VanDerWaalsContact CZ-OD1 3.26Å; R25-D91 IonicContact NH1-OD1 3.08Å; R25-D91 PolarHBondContact NH1-OD1 3.11Å; R25-D91 IonicContact NH2-OD1 2.65Å; R25-D91 PolarHBondContact NH2-OD1 3.36Å; K87-D91 WeakPolarHBondContact CG-OD2 3.34Å; K87-D91 IonicContact NZ-OD2 2.72Å; K87-D91 PolarHBondContact NZ-OD2 3.32Å; K87-D91 WeakPolarHBondContact O-CB 3.43Å; K87-D91 PolarHBondContact O-N 2.99Å; I89-D91 VanDerWaalsContact C-N 3.28Å; I89-D91 PolarHBondContact O-N 3.23Å; D91-Y94 PolarHBondContact O-N 3.18Å; D91-S95 VanDerWaalsContact O-CB 3.28Å; D91-S95 WeakPolarHBondContact O-CB 3.34Å; D91-S95 PolarHBondContact O-N 3.21Å; D91-S95 PolarHBondContact O-OG 3.47Å
92	F	91.4	Very high	90.2	Very high	57 Å²	57	44.5 Å²	44.5	25%	0.25	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-42.7	169.2	164.3	-99.1	0	0	0	112.3	A88 I89 Y94 S95 A96 H97 L98 I120	A88-F92 PolarHBondContact O-N 3.25Å; A88-F92 VanDerWaalsContact O-N 3.08Å; I89-F92 CarbonylContact O-C 3.59Å; I89-F92 WeakPolarHBondContact O-CA 3.41Å; I89-F92 WeakPolarHBondContact O-CB 3.36Å; I89-F92 PolarHBondContact O-N 3.45Å; I89-F92 VanDerWaalsContact O-N 3.12Å; F92-Y94 PolarHBondContact O-N 3.44Å; F92-S95 PolarHBondContact O-N 2.93Å; F92-A96 VanDerWaalsContact O-CA 3.26Å; F92-A96 WeakPolarHBondContact O-CA 3.45Å; F92-A96 PolarHBondContact O-N 3.21Å; F92-H97 WeakPolarHBondContact CA-O 3.46Å; F92-L98 HydrophobicContact CB-CB 4.22Å; F92-L98 HydrophobicContact CB-CD1 4.11Å; F92-L98 HydrophobicContact CD2-CB 3.71Å; F92-L98 HydrophobicContact CE2-CB 4.46Å; F92-L98 HydrophobicContact CG-CB 4.18Å; F92-I120 HydrophobicContact CD1-CD1 3.5Å; F92-I120 HydrophobicContact CD1-CG1 4.28Å; F92-I120 HydrophobicContact CE1-CD1 3.5Å; F92-I120 HydrophobicContact CE1-CG1 3.9Å; F92-I120 HydrophobicContact CG-CD1 4.4Å; F92-I120 HydrophobicContact CZ-CD1 4.38Å; F92-I120 HydrophobicContact CZ-CG1 4.33Å
93	M	90.8	Very high	90	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.039	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-28.6	180	-71	171.8	55	0	0	113	V48 L49 I89 L90 M117	V48-M93 HydrophobicContact CG1-CB 4.38Å; V48-M93 HydrophobicContact CG1-CE 4.42Å; L49-M93 HydrophobicContact CD2-CE 3.72Å; I89-M93 HydrophobicContact CG2-CG 4.48Å; I89-M93 HydrophobicContact CG2-SD 3.9Å; I89-M93 WeakPolarHBondContact O-CG 3.48Å; I89-M93 PolarHBondContact O-N 3.26Å; L90-M93 HydrophobicContact CD1-SD 4.42Å; L90-M93 PolarHBondContact O-N 3.16Å; M93-M117 HydrophobicContact SD-SD 4.49Å
94	Y	91	Very high	90	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-100.2	-9.2	-179.6	-81.4	-96.7	0	0	0	114.7	L18 L21 N22 R25 H45 V48 L90 D91 F92	L18-Y94 CarbonylContact C-O 3.59Å; L21-Y94 HydrophobicContact CB-CD1 4.17Å; L21-Y94 HydrophobicContact CB-CE1 4.02Å; L21-Y94 WeakPolarHBondContact O-CE1 3.45Å; N22-Y94 HydrophobicContact CB-CD1 4.06Å; N22-Y94 HydrophobicContact CB-CG 4.41Å; N22-Y94 VanDerWaalsContact OD1-CB 3.27Å; N22-Y94 WeakPolarHBondContact OD1-CB 3.27Å; R25-Y94 HydrophobicContact CB-CD1 4.42Å; R25-Y94 HydrophobicContact CB-CE1 4.06Å; H45-Y94 WeakPolarHBondContact CB-OH 3.39Å; H45-Y94 PolarHBondContact N-OH 3.04Å; H45-Y94 AromaticContact ND1-CE1 3.53Å; H45-Y94 AromaticContact ND1-CZ 3.74Å; H45-Y94 PolarHBondContact ND1-OH 3.45Å; V48-Y94 HydrophobicContact CB-CE1 4.38Å; V48-Y94 HydrophobicContact CB-CE2 4.04Å; V48-Y94 HydrophobicContact CG1-CD2 3.98Å; V48-Y94 HydrophobicContact CG1-CE1 4.28Å; V48-Y94 HydrophobicContact CG1-CE2 3.57Å; V48-Y94 HydrophobicContact CG1-CG 4.49Å; V48-Y94 HydrophobicContact CG2-CE1 4.03Å; L90-Y94 HydrophobicContact CD1-CD2 4.15Å; L90-Y94 HydrophobicContact CD1-CE2 3.84Å; L90-Y94 HydrophobicContact CG-CD2 4.39Å; L90-Y94 HydrophobicContact CG-CE2 4.4Å; L90-Y94 VanDerWaalsContact O-CD2 3.3Å; L90-Y94 WeakPolarHBondContact O-CD2 3.4Å; L90-Y94 PolarHBondContact O-N 3.02Å; D91-Y94 PolarHBondContact O-N 3.18Å; F92-Y94 PolarHBondContact O-N 3.44Å
95	S	87.8	Confident	90	Very high	46 Å²	46	49.4 Å²	49.4	32%	0.322	28%	0.278	S	S	.	.	H	α-helix	trans	-120.3	-15.3	178.3	66.2	0	0	0	0	114.6	D91 F92 H97	D91-S95 VanDerWaalsContact O-CB 3.28Å; D91-S95 WeakPolarHBondContact O-CB 3.34Å; D91-S95 PolarHBondContact O-N 3.21Å; D91-S95 PolarHBondContact O-OG 3.47Å; F92-S95 PolarHBondContact O-N 2.93Å; S95-H97 PolarHBondContact O-CD2 3.02Å; S95-H97 PolarHBondContact O-N 3.27Å; S95-H97 PolarHBondContact OG-N 2.86Å; S95-H97 VanDerWaalsContact OG-N 3.11Å; S95-H97 PolarHBondContact OG-O 3.25Å
96	A	85.6	Confident	90	Very high	54 Å²	54	54.9 Å²	54.9	45%	0.446	31%	0.306	S	S	.	.	S	Bend	trans	56.3	14.4	-163.7	0	0	0	0	0	115.1	F92	F92-A96 VanDerWaalsContact O-CA 3.26Å; F92-A96 WeakPolarHBondContact O-CA 3.45Å; F92-A96 PolarHBondContact O-N 3.21Å
97	H	85	Confident	89.9	Confident	136 Å²	136	58.2 Å²	58.2	63%	0.63	32%	0.322	S	S	*	.			trans	-118.9	134.1	179.6	-74.1	-75.8	0	0	0	111.6	F92 S95	F92-H97 WeakPolarHBondContact CA-O 3.46Å; S95-H97 PolarHBondContact O-CD2 3.02Å; S95-H97 PolarHBondContact O-N 3.27Å; S95-H97 PolarHBondContact OG-N 2.86Å; S95-H97 VanDerWaalsContact OG-N 3.11Å; S95-H97 PolarHBondContact OG-O 3.25Å
98	L	89.3	Confident	89.9	Confident	49 Å²	49	53.2 Å²	53.2	26%	0.257	30%	0.3	S	S	.	.			trans	-130.4	119.2	-179	-178	64.9	0	0	0	110.4	F92 L100 V108 I120	F92-L98 HydrophobicContact CB-CB 4.22Å; F92-L98 HydrophobicContact CB-CD1 4.11Å; F92-L98 HydrophobicContact CD2-CB 3.71Å; F92-L98 HydrophobicContact CE2-CB 4.46Å; F92-L98 HydrophobicContact CG-CB 4.18Å; L98-L100 HydrophobicContact CD2-CD2 3.9Å; L98-L100 HydrophobicContact CD2-CG 4.21Å; L98-L100 HydrophobicContact CG-CD2 4.02Å; L98-L100 HydrophobicContact CG-CG 4.22Å; L98-V108 HydrophobicContact CD1-CG1 4.07Å; L98-V108 HydrophobicContact CD2-CG1 4.04Å; L98-I120 HydrophobicContact CD2-CG2 3.64Å
99	A	87.6	Confident	90	Very high	78 Å²	78	53.9 Å²	53.9	65%	0.645	30%	0.299	S	S	*	.			trans	-90.9	101.8	175.9	0	0	0	0	0	110.5	N104	A99-N104 PolarHBondContact O-ND2 3.26Å
100	L	88.7	Confident	90	Very high	37 Å²	37	56.8 Å²	56.8	19%	0.194	32%	0.32	C	S	.	.			trans	-89.9	136.5	173.5	-64.8	-178.1	0	0	0	111.2	L98 V105 V108 A123 F127	L98-L100 HydrophobicContact CD2-CD2 3.9Å; L98-L100 HydrophobicContact CD2-CG 4.21Å; L98-L100 HydrophobicContact CG-CD2 4.02Å; L98-L100 HydrophobicContact CG-CG 4.22Å; L100-V105 HydrophobicContact CD2-CG2 4.36Å; L100-V108 HydrophobicContact CD2-CB 4.23Å; L100-V108 HydrophobicContact CD2-CG1 3.9Å; L100-A123 HydrophobicContact CD1-CB 4.47Å; L100-F127 HydrophobicContact CB-CD2 3.93Å; L100-F127 HydrophobicContact CB-CE2 4.12Å; L100-F127 HydrophobicContact CB-CG 4.2Å; L100-F127 HydrophobicContact CD1-CB 4.09Å; L100-F127 HydrophobicContact CD1-CG 4.39Å
101	T	89.3	Confident	90.1	Very high	63 Å²	63	56.8 Å²	56.8	39%	0.387	32%	0.32	S	S	.	.			trans	-140.1	161.3	178.7	69.2	0	0	0	0	109.2	K103 N104 V105	T101-K103 PolarHBondContact O-N 2.98Å; T101-K103 VanDerWaalsContact O-N 3.14Å; T101-K103 PolarHBondContact OG1-N 3.4Å; T101-N104 WeakPolarHBondContact CA-OD1 3.45Å; T101-N104 PolarHBondContact N-OD1 2.91Å; T101-N104 PolarHBondContact O-N 2.96Å; T101-N104 PolarHBondContact O-OD1 3.42Å; T101-N104 VanDerWaalsContact OG1-CG 3.29Å; T101-N104 PolarHBondContact OG1-N 2.96Å; T101-N104 PolarHBondContact OG1-OD1 3.37Å; T101-V105 VanDerWaalsContact O-CB 3.29Å; T101-V105 WeakPolarHBondContact O-CB 3.35Å; T101-V105 WeakPolarHBondContact O-CG1 3.25Å; T101-V105 PolarHBondContact O-N 3.16Å
102	S	86.8	Confident	90.3	Very high	100 Å²	100	54.7 Å²	54.7	70%	0.699	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.2	174	51	0	0	0	0	113.7
103	K	87.4	Confident	90.4	Very high	189 Å²	189	55.6 Å²	55.6	82%	0.822	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-41	-179.6	-62.8	-174.8	179.3	-177	0	113.3	T101	T101-K103 PolarHBondContact O-N 2.98Å; T101-K103 VanDerWaalsContact O-N 3.14Å; T101-K103 PolarHBondContact OG1-N 3.4Å
104	N	91	Very high	90.6	Very high	39 Å²	39	58.4 Å²	58.4	21%	0.209	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-14.1	-174.2	74.7	-16.3	0	0	0	115.1	A99 T101 I106 E107 V108	A99-N104 PolarHBondContact O-ND2 3.26Å; T101-N104 WeakPolarHBondContact CA-OD1 3.45Å; T101-N104 PolarHBondContact N-OD1 2.91Å; T101-N104 PolarHBondContact O-N 2.96Å; T101-N104 PolarHBondContact O-OD1 3.42Å; T101-N104 VanDerWaalsContact OG1-CG 3.29Å; T101-N104 PolarHBondContact OG1-N 2.96Å; T101-N104 PolarHBondContact OG1-OD1 3.37Å; N104-I106 VanDerWaalsContact C-N 3.25Å; N104-I106 PolarHBondContact O-N 2.91Å; N104-I106 VanDerWaalsContact O-N 3.17Å; N104-E107 PolarHBondContact O-N 3.15Å; N104-V108 HydrophobicContact CB-CG2 4.39Å; N104-V108 WeakPolarHBondContact O-CG2 3.26Å; N104-V108 PolarHBondContact O-N 3.05Å
105	V	91.8	Very high	90.7	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.03	33%	0.332	C	S	.	.	H	α-helix	trans	-59.4	-33.1	-172.3	65.5	0	0	0	0	113.5	L100 T101 M109 C124 F127 I128	L100-V105 HydrophobicContact CD2-CG2 4.36Å; T101-V105 VanDerWaalsContact O-CB 3.29Å; T101-V105 WeakPolarHBondContact O-CB 3.35Å; T101-V105 WeakPolarHBondContact O-CG1 3.25Å; T101-V105 PolarHBondContact O-N 3.16Å; V105-M109 WeakPolarHBondContact O-CB 3.47Å; V105-M109 PolarHBondContact O-N 2.93Å; V105-C124 HydrophobicContact CG2-CB 3.74Å; V105-F127 HydrophobicContact CB-CD1 4.09Å; V105-F127 HydrophobicContact CB-CE1 4.29Å; V105-F127 HydrophobicContact CG1-CD1 4.19Å; V105-F127 HydrophobicContact CG1-CE1 4.22Å; V105-F127 HydrophobicContact CG2-CD1 3.88Å; V105-I128 HydrophobicContact CG1-CD1 4.4Å; V105-I128 HydrophobicContact CG1-CG1 4.02Å; V105-I128 HydrophobicContact CG2-CD1 4.07Å; V105-I128 HydrophobicContact CG2-CG1 3.93Å
106	I	90.9	Very high	91	Very high	116 Å²	116	60.5 Å²	60.5	60%	0.595	34%	0.337	S	S	*	.	H	α-helix	trans	-69.6	-46.8	178.8	-58.3	178	0	0	0	110.8	N104 M109 S110	N104-I106 VanDerWaalsContact C-N 3.25Å; N104-I106 PolarHBondContact O-N 2.91Å; N104-I106 VanDerWaalsContact O-N 3.17Å; I106-M109 PolarHBondContact O-N 2.98Å; I106-S110 PolarHBondContact O-N 3.24Å; I106-S110 PolarHBondContact O-OG 3.47Å
107	E	92.5	Very high	91.3	Very high	70 Å²	70	58.6 Å²	58.6	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-42.4	177.8	-62.5	-179	-164.2	0	0	112.1	T82 T84 N104 M109 S110 A111	T82-E107 PolarHBondContact OG1-OE2 3.48Å; T84-E107 VanDerWaalsContact CB-OE2 3.22Å; T84-E107 WeakPolarHBondContact CB-OE2 3.33Å; T84-E107 PolarHBondContact OG1-OE2 3.24Å; N104-E107 PolarHBondContact O-N 3.15Å; E107-M109 VanDerWaalsContact C-N 3.32Å; E107-M109 PolarHBondContact O-N 3.28Å; E107-S110 PolarHBondContact O-OG 3.49Å; E107-S110 VanDerWaalsContact O-OG 3.04Å; E107-A111 WeakPolarHBondContact O-CB 3.23Å; E107-A111 PolarHBondContact O-N 3.14Å
108	V	92.9	Very high	91.7	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-37.9	175.7	174.8	0	0	0	0	110.6	A88 L98 L100 N104 A112 I120	A88-V108 HydrophobicContact CB-CG2 3.86Å; L98-V108 HydrophobicContact CD1-CG1 4.07Å; L98-V108 HydrophobicContact CD2-CG1 4.04Å; L100-V108 HydrophobicContact CD2-CB 4.23Å; L100-V108 HydrophobicContact CD2-CG1 3.9Å; N104-V108 HydrophobicContact CB-CG2 4.39Å; N104-V108 WeakPolarHBondContact O-CG2 3.26Å; N104-V108 PolarHBondContact O-N 3.05Å; V108-A112 WeakPolarHBondContact O-CB 3.34Å; V108-A112 PolarHBondContact O-N 2.9Å; V108-I120 HydrophobicContact CG1-CG2 4.03Å
109	M	93.4	Very high	91.8	Very high	38 Å²	38	59 Å²	59	19%	0.187	33%	0.329	C	S	.	.	H	α-helix	trans	-70.3	-41.5	178.1	-172.8	170.9	62.4	0	0	112.8	V105 I106 E107 S113 V121 C124 I128	V105-M109 WeakPolarHBondContact O-CB 3.47Å; V105-M109 PolarHBondContact O-N 2.93Å; I106-M109 PolarHBondContact O-N 2.98Å; E107-M109 VanDerWaalsContact C-N 3.32Å; E107-M109 PolarHBondContact O-N 3.28Å; M109-S113 VanDerWaalsContact O-CB 3.24Å; M109-S113 WeakPolarHBondContact O-CB 3.3Å; M109-S113 PolarHBondContact O-N 2.91Å; M109-V121 HydrophobicContact CG-CG1 4.45Å; M109-C124 HydrophobicContact CB-CB 3.74Å; M109-C124 HydrophobicContact CG-CB 3.87Å; M109-C124 HydrophobicContact SD-CB 3.89Å; M109-I128 HydrophobicContact CE-CD1 3.6Å; M109-I128 HydrophobicContact SD-CD1 3.82Å
110	S	94.3	Very high	92	Very high	62 Å²	62	55.7 Å²	55.7	43%	0.434	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-45.5	176.2	62.9	0	0	0	0	111.1	I106 E107 A112 S113 Y114	I106-S110 PolarHBondContact O-N 3.24Å; I106-S110 PolarHBondContact O-OG 3.47Å; E107-S110 PolarHBondContact O-OG 3.49Å; E107-S110 VanDerWaalsContact O-OG 3.04Å; S110-A112 PolarHBondContact O-N 3.06Å; S110-S113 WeakPolarHBondContact O-CB 3.27Å; S110-S113 PolarHBondContact O-N 2.92Å; S110-Y114 PolarHBondContact O-N 3.2Å
111	A	94.3	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-43.8	175.7	0	0	0	0	0	112.4	V81 I89 E107 Y114 L115	V81-A111 HydrophobicContact CG1-CB 3.43Å; V81-A111 VanDerWaalsContact CG1-CB 3.43Å; I89-A111 VanDerWaalsContact CD1-C 3.46Å; I89-A111 HydrophobicContact CD1-CB 3.39Å; E107-A111 WeakPolarHBondContact O-CB 3.23Å; E107-A111 PolarHBondContact O-N 3.14Å; A111-Y114 PolarHBondContact O-N 2.73Å; A111-L115 WeakPolarHBondContact O-CB 3.48Å; A111-L115 WeakPolarHBondContact O-CG 3.31Å; A111-L115 PolarHBondContact O-N 2.93Å
112	A	94	Very high	92.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.2	-31.5	179	0	0	0	0	0	112.7	I89 V108 S110 L115 Q116 M117 I120 V121	I89-A112 HydrophobicContact CD1-CB 3.87Å; I89-A112 VanDerWaalsContact CD1-N 3.27Å; V108-A112 WeakPolarHBondContact O-CB 3.34Å; V108-A112 PolarHBondContact O-N 2.9Å; S110-A112 PolarHBondContact O-N 3.06Å; A112-L115 CarbonylContact O-C 3.55Å; A112-Q116 PolarHBondContact O-N 3.46Å; A112-Q116 VanDerWaalsContact O-N 3.08Å; A112-M117 HydrophobicContact CB-CB 4.47Å; A112-M117 HydrophobicContact CB-CE 4.27Å; A112-M117 PolarHBondContact O-N 3.27Å; A112-I120 HydrophobicContact CB-CB 3.87Å; A112-I120 HydrophobicContact CB-CG2 3.61Å; A112-V121 HydrophobicContact CB-CG2 3.76Å
113	S	94.8	Very high	92.6	Very high	76 Å²	76	56 Å²	56	53%	0.531	30%	0.295	S	S	.	.	H	α-helix	trans	-65	-48.1	172.5	-173	0	0	0	0	111	M109 S110 L115 Q116	M109-S113 VanDerWaalsContact O-CB 3.24Å; M109-S113 WeakPolarHBondContact O-CB 3.3Å; M109-S113 PolarHBondContact O-N 2.91Å; S110-S113 WeakPolarHBondContact O-CB 3.27Å; S110-S113 PolarHBondContact O-N 2.92Å; S113-L115 PolarHBondContact O-N 3.17Å; S113-Q116 PolarHBondContact O-N 3.06Å; S113-Q116 VanDerWaalsContact O-N 3.12Å
114	Y	93.9	Very high	92.9	Very high	66 Å²	66	47 Å²	47	26%	0.259	26%	0.256	S	S	.	.	H	α-helix	trans	-59.5	-45.8	175.4	-174.3	-91.1	0	0	0	112.1	Y55 L78 I80 V81 S110 A111 Q116	Y55-Y114 HydrophobicContact CD2-CD1 4.43Å; Y55-Y114 HydrophobicContact CD2-CE1 4.03Å; Y55-Y114 HydrophobicContact CE1-CE1 4.13Å; Y55-Y114 HydrophobicContact CE2-CD1 4.2Å; Y55-Y114 AromaticContact CE2-CE1 3.38Å; Y55-Y114 HydrophobicContact CE2-CE1 3.38Å; Y55-Y114 AromaticContact CE2-CZ 3.6Å; Y55-Y114 AromaticContact CZ-CE1 3.43Å; Y55-Y114 VanDerWaalsContact CZ-CE1 3.43Å; Y55-Y114 AromaticContact CZ-CZ 3.86Å; Y55-Y114 PolarHBondContact OH-OH 3.01Å; L78-Y114 HydrophobicContact CD2-CD1 4.45Å; L78-Y114 HydrophobicContact CD2-CE1 4.25Å; L78-Y114 HydrophobicContact CG-CE1 4.01Å; I80-Y114 HydrophobicContact CB-CD2 4.22Å; I80-Y114 HydrophobicContact CB-CE2 4.04Å; I80-Y114 HydrophobicContact CD1-CE2 3.89Å; I80-Y114 HydrophobicContact CG2-CD2 3.86Å; I80-Y114 HydrophobicContact CG2-CE2 4.12Å; V81-Y114 HydrophobicContact CG2-CD1 3.58Å; V81-Y114 HydrophobicContact CG2-CD2 4.5Å; V81-Y114 HydrophobicContact CG2-CE1 4.29Å; V81-Y114 HydrophobicContact CG2-CG 3.71Å; S110-Y114 PolarHBondContact O-N 3.2Å; A111-Y114 PolarHBondContact O-N 2.73Å; Y114-Q116 PolarHBondContact O-N 2.64Å
115	L	93.4	Very high	92.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	4.6	177.8	-69.6	172.5	0	0	0	114.6	S53 Y55 F56 L78 F86 I89 A111 A112 S113 M117	S53-L115 PolarHBondContact OG-O 3.46Å; Y55-L115 HydrophobicContact CD1-CD2 3.66Å; Y55-L115 HydrophobicContact CE1-CD2 4.29Å; Y55-L115 HydrophobicContact CG-CD2 4.08Å; F56-L115 HydrophobicContact CD2-CD2 4.06Å; F56-L115 HydrophobicContact CE2-CD1 4.5Å; F56-L115 HydrophobicContact CE2-CD2 3.51Å; F56-L115 HydrophobicContact CZ-CD2 3.86Å; L78-L115 HydrophobicContact CD2-CD2 4.05Å; F86-L115 HydrophobicContact CD2-CD1 3.95Å; F86-L115 HydrophobicContact CE2-CD1 3.95Å; I89-L115 HydrophobicContact CD1-CD1 4.15Å; I89-L115 HydrophobicContact CG2-CD1 3.72Å; A111-L115 WeakPolarHBondContact O-CB 3.48Å; A111-L115 WeakPolarHBondContact O-CG 3.31Å; A111-L115 PolarHBondContact O-N 2.93Å; A112-L115 CarbonylContact O-C 3.55Å; S113-L115 PolarHBondContact O-N 3.17Å; L115-M117 VanDerWaalsContact C-N 3.29Å; L115-M117 HydrophobicContact CB-CE 3.9Å; L115-M117 HydrophobicContact CB-CG 4.44Å; L115-M117 HydrophobicContact CD1-CE 4.08Å; L115-M117 PolarHBondContact O-N 2.79Å
116	Q	94	Very high	92.9	Very high	91 Å²	91	53.5 Å²	53.5	43%	0.425	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	31.6	175.1	-54.8	179.7	14.8	0	0	114.9	R54 A112 S113 Y114 T118	R54-Q116 HydrophobicContact CB-CB 4.02Å; A112-Q116 PolarHBondContact O-N 3.46Å; A112-Q116 VanDerWaalsContact O-N 3.08Å; S113-Q116 PolarHBondContact O-N 3.06Å; S113-Q116 VanDerWaalsContact O-N 3.12Å; Y114-Q116 PolarHBondContact O-N 2.64Å; Q116-T118 PolarHBondContact O-N 2.93Å
117	M	92.8	Very high	92.9	Very high	14 Å²	14	51.4 Å²	51.4	7%	0.069	28%	0.279	C	S	.	.			trans	-93.2	84.2	178.2	-63.2	-173.1	-69.7	0	0	110.3	I89 M93 A112 L115 D119 I120 V121	I89-M117 HydrophobicContact CB-CE 4.17Å; I89-M117 HydrophobicContact CD1-CE 3.67Å; I89-M117 HydrophobicContact CG1-CE 3.82Å; I89-M117 HydrophobicContact CG2-CE 3.33Å; I89-M117 HydrophobicContact CG2-SD 4.48Å; M93-M117 HydrophobicContact SD-SD 4.49Å; A112-M117 HydrophobicContact CB-CB 4.47Å; A112-M117 HydrophobicContact CB-CE 4.27Å; A112-M117 PolarHBondContact O-N 3.27Å; L115-M117 VanDerWaalsContact C-N 3.29Å; L115-M117 HydrophobicContact CB-CE 3.9Å; L115-M117 HydrophobicContact CB-CG 4.44Å; L115-M117 HydrophobicContact CD1-CE 4.08Å; L115-M117 PolarHBondContact O-N 2.79Å; M117-D119 PolarHBondContact O-N 3.12Å; M117-D119 VanDerWaalsContact O-N 3.11Å; M117-I120 HydrophobicContact CB-CB 4.46Å; M117-I120 HydrophobicContact CB-CD1 4.01Å; M117-I120 HydrophobicContact CB-CG1 4.31Å; M117-I120 HydrophobicContact CE-CD1 3.56Å; M117-I120 PolarHBondContact O-N 2.99Å; M117-I120 HydrophobicContact SD-CD1 3.69Å; M117-V121 PolarHBondContact O-N 3.21Å
118	T	92.9	Very high	92.9	Very high	69 Å²	69	50.3 Å²	50.3	42%	0.423	28%	0.275	S	S	.	.	H	α-helix	trans	-51.4	-36.9	-175.5	41.2	0	0	0	0	113.9	Q116 V121 Q122	Q116-T118 PolarHBondContact O-N 2.93Å; T118-V121 PolarHBondContact O-N 3.09Å; T118-Q122 WeakPolarHBondContact O-CB 3.45Å; T118-Q122 PolarHBondContact O-N 3.06Å
119	D	90.8	Very high	92.6	Very high	125 Å²	125	56.2 Å²	56.2	67%	0.668	30%	0.3	S	S	*	.	H	α-helix	trans	-79.5	-34.8	-165.8	-49.5	-2.4	0	0	0	110.2	M117 A123	M117-D119 PolarHBondContact O-N 3.12Å; M117-D119 VanDerWaalsContact O-N 3.11Å; D119-A123 PolarHBondContact O-N 2.95Å
