A0A087YN86_POEFO Loading...

PR domain containing 13

AlphaFold DB , UniProt , Accession A0A087YN86, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 586 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	L	42.2	Very low	52	Low	151 Å²	151	84.1 Å²	84.1	79%	0.791	42%	0.415	S	S	*	.				0	130.4	0	-70.4	168.8	0	0	0	107.9	R54	L1-R54 HydrophobicContact CB-CG 4.49Å
2	P	48.2	Very low	51.9	Low	89 Å²	89	79.6 Å²	79.6	58%	0.578	41%	0.406	S	S	*	.			trans	-69.1	145.3	174.7	29.7	-33.8	0	0	0	111	V55	P2-V55 HydrophobicContact CG-CG2 4.4Å
3	L	52.8	Low	51.6	Low	99 Å²	99	84.3 Å²	84.3	52%	0.518	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132	162.3	-66.4	169	0	0	0	107.3	F52 R54	L3-F52 HydrophobicContact CD1-CD1 4.11Å; L3-F52 HydrophobicContact CD1-CE1 4.5Å; L3-F52 HydrophobicContact CD2-CB 4.27Å; L3-F52 HydrophobicContact CD2-CD1 4.28Å; L3-R54 HydrophobicContact CD2-CB 4.48Å
4	L	58.6	Low	52.1	Low	82 Å²	82	81.3 Å²	81.3	43%	0.429	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-38.8	176.3	-84.6	171.8	0	0	0	112.2	L40 Y53 V55	L4-L40 HydrophobicContact CD1-CD1 4.22Å; L4-L40 HydrophobicContact CD1-CD2 3.49Å; L4-L40 VanDerWaalsContact CD1-CD2 3.49Å; L4-Y53 PolarHBondContact N-O 3.45Å; L4-V55 HydrophobicContact CD1-CG2 3.69Å; L4-V55 HydrophobicContact CG-CG2 3.69Å
5	A	58.9	Low	52.6	Low	18 Å²	18	77.1 Å²	77.1	15%	0.149	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	157.1	177.3	0	0	0	0	0	111.6	I7 W25 Y53	A5-I7 HydrophobicContact CB-CD1 3.55Å; A5-I7 HydrophobicContact CB-CG1 4.48Å; A5-W25 HydrophobicContact CB-CH2 3.73Å; A5-W25 HydrophobicContact CB-CZ2 3.74Å; A5-Y53 PolarHBondContact O-N 3.13Å; A5-Y53 VanDerWaalsContact O-N 3.14Å
6	Q	56.2	Low	53.3	Low	52 Å²	52	74.9 Å²	74.9	24%	0.243	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	115.9	177.2	174.1	177.1	-18.9	0	0	108.5	E17 F52	Q6-E17 HydrophobicContact CB-CG 4.19Å; Q6-E17 VanDerWaalsContact CD-CD 3.43Å; Q6-E17 HydrophobicContact CG-CG 3.89Å; Q6-E17 VanDerWaalsContact NE2-CD 3.29Å; Q6-E17 PolarHBondContact NE2-OE1 2.93Å; Q6-F52 HydrophobicContact CB-CD1 3.94Å; Q6-F52 HydrophobicContact CB-CE1 3.93Å; Q6-F52 HydrophobicContact CG-CD1 3.83Å; Q6-F52 HydrophobicContact CG-CE1 3.37Å; Q6-F52 HydrophobicContact CG-CZ 3.76Å
7	I	59.1	Low	53.5	Low	1 Å²	1	76.7 Å²	76.7	1%	0.005	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.3	-169.2	-62.3	104.1	0	0	0	109.7	A5 F14 V15 V22 I26 Q50 I51 Y53	A5-I7 HydrophobicContact CB-CD1 3.55Å; A5-I7 HydrophobicContact CB-CG1 4.48Å; I7-F14 HydrophobicContact CG2-CB 3.82Å; I7-F14 HydrophobicContact CG2-CD1 3.79Å; I7-F14 HydrophobicContact CG2-CG 4.29Å; I7-V15 CarbonylContact C-O 3.58Å; I7-V22 HydrophobicContact CB-CG2 4.3Å; I7-V22 HydrophobicContact CG1-CG2 3.75Å; I7-V22 HydrophobicContact CG2-CG2 3.57Å; I7-I26 HydrophobicContact CD1-CD1 3.47Å; I7-I26 VanDerWaalsContact CD1-CD1 3.47Å; I7-I26 HydrophobicContact CG1-CD1 3.79Å; I7-Q50 CarbonylContact O-C 3.55Å; I7-Q50 VanDerWaalsContact O-CA 3.28Å; I7-Q50 WeakPolarHBondContact O-CA 2.94Å; I7-I51 PolarHBondContact N-O 2.83Å; I7-I51 PolarHBondContact O-N 2.86Å; I7-Y53 HydrophobicContact CD1-CD2 3.6Å; I7-Y53 HydrophobicContact CD1-CE2 3.71Å
8	R	53	Low	53.7	Low	92 Å²	92	77.5 Å²	77.5	35%	0.347	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.8	175.2	-49.5	-165.4	-178.3	171.1	6.8	109.3	V10 V15 E17 Q50	R8-V10 HydrophobicContact CB-CG2 3.99Å; R8-V10 PolarHBondContact O-N 2.92Å; R8-V15 PolarHBondContact N-O 3.46Å; R8-V15 PolarHBondContact O-N 3.48Å; R8-E17 IonicContact NH2-OE1 3.13Å; R8-E17 PolarHBondContact NH2-OE1 3.25Å; R8-Q50 HydrophobicContact CG-CB 4.3Å; R8-Q50 HydrophobicContact CG-CG 3.87Å
9	L	49.4	Very low	53.8	Low	44 Å²	44	76.4 Å²	76.4	23%	0.23	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	75.2	176.5	-172.9	69.5	0	0	0	110.2	R11 E13 F14 E49 Y77	L9-R11 PolarHBondContact O-N 3.46Å; L9-E13 CarbonylContact C-O 3.54Å; L9-F14 HydrophobicContact CD1-CD1 3.83Å; L9-F14 HydrophobicContact CD1-CD2 4.45Å; L9-F14 HydrophobicContact CD1-CE1 3.8Å; L9-F14 HydrophobicContact CD1-CE2 4.41Å; L9-F14 HydrophobicContact CD1-CG 4.17Å; L9-F14 HydrophobicContact CD1-CZ 4.1Å; L9-E49 PolarHBondContact N-O 3.17Å; L9-Y77 WeakPolarHBondContact CD2-OH 3.3Å
10	V	48.6	Very low	54	Low	67 Å²	67	75.9 Å²	75.9	41%	0.406	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	111.2	-176.8	-175.6	0	0	0	0	109.6	R8 G12 E13 V15	R8-V10 HydrophobicContact CB-CG2 3.99Å; R8-V10 PolarHBondContact O-N 2.92Å; V10-G12 PolarHBondContact O-N 2.91Å; V10-E13 PolarHBondContact N-O 3.46Å; V10-E13 PolarHBondContact O-N 3.22Å; V10-E13 VanDerWaalsContact O-N 3.08Å; V10-V15 HydrophobicContact CB-CG2 4.03Å; V10-V15 HydrophobicContact CG2-CB 4.22Å; V10-V15 HydrophobicContact CG2-CG2 4.29Å
11	R	45.6	Very low	54.2	Low	230 Å²	230	77.4 Å²	77.4	87%	0.868	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	18.4	176.7	-60.4	176.1	174.8	161.3	0.2	115.3	L9	L9-R11 PolarHBondContact O-N 3.46Å
12	G	49.9	Very low	55.1	Low	30 Å²	30	71.5 Å²	71.5	31%	0.309	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	5.5	-179.3	0	0	0	0	0	115	V10	V10-G12 PolarHBondContact O-N 2.91Å
13	E	48.5	Very low	55.6	Low	141 Å²	141	69.6 Å²	69.6	66%	0.659	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	144.2	162.4	-69.3	176.1	166.2	0	0	108.9	L9 V10 V15	L9-E13 CarbonylContact C-O 3.54Å; V10-E13 PolarHBondContact N-O 3.46Å; V10-E13 PolarHBondContact O-N 3.22Å; V10-E13 VanDerWaalsContact O-N 3.08Å; E13-V15 HydrophobicContact CB-CG2 4.4Å
14	F	58.1	Low	55.9	Low	42 Å²	42	71.4 Å²	71.4	18%	0.184	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	126.7	173.4	-70.6	-76.1	0	0	0	108.7	I7 L9 V22 I51	I7-F14 HydrophobicContact CG2-CB 3.82Å; I7-F14 HydrophobicContact CG2-CD1 3.79Å; I7-F14 HydrophobicContact CG2-CG 4.29Å; L9-F14 HydrophobicContact CD1-CD1 3.83Å; L9-F14 HydrophobicContact CD1-CD2 4.45Å; L9-F14 HydrophobicContact CD1-CE1 3.8Å; L9-F14 HydrophobicContact CD1-CE2 4.41Å; L9-F14 HydrophobicContact CD1-CG 4.17Å; L9-F14 HydrophobicContact CD1-CZ 4.1Å; F14-V22 HydrophobicContact CB-CB 3.92Å; F14-V22 HydrophobicContact CB-CG1 4.41Å; F14-V22 HydrophobicContact CB-CG2 3.82Å; F14-V22 WeakPolarHBondContact O-CB 3.46Å; F14-V22 PolarHBondContact O-N 3.27Å; F14-I51 HydrophobicContact CE1-CD1 4.33Å
15	V	59.6	Low	56.1	Low	18 Å²	18	72.3 Å²	72.3	11%	0.109	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.9	-169.8	-179.1	0	0	0	0	109.4	I7 R8 V10 E13 G19 C20	I7-V15 CarbonylContact C-O 3.58Å; R8-V15 PolarHBondContact N-O 3.46Å; R8-V15 PolarHBondContact O-N 3.48Å; V10-V15 HydrophobicContact CB-CG2 4.03Å; V10-V15 HydrophobicContact CG2-CB 4.22Å; V10-V15 HydrophobicContact CG2-CG2 4.29Å; E13-V15 HydrophobicContact CB-CG2 4.4Å; V15-G19 VanDerWaalsContact CG1-CA 3.46Å; V15-C20 CarbonylContact C-O 3.54Å; V15-C20 VanDerWaalsContact CA-O 3.31Å; V15-C20 WeakPolarHBondContact CA-O 3.2Å; V15-C20 VanDerWaalsContact CG1-O 3.3Å; V15-C20 WeakPolarHBondContact CG1-O 3.31Å
16	D	63.4	Low	56.3	Low	42 Å²	42	71.7 Å²	71.7	23%	0.225	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	166.4	176.4	-81.1	-11.2	0	0	0	111.3	S18 G19 C20 V22 P23	D16-S18 PolarHBondContact O-N 2.97Å; D16-G19 PolarHBondContact O-N 2.92Å; D16-C20 PolarHBondContact N-O 3.07Å; D16-V22 WeakPolarHBondContact OD1-CG2 3.38Å; D16-P23 WeakPolarHBondContact OD2-CD 3.42Å
17	E	58.2	Low	56.6	Low	106 Å²	106	72.2 Å²	72.2	50%	0.495	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-29.5	176.2	-71.8	-138.1	92	0	0	114.9	Q6 R8 G19	Q6-E17 HydrophobicContact CB-CG 4.19Å; Q6-E17 VanDerWaalsContact CD-CD 3.43Å; Q6-E17 HydrophobicContact CG-CG 3.89Å; Q6-E17 VanDerWaalsContact NE2-CD 3.29Å; Q6-E17 PolarHBondContact NE2-OE1 2.93Å; R8-E17 IonicContact NH2-OE1 3.13Å; R8-E17 PolarHBondContact NH2-OE1 3.25Å; E17-G19 VanDerWaalsContact C-N 3.3Å; E17-G19 PolarHBondContact O-N 3.38Å
18	S	56.2	Low	56.8	Low	91 Å²	91	80.6 Å²	80.6	64%	0.636	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-9.5	179.6	56	0	0	0	0	114.8	D16 C20	D16-S18 PolarHBondContact O-N 2.97Å; S18-C20 VanDerWaalsContact C-N 3.32Å; S18-C20 PolarHBondContact OG-N 2.82Å
19	G	56.5	Low	57.6	Low	56 Å²	56	76.6 Å²	76.6	58%	0.577	43%	0.426	S	S	*	.	S	Bend	trans	84.4	2.4	-171.2	0	0	0	0	0	114.4	V15 D16 E17	V15-G19 VanDerWaalsContact CG1-CA 3.46Å; D16-G19 PolarHBondContact O-N 2.92Å; E17-G19 VanDerWaalsContact C-N 3.3Å; E17-G19 PolarHBondContact O-N 3.38Å
20	C	57.4	Low	58.6	Low	67 Å²	67	78.3 Å²	78.3	45%	0.453	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-76.1	147.3	173.7	-68.5	0	0	0	0	111.6	V15 D16 S18 V22	V15-C20 CarbonylContact C-O 3.54Å; V15-C20 VanDerWaalsContact CA-O 3.31Å; V15-C20 WeakPolarHBondContact CA-O 3.2Å; V15-C20 VanDerWaalsContact CG1-O 3.3Å; V15-C20 WeakPolarHBondContact CG1-O 3.31Å; D16-C20 PolarHBondContact N-O 3.07Å; S18-C20 VanDerWaalsContact C-N 3.32Å; S18-C20 PolarHBondContact OG-N 2.82Å; C20-V22 PolarHBondContact O-N 3.42Å
21	P	58.4	Low	59.8	Low	108 Å²	108	76.5 Å²	76.5	70%	0.701	42%	0.422	S	S	*	.	B	Isolated β-bridge	trans	-57.8	139	168.7	28	-34.9	0	0	0	109.4
22	V	61	Low	61	Low	27 Å²	27	65.6 Å²	65.6	16%	0.164	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-55.8	134.6	-176.3	143.8	0	0	0	0	111.5	I7 F14 D16 C20 I26	I7-V22 HydrophobicContact CB-CG2 4.3Å; I7-V22 HydrophobicContact CG1-CG2 3.75Å; I7-V22 HydrophobicContact CG2-CG2 3.57Å; F14-V22 HydrophobicContact CB-CB 3.92Å; F14-V22 HydrophobicContact CB-CG1 4.41Å; F14-V22 HydrophobicContact CB-CG2 3.82Å; F14-V22 WeakPolarHBondContact O-CB 3.46Å; F14-V22 PolarHBondContact O-N 3.27Å; D16-V22 WeakPolarHBondContact OD1-CG2 3.38Å; C20-V22 PolarHBondContact O-N 3.42Å; V22-I26 HydrophobicContact CG1-CB 3.56Å; V22-I26 HydrophobicContact CG1-CD1 3.63Å; V22-I26 HydrophobicContact CG1-CG1 3.69Å; V22-I26 HydrophobicContact CG1-CG2 4.16Å; V22-I26 HydrophobicContact CG2-CD1 4.2Å
23	P	58.5	Low	61.5	Low	49 Å²	49	70 Å²	70	32%	0.318	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-63	144.4	177.2	27	-37	0	0	0	111.8	D16 W25 I26	D16-P23 WeakPolarHBondContact OD2-CD 3.42Å; P23-W25 VanDerWaalsContact CG-NE1 3.29Å; P23-W25 PolarHBondContact O-N 3.26Å; P23-I26 PolarHBondContact O-N 3.44Å
24	D	57.5	Low	62.3	Low	137 Å²	137	66.4 Å²	66.4	73%	0.733	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-54	-25.9	-166.1	-61.3	-60	0	0	0	114.9	I26 G27 F28	D24-I26 PolarHBondContact O-N 3.08Å; D24-G27 WeakPolarHBondContact O-CA 3.1Å; D24-G27 PolarHBondContact O-N 3.08Å; D24-F28 HydrophobicContact CB-CE2 4.14Å; D24-F28 WeakPolarHBondContact O-CD2 3.43Å
25	W	63.7	Low	62.8	Low	101 Å²	101	69 Å²	69	38%	0.383	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-54.1	-28.5	-178.7	72.3	-99.4	0	0	0	113.7	A5 P23 G27 F28 I29	A5-W25 HydrophobicContact CB-CH2 3.73Å; A5-W25 HydrophobicContact CB-CZ2 3.74Å; P23-W25 VanDerWaalsContact CG-NE1 3.29Å; P23-W25 PolarHBondContact O-N 3.26Å; W25-G27 VanDerWaalsContact C-N 3.29Å; W25-G27 PolarHBondContact O-N 2.95Å; W25-F28 PolarHBondContact O-N 2.76Å; W25-F28 VanDerWaalsContact O-N 3.09Å; W25-I29 HydrophobicContact CE3-CD1 4.07Å; W25-I29 HydrophobicContact CE3-CG1 4.24Å; W25-I29 HydrophobicContact CZ3-CD1 3.66Å; W25-I29 HydrophobicContact CZ3-CG1 4.25Å; W25-I29 PolarHBondContact O-N 2.88Å
26	I	64.3	Low	63.1	Low	4 Å²	4	76.4 Å²	76.4	2%	0.021	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-68.9	-29.2	175.9	-58.5	-161.4	0	0	0	111.9	I7 V22 P23 D24 F28 I29	I7-I26 HydrophobicContact CD1-CD1 3.47Å; I7-I26 VanDerWaalsContact CD1-CD1 3.47Å; I7-I26 HydrophobicContact CG1-CD1 3.79Å; V22-I26 HydrophobicContact CG1-CB 3.56Å; V22-I26 HydrophobicContact CG1-CD1 3.63Å; V22-I26 HydrophobicContact CG1-CG1 3.69Å; V22-I26 HydrophobicContact CG1-CG2 4.16Å; V22-I26 HydrophobicContact CG2-CD1 4.2Å; P23-I26 PolarHBondContact O-N 3.44Å; D24-I26 PolarHBondContact O-N 3.08Å; I26-F28 PolarHBondContact O-N 3.06Å; I26-I29 HydrophobicContact CB-CD1 4.3Å; I26-I29 HydrophobicContact CG1-CD1 4.36Å; I26-I29 HydrophobicContact CG2-CD1 4.09Å; I26-I29 PolarHBondContact O-N 3.02Å
27	G	60.5	Low	63.4	Low	64 Å²	64	77.3 Å²	77.3	66%	0.66	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-70.9	-13.8	171.2	0	0	0	0	0	114.4	D24 W25	D24-G27 WeakPolarHBondContact O-CA 3.1Å; D24-G27 PolarHBondContact O-N 3.08Å; W25-G27 VanDerWaalsContact C-N 3.29Å; W25-G27 PolarHBondContact O-N 2.95Å
28	F	63.8	Low	64.3	Low	176 Å²	176	73.6 Å²	73.6	77%	0.772	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-95.9	-8.1	173.7	-62.8	-92.6	0	0	0	113.3	D24 W25 I26 R30	D24-F28 HydrophobicContact CB-CE2 4.14Å; D24-F28 WeakPolarHBondContact O-CD2 3.43Å; W25-F28 PolarHBondContact O-N 2.76Å; W25-F28 VanDerWaalsContact O-N 3.09Å; I26-F28 PolarHBondContact O-N 3.06Å; F28-R30 PolarHBondContact O-N 2.94Å
29	I	71.1	Confident	65.5	Low	8 Å²	8	69.4 Å²	69.4	4%	0.041	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-68.4	123.3	171.5	-53.8	172.1	0	0	0	108.1	W25 I26 L40 Y53 L65 V67 W98	W25-I29 HydrophobicContact CE3-CD1 4.07Å; W25-I29 HydrophobicContact CE3-CG1 4.24Å; W25-I29 HydrophobicContact CZ3-CD1 3.66Å; W25-I29 HydrophobicContact CZ3-CG1 4.25Å; W25-I29 PolarHBondContact O-N 2.88Å; I26-I29 HydrophobicContact CB-CD1 4.3Å; I26-I29 HydrophobicContact CG1-CD1 4.36Å; I26-I29 HydrophobicContact CG2-CD1 4.09Å; I26-I29 PolarHBondContact O-N 3.02Å; I29-L40 HydrophobicContact CD1-CD1 4.49Å; I29-L40 HydrophobicContact CG2-CD1 4.12Å; I29-Y53 HydrophobicContact CD1-CD1 3.97Å; I29-Y53 HydrophobicContact CD1-CE1 3.79Å; I29-L65 HydrophobicContact CG2-CB 4.35Å; I29-V67 HydrophobicContact CG2-CB 3.9Å; I29-V67 HydrophobicContact CG2-CG1 3.75Å; I29-W98 HydrophobicContact CB-CH2 4.45Å; I29-W98 VanDerWaalsContact O-CH2 3.31Å; I29-W98 WeakPolarHBondContact O-CH2 3.3Å
30	R	69.9	Low	66.5	Low	81 Å²	81	66.7 Å²	66.7	31%	0.306	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	153.3	177.2	-160	168.9	59.9	-139.1	-1.4	110.2	F28 A32 E64 L65 S66 V67	F28-R30 PolarHBondContact O-N 2.94Å; R30-A32 PolarHBondContact O-N 3.06Å; R30-E64 IonicContact CZ-OE1 3.29Å; R30-E64 IonicContact CZ-OE2 2.68Å; R30-E64 IonicContact NH1-OE1 3.35Å; R30-E64 PolarHBondContact NH1-OE1 2.92Å; R30-E64 IonicContact NH1-OE2 3.97Å; R30-E64 PolarHBondContact NH1-OE2 2.95Å; R30-E64 IonicContact NH2-OE2 2.62Å; R30-E64 PolarHBondContact NH2-OE2 2.99Å; R30-L65 PolarHBondContact N-O 2.84Å; R30-S66 CarbonylContact O-C 3.48Å; R30-S66 VanDerWaalsContact O-CA 3.23Å; R30-S66 WeakPolarHBondContact O-CA 3.22Å; R30-V67 PolarHBondContact O-N 2.91Å
31	A	73.2	Confident	67.5	Low	29 Å²	29	65.3 Å²	65.3	24%	0.24	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	127.5	156.8	0	0	0	0	0	108.5	R33 W98	A31-R33 PolarHBondContact O-N 3.24Å; A31-W98 HydrophobicContact CB-CZ3 4.26Å
32	A	70.4	Confident	68.5	Low	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-55.3	138.9	167.6	0	0	0	0	0	108.7	R30 Q38 S66 V67 W68 P85	R30-A32 PolarHBondContact O-N 3.06Å; A32-Q38 HydrophobicContact CB-CB 3.78Å; A32-Q38 HydrophobicContact CB-CG 4.16Å; A32-S66 WeakPolarHBondContact CA-OG 3.47Å; A32-S66 VanDerWaalsContact CB-OG 3.29Å; A32-S66 WeakPolarHBondContact CB-OG 3.25Å; A32-V67 PolarHBondContact N-O 3.05Å; A32-W68 HydrophobicContact CB-CB 4.48Å; A32-P85 WeakPolarHBondContact O-CB 3.18Å; A32-P85 VanDerWaalsContact O-CG 3.24Å; A32-P85 WeakPolarHBondContact O-CG 3.37Å
33	R	62.2	Low	69.3	Low	124 Å²	124	60.7 Å²	60.7	47%	0.468	32%	0.315	S	S	.	.	S	Bend	trans	-88.2	-29.2	178.1	-60.2	-179.3	171.8	157.9	-2.2	113.2	A31 E37 P85 T86	A31-R33 PolarHBondContact O-N 3.24Å; R33-E37 VanDerWaalsContact CB-OE2 3.26Å; R33-E37 WeakPolarHBondContact CB-OE2 3.28Å; R33-E37 WeakPolarHBondContact CG-OE2 3.36Å; R33-E37 PolarHBondContact N-OE2 3.14Å; R33-P85 WeakPolarHBondContact O-CB 3.36Å; R33-P85 VanDerWaalsContact O-CD 3.25Å; R33-P85 WeakPolarHBondContact O-CD 3.33Å; R33-P85 WeakPolarHBondContact O-CG 3.17Å; R33-T86 HydrophobicContact CB-CG2 4.01Å; R33-T86 HydrophobicContact CG-CG2 3.83Å; R33-T86 PolarHBondContact O-N 3.24Å
34	N	65.3	Low	70	Confident	65 Å²	65	59 Å²	59	35%	0.348	30%	0.304	S	S	.	.	S	Bend	trans	-141.5	155.9	-176.9	-66.1	-64.2	0	0	0	109.6	Q36 E37 Q38	N34-Q36 PolarHBondContact O-N 3.09Å; N34-E37 PolarHBondContact O-N 3.23Å; N34-Q38 PolarHBondContact O-N 3.29Å; N34-Q38 VanDerWaalsContact O-N 3.1Å
35	S	67.2	Low	70.5	Confident	97 Å²	97	56.4 Å²	56.4	68%	0.678	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.3	175.8	-48.5	0	0	0	0	114.3
36	Q	66.1	Low	70.2	Confident	173 Å²	173	55.1 Å²	55.1	81%	0.808	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-27.4	172.2	-68.5	-176.3	-19.9	0	0	113.4	N34 R57	N34-Q36 PolarHBondContact O-N 3.09Å; Q36-R57 PolarHBondContact O-NH1 2.82Å
37	E	70.6	Confident	69.6	Low	61 Å²	61	61.1 Å²	61.1	29%	0.285	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-31.4	172	-67.2	178.5	-161	0	0	111.2	R33 N34 N39 S66	R33-E37 VanDerWaalsContact CB-OE2 3.26Å; R33-E37 WeakPolarHBondContact CB-OE2 3.28Å; R33-E37 WeakPolarHBondContact CG-OE2 3.36Å; R33-E37 PolarHBondContact N-OE2 3.14Å; N34-E37 PolarHBondContact O-N 3.23Å; E37-N39 PolarHBondContact O-N 3.15Å; E37-S66 PolarHBondContact O-OG 3.02Å
38	Q	76.8	Confident	69.4	Low	27 Å²	27	59.4 Å²	59.4	13%	0.126	31%	0.312	C	S	.	.			trans	-56.6	107.6	-176.5	-169.4	-168.2	-9	0	0	111.6	A32 N34 L40 L56 W68	A32-Q38 HydrophobicContact CB-CB 3.78Å; A32-Q38 HydrophobicContact CB-CG 4.16Å; N34-Q38 PolarHBondContact O-N 3.29Å; N34-Q38 VanDerWaalsContact O-N 3.1Å; Q38-L40 WeakPolarHBondContact CG-O 3.41Å; Q38-L40 PolarHBondContact NE2-O 3.27Å; Q38-L56 HydrophobicContact CG-CD1 3.92Å; Q38-W68 VanDerWaalsContact CD-CB 3.46Å; Q38-W68 HydrophobicContact CG-CB 3.86Å
39	N	80.7	Confident	69.3	Low	3 Å²	3	58.2 Å²	58.2	2%	0.016	31%	0.309	C	S	.	.			trans	-109.2	-15.1	173.8	45.3	10	0	0	0	112.1	E37 L56 R57 I59 E63 E64 S66	E37-N39 PolarHBondContact O-N 3.15Å; N39-L56 PolarHBondContact O-N 3.36Å; N39-R57 HydrophobicContact CB-CG 4.08Å; N39-I59 HydrophobicContact CB-CD1 3.83Å; N39-I59 HydrophobicContact CB-CG1 4.06Å; N39-E63 PolarHBondContact ND2-OE2 3.04Å; N39-E64 PolarHBondContact ND2-O 3.05Å; N39-S66 PolarHBondContact N-O 3.33Å; N39-S66 WeakPolarHBondContact OD1-CA 3.47Å; N39-S66 PolarHBondContact OD1-N 2.83Å; N39-S66 PolarHBondContact OD1-O 3.1Å; N39-S66 PolarHBondContact OD1-OG 2.81Å
40	L	77.6	Confident	69.2	Low	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.6	171.4	-53.6	-177.9	0	0	0	113.3	L4 I29 Q38 Y53 R54 V55 I59 L65 S66 V67 W68	L4-L40 HydrophobicContact CD1-CD1 4.22Å; L4-L40 HydrophobicContact CD1-CD2 3.49Å; L4-L40 VanDerWaalsContact CD1-CD2 3.49Å; I29-L40 HydrophobicContact CD1-CD1 4.49Å; I29-L40 HydrophobicContact CG2-CD1 4.12Å; Q38-L40 WeakPolarHBondContact CG-O 3.41Å; Q38-L40 PolarHBondContact NE2-O 3.27Å; L40-Y53 HydrophobicContact CD1-CD1 4.36Å; L40-R54 WeakPolarHBondContact CA-O 3.35Å; L40-V55 HydrophobicContact CD2-CG2 4.03Å; L40-I59 HydrophobicContact CD2-CD1 3.84Å; L40-L65 HydrophobicContact CD1-CB 4.19Å; L40-L65 HydrophobicContact CD1-CD2 4.48Å; L40-S66 PolarHBondContact N-O 2.89Å; L40-V67 HydrophobicContact CB-CB 3.92Å; L40-V67 HydrophobicContact CB-CG2 3.89Å; L40-V67 WeakPolarHBondContact O-CA 3.27Å; L40-W68 PolarHBondContact O-N 3.05Å; L40-W68 VanDerWaalsContact O-N 3.13Å