120	I	92.1	Very high	92.3	Very high	9 Å²	9	56.7 Å²	56.7	5%	0.046	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-45.5	169.2	-58.7	176.2	0	0	0	110.4	F92 L98 V108 A112 M117 Q122 A123 C124	F92-I120 HydrophobicContact CD1-CD1 3.5Å; F92-I120 HydrophobicContact CD1-CG1 4.28Å; F92-I120 HydrophobicContact CE1-CD1 3.5Å; F92-I120 HydrophobicContact CE1-CG1 3.9Å; F92-I120 HydrophobicContact CG-CD1 4.4Å; F92-I120 HydrophobicContact CZ-CD1 4.38Å; F92-I120 HydrophobicContact CZ-CG1 4.33Å; L98-I120 HydrophobicContact CD2-CG2 3.64Å; V108-I120 HydrophobicContact CG1-CG2 4.03Å; A112-I120 HydrophobicContact CB-CB 3.87Å; A112-I120 HydrophobicContact CB-CG2 3.61Å; M117-I120 HydrophobicContact CB-CB 4.46Å; M117-I120 HydrophobicContact CB-CD1 4.01Å; M117-I120 HydrophobicContact CB-CG1 4.31Å; M117-I120 HydrophobicContact CE-CD1 3.56Å; M117-I120 PolarHBondContact O-N 2.99Å; M117-I120 HydrophobicContact SD-CD1 3.69Å; I120-Q122 VanDerWaalsContact C-N 3.26Å; I120-Q122 PolarHBondContact O-N 3.32Å; I120-A123 WeakPolarHBondContact O-CA 3.29Å; I120-A123 WeakPolarHBondContact O-CB 3.49Å; I120-A123 PolarHBondContact O-N 3.46Å; I120-C124 PolarHBondContact O-N 3.2Å; I120-C124 PolarHBondContact O-SG 3.43Å; I120-C124 VanDerWaalsContact O-SG 3.39Å
121	V	94	Very high	91.8	Very high	27 Å²	27	56 Å²	56	16%	0.164	31%	0.309	C	S	.	.	H	α-helix	trans	-59.6	-39.5	177.8	173.5	0	0	0	0	110.9	M109 A112 M117 T118 C124 H125	M109-V121 HydrophobicContact CG-CG1 4.45Å; A112-V121 HydrophobicContact CB-CG2 3.76Å; M117-V121 PolarHBondContact O-N 3.21Å; T118-V121 PolarHBondContact O-N 3.09Å; V121-C124 PolarHBondContact O-N 3.36Å; V121-H125 PolarHBondContact O-CD2 2.78Å; V121-H125 VanDerWaalsContact O-CD2 3.26Å; V121-H125 PolarHBondContact O-N 3.19Å
122	Q	92.8	Very high	91.2	Very high	134 Å²	134	60.9 Å²	60.9	63%	0.626	33%	0.334	S	S	*	.	H	α-helix	trans	-68.3	-36.2	174.8	-174.7	170.9	-16.6	0	0	112.4	T118 I120 S126	T118-Q122 WeakPolarHBondContact O-CB 3.45Å; T118-Q122 PolarHBondContact O-N 3.06Å; I120-Q122 VanDerWaalsContact C-N 3.26Å; I120-Q122 PolarHBondContact O-N 3.32Å; Q122-S126 WeakPolarHBondContact O-CB 3.18Å; Q122-S126 PolarHBondContact O-N 3Å; Q122-S126 PolarHBondContact O-OG 3.22Å
123	A	90.8	Very high	90.4	Very high	45 Å²	45	64.2 Å²	64.2	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-64.1	-45.5	173.1	0	0	0	0	0	111.5	L100 D119 I120 S126 F127	L100-A123 HydrophobicContact CD1-CB 4.47Å; D119-A123 PolarHBondContact O-N 2.95Å; I120-A123 WeakPolarHBondContact O-CA 3.29Å; I120-A123 WeakPolarHBondContact O-CB 3.49Å; I120-A123 PolarHBondContact O-N 3.46Å; A123-S126 WeakPolarHBondContact O-CB 3.48Å; A123-S126 PolarHBondContact O-N 3.2Å; A123-F127 WeakPolarHBondContact O-CB 3.43Å; A123-F127 PolarHBondContact O-N 3.45Å
124	C	93.6	Very high	89.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-46.1	175.3	-66.9	0	0	0	0	112.5	V105 M109 I120 V121 S126 F127 I128	V105-C124 HydrophobicContact CG2-CB 3.74Å; M109-C124 HydrophobicContact CB-CB 3.74Å; M109-C124 HydrophobicContact CG-CB 3.87Å; M109-C124 HydrophobicContact SD-CB 3.89Å; I120-C124 PolarHBondContact O-N 3.2Å; I120-C124 PolarHBondContact O-SG 3.43Å; I120-C124 VanDerWaalsContact O-SG 3.39Å; V121-C124 PolarHBondContact O-N 3.36Å; C124-S126 VanDerWaalsContact C-N 3.29Å; C124-S126 PolarHBondContact O-N 3.28Å; C124-F127 PolarHBondContact O-N 3.22Å; C124-I128 VanDerWaalsContact O-CG1 3.29Å; C124-I128 WeakPolarHBondContact O-CG1 3.46Å; C124-I128 PolarHBondContact O-N 3.32Å
125	H	92.1	Very high	88.4	Confident	111 Å²	111	65.1 Å²	65.1	51%	0.514	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-38	174	-82.7	-59.2	0	0	0	112.5	V121 K129	V121-H125 PolarHBondContact O-CD2 2.78Å; V121-H125 VanDerWaalsContact O-CD2 3.26Å; V121-H125 PolarHBondContact O-N 3.19Å; H125-K129 WeakPolarHBondContact O-CB 3.45Å; H125-K129 PolarHBondContact O-N 3.19Å
126	S	90.8	Very high	87.1	Confident	70 Å²	70	69.7 Å²	69.7	49%	0.49	38%	0.381	S	S	.	.	H	α-helix	trans	-68.4	-39.5	177.9	-57.7	0	0	0	0	111.7	Q122 A123 C124 A130	Q122-S126 WeakPolarHBondContact O-CB 3.18Å; Q122-S126 PolarHBondContact O-N 3Å; Q122-S126 PolarHBondContact O-OG 3.22Å; A123-S126 WeakPolarHBondContact O-CB 3.48Å; A123-S126 PolarHBondContact O-N 3.2Å; C124-S126 VanDerWaalsContact C-N 3.29Å; C124-S126 PolarHBondContact O-N 3.28Å; S126-A130 WeakPolarHBondContact O-CB 3.44Å; S126-A130 PolarHBondContact O-N 3Å
127	F	91.8	Very high	85.7	Confident	71 Å²	71	74 Å²	74	31%	0.311	39%	0.394	S	S	.	.	H	α-helix	trans	-64.2	-48.8	174.2	-179.6	-85.8	0	0	0	111.7	L100 V105 A123 C124 K129 A130 A131	L100-F127 HydrophobicContact CB-CD2 3.93Å; L100-F127 HydrophobicContact CB-CE2 4.12Å; L100-F127 HydrophobicContact CB-CG 4.2Å; L100-F127 HydrophobicContact CD1-CB 4.09Å; L100-F127 HydrophobicContact CD1-CG 4.39Å; V105-F127 HydrophobicContact CB-CD1 4.09Å; V105-F127 HydrophobicContact CB-CE1 4.29Å; V105-F127 HydrophobicContact CG1-CD1 4.19Å; V105-F127 HydrophobicContact CG1-CE1 4.22Å; V105-F127 HydrophobicContact CG2-CD1 3.88Å; A123-F127 WeakPolarHBondContact O-CB 3.43Å; A123-F127 PolarHBondContact O-N 3.45Å; C124-F127 PolarHBondContact O-N 3.22Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 3.31Å; F127-A130 PolarHBondContact O-N 3.2Å; F127-A131 PolarHBondContact O-N 3.38Å
128	I	90.8	Very high	84.3	Confident	47 Å²	47	76 Å²	76	24%	0.241	41%	0.409	C	S	.	.	H	α-helix	trans	-59.5	-44.7	177.3	-68.2	163.7	0	0	0	110.1	V105 M109 C124 A131 L132	V105-I128 HydrophobicContact CG1-CD1 4.4Å; V105-I128 HydrophobicContact CG1-CG1 4.02Å; V105-I128 HydrophobicContact CG2-CD1 4.07Å; V105-I128 HydrophobicContact CG2-CG1 3.93Å; M109-I128 HydrophobicContact CE-CD1 3.6Å; M109-I128 HydrophobicContact SD-CD1 3.82Å; C124-I128 VanDerWaalsContact O-CG1 3.29Å; C124-I128 WeakPolarHBondContact O-CG1 3.46Å; C124-I128 PolarHBondContact O-N 3.32Å; I128-A131 PolarHBondContact O-N 3.32Å; I128-L132 HydrophobicContact CG2-CD1 4.06Å; I128-L132 WeakPolarHBondContact O-CG 3.44Å; I128-L132 PolarHBondContact O-N 3.47Å
129	K	88.3	Confident	82.8	Confident	126 Å²	126	78 Å²	78	55%	0.548	41%	0.414	S	S	.	.	H	α-helix	trans	-61.7	-46.6	176	-166	-169.5	178.3	-119.3	0	111.6	H125 F127 A131 L132 D133	H125-K129 WeakPolarHBondContact O-CB 3.45Å; H125-K129 PolarHBondContact O-N 3.19Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 3.31Å; K129-A131 VanDerWaalsContact C-N 3.29Å; K129-A131 PolarHBondContact O-N 2.89Å; K129-L132 PolarHBondContact O-N 2.94Å; K129-D133 WeakPolarHBondContact CE-OD1 3.5Å; K129-D133 VanDerWaalsContact CE-OD2 3.26Å; K129-D133 WeakPolarHBondContact CE-OD2 3.47Å; K129-D133 IonicContact NZ-OD1 2.92Å; K129-D133 IonicContact NZ-OD2 3.47Å; K129-D133 PolarHBondContact NZ-OD2 3.25Å; K129-D133 WeakPolarHBondContact O-CB 3.45Å; K129-D133 PolarHBondContact O-N 3.37Å
130	A	87.1	Confident	81.3	Confident	47 Å²	47	77.5 Å²	77.5	39%	0.388	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-38.1	178.9	0	0	0	0	0	112.4	S126 F127 I134	S126-A130 WeakPolarHBondContact O-CB 3.44Å; S126-A130 PolarHBondContact O-N 3Å; F127-A130 PolarHBondContact O-N 3.2Å; A130-I134 WeakPolarHBondContact O-CB 3.46Å; A130-I134 WeakPolarHBondContact O-CD1 3.42Å; A130-I134 WeakPolarHBondContact O-CG1 3.35Å; A130-I134 PolarHBondContact O-N 3.16Å
131	A	82.4	Confident	80	Confident	49 Å²	49	79.5 Å²	79.5	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-65.3	-41.8	175.2	0	0	0	0	0	112.6	F127 I128 K129 I134 S135	F127-A131 PolarHBondContact O-N 3.38Å; I128-A131 PolarHBondContact O-N 3.32Å; K129-A131 VanDerWaalsContact C-N 3.29Å; K129-A131 PolarHBondContact O-N 2.89Å; A131-I134 PolarHBondContact O-N 2.87Å; A131-S135 PolarHBondContact O-N 3.45Å
132	L	81.3	Confident	78.5	Confident	102 Å²	102	83.8 Å²	83.8	53%	0.534	45%	0.449	S	S	.	.	H	α-helix	trans	-70	-43.2	175.7	-66.6	171.1	0	0	0	112.3	I128 K129 I134 S135 I136	I128-L132 HydrophobicContact CG2-CD1 4.06Å; I128-L132 WeakPolarHBondContact O-CG 3.44Å; I128-L132 PolarHBondContact O-N 3.47Å; K129-L132 PolarHBondContact O-N 2.94Å; L132-I134 PolarHBondContact O-N 3.06Å; L132-S135 PolarHBondContact O-N 3.04Å; L132-S135 VanDerWaalsContact O-N 3.13Å; L132-I136 WeakPolarHBondContact O-CG1 3.4Å; L132-I136 PolarHBondContact O-N 3.14Å
133	D	78.9	Confident	77.1	Confident	69 Å²	69	84.2 Å²	84.2	37%	0.369	45%	0.451	S	S	.	.	H	α-helix	trans	-60.7	-25.4	173.1	-74.5	-12.1	0	0	0	111	K129 R137	K129-D133 WeakPolarHBondContact CE-OD1 3.5Å; K129-D133 VanDerWaalsContact CE-OD2 3.26Å; K129-D133 WeakPolarHBondContact CE-OD2 3.47Å; K129-D133 IonicContact NZ-OD1 2.92Å; K129-D133 IonicContact NZ-OD2 3.47Å; K129-D133 PolarHBondContact NZ-OD2 3.25Å; K129-D133 WeakPolarHBondContact O-CB 3.45Å; K129-D133 PolarHBondContact O-N 3.37Å; D133-R137 WeakPolarHBondContact O-CB 3.33Å; D133-R137 WeakPolarHBondContact O-CD 3.5Å; D133-R137 WeakPolarHBondContact O-CG 3.33Å
134	I	74.4	Confident	75.7	Confident	112 Å²	112	88 Å²	88	57%	0.574	46%	0.464	S	S	*	.	H	α-helix	trans	-79	-46.9	170.2	-71.7	163.5	0	0	0	111.4	A130 A131 L132 I136 R137 S138	A130-I134 WeakPolarHBondContact O-CB 3.46Å; A130-I134 WeakPolarHBondContact O-CD1 3.42Å; A130-I134 WeakPolarHBondContact O-CG1 3.35Å; A130-I134 PolarHBondContact O-N 3.16Å; A131-I134 PolarHBondContact O-N 2.87Å; L132-I134 PolarHBondContact O-N 3.06Å; I134-I136 PolarHBondContact O-N 3.23Å; I134-R137 CarbonylContact O-C 3.48Å; I134-R137 WeakPolarHBondContact O-CA 3.49Å; I134-R137 WeakPolarHBondContact O-CB 3.4Å; I134-R137 PolarHBondContact O-N 3.03Å; I134-S138 PolarHBondContact O-N 2.89Å; I134-S138 PolarHBondContact O-OG 3.05Å
135	S	71.1	Confident	74.1	Confident	50 Å²	50	90.3 Å²	90.3	35%	0.35	48%	0.483	S	S	.	.	H	α-helix	trans	-55.7	-48.6	-179.4	-158.4	0	0	0	0	112	A131 L132 R137 S138 E139	A131-S135 PolarHBondContact O-N 3.45Å; L132-S135 PolarHBondContact O-N 3.04Å; L132-S135 VanDerWaalsContact O-N 3.13Å; S135-R137 PolarHBondContact O-N 3.33Å; S135-S138 WeakPolarHBondContact CA-OG 3.28Å; S135-S138 PolarHBondContact O-N 2.88Å; S135-S138 VanDerWaalsContact O-N 3.13Å; S135-S138 PolarHBondContact O-OG 3.21Å; S135-E139 WeakPolarHBondContact O-CG 3.37Å; S135-E139 PolarHBondContact O-N 2.97Å; S135-E139 PolarHBondContact OG-OE1 3.22Å
136	I	66.1	Low	72.3	Confident	96 Å²	96	91 Å²	91	49%	0.492	49%	0.491	S	S	.	.	H	α-helix	trans	-62	-33.2	176.9	-63.5	164	0	0	0	110.8	L132 I134 M140	L132-I136 WeakPolarHBondContact O-CG1 3.4Å; L132-I136 PolarHBondContact O-N 3.14Å; I134-I136 PolarHBondContact O-N 3.23Å; I136-M140 WeakPolarHBondContact O-CG 3.47Å; I136-M140 PolarHBondContact O-N 2.98Å
137	R	65.4	Low	70.5	Confident	180 Å²	180	96 Å²	96	68%	0.679	50%	0.504	S	S	*	.	H	α-helix	trans	-77.6	-24.8	177.2	-77.5	-175.8	70.9	-169.1	-1.5	114.1	D133 I134 S135 M140 A141	D133-R137 WeakPolarHBondContact O-CB 3.33Å; D133-R137 WeakPolarHBondContact O-CD 3.5Å; D133-R137 WeakPolarHBondContact O-CG 3.33Å; I134-R137 CarbonylContact O-C 3.48Å; I134-R137 WeakPolarHBondContact O-CA 3.49Å; I134-R137 WeakPolarHBondContact O-CB 3.4Å; I134-R137 PolarHBondContact O-N 3.03Å; S135-R137 PolarHBondContact O-N 3.33Å; R137-M140 HydrophobicContact CB-CE 4.26Å; R137-M140 HydrophobicContact CG-CE 3.6Å; R137-A141 VanDerWaalsContact O-CB 3.31Å; R137-A141 WeakPolarHBondContact O-CB 3.46Å
138	S	63.9	Low	68.6	Low	56 Å²	56	99.8 Å²	99.8	39%	0.392	52%	0.523	S	S	.	.	H	α-helix	trans	-77.4	-43	169.1	35.4	0	0	0	0	111.5	I134 S135 M140 A141 D142	I134-S138 PolarHBondContact O-N 2.89Å; I134-S138 PolarHBondContact O-OG 3.05Å; S135-S138 WeakPolarHBondContact CA-OG 3.28Å; S135-S138 PolarHBondContact O-N 2.88Å; S135-S138 VanDerWaalsContact O-N 3.13Å; S135-S138 PolarHBondContact O-OG 3.21Å; S138-M140 PolarHBondContact O-N 2.87Å; S138-A141 WeakPolarHBondContact O-CA 3.31Å; S138-A141 WeakPolarHBondContact O-CB 3.37Å; S138-A141 PolarHBondContact O-N 3.1Å; S138-D142 PolarHBondContact O-N 3.48Å
139	E	60.9	Low	66.8	Low	113 Å²	113	104.3 Å²	104.3	53%	0.528	54%	0.544	S	S	.	.	H	α-helix	trans	-57.5	-51.1	178.7	-73	158.5	-163.2	0	0	111.4	S135 A141 D142 E143	S135-E139 WeakPolarHBondContact O-CG 3.37Å; S135-E139 PolarHBondContact O-N 2.97Å; S135-E139 PolarHBondContact OG-OE1 3.22Å; E139-A141 PolarHBondContact O-N 3.2Å; E139-A141 VanDerWaalsContact O-N 3.16Å; E139-D142 PolarHBondContact O-N 3.39Å; E139-E143 PolarHBondContact O-N 3Å
140	M	59.5	Low	64.8	Low	113 Å²	113	100.8 Å²	100.8	56%	0.557	54%	0.544	S	S	*	.	H	α-helix	trans	-75	2.1	175.7	76	176.5	161.3	0	0	115	I136 R137 S138	I136-M140 WeakPolarHBondContact O-CG 3.47Å; I136-M140 PolarHBondContact O-N 2.98Å; R137-M140 HydrophobicContact CB-CE 4.26Å; R137-M140 HydrophobicContact CG-CE 3.6Å; S138-M140 PolarHBondContact O-N 2.87Å
141	A	63.4	Low	62.7	Low	52 Å²	52	102.4 Å²	102.4	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-99.7	-39.3	171.1	0	0	0	0	0	111.5	R137 S138 E139 L144 A145	R137-A141 VanDerWaalsContact O-CB 3.31Å; R137-A141 WeakPolarHBondContact O-CB 3.46Å; S138-A141 WeakPolarHBondContact O-CA 3.31Å; S138-A141 WeakPolarHBondContact O-CB 3.37Å; S138-A141 PolarHBondContact O-N 3.1Å; E139-A141 PolarHBondContact O-N 3.2Å; E139-A141 VanDerWaalsContact O-N 3.16Å; A141-L144 PolarHBondContact O-N 2.89Å; A141-A145 WeakPolarHBondContact O-CB 3.45Å; A141-A145 PolarHBondContact O-N 3.44Å
142	D	63.1	Low	60.9	Low	116 Å²	116	105.7 Å²	105.7	62%	0.62	57%	0.572	S	S	*	*	H	α-helix	trans	-65.1	-45.8	170.9	-88.1	-6.3	0	0	0	110.9	S138 E139 L144 A145 D146	S138-D142 PolarHBondContact O-N 3.48Å; E139-D142 PolarHBondContact O-N 3.39Å; D142-L144 PolarHBondContact O-N 3.31Å; D142-A145 PolarHBondContact O-N 3.25Å; D142-D146 PolarHBondContact O-N 3.48Å
143	E	64.3	Low	59.1	Low	143 Å²	143	105.2 Å²	105.2	67%	0.668	58%	0.583	S	S	*	*	H	α-helix	trans	-57.4	-35.3	174.3	-74.5	-166.3	154.4	0	0	112	E139 F147	E139-E143 PolarHBondContact O-N 3Å; E143-F147 WeakPolarHBondContact O-CD2 3.41Å; E143-F147 PolarHBondContact O-N 2.91Å
144	L	61.6	Low	57.3	Low	124 Å²	124	106.6 Å²	106.6	65%	0.649	60%	0.604	S	S	*	*	H	α-helix	trans	-73.6	-34.3	177.3	-172.4	62	0	0	0	112.3	A141 D142 E148	A141-L144 PolarHBondContact O-N 2.89Å; D142-L144 PolarHBondContact O-N 3.31Å; L144-E148 PolarHBondContact O-N 3.29Å
145	A	58.4	Low	55.8	Low	49 Å²	49	104.3 Å²	104.3	41%	0.405	61%	0.608	S	S	.	*	H	α-helix	trans	-70	-43.4	177.1	0	0	0	0	0	112.1	A141 D142 F147 E148 M149	A141-A145 WeakPolarHBondContact O-CB 3.45Å; A141-A145 PolarHBondContact O-N 3.44Å; D142-A145 PolarHBondContact O-N 3.25Å; A145-F147 VanDerWaalsContact C-N 3.31Å; A145-F147 PolarHBondContact O-N 2.98Å; A145-E148 PolarHBondContact O-N 2.81Å; A145-E148 VanDerWaalsContact O-N 3.08Å; A145-M149 PolarHBondContact O-N 3.42Å
146	D	54.9	Low	54.2	Low	126 Å²	126	110.9 Å²	110.9	67%	0.674	64%	0.638	S	S	*	*	H	α-helix	trans	-62.8	-37.4	176.1	-88.5	-14.7	0	0	0	111.9	D142 E148 M149 G150	D142-D146 PolarHBondContact O-N 3.48Å; D146-E148 VanDerWaalsContact C-N 3.31Å; D146-E148 PolarHBondContact O-N 3.28Å; D146-M149 PolarHBondContact O-N 3.27Å; D146-G150 PolarHBondContact O-N 3.23Å
147	F	52.3	Low	52.6	Low	175 Å²	175	110.3 Å²	110.3	77%	0.768	66%	0.656	S	S	*	*	H	α-helix	trans	-66	-28.9	173	-98.3	-80.3	0	0	0	113.6	E143 A145	E143-F147 WeakPolarHBondContact O-CD2 3.41Å; E143-F147 PolarHBondContact O-N 2.91Å; A145-F147 VanDerWaalsContact C-N 3.31Å; A145-F147 PolarHBondContact O-N 2.98Å
148	E	52.5	Low	51.1	Low	151 Å²	151	105.9 Å²	105.9	71%	0.706	67%	0.666	S	S	*	*	H	α-helix	trans	-81.1	-36	175.5	-162.5	160.8	-133.4	0	0	111.6	L144 A145 D146 A151	L144-E148 PolarHBondContact O-N 3.29Å; A145-E148 PolarHBondContact O-N 2.81Å; A145-E148 VanDerWaalsContact O-N 3.08Å; D146-E148 VanDerWaalsContact C-N 3.31Å; D146-E148 PolarHBondContact O-N 3.28Å; E148-A151 PolarHBondContact O-N 3.04Å
149	M	52.3	Low	49.7	Very low	141 Å²	141	107.4 Å²	107.4	70%	0.695	69%	0.691	S	S	*	*	H	α-helix	trans	-69.3	-32.9	175.3	-123.2	62.3	-177.9	0	0	113.2	A145 D146 A151 V152	A145-M149 PolarHBondContact O-N 3.42Å; D146-M149 PolarHBondContact O-N 3.27Å; M149-A151 PolarHBondContact O-N 3.45Å; M149-V152 VanDerWaalsContact O-CG2 3.24Å; M149-V152 WeakPolarHBondContact O-CG2 3.5Å
150	G	47.6	Very low	48.3	Very low	53 Å²	53	106.1 Å²	106.1	55%	0.546	71%	0.708	S	S	.	*	G	3₁₀ helix	trans	-63.1	-26.1	174.2	0	0	0	0	0	114.1	D146 V152	D146-G150 PolarHBondContact O-N 3.23Å; G150-V152 PolarHBondContact O-N 3.4Å
151	A	43.3	Very low	47	Very low	81 Å²	81	104.3 Å²	104.3	67%	0.669	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-76	-19.6	-175.1	0	0	0	0	0	114.4	E148 M149	E148-A151 PolarHBondContact O-N 3.04Å; M149-A151 PolarHBondContact O-N 3.45Å
152	V	44.2	Very low	45.5	Very low	118 Å²	118	109 Å²	109	72%	0.715	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-96.2	-8.1	-177.8	-71.4	0	0	0	0	114.3	M149 G150 A154	M149-V152 VanDerWaalsContact O-CG2 3.24Å; M149-V152 WeakPolarHBondContact O-CG2 3.5Å; G150-V152 PolarHBondContact O-N 3.4Å; V152-A154 PolarHBondContact O-N 2.83Å
153	A	42.2	Very low	44.1	Very low	91 Å²	91	109.2 Å²	109.2	75%	0.752	75%	0.752	S	S	*	*	S	Bend	trans	-82.9	-5.3	-175.6	0	0	0	0	0	115.1
154	A	42.8	Very low	42.5	Very low	99 Å²	99	106 Å²	106	82%	0.818	76%	0.758	S	S	*	*	S	Bend	trans	-117.9	50.1	-171.6	0	0	0	0	0	113.4	V152	V152-A154 PolarHBondContact O-N 2.83Å
155	G	42.9	Very low	41	Very low	64 Å²	64	108.2 Å²	108.2	66%	0.66	77%	0.77	S	S	*	*	S	Bend	trans	-150.5	-7.1	-171.8	0	0	0	0	0	119.7
156	L	35.6	Very low	39.7	Very low	187 Å²	187	108.8 Å²	108.8	98%	0.979	78%	0.781	S	S	*	*			trans	-138.3	102.2	-177.4	-72.8	175.9	0	0	0	113.1
157	G	33.3	Very low	38.6	Very low	84 Å²	84	107.1 Å²	107.1	87%	0.866	79%	0.793	S	S	*	*			trans	-150.1	119.5	168.2	0	0	0	0	0	110.4
158	G	34.3	Very low	37.6	Very low	87 Å²	87	102.7 Å²	102.7	90%	0.897	80%	0.797	S	S	*	*			trans	119.7	99.9	-175.6	0	0	0	0	0	112.2
159	G	34.9	Very low	36.5	Very low	88 Å²	88	102 Å²	102	91%	0.907	80%	0.803	S	S	*	*			trans	-98.5	165.7	177.8	0	0	0	0	0	113.3
160	G	31.2	Very low	35.5	Very low	86 Å²	86	100 Å²	100	89%	0.887	80%	0.803	S	S	*	*			trans	158.8	107.8	175	0	0	0	0	0	110.6
161	G	32.3	Very low	34.7	Very low	76 Å²	76	105 Å²	105	78%	0.784	82%	0.816	S	S	*	*			trans	-109.6	136.9	-178.9	0	0	0	0	0	112.5
162	V	31.9	Very low	34.1	Very low	150 Å²	150	106 Å²	106	91%	0.909	83%	0.825	S	S	*	*			trans	-164.8	153.3	146.5	130.2	0	0	0	0	110.5
163	S	32.7	Very low	33.4	Very low	120 Å²	120	104.3 Å²	104.3	84%	0.839	83%	0.831	S	S	*	*			trans	-43.7	142.3	179.2	-168.1	0	0	0	0	116.3
164	G	31.4	Very low	32.9	Very low	77 Å²	77	105.1 Å²	105.1	79%	0.794	84%	0.838	S	S	*	*			trans	-165.9	104.6	174.7	0	0	0	0	0	113.6
165	N	31.2	Very low	32.2	Very low	169 Å²	169	104.6 Å²	104.6	90%	0.904	84%	0.842	S	S	*	*			trans	-81.8	138.2	-174.6	170.4	61.7	0	0	0	114.4
166	G	30.8	Very low	31.5	Very low	62 Å²	62	105.4 Å²	105.4	64%	0.639	85%	0.85	S	S	*	*			trans	107	111.2	138	0	0	0	0	0	120.4
167	G	31.3	Very low	31.4	Very low	90 Å²	90	103.5 Å²	103.5	93%	0.928	85%	0.846	S	S	*	*			trans	68.5	154.7	138.3	0	0	0	0	0	120.8
168	G	30.3	Very low	31.9	Very low	82 Å²	82	105.9 Å²	105.9	85%	0.845	85%	0.846	S	S	*	*			trans	143.1	94.4	160.8	0	0	0	0	0	117.7