41	E	79.4	Confident	69.3	Low	37 Å²	37	55.7 Å²	55.7	17%	0.173	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.3	168.4	-173.5	-179	-163.7	0	0	110.1	V43 R54 L56 W68 S70	E41-V43 HydrophobicContact CG-CG2 3.91Å; E41-R54 PolarHBondContact N-O 3.29Å; E41-R54 PolarHBondContact O-N 3.31Å; E41-R54 IonicContact OE2-CZ 3.82Å; E41-R54 IonicContact OE2-NH1 2.83Å; E41-R54 PolarHBondContact OE2-NH1 3.38Å; E41-R54 IonicContact OE2-NH2 2.82Å; E41-R54 PolarHBondContact OE2-NH2 3.03Å; E41-L56 HydrophobicContact CB-CD1 4.3Å; E41-L56 HydrophobicContact CB-CD2 3.78Å; E41-L56 HydrophobicContact CB-CG 3.99Å; E41-W68 CarbonylContact C-O 3.55Å; E41-W68 WeakPolarHBondContact CA-O 3.35Å; E41-S70 WeakPolarHBondContact OE1-CA 3.38Å; E41-S70 WeakPolarHBondContact OE1-CB 3.34Å
42	A	79.8	Confident	69.4	Low	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.3	170	0	0	0	0	0	109.5	I51 F52 V67 W68 S70 L73	A42-I51 HydrophobicContact CB-CG2 4.06Å; A42-F52 CarbonylContact C-O 3.56Å; A42-F52 WeakPolarHBondContact CA-O 3.39Å; A42-V67 HydrophobicContact CB-CG2 3.78Å; A42-W68 PolarHBondContact N-O 3.21Å; A42-S70 PolarHBondContact O-N 3.35Å; A42-S70 PolarHBondContact O-OG 3.08Å; A42-L73 HydrophobicContact CB-CD2 3.67Å; A42-L73 VanDerWaalsContact O-CD2 3.22Å; A42-L73 WeakPolarHBondContact O-CD2 3.47Å
43	V	76.1	Confident	69.8	Low	38 Å²	38	55.9 Å²	55.9	23%	0.23	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.1	-175.9	-175.3	0	0	0	0	109.6	E41 I51 F52	E41-V43 HydrophobicContact CG-CG2 3.91Å; V43-I51 WeakPolarHBondContact O-CA 3.37Å; V43-F52 PolarHBondContact N-O 2.75Å; V43-F52 PolarHBondContact O-N 3.36Å
44	S	74.9	Confident	70.4	Confident	15 Å²	15	53.8 Å²	53.8	11%	0.105	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.7	166	48.9	0	0	0	0	111.2	Q50	S44-Q50 WeakPolarHBondContact CA-O 3.29Å
45	D	66.6	Low	71	Confident	82 Å²	82	51.3 Å²	51.3	44%	0.439	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.5	155.4	-176.3	28.3	0	0	0	109.2	G48 Q50 F52	D45-G48 PolarHBondContact O-N 3.25Å; D45-Q50 PolarHBondContact N-O 3.5Å; D45-Q50 VanDerWaalsContact N-O 3.09Å; D45-F52 HydrophobicContact CB-CD2 4.28Å; D45-F52 HydrophobicContact CB-CE2 3.52Å; D45-F52 HydrophobicContact CB-CZ 4.29Å
46	L	58.5	Low	71.4	Confident	74 Å²	74	49.8 Å²	49.8	39%	0.387	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	121.1	-178.8	-66.7	178.8	0	0	0	108.4	W76	L46-W76 HydrophobicContact CD1-CD2 4.21Å; L46-W76 HydrophobicContact CD1-CE3 3.59Å; L46-W76 HydrophobicContact CD1-CZ3 4.01Å; L46-W76 HydrophobicContact CD2-CD2 3.69Å; L46-W76 HydrophobicContact CD2-CE3 3.66Å; L46-W76 HydrophobicContact CD2-CG 4.34Å; L46-W76 HydrophobicContact CD2-CH2 3.98Å; L46-W76 HydrophobicContact CD2-CZ2 4.01Å; L46-W76 HydrophobicContact CD2-CZ3 3.81Å; L46-W76 HydrophobicContact CG-CE3 4.3Å
47	P	51.1	Low	71.8	Confident	129 Å²	129	46 Å²	46	84%	0.838	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	cis	-99.7	26.3	24	39.1	-38.2	0	0	0	115.6	E49	P47-E49 PolarHBondContact O-N 3.09Å
48	G	55.9	Low	71.8	Confident	28 Å²	28	52 Å²	52	29%	0.289	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-9	-161.7	0	0	0	0	0	119.2	D45 Q50	D45-G48 PolarHBondContact O-N 3.25Å; G48-Q50 WeakPolarHBondContact O-CG 3.46Å; G48-Q50 PolarHBondContact O-N 3.01Å; G48-Q50 VanDerWaalsContact O-N 3.17Å
49	E	62.8	Low	71.7	Confident	152 Å²	152	53.1 Å²	53.1	71%	0.71	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	16.3	-169.8	-58.2	-167.6	145.1	0	0	115.2	L9 P47	L9-E49 PolarHBondContact N-O 3.17Å; P47-E49 PolarHBondContact O-N 3.09Å
50	Q	67.2	Low	71.3	Confident	27 Å²	27	56.5 Å²	56.5	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.9	-176.9	-32.2	-166.6	46	0	0	111.7	I7 R8 S44 D45 G48 F52	I7-Q50 CarbonylContact O-C 3.55Å; I7-Q50 VanDerWaalsContact O-CA 3.28Å; I7-Q50 WeakPolarHBondContact O-CA 2.94Å; R8-Q50 HydrophobicContact CG-CB 4.3Å; R8-Q50 HydrophobicContact CG-CG 3.87Å; S44-Q50 WeakPolarHBondContact CA-O 3.29Å; D45-Q50 PolarHBondContact N-O 3.5Å; D45-Q50 VanDerWaalsContact N-O 3.09Å; G48-Q50 WeakPolarHBondContact O-CG 3.46Å; G48-Q50 PolarHBondContact O-N 3.01Å; G48-Q50 VanDerWaalsContact O-N 3.17Å; Q50-F52 HydrophobicContact CB-CD2 4.41Å; Q50-F52 HydrophobicContact CB-CE2 3.74Å; Q50-F52 HydrophobicContact CB-CZ 4.28Å
51	I	73.9	Confident	70.8	Confident	9 Å²	9	62 Å²	62	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.5	175.3	-60.4	173.5	0	0	0	108.3	I7 F14 A42 V43 Y53 L73	I7-I51 PolarHBondContact N-O 2.83Å; I7-I51 PolarHBondContact O-N 2.86Å; F14-I51 HydrophobicContact CE1-CD1 4.33Å; A42-I51 HydrophobicContact CB-CG2 4.06Å; V43-I51 WeakPolarHBondContact O-CA 3.37Å; I51-Y53 HydrophobicContact CG2-CE2 4.14Å; I51-L73 HydrophobicContact CD1-CD1 4.21Å; I51-L73 HydrophobicContact CG1-CD1 4.18Å; I51-L73 HydrophobicContact CG2-CD2 4.38Å
52	F	75.1	Confident	70.3	Confident	31 Å²	31	64.3 Å²	64.3	14%	0.136	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.4	-177.8	-64.3	-105	0	0	0	110	L3 Q6 A42 V43 D45 Q50	L3-F52 HydrophobicContact CD1-CD1 4.11Å; L3-F52 HydrophobicContact CD1-CE1 4.5Å; L3-F52 HydrophobicContact CD2-CB 4.27Å; L3-F52 HydrophobicContact CD2-CD1 4.28Å; Q6-F52 HydrophobicContact CB-CD1 3.94Å; Q6-F52 HydrophobicContact CB-CE1 3.93Å; Q6-F52 HydrophobicContact CG-CD1 3.83Å; Q6-F52 HydrophobicContact CG-CE1 3.37Å; Q6-F52 HydrophobicContact CG-CZ 3.76Å; A42-F52 CarbonylContact C-O 3.56Å; A42-F52 WeakPolarHBondContact CA-O 3.39Å; V43-F52 PolarHBondContact N-O 2.75Å; V43-F52 PolarHBondContact O-N 3.36Å; D45-F52 HydrophobicContact CB-CD2 4.28Å; D45-F52 HydrophobicContact CB-CE2 3.52Å; D45-F52 HydrophobicContact CB-CZ 4.29Å; Q50-F52 HydrophobicContact CB-CD2 4.41Å; Q50-F52 HydrophobicContact CB-CE2 3.74Å; Q50-F52 HydrophobicContact CB-CZ 4.28Å
53	Y	77.6	Confident	70	Confident	1 Å²	1	67.9 Å²	67.9	0%	0.004	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	98.7	174.8	-71.6	-107.6	0	0	0	109	L4 A5 I7 I29 L40 I51 V67	L4-Y53 PolarHBondContact N-O 3.45Å; A5-Y53 PolarHBondContact O-N 3.13Å; A5-Y53 VanDerWaalsContact O-N 3.14Å; I7-Y53 HydrophobicContact CD1-CD2 3.6Å; I7-Y53 HydrophobicContact CD1-CE2 3.71Å; I29-Y53 HydrophobicContact CD1-CD1 3.97Å; I29-Y53 HydrophobicContact CD1-CE1 3.79Å; L40-Y53 HydrophobicContact CD1-CD1 4.36Å; I51-Y53 HydrophobicContact CG2-CE2 4.14Å; Y53-V67 HydrophobicContact CD1-CB 4.4Å; Y53-V67 HydrophobicContact CD1-CG2 3.84Å; Y53-V67 HydrophobicContact CE1-CB 4.21Å; Y53-V67 HydrophobicContact CE1-CG1 4.17Å; Y53-V67 HydrophobicContact CE1-CG2 3.8Å
54	R	75.4	Confident	69.9	Low	81 Å²	81	72 Å²	72	31%	0.306	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.5	176.6	-162.5	-177.1	84.2	-119.6	-3.4	109.9	L1 L3 L40 E41	L1-R54 HydrophobicContact CB-CG 4.49Å; L3-R54 HydrophobicContact CD2-CB 4.48Å; L40-R54 WeakPolarHBondContact CA-O 3.35Å; E41-R54 PolarHBondContact N-O 3.29Å; E41-R54 PolarHBondContact O-N 3.31Å; E41-R54 IonicContact OE2-CZ 3.82Å; E41-R54 IonicContact OE2-NH1 2.83Å; E41-R54 PolarHBondContact OE2-NH1 3.38Å; E41-R54 IonicContact OE2-NH2 2.82Å; E41-R54 PolarHBondContact OE2-NH2 3.03Å
55	V	78.6	Confident	70	Confident	13 Å²	13	74 Å²	74	8%	0.079	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	131.3	170.3	179.6	0	0	0	0	109.7	P2 L4 L40 R57 I59	P2-V55 HydrophobicContact CG-CG2 4.4Å; L4-V55 HydrophobicContact CD1-CG2 3.69Å; L4-V55 HydrophobicContact CG-CG2 3.69Å; L40-V55 HydrophobicContact CD2-CG2 4.03Å; V55-R57 WeakPolarHBondContact CG1-O 3.49Å; V55-I59 HydrophobicContact CG1-CD1 4.48Å; V55-I59 HydrophobicContact CG1-CG1 4.33Å
56	L	75.4	Confident	70.3	Confident	64 Å²	64	70.2 Å²	70.2	34%	0.335	40%	0.395	S	S	.	.	S	Bend	trans	-91.2	-37.9	176	-71.7	-169.6	0	0	0	113.5	Q38 N39 E41	Q38-L56 HydrophobicContact CG-CD1 3.92Å; N39-L56 PolarHBondContact O-N 3.36Å; E41-L56 HydrophobicContact CB-CD1 4.3Å; E41-L56 HydrophobicContact CB-CD2 3.78Å; E41-L56 HydrophobicContact CB-CG 3.99Å
57	R	73.9	Confident	71.3	Confident	95 Å²	95	66.7 Å²	66.7	36%	0.358	38%	0.377	S	S	.	.	S	Bend	trans	-136.7	153.9	179	73.6	-177.4	-164.3	-147	11.8	109.4	Q36 N39 V55 I59 E63	Q36-R57 PolarHBondContact O-NH1 2.82Å; N39-R57 HydrophobicContact CB-CG 4.08Å; V55-R57 WeakPolarHBondContact CG1-O 3.49Å; R57-I59 WeakPolarHBondContact O-CG1 3.42Å; R57-I59 PolarHBondContact O-N 3.44Å; R57-E63 IonicContact CZ-OE1 2.92Å; R57-E63 IonicContact CZ-OE2 2.98Å; R57-E63 IonicContact NE-OE2 2.95Å; R57-E63 PolarHBondContact NE-OE2 3.27Å; R57-E63 IonicContact NH2-OE1 3.62Å; R57-E63 PolarHBondContact NH2-OE1 3.43Å; R57-E63 IonicContact NH2-OE2 3.37Å; R57-E63 PolarHBondContact NH2-OE2 3.08Å
58	E	70.9	Confident	72.6	Confident	187 Å²	187	61.8 Å²	61.8	87%	0.874	34%	0.342	S	S	*	.			trans	-59.7	127.5	171.3	-64.1	-176.2	165.3	0	0	109.7
59	I	73.8	Confident	73.5	Confident	49 Å²	49	60.8 Å²	60.8	25%	0.251	33%	0.329	S	S	.	.			trans	-101.3	111.4	-173.7	-51.3	-175.2	0	0	0	107.7	N39 L40 V55 R57 E63 L65	N39-I59 HydrophobicContact CB-CD1 3.83Å; N39-I59 HydrophobicContact CB-CG1 4.06Å; L40-I59 HydrophobicContact CD2-CD1 3.84Å; V55-I59 HydrophobicContact CG1-CD1 4.48Å; V55-I59 HydrophobicContact CG1-CG1 4.33Å; R57-I59 WeakPolarHBondContact O-CG1 3.42Å; R57-I59 PolarHBondContact O-N 3.44Å; I59-E63 HydrophobicContact CG2-CB 3.64Å; I59-L65 HydrophobicContact CD1-CD2 3.57Å; I59-L65 HydrophobicContact CG2-CD2 4.3Å
60	P	73.1	Confident	73.9	Confident	74 Å²	74	53.8 Å²	53.8	48%	0.481	30%	0.297	S	S	.	.			trans	-67.8	149.1	177.8	28.9	-34.7	0	0	0	110.9	G62 E63	P60-G62 PolarHBondContact O-N 3.09Å; P60-G62 VanDerWaalsContact O-N 3.08Å; P60-E63 HydrophobicContact CG-CB 4.32Å; P60-E63 HydrophobicContact CG-CG 3.86Å; P60-E63 PolarHBondContact O-N 2.87Å
61	A	67.6	Low	73.9	Confident	116 Å²	116	57.6 Å²	57.6	96%	0.959	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	114.6	-179.5	0	0	0	0	0	111
62	G	68.8	Low	73.6	Confident	85 Å²	85	60.6 Å²	60.6	88%	0.876	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.9	-9.3	-176.5	0	0	0	0	0	115.1	P60	P60-G62 PolarHBondContact O-N 3.09Å; P60-G62 VanDerWaalsContact O-N 3.08Å
63	E	73.6	Confident	73.3	Confident	75 Å²	75	59.3 Å²	59.3	35%	0.35	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-71.3	140.7	166.4	-96.6	-170.2	-159.4	0	0	111.6	N39 R57 I59 P60	N39-E63 PolarHBondContact ND2-OE2 3.04Å; R57-E63 IonicContact CZ-OE1 2.92Å; R57-E63 IonicContact CZ-OE2 2.98Å; R57-E63 IonicContact NE-OE2 2.95Å; R57-E63 PolarHBondContact NE-OE2 3.27Å; R57-E63 IonicContact NH2-OE1 3.62Å; R57-E63 PolarHBondContact NH2-OE1 3.43Å; R57-E63 IonicContact NH2-OE2 3.37Å; R57-E63 PolarHBondContact NH2-OE2 3.08Å; I59-E63 HydrophobicContact CG2-CB 3.64Å; P60-E63 HydrophobicContact CG-CB 4.32Å; P60-E63 HydrophobicContact CG-CG 3.86Å; P60-E63 PolarHBondContact O-N 2.87Å
64	E	73.9	Confident	72.7	Confident	124 Å²	124	59.2 Å²	59.2	58%	0.579	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-71.4	134.4	174	-62.4	-179.6	112.2	0	0	111	R30 N39 S66	R30-E64 IonicContact CZ-OE1 3.29Å; R30-E64 IonicContact CZ-OE2 2.68Å; R30-E64 IonicContact NH1-OE1 3.35Å; R30-E64 PolarHBondContact NH1-OE1 2.92Å; R30-E64 IonicContact NH1-OE2 3.97Å; R30-E64 PolarHBondContact NH1-OE2 2.95Å; R30-E64 IonicContact NH2-OE2 2.62Å; R30-E64 PolarHBondContact NH2-OE2 2.99Å; N39-E64 PolarHBondContact ND2-O 3.05Å; E64-S66 PolarHBondContact O-N 3.31Å
65	L	75.7	Confident	72.2	Confident	58 Å²	58	62.9 Å²	62.9	30%	0.304	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-73.2	120.1	173.8	-62.1	-177.1	0	0	0	110.3	I29 R30 L40 I59	I29-L65 HydrophobicContact CG2-CB 4.35Å; R30-L65 PolarHBondContact N-O 2.84Å; L40-L65 HydrophobicContact CD1-CB 4.19Å; L40-L65 HydrophobicContact CD1-CD2 4.48Å; I59-L65 HydrophobicContact CD1-CD2 3.57Å; I59-L65 HydrophobicContact CG2-CD2 4.3Å
66	S	73.7	Confident	71.5	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.014	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.9	177.1	90.1	0	0	0	0	112.7	R30 A32 E37 N39 L40 E64	R30-S66 CarbonylContact O-C 3.48Å; R30-S66 VanDerWaalsContact O-CA 3.23Å; R30-S66 WeakPolarHBondContact O-CA 3.22Å; A32-S66 WeakPolarHBondContact CA-OG 3.47Å; A32-S66 VanDerWaalsContact CB-OG 3.29Å; A32-S66 WeakPolarHBondContact CB-OG 3.25Å; E37-S66 PolarHBondContact O-OG 3.02Å; N39-S66 PolarHBondContact N-O 3.33Å; N39-S66 WeakPolarHBondContact OD1-CA 3.47Å; N39-S66 PolarHBondContact OD1-N 2.83Å; N39-S66 PolarHBondContact OD1-O 3.1Å; N39-S66 PolarHBondContact OD1-OG 2.81Å; L40-S66 PolarHBondContact N-O 2.89Å; E64-S66 PolarHBondContact O-N 3.31Å
67	V	79.3	Confident	70.7	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	146.2	-172.7	70.7	0	0	0	0	112.5	I29 R30 A32 L40 A42 Y53 W98	I29-V67 HydrophobicContact CG2-CB 3.9Å; I29-V67 HydrophobicContact CG2-CG1 3.75Å; R30-V67 PolarHBondContact O-N 2.91Å; A32-V67 PolarHBondContact N-O 3.05Å; L40-V67 HydrophobicContact CB-CB 3.92Å; L40-V67 HydrophobicContact CB-CG2 3.89Å; L40-V67 WeakPolarHBondContact O-CA 3.27Å; A42-V67 HydrophobicContact CB-CG2 3.78Å; Y53-V67 HydrophobicContact CD1-CB 4.4Å; Y53-V67 HydrophobicContact CD1-CG2 3.84Å; Y53-V67 HydrophobicContact CE1-CB 4.21Å; Y53-V67 HydrophobicContact CE1-CG1 4.17Å; Y53-V67 HydrophobicContact CE1-CG2 3.8Å; V67-W98 HydrophobicContact CG1-CH2 3.6Å; V67-W98 HydrophobicContact CG1-CZ3 4.1Å
68	W	77.7	Confident	70	Confident	26 Å²	26	73.2 Å²	73.2	10%	0.098	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	159.6	162.1	-162.7	-122.6	0	0	0	111.1	A32 Q38 L40 E41 A42 A83 P85 I96	A32-W68 HydrophobicContact CB-CB 4.48Å; Q38-W68 VanDerWaalsContact CD-CB 3.46Å; Q38-W68 HydrophobicContact CG-CB 3.86Å; L40-W68 PolarHBondContact O-N 3.05Å; L40-W68 VanDerWaalsContact O-N 3.13Å; E41-W68 CarbonylContact C-O 3.55Å; E41-W68 WeakPolarHBondContact CA-O 3.35Å; A42-W68 PolarHBondContact N-O 3.21Å; W68-A83 WeakPolarHBondContact CZ2-O 3.39Å; W68-P85 HydrophobicContact CD2-CB 4.24Å; W68-P85 HydrophobicContact CD2-CG 3.68Å; W68-P85 HydrophobicContact CE3-CB 3.75Å; W68-P85 HydrophobicContact CE3-CG 3.7Å; W68-P85 HydrophobicContact CG-CG 4.32Å; W68-P85 VanDerWaalsContact CH2-CA 3.49Å; W68-P85 HydrophobicContact CH2-CB 3.68Å; W68-P85 HydrophobicContact CH2-CG 3.97Å; W68-P85 HydrophobicContact CZ2-CB 4.12Å; W68-P85 HydrophobicContact CZ2-CG 3.9Å; W68-P85 HydrophobicContact CZ3-CB 3.48Å; W68-P85 VanDerWaalsContact CZ3-CB 3.48Å; W68-P85 HydrophobicContact CZ3-CG 3.88Å; W68-I96 HydrophobicContact CH2-CD1 3.39Å; W68-I96 HydrophobicContact CZ3-CD1 3.4Å
69	Y	74.7	Confident	69.6	Low	8 Å²	8	65 Å²	65	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	150.2	178.5	50.8	-107.7	0	0	0	112.4	A74 I79 P80 W101	Y69-A74 HydrophobicContact CD2-CB 3.57Å; Y69-A74 HydrophobicContact CE2-CB 3.53Å; Y69-I79 HydrophobicContact CD1-CD1 3.98Å; Y69-I79 HydrophobicContact CE1-CB 4.48Å; Y69-I79 HydrophobicContact CE1-CD1 3.94Å; Y69-I79 HydrophobicContact CE1-CG2 3.82Å; Y69-I79 HydrophobicContact CE2-CG2 4.45Å; Y69-I79 HydrophobicContact CG-CD1 4.43Å; Y69-I79 WeakPolarHBondContact OH-CG2 3.22Å; Y69-P80 PolarHBondContact OH-O 2.75Å; Y69-P80 VanDerWaalsContact OH-O 3.13Å; Y69-W101 AromaticContact CD1-CE3 3.76Å; Y69-W101 HydrophobicContact CD1-CE3 3.76Å; Y69-W101 AromaticContact CD1-CZ3 3.98Å; Y69-W101 HydrophobicContact CD1-CZ3 3.98Å; Y69-W101 HydrophobicContact CE1-CE3 4.47Å
70	S	72.8	Confident	68.7	Low	4 Å²	4	65.6 Å²	65.6	3%	0.028	37%	0.367	C	S	.	.			trans	-74.7	159.4	168.4	74	0	0	0	0	111.7	E41 A42 L73 A74	E41-S70 WeakPolarHBondContact OE1-CA 3.38Å; E41-S70 WeakPolarHBondContact OE1-CB 3.34Å; A42-S70 PolarHBondContact O-N 3.35Å; A42-S70 PolarHBondContact O-OG 3.08Å; S70-L73 PolarHBondContact O-N 3.08Å; S70-L73 VanDerWaalsContact O-N 3.09Å; S70-L73 PolarHBondContact OG-N 2.83Å; S70-A74 PolarHBondContact O-N 3.39Å
71	N	67.3	Low	67.7	Low	108 Å²	108	66 Å²	66	58%	0.578	37%	0.369	S	S	*	.	H	α-helix	trans	-57.7	-40.7	176.7	-78.3	-29.7	0	0	0	113.9	L73 A74 Q75 T81	N71-L73 VanDerWaalsContact C-N 3.35Å; N71-L73 PolarHBondContact O-N 3.31Å; N71-A74 WeakPolarHBondContact O-CB 3.17Å; N71-A74 PolarHBondContact O-N 3.34Å; N71-Q75 WeakPolarHBondContact O-CB 3.38Å; N71-Q75 PolarHBondContact O-N 3.22Å; N71-T81 VanDerWaalsContact OD1-CG2 3.29Å; N71-T81 WeakPolarHBondContact OD1-CG2 3.23Å
72	P	66.6	Low	66.9	Low	71 Å²	71	65.1 Å²	65.1	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-40.8	171.2	-27	35.8	0	0	0	113.6	Q75 W76	P72-Q75 PolarHBondContact O-N 2.97Å; P72-W76 PolarHBondContact O-N 2.96Å
73	L	69.2	Low	65.9	Low	4 Å²	4	61.4 Å²	61.4	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-39.1	177.9	-175.3	66	0	0	0	111.1	A42 I51 S70 N71 W76 Y77	A42-L73 HydrophobicContact CB-CD2 3.67Å; A42-L73 VanDerWaalsContact O-CD2 3.22Å; A42-L73 WeakPolarHBondContact O-CD2 3.47Å; I51-L73 HydrophobicContact CD1-CD1 4.21Å; I51-L73 HydrophobicContact CG1-CD1 4.18Å; I51-L73 HydrophobicContact CG2-CD2 4.38Å; S70-L73 PolarHBondContact O-N 3.08Å; S70-L73 VanDerWaalsContact O-N 3.09Å; S70-L73 PolarHBondContact OG-N 2.83Å; N71-L73 VanDerWaalsContact C-N 3.35Å; N71-L73 PolarHBondContact O-N 3.31Å; L73-W76 PolarHBondContact O-N 2.87Å; L73-Y77 HydrophobicContact CD1-CD2 3.79Å; L73-Y77 HydrophobicContact CD1-CE2 3.58Å; L73-Y77 HydrophobicContact CG-CD2 4.34Å; L73-Y77 WeakPolarHBondContact O-CD2 3.31Å; L73-Y77 PolarHBondContact O-N 3.17Å
74	A	65.6	Low	64.8	Low	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.6	-50.2	172.1	0	0	0	0	0	112.1	Y69 S70 N71 W76 Y77 D78 I79 T81	Y69-A74 HydrophobicContact CD2-CB 3.57Å; Y69-A74 HydrophobicContact CE2-CB 3.53Å; S70-A74 PolarHBondContact O-N 3.39Å; N71-A74 WeakPolarHBondContact O-CB 3.17Å; N71-A74 PolarHBondContact O-N 3.34Å; A74-W76 VanDerWaalsContact C-N 3.3Å; A74-W76 PolarHBondContact O-N 2.92Å; A74-Y77 PolarHBondContact O-N 3.02Å; A74-D78 PolarHBondContact O-N 3.39Å; A74-I79 HydrophobicContact CB-CB 4.32Å; A74-I79 PolarHBondContact O-N 3.38Å; A74-T81 HydrophobicContact CB-CG2 3.76Å
75	Q	63.1	Low	63.9	Low	157 Å²	157	55.3 Å²	55.3	73%	0.734	29%	0.289	S	S	*	.	H	α-helix	trans	-63.4	-35.2	-178.6	-172.6	175.5	2.5	0	0	112.2	N71 P72 Y77	N71-Q75 WeakPolarHBondContact O-CB 3.38Å; N71-Q75 PolarHBondContact O-N 3.22Å; P72-Q75 PolarHBondContact O-N 2.97Å; Q75-Y77 VanDerWaalsContact C-N 3.32Å; Q75-Y77 PolarHBondContact O-N 3.43Å
76	W	64	Low	62.8	Low	153 Å²	153	54 Å²	54	58%	0.58	28%	0.283	S	S	*	.	H	α-helix	trans	-67.6	-29.8	176.8	-169.7	-98.9	0	0	0	113.6	L46 P72 L73 A74	L46-W76 HydrophobicContact CD1-CD2 4.21Å; L46-W76 HydrophobicContact CD1-CE3 3.59Å; L46-W76 HydrophobicContact CD1-CZ3 4.01Å; L46-W76 HydrophobicContact CD2-CD2 3.69Å; L46-W76 HydrophobicContact CD2-CE3 3.66Å; L46-W76 HydrophobicContact CD2-CG 4.34Å; L46-W76 HydrophobicContact CD2-CH2 3.98Å; L46-W76 HydrophobicContact CD2-CZ2 4.01Å; L46-W76 HydrophobicContact CD2-CZ3 3.81Å; L46-W76 HydrophobicContact CG-CE3 4.3Å; P72-W76 PolarHBondContact O-N 2.96Å; L73-W76 PolarHBondContact O-N 2.87Å; A74-W76 VanDerWaalsContact C-N 3.3Å; A74-W76 PolarHBondContact O-N 2.92Å