169	V	31	Very low	31.7	Very low	136 Å²	136	105.4 Å²	105.4	82%	0.824	84%	0.842	S	S	*	*			trans	-46.5	144.8	168.5	-80.3	0	0	0	0	118.8
170	S	29.6	Very low	31.6	Very low	100 Å²	100	106.4 Å²	106.4	70%	0.699	84%	0.841	S	S	*	*			trans	86.8	129.7	130.5	-73.1	0	0	0	0	125.2
171	L	32	Very low	31.5	Very low	158 Å²	158	108 Å²	108	83%	0.827	84%	0.839	S	S	*	*			trans	71.2	111.6	131.9	-73.5	164.9	0	0	0	123.1
172	A	31.2	Very low	31.5	Very low	103 Å²	103	113.2 Å²	113.2	85%	0.851	85%	0.847	S	S	*	*				68.8	144.8	125.9	0	0	0	0	0	121.8
173	G	28.7	Very low	31.4	Very low	82 Å²	82	110 Å²	110	85%	0.845	85%	0.845	S	S	*	*			trans	163.1	138.2	171	0	0	0	0	0	110.8
174	A	31.3	Very low	31.4	Very low	108 Å²	108	116.6 Å²	116.6	89%	0.893	85%	0.852	S	S	*	*			trans	-137.6	144.2	-171.9	0	0	0	0	0	114.3
175	G	28.4	Very low	31.3	Very low	87 Å²	87	116.8 Å²	116.8	90%	0.897	85%	0.854	S	S	*	*			trans	88.5	155.2	150.1	0	0	0	0	0	118
176	G	29.2	Very low	31.3	Very low	82 Å²	82	112.9 Å²	112.9	85%	0.845	85%	0.854	S	S	*	*			trans	133.9	91	165.4	0	0	0	0	0	116.1
177	V	32.9	Very low	31.2	Very low	146 Å²	146	113.7 Å²	113.7	89%	0.885	86%	0.862	S	S	*	*			trans	-96.5	140.8	151.4	-93.9	0	0	0	0	108.1
178	P	44.1	Very low	31.3	Very low	135 Å²	135	117.5 Å²	117.5	88%	0.877	86%	0.859	S	S	*	*				-140.5	-170.3	88.6	39.9	-23.8	0	0	0	111.4
179	G	29.3	Very low	31.4	Very low	77 Å²	77	120.2 Å²	120.2	79%	0.794	86%	0.859	S	S	*	*			cis	-174.6	172.4	1.4	0	0	0	0	0	109.9
180	A	32.7	Very low	31.4	Very low	108 Å²	108	117.1 Å²	117.1	89%	0.893	85%	0.854	S	S	*	*			trans	-103.8	149.3	-168.3	0	0	0	0	0	115.1
181	S	28.6	Very low	31.5	Very low	120 Å²	120	120.8 Å²	120.8	84%	0.839	87%	0.865	S	S	*	*			trans	-150.1	127.5	161.3	63.2	0	0	0	0	113.9
182	L	32.4	Very low	31.4	Very low	185 Å²	185	117.8 Å²	117.8	97%	0.969	86%	0.862	S	S	*	*			trans	-42.7	149	177.5	-64.1	148.8	0	0	0	117.6
183	G	29.7	Very low	31.6	Very low	84 Å²	84	118.8 Å²	118.8	87%	0.866	86%	0.863	S	S	*	*			trans	-153.1	128.9	157.3	0	0	0	0	0	110.4
184	R	32.8	Very low	31.7	Very low	257 Å²	257	124.4 Å²	124.4	97%	0.97	87%	0.868	S	S	*	*			trans	-130.6	118.3	-170.3	-179.4	-177.2	-179.5	-127.4	4.7	111.7
185	G	30.5	Very low	31.6	Very low	82 Å²	82	123.6 Å²	123.6	85%	0.845	86%	0.861	S	S	*	*			trans	-146.9	134.1	168	0	0	0	0	0	108.7
186	G	30.6	Very low	31.9	Very low	87 Å²	87	128.1 Å²	128.1	90%	0.897	86%	0.863	S	S	*	*			trans	-113.2	143.3	-167.7	0	0	0	0	0	114
187	G	28.9	Very low	32	Very low	79 Å²	79	128.6 Å²	128.6	81%	0.814	86%	0.859	S	S	*	*			trans	-153.1	118.8	168.3	0	0	0	0	0	110
188	I	33.6	Very low	31.9	Very low	169 Å²	169	127.3 Å²	127.3	87%	0.867	86%	0.857	S	S	*	*			trans	-62.5	145.3	165.1	51.3	177.1	0	0	0	108.5
189	V	32.1	Very low	31.6	Very low	140 Å²	140	128.3 Å²	128.3	85%	0.848	85%	0.853	S	S	*	*				-154	153.3	53.5	168.4	0	0	0	0	110.5
190	G	30.4	Very low	31.9	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	86%	0.858	S	S	*	*			trans	127.2	112.8	161.1	0	0	0	0	0	114.4
191	I	33.2	Very low	32	Very low	178 Å²	178	132.3 Å²	132.3	91%	0.913	85%	0.847	S	S	*	*			trans	-115	105.7	-178.2	42.2	160.6	0	0	0	112.3
192	A	29	Very low	32.3	Very low	94 Å²	94	130.5 Å²	130.5	78%	0.777	85%	0.847	S	S	*	*			trans	176.6	115.2	149.5	0	0	0	0	0	111.1
193	S	34.5	Very low	32.2	Very low	125 Å²	125	132 Å²	132	87%	0.874	84%	0.84	S	S	*	*			trans	160.9	88.6	143.7	-76.2	0	0	0	0	112.3
194	E	32	Very low	32.9	Very low	200 Å²	200	134 Å²	134	94%	0.935	84%	0.84	S	S	*	*			trans	-134.7	140.7	157.5	-70.4	-171.1	161.3	0	0	107.2
195	A	29.3	Very low	32.9	Very low	91 Å²	91	127.7 Å²	127.7	75%	0.752	83%	0.831	S	S	*	*			cis	-144.9	151.9	5.9	0	0	0	0	0	112.5
196	L	34.5	Very low	33	Very low	181 Å²	181	129 Å²	129	95%	0.948	83%	0.827	S	S	*	*			trans	-133.3	109.7	161.7	-79.7	176.9	0	0	0	109.4
197	A	30.5	Very low	33.3	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	83%	0.825	S	S	*	*			trans	-161.5	136.6	166.8	0	0	0	0	0	111.3
198	S	30.8	Very low	33.4	Very low	119 Å²	119	138.5 Å²	138.5	83%	0.832	83%	0.829	S	S	*	*			trans	71.2	147.4	-178.1	-39.2	0	0	0	0	114.3
199	I	38.5	Very low	33.5	Very low	156 Å²	156	137.5 Å²	137.5	80%	0.8	82%	0.824	S	S	*	*			cis	-131.1	131.6	14.7	-59.1	164.7	0	0	0	110.6
200	I	35.2	Very low	33.3	Very low	174 Å²	174	135.8 Å²	135.8	89%	0.892	83%	0.825	S	S	*	*			trans	-96.8	114.5	160.1	-63.3	176.1	0	0	0	108.6
201	S	34.3	Very low	33.5	Very low	96 Å²	96	142.4 Å²	142.4	67%	0.671	83%	0.828	S	S	*	*			trans	-157.5	98.2	162	-159.4	0	0	0	0	110.8	R203	S201-R203 PolarHBondContact O-N 3.24Å; S201-R203 VanDerWaalsContact O-N 3.14Å
202	G	34.9	Very low	33.4	Very low	81 Å²	81	145.4 Å²	145.4	84%	0.835	83%	0.828	S	S	*	*			trans	-72.8	102.9	-178.9	0	0	0	0	0	112.5
203	R	31.4	Very low	33.5	Very low	216 Å²	216	146.8 Å²	146.8	82%	0.815	83%	0.827	S	S	*	*			trans	-137.9	122.7	163.5	-57.5	-169.5	80.1	163.6	5.7	109.5	S201 T205	S201-R203 PolarHBondContact O-N 3.24Å; S201-R203 VanDerWaalsContact O-N 3.14Å; R203-T205 PolarHBondContact O-N 3.11Å
204	S	44.1	Very low	33.3	Very low	126 Å²	126	146.5 Å²	146.5	88%	0.881	83%	0.825	S	S	*	*			trans	-74.7	118.3	-176.5	47.3	0	0	0	0	112.3
205	T	32.2	Very low	33.4	Very low	126 Å²	126	143 Å²	143	77%	0.773	82%	0.819	S	S	*	*			trans	-140.3	108.7	169.4	51.3	0	0	0	0	111	R203	R203-T205 PolarHBondContact O-N 3.11Å
206	S	34.1	Very low	33.7	Very low	109 Å²	109	143.2 Å²	143.2	76%	0.762	82%	0.821	S	S	*	*			trans	-65.7	131.1	176.1	-48.8	0	0	0	0	111.5	W208	S206-W208 VanDerWaalsContact C-N 3.35Å; S206-W208 PolarHBondContact O-N 3.35Å
207	P	36.2	Very low	33.4	Very low	132 Å²	132	142 Å²	142	86%	0.857	82%	0.816	S	S	*	*			trans	-73.3	77.2	-179.7	-20.5	34.5	0	0	0	114.3
208	W	31.1	Very low	33.7	Very low	234 Å²	234	143.4 Å²	143.4	89%	0.886	82%	0.82	S	S	*	*			trans	-128.7	143.4	165.5	-85	83.2	0	0	0	111.1	S206	S206-W208 VanDerWaalsContact C-N 3.35Å; S206-W208 PolarHBondContact O-N 3.35Å
209	L	34.3	Very low	33.8	Very low	147 Å²	147	143.1 Å²	143.1	77%	0.77	82%	0.818	S	S	*	*			trans	81.7	73.4	175.7	-56.7	168.3	0	0	0	118.8
210	A	29.3	Very low	33.6	Very low	105 Å²	105	139.3 Å²	139.3	87%	0.868	82%	0.817	S	S	*	*			trans	-140.1	93.3	146.9	0	0	0	0	0	111.5
211	R	34.1	Very low	33.2	Very low	209 Å²	209	138.1 Å²	138.1	79%	0.789	81%	0.813	S	S	*	*			trans	-50.6	148	-176	-73.9	164.9	-88.4	-94.9	-5.4	115.5
212	R	32.3	Very low	33.1	Very low	240 Å²	240	138.7 Å²	138.7	91%	0.906	82%	0.817	S	S	*	*				-144	107.1	109.9	-96.6	178.4	-154.3	-93.5	0.6	112.5
213	T	30.3	Very low	32.9	Very low	123 Å²	123	138.8 Å²	138.8	76%	0.755	81%	0.809	S	S	*	*			trans	34.1	103.9	147.4	53.2	0	0	0	0	120.3
214	S	30.6	Very low	32.8	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.6	140.1	158.4	-37.1	0	0	0	0	111.7
215	P	33.6	Very low	32	Very low	127 Å²	127	134.4 Å²	134.4	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76.1	120.4	159.8	-12.5	29.1	0	0	0	110.1
216	A	35.1	Very low	31.9	Very low	96 Å²	96	133 Å²	133	79%	0.793	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-96	138.5	165	0	0	0	0	0	109.3
217	N	29.7	Very low	31.8	Very low	155 Å²	155	133.8 Å²	133.8	83%	0.829	80%	0.804	S	S	*	*			trans	-137.9	60	176.4	64.2	-19	0	0	0	113
218	S	35.2	Very low	31.5	Very low	121 Å²	121	135 Å²	135	85%	0.846	80%	0.798	S	S	*	*			trans	-110.2	69.9	167.4	65.4	0	0	0	0	111.7
219	S	32.9	Very low	31.7	Very low	114 Å²	114	132 Å²	132	80%	0.797	79%	0.794	S	S	*	*			trans	-152	140	163.1	48.8	0	0	0	0	106
220	G	34.9	Very low	31.3	Very low	76 Å²	76	128.5 Å²	128.5	78%	0.784	79%	0.794	S	S	*	*			cis	115.8	71.4	32.2	0	0	0	0	0	105.7
221	D	27.4	Very low	31.2	Very low	148 Å²	148	127.5 Å²	127.5	79%	0.791	79%	0.793	S	S	*	*			trans	-96.9	118.1	-170.7	-169	0.6	0	0	0	110.3
222	S	32.1	Very low	30.8	Very low	109 Å²	109	123.3 Å²	123.3	76%	0.762	80%	0.796	S	S	*	*			trans	-159.5	65	179	-71.3	0	0	0	0	110.2
223	A	30.8	Very low	30.8	Very low	82 Å²	82	117.1 Å²	117.1	68%	0.678	79%	0.785	S	S	*	*			trans	-113.7	130.8	155.1	0	0	0	0	0	107.2
224	I	28.3	Very low	30.7	Very low	150 Å²	150	122.2 Å²	122.2	77%	0.769	79%	0.792	S	S	*	*			cis	60	63.9	26.2	-34.7	178.3	0	0	0	112
225	A	28.3	Very low	30.6	Very low	100 Å²	100	120.2 Å²	120.2	83%	0.826	79%	0.79	S	S	*	*			trans	-83.6	119.2	146.8	0	0	0	0	0	107.3
226	S	29.6	Very low	30.6	Very low	96 Å²	96	122.1 Å²	122.1	67%	0.671	79%	0.785	S	S	*	*			trans	-105.8	122.6	175.3	-173.9	0	0	0	0	109.3
227	C	32.2	Very low	30.3	Very low	126 Å²	126	126.8 Å²	126.8	85%	0.851	79%	0.791	S	S	*	*			trans	-125.5	90.9	169	-63.9	0	0	0	0	108.6
228	H	30.1	Very low	30.4	Very low	158 Å²	158	124 Å²	124	73%	0.731	78%	0.776	S	S	*	*			trans	-74.8	153.8	150.7	-98.6	-112.8	0	0	0	107.8
229	E	34	Very low	30.1	Very low	171 Å²	171	126.2 Å²	126.2	80%	0.799	77%	0.773	S	S	*	*			cis	-155.1	172.2	1.4	-163.4	161.6	-109.4	0	0	109.4
230	G	26.9	Very low	29.9	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	78%	0.776	S	S	*	*			trans	98	118.9	171.6	0	0	0	0	0	113.6
231	G	26.3	Very low	30.8	Very low	83 Å²	83	131.3 Å²	131.3	86%	0.856	77%	0.773	S	S	*	*			cis	123.4	92.7	-2.5	0	0	0	0	0	112.2
232	S	26	Very low	31.5	Very low	121 Å²	121	129.3 Å²	129.3	85%	0.846	77%	0.769	S	S	*	*			trans	-155.7	165.7	162.6	-163.9	0	0	0	0	109.6
233	T	33.4	Very low	31.3	Very low	110 Å²	110	133.4 Å²	133.4	68%	0.675	77%	0.773	S	S	*	*			trans	-120.3	-178.6	-161.8	48.7	0	0	0	0	113.5
234	Y	27.5	Very low	31.2	Very low	230 Å²	230	135.1 Å²	135.1	90%	0.902	78%	0.78	S	S	*	*			trans	74.3	142.8	179.6	-60.3	-89.3	0	0	0	115.7
235	G	28.7	Very low	31.2	Very low	77 Å²	77	135.3 Å²	135.3	79%	0.794	78%	0.777	S	S	*	*			cis	-152.5	169	-0.3	0	0	0	0	0	112.4
236	K	33.6	Very low	31.2	Very low	168 Å²	168	138.1 Å²	138.1	73%	0.73	77%	0.773	S	S	*	*			trans	-128.8	128.6	177.9	-171.6	-171	-179.1	-71.5	0	107.6	D238	K236-D238 IonicContact NZ-OD2 2.89Å; K236-D238 PolarHBondContact NZ-OD2 2.91Å
237	E	28.5	Very low	31.2	Very low	193 Å²	193	138 Å²	138	90%	0.902	77%	0.772	S	S	*	*			trans	178.1	165.4	164.2	-103.2	149.7	-163.5	0	0	109.1
238	D	31.7	Very low	30.9	Very low	97 Å²	97	139.1 Å²	139.1	52%	0.519	77%	0.765	S	S	.	*				-158.5	146.7	-83.6	-122.4	-80.6	0	0	0	109.1	K236	K236-D238 IonicContact NZ-OD2 2.89Å; K236-D238 PolarHBondContact NZ-OD2 2.91Å
239	Q	29.7	Very low	30.9	Very low	168 Å²	168	139 Å²	139	79%	0.785	76%	0.764	S	S	*	*			trans	65.1	-177.8	162.2	-75.7	152.8	72.5	0	0	121
240	E	29	Very low	30.7	Very low	183 Å²	183	139.4 Å²	139.4	86%	0.855	77%	0.767	S	S	*	*			trans	-118.2	-153.5	-135.9	-32.3	177.7	74.7	0	0	116.4
241	P	53.1	Low	30.8	Very low	113 Å²	113	140.3 Å²	140.3	73%	0.734	77%	0.766	S	S	*	*			trans	-107.2	-169.6	-152.2	49.4	-38.9	0	0	0	113.9
242	P	42.1	Very low	30.8	Very low	107 Å²	107	141.9 Å²	141.9	70%	0.695	76%	0.763	S	S	*	*				-160.5	162.1	78.3	42.1	-20.4	0	0	0	120.2
243	K	27.6	Very low	30.9	Very low	195 Å²	195	144.8 Å²	144.8	85%	0.848	76%	0.763	S	S	*	*			trans	56.6	157.1	139.5	-71.2	179.7	177.2	-178.1	0	125
244	S	29.5	Very low	30.5	Very low	118 Å²	118	146.5 Å²	146.5	83%	0.825	77%	0.768	S	S	*	*			trans	71.8	148.8	157.7	46	0	0	0	0	120.1
245	H	28.2	Very low	30.6	Very low	154 Å²	154	140.9 Å²	140.9	71%	0.713	76%	0.762	S	S	*	*			cis	-171.3	159.6	-19.5	-173.8	-121.5	0	0	0	109.4
246	E	27.3	Very low	30.5	Very low	159 Å²	159	146.1 Å²	146.1	74%	0.743	77%	0.766	S	S	*	*			trans	61.7	154.2	170.4	-81	158.6	134.9	0	0	118.6
247	S	29.6	Very low	30.7	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	76%	0.764	S	S	*	*			cis	-166.8	177.2	-12.6	49.1	0	0	0	0	111.7
248	Q	25.9	Very low	30.6	Very low	151 Å²	151	138.5 Å²	138.5	71%	0.706	76%	0.758	S	S	*	*			trans	79.1	106.7	152.8	-132.3	147.5	18.1	0	0	117.1
249	E	29.6	Very low	30.6	Very low	154 Å²	154	145.7 Å²	145.7	72%	0.72	78%	0.779	S	S	*	*				72.8	137.2	69.2	111.3	-158.8	152.8	0	0	113.8
250	E	31.5	Very low	31.3	Very low	181 Å²	181	142 Å²	142	85%	0.846	77%	0.769	S	S	*	*			cis	-155.7	-168	9.7	-140.1	-166.6	175.8	0	0	113.1
251	A	27.8	Very low	31.3	Very low	92 Å²	92	141.4 Å²	141.4	76%	0.76	77%	0.766	S	S	*	*			trans	91.2	131.7	158.2	0	0	0	0	0	120.2
252	C	26.2	Very low	30	Very low	117 Å²	117	142 Å²	142	79%	0.791	76%	0.763	S	S	*	*			trans	-118.5	169.6	-174.9	-59.7	0	0	0	0	112.4
253	H	28.5	Very low	29.2	Very low	182 Å²	182	148.1 Å²	148.1	84%	0.843	77%	0.774	S	S	*	*			trans	163.2	109.7	137.6	-82.5	-56.8	0	0	0	107.8
254	D	25.1	Very low	29.2	Very low	146 Å²	146	148.4 Å²	148.4	78%	0.781	77%	0.77	S	S	*	*				98.9	154.4	57.9	-166.9	9.1	0	0	0	112
255	S	29.4	Very low	29.5	Very low	111 Å²	111	148.4 Å²	148.4	78%	0.776	77%	0.767	S	S	*	*			trans	81.5	104.6	179.7	-58.9	0	0	0	0	120.4
256	Q	25.7	Very low	29.4	Very low	188 Å²	188	146.3 Å²	146.3	88%	0.879	77%	0.765	S	S	*	*			trans	-95.6	-169.2	155.5	-125.7	-177.8	-126.2	0	0	108.4
257	P	39.6	Very low	29.3	Very low	104 Å²	104	145.4 Å²	145.4	68%	0.675	77%	0.765	S	S	*	*			cis	-139.5	179	-4.8	42.4	-23.4	0	0	0	118.2
258	A	25.9	Very low	29.1	Very low	96 Å²	96	146.6 Å²	146.6	79%	0.793	77%	0.768	S	S	*	*			trans	77.1	159.1	142.8	0	0	0	0	0	123.7
259	W	31.7	Very low	29	Very low	248 Å²	248	148.2 Å²	148.2	94%	0.939	77%	0.773	S	S	*	*			trans	-103.2	-168.3	-175.9	-56.1	83.3	0	0	0	111.2
260	P	44.7	Very low	28.8	Very low	91 Å²	91	147.8 Å²	147.8	59%	0.591	77%	0.771	S	S	*	*			cis	-135.6	-172.5	-7.4	42.8	-24.6	0	0	0	115.1
261	H	27.7	Very low	28.3	Very low	170 Å²	170	148.5 Å²	148.5	79%	0.787	77%	0.774	S	S	*	*				168.2	-174.8	129.7	-92.4	-56.5	0	0	0	115.5
262	D	26.5	Very low	28.2	Very low	127 Å²	127	152 Å²	152	68%	0.679	78%	0.775	S	S	*	*			trans	-125.8	-178.5	-141.9	-58.9	-90.8	0	0	0	118
263	Y	24.4	Very low	28.1	Very low	234 Å²	234	152.7 Å²	152.7	92%	0.918	78%	0.775	S	S	*	*			trans	93.5	156.8	156.4	-90.1	-87.7	0	0	0	123.1
264	R	28.7	Very low	28.3	Very low	201 Å²	201	149.3 Å²	149.3	76%	0.758	77%	0.772	S	S	*	*			trans	-130.1	165.9	-169.7	-138.5	-164.7	-169.7	-153	7.5	108.7
265	P	36.3	Very low	29.1	Very low	118 Å²	118	148.2 Å²	148.2	77%	0.766	77%	0.773	S	S	*	*				-157.1	150	72.7	42.1	-20.3	0	0	0	117.5
266	V	26	Very low	28.9	Very low	110 Å²	110	147.6 Å²	147.6	67%	0.667	78%	0.775	S	S	*	*				86	148.1	87.4	-179.1	0	0	0	0	118.9
267	N	25.5	Very low	28.9	Very low	141 Å²	141	144.5 Å²	144.5	75%	0.754	77%	0.773	S	S	*	*			trans	100.5	156.3	163.7	-131.6	9.4	0	0	0	115.6
268	V	24.8	Very low	28.3	Very low	116 Å²	116	144.7 Å²	144.7	70%	0.703	78%	0.777	S	S	*	*			cis	-149.9	149.6	10.8	-146.8	0	0	0	0	114.5
269	K	23.6	Very low	28.5	Very low	185 Å²	185	144.6 Å²	144.6	80%	0.804	77%	0.771	S	S	*	*			trans	69.4	168.2	143.3	-103	-169.4	172.6	-165.9	0	127.8
270	E	25.3	Very low	28.3	Very low	146 Å²	146	141.2 Å²	141.2	68%	0.682	77%	0.765	S	S	*	*			trans	-124.4	168.8	-156.4	-41.3	136.6	83.3	0	0	114
271	E	21.1	Very low	28.6	Very low	196 Å²	196	141.9 Å²	141.9	92%	0.916	77%	0.77	S	S	*	*			trans	-159.4	-175.6	137.8	-138	170.6	83.5	0	0	113.4
272	Q	24.6	Very low	28.7	Very low	165 Å²	165	144.4 Å²	144.4	77%	0.771	77%	0.772	S	S	*	*			trans	-139.1	-175	-161.8	-64.6	-169.8	14.1	0	0	116.5
273	V	24.1	Very low	28.7	Very low	132 Å²	132	143.8 Å²	143.8	80%	0.8	77%	0.769	S	S	*	*			trans	103.9	151.7	151.9	-169.8	0	0	0	0	118.6
274	S	32.7	Very low	28.8	Very low	110 Å²	110	138.4 Å²	138.4	77%	0.769	76%	0.76	S	S	*	*			trans	-161.5	157.2	179.9	-52.5	0	0	0	0	112.4
275	P	42.1	Very low	29.4	Very low	124 Å²	124	135.1 Å²	135.1	81%	0.805	77%	0.765	S	S	*	*			trans	-149.3	151.3	162	38.1	-20	0	0	0	120.1
276	A	26.4	Very low	29.1	Very low	98 Å²	98	139.4 Å²	139.4	81%	0.81	77%	0.772	S	S	*	*			trans	62.9	160.9	142.9	0	0	0	0	0	122.8
277	S	26.1	Very low	29.3	Very low	122 Å²	122	137.9 Å²	137.9	85%	0.853	78%	0.778	S	S	*	*			cis	-166.8	-152.1	-24.3	62.2	0	0	0	0	112.8
278	S	26.8	Very low	29.5	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	79%	0.786	S	S	*	*			trans	-143.6	168.3	-145.8	52.9	0	0	0	0	116.2
279	S	28.8	Very low	29.9	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	79%	0.791	S	S	*	*			cis	-179.6	-169.4	-7.4	52.6	0	0	0	0	112.7
280	H	27.7	Very low	30.2	Very low	177 Å²	177	137.8 Å²	137.8	82%	0.819	79%	0.792	S	S	*	*			trans	98.8	-175.9	164.1	-64.5	-65	0	0	0	120.4
281	P	51.7	Low	30.2	Very low	105 Å²	105	135.4 Å²	135.4	68%	0.682	79%	0.792	S	S	*	*				-142.3	175.2	-94.2	45.5	-26.4	0	0	0	121
282	R	28.5	Very low	30.6	Very low	222 Å²	222	135.2 Å²	135.2	84%	0.838	79%	0.791	S	S	*	*			trans	71.4	167	156.6	-81.5	176.1	174	-82.7	0.5	119.6
283	D	27.5	Very low	30.7	Very low	114 Å²	114	133 Å²	133	61%	0.61	79%	0.788	S	S	*	*			cis	-154.5	-163.5	0.5	-135.8	-57.1	0	0	0	115.4
284	T	25.8	Very low	31	Very low	121 Å²	121	134.8 Å²	134.8	74%	0.742	79%	0.788	S	S	*	*			trans	-134.4	155.9	177.6	68	0	0	0	0	115.7
285	P	41.5	Very low	31.4	Very low	133 Å²	133	139.2 Å²	139.2	86%	0.864	80%	0.797	S	S	*	*				-154.9	-143.6	100.3	42.1	-20.3	0	0	0	116.2
286	K	31	Very low	30.9	Very low	207 Å²	207	136.8 Å²	136.8	90%	0.9	79%	0.794	S	S	*	*			trans	-121.1	172.1	-164.4	-54.4	172.8	-176.9	175	0	113.6
287	G	29.3	Very low	31.2	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	80%	0.801	S	S	*	*			cis	133.1	122.2	-7.1	0	0	0	0	0	115.8
288	S	30.3	Very low	31.3	Very low	131 Å²	131	135.6 Å²	135.6	92%	0.916	80%	0.8	S	S	*	*			trans	-157.6	-168.7	173.9	63.8	0	0	0	0	114
289	T	32.2	Very low	31.5	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	81%	0.806	S	S	*	*			trans	-110	152.5	-150.6	52.7	0	0	0	0	119
290	Q	30.1	Very low	32	Very low	178 Å²	178	135.2 Å²	135.2	83%	0.832	82%	0.817	S	S	*	*				169.7	133.8	116.1	-176.2	162.3	-12	0	0	115.9
291	S	27	Very low	32.1	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	82%	0.82	S	S	*	*			trans	43.9	120.7	160.1	65.3	0	0	0	0	125.3
292	Q	28.4	Very low	31.1	Very low	191 Å²	191	129.9 Å²	129.9	89%	0.893	83%	0.829	S	S	*	*			trans	37.2	139.5	136.7	-69.2	-178.9	-15.5	0	0	121.6
293	V	26.1	Very low	30.9	Very low	118 Å²	118	123.4 Å²	123.4	72%	0.715	83%	0.831	S	S	*	*			cis	-155.1	165.7	10.9	95.8	0	0	0	0	112.7
294	E	32.1	Very low	30.8	Very low	170 Å²	170	121.3 Å²	121.3	79%	0.794	84%	0.836	S	S	*	*			trans	54.7	97.8	168.5	-77.5	-174.4	105.7	0	0	121.7
295	Q	40.4	Very low	30.8	Very low	204 Å²	204	119.9 Å²	119.9	95%	0.953	84%	0.837	S	S	*	*			trans	176.5	157.1	134.1	-102.8	162.4	84.7	0	0	112.8
296	G	30.2	Very low	30.1	Very low	73 Å²	73	122.5 Å²	122.5	75%	0.753	84%	0.838	S	S	*	*			trans	87.8	109.1	143.6	0	0	0	0	0	121.1
297	A	34.2	Very low	30	Very low	114 Å²	114	115.9 Å²	115.9	94%	0.942	83%	0.828	S	S	*	*			trans	42.9	139.2	137.5	0	0	0	0	0	124
298	G	28.2	Very low	30.3	Very low	81 Å²	81	117.7 Å²	117.7	84%	0.835	83%	0.825	S	S	*	*				128.5	144.8	128.2	0	0	0	0	0	119.4
299	G	30.2	Very low	30	Very low	87 Å²	87	121.7 Å²	121.7	90%	0.897	82%	0.821	S	S	*	*			trans	87.2	149.6	152.1	0	0	0	0	0	117.8
300	A	39	Very low	30	Very low	108 Å²	108	123.1 Å²	123.1	89%	0.893	82%	0.818	S	S	*	*			trans	-119	131.9	178.7	0	0	0	0	0	112.5
301	G	31.1	Very low	31.1	Very low	86 Å²	86	119.3 Å²	119.3	89%	0.887	81%	0.809	S	S	*	*			trans	89.4	117.9	151.1	0	0	0	0	0	118.1
302	G	30.1	Very low	31.1	Very low	84 Å²	84	122.2 Å²	122.2	87%	0.866	82%	0.816	S	S	*	*			trans	158.6	76.1	161.4	0	0	0	0	0	117.2
303	G	24.5	Very low	31.1	Very low	85 Å²	85	119.3 Å²	119.3	88%	0.876	82%	0.817	S	S	*	*			trans	77.6	159.8	170.8	0	0	0	0	0	115.5