77	Y	60.3	Low	61.7	Low	82 Å²	82	56.5 Å²	56.5	32%	0.322	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	14.9	-177.1	-77.4	-78.2	0	0	0	114.3	L9 L73 A74 Q75 I79	L9-Y77 WeakPolarHBondContact CD2-OH 3.3Å; L73-Y77 HydrophobicContact CD1-CD2 3.79Å; L73-Y77 HydrophobicContact CD1-CE2 3.58Å; L73-Y77 HydrophobicContact CG-CD2 4.34Å; L73-Y77 WeakPolarHBondContact O-CD2 3.31Å; L73-Y77 PolarHBondContact O-N 3.17Å; A74-Y77 PolarHBondContact O-N 3.02Å; Q75-Y77 VanDerWaalsContact C-N 3.32Å; Q75-Y77 PolarHBondContact O-N 3.43Å; Y77-I79 PolarHBondContact O-N 3.47Å
78	D	58.3	Low	60.4	Low	154 Å²	154	58.4 Å²	58.4	82%	0.824	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	29	-174	-77.8	-32.8	0	0	0	113.4	A74	A74-D78 PolarHBondContact O-N 3.39Å
79	I	62.1	Low	59.3	Low	14 Å²	14	65.4 Å²	65.4	7%	0.072	34%	0.339	C	S	.	.			trans	-87.9	131.5	-177.4	-37.1	172.8	0	0	0	110.4	Y69 A74 Y77 T81 W101 I103	Y69-I79 HydrophobicContact CD1-CD1 3.98Å; Y69-I79 HydrophobicContact CE1-CB 4.48Å; Y69-I79 HydrophobicContact CE1-CD1 3.94Å; Y69-I79 HydrophobicContact CE1-CG2 3.82Å; Y69-I79 HydrophobicContact CE2-CG2 4.45Å; Y69-I79 HydrophobicContact CG-CD1 4.43Å; Y69-I79 WeakPolarHBondContact OH-CG2 3.22Å; A74-I79 HydrophobicContact CB-CB 4.32Å; A74-I79 PolarHBondContact O-N 3.38Å; Y77-I79 PolarHBondContact O-N 3.47Å; I79-T81 PolarHBondContact O-N 3.36Å; I79-W101 HydrophobicContact CD1-CB 3.59Å; I79-W101 HydrophobicContact CD1-CG 4.44Å; I79-W101 HydrophobicContact CG1-CB 4.46Å; I79-I103 HydrophobicContact CG2-CD1 4.08Å; I79-I103 HydrophobicContact CG2-CG1 4.49Å
80	P	54.5	Low	58.3	Low	62 Å²	62	73.7 Å²	73.7	40%	0.403	38%	0.375	S	S	.	.			trans	-61.1	122.5	175.3	-23.5	33.9	0	0	0	112.5	Y69 T82 A83	Y69-P80 PolarHBondContact OH-O 2.75Å; Y69-P80 VanDerWaalsContact OH-O 3.13Å; P80-T82 PolarHBondContact O-N 3.26Å; P80-A83 HydrophobicContact CB-CB 4.32Å; P80-A83 PolarHBondContact O-N 3.19Å
81	T	53.9	Low	57.4	Low	83 Å²	83	75.7 Å²	75.7	51%	0.509	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.9	175.1	50.2	0	0	0	0	113.3	N71 A74 I79	N71-T81 VanDerWaalsContact OD1-CG2 3.29Å; N71-T81 WeakPolarHBondContact OD1-CG2 3.23Å; A74-T81 HydrophobicContact CB-CG2 3.76Å; I79-T81 PolarHBondContact O-N 3.36Å
82	T	49	Very low	57	Low	98 Å²	98	74.3 Å²	74.3	60%	0.601	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.2	175	56.3	0	0	0	0	114	P80 T84	P80-T82 PolarHBondContact O-N 3.26Å; T82-T84 PolarHBondContact O-N 3.12Å
83	A	49.2	Very low	56.6	Low	7 Å²	7	76.3 Å²	76.3	6%	0.058	39%	0.39	C	S	.	.			trans	-75.2	110.5	175.9	0	0	0	0	0	109.8	W68 P80 I103	W68-A83 WeakPolarHBondContact CZ2-O 3.39Å; P80-A83 HydrophobicContact CB-CB 4.32Å; P80-A83 PolarHBondContact O-N 3.19Å; A83-I103 HydrophobicContact CB-CD1 3.45Å; A83-I103 VanDerWaalsContact CB-CD1 3.45Å
84	T	50.6	Low	56.5	Low	62 Å²	62	79.1 Å²	79.1	38%	0.38	40%	0.4	S	S	.	.			trans	-68.8	148.2	163.1	78.7	0	0	0	0	108.8	T82 T86 H87	T82-T84 PolarHBondContact O-N 3.12Å; T84-T86 VanDerWaalsContact C-N 3.3Å; T84-T86 PolarHBondContact O-N 3.45Å; T84-T86 VanDerWaalsContact O-N 3.09Å; T84-H87 PolarHBondContact O-N 3.06Å; T84-H87 WeakPolarHBondContact OG1-CB 3.48Å; T84-H87 PolarHBondContact OG1-N 3.18Å; T84-H87 PolarHBondContact OG1-O 2.88Å
85	P	54.2	Low	56.4	Low	8 Å²	8	82.6 Å²	82.6	5%	0.052	41%	0.414	C	S	.	.	S	Bend	trans	-61.2	-31.1	-159	-25.1	30.1	0	0	0	116.5	A32 R33 W68 I96	A32-P85 WeakPolarHBondContact O-CB 3.18Å; A32-P85 VanDerWaalsContact O-CG 3.24Å; A32-P85 WeakPolarHBondContact O-CG 3.37Å; R33-P85 WeakPolarHBondContact O-CB 3.36Å; R33-P85 VanDerWaalsContact O-CD 3.25Å; R33-P85 WeakPolarHBondContact O-CD 3.33Å; R33-P85 WeakPolarHBondContact O-CG 3.17Å; W68-P85 HydrophobicContact CD2-CB 4.24Å; W68-P85 HydrophobicContact CD2-CG 3.68Å; W68-P85 HydrophobicContact CE3-CB 3.75Å; W68-P85 HydrophobicContact CE3-CG 3.7Å; W68-P85 HydrophobicContact CG-CG 4.32Å; W68-P85 VanDerWaalsContact CH2-CA 3.49Å; W68-P85 HydrophobicContact CH2-CB 3.68Å; W68-P85 HydrophobicContact CH2-CG 3.97Å; W68-P85 HydrophobicContact CZ2-CB 4.12Å; W68-P85 HydrophobicContact CZ2-CG 3.9Å; W68-P85 HydrophobicContact CZ3-CB 3.48Å; W68-P85 VanDerWaalsContact CZ3-CB 3.48Å; W68-P85 HydrophobicContact CZ3-CG 3.88Å; P85-I96 VanDerWaalsContact O-CD1 3.26Å; P85-I96 WeakPolarHBondContact O-CD1 3.28Å
86	T	51.9	Low	56.5	Low	30 Å²	30	76.8 Å²	76.8	18%	0.184	39%	0.388	C	S	.	.	S	Bend	trans	-120	2.6	171.6	56	0	0	0	0	114.7	R33 T84 E93 R94	R33-T86 HydrophobicContact CB-CG2 4.01Å; R33-T86 HydrophobicContact CG-CG2 3.83Å; R33-T86 PolarHBondContact O-N 3.24Å; T84-T86 VanDerWaalsContact C-N 3.3Å; T84-T86 PolarHBondContact O-N 3.45Å; T84-T86 VanDerWaalsContact O-N 3.09Å; T86-E93 CarbonylContact O-C 3.07Å; T86-E93 VanDerWaalsContact O-CA 3.22Å; T86-E93 WeakPolarHBondContact O-CA 3.48Å; T86-R94 PolarHBondContact O-N 3.01Å
87	H	51	Low	56.8	Low	55 Å²	55	69.6 Å²	69.6	26%	0.255	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-136.5	139.2	-175.9	-59.5	-75.9	0	0	0	115	T84 G91 E92	T84-H87 PolarHBondContact O-N 3.06Å; T84-H87 WeakPolarHBondContact OG1-CB 3.48Å; T84-H87 PolarHBondContact OG1-N 3.18Å; T84-H87 PolarHBondContact OG1-O 2.88Å; H87-G91 PolarHBondContact ND1-O 3.35Å; H87-E92 WeakPolarHBondContact CA-O 3.44Å
88	D	52.6	Low	56.6	Low	41 Å²	41	68.6 Å²	68.6	22%	0.219	36%	0.356	C	S	.	.			trans	-64.3	166	157.9	-103.9	-53.5	0	0	0	111.5	K90 G91 E92 R94	D88-K90 HydrophobicContact CB-CB 4.49Å; D88-K90 PolarHBondContact O-N 2.87Å; D88-G91 PolarHBondContact O-N 3.44Å; D88-E92 HydrophobicContact CB-CB 4.28Å; D88-E92 PolarHBondContact N-O 3.36Å; D88-E92 VanDerWaalsContact N-O 3.07Å; D88-R94 IonicContact OD1-CZ 3.01Å; D88-R94 IonicContact OD1-NE 2.76Å; D88-R94 PolarHBondContact OD1-NE 3.13Å; D88-R94 IonicContact OD1-NH1 3.46Å; D88-R94 IonicContact OD1-NH2 3.17Å; D88-R94 PolarHBondContact OD1-NH2 2.81Å; D88-R94 IonicContact OD2-CZ 3.48Å; D88-R94 IonicContact OD2-NE 2.74Å; D88-R94 PolarHBondContact OD2-NE 3.01Å; D88-R94 IonicContact OD2-NH2 2.68Å; D88-R94 PolarHBondContact OD2-NH2 2.84Å
89	E	53.5	Low	56.8	Low	172 Å²	172	68.7 Å²	68.7	80%	0.804	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-12.3	167.3	-62.1	173.3	169.3	0	0	113.4
90	K	53.8	Low	57	Low	182 Å²	182	69.7 Å²	69.7	79%	0.791	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	4.1	177.2	-61.1	-179.9	179	179.1	0	113.9	D88 E92	D88-K90 HydrophobicContact CB-CB 4.49Å; D88-K90 PolarHBondContact O-N 2.87Å; K90-E92 VanDerWaalsContact C-N 3.31Å; K90-E92 HydrophobicContact CB-CG 4.42Å; K90-E92 PolarHBondContact O-N 2.88Å
91	G	54.7	Low	57.3	Low	47 Å²	47	67.7 Å²	67.7	49%	0.485	34%	0.338	S	S	.	.			trans	78.8	1	-177.2	0	0	0	0	0	115.7	H87 D88	H87-G91 PolarHBondContact ND1-O 3.35Å; D88-G91 PolarHBondContact O-N 3.44Å
92	E	58.3	Low	57.8	Low	79 Å²	79	71.4 Å²	71.4	37%	0.369	34%	0.343	S	S	.	.			trans	-70	133.9	-178.3	-60.1	-172.7	117.4	0	0	112.2	H87 D88 K90 K105	H87-E92 WeakPolarHBondContact CA-O 3.44Å; D88-E92 HydrophobicContact CB-CB 4.28Å; D88-E92 PolarHBondContact N-O 3.36Å; D88-E92 VanDerWaalsContact N-O 3.07Å; K90-E92 VanDerWaalsContact C-N 3.31Å; K90-E92 HydrophobicContact CB-CG 4.42Å; K90-E92 PolarHBondContact O-N 2.88Å; E92-K105 WeakPolarHBondContact OE1-CE 3.47Å; E92-K105 IonicContact OE1-NZ 3.92Å; E92-K105 PolarHBondContact OE1-NZ 3.34Å; E92-K105 IonicContact OE2-NZ 2.96Å; E92-K105 PolarHBondContact OE2-NZ 2.69Å
93	E	58.6	Low	58.7	Low	113 Å²	113	68.8 Å²	68.8	53%	0.528	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-61.7	135.2	-177.1	-75	-171	172.9	0	0	114	T86 Y95	T86-E93 CarbonylContact O-C 3.07Å; T86-E93 VanDerWaalsContact O-CA 3.22Å; T86-E93 WeakPolarHBondContact O-CA 3.48Å; E93-Y95 HydrophobicContact CB-CE2 3.82Å; E93-Y95 PolarHBondContact OE2-OH 2.8Å
94	R	66.5	Low	59.7	Low	63 Å²	63	70.1 Å²	70.1	24%	0.238	33%	0.33	C	S	.	.			trans	-125.4	138.1	178.6	-77	-178.8	164.9	-146.7	4.3	111.5	T86 D88 I103	T86-R94 PolarHBondContact O-N 3.01Å; D88-R94 IonicContact OD1-CZ 3.01Å; D88-R94 IonicContact OD1-NE 2.76Å; D88-R94 PolarHBondContact OD1-NE 3.13Å; D88-R94 IonicContact OD1-NH1 3.46Å; D88-R94 IonicContact OD1-NH2 3.17Å; D88-R94 PolarHBondContact OD1-NH2 2.81Å; D88-R94 IonicContact OD2-CZ 3.48Å; D88-R94 IonicContact OD2-NE 2.74Å; D88-R94 PolarHBondContact OD2-NE 3.01Å; D88-R94 IonicContact OD2-NH2 2.68Å; D88-R94 PolarHBondContact OD2-NH2 2.84Å; R94-I103 HydrophobicContact CB-CG2 3.74Å; R94-I103 HydrophobicContact CG-CG2 4.02Å
95	Y	63.5	Low	60.6	Low	73 Å²	73	71.2 Å²	71.2	29%	0.286	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.5	-169.8	-70	-98.1	0	0	0	109.7	E93 I103 F104 P107	E93-Y95 HydrophobicContact CB-CE2 3.82Å; E93-Y95 PolarHBondContact OE2-OH 2.8Å; Y95-I103 CarbonylContact O-C 3.54Å; Y95-F104 PolarHBondContact N-O 3.06Å; Y95-F104 WeakPolarHBondContact O-CB 3.33Å; Y95-F104 PolarHBondContact O-N 2.72Å; Y95-P107 HydrophobicContact CD1-CB 3.92Å; Y95-P107 HydrophobicContact CE1-CB 3.69Å; Y95-P107 HydrophobicContact CE1-CG 4.18Å; Y95-P107 HydrophobicContact CE2-CG 4.5Å; Y95-P107 HydrophobicContact CG-CB 4.48Å
96	I	66.1	Low	61.3	Low	35 Å²	35	77.2 Å²	77.2	18%	0.179	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.2	-170.2	-58.2	176.4	0	0	0	111.1	W68 P85 R102 I103	W68-I96 HydrophobicContact CH2-CD1 3.39Å; W68-I96 HydrophobicContact CZ3-CD1 3.4Å; P85-I96 VanDerWaalsContact O-CD1 3.26Å; P85-I96 WeakPolarHBondContact O-CD1 3.28Å; I96-R102 WeakPolarHBondContact CA-O 3.5Å; I96-I103 HydrophobicContact CG1-CG1 4.31Å; I96-I103 HydrophobicContact CG1-CG2 4.43Å
97	C	69.8	Low	61.9	Low	1 Å²	1	78.6 Å²	78.6	1%	0.007	36%	0.361	C	S	.	.			trans	-87.5	107.1	173.9	-174.7	0	0	0	0	111.2	Y99 C100 W101 R102 F104 L110 H113 C118	C97-Y99 PolarHBondContact O-N 2.91Å; C97-C100 PolarHBondContact O-N 2.96Å; C97-C100 VanDerWaalsContact O-N 3.14Å; C97-W101 VanDerWaalsContact O-CA 3.23Å; C97-W101 WeakPolarHBondContact O-CA 3.37Å; C97-W101 PolarHBondContact O-N 2.91Å; C97-R102 PolarHBondContact N-O 3.37Å; C97-F104 HydrophobicContact CB-CE2 3.92Å; C97-L110 HydrophobicContact CB-CD1 3.5Å; C97-H113 PolarHBondContact SG-CD2 2.79Å; C97-H113 PolarHBondContact SG-NE2 2.91Å; C97-C118 VanDerWaalsContact SG-SG 3.61Å
98	W	57.2	Low	62.7	Low	62 Å²	62	82 Å²	82	24%	0.235	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-29.4	179.1	-162	-104.2	0	0	0	114.3	I29 A31 V67 W101	I29-W98 HydrophobicContact CB-CH2 4.45Å; I29-W98 VanDerWaalsContact O-CH2 3.31Å; I29-W98 WeakPolarHBondContact O-CH2 3.3Å; A31-W98 HydrophobicContact CB-CZ3 4.26Å; V67-W98 HydrophobicContact CG1-CH2 3.6Å; V67-W98 HydrophobicContact CG1-CZ3 4.1Å; W98-W101 HydrophobicContact CZ3-CH2 4.38Å; W98-W101 PolarHBondContact O-NE1 3.33Å
99	Y	61.5	Low	63.8	Low	155 Å²	155	83.1 Å²	83.1	61%	0.608	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-16.1	-178	-60	-74.7	0	0	0	115.3	C97 V114 C118	C97-Y99 PolarHBondContact O-N 2.91Å; Y99-V114 HydrophobicContact CD2-CG1 4.31Å; Y99-V114 HydrophobicContact CE2-CG1 4.11Å; Y99-C118 WeakPolarHBondContact CB-SG 3.33Å
100	C	66.5	Low	64.7	Low	36 Å²	36	76.4 Å²	76.4	24%	0.243	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.7	11.4	175.5	75.1	0	0	0	0	115.1	C97 R102 H113 C118	C97-C100 PolarHBondContact O-N 2.96Å; C97-C100 VanDerWaalsContact O-N 3.14Å; C100-R102 PolarHBondContact O-N 3.31Å; C100-H113 VanDerWaalsContact SG-CE1 3.56Å; C100-H113 PolarHBondContact SG-NE2 3.36Å; C100-C118 VanDerWaalsContact CB-SG 3.58Å; C100-C118 PolarHBondContact SG-SG 2.64Å
101	W	61.8	Low	65.4	Low	19 Å²	19	75.2 Å²	75.2	7%	0.072	35%	0.354	C	S	.	.			trans	56.2	13.4	175.5	-60.2	70.8	0	0	0	115.9	Y69 I79 C97 W98	Y69-W101 AromaticContact CD1-CE3 3.76Å; Y69-W101 HydrophobicContact CD1-CE3 3.76Å; Y69-W101 AromaticContact CD1-CZ3 3.98Å; Y69-W101 HydrophobicContact CD1-CZ3 3.98Å; Y69-W101 HydrophobicContact CE1-CE3 4.47Å; I79-W101 HydrophobicContact CD1-CB 3.59Å; I79-W101 HydrophobicContact CD1-CG 4.44Å; I79-W101 HydrophobicContact CG1-CB 4.46Å; C97-W101 VanDerWaalsContact O-CA 3.23Å; C97-W101 WeakPolarHBondContact O-CA 3.37Å; C97-W101 PolarHBondContact O-N 2.91Å; W98-W101 HydrophobicContact CZ3-CH2 4.38Å; W98-W101 PolarHBondContact O-NE1 3.33Å
102	R	63.3	Low	66	Low	162 Å²	162	75 Å²	75	61%	0.611	35%	0.347	S	S	*	.			trans	-71.9	145.7	173.5	-73.3	-176.4	-179.4	151.4	8.4	112.4	I96 C97 C100 F104	I96-R102 WeakPolarHBondContact CA-O 3.5Å; C97-R102 PolarHBondContact N-O 3.37Å; C100-R102 PolarHBondContact O-N 3.31Å; R102-F104 HydrophobicContact CB-CE2 3.64Å; R102-F104 HydrophobicContact CB-CZ 3.93Å; R102-F104 WeakPolarHBondContact O-CD2 3.39Å; R102-F104 WeakPolarHBondContact O-CE2 3.3Å
103	I	68.5	Low	67	Low	42 Å²	42	72 Å²	72	22%	0.215	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	137.7	-175.7	-46.4	172.1	0	0	0	109.8	I79 A83 R94 Y95 I96	I79-I103 HydrophobicContact CG2-CD1 4.08Å; I79-I103 HydrophobicContact CG2-CG1 4.49Å; A83-I103 HydrophobicContact CB-CD1 3.45Å; A83-I103 VanDerWaalsContact CB-CD1 3.45Å; R94-I103 HydrophobicContact CB-CG2 3.74Å; R94-I103 HydrophobicContact CG-CG2 4.02Å; Y95-I103 CarbonylContact O-C 3.54Å; I96-I103 HydrophobicContact CG1-CG1 4.31Å; I96-I103 HydrophobicContact CG1-CG2 4.43Å
104	F	70.1	Confident	67.5	Low	36 Å²	36	68.6 Å²	68.6	16%	0.158	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136.8	-175.4	-64.4	-89.4	0	0	0	110.4	Y95 C97 R102 Y106 L110 H113	Y95-F104 PolarHBondContact N-O 3.06Å; Y95-F104 WeakPolarHBondContact O-CB 3.33Å; Y95-F104 PolarHBondContact O-N 2.72Å; C97-F104 HydrophobicContact CB-CE2 3.92Å; R102-F104 HydrophobicContact CB-CE2 3.64Å; R102-F104 HydrophobicContact CB-CZ 3.93Å; R102-F104 WeakPolarHBondContact O-CD2 3.39Å; R102-F104 WeakPolarHBondContact O-CE2 3.3Å; F104-Y106 VanDerWaalsContact C-N 3.26Å; F104-Y106 PolarHBondContact O-N 3.48Å; F104-L110 HydrophobicContact CB-CB 4.1Å; F104-L110 HydrophobicContact CD2-CB 4.17Å; F104-L110 HydrophobicContact CD2-CD1 3.88Å; F104-L110 HydrophobicContact CE2-CD1 4.17Å; F104-L110 HydrophobicContact CG-CB 4.14Å; F104-H113 HydrophobicContact CD1-CB 4.46Å; F104-H113 HydrophobicContact CE1-CB 3.63Å; F104-H113 AromaticContact CE1-CG 3.8Å; F104-H113 HydrophobicContact CE2-CB 4.3Å; F104-H113 AromaticContact CE2-CD2 3.36Å; F104-H113 WeakPolarHBondContact CE2-CD2 3.45Å; F104-H113 AromaticContact CE2-CG 3.87Å; F104-H113 HydrophobicContact CZ-CB 3.56Å; F104-H113 AromaticContact CZ-CD2 3.18Å; F104-H113 WeakPolarHBondContact CZ-CD2 3.48Å; F104-H113 AromaticContact CZ-CG 3.19Å; F104-H113 AromaticContact CZ-ND1 3.85Å; F104-H113 AromaticContact CZ-NE2 3.82Å
105	K	68.8	Low	67.3	Low	85 Å²	85	71.6 Å²	71.6	37%	0.37	34%	0.337	S	S	.	.	S	Bend	trans	-73.3	-11.7	178.3	-176.9	162.3	176.7	161.3	0	114.2	E92	E92-K105 WeakPolarHBondContact OE1-CE 3.47Å; E92-K105 IonicContact OE1-NZ 3.92Å; E92-K105 PolarHBondContact OE1-NZ 3.34Å; E92-K105 IonicContact OE2-NZ 2.96Å; E92-K105 PolarHBondContact OE2-NZ 2.69Å
106	Y	69.3	Low	66.9	Low	133 Å²	133	74 Å²	74	52%	0.522	35%	0.349	S	S	.	.	S	Bend	trans	-142.7	144.4	-176.1	-57.6	-68.1	0	0	0	112	F104 N108 T109 L110	F104-Y106 VanDerWaalsContact C-N 3.26Å; F104-Y106 PolarHBondContact O-N 3.48Å; Y106-N108 PolarHBondContact O-N 3.39Å; Y106-T109 HydrophobicContact CD2-CG2 4.49Å; Y106-T109 PolarHBondContact O-N 2.85Å; Y106-T109 VanDerWaalsContact O-N 3.15Å; Y106-T109 PolarHBondContact O-OG1 3.32Å; Y106-L110 PolarHBondContact O-N 3.11Å; Y106-L110 VanDerWaalsContact O-N 3.12Å
107	P	65.7	Low	66.5	Low	59 Å²	59	78.8 Å²	78.8	38%	0.383	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-31.7	177.6	24.4	-32.6	0	0	0	111.9	Y95 L110 K111	Y95-P107 HydrophobicContact CD1-CB 3.92Å; Y95-P107 HydrophobicContact CE1-CB 3.69Å; Y95-P107 HydrophobicContact CE1-CG 4.18Å; Y95-P107 HydrophobicContact CE2-CG 4.5Å; Y95-P107 HydrophobicContact CG-CB 4.48Å; P107-L110 PolarHBondContact O-N 3.02Å; P107-K111 VanDerWaalsContact O-CB 3.31Å; P107-K111 WeakPolarHBondContact O-CB 3.33Å; P107-K111 PolarHBondContact O-N 3.33Å
108	N	67.1	Low	66.3	Low	128 Å²	128	79 Å²	79	68%	0.684	37%	0.372	S	S	*	.	H	α-helix	trans	-67.7	-35.3	177.3	-68.9	-26	0	0	0	112.7	Y106 A112	Y106-N108 PolarHBondContact O-N 3.39Å; N108-A112 WeakPolarHBondContact O-CB 3.3Å; N108-A112 PolarHBondContact O-N 3.03Å
109	T	74.6	Confident	66.2	Low	63 Å²	63	78.9 Å²	78.9	39%	0.387	38%	0.384	S	S	.	.	H	α-helix	trans	-78.4	-33.5	177.2	56.2	0	0	0	0	111.6	Y106 H113	Y106-T109 HydrophobicContact CD2-CG2 4.49Å; Y106-T109 PolarHBondContact O-N 2.85Å; Y106-T109 VanDerWaalsContact O-N 3.15Å; Y106-T109 PolarHBondContact O-OG1 3.32Å; T109-H113 VanDerWaalsContact O-CB 3.22Å; T109-H113 WeakPolarHBondContact O-CB 3.48Å; T109-H113 PolarHBondContact O-N 3.31Å
110	L	74	Confident	65.6	Low	31 Å²	31	76.7 Å²	76.7	16%	0.162	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-52.2	165.7	172	59.6	0	0	0	111.2	C97 F104 Y106 P107 A112 H113 V114	C97-L110 HydrophobicContact CB-CD1 3.5Å; F104-L110 HydrophobicContact CB-CB 4.1Å; F104-L110 HydrophobicContact CD2-CB 4.17Å; F104-L110 HydrophobicContact CD2-CD1 3.88Å; F104-L110 HydrophobicContact CE2-CD1 4.17Å; F104-L110 HydrophobicContact CG-CB 4.14Å; Y106-L110 PolarHBondContact O-N 3.11Å; Y106-L110 VanDerWaalsContact O-N 3.12Å; P107-L110 PolarHBondContact O-N 3.02Å; L110-A112 PolarHBondContact O-N 2.91Å; L110-H113 WeakPolarHBondContact O-CA 3.29Å; L110-H113 WeakPolarHBondContact O-CB 3.31Å; L110-H113 PolarHBondContact O-N 2.8Å; L110-V114 HydrophobicContact CD1-CG2 3.82Å; L110-V114 HydrophobicContact CG-CG2 4.4Å; L110-V114 WeakPolarHBondContact O-CG2 3.46Å; L110-V114 PolarHBondContact O-N 2.8Å
111	K	66.9	Low	64.5	Low	157 Å²	157	78.8 Å²	78.8	68%	0.683	40%	0.397	S	S	*	.	H	α-helix	trans	-59.7	-43.8	-178.4	-172.1	172.2	-176.8	174.4	0	112	P107 H115	P107-K111 VanDerWaalsContact O-CB 3.31Å; P107-K111 WeakPolarHBondContact O-CB 3.33Å; P107-K111 PolarHBondContact O-N 3.33Å; K111-H115 VanDerWaalsContact O-CB 3.23Å; K111-H115 WeakPolarHBondContact O-CB 3.2Å; K111-H115 PolarHBondContact O-N 3.18Å; K111-H115 VanDerWaalsContact O-N 3.07Å
112	A	68.8	Low	63.8	Low	43 Å²	43	82.1 Å²	82.1	36%	0.355	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-40.7	173.3	0	0	0	0	0	112.2	N108 L110 F116	N108-A112 WeakPolarHBondContact O-CB 3.3Å; N108-A112 PolarHBondContact O-N 3.03Å; L110-A112 PolarHBondContact O-N 2.91Å; A112-F116 HydrophobicContact CB-CD2 4.29Å; A112-F116 WeakPolarHBondContact O-CB 3.36Å; A112-F116 VanDerWaalsContact O-CD2 3.28Å; A112-F116 WeakPolarHBondContact O-CD2 3.39Å; A112-F116 PolarHBondContact O-N 3.41Å