304	G	24.1	Very low	31	Very low	70 Å²	70	117.4 Å²	117.4	72%	0.722	82%	0.821	S	S	*	*			cis	174.3	138.2	-7.8	0	0	0	0	0	111.2
305	A	26.3	Very low	30.9	Very low	91 Å²	91	115.6 Å²	115.6	75%	0.752	83%	0.827	S	S	*	*			trans	63.1	148.4	-170.8	0	0	0	0	0	114.2
306	E	27.8	Very low	30.1	Very low	189 Å²	189	108.7 Å²	108.7	88%	0.883	81%	0.811	S	S	*	*			cis	-159.4	143.5	-15.4	47	-158.6	115.7	0	0	108.2
307	G	27.5	Very low	30	Very low	67 Å²	67	116.5 Å²	116.5	69%	0.691	82%	0.817	S	S	*	*			cis	-154.7	-137.1	-0.1	0	0	0	0	0	110
308	P	35.6	Very low	29.7	Very low	116 Å²	116	121.7 Å²	121.7	75%	0.753	81%	0.812	S	S	*	*	S	Bend	cis	-126.6	89.5	2.7	36.3	-17.4	0	0	0	112.1
309	W	25.7	Very low	30	Very low	216 Å²	216	126.8 Å²	126.8	82%	0.818	81%	0.812	S	S	*	*			trans	-141.6	114.7	177.8	-82.6	95.3	0	0	0	114.2
310	Q	32.1	Very low	30	Very low	160 Å²	160	129.5 Å²	129.5	75%	0.748	81%	0.806	S	S	*	*			trans	68.1	167.8	148.5	-88.9	179.4	26.9	0	0	119
311	P	52.7	Low	30.4	Very low	98 Å²	98	135.5 Å²	135.5	64%	0.636	81%	0.805	S	S	*	*			cis	-138.3	-163.2	-17.4	32.1	-9.4	0	0	0	114.4
312	L	26.9	Very low	30.9	Very low	159 Å²	159	140 Å²	140	83%	0.832	80%	0.8	S	S	*	*			trans	78	110.8	151.7	-71.3	169	0	0	0	121.3
313	S	27.4	Very low	31.2	Very low	129 Å²	129	142.7 Å²	142.7	90%	0.902	80%	0.795	S	S	*	*				-156.5	150.1	125.1	-85.6	0	0	0	0	110
314	G	25.4	Very low	31.9	Very low	78 Å²	78	145.3 Å²	145.3	80%	0.804	78%	0.782	S	S	*	*			trans	-122.9	142	-177.4	0	0	0	0	0	113.1
315	S	28.8	Very low	32.5	Very low	132 Å²	132	147.2 Å²	147.2	92%	0.923	78%	0.776	S	S	*	*			trans	-157.2	145.9	160.6	-168.1	0	0	0	0	109.7
316	G	25.1	Very low	33.5	Very low	59 Å²	59	147.4 Å²	147.4	61%	0.608	77%	0.768	S	S	*	*			trans	-98.1	-172	-166.5	0	0	0	0	0	116.1
317	R	27	Very low	34.1	Very low	238 Å²	238	143 Å²	143	90%	0.898	75%	0.754	S	S	*	*			trans	79.8	145.7	178.4	-45.9	179.7	-159.4	-105.7	8.6	112.6
318	R	28	Very low	34.7	Very low	222 Å²	222	147.5 Å²	147.5	84%	0.838	75%	0.75	S	S	*	*			cis	-144.8	132.8	13.6	-113.3	132.9	-174.6	-113.2	10.3	112.7
319	K	34.3	Very low	34.9	Very low	189 Å²	189	148.6 Å²	148.6	82%	0.822	74%	0.744	S	S	*	*			trans	26.6	128.1	141	-57.6	179.5	179.6	-179.8	0	121.3
320	N	29.6	Very low	35.9	Very low	143 Å²	143	144 Å²	144	77%	0.765	74%	0.735	S	S	*	*			trans	-157.3	95.1	147.2	-159.4	-0.7	0	0	0	108.6
321	R	47.8	Very low	36.5	Very low	235 Å²	235	140 Å²	140	89%	0.887	72%	0.721	S	S	*	*			cis	76.5	25.7	42.8	-143.4	-147.7	163.8	142.3	0.6	117.3
322	K	41.9	Very low	36.1	Very low	179 Å²	179	140 Å²	140	78%	0.778	71%	0.713	S	S	*	*			trans	-134	0.4	168.5	-77.2	-163	173.3	-174.2	0	119.1
323	N	37.7	Very low	36.6	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	70%	0.703	S	S	*	*	S	Bend	trans	-114.6	30.6	-175.2	-101.2	44	0	0	0	115.9
324	K	38.3	Very low	37.3	Very low	140 Å²	140	135.3 Å²	135.3	61%	0.609	68%	0.679	S	S	*	*	S	Bend	trans	-96.7	-24.5	-176	-169.4	165.7	-179.7	175.5	0	114.8
325	D	37.7	Very low	37.9	Very low	110 Å²	110	136.7 Å²	136.7	59%	0.588	66%	0.664	S	S	*	*	S	Bend	trans	-99	-26.9	-162	-52.2	-67.9	0	0	0	113.3	R328	D325-R328 PolarHBondContact O-N 3.32Å
326	T	45.9	Very low	38.3	Very low	95 Å²	95	137 Å²	137	58%	0.583	65%	0.645	S	S	*	*	H	α-helix	trans	-65	-39.6	172.5	46.7	0	0	0	0	112.9	R328 H329	T326-R328 PolarHBondContact O-N 2.79Å; T326-H329 PolarHBondContact O-N 3.15Å
327	V	39.9	Very low	39	Very low	97 Å²	97	138.5 Å²	138.5	59%	0.588	64%	0.643	S	S	*	*	H	α-helix	trans	-63.9	-27.7	-179.3	-177.9	0	0	0	0	112	T331	V327-T331 PolarHBondContact O-OG1 3.31Å
328	R	41.8	Very low	39.5	Very low	160 Å²	160	136.7 Å²	136.7	60%	0.604	64%	0.636	S	S	*	*	H	α-helix	trans	-78.8	-24	-178.8	-74.7	177.4	155.5	-165.5	-12.7	114.2	D325 T326	D325-R328 PolarHBondContact O-N 3.32Å; T326-R328 PolarHBondContact O-N 2.79Å
329	H	39.4	Very low	40	Very low	139 Å²	139	130.5 Å²	130.5	64%	0.644	62%	0.619	S	S	*	*	H	α-helix	trans	-76.4	-32.2	179.7	-106	-86.3	0	0	0	112.9	T326 Q333	T326-H329 PolarHBondContact O-N 3.15Å; H329-Q333 PolarHBondContact O-N 3.11Å
330	I	46.8	Very low	40.2	Very low	121 Å²	121	129.6 Å²	129.6	62%	0.621	61%	0.611	S	S	*	*	H	α-helix	trans	-74.9	-48.4	-173.1	-61.1	173.8	0	0	0	111.1	Q332 Q333 S334	I330-Q332 VanDerWaalsContact C-N 3.34Å; I330-Q332 PolarHBondContact O-N 2.71Å; I330-Q333 PolarHBondContact O-N 2.65Å; I330-S334 PolarHBondContact O-N 2.9Å; I330-S334 PolarHBondContact O-OG 3.21Å
331	T	44.3	Very low	40.8	Very low	74 Å²	74	128 Å²	128	45%	0.454	60%	0.599	S	S	.	*	H	α-helix	trans	-60.3	-42.8	175.8	33.8	0	0	0	0	112.2	V327 Q333 S334 E335	V327-T331 PolarHBondContact O-OG1 3.31Å; T331-Q333 PolarHBondContact O-N 2.86Å; T331-S334 WeakPolarHBondContact CA-OG 3.13Å; T331-S334 PolarHBondContact O-N 3.08Å; T331-S334 VanDerWaalsContact O-N 3.15Å; T331-S334 PolarHBondContact O-OG 3.42Å; T331-E335 WeakPolarHBondContact O-CG 3.39Å; T331-E335 PolarHBondContact O-N 2.83Å; T331-E335 VanDerWaalsContact O-N 3.14Å
332	Q	43.8	Very low	40.3	Very low	99 Å²	99	125.5 Å²	125.5	46%	0.463	59%	0.59	S	S	.	*	H	α-helix	trans	-71.6	-14.3	-178.7	-153.6	-178.8	105.5	0	0	113.6	I330 R336	I330-Q332 VanDerWaalsContact C-N 3.34Å; I330-Q332 PolarHBondContact O-N 2.71Å; Q332-R336 VanDerWaalsContact O-CD 3.27Å; Q332-R336 WeakPolarHBondContact O-CD 3.48Å; Q332-R336 WeakPolarHBondContact O-CG 3.44Å
333	Q	38.5	Very low	40.1	Very low	132 Å²	132	120.1 Å²	120.1	62%	0.617	57%	0.569	S	S	*	*	H	α-helix	trans	-82.2	-38.2	168.2	-81.2	-173.6	-40.9	0	0	112.4	H329 I330 T331 T337	H329-Q333 PolarHBondContact O-N 3.11Å; I330-Q333 PolarHBondContact O-N 2.65Å; T331-Q333 PolarHBondContact O-N 2.86Å; Q333-T337 PolarHBondContact O-N 3.24Å; Q333-T337 PolarHBondContact O-OG1 3.12Å
334	S	40.6	Very low	40.2	Very low	57 Å²	57	122.3 Å²	122.3	40%	0.399	57%	0.567	S	S	.	*	H	α-helix	trans	-62.9	-47.2	175.6	35.6	0	0	0	0	112.5	I330 T331 T337 W338	I330-S334 PolarHBondContact O-N 2.9Å; I330-S334 PolarHBondContact O-OG 3.21Å; T331-S334 WeakPolarHBondContact CA-OG 3.13Å; T331-S334 PolarHBondContact O-N 3.08Å; T331-S334 VanDerWaalsContact O-N 3.15Å; T331-S334 PolarHBondContact O-OG 3.42Å; S334-T337 PolarHBondContact O-N 3.2Å; S334-T337 VanDerWaalsContact O-N 3.16Å; S334-W338 VanDerWaalsContact O-CD1 3.24Å; S334-W338 PolarHBondContact O-N 2.86Å
335	E	39.7	Very low	40.4	Very low	108 Å²	108	120.8 Å²	120.8	51%	0.505	57%	0.565	S	S	.	*	H	α-helix	trans	-60.3	-53.1	-177.4	-68.6	157.2	178.2	0	0	111.1	T331 T337 W338 D339	T331-E335 WeakPolarHBondContact O-CG 3.39Å; T331-E335 PolarHBondContact O-N 2.83Å; T331-E335 VanDerWaalsContact O-N 3.14Å; E335-T337 PolarHBondContact O-N 2.74Å; E335-W338 PolarHBondContact O-N 3.1Å; E335-D339 PolarHBondContact O-N 2.86Å
336	R	37.3	Very low	40.3	Very low	137 Å²	137	123 Å²	123	52%	0.517	57%	0.565	S	S	.	*	H	α-helix	trans	-61	-5.9	177	-67.6	178	-173.6	-100.9	9.7	115.3	Q332 R340	Q332-R336 VanDerWaalsContact O-CD 3.27Å; Q332-R336 WeakPolarHBondContact O-CD 3.48Å; Q332-R336 WeakPolarHBondContact O-CG 3.44Å; R336-R340 WeakPolarHBondContact O-CG 3.4Å; R336-R340 PolarHBondContact O-NH1 3.09Å
337	T	39.4	Very low	39.7	Very low	92 Å²	92	124.6 Å²	124.6	56%	0.564	57%	0.57	S	S	*	*	H	α-helix	trans	-99	-37	176.4	-52.7	0	0	0	0	111.2	Q333 S334 E335 Q341	Q333-T337 PolarHBondContact O-N 3.24Å; Q333-T337 PolarHBondContact O-OG1 3.12Å; S334-T337 PolarHBondContact O-N 3.2Å; S334-T337 VanDerWaalsContact O-N 3.16Å; E335-T337 PolarHBondContact O-N 2.74Å; T337-Q341 PolarHBondContact O-N 2.81Å
338	W	36.5	Very low	39.6	Very low	200 Å²	200	130.5 Å²	130.5	76%	0.758	58%	0.582	S	S	*	*	H	α-helix	trans	-71.2	-40.1	175.1	-72.1	109.2	0	0	0	113	S334 E335 R340 Q341 R342	S334-W338 VanDerWaalsContact O-CD1 3.24Å; S334-W338 PolarHBondContact O-N 2.86Å; E335-W338 PolarHBondContact O-N 3.1Å; W338-R340 PolarHBondContact O-N 2.84Å; W338-Q341 PolarHBondContact O-N 2.86Å; W338-R342 PolarHBondContact O-N 2.85Å; W338-R342 VanDerWaalsContact O-N 3.12Å
339	D	39.4	Very low	39.3	Very low	91 Å²	91	129.7 Å²	129.7	49%	0.487	59%	0.59	S	S	.	*	H	α-helix	trans	-62.6	-43.9	179.4	-63.2	-34.5	0	0	0	111.6	E335 Q341 R342 D343	E335-D339 PolarHBondContact O-N 2.86Å; D339-Q341 PolarHBondContact O-N 2.8Å; D339-R342 PolarHBondContact O-N 2.73Å; D339-R342 VanDerWaalsContact O-N 3.09Å; D339-D343 PolarHBondContact O-N 2.98Å
340	R	37.5	Very low	39.2	Very low	170 Å²	170	127.5 Å²	127.5	64%	0.642	59%	0.59	S	S	*	*	H	α-helix	trans	-62.6	-27.7	177.3	-76.2	-170.9	179.6	106.4	-14.3	114.3	R336 W338 R344	R336-R340 WeakPolarHBondContact O-CG 3.4Å; R336-R340 PolarHBondContact O-NH1 3.09Å; W338-R340 PolarHBondContact O-N 2.84Å; R340-R344 WeakPolarHBondContact O-CB 3.21Å
341	Q	43.1	Very low	38.5	Very low	109 Å²	109	133.4 Å²	133.4	51%	0.509	61%	0.605	S	S	.	*	H	α-helix	trans	-73.8	-46.4	173.7	-162.1	74.9	6.9	0	0	109.5	T337 W338 D339 R344 D345	T337-Q341 PolarHBondContact O-N 2.81Å; W338-Q341 PolarHBondContact O-N 2.86Å; D339-Q341 PolarHBondContact O-N 2.8Å; Q341-R344 PolarHBondContact O-N 3.07Å; Q341-D345 PolarHBondContact O-N 3.01Å
342	R	37.7	Very low	38.1	Very low	184 Å²	184	136.1 Å²	136.1	69%	0.694	62%	0.623	S	S	*	*	H	α-helix	trans	-65.2	-40.9	-177.6	-174.6	177.5	-65.3	-142.6	-2	113.9	W338 D339 R346	W338-R342 PolarHBondContact O-N 2.85Å; W338-R342 VanDerWaalsContact O-N 3.12Å; D339-R342 PolarHBondContact O-N 2.73Å; D339-R342 VanDerWaalsContact O-N 3.09Å; R342-R346 PolarHBondContact O-N 3.39Å
343	D	36.3	Very low	37.3	Very low	66 Å²	66	135.1 Å²	135.1	35%	0.353	64%	0.64	S	S	.	*	H	α-helix	trans	-68.5	-36.4	177.3	-74.1	-38.5	0	0	0	111.6	D339 D345 R346 D347	D339-D343 PolarHBondContact O-N 2.98Å; D343-D345 VanDerWaalsContact C-N 3.3Å; D343-D345 PolarHBondContact O-N 3.33Å; D343-R346 PolarHBondContact O-N 2.9Å; D343-R346 VanDerWaalsContact O-N 3.11Å; D343-R346 IonicContact OD1-CZ 2.74Å; D343-R346 IonicContact OD1-NH1 3.64Å; D343-R346 PolarHBondContact OD1-NH1 2.86Å; D343-R346 IonicContact OD1-NH2 2.75Å; D343-R346 PolarHBondContact OD1-NH2 3.36Å; D343-D347 PolarHBondContact O-N 3.36Å
344	R	41.3	Very low	37.1	Very low	187 Å²	187	134.5 Å²	134.5	71%	0.706	65%	0.65	S	S	*	*	H	α-helix	trans	-63	-34.1	178	-179.7	177.7	-72.2	-177.5	-4.1	113.1	R340 Q341	R340-R344 WeakPolarHBondContact O-CB 3.21Å; Q341-R344 PolarHBondContact O-N 3.07Å
345	D	41.3	Very low	37	Very low	108 Å²	108	137.7 Å²	137.7	58%	0.578	67%	0.669	S	S	*	*	H	α-helix	trans	-76.5	-34.8	173.8	-66.7	-38.9	0	0	0	111.4	Q341 D343 R348	Q341-D345 PolarHBondContact O-N 3.01Å; D343-D345 VanDerWaalsContact C-N 3.3Å; D343-D345 PolarHBondContact O-N 3.33Å; D345-R348 PolarHBondContact O-N 3.23Å
346	R	35.9	Very low	36.9	Very low	156 Å²	156	139.7 Å²	139.7	59%	0.589	68%	0.683	S	S	*	*	H	α-helix	trans	-73.6	-29.3	-179.1	-158.3	179.8	74.1	-115	-8.3	114.1	R342 D343 R348	R342-R346 PolarHBondContact O-N 3.39Å; D343-R346 PolarHBondContact O-N 2.9Å; D343-R346 VanDerWaalsContact O-N 3.11Å; D343-R346 IonicContact OD1-CZ 2.74Å; D343-R346 IonicContact OD1-NH1 3.64Å; D343-R346 PolarHBondContact OD1-NH1 2.86Å; D343-R346 IonicContact OD1-NH2 2.75Å; D343-R346 PolarHBondContact OD1-NH2 3.36Å; R346-R348 PolarHBondContact O-N 3.12Å
347	D	32.7	Very low	36.6	Very low	129 Å²	129	139.2 Å²	139.2	69%	0.69	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-7.9	176.8	-82.5	-34	0	0	0	113.8	D343	D343-D347 PolarHBondContact O-N 3.36Å
348	R	37.9	Very low	36.1	Very low	222 Å²	222	139.4 Å²	139.4	84%	0.838	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-26.9	-177.8	-155	173.8	-169.5	-151.2	-1.6	114.2	D345 R346	D345-R348 PolarHBondContact O-N 3.23Å; R346-R348 PolarHBondContact O-N 3.12Å
349	D	35.3	Very low	35.8	Very low	143 Å²	143	138.3 Å²	138.3	77%	0.765	71%	0.708	S	S	*	*	S	Bend	trans	-100.5	27.7	-173.2	-65.7	-32.5	0	0	0	113.4
350	S	37.1	Very low	35.4	Very low	92 Å²	92	142.4 Å²	142.4	64%	0.643	73%	0.729	S	S	*	*			trans	-153.1	81.4	-177.5	-78.6	0	0	0	0	115.4
351	R	32.1	Very low	35	Very low	246 Å²	246	138.7 Å²	138.7	93%	0.928	73%	0.734	S	S	*	*			trans	-158.1	146.1	144.8	-107.4	154.5	-155	-87.7	-0.9	111.9
352	P	37	Very low	34.2	Very low	131 Å²	131	139.9 Å²	139.9	85%	0.851	75%	0.749	S	S	*	*			trans	-104.9	168.9	-171.3	40.5	-35.8	0	0	0	113.9
353	G	27	Very low	33.9	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	76%	0.755	S	S	*	*			trans	129.2	115.7	155.6	0	0	0	0	0	115.6
354	S	34.5	Very low	33.5	Very low	119 Å²	119	137.9 Å²	137.9	83%	0.832	77%	0.774	S	S	*	*			trans	-74.8	170.7	169.3	-40.4	0	0	0	0	111.5
355	P	37.6	Very low	32.8	Very low	124 Å²	124	140.2 Å²	140.2	81%	0.805	78%	0.783	S	S	*	*				-140.1	166.8	80.5	37.7	-22.7	0	0	0	115.7
356	L	37.2	Very low	32.2	Very low	150 Å²	150	140.6 Å²	140.6	79%	0.785	79%	0.785	S	S	*	*			trans	-70.1	165	166.1	-70.6	161.5	0	0	0	111.2
357	P	31.1	Very low	31.7	Very low	126 Å²	126	142.1 Å²	142.1	82%	0.818	79%	0.792	S	S	*	*				-131.6	151.7	114.4	36.9	-30.4	0	0	0	114.1
358	S	29.6	Very low	31.4	Very low	96 Å²	96	141.6 Å²	141.6	67%	0.671	79%	0.79	S	S	*	*			trans	-114	-171.6	168.5	-58.2	0	0	0	0	110
359	M	30.2	Very low	30.9	Very low	177 Å²	177	134 Å²	134	87%	0.872	78%	0.78	S	S	*	*			trans	79.4	139.7	-167.4	-47	-62.9	-175.7	0	0	111.8
360	L	31.9	Very low	30.6	Very low	177 Å²	177	135 Å²	135	93%	0.927	78%	0.78	S	S	*	*			cis	-110.9	170.4	15.4	-68.1	161.8	0	0	0	113.5
361	A	28.8	Very low	30	Very low	92 Å²	92	137.5 Å²	137.5	76%	0.76	79%	0.786	S	S	*	*			trans	-123.6	170	-176.2	0	0	0	0	0	112.1
362	V	26	Very low	30	Very low	134 Å²	134	133.2 Å²	133.2	81%	0.812	78%	0.78	S	S	*	*			trans	-147.8	119.9	152.5	127.4	0	0	0	0	111.2
363	T	30.8	Very low	30.1	Very low	136 Å²	136	132.9 Å²	132.9	83%	0.834	78%	0.778	S	S	*	*			trans	24.4	127.1	160.2	60.9	0	0	0	0	122.6
364	G	28.8	Very low	30.1	Very low	73 Å²	73	132.9 Å²	132.9	75%	0.753	78%	0.778	S	S	*	*			trans	-175.6	117.5	158.7	0	0	0	0	0	113.4
365	W	26.8	Very low	29.9	Very low	236 Å²	236	131.9 Å²	131.9	89%	0.894	78%	0.777	S	S	*	*			trans	-140.4	155.1	-174.7	-85.2	-0.6	0	0	0	108.8
366	N	27.6	Very low	29.3	Very low	116 Å²	116	133.5 Å²	133.5	62%	0.62	78%	0.779	S	S	*	*			cis	-160.1	-173.6	-8.6	-99.2	-13.8	0	0	0	105.9
367	Y	25.5	Very low	29	Very low	188 Å²	188	131.8 Å²	131.8	74%	0.737	77%	0.774	S	S	*	*			cis	-156.3	-157.3	15.8	-161.3	-137	0	0	0	111.2
368	N	27.7	Very low	28.9	Very low	118 Å²	118	131.8 Å²	131.8	63%	0.631	77%	0.772	S	S	*	*			trans	-54.5	166.1	164.5	-56.3	-9.2	0	0	0	112.8
369	G	27.1	Very low	29	Very low	61 Å²	61	135.1 Å²	135.1	63%	0.629	78%	0.777	S	S	*	*			cis	144.3	-179.1	4.7	0	0	0	0	0	111
370	Q	27.7	Very low	29.4	Very low	166 Å²	166	132.1 Å²	132.1	78%	0.776	77%	0.771	S	S	*	*			trans	65.2	155.5	-175.1	-99.8	87	-17.2	0	0	114.9
371	D	24.9	Very low	29	Very low	144 Å²	144	130.2 Å²	130.2	77%	0.77	76%	0.762	S	S	*	*			cis	-148.7	174.8	7.3	-113.6	-41.3	0	0	0	112.4
372	I	33.4	Very low	28.9	Very low	156 Å²	156	130.1 Å²	130.1	80%	0.8	76%	0.755	S	S	*	*			trans	-138	128.9	178.3	-70.5	176.1	0	0	0	107.8
373	P	39.2	Very low	29.1	Very low	124 Å²	124	129 Å²	129	81%	0.805	75%	0.754	S	S	*	*				-163.6	160.1	87.3	41.6	-20.2	0	0	0	120.7
374	G	26	Very low	28.8	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	75%	0.752	S	S	*	*				102.7	150.8	120.8	0	0	0	0	0	122.8
375	A	29.3	Very low	28.8	Very low	98 Å²	98	130.5 Å²	130.5	81%	0.81	75%	0.746	S	S	*	*			trans	77.1	94.6	151.6	0	0	0	0	0	122.9
376	D	26.1	Very low	28.8	Very low	158 Å²	158	130.8 Å²	130.8	85%	0.845	75%	0.747	S	S	*	*				76.1	149.4	113.4	-107.7	-34.2	0	0	0	126
377	V	30.9	Very low	28.8	Very low	114 Å²	114	128.8 Å²	128.8	69%	0.691	75%	0.754	S	S	*	*			trans	76.9	102.8	153.1	174.9	0	0	0	0	122.1
378	T	28	Very low	28.9	Very low	125 Å²	125	129 Å²	129	77%	0.767	76%	0.761	S	S	*	*			trans	54.1	126.3	145.3	61	0	0	0	0	124.5
379	E	33.4	Very low	29	Very low	166 Å²	166	133 Å²	133	78%	0.776	77%	0.768	S	S	*	*				0.4	144.2	127.5	-68.7	-66.9	146.5	0	0	117.9
380	P	38.2	Very low	28.9	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	77%	0.773	S	S	*	*			cis	-151.6	163.8	49.2	42.6	-23.1	0	0	0	120.1
381	N	23.9	Very low	28.9	Very low	137 Å²	137	134.2 Å²	134.2	73%	0.733	76%	0.764	S	S	*	*			trans	46.4	138.6	136.3	-163.5	38.4	0	0	0	123.7
382	S	25.8	Very low	28.9	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	76%	0.762	S	S	*	*			trans	69.7	116.1	150.1	57.8	0	0	0	0	122.6
383	S	29.8	Very low	28.8	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	76%	0.755	S	S	*	*				56.1	107.1	128.6	-52	0	0	0	0	122.5
384	D	24.1	Very low	28.5	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	75%	0.75	S	S	*	*				-160.2	125.2	117.6	-121.9	7.2	0	0	0	108.7
385	S	30.3	Very low	28.7	Very low	90 Å²	90	138.4 Å²	138.4	63%	0.629	74%	0.742	S	S	*	*				80.4	101.4	70.9	-58.3	0	0	0	0	115.2
386	R	25.6	Very low	28.4	Very low	243 Å²	243	141.7 Å²	141.7	92%	0.917	74%	0.74	S	S	*	*			trans	-171	136.6	136.9	-108.1	170.7	176.1	99.8	-1	110.5
387	G	28.6	Very low	28.4	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	73%	0.728	S	S	*	*			trans	158.6	74.4	-171.9	0	0	0	0	0	109.7
388	E	27.8	Very low	28.2	Very low	192 Å²	192	142 Å²	142	90%	0.897	73%	0.729	S	S	*	*			trans	-68.6	144.1	-170	-74.3	155	105.1	0	0	112.8
389	R	28.4	Very low	27.9	Very low	201 Å²	201	141.1 Å²	141.1	76%	0.758	72%	0.723	S	S	*	*			trans	-117.3	138.1	171.7	172.8	-176.8	-174.1	172.1	6.6	107.9	D391	R389-D391 IonicContact CZ-OD2 2.92Å; R389-D391 IonicContact NE-OD2 3.53Å; R389-D391 PolarHBondContact NE-OD2 2.9Å; R389-D391 VanDerWaalsContact NE-OD2 3.08Å; R389-D391 IonicContact NH2-OD2 3.27Å; R389-D391 PolarHBondContact NH2-OD2 3.47Å
390	L	25.1	Very low	27.4	Very low	141 Å²	141	141.1 Å²	141.1	74%	0.738	73%	0.728	S	S	*	*			trans	-167	114.6	136.9	-107.3	160.5	0	0	0	112.9	F392	L390-F392 HydrophobicContact CD2-CD2 3.92Å; L390-F392 HydrophobicContact CD2-CE2 3.75Å
391	D	29.1	Very low	26.8	Very low	112 Å²	112	139.4 Å²	139.4	60%	0.599	72%	0.723	S	S	*	*			trans	-75.8	144.8	157.9	-38.4	-91.4	0	0	0	109.3	R389	R389-D391 IonicContact CZ-OD2 2.92Å; R389-D391 IonicContact NE-OD2 3.53Å; R389-D391 PolarHBondContact NE-OD2 2.9Å; R389-D391 VanDerWaalsContact NE-OD2 3.08Å; R389-D391 IonicContact NH2-OD2 3.27Å; R389-D391 PolarHBondContact NH2-OD2 3.47Å
392	F	25	Very low	26.8	Very low	165 Å²	165	139.2 Å²	139.2	72%	0.724	73%	0.728	S	S	*	*			trans	-154.3	146.3	174.5	-97.2	-171.8	0	0	0	107.7	L390	L390-F392 HydrophobicContact CD2-CD2 3.92Å; L390-F392 HydrophobicContact CD2-CE2 3.75Å
393	F	29.4	Very low	26.7	Very low	147 Å²	147	144 Å²	144	65%	0.645	74%	0.74	S	S	*	*			cis	-141.5	146.2	-4.8	-126.7	-110.7	0	0	0	105.4
394	L	34	Very low	26.5	Very low	136 Å²	136	143.8 Å²	143.8	71%	0.712	74%	0.739	S	S	*	*			cis	82.3	114.3	35.5	-142.7	-171.2	0	0	0	115.1
395	K	29.8	Very low	26.5	Very low	143 Å²	143	142.3 Å²	142.3	62%	0.622	74%	0.74	S	S	*	*			trans	-176.8	150.6	135.1	-143.1	155.1	171.4	77.1	0	106.7	E397	K395-E397 WeakPolarHBondContact CE-OE2 3.47Å; K395-E397 IonicContact NZ-OE1 2.71Å; K395-E397 PolarHBondContact NZ-OE1 3.48Å; K395-E397 IonicContact NZ-OE2 2.65Å; K395-E397 PolarHBondContact NZ-OE2 3.08Å
396	Q	23	Very low	26.3	Very low	166 Å²	166	147.1 Å²	147.1	78%	0.776	75%	0.75	S	S	*	*			cis	-151.8	132.5	32.1	-166.2	172.2	11.8	0	0	107.1
397	E	26.8	Very low	26.6	Very low	127 Å²	127	142.9 Å²	142.9	59%	0.593	74%	0.744	S	S	*	*				56.9	135	78.5	-80.8	166.8	-160.7	0	0	114	K395	K395-E397 WeakPolarHBondContact CE-OE2 3.47Å; K395-E397 IonicContact NZ-OE1 2.71Å; K395-E397 PolarHBondContact NZ-OE1 3.48Å; K395-E397 IonicContact NZ-OE2 2.65Å; K395-E397 PolarHBondContact NZ-OE2 3.08Å
398	E	25.3	Very low	26.4	Very low	153 Å²	153	143 Å²	143	72%	0.715	75%	0.745	S	S	*	*			cis	-159.2	172.7	12.6	-145.8	-162	99.2	0	0	113.8
399	T	23	Very low	26.3	Very low	105 Å²	105	138.7 Å²	138.7	64%	0.644	74%	0.743	S	S	*	*			trans	33.8	142.2	152.5	36.9	0	0	0	0	122.4
400	L	23.1	Very low	26.2	Very low	166 Å²	166	136.9 Å²	136.9	87%	0.869	75%	0.749	S	S	*	*			cis	-174.8	-172.4	45.8	-128.9	164.5	0	0	0	110.2
401	A	24.6	Very low	26.2	Very low	79 Å²	79	139.6 Å²	139.6	65%	0.653	76%	0.758	S	S	*	*			trans	-131.2	146.9	-174.5	0	0	0	0	0	114.8
402	T	24.1	Very low	26.2	Very low	134 Å²	134	139.7 Å²	139.7	82%	0.822	77%	0.767	S	S	*	*			trans	178.8	149.4	169.9	28	0	0	0	0	108.3
403	E	24	Very low	26.3	Very low	189 Å²	189	141.5 Å²	141.5	88%	0.883	78%	0.778	S	S	*	*			cis	-144.2	-178.9	-10.2	-74.2	-137.6	129.8	0	0	110.2
404	S	25.3	Very low	26.3	Very low	108 Å²	108	143 Å²	143	76%	0.755	79%	0.786	S	S	*	*			trans	-129.6	133.6	-179	59.2	0	0	0	0	114.1
405	S	24.9	Very low	26.7	Very low	118 Å²	118	141.4 Å²	141.4	83%	0.825	78%	0.784	S	S	*	*			trans	-170.3	133.6	152.2	-86.6	0	0	0	0	110.9
406	F	25.8	Very low	26.6	Very low	191 Å²	191	140.2 Å²	140.2	84%	0.838	79%	0.794	S	S	*	*				69.8	122.5	77.8	-128.7	-125.4	0	0	0	111.3
407	L	31.6	Very low	27.2	Very low	153 Å²	153	136.4 Å²	136.4	80%	0.801	80%	0.8	S	S	*	*			cis	-130.7	175.8	27.4	-80	155.7	0	0	0	113.2
408	G	23.9	Very low	27.3	Very low	76 Å²	76	134.1 Å²	134.1	78%	0.784	81%	0.81	S	S	*	*			trans	-139.3	-171.5	173.2	0	0	0	0	0	113.4
409	A	25.9	Very low	28	Very low	103 Å²	103	132.5 Å²	132.5	85%	0.851	82%	0.822	S	S	*	*			trans	-144.9	141.2	172.4	0	0	0	0	0	110.7
410	N	27	Very low	28.8	Very low	163 Å²	163	130.8 Å²	130.8	87%	0.872	83%	0.826	S	S	*	*			trans	-89.2	132.4	170.4	-66	-19.4	0	0	0	109.5
411	E	23.9	Very low	29.5	Very low	198 Å²	198	126.3 Å²	126.3	93%	0.925	82%	0.82	S	S	*	*			trans	-141.1	147.1	144.2	-67.6	-163.9	153.6	0	0	108.1
412	S	29	Very low	30.3	Very low	113 Å²	113	125.5 Å²	125.5	79%	0.79	82%	0.819	S	S	*	*			trans	-150	95.6	-167.1	61.1	0	0	0	0	113.1
413	E	27.2	Very low	31.3	Very low	204 Å²	204	122.6 Å²	122.6	95%	0.953	81%	0.809	S	S	*	*			trans	-141.6	139.6	163.2	-70.4	-160.2	129	0	0	111.6
414	E	31.1	Very low	32.4	Very low	178 Å²	178	120.5 Å²	120.5	83%	0.832	80%	0.802	S	S	*	*			trans	-114.8	157.3	160.6	-88.1	-83.3	165.3	0	0	106.2
415	P	41.6	Very low	33.3	Very low	102 Å²	102	119.3 Å²	119.3	66%	0.662	79%	0.794	S	S	*	*			cis	-135.3	-175.1	8.2	41.4	-24.7	0	0	0	114.9
416	S	28.1	Very low	34.5	Very low	118 Å²	118	116.9 Å²	116.9	83%	0.825	78%	0.777	S	S	*	*			trans	134.3	150.6	136.3	72.8	0	0	0	0	116.8
417	G	34.1	Very low	35.6	Very low	87 Å²	87	112.7 Å²	112.7	90%	0.897	77%	0.767	S	S	*	*			trans	-65.3	140.4	-156.9	0	0	0	0	0	118.4
418	G	29	Very low	36.6	Very low	79 Å²	79	108.6 Å²	108.6	81%	0.814	76%	0.755	S	S	*	*			trans	-142.5	90	170.6	0	0	0	0	0	112.4	G420	G418-G420 PolarHBondContact O-N 3.21Å
419	A	40.3	Very low	37.9	Very low	118 Å²	118	110 Å²	110	98%	0.975	74%	0.744	S	S	*	*			trans	-84.7	97.6	177.2	0	0	0	0	0	111.4
420	G	41.2	Very low	39.1	Very low	69 Å²	69	108.7 Å²	108.7	71%	0.711	72%	0.723	S	S	*	*			trans	-135.2	-10.2	-174.8	0	0	0	0	0	118	G418	G418-G420 PolarHBondContact O-N 3.21Å
421	G	36	Very low	40	Very low	73 Å²	73	108.8 Å²	108.8	75%	0.753	72%	0.715	S	S	*	*	S	Bend	trans	-84.3	-17.2	-168	0	0	0	0	0	117.5
422	G	41.8	Very low	41.4	Very low	62 Å²	62	102.4 Å²	102.4	64%	0.639	70%	0.697	S	S	*	*	S	Bend	trans	-81.6	-23	-163.7	0	0	0	0	0	117	I424	G422-I424 PolarHBondContact O-N 2.97Å
423	A	44.9	Very low	42.3	Very low	72 Å²	72	98.4 Å²	98.4	60%	0.595	67%	0.67	S	S	*	*	H	α-helix	trans	-76.9	-24.3	-161.8	0	0	0	0	0	115.4	S426	A423-S426 PolarHBondContact O-OG 2.95Å; A423-S426 VanDerWaalsContact O-OG 3.1Å
424	I	47.7	Very low	43.4	Very low	145 Å²	145	94 Å²	94	74%	0.744	65%	0.653	S	S	*	*	H	α-helix	trans	-81.7	-29.9	-170.5	-9.5	178.1	0	0	0	112.9	G422	G422-I424 PolarHBondContact O-N 2.97Å
425	S	45.2	Very low	44.1	Very low	84 Å²	84	93 Å²	93	59%	0.587	65%	0.65	S	S	*	*	H	α-helix	trans	-77	-31.3	-176.8	-174.3	0	0	0	0	113.2	N429	S425-N429 PolarHBondContact O-ND2 3.33Å; S425-N429 VanDerWaalsContact O-ND2 3.08Å
426	S	49.2	Very low	44.4	Very low	67 Å²	67	90.8 Å²	90.8	47%	0.469	64%	0.637	S	S	.	*	H	α-helix	trans	-69.6	-37.7	-179.2	54.6	0	0	0	0	113	A423 A428 N429 L430	A423-S426 PolarHBondContact O-OG 2.95Å; A423-S426 VanDerWaalsContact O-OG 3.1Å; S426-A428 PolarHBondContact O-N 3.31Å; S426-N429 PolarHBondContact O-N 3.42Å; S426-L430 PolarHBondContact O-N 3.22Å; S426-L430 VanDerWaalsContact O-N 3.1Å
427	V	49.7	Very low	45.7	Very low	102 Å²	102	95.2 Å²	95.2	62%	0.618	64%	0.642	S	S	*	*	H	α-helix	trans	-63.2	-40.1	-177.1	178	0	0	0	0	112.3	L430 K431	V427-L430 PolarHBondContact O-N 3.13Å; V427-K431 PolarHBondContact O-N 2.96Å
428	A	50.8	Low	46.6	Very low	67 Å²	67	98.5 Å²	98.5	55%	0.554	64%	0.639	S	S	*	*	H	α-helix	trans	-63.5	-45.5	178.1	0	0	0	0	0	112	S426 L430 K431 A432	S426-A428 PolarHBondContact O-N 3.31Å; A428-L430 PolarHBondContact O-N 3.5Å; A428-K431 PolarHBondContact O-N 2.65Å; A428-A432 PolarHBondContact O-N 3.45Å
429	N	53.2	Low	47.7	Very low	106 Å²	106	97.2 Å²	97.2	57%	0.567	62%	0.617	S	S	*	*	H	α-helix	trans	-64.3	-38.4	178.9	-75.3	-53.6	0	0	0	112.6	S425 S426 K431 A432 A433	S425-N429 PolarHBondContact O-ND2 3.33Å; S425-N429 VanDerWaalsContact O-ND2 3.08Å; S426-N429 PolarHBondContact O-N 3.42Å; N429-K431 PolarHBondContact O-N 3.07Å; N429-A432 PolarHBondContact O-N 2.94Å; N429-A433 WeakPolarHBondContact O-CB 3.41Å; N429-A433 PolarHBondContact O-N 2.98Å
430	L	49.9	Very low	48	Very low	75 Å²	75	97.1 Å²	97.1	39%	0.393	60%	0.599	S	S	.	*	H	α-helix	trans	-66.4	-39.2	-179.8	-146	159.6	0	0	0	111.5	S426 V427 A428 A433 L434	S426-L430 PolarHBondContact O-N 3.22Å; S426-L430 VanDerWaalsContact O-N 3.1Å; V427-L430 PolarHBondContact O-N 3.13Å; A428-L430 PolarHBondContact O-N 3.5Å; L430-A433 PolarHBondContact O-N 2.78Å; L430-L434 HydrophobicContact CD2-CD1 3.7Å; L430-L434 HydrophobicContact CD2-CG 4.19Å; L430-L434 WeakPolarHBondContact O-CG 3.39Å; L430-L434 PolarHBondContact O-N 2.8Å; L430-L434 VanDerWaalsContact O-N 3.15Å
431	K	46.3	Very low	48.3	Very low	166 Å²	166	101.9 Å²	101.9	72%	0.722	61%	0.608	S	S	*	*	H	α-helix	trans	-65.7	-36.2	174.1	-168.5	173.5	-177.6	177.2	0	112.7	V427 A428 N429 M435	V427-K431 PolarHBondContact O-N 2.96Å; A428-K431 PolarHBondContact O-N 2.65Å; N429-K431 PolarHBondContact O-N 3.07Å; K431-M435 WeakPolarHBondContact O-CG 3.49Å
432	A	52.2	Low	48.8	Very low	64 Å²	64	103.6 Å²	103.6	53%	0.529	61%	0.608	S	S	.	*	H	α-helix	trans	-69.6	-44	174	0	0	0	0	0	112.2	A428 N429 L434 M435 S436	A428-A432 PolarHBondContact O-N 3.45Å; N429-A432 PolarHBondContact O-N 2.94Å; A432-L434 PolarHBondContact O-N 3.38Å; A432-M435 PolarHBondContact O-N 2.97Å; A432-S436 PolarHBondContact O-N 3.48Å
433	A	49.3	Very low	48.8	Very low	29 Å²	29	106.4 Å²	106.4	24%	0.24	61%	0.608	C	S	.	*	H	α-helix	trans	-60.1	-44.3	179.9	0	0	0	0	0	112.5	N429 L430 M435 S436	N429-A433 WeakPolarHBondContact O-CB 3.41Å; N429-A433 PolarHBondContact O-N 2.98Å; L430-A433 PolarHBondContact O-N 2.78Å; A433-M435 PolarHBondContact O-N 2.92Å; A433-S436 PolarHBondContact O-N 3.12Å
434	L	50.1	Low	48.5	Very low	111 Å²	111	111.7 Å²	111.7	58%	0.581	61%	0.612	S	S	*	*	H	α-helix	trans	-65.8	-20.5	179.3	-73.7	171.2	0	0	0	114.3	L430 A432	L430-L434 HydrophobicContact CD2-CD1 3.7Å; L430-L434 HydrophobicContact CD2-CG 4.19Å; L430-L434 WeakPolarHBondContact O-CG 3.39Å; L430-L434 PolarHBondContact O-N 2.8Å; L430-L434 VanDerWaalsContact O-N 3.15Å; A432-L434 PolarHBondContact O-N 3.38Å
435	M	45.7	Very low	48.3	Very low	156 Å²	156	108.4 Å²	108.4	77%	0.768	61%	0.607	S	S	*	*	H	α-helix	trans	-87.8	-15.4	174.2	-65.1	-69.4	97	0	0	112.9	K431 A432 A433	K431-M435 WeakPolarHBondContact O-CG 3.49Å; A432-M435 PolarHBondContact O-N 2.97Å; A433-M435 PolarHBondContact O-N 2.92Å
436	S	48.5	Very low	48.1	Very low	57 Å²	57	111.7 Å²	111.7	40%	0.399	61%	0.613	S	S	.	*			trans	-91.2	114.7	-179.9	-178	0	0	0	0	112.3	A432 A433 N438 S439	A432-S436 PolarHBondContact O-N 3.48Å; A433-S436 PolarHBondContact O-N 3.12Å; S436-N438 PolarHBondContact O-N 3.28Å; S436-S439 PolarHBondContact O-N 2.87Å
437	K	53.8	Low	47.8	Very low	211 Å²	211	113.8 Å²	113.8	92%	0.917	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-2.1	-175.6	-72.7	175.8	179.8	164.3	0	115.7
438	N	53.3	Low	47.7	Very low	156 Å²	156	116 Å²	116	83%	0.834	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	1.5	-178	-67.7	-21.6	0	0	0	114.1	S436	S436-N438 PolarHBondContact O-N 3.28Å
439	S	51.8	Low	47.2	Very low	52 Å²	52	115.5 Å²	115.5	36%	0.364	62%	0.624	S	S	.	*			trans	-110.5	31.7	-162.4	-162.8	0	0	0	0	116.2	S436	S436-S439 PolarHBondContact O-N 2.87Å
440	L	48.1	Very low	46.9	Very low	115 Å²	115	118.3 Å²	118.3	60%	0.602	64%	0.639	S	S	*	*			trans	-105	15	-177.4	-70.5	176.9	0	0	0	115.2
441	L	47.3	Very low	46.7	Very low	170 Å²	170	122.7 Å²	122.7	89%	0.89	66%	0.663	S	S	*	*	S	Bend	trans	-108.9	6.3	-179.7	-63.6	178.6	0	0	0	114.5
442	S	45.8	Very low	46.6	Very low	109 Å²	109	118.7 Å²	118.7	76%	0.762	65%	0.649	S	S	*	*			trans	-116.9	10.9	-175.9	-52.3	0	0	0	0	114.5
443	L	42.9	Very low	46.6	Very low	120 Å²	120	120.9 Å²	120.9	63%	0.628	66%	0.658	S	S	*	*			trans	-84	122	168.8	-74.2	166.9	0	0	0	108.9
444	R	38	Very low	46.3	Very low	183 Å²	183	125.9 Å²	125.9	69%	0.691	68%	0.68	S	S	*	*			trans	-66.5	148.9	175.2	-73.7	-168	-174.7	165.8	0.6	111.1	E446 M447	R444-E446 HydrophobicContact CB-CB 4.32Å; R444-E446 HydrophobicContact CB-CG 4.46Å; R444-E446 WeakPolarHBondContact CD-OE2 3.41Å; R444-E446 IonicContact CZ-OE2 3.59Å; R444-E446 IonicContact NE-OE2 3.67Å; R444-E446 IonicContact NH1-OE2 2.75Å; R444-E446 PolarHBondContact NH1-OE2 3.26Å; R444-E446 PolarHBondContact O-N 2.93Å; R444-M447 PolarHBondContact O-N 3.39Å
445	A	43.8	Very low	46	Very low	77 Å²	77	125.8 Å²	125.8	64%	0.636	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-60.5	-22.7	172.1	0	0	0	0	0	113.5	M447 M448	A445-M447 PolarHBondContact O-N 3.17Å; A445-M448 PolarHBondContact O-N 2.94Å; A445-M448 VanDerWaalsContact O-N 3.1Å
446	E	40.7	Very low	45.9	Very low	152 Å²	152	128.3 Å²	128.3	71%	0.71	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-61.1	-12	179.6	-60.7	176.2	145.4	0	0	114.5	R444	R444-E446 HydrophobicContact CB-CB 4.32Å; R444-E446 HydrophobicContact CB-CG 4.46Å; R444-E446 WeakPolarHBondContact CD-OE2 3.41Å; R444-E446 IonicContact CZ-OE2 3.59Å; R444-E446 IonicContact NE-OE2 3.67Å; R444-E446 IonicContact NH1-OE2 2.75Å; R444-E446 PolarHBondContact NH1-OE2 3.26Å; R444-E446 PolarHBondContact O-N 2.93Å
447	M	43.1	Very low	45.5	Very low	112 Å²	112	133.1 Å²	133.1	55%	0.552	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-104.1	16.6	177.1	-133.9	-175.8	83	0	0	113.9	R444 A445	R444-M447 PolarHBondContact O-N 3.39Å; A445-M447 PolarHBondContact O-N 3.17Å
448	M	46.8	Very low	45.1	Very low	148 Å²	148	133 Å²	133	73%	0.729	69%	0.693	S	S	*	*			trans	-116.5	36.6	176.7	-56.6	-167.4	-52.8	0	0	112.8	A445	A445-M448 PolarHBondContact O-N 2.94Å; A445-M448 VanDerWaalsContact O-N 3.1Å
449	G	41	Very low	44.4	Very low	57 Å²	57	131.7 Å²	131.7	59%	0.588	69%	0.686	S	S	*	*			trans	-73.6	138.9	159.4	0	0	0	0	0	109.6	D451	G449-D451 PolarHBondContact O-N 2.98Å; G449-D451 VanDerWaalsContact O-N 3.15Å
450	D	45.4	Very low	43.6	Very low	165 Å²	165	134.9 Å²	134.9	88%	0.882	71%	0.705	S	S	*	*	S	Bend	trans	-65.1	-18.4	-172.6	-67	-66.7	0	0	0	114	N452	D450-N452 PolarHBondContact O-N 2.9Å
451	D	46.6	Very low	43.1	Very low	167 Å²	167	139.3 Å²	139.3	89%	0.893	72%	0.72	S	S	*	*			trans	-90.7	61.6	-177.3	-63.2	-61.3	0	0	0	113.9	G449	G449-D451 PolarHBondContact O-N 2.98Å; G449-D451 VanDerWaalsContact O-N 3.15Å
452	N	44.7	Very low	42.6	Very low	82 Å²	82	134.4 Å²	134.4	44%	0.439	71%	0.71	S	S	.	*			trans	-141.4	106.1	165.6	-166.9	-20.9	0	0	0	112.7	D450 L454	D450-N452 PolarHBondContact O-N 2.9Å; N452-L454 PolarHBondContact O-N 3.45Å; N452-L454 VanDerWaalsContact O-N 3.16Å; N452-L454 PolarHBondContact OD1-N 2.95Å
453	P	51	Low	42.3	Very low	110 Å²	110	132.7 Å²	132.7	71%	0.714	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-70	-14.8	-170.5	27.8	-35.3	0	0	0	114.7	L455 Y456	P453-L455 VanDerWaalsContact C-N 3.26Å; P453-L455 PolarHBondContact O-N 2.79Å; P453-Y456 PolarHBondContact O-N 2.93Å
454	L	44.4	Very low	42.2	Very low	133 Å²	133	135.2 Å²	135.2	70%	0.696	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-74	-9.5	-171.3	-61.2	178.8	0	0	0	114.7	N452	N452-L454 PolarHBondContact O-N 3.45Å; N452-L454 VanDerWaalsContact O-N 3.16Å; N452-L454 PolarHBondContact OD1-N 2.95Å
455	L	43.5	Very low	42	Very low	110 Å²	110	132.5 Å²	132.5	58%	0.576	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-78.2	-14.9	176.5	-87.7	169.2	0	0	0	114.3	P453	P453-L455 VanDerWaalsContact C-N 3.26Å; P453-L455 PolarHBondContact O-N 2.79Å
456	Y	43.7	Very low	41.7	Very low	208 Å²	208	136.4 Å²	136.4	82%	0.816	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-86	-8.4	-172.7	-106.5	-83.9	0	0	0	115.7	P453	P453-Y456 PolarHBondContact O-N 2.93Å
457	E	39.6	Very low	41.2	Very low	158 Å²	158	134.2 Å²	134.2	74%	0.738	74%	0.738	S	S	*	*	S	Bend	trans	-95.2	-21	-172.2	-166.8	153.1	-147.3	0	0	114.3
458	Y	44.8	Very low	41.2	Very low	209 Å²	209	135.7 Å²	135.7	82%	0.82	75%	0.747	S	S	*	*	S	Bend	trans	-111.7	11.4	-173.7	-79.5	-78.9	0	0	0	115.9
459	L	38.3	Very low	40.7	Very low	128 Å²	128	135.9 Å²	135.9	67%	0.67	75%	0.751	S	S	*	*	S	Bend	trans	-100.8	127.5	171.6	-83.8	165.4	0	0	0	111.6	K461	L459-K461 PolarHBondContact O-N 3.01Å
460	P	35.7	Very low	40.4	Very low	119 Å²	119	139 Å²	139	77%	0.773	75%	0.754	S	S	*	*			trans	-58.1	125.4	173	-24.9	34.8	0	0	0	111.5	G462	P460-G462 VanDerWaalsContact C-N 3.35Å; P460-G462 PolarHBondContact O-N 2.91Å
461	K	38	Very low	40.1	Very low	209 Å²	209	140.6 Å²	140.6	91%	0.909	75%	0.753	S	S	*	*	S	Bend	trans	-71.3	84	-175.5	-66.2	177.8	-179	174.9	0	111.5	L459	L459-K461 PolarHBondContact O-N 3.01Å
462	G	36.5	Very low	40	Very low	66 Å²	66	137 Å²	137	68%	0.68	74%	0.738	S	S	*	*			trans	-151	86.5	175.1	0	0	0	0	0	109.9	P460	P460-G462 VanDerWaalsContact C-N 3.35Å; P460-G462 PolarHBondContact O-N 2.91Å
463	G	40.7	Very low	40.1	Very low	73 Å²	73	139 Å²	139	75%	0.753	75%	0.752	S	S	*	*			trans	-85.1	150.1	-158.2	0	0	0	0	0	116.8
464	H	39	Very low	39.9	Very low	174 Å²	174	140.9 Å²	140.9	81%	0.806	76%	0.755	S	S	*	*			trans	-134.5	124.9	157	-61.2	-46	0	0	0	107.7
465	S	34.3	Very low	40.4	Very low	126 Å²	126	142.3 Å²	142.3	88%	0.881	75%	0.751	S	S	*	*			trans	-73.7	130.8	168.1	46.6	0	0	0	0	109.1
466	L	37.1	Very low	41.5	Very low	158 Å²	158	146.3 Å²	146.3	83%	0.827	76%	0.764	S	S	*	*			trans	-101.4	101.6	-179.9	-63.6	-178	0	0	0	109.8	L468	L466-L468 PolarHBondContact O-N 3.29Å
467	S	30.9	Very low	43.1	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	75%	0.753	S	S	*	*			trans	-74.2	118.7	165.4	-172.7	0	0	0	0	108.9	N469	S467-N469 PolarHBondContact O-N 3.48Å
468	L	42.8	Very low	45.1	Very low	143 Å²	143	139.5 Å²	139.5	75%	0.749	74%	0.736	S	S	*	*	S	Bend	trans	-75.6	81.3	-179.1	-76.7	168.2	0	0	0	111.3	L466	L466-L468 PolarHBondContact O-N 3.29Å
469	N	37.7	Very low	47	Very low	152 Å²	152	137.6 Å²	137.6	81%	0.813	73%	0.732	S	S	*	*			trans	-152.8	19.8	171.6	-108.5	-38	0	0	0	115.6	S467	S467-N469 PolarHBondContact O-N 3.48Å
470	D	33.8	Very low	49.3	Very low	122 Å²	122	132 Å²	132	65%	0.652	70%	0.703	S	S	*	*			trans	-143.7	77.7	-177.8	-138.8	-35.7	0	0	0	112.5	T472	D470-T472 PolarHBondContact O-N 2.74Å; D470-T472 PolarHBondContact OD1-OG1 2.99Å
471	F	39.7	Very low	51.6	Low	198 Å²	198	131.5 Å²	131.5	87%	0.868	70%	0.701	S	S	*	*			trans	-75.5	35.1	176.7	-90.9	-79.1	0	0	0	113.7
472	T	43.7	Very low	53.6	Low	92 Å²	92	129.4 Å²	129.4	56%	0.564	69%	0.688	S	S	*	*	S	Bend	trans	-84	119.3	161.1	61.1	0	0	0	0	108.9	D470 I474	D470-T472 PolarHBondContact O-N 2.74Å; D470-T472 PolarHBondContact OD1-OG1 2.99Å; T472-I474 WeakPolarHBondContact O-CG1 3.5Å; T472-I474 PolarHBondContact O-N 2.91Å
473	V	46.9	Very low	56	Low	123 Å²	123	128.6 Å²	128.6	75%	0.745	67%	0.672	S	S	*	*			trans	-67.2	98.8	179	-178.2	0	0	0	0	109.1	R475	V473-R475 HydrophobicContact CG1-CG 3.95Å; V473-R475 PolarHBondContact O-N 2.83Å
474	I	46.4	Very low	58.1	Low	151 Å²	151	131.2 Å²	131.2	77%	0.774	68%	0.678	S	S	*	*			trans	-70.9	72.4	-179.4	-47.8	-175.7	0	0	0	110.1	T472 K476	T472-I474 WeakPolarHBondContact O-CG1 3.5Å; T472-I474 PolarHBondContact O-N 2.91Å; I474-K476 PolarHBondContact O-N 3.17Å
475	R	55	Low	60.4	Low	162 Å²	162	126.8 Å²	126.8	61%	0.611	66%	0.657	S	S	*	*			trans	-64.3	104.1	168.9	-60.8	-166.7	-165	173	4.7	108	V473 K477	V473-R475 HydrophobicContact CG1-CG 3.95Å; V473-R475 PolarHBondContact O-N 2.83Å; R475-K477 PolarHBondContact O-N 3.33Å
476	K	67.2	Low	62.8	Low	194 Å²	194	123.2 Å²	123.2	84%	0.843	63%	0.632	S	S	*	*			trans	-49.8	103.4	-179.5	-173.8	172.8	-177.4	172.6	0	110.5	I474 F478	I474-K476 PolarHBondContact O-N 3.17Å; K476-F478 PolarHBondContact O-N 3.11Å
477	K	77.3	Confident	65.1	Low	136 Å²	136	115.9 Å²	115.9	59%	0.591	59%	0.594	S	S	*	*			trans	-64.4	133.4	-177.4	-61.2	177.8	-176.3	174	0	110	R475 K479 A487	R475-K477 PolarHBondContact O-N 3.33Å; K477-K479 PolarHBondContact O-N 3.17Å; K477-K479 VanDerWaalsContact O-N 3.12Å; K477-A487 CarbonylContact C-O 3.21Å
478	F	81	Confident	67.5	Low	88 Å²	88	116 Å²	116	39%	0.386	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.6	102.7	173.2	-63.1	-87.5	0	0	0	108.9	K476 S486 A487 Q490 L493	K476-F478 PolarHBondContact O-N 3.11Å; F478-S486 CarbonylContact O-C 3.6Å; F478-S486 WeakPolarHBondContact O-CA 3.48Å; F478-A487 PolarHBondContact N-O 2.86Å; F478-A487 PolarHBondContact O-N 3.08Å; F478-Q490 HydrophobicContact CD1-CB 4.25Å; F478-Q490 HydrophobicContact CD1-CG 4.26Å; F478-Q490 HydrophobicContact CD2-CB 4.46Å; F478-Q490 HydrophobicContact CE1-CB 3.98Å; F478-Q490 HydrophobicContact CE1-CG 4.12Å; F478-Q490 HydrophobicContact CE2-CB 4.2Å; F478-Q490 HydrophobicContact CG-CB 4.49Å; F478-Q490 HydrophobicContact CZ-CB 3.95Å; F478-L493 HydrophobicContact CB-CB 4.1Å; F478-L493 HydrophobicContact CB-CD2 3.74Å
479	K	84.6	Confident	69.3	Low	168 Å²	168	113.7 Å²	113.7	73%	0.73	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.2	144.8	177.5	-61.5	-176.3	-179.9	-177.8	0	111	K477 L493	K477-K479 PolarHBondContact O-N 3.17Å; K477-K479 VanDerWaalsContact O-N 3.12Å; K479-L493 VanDerWaalsContact O-CD2 3.31Å; K479-L493 WeakPolarHBondContact O-CD2 3.39Å