113	H	77.8	Confident	62.6	Low	15 Å²	15	76.8 Å²	76.8	7%	0.069	41%	0.412	C	S	.	.	H	α-helix	trans	-64.7	-46.9	177	162.9	63.6	0	0	0	112.6	C97 C100 F104 T109 L110 H115 H117 C118	C97-H113 PolarHBondContact SG-CD2 2.79Å; C97-H113 PolarHBondContact SG-NE2 2.91Å; C100-H113 VanDerWaalsContact SG-CE1 3.56Å; C100-H113 PolarHBondContact SG-NE2 3.36Å; F104-H113 HydrophobicContact CD1-CB 4.46Å; F104-H113 HydrophobicContact CE1-CB 3.63Å; F104-H113 AromaticContact CE1-CG 3.8Å; F104-H113 HydrophobicContact CE2-CB 4.3Å; F104-H113 AromaticContact CE2-CD2 3.36Å; F104-H113 WeakPolarHBondContact CE2-CD2 3.45Å; F104-H113 AromaticContact CE2-CG 3.87Å; F104-H113 HydrophobicContact CZ-CB 3.56Å; F104-H113 AromaticContact CZ-CD2 3.18Å; F104-H113 WeakPolarHBondContact CZ-CD2 3.48Å; F104-H113 AromaticContact CZ-CG 3.19Å; F104-H113 AromaticContact CZ-ND1 3.85Å; F104-H113 AromaticContact CZ-NE2 3.82Å; T109-H113 VanDerWaalsContact O-CB 3.22Å; T109-H113 WeakPolarHBondContact O-CB 3.48Å; T109-H113 PolarHBondContact O-N 3.31Å; L110-H113 WeakPolarHBondContact O-CA 3.29Å; L110-H113 WeakPolarHBondContact O-CB 3.31Å; L110-H113 PolarHBondContact O-N 2.8Å; H113-H115 VanDerWaalsContact C-N 3.34Å; H113-H115 PolarHBondContact O-N 3.32Å; H113-H117 CarbonylContact O-C 3.57Å; H113-H117 WeakPolarHBondContact O-CA 3.49Å; H113-H117 WeakPolarHBondContact O-CB 3.46Å; H113-H117 PolarHBondContact O-N 2.86Å; H113-C118 PolarHBondContact NE2-SG 2.86Å; H113-C118 VanDerWaalsContact NE2-SG 3.43Å; H113-C118 PolarHBondContact O-N 3.32Å
114	V	70.3	Confident	61.1	Low	43 Å²	43	86.3 Å²	86.3	26%	0.261	45%	0.445	S	S	.	.	I	π-helix	trans	-56.3	-51.3	175.5	172.7	0	0	0	0	110	Y99 L110 A119	Y99-V114 HydrophobicContact CD2-CG1 4.31Å; Y99-V114 HydrophobicContact CE2-CG1 4.11Å; L110-V114 HydrophobicContact CD1-CG2 3.82Å; L110-V114 HydrophobicContact CG-CG2 4.4Å; L110-V114 WeakPolarHBondContact O-CG2 3.46Å; L110-V114 PolarHBondContact O-N 2.8Å; V114-A119 PolarHBondContact O-N 2.97Å; V114-A119 VanDerWaalsContact O-N 3.12Å
115	H	61.3	Low	59.1	Low	125 Å²	125	87.2 Å²	87.2	58%	0.579	46%	0.464	S	S	*	.	I	π-helix	trans	-69	-38.5	-174.1	-170.7	-87.6	0	0	0	114.5	K111 H113	K111-H115 VanDerWaalsContact O-CB 3.23Å; K111-H115 WeakPolarHBondContact O-CB 3.2Å; K111-H115 PolarHBondContact O-N 3.18Å; K111-H115 VanDerWaalsContact O-N 3.07Å; H113-H115 VanDerWaalsContact C-N 3.34Å; H113-H115 PolarHBondContact O-N 3.32Å
116	F	56.6	Low	57	Low	123 Å²	123	93 Å²	93	54%	0.539	49%	0.49	S	S	.	.	I	π-helix	trans	-109	-15.5	-173.2	-63.2	-66.1	0	0	0	115.2	A112	A112-F116 HydrophobicContact CB-CD2 4.29Å; A112-F116 WeakPolarHBondContact O-CB 3.36Å; A112-F116 VanDerWaalsContact O-CD2 3.28Å; A112-F116 WeakPolarHBondContact O-CD2 3.39Å; A112-F116 PolarHBondContact O-N 3.41Å
117	H	56.4	Low	55.2	Low	136 Å²	136	92.7 Å²	92.7	63%	0.63	50%	0.502	S	S	*	.	I	π-helix	trans	-136	-21.6	-169.5	-72.9	-54	0	0	0	115.9	H113	H113-H117 CarbonylContact O-C 3.57Å; H113-H117 WeakPolarHBondContact O-CA 3.49Å; H113-H117 WeakPolarHBondContact O-CB 3.46Å; H113-H117 PolarHBondContact O-N 2.86Å
118	C	65.8	Low	53.7	Low	6 Å²	6	95.3 Å²	95.3	4%	0.041	52%	0.522	C	S	.	.	I	π-helix	trans	-101.1	-48.8	-177.9	-138	0	0	0	0	113.1	C97 Y99 C100 H113 L120 S121	C97-C118 VanDerWaalsContact SG-SG 3.61Å; Y99-C118 WeakPolarHBondContact CB-SG 3.33Å; C100-C118 VanDerWaalsContact CB-SG 3.58Å; C100-C118 PolarHBondContact SG-SG 2.64Å; H113-C118 PolarHBondContact NE2-SG 2.86Å; H113-C118 VanDerWaalsContact NE2-SG 3.43Å; H113-C118 PolarHBondContact O-N 3.32Å; C118-L120 PolarHBondContact O-N 2.99Å; C118-S121 PolarHBondContact O-N 3.16Å; C118-S121 PolarHBondContact O-OG 2.82Å
119	A	54.6	Low	51.8	Low	59 Å²	59	92.3 Å²	92.3	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-31.6	174.3	0	0	0	0	0	112.3	V114	V114-A119 PolarHBondContact O-N 2.97Å; V114-A119 VanDerWaalsContact O-N 3.12Å
120	L	49.7	Very low	49.6	Very low	110 Å²	110	98.5 Å²	98.5	58%	0.576	55%	0.545	S	S	*	.	H	α-helix	trans	-89.2	-2.8	-173.7	-66.3	174.9	0	0	0	115.2	C118	C118-L120 PolarHBondContact O-N 2.99Å
121	S	44.1	Very low	47.6	Very low	79 Å²	79	106.5 Å²	106.5	55%	0.552	58%	0.582	S	S	*	*	H	α-helix	trans	-86.2	-26.9	176.9	60.8	0	0	0	0	113.7	C118	C118-S121 PolarHBondContact O-N 3.16Å; C118-S121 PolarHBondContact O-OG 2.82Å
122	N	46.4	Very low	45.9	Very low	89 Å²	89	103.7 Å²	103.7	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-112.8	-32	-165.3	-62.5	8.7	0	0	0	114.6
123	G	37.7	Very low	43.9	Very low	50 Å²	50	112.6 Å²	112.6	52%	0.515	61%	0.612	S	S	.	*	S	Bend	trans	-157.2	83.5	-167.6	0	0	0	0	0	118.4
124	R	36.6	Very low	41.5	Very low	242 Å²	242	115.9 Å²	115.9	91%	0.913	65%	0.651	S	S	*	*			trans	60.4	178.1	163.4	-55.4	-174.9	-169.4	-118.5	1.3	115.7
125	G	28.6	Very low	39.6	Very low	55 Å²	55	119.8 Å²	119.8	57%	0.567	68%	0.675	S	S	*	*			trans	-98.7	160.9	-175.5	0	0	0	0	0	112.9	V127	G125-V127 PolarHBondContact O-N 3.19Å; G125-V127 VanDerWaalsContact O-N 3.08Å
126	F	25.8	Very low	38	Very low	207 Å²	207	123.4 Å²	123.4	91%	0.908	69%	0.692	S	S	*	*			trans	-61.4	106.3	175.5	-146.2	-91.2	0	0	0	110.2
127	V	30.4	Very low	36.6	Very low	127 Å²	127	123 Å²	123	77%	0.77	70%	0.704	S	S	*	*			trans	-85.7	126.5	167.3	178.6	0	0	0	0	107.2	G125	G125-V127 PolarHBondContact O-N 3.19Å; G125-V127 VanDerWaalsContact O-N 3.08Å
128	S	33.9	Very low	35.2	Very low	114 Å²	114	128 Å²	128	80%	0.797	72%	0.719	S	S	*	*			trans	-76.1	125.2	175	-62.8	0	0	0	0	110.6
129	G	28.1	Very low	33.4	Very low	65 Å²	65	132.3 Å²	132.3	67%	0.67	75%	0.749	S	S	*	*			trans	140.3	131.1	179.5	0	0	0	0	0	110.4
130	E	28.8	Very low	32.1	Very low	193 Å²	193	141.3 Å²	141.3	90%	0.902	77%	0.771	S	S	*	*			cis	-139.8	156	-3.7	-71.9	-175.6	90.8	0	0	110.7	A132	E130-A132 PolarHBondContact O-N 3.32Å
131	Q	32.1	Very low	30.9	Very low	199 Å²	199	141.3 Å²	141.3	93%	0.93	78%	0.78	S	S	*	*			trans	-88.4	88.4	-176.5	-166.4	168.9	9.4	0	0	110.8	R133	Q131-R133 PolarHBondContact O-N 2.7Å
132	A	29.2	Very low	31.3	Very low	98 Å²	98	142.5 Å²	142.5	81%	0.81	79%	0.785	S	S	*	*			trans	-70.9	88.6	-175.7	0	0	0	0	0	113.6	E130	E130-A132 PolarHBondContact O-N 3.32Å
133	R	28.6	Very low	30.5	Very low	229 Å²	229	147.3 Å²	147.3	86%	0.864	80%	0.802	S	S	*	*			trans	43.5	96.9	152.1	-64.5	179.7	177.1	161.2	0.5	118	Q131	Q131-R133 PolarHBondContact O-N 2.7Å
134	G	26.5	Very low	30.1	Very low	85 Å²	85	150.5 Å²	150.5	88%	0.876	82%	0.816	S	S	*	*			trans	-84.4	133.7	137.7	0	0	0	0	0	109.3
135	T	31	Very low	29.8	Very low	125 Å²	125	142.4 Å²	142.4	77%	0.767	81%	0.808	S	S	*	*			trans	-104.4	107.6	-176.6	50.6	0	0	0	0	112.1
136	E	27.1	Very low	29.7	Very low	201 Å²	201	146.9 Å²	146.9	94%	0.939	82%	0.819	S	S	*	*			trans	-134.8	135.7	158.1	-71.4	-159.6	147.9	0	0	111
137	S	26.9	Very low	30.2	Very low	113 Å²	113	144.4 Å²	144.4	79%	0.79	81%	0.814	S	S	*	*			trans	-103.1	128.8	-176	-58.3	0	0	0	0	110.2
138	Y	27.9	Very low	30.9	Very low	242 Å²	242	143 Å²	143	95%	0.949	81%	0.807	S	S	*	*			trans	-152.4	165.2	147	-102	-66.1	0	0	0	111.2
139	S	28.3	Very low	30.6	Very low	96 Å²	96	144.3 Å²	144.3	67%	0.671	81%	0.806	S	S	*	*			trans	-126.7	137.8	-152	52.4	0	0	0	0	114.4
140	R	26.5	Very low	30.6	Very low	249 Å²	249	146.7 Å²	146.7	94%	0.94	81%	0.807	S	S	*	*				179.4	160.8	128.3	-97.6	163.3	-176	-167.4	1.1	112.4
141	S	24.8	Very low	30.6	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	80%	0.804	S	S	*	*			trans	-132.3	-177.6	176	-142.8	0	0	0	0	107.1
142	P	51.1	Low	30.3	Very low	103 Å²	103	136.9 Å²	136.9	67%	0.669	79%	0.793	S	S	*	*			cis	-136.8	-155.1	-5.5	37.6	-15.8	0	0	0	113
143	K	30	Very low	30.3	Very low	191 Å²	191	140.9 Å²	140.9	83%	0.83	79%	0.794	S	S	*	*			trans	97.3	139.4	165.3	-58.9	179.5	-179.4	-178.3	0	116
144	S	30.6	Very low	30.1	Very low	116 Å²	116	134 Å²	134	81%	0.811	78%	0.781	S	S	*	*			cis	-172.8	147.9	-12.9	45.8	0	0	0	0	109.7
145	G	29.4	Very low	30	Very low	72 Å²	72	137.1 Å²	137.1	74%	0.742	78%	0.777	S	S	*	*			trans	153.6	75.6	169	0	0	0	0	0	117.2
146	D	27.6	Very low	29.7	Very low	150 Å²	150	135.5 Å²	135.5	80%	0.802	77%	0.772	S	S	*	*			trans	-55.8	167	158.4	-51.7	-88.4	0	0	0	112.4
147	I	35.1	Very low	29.7	Very low	154 Å²	154	130.9 Å²	130.9	79%	0.79	76%	0.761	S	S	*	*			cis	-156.4	170.4	14.1	-134.3	150.9	0	0	0	109.7
148	P	44.8	Very low	29.6	Very low	98 Å²	98	132.1 Å²	132.1	64%	0.636	76%	0.759	S	S	*	*			trans	-117.3	-153.5	-158.1	44.9	-36.4	0	0	0	116.9
149	N	27.5	Very low	29.7	Very low	142 Å²	142	124.5 Å²	124.5	76%	0.759	74%	0.741	S	S	*	*			trans	87.6	150	165.2	-68.9	-12.2	0	0	0	118.3
150	T	29	Very low	29.6	Very low	114 Å²	114	126.1 Å²	126.1	70%	0.699	74%	0.742	S	S	*	*			cis	-163.1	155.4	-1.3	10.1	0	0	0	0	112.9
151	S	28.9	Very low	29.8	Very low	120 Å²	120	123.1 Å²	123.1	84%	0.839	73%	0.731	S	S	*	*			trans	59	157.1	151.1	61.7	0	0	0	0	120.7
152	G	26.7	Very low	29.9	Very low	67 Å²	67	127.9 Å²	127.9	69%	0.691	73%	0.732	S	S	*	*			cis	168.6	164.6	-7.5	0	0	0	0	0	113.9
153	H	28.3	Very low	28.7	Very low	182 Å²	182	129 Å²	129	84%	0.843	74%	0.737	S	S	*	*			trans	63.1	93.3	160.6	-67.5	-69.2	0	0	0	123.7
154	S	25.1	Very low	28.4	Very low	83 Å²	83	126.9 Å²	126.9	58%	0.58	74%	0.74	S	S	*	*				35.4	142.2	108.4	65	0	0	0	0	123.9
155	N	24.2	Very low	28.2	Very low	151 Å²	151	126.4 Å²	126.4	81%	0.807	74%	0.737	S	S	*	*			trans	102.1	156.2	157.2	-58.1	-9.8	0	0	0	117.2
156	S	24.3	Very low	28.1	Very low	92 Å²	92	128 Å²	128	64%	0.643	74%	0.736	S	S	*	*				174.4	155.7	-53.2	53.5	0	0	0	0	109.6
157	S	27.7	Very low	28.1	Very low	104 Å²	104	128.7 Å²	128.7	73%	0.727	74%	0.739	S	S	*	*			trans	61.3	160.9	168.6	30.4	0	0	0	0	116.3
158	D	24.6	Very low	28.5	Very low	139 Å²	139	126.7 Å²	126.7	74%	0.743	74%	0.736	S	S	*	*			cis	-154	128.5	-9.6	-116.3	-55.8	0	0	0	106.4
159	S	29.2	Very low	27.6	Very low	81 Å²	81	131.6 Å²	131.6	57%	0.566	75%	0.748	S	S	*	*				76.2	144.5	85.1	89.7	0	0	0	0	118.7
160	N	26.7	Very low	28.2	Very low	131 Å²	131	130.3 Å²	130.3	70%	0.701	75%	0.747	S	S	*	*			trans	71.4	150.8	170.1	-63.2	-78.5	0	0	0	117.3
161	R	29.8	Very low	28.1	Very low	185 Å²	185	129.9 Å²	129.9	70%	0.698	75%	0.749	S	S	*	*			cis	-163.3	155.6	-4.9	-123.7	173	-175.1	-172.1	0.9	114.5
162	R	27	Very low	28	Very low	211 Å²	211	130 Å²	130	80%	0.796	74%	0.74	S	S	*	*			trans	78.1	153.6	145.1	-82	173.1	-179.1	177.6	-2.7	122.5
163	T	26	Very low	28.1	Very low	125 Å²	125	135.8 Å²	135.8	77%	0.767	75%	0.746	S	S	*	*			trans	-123	157	-164.2	49.1	0	0	0	0	112.8
164	V	24.2	Very low	27.9	Very low	148 Å²	148	131.1 Å²	131.1	90%	0.897	75%	0.747	S	S	*	*			trans	-142.2	156.6	152.8	-174.9	0	0	0	0	108.9
165	S	26.5	Very low	27.9	Very low	106 Å²	106	131 Å²	131	74%	0.741	76%	0.76	S	S	*	*			trans	-139.3	153.6	-168.5	-43.2	0	0	0	0	113.7
166	S	26.8	Very low	27.9	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	76%	0.763	S	S	*	*			trans	178.4	122.7	147.6	25.6	0	0	0	0	112.9
167	L	28.1	Very low	28	Very low	164 Å²	164	132 Å²	132	86%	0.859	76%	0.764	S	S	*	*				93	164.2	94.7	-68.9	173.7	0	0	0	114
168	P	42.5	Very low	28	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	77%	0.769	S	S	*	*				-138	-178.5	-51.2	41.2	-24.9	0	0	0	117.1
169	F	26.1	Very low	28	Very low	202 Å²	202	139 Å²	139	89%	0.886	77%	0.774	S	S	*	*			trans	-61.6	168.2	176.2	-72.9	-85.8	0	0	0	117.8
170	P	39.9	Very low	27.8	Very low	114 Å²	114	139.8 Å²	139.8	74%	0.74	78%	0.78	S	S	*	*				-156.5	145.9	86.3	39.3	-18.1	0	0	0	121
171	S	28.6	Very low	27.7	Very low	106 Å²	106	139.1 Å²	139.1	74%	0.741	79%	0.786	S	S	*	*			trans	58.1	157.9	132.4	-56.3	0	0	0	0	122.9
172	N	26.7	Very low	27.6	Very low	122 Å²	122	134.7 Å²	134.7	65%	0.652	79%	0.789	S	S	*	*			cis	-162	161.2	-0.4	-132.3	-28.9	0	0	0	112.7
173	K	28.9	Very low	27.7	Very low	189 Å²	189	132.9 Å²	132.9	82%	0.822	79%	0.789	S	S	*	*			trans	32	145.7	152.7	-65	159.3	-174	-178.8	0	121.9
174	G	23.8	Very low	27.8	Very low	83 Å²	83	134.2 Å²	134.2	86%	0.856	79%	0.787	S	S	*	*			cis	140.2	141.6	-1.8	0	0	0	0	0	112.9
175	G	24	Very low	28.2	Very low	82 Å²	82	135.5 Å²	135.5	85%	0.845	78%	0.783	S	S	*	*			trans	159.2	130.8	171.8	0	0	0	0	0	119.1
176	L	25.2	Very low	28.3	Very low	168 Å²	168	137.6 Å²	137.6	88%	0.88	79%	0.786	S	S	*	*			trans	-57.8	157	-173.4	-86.6	65.9	0	0	0	121.6
177	S	26.1	Very low	28.5	Very low	95 Å²	95	144.4 Å²	144.4	66%	0.664	80%	0.796	S	S	*	*				110.9	110.4	126.2	-85.9	0	0	0	0	124.4
178	K	26.9	Very low	28.6	Very low	192 Å²	192	140.5 Å²	140.5	84%	0.835	79%	0.787	S	S	*	*			trans	70	118	130.6	-73	-179	175.1	173.9	0	124
179	K	24.8	Very low	28.5	Very low	197 Å²	197	143.4 Å²	143.4	86%	0.857	80%	0.795	S	S	*	*				111.4	141.2	121.6	-115.5	-170.2	179	-167.6	0	121
180	S	24.4	Very low	29.3	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	79%	0.793	S	S	*	*			trans	77.2	106	154.2	25.6	0	0	0	0	123.4
181	S	24.8	Very low	28.6	Very low	116 Å²	116	144 Å²	144	81%	0.811	80%	0.798	S	S	*	*				73.8	140	123.3	61.8	0	0	0	0	124.7
182	A	29.2	Very low	28.7	Very low	92 Å²	92	143.6 Å²	143.6	76%	0.76	80%	0.796	S	S	*	*			trans	96.3	145.7	150.7	0	0	0	0	0	120.5
183	E	27.5	Very low	28.8	Very low	173 Å²	173	144.5 Å²	144.5	81%	0.808	81%	0.805	S	S	*	*			trans	-54.9	164.1	172.5	-72	109.2	134	0	0	115.3
184	E	29.8	Very low	28.7	Very low	153 Å²	153	140.1 Å²	140.1	72%	0.715	80%	0.804	S	S	*	*			cis	-165.4	172.8	-11.7	163.4	177.1	138.1	0	0	108.5
185	Q	31.6	Very low	28.7	Very low	175 Å²	175	142 Å²	142	82%	0.818	81%	0.805	S	S	*	*			trans	96.8	144.8	155.2	-103.3	154.7	64.5	0	0	118.6
186	D	28.8	Very low	28.9	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	80%	0.801	S	S	*	*			trans	-140.6	117.5	-151.8	-166.2	0.7	0	0	0	111.9
187	R	31.8	Very low	29	Very low	248 Å²	248	145.4 Å²	145.4	94%	0.936	80%	0.8	S	S	*	*			trans	-163.8	143.2	158.1	-127	172.7	172.3	76.7	1.4	111
188	A	28.4	Very low	28.9	Very low	82 Å²	82	146.8 Å²	146.8	68%	0.678	80%	0.8	S	S	*	*			trans	-126	-171.5	-160.9	0	0	0	0	0	114.3
189	L	42.1	Very low	29	Very low	173 Å²	173	146.4 Å²	146.4	91%	0.906	80%	0.801	S	S	*	*			trans	83.1	118.3	-179.2	-47.2	172.9	0	0	0	113
190	D	41.3	Very low	29	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	80%	0.796	S	S	*	*			cis	-136.6	-170.9	5.1	-159.1	-5	0	0	0	111.3	S192	D190-S192 PolarHBondContact O-N 3.14Å; D190-S192 VanDerWaalsContact O-N 3.15Å
191	M	25.2	Very low	29.3	Very low	170 Å²	170	144.6 Å²	144.6	84%	0.837	80%	0.804	S	S	*	*			trans	-78.4	98.6	-161.7	-148.3	170.6	68.7	0	0	115.8
192	S	30.6	Very low	29.3	Very low	99 Å²	99	145.3 Å²	145.3	69%	0.692	80%	0.798	S	S	*	*			trans	79	121.1	140.2	-71	0	0	0	0	123.2	D190	D190-S192 PolarHBondContact O-N 3.14Å; D190-S192 VanDerWaalsContact O-N 3.15Å
193	V	28.7	Very low	29.4	Very low	141 Å²	141	149 Å²	149	86%	0.855	80%	0.804	S	S	*	*			trans	94.9	139.6	131.4	169.8	0	0	0	0	121.1
194	A	26.7	Very low	29.3	Very low	96 Å²	96	143.6 Å²	143.6	79%	0.793	80%	0.795	S	S	*	*			trans	89.2	116.9	165.7	0	0	0	0	0	119.2
195	S	25.8	Very low	29.4	Very low	124 Å²	124	145.6 Å²	145.6	87%	0.867	81%	0.809	S	S	*	*			trans	-79.8	151.8	-178	-40.2	0	0	0	0	114.7
196	A	26.7	Very low	29.2	Very low	92 Å²	92	140.8 Å²	140.8	76%	0.76	81%	0.807	S	S	*	*				-178.6	138.8	113.4	0	0	0	0	0	115.6
197	R	28.1	Very low	29.2	Very low	229 Å²	229	138.4 Å²	138.4	86%	0.864	81%	0.808	S	S	*	*			trans	43.5	125.8	145.6	-78.5	-179.9	166.5	156.8	-3.6	123.2
198	N	24.6	Very low	29.3	Very low	123 Å²	123	131 Å²	131	66%	0.658	80%	0.8	S	S	*	*			trans	86.1	124.1	131.4	-74.5	16.2	0	0	0	122.9
199	Q	28.8	Very low	29.5	Very low	185 Å²	185	132 Å²	132	86%	0.864	80%	0.802	S	S	*	*			trans	65.5	126.5	134.8	-65.6	175.8	-20.2	0	0	121.6
200	G	25.1	Very low	29.2	Very low	73 Å²	73	128.9 Å²	128.9	75%	0.753	79%	0.794	S	S	*	*				125.1	77.9	118	0	0	0	0	0	121.3
201	H	29.1	Very low	28.7	Very low	185 Å²	185	127.6 Å²	127.6	86%	0.856	79%	0.792	S	S	*	*			trans	54.5	139.7	132.1	-102.9	-46.5	0	0	0	124.9
202	L	25.9	Very low	28.9	Very low	131 Å²	131	127.5 Å²	127.5	69%	0.686	79%	0.794	S	S	*	*			trans	107.9	131.8	130.4	-123.3	74.7	0	0	0	121.7
203	L	30.2	Very low	28.7	Very low	168 Å²	168	126.1 Å²	126.1	88%	0.88	80%	0.795	S	S	*	*			trans	62.3	150.8	162	-51.7	-177.3	0	0	0	119.8
204	G	26.1	Very low	28.8	Very low	61 Å²	61	125.1 Å²	125.1	63%	0.629	79%	0.794	S	S	*	*			cis	159.5	151.3	-12	0	0	0	0	0	115
205	L	32.5	Very low	29	Very low	194 Å²	194	129.5 Å²	129.5	100%	1.016	80%	0.801	S	S	*	*			trans	70.3	151.1	174.7	-53	161.6	0	0	0	115.8
206	G	25.8	Very low	29.3	Very low	75 Å²	75	126.6 Å²	126.6	77%	0.773	79%	0.79	S	S	*	*			cis	151.8	157.4	-6.1	0	0	0	0	0	111.3
207	A	29.1	Very low	29.3	Very low	99 Å²	99	132.3 Å²	132.3	82%	0.818	80%	0.798	S	S	*	*			cis	-172.1	169.4	-15.6	0	0	0	0	0	111.2
208	A	34.8	Very low	29.5	Very low	93 Å²	93	130 Å²	130	77%	0.769	80%	0.797	S	S	*	*			trans	71.7	154.8	156.4	0	0	0	0	0	121.4
209	S	33.2	Very low	30.6	Very low	104 Å²	104	130.4 Å²	130.4	73%	0.727	81%	0.806	S	S	*	*			cis	-170.4	141.4	-21.5	-94.9	0	0	0	0	115.2
210	S	35.3	Very low	30.4	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	80%	0.804	S	S	*	*			trans	56.9	161.4	137.1	71.4	0	0	0	0	125.9
211	V	30.8	Very low	30.6	Very low	131 Å²	131	128.1 Å²	128.1	79%	0.794	81%	0.806	S	S	*	*			trans	92.7	129.2	166.9	178.5	0	0	0	0	114.2
212	L	30.1	Very low	30.7	Very low	169 Å²	169	130.7 Å²	130.7	89%	0.885	81%	0.808	S	S	*	*			cis	-156.6	171.6	-5.7	-128.6	178.2	0	0	0	111.1
213	G	25	Very low	30.8	Very low	69 Å²	69	129.5 Å²	129.5	71%	0.711	81%	0.811	S	S	*	*			trans	130.9	116.5	154.9	0	0	0	0	0	117
214	S	30.5	Very low	31	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	80%	0.797	S	S	*	*			trans	-162	133.4	177.4	178.9	0	0	0	0	113.6
215	M	31.8	Very low	31.3	Very low	189 Å²	189	131.5 Å²	131.5	93%	0.931	81%	0.809	S	S	*	*			trans	170.7	163.4	139	-101.4	-171.7	172	0	0	112.3
216	G	33	Very low	31.2	Very low	62 Å²	62	130 Å²	130	64%	0.639	79%	0.794	S	S	*	*			trans	-167.5	153.2	164.3	0	0	0	0	0	111.7
217	F	26.3	Very low	31.9	Very low	213 Å²	213	132.1 Å²	132.1	93%	0.934	79%	0.794	S	S	*	*			trans	-164.1	163.8	169.5	-102.3	-71.1	0	0	0	111.6
218	H	31.8	Very low	32.1	Very low	180 Å²	180	133 Å²	133	83%	0.833	79%	0.789	S	S	*	*			trans	-90.3	-166.9	176.5	-59	-89.3	0	0	0	111.8
219	P	48.6	Very low	32	Very low	132 Å²	132	132.1 Å²	132.1	86%	0.857	79%	0.789	S	S	*	*			cis	-129.7	-174	-17.2	24.1	0.7	0	0	0	114.1
220	G	24.3	Very low	32.1	Very low	79 Å²	79	133.4 Å²	133.4	81%	0.814	79%	0.792	S	S	*	*			trans	-161.3	116.9	175.7	0	0	0	0	0	117.5
221	V	29.4	Very low	31.9	Very low	131 Å²	131	133.7 Å²	133.7	79%	0.794	80%	0.795	S	S	*	*			trans	-83.9	144.2	-162.4	-155.5	0	0	0	0	117.1
222	R	30.5	Very low	31.7	Very low	239 Å²	239	137 Å²	137	90%	0.902	80%	0.798	S	S	*	*			trans	171.6	126.6	138.5	-94.1	163	-163.6	-91	3.6	109.5
223	S	28.8	Very low	31.7	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	79%	0.794	S	S	*	*			cis	80	129.2	20.3	-144.5	0	0	0	0	114.1
224	A	34	Very low	32.4	Very low	72 Å²	72	137.8 Å²	137.8	60%	0.595	80%	0.798	S	S	*	*			cis	-170	152.4	3.2	0	0	0	0	0	115.4
225	F	32.8	Very low	32.1	Very low	200 Å²	200	135.6 Å²	135.6	88%	0.877	79%	0.794	S	S	*	*			trans	61.2	167.9	151	-78.9	-102.7	0	0	0	119.1
226	K	28.6	Very low	31.8	Very low	163 Å²	163	131.8 Å²	131.8	71%	0.709	79%	0.793	S	S	*	*			cis	-158	151.2	20.6	-158.6	173.9	-174.6	177.6	0	113.8
227	P	42.2	Very low	31.3	Very low	118 Å²	118	137.4 Å²	137.4	77%	0.766	80%	0.803	S	S	*	*			trans	-136.2	148.2	144.7	37.9	-26.1	0	0	0	114.8
228	T	32.8	Very low	31.2	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.724	80%	0.798	S	S	*	*			trans	-166	146.9	176.9	44.6	0	0	0	0	108.5
229	G	32.8	Very low	30.8	Very low	74 Å²	74	129.1 Å²	129.1	76%	0.763	79%	0.791	S	S	*	*			cis	171.6	-155.7	2.7	0	0	0	0	0	108
230	V	34.2	Very low	29.7	Very low	131 Å²	131	132.1 Å²	132.1	79%	0.794	79%	0.786	S	S	*	*			cis	-160.8	123.3	-3.9	-178.4	0	0	0	0	110
231	S	32	Very low	29.8	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	78%	0.778	S	S	*	*			trans	65.6	166.1	158.6	-58.5	0	0	0	0	119.7
232	K	25.8	Very low	29.7	Very low	199 Å²	199	137 Å²	137	87%	0.865	78%	0.778	S	S	*	*			cis	-157.4	169.8	28.1	-160.5	171	-179.4	179	0	113.5
233	V	31.4	Very low	29.6	Very low	133 Å²	133	130.2 Å²	130.2	81%	0.806	77%	0.774	S	S	*	*			trans	-140	138.8	-178.1	168.6	0	0	0	0	107.6
234	P	38.7	Very low	29.4	Very low	122 Å²	122	128.9 Å²	128.9	79%	0.792	78%	0.776	S	S	*	*				-138.3	-172.5	64.6	39.6	-19.9	0	0	0	114.5
235	G	25.2	Very low	29	Very low	74 Å²	74	129.1 Å²	129.1	76%	0.763	79%	0.786	S	S	*	*			cis	123.7	114.6	-5.7	0	0	0	0	0	114.8
236	A	24.7	Very low	28.8	Very low	109 Å²	109	128.8 Å²	128.8	90%	0.901	78%	0.784	S	S	*	*			trans	-165.9	-175.6	175.7	0	0	0	0	0	111.9
237	E	23.4	Very low	28.8	Very low	181 Å²	181	128.1 Å²	128.1	85%	0.846	79%	0.787	S	S	*	*			trans	-109.1	176.8	-167.3	-51.8	176.9	121.8	0	0	115.6
238	S	23.8	Very low	28.2	Very low	118 Å²	118	128.1 Å²	128.1	83%	0.825	79%	0.79	S	S	*	*			trans	70.2	161.7	163.7	78.5	0	0	0	0	117.8
239	S	23.5	Very low	27.9	Very low	100 Å²	100	125.8 Å²	125.8	70%	0.699	79%	0.79	S	S	*	*			cis	-171.2	155.8	-27.8	53	0	0	0	0	112
240	R	25.5	Very low	27.9	Very low	196 Å²	196	131 Å²	131	74%	0.74	80%	0.799	S	S	*	*			trans	53.3	136.8	154.2	-72.4	177.3	73.4	140.8	2.5	122.2
241	E	26	Very low	27.4	Very low	141 Å²	141	127.8 Å²	127.8	66%	0.659	79%	0.792	S	S	*	*			trans	61.2	174	140	-69.7	163.4	173	0	0	119.4
242	E	27.4	Very low	27.3	Very low	170 Å²	170	132.1 Å²	132.1	79%	0.794	80%	0.797	S	S	*	*				-162.8	159.2	-56.6	-156.9	-148.3	128.9	0	0	106.9
243	A	28.3	Very low	27.5	Very low	97 Å²	97	127.4 Å²	127.4	80%	0.802	79%	0.789	S	S	*	*			trans	58	170.8	179.2	0	0	0	0	0	115.4
244	G	25.3	Very low	27.5	Very low	77 Å²	77	130.2 Å²	130.2	79%	0.794	79%	0.791	S	S	*	*			cis	150.3	135.1	-15.2	0	0	0	0	0	112.7
245	G	25.7	Very low	27.2	Very low	77 Å²	77	132.7 Å²	132.7	79%	0.794	80%	0.796	S	S	*	*			trans	105.2	96.3	160.3	0	0	0	0	0	119.6
246	K	27.9	Very low	27.4	Very low	193 Å²	193	136.7 Å²	136.7	84%	0.839	80%	0.799	S	S	*	*				36.3	122.1	127	-73.8	178.3	173.5	177.7	0	122.4
247	L	27.3	Very low	27.6	Very low	149 Å²	149	134.5 Å²	134.5	78%	0.78	79%	0.787	S	S	*	*				85.2	128.7	121.7	-73.5	169	0	0	0	123.8
248	S	29.7	Very low	27.9	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	78%	0.783	S	S	*	*			trans	83.4	129.1	137.8	-64.9	0	0	0	0	121.7
249	G	27	Very low	28.2	Very low	69 Å²	69	134.5 Å²	134.5	71%	0.711	78%	0.78	S	S	*	*			trans	170.1	56.7	166	0	0	0	0	0	120.5
250	L	32.4	Very low	28.7	Very low	185 Å²	185	137.2 Å²	137.2	97%	0.969	78%	0.779	S	S	*	*			trans	63.2	161.3	159.9	-51.9	169.4	0	0	0	117.3
251	G	25.4	Very low	29.4	Very low	62 Å²	62	134.2 Å²	134.2	64%	0.639	79%	0.785	S	S	*	*			cis	170.8	140.3	-13.7	0	0	0	0	0	113.7
252	F	29.3	Very low	29.6	Very low	204 Å²	204	133.7 Å²	133.7	90%	0.895	79%	0.786	S	S	*	*			trans	84.3	132.1	164.4	-78.6	-84.2	0	0	0	124
253	S	30.1	Very low	29.7	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	79%	0.788	S	S	*	*			trans	96.5	94.7	141.5	-66.9	0	0	0	0	123.4
254	K	31	Very low	29.6	Very low	191 Å²	191	138.4 Å²	138.4	83%	0.83	79%	0.786	S	S	*	*				51	125.5	128.1	-81.1	175.7	170.9	173.3	0	121.6
255	L	32.8	Very low	29.7	Very low	174 Å²	174	143.5 Å²	143.5	91%	0.911	79%	0.794	S	S	*	*				-158.2	167.9	106.9	-109.3	169.2	0	0	0	112.1
256	I	30	Very low	29.8	Very low	159 Å²	159	142.8 Å²	142.8	82%	0.815	79%	0.787	S	S	*	*			trans	-141.9	143	-166.9	-65.2	174.5	0	0	0	111.5
257	G	27.4	Very low	29.8	Very low	63 Å²	63	143 Å²	143	65%	0.649	79%	0.791	S	S	*	*			trans	163.7	155.8	164.2	0	0	0	0	0	111.1
258	N	29.3	Very low	29.8	Very low	144 Å²	144	138.9 Å²	138.9	77%	0.77	79%	0.785	S	S	*	*			cis	-155.9	126.3	-10.1	-117.6	10.6	0	0	0	106.8
259	M	31.9	Very low	29.8	Very low	154 Å²	154	140.8 Å²	140.8	76%	0.759	79%	0.785	S	S	*	*				102.3	143.7	85.5	-81	-65.7	175.3	0	0	115.6
260	K	33.2	Very low	30	Very low	158 Å²	158	144.9 Å²	144.9	69%	0.687	79%	0.791	S	S	*	*			trans	-69.4	176.8	-173.4	-47.6	158.2	-178.7	170.1	0	114	I262	K260-I262 HydrophobicContact CB-CG1 4.49Å; K260-I262 HydrophobicContact CD-CD1 3.94Å; K260-I262 HydrophobicContact CD-CG1 4.21Å
261	P	39.8	Very low	29.7	Very low	132 Å²	132	139.5 Å²	139.5	86%	0.857	78%	0.779	S	S	*	*			trans	-110.2	162.5	134.3	35.6	-31.2	0	0	0	112.9
262	I	29.8	Very low	29.9	Very low	131 Å²	131	142.1 Å²	142.1	67%	0.672	80%	0.795	S	S	*	*			trans	-140.2	129.7	-177.2	-74.5	-179	0	0	0	111.2	K260	K260-I262 HydrophobicContact CB-CG1 4.49Å; K260-I262 HydrophobicContact CD-CD1 3.94Å; K260-I262 HydrophobicContact CD-CG1 4.21Å
263	R	30.3	Very low	29.8	Very low	222 Å²	222	136.1 Å²	136.1	84%	0.838	79%	0.791	S	S	*	*			trans	33.9	137.6	148.5	-74.5	-174.8	174.9	169.5	-2.6	124.1
264	N	27.1	Very low	29.7	Very low	143 Å²	143	137 Å²	137	77%	0.765	80%	0.797	S	S	*	*			trans	86.2	107.8	132.9	-71.8	23.2	0	0	0	122.7
265	L	26.9	Very low	29.7	Very low	184 Å²	184	136.6 Å²	136.6	96%	0.963	80%	0.798	S	S	*	*			trans	-155.3	161.1	134.4	-133.2	69.8	0	0	0	105.4
266	G	27.3	Very low	30.2	Very low	62 Å²	62	133.9 Å²	133.9	64%	0.639	79%	0.79	S	S	*	*			cis	167.9	160.1	-1.3	0	0	0	0	0	108.1
267	E	27.1	Very low	31.2	Very low	197 Å²	197	131.7 Å²	131.7	92%	0.921	79%	0.786	S	S	*	*			trans	-64.5	161.3	173.9	-58.1	104.8	124.5	0	0	112.5
268	G	27.2	Very low	31.2	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	80%	0.797	S	S	*	*			cis	142	149.3	1	0	0	0	0	0	110.6
269	L	31.6	Very low	31.1	Very low	158 Å²	158	137.3 Å²	137.3	83%	0.827	80%	0.8	S	S	*	*			trans	171.7	133.3	158.8	-97.9	162.5	0	0	0	113.6
270	N	30.1	Very low	31	Very low	155 Å²	155	134.4 Å²	134.4	83%	0.829	80%	0.801	S	S	*	*			trans	34.9	140.2	152.2	-57.4	-11.2	0	0	0	123.1
271	G	27.1	Very low	31.6	Very low	71 Å²	71	132.8 Å²	132.8	73%	0.732	81%	0.807	S	S	*	*			cis	168.1	163.8	-4.3	0	0	0	0	0	114.2
272	A	28.3	Very low	31	Very low	117 Å²	117	130.3 Å²	130.3	97%	0.967	80%	0.797	S	S	*	*			trans	57.4	143.1	-179.8	0	0	0	0	0	116.5
273	G	28	Very low	30.9	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	80%	0.803	S	S	*	*			cis	143.8	142.3	11.5	0	0	0	0	0	106.9
274	S	28	Very low	30.8	Very low	121 Å²	121	126.9 Å²	126.9	85%	0.846	80%	0.8	S	S	*	*			cis	-149.8	162.1	8.2	54.3	0	0	0	0	112.8
275	H	29.9	Very low	30.7	Very low	182 Å²	182	126.6 Å²	126.6	84%	0.843	80%	0.798	S	S	*	*			trans	-78.9	-174.2	173.1	-80.3	-46.6	0	0	0	112.3
276	P	44	Very low	30.6	Very low	116 Å²	116	121.9 Å²	121.9	75%	0.753	78%	0.781	S	S	*	*			cis	-142.5	-148.7	20.7	37.1	-9.9	0	0	0	116
277	P	51.3	Low	30.6	Very low	113 Å²	113	125.4 Å²	125.4	73%	0.734	79%	0.79	S	S	*	*				-111.4	165.3	-88.7	36	-20	0	0	0	113.4
278	K	27.3	Very low	30.7	Very low	201 Å²	201	121.4 Å²	121.4	87%	0.874	78%	0.784	S	S	*	*			cis	94.5	140.2	29.4	-148.1	176.9	-171.5	-178.7	0	114.3
279	C	26.6	Very low	31.2	Very low	124 Å²	124	124 Å²	124	84%	0.838	79%	0.789	S	S	*	*			trans	-113.6	-168.7	-152.7	-35.2	0	0	0	0	115.4
280	A	29.6	Very low	30.9	Very low	94 Å²	94	124.4 Å²	124.4	78%	0.777	79%	0.789	S	S	*	*			trans	76.9	170	166	0	0	0	0	0	115
281	P	45.5	Very low	30.8	Very low	124 Å²	124	122.8 Å²	122.8	81%	0.805	78%	0.784	S	S	*	*			cis	-128.7	-156.1	7.1	38.7	-18.2	0	0	0	113.6
282	A	27.3	Very low	31.3	Very low	80 Å²	80	125.1 Å²	125.1	66%	0.661	79%	0.786	S	S	*	*				-170.5	-174.2	-63.7	0	0	0	0	0	109.6
283	I	28.3	Very low	31.2	Very low	153 Å²	153	125.9 Å²	125.9	79%	0.785	78%	0.783	S	S	*	*			trans	79.7	118.7	156.4	-65.2	165.2	0	0	0	118.7
284	V	28.3	Very low	31.1	Very low	128 Å²	128	126 Å²	126	78%	0.776	78%	0.784	S	S	*	*			trans	34.2	160.4	155.9	-47.4	0	0	0	0	121.2
285	D	24.2	Very low	31.3	Very low	136 Å²	136	128 Å²	128	73%	0.727	79%	0.785	S	S	*	*			cis	-160.2	167.6	16.7	-146.7	-23.9	0	0	0	112.5
286	S	24.7	Very low	32.2	Very low	86 Å²	86	123.8 Å²	123.8	60%	0.601	77%	0.774	S	S	*	*			trans	33.6	152.3	150.2	80.4	0	0	0	0	125.2
287	T	27.6	Very low	31.6	Very low	136 Å²	136	126.2 Å²	126.2	83%	0.834	78%	0.777	S	S	*	*			trans	71	117.8	157.3	58.2	0	0	0	0	121.5
288	S	28.9	Very low	30.5	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	79%	0.787	S	S	*	*			trans	-68	158.3	150	-31.1	0	0	0	0	110.3
289	P	39.4	Very low	30.4	Very low	118 Å²	118	126.7 Å²	126.7	77%	0.766	78%	0.782	S	S	*	*				-154.5	152.7	70.5	39.9	-19.3	0	0	0	119.3
290	M	24.7	Very low	30.4	Very low	168 Å²	168	130.5 Å²	130.5	83%	0.828	79%	0.785	S	S	*	*			trans	36.6	143.6	138.5	-84.1	173.2	68.3	0	0	124.9
291	V	28	Very low	30.9	Very low	121 Å²	121	131.4 Å²	131.4	73%	0.733	78%	0.783	S	S	*	*			trans	76.1	154.2	143.9	166.4	0	0	0	0	116.3
292	P	37.8	Very low	30	Very low	119 Å²	119	132.6 Å²	132.6	77%	0.773	78%	0.782	S	S	*	*			cis	-122.2	-179.7	-0	27.1	-5.1	0	0	0	116.4
293	C	25.7	Very low	30.1	Very low	133 Å²	133	135.1 Å²	135.1	90%	0.899	78%	0.783	S	S	*	*			trans	-70.8	158.1	163.6	-47.4	0	0	0	0	113.1
294	G	26.3	Very low	30.7	Very low	80 Å²	80	133.5 Å²	133.5	83%	0.825	78%	0.783	S	S	*	*			trans	177.2	100.1	168.5	0	0	0	0	0	116.5
295	N	30.9	Very low	30.6	Very low	163 Å²	163	133.8 Å²	133.8	87%	0.872	78%	0.776	S	S	*	*			trans	-82	173.9	166	-115.1	-0.3	0	0	0	110.4
296	P	49.8	Very low	30.7	Very low	95 Å²	95	134 Å²	134	62%	0.617	78%	0.781	S	S	*	*			cis	-140.5	-165.5	-4.8	29.9	-4.4	0	0	0	115.1
297	M	30.5	Very low	30.8	Very low	166 Å²	166	136.3 Å²	136.3	82%	0.818	78%	0.783	S	S	*	*			trans	112.8	142.3	143.1	-76.1	-68.3	145	0	0	122.9
298	R	28.8	Very low	30.8	Very low	249 Å²	249	137.5 Å²	137.5	94%	0.94	78%	0.779	S	S	*	*			trans	71.1	139.6	174.2	-60.2	-177.4	177.4	-170.8	-1.1	116.6
299	G	24.6	Very low	30.8	Very low	75 Å²	75	138 Å²	138	77%	0.773	78%	0.777	S	S	*	*			cis	-171	169.5	-3.1	0	0	0	0	0	114.3
300	F	26.9	Very low	30.2	Very low	205 Å²	205	137.8 Å²	137.8	90%	0.899	78%	0.779	S	S	*	*			trans	-86	172.1	-178.5	-78.5	-87.5	0	0	0	113.9
301	P	39.8	Very low	30.2	Very low	113 Å²	113	133.7 Å²	133.7	73%	0.734	77%	0.771	S	S	*	*				-143.1	140.7	97.8	26.9	-6.9	0	0	0	117.8
302	L	27.4	Very low	30.1	Very low	148 Å²	148	136.9 Å²	136.9	78%	0.775	78%	0.776	S	S	*	*			trans	57.1	127.7	143	-50.4	174.7	0	0	0	120.4
303	L	28.6	Very low	29.7	Very low	133 Å²	133	139.9 Å²	139.9	70%	0.696	78%	0.777	S	S	*	*			cis	85	153.2	42.4	-72.5	177	0	0	0	115.5	H305	L303-H305 HydrophobicContact CD2-CB 3.67Å
304	P	41.2	Very low	29.8	Very low	120 Å²	120	141 Å²	141	78%	0.779	77%	0.768	S	S	*	*			cis	-111.8	174.4	-3.7	41.4	-31.5	0	0	0	113.6
305	H	27	Very low	29.8	Very low	134 Å²	134	144.1 Å²	144.1	62%	0.62	77%	0.771	S	S	*	*			cis	89.6	90.3	4.3	-151.8	-53.5	0	0	0	118.9	L303 E307	L303-H305 HydrophobicContact CD2-CB 3.67Å; H305-E307 IonicContact CE1-OE1 3.09Å; H305-E307 IonicContact CE1-OE2 2.63Å; H305-E307 PolarHBondContact CE1-OE2 2.93Å; H305-E307 IonicContact ND1-OE2 3.97Å; H305-E307 PolarHBondContact ND1-OE2 3.49Å
306	V	24.9	Very low	29.7	Very low	139 Å²	139	143.2 Å²	143.2	84%	0.842	76%	0.762	S	S	*	*			trans	-145.2	144.9	155	177.2	0	0	0	0	110.2
307	E	27.2	Very low	28.5	Very low	135 Å²	135	143.4 Å²	143.4	63%	0.631	77%	0.765	S	S	*	*			trans	-93.4	-148.7	-178.3	-57.7	92.5	98.6	0	0	111.7	H305	H305-E307 IonicContact CE1-OE1 3.09Å; H305-E307 IonicContact CE1-OE2 2.63Å; H305-E307 PolarHBondContact CE1-OE2 2.93Å; H305-E307 IonicContact ND1-OE2 3.97Å; H305-E307 PolarHBondContact ND1-OE2 3.49Å
308	E	29.2	Very low	28.3	Very low	161 Å²	161	146 Å²	146	75%	0.752	77%	0.766	S	S	*	*			cis	-164.4	-173.9	9.1	-151.3	-92.9	103.3	0	0	108.8
309	T	27.4	Very low	28.2	Very low	123 Å²	123	140.8 Å²	140.8	76%	0.755	76%	0.756	S	S	*	*			trans	89	170.5	162.4	76.5	0	0	0	0	119.5
310	S	27.2	Very low	28.4	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	76%	0.758	S	S	*	*			trans	-148	167.2	-149.2	-173.8	0	0	0	0	114.3
311	A	24.2	Very low	28.5	Very low	82 Å²	82	142.2 Å²	142.2	68%	0.678	75%	0.753	S	S	*	*			trans	62.8	114	161	0	0	0	0	0	120.1
312	F	26.1	Very low	27.8	Very low	189 Å²	189	140.1 Å²	140.1	83%	0.829	75%	0.753	S	S	*	*			trans	-145.1	105.8	149.2	-103.7	-76	0	0	0	114.5
313	K	29.5	Very low	27.9	Very low	182 Å²	182	142 Å²	142	79%	0.791	76%	0.762	S	S	*	*			trans	38.6	128.7	143.9	-60.6	-177	-178.5	180	0	122.9
314	H	28.5	Very low	27.8	Very low	155 Å²	155	140.9 Å²	140.9	72%	0.718	77%	0.766	S	S	*	*			trans	-2.1	136.2	134.6	-82	-104.2	0	0	0	118.8	E316	H314-E316 IonicContact CE1-OE2 3.82Å; H314-E316 IonicContact ND1-OE2 3.7Å
315	V	26.8	Very low	27.9	Very low	146 Å²	146	140.3 Å²	140.3	89%	0.885	76%	0.762	S	S	*	*				-134.6	136.7	125	176.8	0	0	0	0	108.7
316	E	28.6	Very low	27.9	Very low	145 Å²	145	138.9 Å²	138.9	68%	0.678	77%	0.767	S	S	*	*			trans	-116.1	163.5	173.7	-92	-176.7	103.7	0	0	111.9	H314	H314-E316 IonicContact CE1-OE2 3.82Å; H314-E316 IonicContact ND1-OE2 3.7Å
317	S	25	Very low	28.1	Very low	99 Å²	99	143.1 Å²	143.1	69%	0.692	77%	0.768	S	S	*	*			trans	72.6	113.7	154.5	77	0	0	0	0	120
318	R	25.1	Very low	28.2	Very low	220 Å²	220	147.6 Å²	147.6	83%	0.83	78%	0.781	S	S	*	*				166.8	110.1	128.2	-90	169.4	-159	-141.3	4.6	106.5
319	I	26.9	Very low	28.4	Very low	140 Å²	140	145.7 Å²	145.7	72%	0.718	78%	0.782	S	S	*	*				49.9	96.5	62.2	-48.9	180	0	0	0	111.6	T321	I319-T321 HydrophobicContact CG2-CG2 4.43Å
320	H	28.1	Very low	28.5	Very low	180 Å²	180	148.4 Å²	148.4	83%	0.833	79%	0.786	S	S	*	*			trans	-131.3	143.4	144.6	-94	-85.8	0	0	0	108.4
321	T	29.1	Very low	28.7	Very low	129 Å²	129	150.6 Å²	150.6	79%	0.791	79%	0.788	S	S	*	*			trans	-121.4	155.1	-170.3	41.7	0	0	0	0	111.6	I319	I319-T321 HydrophobicContact CG2-CG2 4.43Å
322	G	26.9	Very low	28.8	Very low	70 Å²	70	152 Å²	152	72%	0.722	79%	0.792	S	S	*	*			trans	95.7	139.9	-178.6	0	0	0	0	0	112.6
323	L	28.1	Very low	29.3	Very low	186 Å²	186	149.4 Å²	149.4	97%	0.974	80%	0.795	S	S	*	*			cis	-132.3	174	4.4	-72.5	167.8	0	0	0	111.2
324	S	27.2	Very low	29.3	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	79%	0.792	S	S	*	*			trans	-130.8	-167.3	-169.5	-158.3	0	0	0	0	110.8
325	P	42.8	Very low	29.3	Very low	107 Å²	107	145.1 Å²	145.1	70%	0.695	80%	0.801	S	S	*	*				-122.1	-176.4	-93	40.9	-27.2	0	0	0	113.4
326	S	26.5	Very low	29.5	Very low	104 Å²	104	147 Å²	147	73%	0.727	80%	0.8	S	S	*	*				153	126.3	123.3	58.1	0	0	0	0	115.5
327	R	29.9	Very low	29.4	Very low	229 Å²	229	150 Å²	150	86%	0.864	81%	0.811	S	S	*	*				168.6	95.9	115.9	-95.4	-169.1	-79.4	-170.1	-6.3	112.2
328	Y	29.1	Very low	29.5	Very low	229 Å²	229	152.6 Å²	152.6	90%	0.898	81%	0.812	S	S	*	*	S	Bend	trans	-151.2	148.5	141.7	-98	-76.3	0	0	0	108
329	P	33.1	Very low	29.6	Very low	120 Å²	120	153.7 Å²	153.7	78%	0.779	82%	0.816	S	S	*	*			trans	-76.8	144.9	-172.5	-15.3	31.5	0	0	0	113.5
330	Q	29.9	Very low	29.6	Very low	181 Å²	181	155 Å²	155	85%	0.846	82%	0.818	S	S	*	*			trans	-81	151.9	163.2	-75.5	-74.4	-10.4	0	0	110.4
331	I	30.8	Very low	29.8	Very low	159 Å²	159	151.9 Å²	151.9	82%	0.815	82%	0.816	S	S	*	*			trans	-121.6	135.5	164.2	-65.2	179.9	0	0	0	107.6
332	S	27.8	Very low	29.8	Very low	111 Å²	111	153.2 Å²	153.2	78%	0.776	82%	0.817	S	S	*	*			trans	-69.9	153.1	-166	-56.8	0	0	0	0	114.5
333	P	36.5	Very low	30	Very low	135 Å²	135	154.8 Å²	154.8	88%	0.877	81%	0.814	S	S	*	*			trans	-80.7	147.7	-179.4	33.4	-35.8	0	0	0	112.7
334	G	29.4	Very low	30.2	Very low	71 Å²	71	154.7 Å²	154.7	73%	0.732	81%	0.809	S	S	*	*			trans	166.1	92.5	167.6	0	0	0	0	0	115.1
335	L	28.3	Very low	30.3	Very low	176 Å²	176	159 Å²	159	92%	0.921	81%	0.814	S	S	*	*			trans	-175.2	159.2	139.4	-100.2	163.5	0	0	0	109.6
336	H	30.8	Very low	29.7	Very low	186 Å²	186	161.8 Å²	161.8	86%	0.861	82%	0.823	S	S	*	*			trans	-73.3	141.5	-168.9	-91.8	-135.2	0	0	0	114.2
337	F	25.4	Very low	30	Very low	208 Å²	208	160.5 Å²	160.5	91%	0.912	83%	0.826	S	S	*	*			trans	-93.4	107.4	156.6	-88.5	-83.3	0	0	0	109.5
338	E	27.3	Very low	30.2	Very low	152 Å²	152	155.9 Å²	155.9	71%	0.71	82%	0.823	S	S	*	*			trans	-91.4	123.6	168.4	-167.8	165.1	-132.4	0	0	109.8	F340	E338-F340 HydrophobicContact CB-CE2 4.24Å; E338-F340 HydrophobicContact CG-CD2 4.38Å; E338-F340 HydrophobicContact CG-CE2 3.86Å; E338-F340 HydrophobicContact CG-CZ 4.41Å; E338-F340 PolarHBondContact O-N 3.37Å; E338-F340 WeakPolarHBondContact OE2-CE2 3.35Å
339	R	28.6	Very low	30.4	Very low	243 Å²	243	155 Å²	155	92%	0.917	82%	0.824	S	S	*	*			trans	-86.6	98.6	-179.7	-86.8	-177.7	167.9	151.2	-4.6	110.6	S341	R339-S341 PolarHBondContact O-N 3.48Å
340	F	25.5	Very low	30.4	Very low	169 Å²	169	155 Å²	155	74%	0.741	82%	0.822	S	S	*	*			trans	-78	114.1	164.6	-76	-85.8	0	0	0	110.8	E338	E338-F340 HydrophobicContact CB-CE2 4.24Å; E338-F340 HydrophobicContact CG-CD2 4.38Å; E338-F340 HydrophobicContact CG-CE2 3.86Å; E338-F340 HydrophobicContact CG-CZ 4.41Å; E338-F340 PolarHBondContact O-N 3.37Å; E338-F340 WeakPolarHBondContact OE2-CE2 3.35Å
341	S	32.7	Very low	30.4	Very low	113 Å²	113	157.9 Å²	157.9	79%	0.79	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-80.8	124.1	168.5	52.1	0	0	0	0	110.5	R339	R339-S341 PolarHBondContact O-N 3.48Å
342	L	29.4	Very low	30.5	Very low	158 Å²	158	154.2 Å²	154.2	83%	0.827	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-74.9	152.8	173.7	-73.6	169	0	0	0	111.8
343	P	30.4	Very low	30.6	Very low	102 Å²	102	152.1 Å²	152.1	66%	0.662	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-69.5	160.7	-179.3	-17.6	32.3	0	0	0	113.5
344	H	32.3	Very low	30.7	Very low	184 Å²	184	153.6 Å²	153.6	85%	0.852	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72.5	134.8	168.7	-71.9	50.4	0	0	0	110.4
345	F	29.3	Very low	30.6	Very low	202 Å²	202	155.6 Å²	155.6	89%	0.886	83%	0.826	S	S	*	*			trans	-101	95.9	167.7	-91.3	-90.6	0	0	0	109.7
346	D	31.7	Very low	31.1	Very low	166 Å²	166	155.5 Å²	155.5	89%	0.888	83%	0.826	S	S	*	*			trans	-70.6	127.8	161.5	-85.9	-47.7	0	0	0	109.3
347	G	32.8	Very low	31.2	Very low	76 Å²	76	153.2 Å²	153.2	78%	0.784	82%	0.819	S	S	*	*			trans	166.4	-2.2	179.2	0	0	0	0	0	119.2
348	V	34.2	Very low	31.6	Very low	133 Å²	133	148.1 Å²	148.1	81%	0.806	81%	0.807	S	S	*	*			trans	-113.4	108.9	179.4	-176.7	0	0	0	0	111.1
349	K	31.6	Very low	32	Very low	211 Å²	211	149.2 Å²	149.2	92%	0.917	82%	0.816	S	S	*	*			trans	-87.2	130.3	155.9	-79.2	-169.8	175.4	-177.7	0	108.8
350	T	34	Very low	32.3	Very low	119 Å²	119	143.1 Å²	143.1	73%	0.73	80%	0.8	S	S	*	*			trans	-78.3	149.8	-172.1	43.8	0	0	0	0	113.1
351	Y	29.6	Very low	32.9	Very low	242 Å²	242	140.8 Å²	140.8	95%	0.949	80%	0.802	S	S	*	*			trans	-124.4	136.4	142.3	-102.4	-92.6	0	0	0	107.4
352	G	32.8	Very low	33.2	Very low	81 Å²	81	142.2 Å²	142.2	84%	0.835	79%	0.794	S	S	*	*			trans	-90	160.1	-168	0	0	0	0	0	114.7
353	G	31.1	Very low	33.8	Very low	68 Å²	68	140.2 Å²	140.2	70%	0.701	79%	0.788	S	S	*	*			trans	178.3	118.2	172.5	0	0	0	0	0	109.2	C355	G353-C355 PolarHBondContact O-N 3.39Å
354	D	37.2	Very low	34.3	Very low	165 Å²	165	139.8 Å²	139.8	88%	0.882	78%	0.784	S	S	*	*			trans	-69.6	125.8	-162.9	-56.5	-81.2	0	0	0	114.2