480	C	86.4	Confident	71.5	Confident	10 Å²	10	111.5 Å²	111.5	7%	0.068	55%	0.554	C	S	.	*			trans	-72.8	138.6	164	-178.4	0	0	0	0	109.7	Y482 C483 F485 L493 H496 M497 H500	C480-Y482 VanDerWaalsContact C-N 3.34Å; C480-Y482 PolarHBondContact SG-N 2.75Å; C480-C483 WeakPolarHBondContact CB-O 3.29Å; C480-C483 VanDerWaalsContact O-O 3.1Å; C480-F485 HydrophobicContact CB-CB 4.3Å; C480-F485 WeakPolarHBondContact CB-O 3.1Å; C480-F485 PolarHBondContact N-O 3.16Å; C480-L493 HydrophobicContact CB-CD1 3.93Å; C480-H496 PolarHBondContact SG-NE2 3.14Å; C480-H496 VanDerWaalsContact SG-NE2 3.42Å; C480-M497 HydrophobicContact CB-SD 4.43Å; C480-H500 PolarHBondContact SG-NE2 3.36Å
481	P	84.1	Confident	73.8	Confident	110 Å²	110	109.9 Å²	109.9	71%	0.714	55%	0.552	S	S	*	*	S	Bend	trans	-79.5	-14.4	172.5	25.1	-25.2	0	0	0	113.8
482	Y	80	Confident	75.9	Confident	165 Å²	165	103 Å²	103	65%	0.647	52%	0.523	S	S	*	.	S	Bend	trans	-105.1	-8.1	-176.7	-58.9	-94.2	0	0	0	114.1	C480 M497 H500	C480-Y482 VanDerWaalsContact C-N 3.34Å; C480-Y482 PolarHBondContact SG-N 2.75Å; Y482-M497 HydrophobicContact CD2-CE 3.3Å; Y482-M497 HydrophobicContact CD2-SD 4.49Å; Y482-M497 HydrophobicContact CE2-CE 3.58Å; Y482-M497 HydrophobicContact CG-CE 4.36Å; Y482-H500 HydrophobicContact CG-CB 4.47Å
483	C	87.4	Confident	77.9	Confident	49 Å²	49	99.8 Å²	99.8	33%	0.331	50%	0.502	S	S	.	.	S	Bend	trans	-160.6	173.6	173.8	71.7	0	0	0	0	112.2	C480 F485 H496	C480-C483 WeakPolarHBondContact CB-O 3.29Å; C480-C483 VanDerWaalsContact O-O 3.1Å; C483-F485 PolarHBondContact O-N 2.84Å; C483-F485 VanDerWaalsContact O-N 3.09Å; C483-F485 VanDerWaalsContact SG-CB 3.54Å; C483-H496 VanDerWaalsContact SG-CE1 3.55Å; C483-H496 PolarHBondContact SG-NE2 3.17Å
484	S	85.8	Confident	79.6	Confident	127 Å²	127	100 Å²	100	89%	0.888	49%	0.493	S	S	*	.	S	Bend	trans	-68.1	-1.4	-179.8	52.9	0	0	0	0	115.6
485	F	86.4	Confident	81.3	Confident	81 Å²	81	98 Å²	98	36%	0.355	48%	0.476	S	S	.	.			trans	-63.8	137	178.3	-174.7	-101.4	0	0	0	111.9	C480 C483 A487 I492 L493 H496	C480-F485 HydrophobicContact CB-CB 4.3Å; C480-F485 WeakPolarHBondContact CB-O 3.1Å; C480-F485 PolarHBondContact N-O 3.16Å; C483-F485 PolarHBondContact O-N 2.84Å; C483-F485 VanDerWaalsContact O-N 3.09Å; C483-F485 VanDerWaalsContact SG-CB 3.54Å; F485-A487 HydrophobicContact CE1-CB 3.99Å; F485-I492 HydrophobicContact CE1-CG2 4.35Å; F485-I492 HydrophobicContact CZ-CG2 4.16Å; F485-L493 HydrophobicContact CD1-CD1 4.5Å; F485-H496 HydrophobicContact CD1-CB 3.87Å; F485-H496 AromaticContact CD1-CD2 3.53Å; F485-H496 AromaticContact CD1-CE1 3.81Å; F485-H496 AromaticContact CD1-CG 3.36Å; F485-H496 AromaticContact CD1-ND1 3.55Å; F485-H496 AromaticContact CD1-NE2 3.8Å; F485-H496 HydrophobicContact CE1-CB 3.64Å; F485-H496 AromaticContact CE1-CG 3.65Å; F485-H496 AromaticContact CE1-ND1 3.96Å; F485-H496 AromaticContact CG-CE1 3.67Å; F485-H496 AromaticContact CG-CG 4Å; F485-H496 AromaticContact CG-ND1 3.71Å; F485-H496 AromaticContact CG-NE2 3.93Å; F485-H496 HydrophobicContact CZ-CB 4.44Å
486	S	84.6	Confident	82.7	Confident	51 Å²	51	92 Å²	92	36%	0.357	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.8	172.3	66.7	0	0	0	0	111.6	F478	F478-S486 CarbonylContact O-C 3.6Å; F478-S486 WeakPolarHBondContact O-CA 3.48Å
487	A	85.5	Confident	83.5	Confident	5 Å²	5	84.5 Å²	84.5	4%	0.041	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.5	-174.2	0	0	0	0	0	112	K477 F478 F485 H489 I492 L493	K477-A487 CarbonylContact C-O 3.21Å; F478-A487 PolarHBondContact N-O 2.86Å; F478-A487 PolarHBondContact O-N 3.08Å; F485-A487 HydrophobicContact CE1-CB 3.99Å; A487-H489 VanDerWaalsContact C-N 3.3Å; A487-I492 HydrophobicContact CB-CB 3.9Å; A487-I492 HydrophobicContact CB-CG2 3.75Å; A487-L493 HydrophobicContact CB-CB 4.17Å
488	M	81.4	Confident	83.8	Confident	108 Å²	108	81.1 Å²	81.1	53%	0.532	41%	0.407	S	S	.	.	S	Bend	trans	-74.3	-20.8	175.1	-172.8	169.7	172.8	0	0	113.1
489	H	81.4	Confident	83.7	Confident	95 Å²	95	80.9 Å²	80.9	44%	0.44	42%	0.416	S	S	.	.	S	Bend	trans	-130.6	139.8	-179.7	-62.9	-93.9	0	0	0	111.7	A487 C491 I492 L493	A487-H489 VanDerWaalsContact C-N 3.3Å; H489-C491 VanDerWaalsContact C-N 3.25Å; H489-C491 PolarHBondContact O-N 2.74Å; H489-I492 HydrophobicContact CB-CD1 4.2Å; H489-I492 HydrophobicContact CB-CG1 4.34Å; H489-I492 WeakPolarHBondContact O-CB 3.15Å; H489-I492 PolarHBondContact O-N 2.85Å; H489-L493 PolarHBondContact O-N 2.94Å
490	Q	82.6	Confident	83.5	Confident	107 Å²	107	76.4 Å²	76.4	50%	0.5	40%	0.397	S	S	.	.	H	α-helix	trans	-59.3	-33.1	-179.4	-163.2	-167.4	22.8	0	0	112.9	F478 I492 L493 K494	F478-Q490 HydrophobicContact CD1-CB 4.25Å; F478-Q490 HydrophobicContact CD1-CG 4.26Å; F478-Q490 HydrophobicContact CD2-CB 4.46Å; F478-Q490 HydrophobicContact CE1-CB 3.98Å; F478-Q490 HydrophobicContact CE1-CG 4.12Å; F478-Q490 HydrophobicContact CE2-CB 4.2Å; F478-Q490 HydrophobicContact CG-CB 4.49Å; F478-Q490 HydrophobicContact CZ-CB 3.95Å; Q490-I492 VanDerWaalsContact C-N 3.32Å; Q490-I492 PolarHBondContact O-N 2.96Å; Q490-L493 PolarHBondContact O-N 3.36Å; Q490-K494 WeakPolarHBondContact O-CG 3.24Å; Q490-K494 PolarHBondContact O-N 2.97Å
491	C	82.4	Confident	83.1	Confident	88 Å²	88	79.4 Å²	79.4	60%	0.595	42%	0.415	S	S	*	.	H	α-helix	trans	-64.4	-34.7	176.1	58.6	0	0	0	0	112.8	H489 R495	H489-C491 VanDerWaalsContact C-N 3.25Å; H489-C491 PolarHBondContact O-N 2.74Å; C491-R495 WeakPolarHBondContact O-CB 2.95Å; C491-R495 PolarHBondContact O-N 3.21Å
492	I	82.8	Confident	82.7	Confident	54 Å²	54	76.5 Å²	76.5	28%	0.277	41%	0.406	S	S	.	.	H	α-helix	trans	-71	-40.4	175.3	-62.3	172.1	0	0	0	109.7	F485 A487 H489 Q490 R495 H496	F485-I492 HydrophobicContact CE1-CG2 4.35Å; F485-I492 HydrophobicContact CZ-CG2 4.16Å; A487-I492 HydrophobicContact CB-CB 3.9Å; A487-I492 HydrophobicContact CB-CG2 3.75Å; H489-I492 HydrophobicContact CB-CD1 4.2Å; H489-I492 HydrophobicContact CB-CG1 4.34Å; H489-I492 WeakPolarHBondContact O-CB 3.15Å; H489-I492 PolarHBondContact O-N 2.85Å; Q490-I492 VanDerWaalsContact C-N 3.32Å; Q490-I492 PolarHBondContact O-N 2.96Å; I492-R495 PolarHBondContact O-N 2.72Å; I492-H496 WeakPolarHBondContact O-CB 3.49Å; I492-H496 PolarHBondContact O-N 2.79Å
493	L	85.8	Confident	82.6	Confident	23 Å²	23	73.2 Å²	73.2	12%	0.12	40%	0.396	C	S	.	.	H	α-helix	trans	-64.4	-47.9	173.2	-178.3	62.2	0	0	0	111.7	F478 K479 C480 F485 A487 H489 Q490 R495 H496 M497	F478-L493 HydrophobicContact CB-CB 4.1Å; F478-L493 HydrophobicContact CB-CD2 3.74Å; K479-L493 VanDerWaalsContact O-CD2 3.31Å; K479-L493 WeakPolarHBondContact O-CD2 3.39Å; C480-L493 HydrophobicContact CB-CD1 3.93Å; F485-L493 HydrophobicContact CD1-CD1 4.5Å; A487-L493 HydrophobicContact CB-CB 4.17Å; H489-L493 PolarHBondContact O-N 2.94Å; Q490-L493 PolarHBondContact O-N 3.36Å; L493-R495 VanDerWaalsContact C-N 3.26Å; L493-R495 PolarHBondContact O-N 3.34Å; L493-H496 CarbonylContact O-C 3.57Å; L493-H496 WeakPolarHBondContact O-CA 3.38Å; L493-H496 WeakPolarHBondContact O-CB 3.08Å; L493-H496 PolarHBondContact O-N 3.42Å; L493-M497 HydrophobicContact CD1-CG 4.4Å; L493-M497 HydrophobicContact CD1-SD 4.11Å; L493-M497 HydrophobicContact CG-CG 4.36Å; L493-M497 WeakPolarHBondContact O-CG 3.49Å; L493-M497 PolarHBondContact O-N 3.34Å
494	K	83.3	Confident	82.3	Confident	129 Å²	129	77.6 Å²	77.6	56%	0.561	41%	0.406	S	S	*	.	H	α-helix	trans	-56.4	-38.8	175.7	-75.7	-175.9	175.1	-173.9	0	112	Q490 M497	Q490-K494 WeakPolarHBondContact O-CG 3.24Å; Q490-K494 PolarHBondContact O-N 2.97Å; K494-M497 PolarHBondContact O-N 3.21Å
495	R	82.6	Confident	82.1	Confident	109 Å²	109	74.6 Å²	74.6	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-68.6	-35.9	174.1	-177	176.5	66.6	179.1	-1.5	112.9	C491 I492 L493	C491-R495 WeakPolarHBondContact O-CB 2.95Å; C491-R495 PolarHBondContact O-N 3.21Å; I492-R495 PolarHBondContact O-N 2.72Å; L493-R495 VanDerWaalsContact C-N 3.26Å; L493-R495 PolarHBondContact O-N 3.34Å
496	H	84.6	Confident	82	Confident	36 Å²	36	73.5 Å²	73.5	17%	0.167	38%	0.377	C	S	.	.	H	α-helix	trans	-69.4	-37.9	173.7	168.4	82.4	0	0	0	111.7	C480 C483 F485 I492 L493 R498 S499 H500	C480-H496 PolarHBondContact SG-NE2 3.14Å; C480-H496 VanDerWaalsContact SG-NE2 3.42Å; C483-H496 VanDerWaalsContact SG-CE1 3.55Å; C483-H496 PolarHBondContact SG-NE2 3.17Å; F485-H496 HydrophobicContact CD1-CB 3.87Å; F485-H496 AromaticContact CD1-CD2 3.53Å; F485-H496 AromaticContact CD1-CE1 3.81Å; F485-H496 AromaticContact CD1-CG 3.36Å; F485-H496 AromaticContact CD1-ND1 3.55Å; F485-H496 AromaticContact CD1-NE2 3.8Å; F485-H496 HydrophobicContact CE1-CB 3.64Å; F485-H496 AromaticContact CE1-CG 3.65Å; F485-H496 AromaticContact CE1-ND1 3.96Å; F485-H496 AromaticContact CG-CE1 3.67Å; F485-H496 AromaticContact CG-CG 4Å; F485-H496 AromaticContact CG-ND1 3.71Å; F485-H496 AromaticContact CG-NE2 3.93Å; F485-H496 HydrophobicContact CZ-CB 4.44Å; I492-H496 WeakPolarHBondContact O-CB 3.49Å; I492-H496 PolarHBondContact O-N 2.79Å; L493-H496 CarbonylContact O-C 3.57Å; L493-H496 WeakPolarHBondContact O-CA 3.38Å; L493-H496 WeakPolarHBondContact O-CB 3.08Å; L493-H496 PolarHBondContact O-N 3.42Å; H496-R498 PolarHBondContact O-N 3.06Å; H496-S499 PolarHBondContact O-N 2.96Å; H496-S499 PolarHBondContact O-OG 3.19Å; H496-H500 AromaticContact CD2-NE2 3.88Å; H496-H500 AromaticContact CE1-NE2 3.5Å; H496-H500 AromaticContact NE2-CD2 3.6Å; H496-H500 AromaticContact NE2-NE2 2.98Å; H496-H500 PolarHBondContact NE2-NE2 3.42Å
497	M	83.9	Confident	82	Confident	36 Å²	36	74 Å²	74	18%	0.177	38%	0.379	C	S	.	.	H	α-helix	trans	-57.2	-28.8	-178.7	-74	-41.3	-49.8	0	0	114.2	C480 Y482 L493 K494 S499 H500 T501	C480-M497 HydrophobicContact CB-SD 4.43Å; Y482-M497 HydrophobicContact CD2-CE 3.3Å; Y482-M497 HydrophobicContact CD2-SD 4.49Å; Y482-M497 HydrophobicContact CE2-CE 3.58Å; Y482-M497 HydrophobicContact CG-CE 4.36Å; L493-M497 HydrophobicContact CD1-CG 4.4Å; L493-M497 HydrophobicContact CD1-SD 4.11Å; L493-M497 HydrophobicContact CG-CG 4.36Å; L493-M497 WeakPolarHBondContact O-CG 3.49Å; L493-M497 PolarHBondContact O-N 3.34Å; K494-M497 PolarHBondContact O-N 3.21Å; M497-S499 PolarHBondContact O-N 3Å; M497-S499 VanDerWaalsContact O-N 3.17Å; M497-H500 HydrophobicContact CE-CB 3.99Å; M497-H500 PolarHBondContact O-N 3.17Å; M497-T501 PolarHBondContact O-N 3.04Å; M497-T501 PolarHBondContact O-OG1 3.18Å
498	R	83.3	Confident	82	Confident	65 Å²	65	73.7 Å²	73.7	25%	0.245	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.9	174.4	-59.8	-175.3	-174.9	145.2	3	115	H496 G502 E503	H496-R498 PolarHBondContact O-N 3.06Å; R498-G502 PolarHBondContact O-N 2.54Å; R498-E503 HydrophobicContact CB-CB 4.31Å; R498-E503 HydrophobicContact CG-CB 4.08Å
499	S	79.5	Confident	81.9	Confident	83 Å²	83	75.8 Å²	75.8	58%	0.58	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-19.5	167.7	68.1	0	0	0	0	113.1	H496 M497	H496-S499 PolarHBondContact O-N 2.96Å; H496-S499 PolarHBondContact O-OG 3.19Å; M497-S499 PolarHBondContact O-N 3Å; M497-S499 VanDerWaalsContact O-N 3.17Å
500	H	79.6	Confident	81.8	Confident	73 Å²	73	76.3 Å²	76.3	34%	0.338	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-41.7	177.3	-61.3	-77	0	0	0	111.7	C480 Y482 H496 M497 G502	C480-H500 PolarHBondContact SG-NE2 3.36Å; Y482-H500 HydrophobicContact CG-CB 4.47Å; H496-H500 AromaticContact CD2-NE2 3.88Å; H496-H500 AromaticContact CE1-NE2 3.5Å; H496-H500 AromaticContact NE2-CD2 3.6Å; H496-H500 AromaticContact NE2-NE2 2.98Å; H496-H500 PolarHBondContact NE2-NE2 3.42Å; M497-H500 HydrophobicContact CE-CB 3.99Å; M497-H500 PolarHBondContact O-N 3.17Å; H500-G502 VanDerWaalsContact C-N 3.28Å; H500-G502 PolarHBondContact O-N 3.4Å
501	T	77.4	Confident	81.7	Confident	73 Å²	73	73.5 Å²	73.5	45%	0.448	38%	0.382	S	S	.	.	S	Bend	trans	-80	-7.3	178	60.8	0	0	0	0	113.9	M497 E503	M497-T501 PolarHBondContact O-N 3.04Å; M497-T501 PolarHBondContact O-OG1 3.18Å; T501-E503 VanDerWaalsContact CB-OE1 3.25Å; T501-E503 WeakPolarHBondContact CB-OE1 3.49Å; T501-E503 PolarHBondContact O-N 3.19Å; T501-E503 WeakPolarHBondContact OG1-CG 3.34Å; T501-E503 PolarHBondContact OG1-OE1 3.13Å
502	G	77.5	Confident	81.5	Confident	49 Å²	49	71.5 Å²	71.5	51%	0.505	38%	0.376	S	S	.	.			trans	67	2.4	-176.8	0	0	0	0	0	114.9	R498 H500 R504	R498-G502 PolarHBondContact O-N 2.54Å; H500-G502 VanDerWaalsContact C-N 3.28Å; H500-G502 PolarHBondContact O-N 3.4Å; G502-R504 WeakPolarHBondContact O-CG 3.4Å; G502-R504 PolarHBondContact O-N 2.92Å
503	E	77.8	Confident	81.5	Confident	97 Å²	97	74.9 Å²	74.9	45%	0.453	39%	0.389	S	S	.	.			trans	-56.6	117.2	-176.7	-81.3	166.3	-120	0	0	112.8	R498 T501 P505	R498-E503 HydrophobicContact CB-CB 4.31Å; R498-E503 HydrophobicContact CG-CB 4.08Å; T501-E503 VanDerWaalsContact CB-OE1 3.25Å; T501-E503 WeakPolarHBondContact CB-OE1 3.49Å; T501-E503 PolarHBondContact O-N 3.19Å; T501-E503 WeakPolarHBondContact OG1-CG 3.34Å; T501-E503 PolarHBondContact OG1-OE1 3.13Å; E503-P505 VanDerWaalsContact O-CD 3.23Å; E503-P505 WeakPolarHBondContact O-CD 3.26Å
504	R	80.7	Confident	81.5	Confident	141 Å²	141	79.8 Å²	79.8	53%	0.532	41%	0.409	S	S	.	.			trans	-119.7	68.8	178.1	-69	162.3	81.4	145	3.9	110.2	G502 Y506 K514 F515 T516	G502-R504 WeakPolarHBondContact O-CG 3.4Å; G502-R504 PolarHBondContact O-N 2.92Å; R504-Y506 PolarHBondContact O-N 2.71Å; R504-Y506 VanDerWaalsContact O-N 3.08Å; R504-K514 HydrophobicContact CB-CB 3.59Å; R504-K514 VanDerWaalsContact CZ-O 3.26Å; R504-K514 PolarHBondContact NE-O 3.03Å; R504-K514 PolarHBondContact NH2-O 2.65Å; R504-F515 CarbonylContact C-O 3.5Å; R504-F515 VanDerWaalsContact CA-O 3.27Å; R504-F515 WeakPolarHBondContact CA-O 3.41Å; R504-T516 HydrophobicContact CG-CG2 3.68Å
505	P	81.8	Confident	81.6	Confident	64 Å²	64	75.7 Å²	75.7	42%	0.416	39%	0.391	S	S	.	.			trans	-76.2	8.8	-169.9	33.6	-38.7	0	0	0	114.6	E503	E503-P505 VanDerWaalsContact O-CD 3.23Å; E503-P505 WeakPolarHBondContact O-CD 3.26Å
506	Y	83.3	Confident	81.6	Confident	57 Å²	57	72.7 Å²	72.7	22%	0.224	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	84.8	176.4	-52.9	-70.2	0	0	0	109.4	R504 K514 F515 R518	R504-Y506 PolarHBondContact O-N 2.71Å; R504-Y506 VanDerWaalsContact O-N 3.08Å; Y506-K514 CarbonylContact O-C 3.59Å; Y506-F515 WeakPolarHBondContact CD2-O 3.4Å; Y506-F515 PolarHBondContact N-O 2.93Å; Y506-F515 PolarHBondContact O-N 3.13Å; Y506-R518 HydrophobicContact CD1-CB 3.98Å; Y506-R518 HydrophobicContact CD1-CG 4.46Å; Y506-R518 HydrophobicContact CD2-CB 4.44Å; Y506-R518 HydrophobicContact CE1-CB 3.89Å; Y506-R518 HydrophobicContact CE2-CB 4.33Å; Y506-R518 HydrophobicContact CG-CB 4.26Å
507	P	84.2	Confident	81.5	Confident	61 Å²	61	75.1 Å²	75.1	40%	0.396	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	156.9	164.7	30	-35	0	0	0	110.3	K514 M521	P507-K514 HydrophobicContact CB-CG 4.4Å; P507-M521 VanDerWaalsContact O-CG 3.27Å; P507-M521 WeakPolarHBondContact O-CG 3.37Å
508	C	85.6	Confident	81.4	Confident	0 Å²	0	81 Å²	81	0%	0	41%	0.413	C	S	.	.			trans	-99.1	119.8	163.2	174.3	0	0	0	0	107.4	I510 C511 G512 K513 F515 M521	C508-I510 PolarHBondContact O-N 3.41Å; C508-C511 PolarHBondContact O-N 3.29Å; C508-G512 WeakPolarHBondContact O-CA 3.2Å; C508-G512 PolarHBondContact O-N 2.96Å; C508-K513 PolarHBondContact N-O 2.89Å; C508-F515 HydrophobicContact CB-CE2 4.25Å; C508-M521 HydrophobicContact CB-CG 4.47Å
509	E	81.1	Confident	81.2	Confident	152 Å²	152	83.1 Å²	83.1	71%	0.71	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-36.9	-174.5	-61.6	89.6	-148.6	0	0	112.1	C511	E509-C511 VanDerWaalsContact C-N 3.32Å; E509-C511 PolarHBondContact O-N 2.93Å
510	I	77.7	Confident	81.3	Confident	105 Å²	105	83.2 Å²	83.2	54%	0.538	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-16.8	-173	-52.9	168	0	0	0	113.4	C508 H528	C508-I510 PolarHBondContact O-N 3.41Å; I510-H528 HydrophobicContact CB-CB 4.4Å; I510-H528 HydrophobicContact CD1-CB 3.79Å; I510-H528 HydrophobicContact CG2-CB 3.77Å
511	C	80.6	Confident	81.7	Confident	48 Å²	48	80.9 Å²	80.9	32%	0.324	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.6	11.2	-174.5	70.7	0	0	0	0	115.9	C508 E509 K513 H524 H528	C508-C511 PolarHBondContact O-N 3.29Å; E509-C511 VanDerWaalsContact C-N 3.32Å; E509-C511 PolarHBondContact O-N 2.93Å; C511-K513 PolarHBondContact O-N 3.19Å; C511-H524 PolarHBondContact SG-NE2 3.16Å; C511-H528 PolarHBondContact SG-NE2 3.28Å
512	G	79.8	Confident	81.8	Confident	46 Å²	46	83.8 Å²	83.8	47%	0.474	41%	0.413	S	S	.	.			trans	65.9	-10.3	-179.5	0	0	0	0	0	116.3	C508 K514	C508-G512 WeakPolarHBondContact O-CA 3.2Å; C508-G512 PolarHBondContact O-N 2.96Å; G512-K514 VanDerWaalsContact O-CG 3.31Å; G512-K514 WeakPolarHBondContact O-CG 3.45Å; G512-K514 PolarHBondContact O-N 3.39Å; G512-K514 VanDerWaalsContact O-N 3.14Å
513	K	81.9	Confident	81.7	Confident	125 Å²	125	87.2 Å²	87.2	54%	0.543	41%	0.411	S	S	.	.			trans	-61.8	117.1	-174	-71.6	176.5	-177.6	170.9	0	110.9	C508 C511 F515	C508-K513 PolarHBondContact N-O 2.89Å; C511-K513 PolarHBondContact O-N 3.19Å; K513-F515 HydrophobicContact CB-CE2 3.97Å; K513-F515 HydrophobicContact CB-CZ 4.24Å; K513-F515 WeakPolarHBondContact O-CD2 3.29Å; K513-F515 WeakPolarHBondContact O-CE2 3.49Å
514	K	85.4	Confident	81.8	Confident	126 Å²	126	84 Å²	84	55%	0.548	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	139.7	-175	-54.2	-171.2	-178.8	178.6	0	111.9	R504 Y506 P507 G512	R504-K514 HydrophobicContact CB-CB 3.59Å; R504-K514 VanDerWaalsContact CZ-O 3.26Å; R504-K514 PolarHBondContact NE-O 3.03Å; R504-K514 PolarHBondContact NH2-O 2.65Å; Y506-K514 CarbonylContact O-C 3.59Å; P507-K514 HydrophobicContact CB-CG 4.4Å; G512-K514 VanDerWaalsContact O-CG 3.31Å; G512-K514 WeakPolarHBondContact O-CG 3.45Å; G512-K514 PolarHBondContact O-N 3.39Å; G512-K514 VanDerWaalsContact O-N 3.14Å
515	F	84.6	Confident	81.5	Confident	43 Å²	43	78.8 Å²	78.8	19%	0.189	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.9	-178.7	-63.2	-88.7	0	0	0	113	R504 Y506 C508 K513 H520 M521 H524	R504-F515 CarbonylContact C-O 3.5Å; R504-F515 VanDerWaalsContact CA-O 3.27Å; R504-F515 WeakPolarHBondContact CA-O 3.41Å; Y506-F515 WeakPolarHBondContact CD2-O 3.4Å; Y506-F515 PolarHBondContact N-O 2.93Å; Y506-F515 PolarHBondContact O-N 3.13Å; C508-F515 HydrophobicContact CB-CE2 4.25Å; K513-F515 HydrophobicContact CB-CE2 3.97Å; K513-F515 HydrophobicContact CB-CZ 4.24Å; K513-F515 WeakPolarHBondContact O-CD2 3.29Å; K513-F515 WeakPolarHBondContact O-CE2 3.49Å; F515-H520 HydrophobicContact CB-CB 4.4Å; F515-H520 HydrophobicContact CD1-CB 3.9Å; F515-H520 HydrophobicContact CG-CB 4.38Å; F515-M521 HydrophobicContact CB-CB 4.19Å; F515-M521 HydrophobicContact CD2-CB 3.83Å; F515-M521 HydrophobicContact CD2-CG 4.36Å; F515-M521 HydrophobicContact CG-CB 4.2Å; F515-H524 HydrophobicContact CE1-CB 4.24Å; F515-H524 HydrophobicContact CE2-CB 3.79Å; F515-H524 AromaticContact CE2-CD2 3.52Å; F515-H524 AromaticContact CE2-CG 3.81Å; F515-H524 HydrophobicContact CZ-CB 3.5Å; F515-H524 VanDerWaalsContact CZ-CB 3.5Å; F515-H524 AromaticContact CZ-CD2 3.49Å; F515-H524 VanDerWaalsContact CZ-CD2 3.49Å; F515-H524 WeakPolarHBondContact CZ-CD2 3.31Å; F515-H524 AromaticContact CZ-CG 3.42Å; F515-H524 VanDerWaalsContact CZ-CG 3.42Å