355	C	28.7	Very low	34.3	Very low	114 Å²	114	139.6 Å²	139.6	77%	0.77	78%	0.777	S	S	*	*			trans	-144.7	96.5	167.9	-85.7	0	0	0	0	110.2	G353 I357	G353-C355 PolarHBondContact O-N 3.39Å; C355-I357 PolarHBondContact O-N 3.03Å
356	N	37.9	Very low	34.6	Very low	174 Å²	174	137.1 Å²	137.1	93%	0.93	77%	0.773	S	S	*	*			trans	-73.6	108.2	170	-103.1	-65.8	0	0	0	110
357	I	33.3	Very low	35.4	Very low	138 Å²	138	132.6 Å²	132.6	71%	0.708	77%	0.765	S	S	*	*			trans	-129.2	122.3	170.2	-56.1	179.3	0	0	0	107.9	C355 L359	C355-I357 PolarHBondContact O-N 3.03Å; I357-L359 PolarHBondContact O-N 2.99Å
358	P	33.7	Very low	35.6	Very low	101 Å²	101	135.9 Å²	135.9	66%	0.656	76%	0.76	S	S	*	*			trans	-72.4	125.7	-179.9	28.7	-33.5	0	0	0	111.1	M360	P358-M360 PolarHBondContact O-N 3.43Å
359	L	36.3	Very low	35.7	Very low	174 Å²	174	134.4 Å²	134.4	91%	0.911	75%	0.747	S	S	*	*			trans	-66.1	103.4	168.8	-84.4	137.6	0	0	0	109.9	I357	I357-L359 PolarHBondContact O-N 2.99Å
360	M	34.6	Very low	36	Very low	115 Å²	115	131 Å²	131	57%	0.567	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-91.5	130.5	169.3	-75.9	-71.3	107.1	0	0	110.2	P358	P358-M360 PolarHBondContact O-N 3.43Å
361	P	38	Very low	36.2	Very low	121 Å²	121	133.6 Å²	133.6	79%	0.786	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-77	125.9	177.7	30.5	-32.9	0	0	0	110.9
362	F	38	Very low	36.6	Very low	143 Å²	143	127.8 Å²	127.8	63%	0.627	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-98.6	138.7	171.6	-63.2	-81.5	0	0	0	110.7	L369	F362-L369 HydrophobicContact CB-CD2 3.93Å; F362-L369 HydrophobicContact CD1-CD2 4.16Å; F362-L369 HydrophobicContact CG-CD2 4.34Å
363	T	42.4	Very low	36.6	Very low	115 Å²	115	128 Å²	128	71%	0.706	72%	0.719	S	S	*	*			trans	-116.3	139	166.8	45.9	0	0	0	0	109.7
364	V	40.4	Very low	37.2	Very low	94 Å²	94	129.5 Å²	129.5	57%	0.57	72%	0.717	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.9	133.9	179	-179.5	0	0	0	0	108.2	L369	V364-L369 HydrophobicContact CG2-CD2 3.68Å; V364-L369 HydrophobicContact CG2-CG 4.1Å
365	Y	33.7	Very low	37.2	Very low	180 Å²	180	131.7 Å²	131.7	71%	0.706	71%	0.714	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-136.1	130	173.5	-160.4	-97.3	0	0	0	109.5	G367 E368	Y365-G367 PolarHBondContact O-N 2.88Å; Y365-E368 PolarHBondContact N-O 2.9Å; Y365-E368 PolarHBondContact O-N 2.91Å
366	N	34.3	Very low	37.3	Very low	150 Å²	150	136.1 Å²	136.1	80%	0.802	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.5	31.1	-176.4	-66.6	-7.1	0	0	0	115.7
367	G	47.9	Very low	37	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	87.2	-2.6	177.4	0	0	0	0	0	115.6	Y365	Y365-G367 PolarHBondContact O-N 2.88Å
368	E	37	Very low	37.1	Very low	145 Å²	145	134.1 Å²	134.1	68%	0.678	71%	0.713	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.2	141.9	175.3	-62.8	-166.3	146.6	0	0	111.7	Y365	Y365-E368 PolarHBondContact N-O 2.9Å; Y365-E368 PolarHBondContact O-N 2.91Å
369	L	37.7	Very low	37	Very low	103 Å²	103	138.8 Å²	138.8	54%	0.539	72%	0.723	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.4	114	173.3	-88.3	164	0	0	0	109	F362 V364	F362-L369 HydrophobicContact CB-CD2 3.93Å; F362-L369 HydrophobicContact CD1-CD2 4.16Å; F362-L369 HydrophobicContact CG-CD2 4.34Å; V364-L369 HydrophobicContact CG2-CD2 3.68Å; V364-L369 HydrophobicContact CG2-CG 4.1Å
370	L	38.2	Very low	36.8	Very low	138 Å²	138	137.7 Å²	137.7	72%	0.723	71%	0.711	S	S	*	*			trans	-97.5	112.8	178.2	-65.2	177.1	0	0	0	110.5
371	Y	37.5	Very low	36.8	Very low	175 Å²	175	139.8 Å²	139.8	69%	0.686	72%	0.719	S	S	*	*			trans	-113.3	135.7	167	-175.7	-94.7	0	0	0	109.4
372	S	38.3	Very low	36.5	Very low	119 Å²	119	142 Å²	142	83%	0.832	72%	0.717	S	S	*	*			trans	-130.9	83.8	-170.8	56.4	0	0	0	0	113.1
373	S	33.1	Very low	36.5	Very low	85 Å²	85	138.6 Å²	138.6	59%	0.594	71%	0.711	S	S	*	*	S	Bend	trans	-150	151.1	157.4	-146.7	0	0	0	0	108.4
374	P	42.6	Very low	36.4	Very low	101 Å²	101	140.7 Å²	140.7	66%	0.656	72%	0.718	S	S	*	*	S	Bend	trans	-82.4	166.2	-159.4	32.1	-35.6	0	0	0	115.2
375	Y	37.5	Very low	36.4	Very low	210 Å²	210	143.8 Å²	143.8	82%	0.824	73%	0.73	S	S	*	*	S	Bend	trans	79.6	120.8	-178.6	-56.8	-82.5	0	0	0	116
376	Y	31.5	Very low	36.4	Very low	208 Å²	208	141.7 Å²	141.7	82%	0.816	73%	0.731	S	S	*	*			trans	66.7	105.8	176.9	-61.7	-80.8	0	0	0	118.3	L378	Y376-L378 PolarHBondContact O-N 3.41Å
377	P	31.8	Very low	36.3	Very low	134 Å²	134	144.5 Å²	144.5	87%	0.87	74%	0.736	S	S	*	*			trans	-80.3	99.1	169.4	32.2	-32.1	0	0	0	111.3	K379	P377-K379 PolarHBondContact O-N 2.8Å
378	L	34	Very low	35.4	Very low	136 Å²	136	150.1 Å²	150.1	71%	0.712	74%	0.737	S	S	*	*			trans	-78.3	114.1	171.6	-73.5	170.3	0	0	0	111	Y376 F380	Y376-L378 PolarHBondContact O-N 3.41Å; L378-F380 HydrophobicContact CB-CD2 4.12Å; L378-F380 HydrophobicContact CB-CE2 3.66Å; L378-F380 HydrophobicContact CB-CZ 4.39Å; L378-F380 HydrophobicContact CD1-CE2 4.02Å; L378-F380 HydrophobicContact CD1-CZ 4.25Å; L378-F380 HydrophobicContact CG-CE2 4.4Å; L378-F380 PolarHBondContact O-N 2.96Å
379	K	31.5	Very low	35.3	Very low	199 Å²	199	148.5 Å²	148.5	87%	0.865	74%	0.739	S	S	*	*			trans	-94.5	83.2	-179.5	-168.5	171.1	-175.2	172	0	111.6	P377	P377-K379 PolarHBondContact O-N 2.8Å
380	F	33.1	Very low	35	Very low	151 Å²	151	151.4 Å²	151.4	66%	0.662	75%	0.754	S	S	*	*			trans	-73.7	131.9	174.5	-70	-78.4	0	0	0	111.8	L378 F382	L378-F380 HydrophobicContact CB-CD2 4.12Å; L378-F380 HydrophobicContact CB-CE2 3.66Å; L378-F380 HydrophobicContact CB-CZ 4.39Å; L378-F380 HydrophobicContact CD1-CE2 4.02Å; L378-F380 HydrophobicContact CD1-CZ 4.25Å; L378-F380 HydrophobicContact CG-CE2 4.4Å; L378-F380 PolarHBondContact O-N 2.96Å; F380-F382 HydrophobicContact CB-CD2 4.38Å; F380-F382 HydrophobicContact CB-CE2 3.98Å
381	H	34.8	Very low	34.9	Very low	158 Å²	158	150.2 Å²	150.2	73%	0.731	76%	0.758	S	S	*	*			trans	-114.6	97.7	176.5	-160.2	-88	0	0	0	109.4	S383	H381-S383 PolarHBondContact ND1-OG 3.14Å; H381-S383 VanDerWaalsContact ND1-OG 3.08Å; H381-S383 PolarHBondContact O-N 2.62Å; H381-S383 PolarHBondContact O-OG 2.88Å
382	F	32	Very low	34.8	Very low	168 Å²	168	148 Å²	148	74%	0.737	76%	0.763	S	S	*	*			trans	-77.5	61.3	-176.6	-76.8	-77.4	0	0	0	113	F380	F380-F382 HydrophobicContact CB-CD2 4.38Å; F380-F382 HydrophobicContact CB-CE2 3.98Å
383	S	36.4	Very low	34.6	Very low	72 Å²	72	147.9 Å²	147.9	50%	0.503	76%	0.758	S	S	.	*			trans	-92.2	116.9	167.1	37.5	0	0	0	0	110.1	H381	H381-S383 PolarHBondContact ND1-OG 3.14Å; H381-S383 VanDerWaalsContact ND1-OG 3.08Å; H381-S383 PolarHBondContact O-N 2.62Å; H381-S383 PolarHBondContact O-OG 2.88Å
384	N	41.7	Very low	34.6	Very low	159 Å²	159	153.3 Å²	153.3	85%	0.85	77%	0.768	S	S	*	*	S	Bend	trans	102.1	11.4	171.2	-52	-18	0	0	0	119.3
385	L	40.8	Very low	34	Very low	158 Å²	158	157 Å²	157	83%	0.827	77%	0.773	S	S	*	*			trans	-118.6	51.9	170.2	-78.4	176.6	0	0	0	113.9
386	L	32	Very low	34	Very low	136 Å²	136	150.9 Å²	150.9	71%	0.712	77%	0.774	S	S	*	*			trans	-146.5	86.3	163	-108.1	168.5	0	0	0	109.7	Y388	L386-Y388 HydrophobicContact CD2-CD2 4.37Å; L386-Y388 HydrophobicContact CD2-CE2 4.02Å; L386-Y388 PolarHBondContact O-N 3.27Å
387	K	33.1	Very low	33.8	Very low	210 Å²	210	145.4 Å²	145.4	91%	0.913	77%	0.772	S	S	*	*			trans	-73.9	105.7	161.5	-93.2	-167.1	170.6	-166.9	0	107.9
388	Y	30	Very low	34	Very low	188 Å²	188	144.9 Å²	144.9	74%	0.737	77%	0.769	S	S	*	*			trans	-70	145.9	157.4	-87.3	-97.6	0	0	0	109.2	L386	L386-Y388 HydrophobicContact CD2-CD2 4.37Å; L386-Y388 HydrophobicContact CD2-CE2 4.02Å; L386-Y388 PolarHBondContact O-N 3.27Å
389	P	32.9	Very low	34.1	Very low	111 Å²	111	148 Å²	148	72%	0.721	78%	0.78	S	S	*	*			trans	-68.2	146.7	175.8	29.3	-34.7	0	0	0	111	S391	P389-S391 PolarHBondContact O-N 3.24Å; P389-S391 VanDerWaalsContact O-N 3.13Å
390	D	32.5	Very low	33.9	Very low	163 Å²	163	145.6 Å²	145.6	87%	0.872	78%	0.775	S	S	*	*			trans	-64.2	109.7	-172.1	-58.1	-84.7	0	0	0	112.8	V392	D390-V392 PolarHBondContact O-N 3.02Å
391	S	36.9	Very low	33.8	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	77%	0.766	S	S	*	*			trans	-74.6	106.8	170.1	58.7	0	0	0	0	110	P389	P389-S391 PolarHBondContact O-N 3.24Å; P389-S391 VanDerWaalsContact O-N 3.13Å
392	V	33.8	Very low	34.2	Very low	130 Å²	130	143.2 Å²	143.2	79%	0.788	77%	0.774	S	S	*	*			trans	-41.9	120.8	-175.8	-178.9	0	0	0	0	113.5	D390 Y394	D390-V392 PolarHBondContact O-N 3.02Å; V392-Y394 PolarHBondContact O-N 3.42Å
393	P	33.7	Very low	34.7	Very low	115 Å²	115	140 Å²	140	75%	0.747	77%	0.765	S	S	*	*			trans	-78.2	114.6	168.2	30.6	-31.3	0	0	0	110.3
394	Y	33.7	Very low	35.2	Very low	200 Å²	200	140.5 Å²	140.5	78%	0.784	76%	0.761	S	S	*	*			trans	-87.8	141.3	164.8	-167.9	-111.4	0	0	0	109.4	V392	V392-Y394 PolarHBondContact O-N 3.42Å
395	F	30.6	Very low	35.7	Very low	178 Å²	178	134.5 Å²	134.5	78%	0.781	74%	0.737	S	S	*	*	S	Bend	trans	63.7	136.3	-160.1	-66.4	-77	0	0	0	115.3
396	G	36.5	Very low	36.3	Very low	81 Å²	81	128.8 Å²	128.8	84%	0.835	71%	0.71	S	S	*	*			trans	-117.6	143.8	-174.8	0	0	0	0	0	113.3
397	A	28	Very low	37.3	Very low	93 Å²	93	125.4 Å²	125.4	77%	0.769	69%	0.692	S	S	*	*			trans	-142.5	152.5	166.2	0	0	0	0	0	108.4
398	P	35.7	Very low	38.6	Very low	124 Å²	124	119.5 Å²	119.5	81%	0.805	67%	0.673	S	S	*	*			trans	-73.9	158.1	-170	29.7	-35.8	0	0	0	113.6
399	Q	36.1	Very low	40.2	Very low	201 Å²	201	114.7 Å²	114.7	94%	0.939	66%	0.661	S	S	*	*			trans	-61.2	135.2	178.4	-68.7	-174.7	-13.2	0	0	112.3
400	L	27.3	Very low	41.7	Very low	149 Å²	149	110 Å²	110	78%	0.78	63%	0.629	S	S	*	*			trans	-119.3	155.3	167.6	-98	167.8	0	0	0	110.6	L404	L400-L404 HydrophobicContact CB-CD1 4.01Å; L400-L404 HydrophobicContact CD1-CD1 4.41Å; L400-L404 HydrophobicContact CD2-CD1 4.28Å; L400-L404 HydrophobicContact CG-CD1 4.48Å
401	S	32.3	Very low	43.3	Very low	66 Å²	66	105.1 Å²	105.1	46%	0.462	60%	0.603	S	S	.	*			trans	-80	155.2	-156	56.5	0	0	0	0	115.6	D403 L404	S401-D403 PolarHBondContact O-N 2.9Å; S401-D403 VanDerWaalsContact O-N 3.09Å; S401-L404 PolarHBondContact O-N 3.07Å; S401-L404 VanDerWaalsContact O-N 3.1Å
402	Q	43	Very low	44.7	Very low	193 Å²	193	108.7 Å²	108.7	90%	0.902	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-25	174.3	-72	176.1	-37.9	0	0	113.7	L404 G405	Q402-L404 PolarHBondContact O-N 3.33Å; Q402-G405 PolarHBondContact O-N 2.87Å; Q402-G405 VanDerWaalsContact O-N 3.09Å
403	D	41.8	Very low	46.2	Very low	101 Å²	101	104.7 Å²	104.7	54%	0.54	57%	0.572	S	S	.	*	H	α-helix	trans	-52	-38.2	174.1	-89	-39.8	0	0	0	112.3	S401 G405 S406 I407	S401-D403 PolarHBondContact O-N 2.9Å; S401-D403 VanDerWaalsContact O-N 3.09Å; D403-G405 VanDerWaalsContact C-N 3.3Å; D403-G405 PolarHBondContact O-N 2.85Å; D403-S406 PolarHBondContact O-N 3.49Å; D403-S406 PolarHBondContact O-OG 3.28Å; D403-I407 PolarHBondContact O-N 3.43Å
404	L	46	Very low	47.8	Very low	82 Å²	82	99.3 Å²	99.3	43%	0.429	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-32.7	-179.3	-71	170.9	0	0	0	112.7	L400 S401 Q402 S406 I407 T408	L400-L404 HydrophobicContact CB-CD1 4.01Å; L400-L404 HydrophobicContact CD1-CD1 4.41Å; L400-L404 HydrophobicContact CD2-CD1 4.28Å; L400-L404 HydrophobicContact CG-CD1 4.48Å; S401-L404 PolarHBondContact O-N 3.07Å; S401-L404 VanDerWaalsContact O-N 3.1Å; Q402-L404 PolarHBondContact O-N 3.33Å; L404-S406 VanDerWaalsContact C-N 3.29Å; L404-S406 PolarHBondContact O-N 3.45Å; L404-I407 HydrophobicContact CD2-CD1 4.32Å; L404-I407 PolarHBondContact O-N 3.48Å; L404-T408 PolarHBondContact O-N 3.16Å; L404-T408 VanDerWaalsContact O-N 3.07Å; L404-T408 PolarHBondContact O-OG1 2.87Å
405	G	52.7	Low	49.4	Very low	33 Å²	33	92 Å²	92	34%	0.34	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-32	176.1	0	0	0	0	0	113.1	Q402 D403 T408 N409	Q402-G405 PolarHBondContact O-N 2.87Å; Q402-G405 VanDerWaalsContact O-N 3.09Å; D403-G405 VanDerWaalsContact C-N 3.3Å; D403-G405 PolarHBondContact O-N 2.85Å; G405-T408 PolarHBondContact O-OG1 3.14Å; G405-N409 WeakPolarHBondContact O-CB 3.37Å; G405-N409 PolarHBondContact O-N 2.93Å; G405-N409 VanDerWaalsContact O-N 3.14Å; G405-N409 PolarHBondContact O-ND2 3.32Å
406	S	53.9	Low	51	Low	38 Å²	38	87.7 Å²	87.7	27%	0.266	50%	0.502	S	S	.	.	H	α-helix	trans	-70.5	-34.3	175.3	75.2	0	0	0	0	112.5	D403 L404 I410 Y478	D403-S406 PolarHBondContact O-N 3.49Å; D403-S406 PolarHBondContact O-OG 3.28Å; L404-S406 VanDerWaalsContact C-N 3.29Å; L404-S406 PolarHBondContact O-N 3.45Å; S406-I410 WeakPolarHBondContact O-CG1 3.23Å; S406-I410 PolarHBondContact O-N 3.48Å; S406-Y478 WeakPolarHBondContact OG-CE2 3.4Å
407	I	53.3	Low	52.3	Low	64 Å²	64	84.3 Å²	84.3	33%	0.328	46%	0.464	S	S	.	.	H	α-helix	trans	-68.8	-51.9	178	-66.9	165	0	0	0	110.1	D403 L404 N409 I410 D411 Y478	D403-I407 PolarHBondContact O-N 3.43Å; L404-I407 HydrophobicContact CD2-CD1 4.32Å; L404-I407 PolarHBondContact O-N 3.48Å; I407-N409 VanDerWaalsContact C-N 3.33Å; I407-N409 PolarHBondContact O-N 3.2Å; I407-I410 PolarHBondContact O-N 2.7Å; I407-D411 PolarHBondContact O-N 2.88Å; I407-D411 VanDerWaalsContact O-N 3.12Å; I407-Y478 WeakPolarHBondContact CD1-OH 3.25Å; I407-Y478 HydrophobicContact CG1-CE1 4.33Å; I407-Y478 HydrophobicContact CG1-CE2 4.41Å; I407-Y478 WeakPolarHBondContact CG1-OH 2.82Å
408	T	60.5	Low	54	Low	86 Å²	86	81.3 Å²	81.3	53%	0.528	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-35.1	-177.7	54.3	0	0	0	0	112.1	L404 G405 R412	L404-T408 PolarHBondContact O-N 3.16Å; L404-T408 VanDerWaalsContact O-N 3.07Å; L404-T408 PolarHBondContact O-OG1 2.87Å; G405-T408 PolarHBondContact O-OG1 3.14Å; T408-R412 WeakPolarHBondContact O-CB 3.41Å; T408-R412 PolarHBondContact O-N 3.4Å
409	N	63.7	Low	55.4	Low	88 Å²	88	80.7 Å²	80.7	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-46.4	174.3	-77.5	-19	0	0	0	112.7	G405 I407 D411 R412 E413	G405-N409 WeakPolarHBondContact O-CB 3.37Å; G405-N409 PolarHBondContact O-N 2.93Å; G405-N409 VanDerWaalsContact O-N 3.14Å; G405-N409 PolarHBondContact O-ND2 3.32Å; I407-N409 VanDerWaalsContact C-N 3.33Å; I407-N409 PolarHBondContact O-N 3.2Å; N409-D411 PolarHBondContact O-N 3.35Å; N409-R412 PolarHBondContact O-N 3.04Å; N409-E413 WeakPolarHBondContact O-CG 3.33Å; N409-E413 PolarHBondContact O-N 3.39Å
410	I	64.2	Low	56.5	Low	11 Å²	11	74.4 Å²	74.4	6%	0.056	39%	0.393	C	S	.	.	H	α-helix	trans	-64.8	-41.5	179.6	-69	167.3	0	0	0	111.3	S406 I407 R412 E413 I414 T476 Y478	S406-I410 WeakPolarHBondContact O-CG1 3.23Å; S406-I410 PolarHBondContact O-N 3.48Å; I407-I410 PolarHBondContact O-N 2.7Å; I410-R412 VanDerWaalsContact C-N 3.35Å; I410-E413 PolarHBondContact O-N 2.91Å; I410-I414 HydrophobicContact CG2-CD1 3.79Å; I410-I414 WeakPolarHBondContact O-CB 3.45Å; I410-I414 WeakPolarHBondContact O-CD1 3.42Å; I410-I414 VanDerWaalsContact O-CG1 3.24Å; I410-I414 WeakPolarHBondContact O-CG1 3.23Å; I410-I414 PolarHBondContact O-N 3.4Å; I410-T476 HydrophobicContact CD1-CG2 4.46Å; I410-T476 WeakPolarHBondContact CD1-OG1 3.44Å; I410-T476 HydrophobicContact CG1-CG2 4.17Å; I410-Y478 HydrophobicContact CD1-CD1 3.53Å; I410-Y478 HydrophobicContact CD1-CD2 4.17Å; I410-Y478 HydrophobicContact CD1-CE1 4.43Å; I410-Y478 HydrophobicContact CD1-CG 3.4Å
411	D	66.1	Low	58	Low	62 Å²	62	70 Å²	70	33%	0.332	37%	0.37	S	S	.	.	H	α-helix	trans	-73.5	-26.6	177.4	-88.5	-49.4	0	0	0	113.1	I407 N409 A415 K469	I407-D411 PolarHBondContact O-N 2.88Å; I407-D411 VanDerWaalsContact O-N 3.12Å; N409-D411 PolarHBondContact O-N 3.35Å; D411-A415 VanDerWaalsContact O-CB 3.26Å; D411-A415 WeakPolarHBondContact O-CB 3.36Å; D411-A415 PolarHBondContact O-N 3.29Å; D411-K469 WeakPolarHBondContact OD1-CE 3.46Å; D411-K469 IonicContact OD1-NZ 2.69Å; D411-K469 PolarHBondContact OD1-NZ 3.27Å; D411-K469 WeakPolarHBondContact OD2-CE 3.22Å; D411-K469 IonicContact OD2-NZ 2.8Å; D411-K469 PolarHBondContact OD2-NZ 3.25Å
412	R	65.8	Low	59.3	Low	187 Å²	187	69.7 Å²	69.7	71%	0.706	37%	0.368	S	S	*	.	H	α-helix	trans	-68.9	-42.8	168.8	-175.7	178.3	-175.1	169.1	3.1	112.6	T408 N409 I410 A415 M416	T408-R412 WeakPolarHBondContact O-CB 3.41Å; T408-R412 PolarHBondContact O-N 3.4Å; N409-R412 PolarHBondContact O-N 3.04Å; I410-R412 VanDerWaalsContact C-N 3.35Å; R412-A415 PolarHBondContact O-N 3.09Å; R412-M416 WeakPolarHBondContact O-CB 2.97Å; R412-M416 PolarHBondContact O-N 3.39Å
413	E	66.3	Low	60	Low	46 Å²	46	64.4 Å²	64.4	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-45.4	172.6	-76.8	172.6	-162.2	0	0	111.2	N409 I410 M416 H417	N409-E413 WeakPolarHBondContact O-CG 3.33Å; N409-E413 PolarHBondContact O-N 3.39Å; I410-E413 PolarHBondContact O-N 2.91Å; E413-M416 PolarHBondContact O-N 3.48Å; E413-H417 WeakPolarHBondContact O-CB 3.29Å; E413-H417 PolarHBondContact O-CD2 2.74Å; E413-H417 PolarHBondContact O-N 3.5Å
414	I	65.6	Low	60.8	Low	2 Å²	2	64.7 Å²	64.7	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-66.5	-38.6	177.4	-68.8	163.8	0	0	0	111.3	I410 T418 K465 K469 M472	I410-I414 HydrophobicContact CG2-CD1 3.79Å; I410-I414 WeakPolarHBondContact O-CB 3.45Å; I410-I414 WeakPolarHBondContact O-CD1 3.42Å; I410-I414 VanDerWaalsContact O-CG1 3.24Å; I410-I414 WeakPolarHBondContact O-CG1 3.23Å; I410-I414 PolarHBondContact O-N 3.4Å; I414-T418 PolarHBondContact O-N 2.89Å; I414-T418 PolarHBondContact O-OG1 2.89Å; I414-T418 VanDerWaalsContact O-OG1 3.05Å; I414-K465 HydrophobicContact CG2-CG 4.48Å; I414-K469 HydrophobicContact CD1-CB 3.78Å; I414-K469 HydrophobicContact CD1-CD 3.97Å; I414-K469 HydrophobicContact CD1-CG 3.59Å; I414-M472 HydrophobicContact CG1-CG 4.31Å
415	A	67.4	Low	61.1	Low	47 Å²	47	62.7 Å²	62.7	39%	0.388	34%	0.336	S	S	.	.	H	α-helix	trans	-60.5	-53	173.7	0	0	0	0	0	110.7	D411 R412 H417 T418 Q419	D411-A415 VanDerWaalsContact O-CB 3.26Å; D411-A415 WeakPolarHBondContact O-CB 3.36Å; D411-A415 PolarHBondContact O-N 3.29Å; R412-A415 PolarHBondContact O-N 3.09Å; A415-H417 PolarHBondContact O-N 2.68Å; A415-T418 CarbonylContact O-C 3.57Å; A415-T418 WeakPolarHBondContact O-CA 3.43Å; A415-T418 PolarHBondContact O-N 2.97Å; A415-T418 PolarHBondContact O-OG1 3.15Å; A415-Q419 PolarHBondContact O-N 3.33Å
416	M	65.7	Low	61.1	Low	88 Å²	88	64 Å²	64	43%	0.433	34%	0.34	S	S	.	.	H	α-helix	trans	-55.6	-47.5	176.8	178.5	175.7	61.3	0	0	112.3	R412 E413 T418 Q419 Q420	R412-M416 WeakPolarHBondContact O-CB 2.97Å; R412-M416 PolarHBondContact O-N 3.39Å; E413-M416 PolarHBondContact O-N 3.48Å; M416-T418 VanDerWaalsContact C-N 3.31Å; M416-T418 PolarHBondContact O-N 3.1Å; M416-Q419 PolarHBondContact O-N 3.48Å; M416-Q419 VanDerWaalsContact O-N 3.16Å; M416-Q420 WeakPolarHBondContact O-CG 3.48Å; M416-Q420 PolarHBondContact O-N 2.9Å
417	H	63.8	Low	61	Low	10 Å²	10	66.9 Å²	66.9	5%	0.046	35%	0.353	C	S	.	.	H	α-helix	trans	-63.8	-33.2	175.6	-71.8	-26.5	0	0	0	112.9	E413 A415 Q420 L421 Y457	E413-H417 WeakPolarHBondContact O-CB 3.29Å; E413-H417 PolarHBondContact O-CD2 2.74Å; E413-H417 PolarHBondContact O-N 3.5Å; A415-H417 PolarHBondContact O-N 2.68Å; H417-Q420 PolarHBondContact ND1-OE1 2.76Å; H417-L421 WeakPolarHBondContact O-CD1 3.25Å; H417-L421 VanDerWaalsContact O-CG 3.27Å; H417-L421 WeakPolarHBondContact O-CG 3.41Å; H417-L421 PolarHBondContact O-N 3.35Å; H417-Y457 AromaticContact NE2-CE2 3.71Å
418	T	63.7	Low	60.7	Low	30 Å²	30	70.5 Å²	70.5	18%	0.184	37%	0.366	C	S	.	.	H	α-helix	trans	-73.7	-33.7	171.5	48.9	0	0	0	0	113.5	I414 A415 M416 L421 S422 K465	I414-T418 PolarHBondContact O-N 2.89Å; I414-T418 PolarHBondContact O-OG1 2.89Å; I414-T418 VanDerWaalsContact O-OG1 3.05Å; A415-T418 CarbonylContact O-C 3.57Å; A415-T418 WeakPolarHBondContact O-CA 3.43Å; A415-T418 PolarHBondContact O-N 2.97Å; A415-T418 PolarHBondContact O-OG1 3.15Å; M416-T418 VanDerWaalsContact C-N 3.31Å; M416-T418 PolarHBondContact O-N 3.1Å; T418-L421 PolarHBondContact O-N 2.63Å; T418-S422 PolarHBondContact O-N 2.81Å; T418-S422 PolarHBondContact O-OG 2.96Å; T418-K465 HydrophobicContact CG2-CD 3.84Å; T418-K465 HydrophobicContact CG2-CG 4.2Å; T418-K465 PolarHBondContact OG1-NZ 3.14Å; T418-K465 VanDerWaalsContact OG1-NZ 3.11Å
419	Q	64.1	Low	59.9	Low	111 Å²	111	71.2 Å²	71.2	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-65.8	-50.3	176.5	177.2	173.2	-12.2	0	0	111.4	A415 M416 L421 S422 E423	A415-Q419 PolarHBondContact O-N 3.33Å; M416-Q419 PolarHBondContact O-N 3.48Å; M416-Q419 VanDerWaalsContact O-N 3.16Å; Q419-L421 PolarHBondContact O-N 3.24Å; Q419-S422 VanDerWaalsContact CA-OG 3.31Å; Q419-S422 WeakPolarHBondContact CA-OG 3.34Å; Q419-S422 WeakPolarHBondContact O-CA 3.45Å; Q419-S422 PolarHBondContact O-N 3.02Å; Q419-S422 PolarHBondContact O-OG 3.2Å; Q419-E423 HydrophobicContact CG-CG 4.42Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.22Å; Q419-E423 PolarHBondContact NE2-OE1 2.99Å; Q419-E423 WeakPolarHBondContact O-CG 3.23Å; Q419-E423 PolarHBondContact O-N 3.3Å
420	Q	58.4	Low	59	Low	69 Å²	69	77.9 Å²	77.9	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-54.3	-39.5	174.6	-71.8	171	-26.7	0	0	111.6	M416 H417 I424	M416-Q420 WeakPolarHBondContact O-CG 3.48Å; M416-Q420 PolarHBondContact O-N 2.9Å; H417-Q420 PolarHBondContact ND1-OE1 2.76Å; Q420-I424 WeakPolarHBondContact O-CB 3.39Å; Q420-I424 WeakPolarHBondContact O-CD1 3.48Å; Q420-I424 WeakPolarHBondContact O-CG1 3.24Å; Q420-I424 PolarHBondContact O-N 3.22Å
421	L	59.5	Low	58	Low	55 Å²	55	81 Å²	81	29%	0.288	42%	0.42	S	S	.	.	H	α-helix	trans	-75.4	-27.1	177.2	-70.8	173.3	0	0	0	113.8	H417 T418 Q419 S425	H417-L421 WeakPolarHBondContact O-CD1 3.25Å; H417-L421 VanDerWaalsContact O-CG 3.27Å; H417-L421 WeakPolarHBondContact O-CG 3.41Å; H417-L421 PolarHBondContact O-N 3.35Å; T418-L421 PolarHBondContact O-N 2.63Å; Q419-L421 PolarHBondContact O-N 3.24Å; L421-S425 VanDerWaalsContact O-CB 3.29Å; L421-S425 WeakPolarHBondContact O-CB 3.39Å; L421-S425 PolarHBondContact O-N 3.26Å; L421-S425 PolarHBondContact O-OG 3.41Å
422	S	59.1	Low	56.9	Low	61 Å²	61	86.1 Å²	86.1	43%	0.427	44%	0.435	S	S	.	.	H	α-helix	trans	-67.9	-48.6	167.1	35.9	0	0	0	0	111.3	T418 Q419 S425 S426	T418-S422 PolarHBondContact O-N 2.81Å; T418-S422 PolarHBondContact O-OG 2.96Å; Q419-S422 VanDerWaalsContact CA-OG 3.31Å; Q419-S422 WeakPolarHBondContact CA-OG 3.34Å; Q419-S422 WeakPolarHBondContact O-CA 3.45Å; Q419-S422 PolarHBondContact O-N 3.02Å; Q419-S422 PolarHBondContact O-OG 3.2Å; S422-S425 CarbonylContact O-C 3.44Å; S422-S425 WeakPolarHBondContact O-CA 3.26Å; S422-S425 WeakPolarHBondContact O-CB 3.34Å; S422-S425 PolarHBondContact O-N 2.92Å; S422-S425 PolarHBondContact O-OG 3.27Å; S422-S426 PolarHBondContact O-N 2.88Å; S422-S426 PolarHBondContact O-OG 3.04Å
423	E	58.4	Low	55.7	Low	82 Å²	82	85 Å²	85	38%	0.383	44%	0.442	S	S	.	.	H	α-helix	trans	-58.8	-52.6	-179.2	-70.1	162.4	173.2	0	0	111.4	Q419 S425 S426 D427	Q419-E423 HydrophobicContact CG-CG 4.42Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.22Å; Q419-E423 PolarHBondContact NE2-OE1 2.99Å; Q419-E423 WeakPolarHBondContact O-CG 3.23Å; Q419-E423 PolarHBondContact O-N 3.3Å; E423-S425 PolarHBondContact O-N 3.26Å; E423-S425 VanDerWaalsContact O-N 3.08Å; E423-S426 WeakPolarHBondContact CA-OG 3.13Å; E423-S426 PolarHBondContact O-N 3.11Å; E423-S426 PolarHBondContact O-OG 3.41Å; E423-D427 PolarHBondContact O-N 3.05Å
424	I	58.7	Low	54.2	Low	107 Å²	107	89.8 Å²	89.8	55%	0.549	47%	0.469	S	S	.	.	H	α-helix	trans	-56.9	-29	173.9	-68.7	165.6	0	0	0	111.7	Q420 K428	Q420-I424 WeakPolarHBondContact O-CB 3.39Å; Q420-I424 WeakPolarHBondContact O-CD1 3.48Å; Q420-I424 WeakPolarHBondContact O-CG1 3.24Å; Q420-I424 PolarHBondContact O-N 3.22Å; I424-K428 WeakPolarHBondContact O-CB 3.47Å; I424-K428 PolarHBondContact O-N 2.89Å
425	S	52.9	Low	52.8	Low	39 Å²	39	94.9 Å²	94.9	27%	0.273	51%	0.505	S	S	.	.	H	α-helix	trans	-84.7	-23.9	177.9	83	0	0	0	0	114.6	L421 S422 E423 K451	L421-S425 VanDerWaalsContact O-CB 3.29Å; L421-S425 WeakPolarHBondContact O-CB 3.39Å; L421-S425 PolarHBondContact O-N 3.26Å; L421-S425 PolarHBondContact O-OG 3.41Å; S422-S425 CarbonylContact O-C 3.44Å; S422-S425 WeakPolarHBondContact O-CA 3.26Å; S422-S425 WeakPolarHBondContact O-CB 3.34Å; S422-S425 PolarHBondContact O-N 2.92Å; S422-S425 PolarHBondContact O-OG 3.27Å; E423-S425 PolarHBondContact O-N 3.26Å; E423-S425 VanDerWaalsContact O-N 3.08Å; S425-K451 PolarHBondContact OG-NZ 3.34Å
426	S	52.3	Low	51.3	Low	61 Å²	61	97.9 Å²	97.9	43%	0.427	52%	0.518	S	S	.	.	H	α-helix	trans	-78.6	-38.2	168.3	41.6	0	0	0	0	111.9	S422 E423 K428 S429	S422-S426 PolarHBondContact O-N 2.88Å; S422-S426 PolarHBondContact O-OG 3.04Å; E423-S426 WeakPolarHBondContact CA-OG 3.13Å; E423-S426 PolarHBondContact O-N 3.11Å; E423-S426 PolarHBondContact O-OG 3.41Å; S426-K428 VanDerWaalsContact C-N 3.26Å; S426-K428 PolarHBondContact O-N 3.45Å; S426-S429 PolarHBondContact O-N 3.11Å; S426-S429 VanDerWaalsContact O-N 3.09Å; S426-S429 PolarHBondContact O-OG 3.18Å
427	D	51.3	Low	50	Low	99 Å²	99	99.8 Å²	99.8	53%	0.529	54%	0.537	S	S	.	.	H	α-helix	trans	-66.6	-33.6	177.6	-64.7	-22.7	0	0	0	111.3	E423 S429 R430 A431	E423-D427 PolarHBondContact O-N 3.05Å; D427-S429 PolarHBondContact O-N 2.74Å; D427-R430 PolarHBondContact O-N 3.03Å; D427-R430 VanDerWaalsContact O-N 3.15Å; D427-A431 WeakPolarHBondContact O-CB 3.42Å; D427-A431 PolarHBondContact O-N 2.97Å
428	K	47.6	Very low	48.8	Very low	139 Å²	139	104.4 Å²	104.4	60%	0.604	58%	0.577	S	S	*	*	H	α-helix	trans	-62.7	-23.9	173.9	-142.5	72.7	179.7	-179.8	0	113.9	I424 S426	I424-K428 WeakPolarHBondContact O-CB 3.47Å; I424-K428 PolarHBondContact O-N 2.89Å; S426-K428 VanDerWaalsContact C-N 3.26Å; S426-K428 PolarHBondContact O-N 3.45Å
429	S	43.1	Very low	47.2	Very low	101 Å²	101	106.7 Å²	106.7	71%	0.706	61%	0.607	S	S	*	*	H	α-helix	trans	-82.8	-16.8	177.3	74.5	0	0	0	0	113.5	S426 D427	S426-S429 PolarHBondContact O-N 3.11Å; S426-S429 VanDerWaalsContact O-N 3.09Å; S426-S429 PolarHBondContact O-OG 3.18Å; D427-S429 PolarHBondContact O-N 2.74Å
430	R	46	Very low	45.8	Very low	229 Å²	229	107 Å²	107	86%	0.864	62%	0.621	S	S	*	*	H	α-helix	trans	-94	-20.4	173.9	-79.7	-178.9	162.3	145.6	-3.9	114.4	D427	D427-R430 PolarHBondContact O-N 3.03Å; D427-R430 VanDerWaalsContact O-N 3.15Å
431	A	42.1	Very low	44.7	Very low	75 Å²	75	110.1 Å²	110.1	62%	0.62	65%	0.645	S	S	*	*	S	Bend	trans	-109.3	11.9	-165.7	0	0	0	0	0	116.3	D427	D427-A431 WeakPolarHBondContact O-CB 3.42Å; D427-A431 PolarHBondContact O-N 2.97Å
432	R	42.3	Very low	43.3	Very low	171 Å²	171	111.1 Å²	111.1	65%	0.645	67%	0.669	S	S	*	*			trans	-146.5	78.7	173.1	-77.9	-159.5	171.4	-167.6	-6.2	114.1
433	L	41.5	Very low	42.1	Very low	163 Å²	163	114.2 Å²	114.2	85%	0.853	69%	0.691	S	S	*	*	S	Bend		-93.4	160.2	126	-70.1	173.1	0	0	0	108.1
434	D	35.6	Very low	41	Very low	147 Å²	147	117.4 Å²	117.4	79%	0.786	72%	0.716	S	S	*	*	S	Bend	trans	67.5	142.4	177.2	-58	-38	0	0	0	120.7
435	S	34.8	Very low	39.8	Very low	108 Å²	108	115.6 Å²	115.6	76%	0.755	72%	0.724	S	S	*	*			trans	65.4	100.6	167.6	68.9	0	0	0	0	119.6
436	V	37	Very low	39.4	Very low	111 Å²	111	120.3 Å²	120.3	67%	0.673	76%	0.756	S	S	*	*			trans	-144	125	153.5	174.8	0	0	0	0	109.2
437	P	38.2	Very low	38.7	Very low	127 Å²	127	120.4 Å²	120.4	83%	0.825	77%	0.768	S	S	*	*			trans	-97.2	149.8	149.4	34.2	-28.8	0	0	0	110.4
438	A	38.3	Very low	38.5	Very low	107 Å²	107	124.9 Å²	124.9	88%	0.884	78%	0.782	S	S	*	*			trans	-101.7	151.3	-167.9	0	0	0	0	0	114.4
439	G	29.2	Very low	38.4	Very low	79 Å²	79	124.3 Å²	124.3	81%	0.814	79%	0.793	S	S	*	*			trans	-142.3	121.5	165.4	0	0	0	0	0	109.9
440	S	36.4	Very low	38.7	Very low	116 Å²	116	128.8 Å²	128.8	81%	0.811	80%	0.8	S	S	*	*			trans	-89.2	171.1	179.5	57.5	0	0	0	0	110.8
441	T	35	Very low	39.6	Very low	135 Å²	135	125.6 Å²	125.6	83%	0.828	79%	0.792	S	S	*	*			cis	-144.2	159	18.1	50.5	0	0	0	0	110.5
442	G	29.7	Very low	40.9	Very low	77 Å²	77	122.9 Å²	122.9	79%	0.794	77%	0.772	S	S	*	*			cis	162.7	146.4	-4.1	0	0	0	0	0	111.8
443	S	32.8	Very low	42.5	Very low	126 Å²	126	116.9 Å²	116.9	88%	0.881	75%	0.751	S	S	*	*			trans	-158.6	127.1	162.3	-175.9	0	0	0	0	108.6
444	T	36.3	Very low	44.2	Very low	149 Å²	149	111.9 Å²	111.9	91%	0.914	73%	0.725	S	S	*	*			trans	-95.7	116.1	-170.4	48.9	0	0	0	0	111.8
445	G	33.3	Very low	46.2	Very low	69 Å²	69	104.9 Å²	104.9	71%	0.711	69%	0.687	S	S	*	*			trans	-169.2	114.1	170.7	0	0	0	0	0	111	G447	G445-G447 PolarHBondContact O-N 3.35Å
446	S	45.5	Very low	48.1	Very low	137 Å²	137	104.5 Å²	104.5	96%	0.958	68%	0.676	S	S	*	*			trans	-65.4	104.7	179.3	52.4	0	0	0	0	110.8
447	G	36.9	Very low	49.7	Very low	64 Å²	64	105 Å²	105	66%	0.66	67%	0.667	S	S	*	*			trans	-150.4	138.4	-179.2	0	0	0	0	0	112.1	G445	G445-G447 PolarHBondContact O-N 3.35Å
448	K	47.2	Very low	51.5	Low	192 Å²	192	101.6 Å²	101.6	84%	0.835	65%	0.645	S	S	*	*			trans	-52.8	143.4	170.2	-59.8	172.1	-177.6	177.3	0	109.2	K450	K448-K450 PolarHBondContact O-N 2.83Å
449	P	44.7	Very low	53.3	Low	128 Å²	128	99 Å²	99	83%	0.831	63%	0.629	S	S	*	*			trans	-59.1	109.1	179.7	24.5	-33.8	0	0	0	109.7	K451	P449-K451 PolarHBondContact O-N 3.34Å
450	K	49.9	Very low	55.5	Low	195 Å²	195	100.6 Å²	100.6	85%	0.848	61%	0.613	S	S	*	*			trans	-69.4	100.9	-178.5	-68.9	-177.9	177.8	179.3	0	108.4	K448 G452	K448-K450 PolarHBondContact O-N 2.83Å; K450-G452 PolarHBondContact O-N 2.85Å
451	K	64.1	Low	57.5	Low	161 Å²	161	100.6 Å²	100.6	70%	0.7	60%	0.604	S	S	*	*			trans	-56.2	106.7	166.3	-76.6	-164.3	178.7	-169.4	0	107.5	S425 P449	S425-K451 PolarHBondContact OG-NZ 3.34Å; P449-K451 PolarHBondContact O-N 3.34Å
452	G	70.4	Confident	59.6	Low	19 Å²	19	97.1 Å²	97.1	20%	0.196	58%	0.576	C	S	.	*			trans	-103	152.3	176.5	0	0	0	0	0	110.8	K450 Y462	K450-G452 PolarHBondContact O-N 2.85Å; G452-Y462 CarbonylContact C-O 3.48Å; G452-Y462 WeakPolarHBondContact CA-O 3.34Å
453	H	76.1	Confident	61.9	Low	45 Å²	45	98.3 Å²	98.3	21%	0.208	57%	0.572	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.3	110.1	177.6	-58.2	-88.2	0	0	0	108.8	Y462 K465 L468	H453-Y462 PolarHBondContact N-O 3.25Å; H453-Y462 PolarHBondContact O-N 2.93Å; H453-K465 PolarHBondContact CD2-N 3.01Å; H453-K465 PolarHBondContact NE2-N 3.12Å; H453-L468 HydrophobicContact CB-CB 3.97Å; H453-L468 HydrophobicContact CB-CD2 3.77Å; H453-L468 HydrophobicContact CB-CG 4.48Å
454	L	76.2	Confident	64	Low	58 Å²	58	96.5 Å²	96.5	30%	0.304	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.9	-179.1	-171.2	68.1	0	0	0	110.8	L456 G459 L461	L454-L456 HydrophobicContact CD2-CD2 3.99Å; L454-L456 HydrophobicContact CG-CD2 4.3Å; L454-G459 VanDerWaalsContact CD1-O 3.25Å; L454-G459 WeakPolarHBondContact CD1-O 3.4Å; L454-L461 HydrophobicContact CB-CD1 4.16Å; L454-L461 HydrophobicContact CD1-CB 4.42Å; L454-L461 HydrophobicContact CD1-CD1 4.14Å
455	C	78.8	Confident	65.9	Low	0 Å²	0	94 Å²	94	0%	0	52%	0.522	C	S	.	.			trans	-79.9	111.8	166	175	0	0	0	0	110	Y457 C458 G459 K460 L468 H471 M472 H475	C455-Y457 VanDerWaalsContact C-N 3.29Å; C455-Y457 PolarHBondContact O-N 3.47Å; C455-C458 PolarHBondContact O-N 3.46Å; C455-G459 WeakPolarHBondContact O-CA 3.41Å; C455-G459 PolarHBondContact O-N 2.81Å; C455-K460 HydrophobicContact CB-CB 4.43Å; C455-K460 WeakPolarHBondContact CB-O 3.35Å; C455-K460 PolarHBondContact N-O 3.38Å; C455-L468 HydrophobicContact CB-CD1 3.64Å; C455-H471 VanDerWaalsContact SG-CD2 3.6Å; C455-H471 PolarHBondContact SG-NE2 2.94Å; C455-H471 VanDerWaalsContact SG-NE2 3.43Å; C455-M472 WeakPolarHBondContact SG-CE 3.45Å; C455-H475 PolarHBondContact SG-NE2 2.85Å
456	L	73.2	Confident	68	Low	99 Å²	99	95.3 Å²	95.3	52%	0.518	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.6	179.5	-58.4	-165	0	0	0	112.7	L454 C458	L454-L456 HydrophobicContact CD2-CD2 3.99Å; L454-L456 HydrophobicContact CG-CD2 4.3Å; L456-C458 VanDerWaalsContact C-N 3.29Å; L456-C458 PolarHBondContact O-N 2.87Å
457	Y	72	Confident	69.5	Low	123 Å²	123	89.8 Å²	89.8	48%	0.482	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19	178.9	-65.7	-102.6	0	0	0	115.2	H417 C455 M472	H417-Y457 AromaticContact NE2-CE2 3.71Å; C455-Y457 VanDerWaalsContact C-N 3.29Å; C455-Y457 PolarHBondContact O-N 3.47Å; Y457-M472 HydrophobicContact CD2-CE 3.53Å; Y457-M472 HydrophobicContact CD2-SD 4.19Å; Y457-M472 HydrophobicContact CE2-CE 4.16Å; Y457-M472 HydrophobicContact CE2-SD 4.45Å; Y457-M472 HydrophobicContact CG-CE 4.13Å
458	C	76.1	Confident	71.4	Confident	55 Å²	55	86.9 Å²	86.9	37%	0.372	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.6	17.4	177.1	71.9	0	0	0	0	116.2	C455 L456 K460 H471	C455-C458 PolarHBondContact O-N 3.46Å; L456-C458 VanDerWaalsContact C-N 3.29Å; L456-C458 PolarHBondContact O-N 2.87Å; C458-K460 PolarHBondContact O-N 3.25Å; C458-K460 VanDerWaalsContact O-N 3.1Å; C458-H471 PolarHBondContact SG-NE2 3.29Å
459	G	74.7	Confident	72.7	Confident	53 Å²	53	80.3 Å²	80.3	55%	0.546	41%	0.412	S	S	.	.			trans	67.8	7.7	174.2	0	0	0	0	0	116.3	L454 C455	L454-G459 VanDerWaalsContact CD1-O 3.25Å; L454-G459 WeakPolarHBondContact CD1-O 3.4Å; C455-G459 WeakPolarHBondContact O-CA 3.41Å; C455-G459 PolarHBondContact O-N 2.81Å
460	K	75.3	Confident	74.2	Confident	111 Å²	111	76.1 Å²	76.1	48%	0.483	38%	0.382	S	S	.	.			trans	-77.8	126.6	-179.2	-71.7	177.8	-172.8	165.9	0	111.7	C455 C458 Y462	C455-K460 HydrophobicContact CB-CB 4.43Å; C455-K460 WeakPolarHBondContact CB-O 3.35Å; C455-K460 PolarHBondContact N-O 3.38Å; C458-K460 PolarHBondContact O-N 3.25Å; C458-K460 VanDerWaalsContact O-N 3.1Å; K460-Y462 HydrophobicContact CB-CD2 4.48Å; K460-Y462 HydrophobicContact CB-CE2 3.58Å; K460-Y462 WeakPolarHBondContact O-CD2 3.28Å
461	L	78.8	Confident	75.5	Confident	116 Å²	116	67.4 Å²	67.4	61%	0.607	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	128.2	178.1	-166.2	80.1	0	0	0	111.1	L454	L454-L461 HydrophobicContact CB-CD1 4.16Å; L454-L461 HydrophobicContact CD1-CB 4.42Å; L454-L461 HydrophobicContact CD1-CD1 4.14Å
462	Y	79	Confident	75.9	Confident	63 Å²	63	59.8 Å²	59.8	25%	0.247	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.9	177.6	-69.1	-91.7	0	0	0	111.2	G452 H453 K460 R464 L468 H471	G452-Y462 CarbonylContact C-O 3.48Å; G452-Y462 WeakPolarHBondContact CA-O 3.34Å; H453-Y462 PolarHBondContact N-O 3.25Å; H453-Y462 PolarHBondContact O-N 2.93Å; K460-Y462 HydrophobicContact CB-CD2 4.48Å; K460-Y462 HydrophobicContact CB-CE2 3.58Å; K460-Y462 WeakPolarHBondContact O-CD2 3.28Å; Y462-R464 VanDerWaalsContact C-N 3.27Å; Y462-R464 PolarHBondContact O-N 3.31Å; Y462-L468 HydrophobicContact CD2-CB 4.42Å; Y462-L468 HydrophobicContact CD2-CD1 4.11Å; Y462-L468 HydrophobicContact CG-CB 4.48Å; Y462-H471 HydrophobicContact CE1-CB 4.05Å; Y462-H471 HydrophobicContact CE2-CB 3.82Å; Y462-H471 AromaticContact CE2-CD2 3.29Å; Y462-H471 WeakPolarHBondContact CE2-CD2 3.5Å; Y462-H471 AromaticContact CE2-CG 3.67Å; Y462-H471 AromaticContact CZ-CD2 3.6Å; Y462-H471 AromaticContact CZ-CG 3.51Å; Y462-H471 PolarHBondContact OH-CD2 3.45Å; Y462-H471 PolarHBondContact OH-ND1 3.03Å
463	S	78.8	Confident	76.1	Confident	102 Å²	102	60.7 Å²	60.7	71%	0.713	31%	0.309	S	S	*	.	S	Bend	trans	-73.9	-13	-179.1	52.3	0	0	0	0	114.7
464	R	77.1	Confident	75.9	Confident	88 Å²	88	63.2 Å²	63.2	33%	0.332	33%	0.327	S	S	.	.	S	Bend	trans	-145.2	146.8	-178.2	-74.9	-179.8	-75	173.1	-21.7	111.7	Y462 Y466 G467 L468 D561	Y462-R464 VanDerWaalsContact C-N 3.27Å; Y462-R464 PolarHBondContact O-N 3.31Å; R464-Y466 VanDerWaalsContact C-N 3.26Å; R464-Y466 PolarHBondContact O-N 3.24Å; R464-G467 PolarHBondContact O-N 2.85Å; R464-L468 PolarHBondContact O-N 2.92Å; R464-D561 IonicContact CZ-OD1 2.73Å; R464-D561 IonicContact CZ-OD2 3.13Å; R464-D561 IonicContact NE-OD1 3.83Å; R464-D561 IonicContact NE-OD2 2.77Å; R464-D561 PolarHBondContact NE-OD2 3.1Å; R464-D561 IonicContact NH1-OD1 3.38Å; R464-D561 PolarHBondContact NH1-OD1 2.98Å; R464-D561 IonicContact NH1-OD2 3.16Å; R464-D561 PolarHBondContact NH1-OD2 3.17Å; R464-D561 VanDerWaalsContact NH2-CG 3.28Å; R464-D561 IonicContact NH2-OD1 2.72Å; R464-D561 PolarHBondContact NH2-OD1 3.33Å; R464-D561 IonicContact NH2-OD2 2.78Å; R464-D561 PolarHBondContact NH2-OD2 2.83Å
465	K	74.9	Confident	75.6	Confident	96 Å²	96	63.9 Å²	63.9	42%	0.417	33%	0.329	S	S	.	.	H	α-helix	trans	-55	-39.9	178	-171.9	174.1	179.9	162.3	0	112.2	I414 T418 H453 G467 L468 K469	I414-K465 HydrophobicContact CG2-CG 4.48Å; T418-K465 HydrophobicContact CG2-CD 3.84Å; T418-K465 HydrophobicContact CG2-CG 4.2Å; T418-K465 PolarHBondContact OG1-NZ 3.14Å; T418-K465 VanDerWaalsContact OG1-NZ 3.11Å; H453-K465 PolarHBondContact CD2-N 3.01Å; H453-K465 PolarHBondContact NE2-N 3.12Å; K465-G467 VanDerWaalsContact C-N 3.33Å; K465-G467 PolarHBondContact O-N 3.06Å; K465-L468 PolarHBondContact O-N 3.12Å; K465-K469 PolarHBondContact O-N 3.42Å
466	Y	77.8	Confident	75	Confident	97 Å²	97	66.5 Å²	66.5	38%	0.38	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-39	175.4	179.8	-108.1	0	0	0	113.2	R464 K469 I470 P493	R464-Y466 VanDerWaalsContact C-N 3.26Å; R464-Y466 PolarHBondContact O-N 3.24Å; Y466-K469 PolarHBondContact O-N 2.99Å; Y466-I470 HydrophobicContact CD1-CD1 4.1Å; Y466-I470 HydrophobicContact CE1-CD1 3.45Å; Y466-I470 VanDerWaalsContact CE1-CD1 3.45Å; Y466-I470 HydrophobicContact CE1-CG1 4.35Å; Y466-I470 HydrophobicContact CE2-CD1 4.32Å; Y466-I470 HydrophobicContact CE2-CG1 4.5Å; Y466-I470 PolarHBondContact O-N 3.39Å; Y466-P493 WeakPolarHBondContact OH-CD 3.18Å; Y466-P493 VanDerWaalsContact OH-CG 3.26Å; Y466-P493 WeakPolarHBondContact OH-CG 3.31Å
467	G	76.8	Confident	74.6	Confident	21 Å²	21	63.4 Å²	63.4	22%	0.216	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-38.4	175.7	0	0	0	0	0	112.7	R464 K465 H471	R464-G467 PolarHBondContact O-N 2.85Å; K465-G467 VanDerWaalsContact C-N 3.33Å; K465-G467 PolarHBondContact O-N 3.06Å; G467-H471 WeakPolarHBondContact O-CB 3.48Å; G467-H471 PolarHBondContact O-N 2.91Å
468	L	77.5	Confident	74.4	Confident	2 Å²	2	60 Å²	60	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-68.2	-43.9	171.1	-178.3	61.1	0	0	0	111.5	H453 C455 Y462 R464 K465 I470 H471 M472	H453-L468 HydrophobicContact CB-CB 3.97Å; H453-L468 HydrophobicContact CB-CD2 3.77Å; H453-L468 HydrophobicContact CB-CG 4.48Å; C455-L468 HydrophobicContact CB-CD1 3.64Å; Y462-L468 HydrophobicContact CD2-CB 4.42Å; Y462-L468 HydrophobicContact CD2-CD1 4.11Å; Y462-L468 HydrophobicContact CG-CB 4.48Å; R464-L468 PolarHBondContact O-N 2.92Å; K465-L468 PolarHBondContact O-N 3.12Å; L468-I470 VanDerWaalsContact C-N 3.31Å; L468-I470 PolarHBondContact O-N 2.76Å; L468-H471 CarbonylContact O-C 3.59Å; L468-H471 WeakPolarHBondContact O-CA 3.32Å; L468-H471 PolarHBondContact O-N 3Å; L468-M472 HydrophobicContact CD1-CG 3.88Å; L468-M472 HydrophobicContact CD1-SD 3.98Å; L468-M472 HydrophobicContact CG-CG 4.01Å; L468-M472 HydrophobicContact CG-SD 4.45Å; L468-M472 VanDerWaalsContact O-CG 3.23Å; L468-M472 WeakPolarHBondContact O-CG 3.36Å; L468-M472 PolarHBondContact O-N 3.48Å