516	T	83	Confident	81.1	Confident	47 Å²	47	80.8 Å²	80.8	29%	0.288	39%	0.386	S	S	.	.	S	Bend	trans	-79.4	-14.6	178.5	57.4	0	0	0	0	114	R504	R504-T516 HydrophobicContact CG-CG2 3.68Å
517	R	82.2	Confident	80.4	Confident	86 Å²	86	82.1 Å²	82.1	33%	0.325	40%	0.4	S	S	.	.	S	Bend	trans	-140.9	137.7	-179.8	-47.5	-178.6	-167.4	163.6	4.5	111.6	E519 H520 M521	R517-E519 VanDerWaalsContact C-N 3.26Å; R517-E519 PolarHBondContact O-N 3.24Å; R517-H520 PolarHBondContact NE-NE2 3.25Å; R517-H520 PolarHBondContact NH1-NE2 3.21Å; R517-H520 PolarHBondContact O-N 3.32Å; R517-M521 PolarHBondContact O-N 3.44Å
518	R	83.1	Confident	79.8	Confident	159 Å²	159	82.3 Å²	82.3	60%	0.6	40%	0.395	S	S	*	.	H	α-helix	trans	-55.5	-36.3	177.2	-174.4	180	-80.2	176.2	-7.9	113	Y506 H520 M521 K522	Y506-R518 HydrophobicContact CD1-CB 3.98Å; Y506-R518 HydrophobicContact CD1-CG 4.46Å; Y506-R518 HydrophobicContact CD2-CB 4.44Å; Y506-R518 HydrophobicContact CE1-CB 3.89Å; Y506-R518 HydrophobicContact CE2-CB 4.33Å; Y506-R518 HydrophobicContact CG-CB 4.26Å; R518-H520 VanDerWaalsContact C-N 3.33Å; R518-H520 PolarHBondContact O-N 3.31Å; R518-M521 PolarHBondContact O-N 3.14Å; R518-K522 PolarHBondContact O-N 2.97Å
519	E	79.6	Confident	78.8	Confident	111 Å²	111	85 Å²	85	52%	0.519	41%	0.414	S	S	.	.	H	α-helix	trans	-61.5	-36	176.1	-65.1	154.8	-130.4	0	0	113.5	R517 R523	R517-E519 VanDerWaalsContact C-N 3.26Å; R517-E519 PolarHBondContact O-N 3.24Å; E519-R523 WeakPolarHBondContact O-CB 3.22Å; E519-R523 PolarHBondContact O-N 3.4Å
520	H	79.8	Confident	77.6	Confident	84 Å²	84	87.4 Å²	87.4	39%	0.389	42%	0.423	S	S	.	.	H	α-helix	trans	-76.7	-36.7	178.8	-66.3	-50	0	0	0	111.2	F515 R517 R518 R523 H524	F515-H520 HydrophobicContact CB-CB 4.4Å; F515-H520 HydrophobicContact CD1-CB 3.9Å; F515-H520 HydrophobicContact CG-CB 4.38Å; R517-H520 PolarHBondContact NE-NE2 3.25Å; R517-H520 PolarHBondContact NH1-NE2 3.21Å; R517-H520 PolarHBondContact O-N 3.32Å; R518-H520 VanDerWaalsContact C-N 3.33Å; R518-H520 PolarHBondContact O-N 3.31Å; H520-R523 PolarHBondContact ND1-NH1 2.97Å; H520-R523 PolarHBondContact O-N 3.06Å; H520-H524 WeakPolarHBondContact O-CB 3.37Å; H520-H524 PolarHBondContact O-N 3.36Å
521	M	88.1	Confident	76.5	Confident	24 Å²	24	87.9 Å²	87.9	12%	0.118	43%	0.426	C	S	.	.	H	α-helix	trans	-62.2	-50.1	169.9	175.3	-81.3	-107.6	0	0	111.3	P507 C508 F515 R517 R518 R523 H524 T525	P507-M521 VanDerWaalsContact O-CG 3.27Å; P507-M521 WeakPolarHBondContact O-CG 3.37Å; C508-M521 HydrophobicContact CB-CG 4.47Å; F515-M521 HydrophobicContact CB-CB 4.19Å; F515-M521 HydrophobicContact CD2-CB 3.83Å; F515-M521 HydrophobicContact CD2-CG 4.36Å; F515-M521 HydrophobicContact CG-CB 4.2Å; R517-M521 PolarHBondContact O-N 3.44Å; R518-M521 PolarHBondContact O-N 3.14Å; M521-R523 VanDerWaalsContact C-N 3.28Å; M521-R523 PolarHBondContact O-N 2.89Å; M521-H524 CarbonylContact O-C 3.53Å; M521-H524 WeakPolarHBondContact O-CA 3.36Å; M521-H524 WeakPolarHBondContact O-CB 3.12Å; M521-H524 PolarHBondContact O-N 3.32Å; M521-T525 PolarHBondContact O-N 3.46Å; M521-T525 HydrophobicContact SD-CG2 3.93Å
522	K	79.9	Confident	75.3	Confident	135 Å²	135	92.8 Å²	92.8	59%	0.587	44%	0.442	S	S	*	.	H	α-helix	trans	-63.5	-29.9	177.8	-77.8	-156.3	169.7	-156.1	0	113.4	R518 H524 T525	R518-K522 PolarHBondContact O-N 2.97Å; K522-H524 VanDerWaalsContact C-N 3.34Å; K522-T525 PolarHBondContact O-OG1 3.24Å; K522-T525 VanDerWaalsContact O-OG1 3.1Å
523	R	75.4	Confident	74.6	Confident	121 Å²	121	95.8 Å²	95.8	46%	0.457	44%	0.442	S	S	.	.	H	α-helix	trans	-73.3	-28.3	169.4	-165.5	-179.1	-57.4	97	4.2	111.8	E519 H520 M521 M544	E519-R523 WeakPolarHBondContact O-CB 3.22Å; E519-R523 PolarHBondContact O-N 3.4Å; H520-R523 PolarHBondContact ND1-NH1 2.97Å; H520-R523 PolarHBondContact O-N 3.06Å; M521-R523 VanDerWaalsContact C-N 3.28Å; M521-R523 PolarHBondContact O-N 2.89Å; R523-M544 HydrophobicContact CG-SD 4.14Å; R523-M544 WeakPolarHBondContact O-CE 3.46Å
524	H	80.3	Confident	73.7	Confident	30 Å²	30	93.5 Å²	93.5	14%	0.139	43%	0.43	C	S	.	.	H	α-helix	trans	-80.5	-35.2	178.2	-174.4	51.8	0	0	0	113.7	C511 F515 H520 M521 K522 L526 V527 H528	C511-H524 PolarHBondContact SG-NE2 3.16Å; F515-H524 HydrophobicContact CE1-CB 4.24Å; F515-H524 HydrophobicContact CE2-CB 3.79Å; F515-H524 AromaticContact CE2-CD2 3.52Å; F515-H524 AromaticContact CE2-CG 3.81Å; F515-H524 HydrophobicContact CZ-CB 3.5Å; F515-H524 VanDerWaalsContact CZ-CB 3.5Å; F515-H524 AromaticContact CZ-CD2 3.49Å; F515-H524 VanDerWaalsContact CZ-CD2 3.49Å; F515-H524 WeakPolarHBondContact CZ-CD2 3.31Å; F515-H524 AromaticContact CZ-CG 3.42Å; F515-H524 VanDerWaalsContact CZ-CG 3.42Å; H520-H524 WeakPolarHBondContact O-CB 3.37Å; H520-H524 PolarHBondContact O-N 3.36Å; M521-H524 CarbonylContact O-C 3.53Å; M521-H524 WeakPolarHBondContact O-CA 3.36Å; M521-H524 WeakPolarHBondContact O-CB 3.12Å; M521-H524 PolarHBondContact O-N 3.32Å; K522-H524 VanDerWaalsContact C-N 3.34Å; H524-L526 PolarHBondContact O-N 2.95Å; H524-V527 WeakPolarHBondContact O-CB 3.4Å; H524-V527 WeakPolarHBondContact O-CG2 3.42Å; H524-V527 PolarHBondContact O-N 2.79Å; H524-H528 AromaticContact CD2-NE2 3.93Å; H524-H528 AromaticContact CE1-NE2 3.92Å; H524-H528 AromaticContact NE2-CE1 3.95Å; H524-H528 AromaticContact NE2-NE2 3.41Å; H524-H528 PolarHBondContact NE2-NE2 2.97Å
525	T	73.7	Confident	72.6	Confident	30 Å²	30	89.2 Å²	89.2	18%	0.184	42%	0.415	C	S	.	.	H	α-helix	trans	-58.4	-38.6	176.3	48.6	0	0	0	0	111.7	M521 K522 V527 H528 S529	M521-T525 PolarHBondContact O-N 3.46Å; M521-T525 HydrophobicContact SD-CG2 3.93Å; K522-T525 PolarHBondContact O-OG1 3.24Å; K522-T525 VanDerWaalsContact O-OG1 3.1Å; T525-V527 PolarHBondContact O-N 3.13Å; T525-H528 PolarHBondContact O-N 3.27Å; T525-S529 PolarHBondContact O-N 3.15Å
526	L	73.4	Confident	72	Confident	107 Å²	107	87.2 Å²	87.2	56%	0.56	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-7	172.5	-68.8	170.9	0	0	0	115	H524 M544	H524-L526 PolarHBondContact O-N 2.95Å; L526-M544 HydrophobicContact CB-CE 3.39Å; L526-M544 VanDerWaalsContact O-CE 3.27Å; L526-M544 WeakPolarHBondContact O-CE 3.38Å
527	V	68.8	Low	71.4	Confident	84 Å²	84	92.5 Å²	92.5	51%	0.509	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-28.6	171.5	-179.1	0	0	0	0	110.9	H524 T525 M544	H524-V527 WeakPolarHBondContact O-CB 3.4Å; H524-V527 WeakPolarHBondContact O-CG2 3.42Å; H524-V527 PolarHBondContact O-N 2.79Å; T525-V527 PolarHBondContact O-N 3.13Å; V527-M544 HydrophobicContact CB-CE 4.33Å; V527-M544 HydrophobicContact CG2-CE 3.53Å; V527-M544 HydrophobicContact CG2-SD 3.52Å; V527-M544 VanDerWaalsContact CG2-SD 3.52Å
528	H	72.7	Confident	70.6	Confident	65 Å²	65	92.1 Å²	92.1	30%	0.301	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-29.9	179.8	-52.1	-66.3	0	0	0	111.9	I510 C511 H524 T525 K530	I510-H528 HydrophobicContact CB-CB 4.4Å; I510-H528 HydrophobicContact CD1-CB 3.79Å; I510-H528 HydrophobicContact CG2-CB 3.77Å; C511-H528 PolarHBondContact SG-NE2 3.28Å; H524-H528 AromaticContact CD2-NE2 3.93Å; H524-H528 AromaticContact CE1-NE2 3.92Å; H524-H528 AromaticContact NE2-CE1 3.95Å; H524-H528 AromaticContact NE2-NE2 3.41Å; H524-H528 PolarHBondContact NE2-NE2 2.97Å; T525-H528 PolarHBondContact O-N 3.27Å; H528-K530 PolarHBondContact O-N 3.41Å
529	S	62.8	Low	70	Confident	57 Å²	57	86.6 Å²	86.6	40%	0.399	42%	0.417	S	S	.	.	S	Bend	trans	-56.1	121	166	-52.5	0	0	0	0	109.6	T525 D531	T525-S529 PolarHBondContact O-N 3.15Å; S529-D531 PolarHBondContact O-N 3.27Å
530	K	56.6	Low	69.2	Low	203 Å²	203	85.9 Å²	85.9	88%	0.883	43%	0.425	S	S	*	.	S	Bend	trans	-65.8	1.9	-175.7	-70	178.3	179.3	172.3	0	114.6	H528 K532	H528-K530 PolarHBondContact O-N 3.41Å; K530-K532 PolarHBondContact O-N 2.9Å
531	D	55.7	Low	68.2	Low	114 Å²	114	88.7 Å²	88.7	61%	0.61	43%	0.432	S	S	*	.			trans	-76.1	56.9	-173.6	-129.6	-42.9	0	0	0	113.7	S529 K533	S529-D531 PolarHBondContact O-N 3.27Å; D531-K533 PolarHBondContact O-N 3.18Å; D531-K533 VanDerWaalsContact O-N 3.09Å; D531-K533 WeakPolarHBondContact OD1-CE 3.38Å; D531-K533 IonicContact OD1-NZ 2.61Å; D531-K533 PolarHBondContact OD1-NZ 3.5Å; D531-K533 IonicContact OD2-NZ 3.98Å
532	K	54.1	Low	67	Low	151 Å²	151	91 Å²	91	66%	0.657	45%	0.447	S	S	*	.			trans	-62.2	107.5	-178.7	-60.9	177.1	-175.7	172.8	0	111.4	K530 V542	K530-K532 PolarHBondContact O-N 2.9Å; K532-V542 HydrophobicContact CB-CG1 4.12Å; K532-V542 HydrophobicContact CD-CG2 4.21Å; K532-V542 HydrophobicContact CG-CG1 4.09Å
533	K	66.4	Low	66.3	Low	109 Å²	109	86.6 Å²	86.6	47%	0.474	43%	0.428	S	S	.	.			trans	-128.5	124.5	169.9	-72.6	154.5	-175.4	157	0	108.2	D531	D531-K533 PolarHBondContact O-N 3.18Å; D531-K533 VanDerWaalsContact O-N 3.09Å; D531-K533 WeakPolarHBondContact OD1-CE 3.38Å; D531-K533 IonicContact OD1-NZ 2.61Å; D531-K533 PolarHBondContact OD1-NZ 3.5Å; D531-K533 IonicContact OD2-NZ 3.98Å
534	Y	62.6	Low	65.6	Low	78 Å²	78	84.7 Å²	84.7	31%	0.306	43%	0.425	S	S	.	.			trans	85.6	99.4	-169.8	-43.5	-61.3	0	0	0	116	F543 A546 I551 R557	Y534-F543 PolarHBondContact O-N 3.41Å; Y534-A546 HydrophobicContact CD1-CB 4.32Å; Y534-A546 HydrophobicContact CD2-CB 4.47Å; Y534-A546 HydrophobicContact CE1-CB 3.93Å; Y534-A546 HydrophobicContact CE2-CB 4.11Å; Y534-I551 HydrophobicContact CD1-CD1 3.54Å; Y534-I551 HydrophobicContact CE1-CD1 4.19Å; Y534-I551 HydrophobicContact CG-CD1 4.38Å; Y534-R557 VanDerWaalsContact CA-O 3.3Å; Y534-R557 WeakPolarHBondContact CA-O 3.41Å
535	V	62.3	Low	64.7	Low	36 Å²	36	85.9 Å²	85.9	22%	0.218	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.4	171	-174.6	0	0	0	0	110	S540 V542 R557 H558 G559	V535-S540 WeakPolarHBondContact CG1-O 3.48Å; V535-V542 HydrophobicContact CG2-CG2 4.26Å; V535-R557 PolarHBondContact N-O 3.26Å; V535-H558 WeakPolarHBondContact O-CA 3.48Å; V535-G559 PolarHBondContact O-N 2.98Å
536	C	72.4	Confident	64.1	Low	1 Å²	1	85.8 Å²	85.8	1%	0.007	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.7	173.1	178.9	0	0	0	0	111.1	V538 C539 S540 R541 F543 V549 G559 C561	C536-V538 VanDerWaalsContact C-N 3.26Å; C536-V538 PolarHBondContact O-N 2.84Å; C536-V538 PolarHBondContact SG-N 3.27Å; C536-C539 PolarHBondContact SG-SG 2.91Å; C536-S540 VanDerWaalsContact O-CA 3.31Å; C536-S540 WeakPolarHBondContact O-CA 3.4Å; C536-S540 PolarHBondContact O-N 3.42Å; C536-R541 PolarHBondContact N-O 3.2Å; C536-F543 HydrophobicContact CB-CD2 4.28Å; C536-F543 HydrophobicContact CB-CE2 3.71Å; C536-V549 HydrophobicContact CB-CG1 4.38Å; C536-G559 WeakPolarHBondContact CA-O 3.44Å; C536-C561 HydrophobicContact CB-CB 4.26Å; C536-C561 PolarHBondContact SG-N 3.45Å; C536-C561 VanDerWaalsContact SG-SG 3.68Å
537	K	68.8	Low	63.4	Low	157 Å²	157	85.1 Å²	85.1	68%	0.683	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-20.7	179.7	-67.2	-167.3	176.7	-169.5	0	114.8	H558 G559	K537-H558 HydrophobicContact CD-CB 4.31Å; K537-H558 VanDerWaalsContact CE-CB 3.49Å; K537-H558 HydrophobicContact CG-CB 3.89Å; K537-G559 PolarHBondContact N-O 3.42Å
538	V	66.4	Low	63	Low	79 Å²	79	83.2 Å²	83.2	48%	0.479	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-27	-171.1	-179.1	0	0	0	0	112.6	C536 V560 C564	C536-V538 VanDerWaalsContact C-N 3.26Å; C536-V538 PolarHBondContact O-N 2.84Å; C536-V538 PolarHBondContact SG-N 3.27Å; V538-V560 HydrophobicContact CG2-CG1 3.9Å; V538-V560 HydrophobicContact CG2-CG2 4.08Å; V538-C564 HydrophobicContact CB-CB 3.89Å; V538-C564 HydrophobicContact CG1-CB 3.91Å; V538-C564 HydrophobicContact CG2-CB 4.46Å
539	C	70.8	Confident	62.4	Low	43 Å²	43	80.1 Å²	80.1	29%	0.291	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.2	9.3	-177.5	66.5	0	0	0	0	114.3	C536 R541 C561 C564	C536-C539 PolarHBondContact SG-SG 2.91Å; C539-R541 PolarHBondContact O-N 3.04Å; C539-C561 VanDerWaalsContact SG-SG 3.69Å; C539-C564 VanDerWaalsContact SG-SG 3.64Å
540	S	62	Low	62.2	Low	96 Å²	96	80 Å²	80	67%	0.671	43%	0.432	S	S	*	.			trans	54.7	2.9	177.9	-57.1	0	0	0	0	116.9	V535 C536 V542	V535-S540 WeakPolarHBondContact CG1-O 3.48Å; C536-S540 VanDerWaalsContact O-CA 3.31Å; C536-S540 WeakPolarHBondContact O-CA 3.4Å; C536-S540 PolarHBondContact O-N 3.42Å; S540-V542 PolarHBondContact O-N 2.93Å
541	R	59.8	Low	62.2	Low	143 Å²	143	71.8 Å²	71.8	54%	0.54	40%	0.398	S	S	.	.			trans	-61.2	132.8	175.9	-69.3	178.5	-176.5	174.2	-1.7	110.1	C536 C539 F543 D563	C536-R541 PolarHBondContact N-O 3.2Å; C539-R541 PolarHBondContact O-N 3.04Å; R541-F543 HydrophobicContact CB-CD2 4.3Å; R541-F543 HydrophobicContact CB-CE2 3.52Å; R541-F543 HydrophobicContact CB-CZ 3.94Å; R541-F543 WeakPolarHBondContact O-CD2 3.5Å; R541-F543 WeakPolarHBondContact O-CE2 3.45Å; R541-D563 IonicContact NH1-OD2 3.26Å; R541-D563 PolarHBondContact NH1-OD2 3.04Å
542	V	62.2	Low	61.8	Low	73 Å²	73	75.3 Å²	75.3	44%	0.442	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-82.6	136.2	171.5	-172.1	0	0	0	0	108.6	K532 V535 S540	K532-V542 HydrophobicContact CB-CG1 4.12Å; K532-V542 HydrophobicContact CD-CG2 4.21Å; K532-V542 HydrophobicContact CG-CG1 4.09Å; V535-V542 HydrophobicContact CG2-CG2 4.26Å; S540-V542 PolarHBondContact O-N 2.93Å
543	F	64.9	Low	61	Low	41 Å²	41	78.1 Å²	78.1	18%	0.18	42%	0.423	C	S	.	.			trans	-125	169	177.6	-68.2	-93.6	0	0	0	109.8	Y534 C536 R541 V549 C561	Y534-F543 PolarHBondContact O-N 3.41Å; C536-F543 HydrophobicContact CB-CD2 4.28Å; C536-F543 HydrophobicContact CB-CE2 3.71Å; R541-F543 HydrophobicContact CB-CD2 4.3Å; R541-F543 HydrophobicContact CB-CE2 3.52Å; R541-F543 HydrophobicContact CB-CZ 3.94Å; R541-F543 WeakPolarHBondContact O-CD2 3.5Å; R541-F543 WeakPolarHBondContact O-CE2 3.45Å; F543-V549 HydrophobicContact CB-CG2 3.33Å; F543-V549 HydrophobicContact CD1-CG2 4.33Å; F543-V549 HydrophobicContact CD2-CG2 3.7Å; F543-V549 HydrophobicContact CG-CG2 3.54Å; F543-C561 HydrophobicContact CE1-CB 4.05Å; F543-C561 HydrophobicContact CE2-CB 3.67Å; F543-C561 HydrophobicContact CZ-CB 3.35Å
544	M	61.4	Low	60.1	Low	82 Å²	82	77 Å²	77	40%	0.404	44%	0.443	S	S	.	.	S	Bend	trans	-116.3	-2.5	-168.4	-43.2	-173.4	80.4	0	0	113.2	R523 L526 V527	R523-M544 HydrophobicContact CG-SD 4.14Å; R523-M544 WeakPolarHBondContact O-CE 3.46Å; L526-M544 HydrophobicContact CB-CE 3.39Å; L526-M544 VanDerWaalsContact O-CE 3.27Å; L526-M544 WeakPolarHBondContact O-CE 3.38Å; V527-M544 HydrophobicContact CB-CE 4.33Å; V527-M544 HydrophobicContact CG2-CE 3.53Å; V527-M544 HydrophobicContact CG2-SD 3.52Å; V527-M544 VanDerWaalsContact CG2-SD 3.52Å
545	S	61.1	Low	59.3	Low	55 Å²	55	77.8 Å²	77.8	39%	0.385	46%	0.459	S	S	.	.			trans	-152.8	138.9	179	70.1	0	0	0	0	111	A547 S548	S545-A547 PolarHBondContact O-N 3.3Å; S545-A547 VanDerWaalsContact O-N 3.15Å; S545-S548 PolarHBondContact O-N 3.05Å; S545-S548 PolarHBondContact O-OG 3.18Å; S545-S548 PolarHBondContact OG-OG 3.1Å
546	A	60.4	Low	58.9	Low	28 Å²	28	86.6 Å²	86.6	23%	0.231	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-53.4	-35.8	177.7	0	0	0	0	0	112.7	Y534 S548 V549 G550 I551	Y534-A546 HydrophobicContact CD1-CB 4.32Å; Y534-A546 HydrophobicContact CD2-CB 4.47Å; Y534-A546 HydrophobicContact CE1-CB 3.93Å; Y534-A546 HydrophobicContact CE2-CB 4.11Å; A546-S548 VanDerWaalsContact C-N 3.31Å; A546-S548 PolarHBondContact O-N 3.39Å; A546-V549 CarbonylContact O-C 3.6Å; A546-V549 PolarHBondContact O-N 3.47Å; A546-V549 VanDerWaalsContact O-N 3.08Å; A546-G550 PolarHBondContact O-N 3.34Å; A546-I551 HydrophobicContact CB-CB 4.18Å; A546-I551 PolarHBondContact O-N 3.43Å; A546-I551 VanDerWaalsContact O-N 3.14Å
547	A	60.1	Low	58.2	Low	93 Å²	93	94.5 Å²	94.5	77%	0.769	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-59.5	-35.9	177.7	0	0	0	0	0	113.4	S545 V549	S545-A547 PolarHBondContact O-N 3.3Å; S545-A547 VanDerWaalsContact O-N 3.15Å; A547-V549 VanDerWaalsContact C-N 3.29Å; A547-V549 PolarHBondContact O-N 3.46Å
548	S	60.2	Low	57.6	Low	44 Å²	44	91.9 Å²	91.9	31%	0.308	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-76.1	-15.2	177	62.5	0	0	0	0	114.1	S545 A546	S545-S548 PolarHBondContact O-N 3.05Å; S545-S548 PolarHBondContact O-OG 3.18Å; S545-S548 PolarHBondContact OG-OG 3.1Å; A546-S548 VanDerWaalsContact C-N 3.31Å; A546-S548 PolarHBondContact O-N 3.39Å
549	V	59.9	Low	57.6	Low	0 Å²	0	88.7 Å²	88.7	0%	0	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-108.8	16.4	179.8	-155.3	0	0	0	0	111.9	C536 F543 A546 A547 I551 V560	C536-V549 HydrophobicContact CB-CG1 4.38Å; F543-V549 HydrophobicContact CB-CG2 3.33Å; F543-V549 HydrophobicContact CD1-CG2 4.33Å; F543-V549 HydrophobicContact CD2-CG2 3.7Å; F543-V549 HydrophobicContact CG-CG2 3.54Å; A546-V549 CarbonylContact O-C 3.6Å; A546-V549 PolarHBondContact O-N 3.47Å; A546-V549 VanDerWaalsContact O-N 3.08Å; A547-V549 VanDerWaalsContact C-N 3.29Å; A547-V549 PolarHBondContact O-N 3.46Å; V549-I551 HydrophobicContact CB-CD1 4.05Å; V549-I551 HydrophobicContact CB-CG1 4.11Å; V549-I551 HydrophobicContact CG1-CD1 4.32Å; V549-I551 HydrophobicContact CG1-CG1 4.45Å; V549-I551 WeakPolarHBondContact O-CG1 3.37Å; V549-I551 PolarHBondContact O-N 3.08Å; V549-V560 CarbonylContact C-O 3.23Å; V549-V560 VanDerWaalsContact C-O 3.23Å; V549-V560 CarbonylContact O-C 3.57Å; V549-V560 PolarHBondContact O-N 3.44Å
550	G	58.7	Low	57.4	Low	53 Å²	53	89 Å²	89	55%	0.546	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	11.6	177.5	0	0	0	0	0	115.1	A546 K552	A546-G550 PolarHBondContact O-N 3.34Å; G550-K552 PolarHBondContact O-N 3.31Å
551	I	55.4	Low	57.8	Low	31 Å²	31	84.4 Å²	84.4	16%	0.159	46%	0.46	C	S	.	.			trans	-75.4	102	-172	-60.1	170.7	0	0	0	108.9	Y534 A546 V549	Y534-I551 HydrophobicContact CD1-CD1 3.54Å; Y534-I551 HydrophobicContact CE1-CD1 4.19Å; Y534-I551 HydrophobicContact CG-CD1 4.38Å; A546-I551 HydrophobicContact CB-CB 4.18Å; A546-I551 PolarHBondContact O-N 3.43Å; A546-I551 VanDerWaalsContact O-N 3.14Å; V549-I551 HydrophobicContact CB-CD1 4.05Å; V549-I551 HydrophobicContact CB-CG1 4.11Å; V549-I551 HydrophobicContact CG1-CD1 4.32Å; V549-I551 HydrophobicContact CG1-CG1 4.45Å; V549-I551 WeakPolarHBondContact O-CG1 3.37Å; V549-I551 PolarHBondContact O-N 3.08Å
552	K	48.1	Very low	58.1	Low	189 Å²	189	80.9 Å²	80.9	82%	0.822	46%	0.461	S	S	*	.			trans	-63.4	148.1	164	-65.9	-178.2	179.5	178.4	0	109.4	G550 G554	G550-K552 PolarHBondContact O-N 3.31Å; K552-G554 PolarHBondContact O-N 3.33Å
553	H	36.8	Very low	58	Low	209 Å²	209	81.2 Å²	81.2	97%	0.968	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	127.8	-177	-106.1	-108.9	0	0	0	112.5
554	G	47.3	Very low	58.1	Low	86 Å²	86	80.3 Å²	80.3	89%	0.887	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.3	-0.5	164.6	0	0	0	0	0	118.6	K552	K552-G554 PolarHBondContact O-N 3.33Å
555	S	46.4	Very low	58.3	Low	94 Å²	94	80.1 Å²	80.1	66%	0.657	47%	0.466	S	S	*	.			trans	-124.7	151.5	-178	-161.1	0	0	0	0	116	R557	S555-R557 PolarHBondContact O-N 3.44Å
556	R	54.6	Low	58.1	Low	222 Å²	222	81 Å²	81	84%	0.838	48%	0.483	S	S	*	.			trans	-74.9	104.6	-159.9	-62.6	179.4	179.4	-172	-1	114.6	H558	R556-H558 PolarHBondContact O-N 3.08Å; R556-H558 PolarHBondContact O-ND1 3.24Å
557	R	56	Low	57.9	Low	166 Å²	166	88.5 Å²	88.5	63%	0.626	51%	0.506	S	S	*	.	S	Bend	trans	49.7	-1.1	158.6	-70	-160.7	-82.1	-104.5	11.2	119.4	Y534 V535 S555	Y534-R557 VanDerWaalsContact CA-O 3.3Å; Y534-R557 WeakPolarHBondContact CA-O 3.41Å; V535-R557 PolarHBondContact N-O 3.26Å; S555-R557 PolarHBondContact O-N 3.44Å
558	H	57	Low	57.2	Low	102 Å²	102	87.2 Å²	87.2	47%	0.472	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	123.5	-172.9	-56.8	100.7	0	0	0	110.3	V535 K537 R556	V535-H558 WeakPolarHBondContact O-CA 3.48Å; K537-H558 HydrophobicContact CD-CB 4.31Å; K537-H558 VanDerWaalsContact CE-CB 3.49Å; K537-H558 HydrophobicContact CG-CB 3.89Å; R556-H558 PolarHBondContact O-N 3.08Å; R556-H558 PolarHBondContact O-ND1 3.24Å
559	G	66.4	Low	56.7	Low	12 Å²	12	94 Å²	94	12%	0.124	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	-156.8	-178.7	0	0	0	0	0	112.3	V535 C536 K537	V535-G559 PolarHBondContact O-N 2.98Å; C536-G559 WeakPolarHBondContact CA-O 3.44Å; K537-G559 PolarHBondContact N-O 3.42Å
560	V	66.8	Low	55.9	Low	50 Å²	50	98.5 Å²	98.5	30%	0.303	57%	0.568	S	S	.	*			trans	-126.5	121	173.9	-173.8	0	0	0	0	107.8	V538 V549 C564 S565	V538-V560 HydrophobicContact CG2-CG1 3.9Å; V538-V560 HydrophobicContact CG2-CG2 4.08Å; V549-V560 CarbonylContact C-O 3.23Å; V549-V560 VanDerWaalsContact C-O 3.23Å; V549-V560 CarbonylContact O-C 3.57Å; V549-V560 PolarHBondContact O-N 3.44Å; V560-C564 HydrophobicContact CG1-CB 3.54Å; V560-S565 PolarHBondContact O-OG 3.47Å
561	C	70.4	Confident	55	Low	0 Å²	0	100.5 Å²	100.5	0%	0	58%	0.579	C	S	.	*			trans	-65.7	163.2	178.9	67.3	0	0	0	0	112	C536 C539 F543 D563 C564 S565	C536-C561 HydrophobicContact CB-CB 4.26Å; C536-C561 PolarHBondContact SG-N 3.45Å; C536-C561 VanDerWaalsContact SG-SG 3.68Å; C539-C561 VanDerWaalsContact SG-SG 3.69Å; F543-C561 HydrophobicContact CE1-CB 4.05Å; F543-C561 HydrophobicContact CE2-CB 3.67Å; F543-C561 HydrophobicContact CZ-CB 3.35Å; C561-D563 VanDerWaalsContact C-N 3.28Å; C561-D563 PolarHBondContact O-N 3.1Å; C561-C564 PolarHBondContact O-N 2.75Å; C561-C564 VanDerWaalsContact O-N 3.12Å; C561-C564 VanDerWaalsContact SG-SG 3.66Å; C561-S565 WeakPolarHBondContact O-CB 2.92Å; C561-S565 PolarHBondContact O-N 3.45Å; C561-S565 PolarHBondContact O-OG 3.15Å
562	A	66.1	Low	54.3	Low	69 Å²	69	107 Å²	107	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-53.6	-45.5	179.5	0	0	0	0	0	112.1	C564 S565 G566	A562-C564 PolarHBondContact O-N 3.1Å; A562-C564 VanDerWaalsContact O-N 3.14Å; A562-S565 PolarHBondContact O-N 3.47Å; A562-G566 PolarHBondContact O-N 3.24Å
563	D	60.6	Low	54.3	Low	79 Å²	79	105.6 Å²	105.6	42%	0.422	61%	0.614	S	S	.	*	H	α-helix	trans	-56	-31	179.6	-40.2	-17.2	0	0	0	114.1	R541 C561 R567	R541-D563 IonicContact NH1-OD2 3.26Å; R541-D563 PolarHBondContact NH1-OD2 3.04Å; C561-D563 VanDerWaalsContact C-N 3.28Å; C561-D563 PolarHBondContact O-N 3.1Å; D563-R567 WeakPolarHBondContact O-CD 3.24Å; D563-R567 WeakPolarHBondContact O-CG 3.37Å; D563-R567 PolarHBondContact O-NE 3.24Å; D563-R567 VanDerWaalsContact O-NE 3.1Å
564	C	66.4	Low	54.3	Low	22 Å²	22	103 Å²	103	15%	0.149	61%	0.607	C	S	.	*	H	α-helix	trans	-99	-20.5	179	-65.8	0	0	0	0	112.4	V538 C539 V560 C561 A562	V538-C564 HydrophobicContact CB-CB 3.89Å; V538-C564 HydrophobicContact CG1-CB 3.91Å; V538-C564 HydrophobicContact CG2-CB 4.46Å; C539-C564 VanDerWaalsContact SG-SG 3.64Å; V560-C564 HydrophobicContact CG1-CB 3.54Å; C561-C564 PolarHBondContact O-N 2.75Å; C561-C564 VanDerWaalsContact O-N 3.12Å; C561-C564 VanDerWaalsContact SG-SG 3.66Å; A562-C564 PolarHBondContact O-N 3.1Å; A562-C564 VanDerWaalsContact O-N 3.14Å
565	S	66.4	Low	53.8	Low	78 Å²	78	108 Å²	108	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-75.2	-28.2	173.4	-56.9	0	0	0	0	111.9	V560 C561 A562	V560-S565 PolarHBondContact O-OG 3.47Å; C561-S565 WeakPolarHBondContact O-CB 2.92Å; C561-S565 PolarHBondContact O-N 3.45Å; C561-S565 PolarHBondContact O-OG 3.15Å; A562-S565 PolarHBondContact O-N 3.47Å
566	G	56.8	Low	53.2	Low	73 Å²	73	111.5 Å²	111.5	75%	0.753	62%	0.619	S	S	*	*	S	Bend	trans	-83.6	-3.3	174.4	0	0	0	0	0	115	A562	A562-G566 PolarHBondContact O-N 3.24Å
567	R	56.5	Low	52	Low	187 Å²	187	104.4 Å²	104.4	71%	0.706	61%	0.614	S	S	*	*	S	Bend	trans	-113.3	119.4	175.2	-62.1	175.9	-158	-107.5	-2.7	107.9	D563	D563-R567 WeakPolarHBondContact O-CD 3.24Å; D563-R567 WeakPolarHBondContact O-CG 3.37Å; D563-R567 PolarHBondContact O-NE 3.24Å; D563-R567 VanDerWaalsContact O-NE 3.1Å
568	G	45.5	Very low	51	Low	66 Å²	66	105 Å²	105	68%	0.68	62%	0.624	S	S	*	*			trans	-59.4	152.5	177.8	0	0	0	0	0	111.9	A570	G568-A570 PolarHBondContact O-N 3.16Å
569	M	49.1	Very low	49.8	Very low	186 Å²	186	107.2 Å²	107.2	92%	0.916	65%	0.645	S	S	*	*	S	Bend	trans	-72.2	63.1	175.7	-67.6	-97	-69.3	0	0	111
570	A	42.6	Very low	48	Very low	94 Å²	94	110.9 Å²	110.9	78%	0.777	68%	0.683	S	S	*	*			trans	-155.6	48	-170.5	0	0	0	0	0	112	G568	G568-A570 PolarHBondContact O-N 3.16Å
571	A	40.9	Very low	46.1	Very low	95 Å²	95	112.2 Å²	112.2	79%	0.785	71%	0.707	S	S	*	*	S	Bend	trans	-160.6	45.3	176.7	0	0	0	0	0	113.1
572	L	40.6	Very low	44.2	Very low	168 Å²	168	119.8 Å²	119.8	88%	0.88	75%	0.747	S	S	*	*	S	Bend	trans	-158.2	35.9	169.1	-126.5	172	0	0	0	113.6
573	L	47	Very low	42.3	Very low	160 Å²	160	124.4 Å²	124.4	84%	0.838	76%	0.761	S	S	*	*			trans	-122.4	168.9	157.4	-69.5	174.8	0	0	0	106.9
574	D	37	Very low	40.8	Very low	153 Å²	153	125.9 Å²	125.9	82%	0.818	78%	0.777	S	S	*	*			trans	71.5	68.3	-179.8	-50.7	-22.4	0	0	0	115.5
575	H	36.4	Very low	39.8	Very low	193 Å²	193	129.6 Å²	129.6	89%	0.894	80%	0.801	S	S	*	*			trans	-149.7	55.5	139	-119.3	-66.8	0	0	0	113
576	N	35.1	Very low	38	Very low	167 Å²	167	133.4 Å²	133.4	89%	0.893	81%	0.81	S	S	*	*			trans	-88.7	117	158.6	-93.4	39.8	0	0	0	108.9
577	G	28.7	Very low	36.8	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	81%	0.808	S	S	*	*			trans	-135.2	115.1	164.9	0	0	0	0	0	107.3
578	E	34.8	Very low	35.6	Very low	179 Å²	179	135.6 Å²	135.6	84%	0.836	81%	0.808	S	S	*	*			trans	-84.8	136.1	-164	-59.2	164.9	116.7	0	0	112.3
579	T	31.6	Very low	34.5	Very low	149 Å²	149	139 Å²	139	91%	0.914	81%	0.811	S	S	*	*			trans	-164	105.5	142.4	-2.6	0	0	0	0	113.1
580	G	29	Very low	33.5	Very low	89 Å²	89	140.3 Å²	140.3	92%	0.918	81%	0.807	S	S	*	*			trans	60.1	127.2	142.7	0	0	0	0	0	121.1
581	G	27.4	Very low	33.3	Very low	78 Å²	78	141.6 Å²	141.6	80%	0.804	81%	0.807	S	S	*	*			trans	148.8	85.3	161.5	0	0	0	0	0	113.9
582	D	28.8	Very low	32.6	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	81%	0.805	S	S	*	*			trans	-66.6	149.5	165.3	-61	-79.5	0	0	0	111.2
583	I	27.5	Very low	31.9	Very low	167 Å²	167	138.9 Å²	138.9	86%	0.856	80%	0.797	S	S	*	*			trans	165.7	106.9	137.2	-82.8	152.9	0	0	0	108.7
584	S	28.5	Very low	30.8	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	80%	0.796	S	S	*	*			trans	-104.4	172.7	143.2	-79.7	0	0	0	0	106
585	P	45.7	Very low	30.2	Very low	100 Å²	100	143 Å²	143	65%	0.649	80%	0.795	S	S	*	*			cis	-147.9	-149.4	30.5	30.2	-1.2	0	0	0	114.6
586	E	28.4	Very low	29.7	Very low	158 Å²	158	143 Å²	143	74%	0.738	80%	0.796	S	S	*	*			trans	80.6	134.5	157.3	-64.4	160.8	-133.1	0	0	117.8
587	E	32.4	Very low	29.3	Very low	153 Å²	153	141.6 Å²	141.6	72%	0.715	79%	0.788	S	S	*	*			cis	-161.2	155.6	-11.5	-126	-174.8	-178.3	0	0	113.6
588	E	29.9	Very low	29.2	Very low	153 Å²	153	144.8 Å²	144.8	72%	0.715	79%	0.788	S	S	*	*			trans	48.7	169	153.2	-48	-141.1	114.8	0	0	121.2
589	L	23.9	Very low	28.8	Very low	139 Å²	139	144.4 Å²	144.4	73%	0.728	79%	0.786	S	S	*	*			cis	-148.3	149.8	8.4	-172.1	57.3	0	0	0	112.5
590	Y	27.4	Very low	28.6	Very low	213 Å²	213	141.7 Å²	141.7	84%	0.835	78%	0.779	S	S	*	*			trans	-107.9	149.2	166.9	-111.9	-81.1	0	0	0	108.6
591	P	37.9	Very low	28.5	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	78%	0.777	S	S	*	*				-161.3	156.8	90.7	39.7	-19.5	0	0	0	119.3
592	G	26.6	Very low	28.6	Very low	71 Å²	71	148 Å²	148	73%	0.732	77%	0.774	S	S	*	*			trans	76.2	163.3	141.9	0	0	0	0	0	120.4
593	D	25.1	Very low	28.4	Very low	135 Å²	135	148.3 Å²	148.3	72%	0.722	78%	0.776	S	S	*	*			cis	-160.6	163.8	-15.3	-167.4	20	0	0	0	111.5
594	R	24.2	Very low	28.3	Very low	217 Å²	217	143.3 Å²	143.3	82%	0.819	77%	0.766	S	S	*	*			trans	79.7	151.9	160	-79.5	162.1	-164.8	-151.1	-7.1	123.4
595	F	25.4	Very low	28.1	Very low	182 Å²	182	146.2 Å²	146.2	80%	0.798	77%	0.773	S	S	*	*			trans	-94	162.6	-177.8	-70.3	-124.3	0	0	0	111.9
596	H	24.8	Very low	27.3	Very low	194 Å²	194	144.8 Å²	144.8	90%	0.898	78%	0.776	S	S	*	*				-164.6	174.4	107.2	-101.5	78.9	0	0	0	112.4
597	D	27.6	Very low	27.4	Very low	136 Å²	136	146.4 Å²	146.4	73%	0.727	78%	0.784	S	S	*	*			trans	-100.5	-179.8	-167.9	-106.4	-66.6	0	0	0	113.9
598	D	25.7	Very low	27.2	Very low	140 Å²	140	148.4 Å²	148.4	75%	0.749	79%	0.793	S	S	*	*			trans	65.3	169	163.8	-67.4	-45.7	0	0	0	118.2
599	Q	26.3	Very low	27.2	Very low	170 Å²	170	150 Å²	150	79%	0.794	80%	0.8	S	S	*	*			cis	-163.7	144.3	-46	173.6	164.4	61.9	0	0	108.6
600	A	29.1	Very low	27.4	Very low	92 Å²	92	151.5 Å²	151.5	76%	0.76	81%	0.806	S	S	*	*			trans	67.2	169.1	177.5	0	0	0	0	0	113
601	E	26.1	Very low	27.7	Very low	190 Å²	190	149.7 Å²	149.7	89%	0.888	81%	0.807	S	S	*	*			cis	-129	-163.8	26.9	-70.8	-175	124.2	0	0	114.6
602	C	29	Very low	27.4	Very low	109 Å²	109	150.4 Å²	150.4	74%	0.736	81%	0.809	S	S	*	*			trans	-88.3	-165.6	-177	-74	0	0	0	0	112.2
603	D	24.8	Very low	27.9	Very low	165 Å²	165	156 Å²	156	88%	0.882	82%	0.816	S	S	*	*			trans	72.6	148.2	165.5	-43.2	-37	0	0	0	114.8
604	G	26	Very low	28.2	Very low	63 Å²	63	152.1 Å²	152.1	65%	0.649	81%	0.808	S	S	*	*			cis	-152.8	-176.6	-1.2	0	0	0	0	0	113.4
605	D	24.3	Very low	28.6	Very low	170 Å²	170	149.7 Å²	149.7	91%	0.909	81%	0.811	S	S	*	*			trans	-56	179.6	155.2	54.5	-59.7	0	0	0	113.1
606	G	28.6	Very low	28.9	Very low	70 Å²	70	144.5 Å²	144.5	72%	0.722	81%	0.809	S	S	*	*			trans	128.4	77.3	179.8	0	0	0	0	0	113.2
607	E	29.7	Very low	29.3	Very low	192 Å²	192	144 Å²	144	90%	0.897	81%	0.807	S	S	*	*			trans	-88.6	101.9	160.4	58.8	-163.8	148.5	0	0	109.1
608	E	29	Very low	29.5	Very low	194 Å²	194	144.8 Å²	144.8	91%	0.907	81%	0.81	S	S	*	*			trans	-98.2	107	170.8	-71	-163.1	147.3	0	0	110.5	M610	E608-M610 PolarHBondContact O-N 3.33Å
609	E	30.8	Very low	29.8	Very low	186 Å²	186	145.9 Å²	145.9	87%	0.869	82%	0.815	S	S	*	*			trans	-78.5	95.1	168.6	-68.8	-162.8	143.7	0	0	109.9	M611	E609-M611 PolarHBondContact O-N 3.37Å; E609-M611 VanDerWaalsContact O-N 3.08Å
610	M	28	Very low	30	Very low	171 Å²	171	140.8 Å²	140.8	84%	0.842	81%	0.808	S	S	*	*			trans	-59.5	110.8	162.8	169.7	174.8	-87.7	0	0	109.1	E608	E608-M610 PolarHBondContact O-N 3.33Å
611	M	31.8	Very low	30	Very low	176 Å²	176	145.8 Å²	145.8	87%	0.867	82%	0.816	S	S	*	*			trans	-63.4	141.9	168.2	-67.5	-167.4	-178	0	0	110.1	E609	E609-M611 PolarHBondContact O-N 3.37Å; E609-M611 VanDerWaalsContact O-N 3.08Å
612	V	33.4	Very low	30.2	Very low	135 Å²	135	140.1 Å²	140.1	82%	0.818	81%	0.808	S	S	*	*			trans	-108.4	109.1	169.9	175	0	0	0	0	107.4
613	E	36.3	Very low	30.3	Very low	190 Å²	190	144 Å²	144	89%	0.888	82%	0.816	S	S	*	*			trans	-86.3	146.9	160.7	-68.5	-169.3	137.9	0	0	110.1
614	G	31.8	Very low	30.7	Very low	53 Å²	53	145.5 Å²	145.5	55%	0.546	82%	0.817	S	S	.	*			trans	-139.1	129.9	165	0	0	0	0	0	109.3
615	D	31.5	Very low	31.1	Very low	166 Å²	166	151.4 Å²	151.4	89%	0.888	83%	0.828	S	S	*	*				45	119.2	128.8	70.8	-37.3	0	0	0	118.6
616	G	32.2	Very low	31.3	Very low	73 Å²	73	147.4 Å²	147.4	75%	0.753	82%	0.819	S	S	*	*				115	139.7	54	0	0	0	0	0	106.6
617	E	32.7	Very low	31.3	Very low	183 Å²	183	148 Å²	148	86%	0.855	82%	0.824	S	S	*	*			cis	-150	146.4	24.3	-58.6	174.6	127.6	0	0	112.1
618	I	32.9	Very low	31.1	Very low	152 Å²	152	147.8 Å²	147.8	78%	0.779	82%	0.821	S	S	*	*				42.9	119.4	125.4	-53.6	172.3	0	0	0	121.6
619	L	31.9	Very low	31	Very low	163 Å²	163	149.2 Å²	149.2	85%	0.853	82%	0.818	S	S	*	*				-154.8	147.7	122	-94.7	168.5	0	0	0	106.2
620	G	29.8	Very low	30.9	Very low	64 Å²	64	147.5 Å²	147.5	66%	0.66	81%	0.807	S	S	*	*				71.9	119	72.1	0	0	0	0	0	110.2
621	E	29.8	Very low	30.7	Very low	197 Å²	197	145.4 Å²	145.4	92%	0.921	80%	0.8	S	S	*	*			cis	-147	147.6	10.6	-65.3	161.6	-174.6	0	0	107.4
622	G	29.1	Very low	30.6	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	79%	0.794	S	S	*	*				124.9	147.2	90.3	0	0	0	0	0	111.9
623	E	31.2	Very low	30.2	Very low	191 Å²	191	139 Å²	139	89%	0.893	79%	0.789	S	S	*	*			trans	17.4	143.5	150.5	-46.2	-177.1	155.2	0	0	120.3
624	E	34.9	Very low	29.8	Very low	195 Å²	195	138.9 Å²	138.9	91%	0.911	79%	0.791	S	S	*	*			cis	-140.9	-163	28.7	-73.9	-169.5	127	0	0	114.2
625	E	32.7	Very low	29.6	Very low	187 Å²	187	141.1 Å²	141.1	87%	0.874	80%	0.804	S	S	*	*			trans	-109.1	-175.3	-161	-145	-143.2	-157.6	0	0	116.2
626	A	28.7	Very low	29.5	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	80%	0.795	S	S	*	*			trans	81.3	86.3	149	0	0	0	0	0	121.5
627	G	28.9	Very low	29.2	Very low	81 Å²	81	143.1 Å²	143.1	84%	0.835	80%	0.803	S	S	*	*				117	156	127	0	0	0	0	0	118.3
628	K	26.6	Very low	28.9	Very low	189 Å²	189	137.8 Å²	137.8	82%	0.822	79%	0.79	S	S	*	*			cis	-162	127.2	-3.7	178.5	171.1	177.2	-179.4	0	111
629	W	26.6	Very low	28.7	Very low	223 Å²	223	139.1 Å²	139.1	85%	0.845	79%	0.793	S	S	*	*			trans	26	136.1	143.7	-64.9	30.9	0	0	0	118.6
630	K	27.6	Very low	28.5	Very low	151 Å²	151	142.2 Å²	142.2	66%	0.657	79%	0.793	S	S	*	*			cis	-174.3	-177.7	15.4	-133.5	178.8	174.1	-111.2	0	111.4
631	D	25.2	Very low	28.5	Very low	127 Å²	127	143 Å²	143	68%	0.679	79%	0.794	S	S	*	*			trans	21.4	139.4	144.7	-81.5	-43.2	0	0	0	119.7
632	S	28.1	Very low	28.6	Very low	107 Å²	107	141 Å²	141	75%	0.748	79%	0.788	S	S	*	*			cis	-159.1	168.1	8.9	49	0	0	0	0	108.6
633	G	26	Very low	28.6	Very low	69 Å²	69	143.7 Å²	143.7	71%	0.711	79%	0.786	S	S	*	*				65.2	138.6	83.5	0	0	0	0	0	113.7
634	M	28	Very low	28.6	Very low	188 Å²	188	140.5 Å²	140.5	93%	0.926	78%	0.775	S	S	*	*			cis	-174.4	153.8	-2.1	-152.7	167	-179.8	0	0	108.8
635	A	27.6	Very low	28.5	Very low	99 Å²	99	138.6 Å²	138.6	82%	0.818	77%	0.766	S	S	*	*			trans	62.8	146.2	174.9	0	0	0	0	0	116.5
636	A	28.2	Very low	28.5	Very low	85 Å²	85	138.2 Å²	138.2	70%	0.702	76%	0.761	S	S	*	*			cis	112.9	148.8	14.5	0	0	0	0	0	113.4
637	E	25.9	Very low	28.9	Very low	197 Å²	197	142.7 Å²	142.7	92%	0.921	77%	0.767	S	S	*	*			trans	65.6	155.7	-179.6	-61.3	176.7	95.5	0	0	117.2
638	A	26.8	Very low	29.1	Very low	70 Å²	70	146.5 Å²	146.5	58%	0.579	76%	0.763	S	S	*	*			cis	166.7	144.2	-46.7	0	0	0	0	0	109
639	H	29.6	Very low	29.4	Very low	181 Å²	181	142 Å²	142	84%	0.838	76%	0.756	S	S	*	*			trans	63.4	161.9	-179	-43.6	-80.7	0	0	0	114.4
640	R	27.3	Very low	29.4	Very low	227 Å²	227	138.1 Å²	138.1	86%	0.857	75%	0.752	S	S	*	*			cis	-124.6	144.6	-1.6	-91.5	-178.4	155.8	76.2	-2.3	107.6
641	A	29.9	Very low	29.5	Very low	82 Å²	82	135.2 Å²	135.2	68%	0.678	75%	0.75	S	S	*	*				83.7	135.3	53.3	0	0	0	0	0	114.6
642	L	31.1	Very low	29.7	Very low	154 Å²	154	134.4 Å²	134.4	81%	0.806	76%	0.755	S	S	*	*			trans	74.7	149.8	172.4	-54.2	178.2	0	0	0	115.7
643	D	29.9	Very low	29.8	Very low	127 Å²	127	133.9 Å²	133.9	68%	0.679	76%	0.757	S	S	*	*			cis	-152	167.8	5.8	-128.5	-29.1	0	0	0	114
644	N	31.8	Very low	29.9	Very low	124 Å²	124	138.4 Å²	138.4	66%	0.663	76%	0.76	S	S	*	*			trans	7.4	156.1	146.9	-100.3	34	0	0	0	121.7
645	E	32.9	Very low	29.9	Very low	156 Å²	156	137.6 Å²	137.6	73%	0.729	75%	0.754	S	S	*	*			cis	176.3	171.5	-15.6	-120	-172.1	159.4	0	0	106.9
646	K	32.9	Very low	29.8	Very low	178 Å²	178	136.2 Å²	136.2	77%	0.774	75%	0.749	S	S	*	*			trans	70.9	107.3	157.5	-138.7	162.8	-174	165.5	0	117
647	E	36.3	Very low	29.8	Very low	181 Å²	181	140 Å²	140	85%	0.846	75%	0.752	S	S	*	*				63.3	122	73	-62	-116.1	130.8	0	0	115.3
648	E	32	Very low	30	Very low	161 Å²	161	137.3 Å²	137.3	75%	0.752	74%	0.74	S	S	*	*			trans	167.5	121	135.5	-90.3	-83.7	169.6	0	0	110.1
649	S	33.6	Very low	30.1	Very low	96 Å²	96	141 Å²	141	67%	0.671	75%	0.745	S	S	*	*			trans	57.9	146.6	136.3	-55.5	0	0	0	0	121
650	D	26.7	Very low	29.9	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	75%	0.745	S	S	*	*			cis	-160.1	168.3	2.4	-147.5	-41.9	0	0	0	111.9
651	S	30	Very low	29.8	Very low	90 Å²	90	131.8 Å²	131.8	63%	0.629	73%	0.733	S	S	*	*			trans	68.6	112.6	140.5	-75.7	0	0	0	0	123.9
652	S	29.3	Very low	29.8	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	74%	0.742	S	S	*	*				78.1	104.2	122.1	74.8	0	0	0	0	122.8
653	A	30.6	Very low	29.8	Very low	97 Å²	97	136 Å²	136	80%	0.802	75%	0.748	S	S	*	*				91.8	135	108	0	0	0	0	0	123.1
654	Q	27.9	Very low	30	Very low	163 Å²	163	139.2 Å²	139.2	76%	0.762	76%	0.756	S	S	*	*			trans	99.8	102.5	139	-155.9	160.2	3.3	0	0	120.4
655	E	27.7	Very low	29.9	Very low	172 Å²	172	140.3 Å²	140.3	80%	0.804	76%	0.762	S	S	*	*			trans	46.3	134.5	136.8	-59.6	168.3	158.7	0	0	122
656	G	25.7	Very low	29.7	Very low	70 Å²	70	141.7 Å²	141.7	72%	0.722	77%	0.766	S	S	*	*			trans	146.7	104.3	147.2	0	0	0	0	0	117.3
657	E	28.3	Very low	29.6	Very low	163 Å²	163	136.7 Å²	136.7	76%	0.762	76%	0.758	S	S	*	*			trans	60.8	124.9	143.4	-50.4	-155.6	88.4	0	0	120.2
658	Q	29	Very low	29.3	Very low	142 Å²	142	140 Å²	140	66%	0.664	76%	0.762	S	S	*	*				57.2	133.5	101.7	-54	-171.3	69.1	0	0	114.9
659	Q	29	Very low	29.4	Very low	146 Å²	146	139.9 Å²	139.9	68%	0.682	77%	0.766	S	S	*	*			cis	-165.9	164.7	24.2	-133.6	167.6	62.2	0	0	110.6
660	N	25.8	Very low	29.7	Very low	157 Å²	157	144.3 Å²	144.3	84%	0.84	80%	0.796	S	S	*	*			trans	65.1	152.5	172.8	-60	-31	0	0	0	117.3
661	G	25.9	Very low	29.8	Very low	59 Å²	59	144.5 Å²	144.5	61%	0.608	80%	0.799	S	S	*	*			cis	172.2	163	-8.2	0	0	0	0	0	113.2
662	S	29.4	Very low	29.8	Very low	125 Å²	125	147.4 Å²	147.4	87%	0.874	81%	0.808	S	S	*	*			trans	45.6	108.3	167.7	59.7	0	0	0	0	118.8
663	E	31	Very low	29.9	Very low	199 Å²	199	149.4 Å²	149.4	93%	0.93	81%	0.81	S	S	*	*			trans	-140.4	122.8	152.7	-137.6	166.9	-165.1	0	0	111.9
664	K	33.8	Very low	29.8	Very low	194 Å²	194	152.5 Å²	152.5	84%	0.843	81%	0.81	S	S	*	*			trans	-134.7	127.3	156.1	-74.4	-179	178	179.6	0	104.1
665	D	30.3	Very low	29.9	Very low	147 Å²	147	151.9 Å²	151.9	79%	0.786	81%	0.813	S	S	*	*				-174.4	173.5	128.1	-95.8	-15.5	0	0	0	113.5
666	F	28.6	Very low	30.1	Very low	185 Å²	185	150.5 Å²	150.5	81%	0.811	81%	0.814	S	S	*	*			trans	-69.4	132.4	-156.6	-75.9	-106.4	0	0	0	118.1
667	A	30.1	Very low	30.4	Very low	73 Å²	73	156.3 Å²	156.3	60%	0.603	82%	0.82	S	S	*	*				48.2	131.4	113.9	0	0	0	0	0	123.7
668	W	30.4	Very low	30.6	Very low	250 Å²	250	155.8 Å²	155.8	95%	0.947	83%	0.825	S	S	*	*			trans	84	162.6	133.2	-81.2	-23.3	0	0	0	122.6
669	I	34.3	Very low	30.7	Very low	160 Å²	160	156.9 Å²	156.9	82%	0.821	84%	0.838	S	S	*	*			trans	80.3	120.9	170.9	-50.1	-173.4	0	0	0	113.9
670	S	40	Very low	30.9	Very low	188 Å²	188	157.9 Å²	157.9	100%	1.315	85%	0.853	S	S	*	*			cis	-125.7	0	-1.2	-75.1	0	0	0	0	111.5

Retrieved 670 of 670 residues in 329.3 ms (Link to these results)

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