469	K	75.5	Confident	74.2	Confident	55 Å²	55	62 Å²	62	24%	0.239	33%	0.326	C	S	.	.	H	α-helix	trans	-58.3	-40.1	177.1	-180	157.1	-176.7	170.9	0	112.5	D411 I414 K465 Y466	D411-K469 WeakPolarHBondContact OD1-CE 3.46Å; D411-K469 IonicContact OD1-NZ 2.69Å; D411-K469 PolarHBondContact OD1-NZ 3.27Å; D411-K469 WeakPolarHBondContact OD2-CE 3.22Å; D411-K469 IonicContact OD2-NZ 2.8Å; D411-K469 PolarHBondContact OD2-NZ 3.25Å; I414-K469 HydrophobicContact CD1-CB 3.78Å; I414-K469 HydrophobicContact CD1-CD 3.97Å; I414-K469 HydrophobicContact CD1-CG 3.59Å; K465-K469 PolarHBondContact O-N 3.42Å; Y466-K469 PolarHBondContact O-N 2.99Å
470	I	74.9	Confident	73.8	Confident	39 Å²	39	61.8 Å²	61.8	20%	0.2	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-48.6	168.9	-82.5	-178.7	0	0	0	111.1	Y466 L468 M472 R473 D492	Y466-I470 HydrophobicContact CD1-CD1 4.1Å; Y466-I470 HydrophobicContact CE1-CD1 3.45Å; Y466-I470 VanDerWaalsContact CE1-CD1 3.45Å; Y466-I470 HydrophobicContact CE1-CG1 4.35Å; Y466-I470 HydrophobicContact CE2-CD1 4.32Å; Y466-I470 HydrophobicContact CE2-CG1 4.5Å; Y466-I470 PolarHBondContact O-N 3.39Å; L468-I470 VanDerWaalsContact C-N 3.31Å; L468-I470 PolarHBondContact O-N 2.76Å; I470-M472 PolarHBondContact O-N 3.37Å; I470-R473 WeakPolarHBondContact O-CB 3.45Å; I470-R473 PolarHBondContact O-N 3.25Å; I470-D492 HydrophobicContact CD1-CB 4.08Å; I470-D492 HydrophobicContact CG1-CB 4.42Å; I470-D492 WeakPolarHBondContact CG1-OD1 3.4Å; I470-D492 WeakPolarHBondContact CG2-OD1 3.39Å
471	H	77.5	Confident	73.5	Confident	13 Å²	13	59 Å²	59	6%	0.06	31%	0.306	C	S	.	.	H	α-helix	trans	-66.8	-34.4	-176.8	178.9	41.9	0	0	0	113.5	C455 C458 Y462 G467 L468 R473 T474 H475	C455-H471 VanDerWaalsContact SG-CD2 3.6Å; C455-H471 PolarHBondContact SG-NE2 2.94Å; C455-H471 VanDerWaalsContact SG-NE2 3.43Å; C458-H471 PolarHBondContact SG-NE2 3.29Å; Y462-H471 HydrophobicContact CE1-CB 4.05Å; Y462-H471 HydrophobicContact CE2-CB 3.82Å; Y462-H471 AromaticContact CE2-CD2 3.29Å; Y462-H471 WeakPolarHBondContact CE2-CD2 3.5Å; Y462-H471 AromaticContact CE2-CG 3.67Å; Y462-H471 AromaticContact CZ-CD2 3.6Å; Y462-H471 AromaticContact CZ-CG 3.51Å; Y462-H471 PolarHBondContact OH-CD2 3.45Å; Y462-H471 PolarHBondContact OH-ND1 3.03Å; G467-H471 WeakPolarHBondContact O-CB 3.48Å; G467-H471 PolarHBondContact O-N 2.91Å; L468-H471 CarbonylContact O-C 3.59Å; L468-H471 WeakPolarHBondContact O-CA 3.32Å; L468-H471 PolarHBondContact O-N 3Å; H471-R473 PolarHBondContact O-N 3.13Å; H471-T474 PolarHBondContact CE1-OG1 2.95Å; H471-T474 VanDerWaalsContact CE1-OG1 3.32Å; H471-T474 PolarHBondContact ND1-OG1 3.04Å; H471-T474 WeakPolarHBondContact O-CA 3.48Å; H471-T474 WeakPolarHBondContact O-CB 3.26Å; H471-T474 PolarHBondContact O-N 3.12Å; H471-T474 PolarHBondContact O-OG1 2.95Å; H471-H475 AromaticContact CD2-NE2 3.94Å; H471-H475 AromaticContact CE1-CD2 3.73Å; H471-H475 AromaticContact CE1-NE2 3.14Å; H471-H475 PolarHBondContact CE1-NE2 3.45Å; H471-H475 AromaticContact NE2-CD2 3.77Å; H471-H475 AromaticContact NE2-NE2 3.02Å; H471-H475 PolarHBondContact NE2-NE2 3.35Å
472	M	71.8	Confident	73.2	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-30.4	179.8	-59.6	-87	51	0	0	112	I414 C455 Y457 L468 I470 T474 H475 T476	I414-M472 HydrophobicContact CG1-CG 4.31Å; C455-M472 WeakPolarHBondContact SG-CE 3.45Å; Y457-M472 HydrophobicContact CD2-CE 3.53Å; Y457-M472 HydrophobicContact CD2-SD 4.19Å; Y457-M472 HydrophobicContact CE2-CE 4.16Å; Y457-M472 HydrophobicContact CE2-SD 4.45Å; Y457-M472 HydrophobicContact CG-CE 4.13Å; L468-M472 HydrophobicContact CD1-CG 3.88Å; L468-M472 HydrophobicContact CD1-SD 3.98Å; L468-M472 HydrophobicContact CG-CG 4.01Å; L468-M472 HydrophobicContact CG-SD 4.45Å; L468-M472 VanDerWaalsContact O-CG 3.23Å; L468-M472 WeakPolarHBondContact O-CG 3.36Å; L468-M472 PolarHBondContact O-N 3.48Å; I470-M472 PolarHBondContact O-N 3.37Å; M472-T474 PolarHBondContact O-N 3.32Å; M472-T474 VanDerWaalsContact O-N 3.14Å; M472-H475 HydrophobicContact CE-CB 4.35Å; M472-H475 WeakPolarHBondContact CE-CD2 3.44Å; M472-H475 PolarHBondContact O-N 3.43Å; M472-T476 PolarHBondContact O-N 2.82Å; M472-T476 PolarHBondContact O-OG1 3.25Å
473	R	75	Confident	73	Confident	39 Å²	39	57 Å²	57	15%	0.147	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.4	169.4	-65.2	174.7	-177.7	150.9	3.4	114.5	I470 H471 G477 Y478 G491	I470-R473 WeakPolarHBondContact O-CB 3.45Å; I470-R473 PolarHBondContact O-N 3.25Å; H471-R473 PolarHBondContact O-N 3.13Å; R473-G477 CarbonylContact O-C 3.44Å; R473-G477 WeakPolarHBondContact O-CA 3.29Å; R473-G477 PolarHBondContact O-N 2.92Å; R473-Y478 WeakPolarHBondContact CB-O 3.17Å; R473-Y478 HydrophobicContact CG-CD1 4.46Å; R473-Y478 PolarHBondContact O-N 2.82Å; R473-G491 VanDerWaalsContact CD-O 3.23Å; R473-G491 WeakPolarHBondContact CD-O 3.4Å; R473-G491 PolarHBondContact NH1-O 2.84Å
474	T	71.7	Confident	72.5	Confident	98 Å²	98	61.4 Å²	61.4	60%	0.601	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-15.9	172.8	69.3	0	0	0	0	113.5	H471 M472	H471-T474 PolarHBondContact CE1-OG1 2.95Å; H471-T474 VanDerWaalsContact CE1-OG1 3.32Å; H471-T474 PolarHBondContact ND1-OG1 3.04Å; H471-T474 WeakPolarHBondContact O-CA 3.48Å; H471-T474 WeakPolarHBondContact O-CB 3.26Å; H471-T474 PolarHBondContact O-N 3.12Å; H471-T474 PolarHBondContact O-OG1 2.95Å; M472-T474 PolarHBondContact O-N 3.32Å; M472-T474 VanDerWaalsContact O-N 3.14Å
475	H	70.6	Confident	72	Confident	72 Å²	72	61.5 Å²	61.5	33%	0.333	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-46.2	171.7	-65.2	-85.2	0	0	0	111.4	C455 H471 M472 G477	C455-H475 PolarHBondContact SG-NE2 2.85Å; H471-H475 AromaticContact CD2-NE2 3.94Å; H471-H475 AromaticContact CE1-CD2 3.73Å; H471-H475 AromaticContact CE1-NE2 3.14Å; H471-H475 PolarHBondContact CE1-NE2 3.45Å; H471-H475 AromaticContact NE2-CD2 3.77Å; H471-H475 AromaticContact NE2-NE2 3.02Å; H471-H475 PolarHBondContact NE2-NE2 3.35Å; M472-H475 HydrophobicContact CE-CB 4.35Å; M472-H475 WeakPolarHBondContact CE-CD2 3.44Å; M472-H475 PolarHBondContact O-N 3.43Å; H475-G477 PolarHBondContact O-N 2.97Å
476	T	66.5	Low	71.6	Confident	54 Å²	54	59.7 Å²	59.7	33%	0.331	31%	0.308	S	S	.	.	S	Bend	trans	-81	0.2	-179.8	61.2	0	0	0	0	113.8	I410 M472 Y478	I410-T476 HydrophobicContact CD1-CG2 4.46Å; I410-T476 WeakPolarHBondContact CD1-OG1 3.44Å; I410-T476 HydrophobicContact CG1-CG2 4.17Å; M472-T476 PolarHBondContact O-N 2.82Å; M472-T476 PolarHBondContact O-OG1 3.25Å; T476-Y478 PolarHBondContact O-N 2.8Å
477	G	64.8	Low	71.2	Confident	35 Å²	35	62.2 Å²	62.2	36%	0.361	32%	0.322	S	S	.	.			trans	64.4	-1.9	-177.6	0	0	0	0	0	115.5	R473 H475 K479	R473-G477 CarbonylContact O-C 3.44Å; R473-G477 WeakPolarHBondContact O-CA 3.29Å; R473-G477 PolarHBondContact O-N 2.92Å; H475-G477 PolarHBondContact O-N 2.97Å; G477-K479 WeakPolarHBondContact O-CE 3.45Å; G477-K479 WeakPolarHBondContact O-CG 3.41Å; G477-K479 PolarHBondContact O-NZ 2.91Å
478	Y	67.5	Low	70.7	Confident	50 Å²	50	69 Å²	69	20%	0.196	34%	0.341	C	S	.	.			trans	-74.1	126.4	-163.9	-178.1	-102.9	0	0	0	113.7	S406 I407 I410 R473 T476 P480	S406-Y478 WeakPolarHBondContact OG-CE2 3.4Å; I407-Y478 WeakPolarHBondContact CD1-OH 3.25Å; I407-Y478 HydrophobicContact CG1-CE1 4.33Å; I407-Y478 HydrophobicContact CG1-CE2 4.41Å; I407-Y478 WeakPolarHBondContact CG1-OH 2.82Å; I410-Y478 HydrophobicContact CD1-CD1 3.53Å; I410-Y478 HydrophobicContact CD1-CD2 4.17Å; I410-Y478 HydrophobicContact CD1-CE1 4.43Å; I410-Y478 HydrophobicContact CD1-CG 3.4Å; R473-Y478 WeakPolarHBondContact CB-O 3.17Å; R473-Y478 HydrophobicContact CG-CD1 4.46Å; R473-Y478 PolarHBondContact O-N 2.82Å; T476-Y478 PolarHBondContact O-N 2.8Å; Y478-P480 HydrophobicContact CD1-CG 4.18Å; Y478-P480 HydrophobicContact CE1-CB 3.64Å; Y478-P480 HydrophobicContact CE1-CG 3.62Å
479	K	72	Confident	70.1	Confident	97 Å²	97	71.9 Å²	71.9	42%	0.422	36%	0.359	S	S	.	.			trans	-131	82.2	-170.3	-66.2	167.4	-160.5	95.3	0	110.9	G477 L481 P489 F490	G477-K479 WeakPolarHBondContact O-CE 3.45Å; G477-K479 WeakPolarHBondContact O-CG 3.41Å; G477-K479 PolarHBondContact O-NZ 2.91Å; K479-L481 PolarHBondContact O-N 2.84Å; K479-P489 HydrophobicContact CB-CB 3.76Å; K479-P489 HydrophobicContact CD-CB 4.17Å; K479-P489 HydrophobicContact CD-CG 4.1Å; K479-F490 CarbonylContact C-O 3.34Å; K479-F490 VanDerWaalsContact C-O 3.3Å; K479-F490 WeakPolarHBondContact CA-O 3.33Å
480	P	65.7	Low	70	Confident	49 Å²	49	70.9 Å²	70.9	32%	0.318	36%	0.355	S	S	.	.			trans	-66.7	-22.1	-173.5	20.2	-25.6	0	0	0	113.6	Y478 K482	Y478-P480 HydrophobicContact CD1-CG 4.18Å; Y478-P480 HydrophobicContact CE1-CB 3.64Å; Y478-P480 HydrophobicContact CE1-CG 3.62Å; P480-K482 PolarHBondContact O-N 3.23Å
481	L	69.3	Low	69.7	Low	54 Å²	54	69.7 Å²	69.7	28%	0.283	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	89.2	-163.2	-65.8	168	0	0	0	111	K479 F490 P493 L496	K479-L481 PolarHBondContact O-N 2.84Å; L481-F490 HydrophobicContact CB-CB 4.41Å; L481-F490 PolarHBondContact N-O 3.12Å; L481-F490 VanDerWaalsContact N-O 3.12Å; L481-F490 WeakPolarHBondContact O-CB 3.26Å; L481-F490 PolarHBondContact O-N 2.75Å; L481-P493 HydrophobicContact CD1-CB 3.88Å; L481-P493 HydrophobicContact CD1-CG 4.32Å; L481-P493 VanDerWaalsContact CD1-N 3.27Å; L481-L496 HydrophobicContact CB-CB 4.48Å; L481-L496 HydrophobicContact CB-CD2 3.88Å
482	K	72.6	Confident	69.6	Low	135 Å²	135	70.3 Å²	70.3	59%	0.587	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	136.4	176.1	-63.7	171.9	-175.3	171.5	0	110.6	P480 P489	P480-K482 PolarHBondContact O-N 3.23Å; K482-P489 HydrophobicContact CG-CB 4.24Å
483	C	74.1	Confident	69.6	Low	2 Å²	2	73 Å²	73	1%	0.014	37%	0.374	C	S	.	.			trans	-71.3	127.6	175	-176.9	0	0	0	0	111.4	V485 F487 R488 F490 L496 H499	C483-V485 PolarHBondContact O-N 3.32Å; C483-F487 WeakPolarHBondContact O-CA 3.24Å; C483-F487 PolarHBondContact O-N 2.71Å; C483-R488 PolarHBondContact N-O 2.62Å; C483-F490 HydrophobicContact CB-CE2 4.28Å; C483-L496 HydrophobicContact CB-CD1 3.75Å; C483-H499 VanDerWaalsContact SG-CD2 3.59Å
484	K	69.9	Low	69.6	Low	194 Å²	194	74.1 Å²	74.1	84%	0.843	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.5	179.2	-65.9	-169.9	177.6	-173.7	0	114.7
485	V	65.3	Low	69.6	Low	89 Å²	89	72.3 Å²	72.3	54%	0.539	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-39.1	-176.3	-172.6	0	0	0	0	112.8	C483 H503	C483-V485 PolarHBondContact O-N 3.32Å; V485-H503 HydrophobicContact CB-CB 4.13Å; V485-H503 HydrophobicContact CG1-CB 3.97Å; V485-H503 HydrophobicContact CG2-CB 4.01Å
486	C	66.4	Low	69.9	Low	58 Å²	58	70 Å²	70	39%	0.392	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	15.4	-177	79.9	0	0	0	0	114.2	R488 H499 H503	C486-R488 PolarHBondContact O-N 2.68Å; C486-H499 PolarHBondContact SG-NE2 2.82Å; C486-H503 PolarHBondContact SG-NE2 3.06Å; C486-H503 VanDerWaalsContact SG-NE2 3.44Å
487	F	69.7	Low	70.3	Confident	151 Å²	151	71.2 Å²	71.2	66%	0.662	37%	0.368	S	S	*	.			trans	56.7	-0.1	174.9	-56.4	-76.4	0	0	0	117.5	C483	C483-F487 WeakPolarHBondContact O-CA 3.24Å; C483-F487 PolarHBondContact O-N 2.71Å
488	R	66.7	Low	70.6	Confident	163 Å²	163	73.9 Å²	73.9	62%	0.615	37%	0.37	S	S	*	.			trans	-59.2	129.5	-179.6	-169.4	170.1	-171.6	143	3.4	110.9	C483 C486 F490	C483-R488 PolarHBondContact N-O 2.62Å; C486-R488 PolarHBondContact O-N 2.68Å; R488-F490 HydrophobicContact CB-CE2 3.98Å; R488-F490 HydrophobicContact CB-CZ 4.42Å; R488-F490 HydrophobicContact CG-CE2 4.05Å; R488-F490 HydrophobicContact CG-CZ 4.13Å; R488-F490 VanDerWaalsContact O-CD2 3.22Å; R488-F490 WeakPolarHBondContact O-CD2 3.47Å; R488-F490 VanDerWaalsContact O-CE2 3.24Å; R488-F490 WeakPolarHBondContact O-CE2 3.45Å
489	P	65.6	Low	70.9	Confident	62 Å²	62	72.6 Å²	72.6	40%	0.403	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	141.5	-176.6	34.4	-36.4	0	0	0	112.6	K479 K482	K479-P489 HydrophobicContact CB-CB 3.76Å; K479-P489 HydrophobicContact CD-CB 4.17Å; K479-P489 HydrophobicContact CD-CG 4.1Å; K482-P489 HydrophobicContact CG-CB 4.24Å
490	F	73	Confident	70.9	Confident	35 Å²	35	71.3 Å²	71.3	15%	0.154	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149	179.3	-65.2	-92.4	0	0	0	111.7	K479 L481 C483 R488 N495 L496 H499	K479-F490 CarbonylContact C-O 3.34Å; K479-F490 VanDerWaalsContact C-O 3.3Å; K479-F490 WeakPolarHBondContact CA-O 3.33Å; L481-F490 HydrophobicContact CB-CB 4.41Å; L481-F490 PolarHBondContact N-O 3.12Å; L481-F490 VanDerWaalsContact N-O 3.12Å; L481-F490 WeakPolarHBondContact O-CB 3.26Å; L481-F490 PolarHBondContact O-N 2.75Å; C483-F490 HydrophobicContact CB-CE2 4.28Å; R488-F490 HydrophobicContact CB-CE2 3.98Å; R488-F490 HydrophobicContact CB-CZ 4.42Å; R488-F490 HydrophobicContact CG-CE2 4.05Å; R488-F490 HydrophobicContact CG-CZ 4.13Å; R488-F490 VanDerWaalsContact O-CD2 3.22Å; R488-F490 WeakPolarHBondContact O-CD2 3.47Å; R488-F490 VanDerWaalsContact O-CE2 3.24Å; R488-F490 WeakPolarHBondContact O-CE2 3.45Å; F490-N495 HydrophobicContact CD1-CB 4.45Å; F490-L496 HydrophobicContact CB-CB 4.24Å; F490-L496 HydrophobicContact CD2-CB 4.34Å; F490-L496 HydrophobicContact CD2-CD1 3.83Å; F490-L496 HydrophobicContact CE2-CD1 4.15Å; F490-L496 HydrophobicContact CG-CB 4.3Å; F490-H499 HydrophobicContact CE1-CB 4Å; F490-H499 HydrophobicContact CE2-CB 4.19Å; F490-H499 AromaticContact CE2-CD2 3.26Å; F490-H499 WeakPolarHBondContact CE2-CD2 3.16Å; F490-H499 AromaticContact CE2-CG 3.7Å; F490-H499 AromaticContact CE2-NE2 3.77Å; F490-H499 HydrophobicContact CZ-CB 3.63Å; F490-H499 AromaticContact CZ-CD2 3.33Å; F490-H499 WeakPolarHBondContact CZ-CD2 3.47Å; F490-H499 AromaticContact CZ-CG 3.24Å; F490-H499 AromaticContact CZ-ND1 3.71Å; F490-H499 AromaticContact CZ-NE2 3.81Å
491	G	68.6	Low	71	Confident	14 Å²	14	76.6 Å²	76.6	14%	0.144	38%	0.377	C	S	.	.	S	Bend	trans	-76.4	-28.2	172.6	0	0	0	0	0	113.8	R473	R473-G491 VanDerWaalsContact CD-O 3.23Å; R473-G491 WeakPolarHBondContact CD-O 3.4Å; R473-G491 PolarHBondContact NH1-O 2.84Å
492	D	75.1	Confident	70.7	Confident	26 Å²	26	77.4 Å²	77.4	14%	0.139	38%	0.381	C	S	.	.			trans	-133.6	137.2	-162.9	-30.3	-58.6	0	0	0	112.8	I470 S494 N495 L496	I470-D492 HydrophobicContact CD1-CB 4.08Å; I470-D492 HydrophobicContact CG1-CB 4.42Å; I470-D492 WeakPolarHBondContact CG1-OD1 3.4Å; I470-D492 WeakPolarHBondContact CG2-OD1 3.39Å; D492-S494 VanDerWaalsContact C-N 3.31Å; D492-S494 PolarHBondContact O-N 3.24Å; D492-N495 HydrophobicContact CB-CB 4.18Å; D492-N495 PolarHBondContact O-N 3.43Å; D492-N495 PolarHBondContact OD2-ND2 3.23Å; D492-L496 PolarHBondContact O-N 3.22Å
493	P	72.3	Confident	70.1	Confident	57 Å²	57	74.1 Å²	74.1	37%	0.37	37%	0.367	S	S	.	.	H	α-helix	trans	-66.9	-34.2	-178.9	27.4	-34	0	0	0	111.7	Y466 L481 N495 L496 N497	Y466-P493 WeakPolarHBondContact OH-CD 3.18Å; Y466-P493 VanDerWaalsContact OH-CG 3.26Å; Y466-P493 WeakPolarHBondContact OH-CG 3.31Å; L481-P493 HydrophobicContact CD1-CB 3.88Å; L481-P493 HydrophobicContact CD1-CG 4.32Å; L481-P493 VanDerWaalsContact CD1-N 3.27Å; P493-N495 PolarHBondContact O-N 3.42Å; P493-L496 PolarHBondContact O-N 3.07Å; P493-N497 VanDerWaalsContact O-CB 3.29Å; P493-N497 WeakPolarHBondContact O-CB 3.47Å; P493-N497 PolarHBondContact O-N 2.68Å
494	S	75.1	Confident	69.7	Low	61 Å²	61	77.8 Å²	77.8	43%	0.427	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-29	174.2	-40.7	0	0	0	0	112.4	D492 K498	D492-S494 VanDerWaalsContact C-N 3.31Å; D492-S494 PolarHBondContact O-N 3.24Å; S494-K498 WeakPolarHBondContact O-CB 3.38Å; S494-K498 VanDerWaalsContact O-CD 3.29Å; S494-K498 WeakPolarHBondContact O-CD 3.44Å; S494-K498 VanDerWaalsContact O-CE 3.25Å; S494-K498 WeakPolarHBondContact O-CE 3.25Å; S494-K498 WeakPolarHBondContact O-CG 3.42Å; S494-K498 PolarHBondContact O-N 3.37Å
495	N	71.5	Confident	68.8	Low	61 Å²	61	75.4 Å²	75.4	33%	0.326	39%	0.39	S	S	.	.	H	α-helix	trans	-88.5	-33	178.1	-71.9	-26.8	0	0	0	111.9	F490 D492 P493 K498 H499	F490-N495 HydrophobicContact CD1-CB 4.45Å; D492-N495 HydrophobicContact CB-CB 4.18Å; D492-N495 PolarHBondContact O-N 3.43Å; D492-N495 PolarHBondContact OD2-ND2 3.23Å; P493-N495 PolarHBondContact O-N 3.42Å; N495-K498 PolarHBondContact OD1-NZ 3.21Å; N495-H499 WeakPolarHBondContact O-CB 3.47Å; N495-H499 PolarHBondContact O-N 3.15Å
496	L	76.8	Confident	68.2	Low	22 Å²	22	75 Å²	75	12%	0.115	40%	0.403	C	S	.	.	H	α-helix	trans	-62.8	-45.2	166.7	175.2	59.1	0	0	0	111.7	L481 C483 F490 D492 P493 K498 H499 I500	L481-L496 HydrophobicContact CB-CB 4.48Å; L481-L496 HydrophobicContact CB-CD2 3.88Å; C483-L496 HydrophobicContact CB-CD1 3.75Å; F490-L496 HydrophobicContact CB-CB 4.24Å; F490-L496 HydrophobicContact CD2-CB 4.34Å; F490-L496 HydrophobicContact CD2-CD1 3.83Å; F490-L496 HydrophobicContact CE2-CD1 4.15Å; F490-L496 HydrophobicContact CG-CB 4.3Å; D492-L496 PolarHBondContact O-N 3.22Å; P493-L496 PolarHBondContact O-N 3.07Å; L496-K498 PolarHBondContact O-N 3.09Å; L496-H499 CarbonylContact O-C 3.47Å; L496-H499 WeakPolarHBondContact O-CA 3.45Å; L496-H499 WeakPolarHBondContact O-CB 3.26Å; L496-H499 PolarHBondContact O-N 2.99Å; L496-I500 HydrophobicContact CD1-CD1 3.84Å; L496-I500 HydrophobicContact CD1-CG1 3.85Å; L496-I500 HydrophobicContact CD2-CD1 4.26Å; L496-I500 HydrophobicContact CG-CD1 3.77Å; L496-I500 HydrophobicContact CG-CG1 4.23Å; L496-I500 WeakPolarHBondContact O-CG1 3.48Å; L496-I500 PolarHBondContact O-N 3.28Å
497	N	74.4	Confident	67.5	Low	80 Å²	80	76.1 Å²	76.1	43%	0.428	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-45.6	178.6	-171.4	-37.7	0	0	0	111.2	P493 H499 I500 R501	P493-N497 VanDerWaalsContact O-CB 3.29Å; P493-N497 WeakPolarHBondContact O-CB 3.47Å; P493-N497 PolarHBondContact O-N 2.68Å; N497-H499 PolarHBondContact O-N 3.26Å; N497-I500 PolarHBondContact O-N 3.18Å; N497-R501 WeakPolarHBondContact O-CG 3.29Å; N497-R501 PolarHBondContact O-N 2.79Å; N497-R501 VanDerWaalsContact O-N 3.17Å; N497-R501 PolarHBondContact OD1-NE 3.22Å; N497-R501 PolarHBondContact OD1-NH2 3.39Å
498	K	71.3	Confident	66.7	Low	91 Å²	91	74.4 Å²	74.4	40%	0.396	41%	0.407	S	S	.	.	H	α-helix	trans	-57.6	-19.1	170.3	-74.7	169.5	-151.2	163.9	0	114.5	S494 N495 L496 R521	S494-K498 WeakPolarHBondContact O-CB 3.38Å; S494-K498 VanDerWaalsContact O-CD 3.29Å; S494-K498 WeakPolarHBondContact O-CD 3.44Å; S494-K498 VanDerWaalsContact O-CE 3.25Å; S494-K498 WeakPolarHBondContact O-CE 3.25Å; S494-K498 WeakPolarHBondContact O-CG 3.42Å; S494-K498 PolarHBondContact O-N 3.37Å; N495-K498 PolarHBondContact OD1-NZ 3.21Å; L496-K498 PolarHBondContact O-N 3.09Å; K498-R521 PolarHBondContact O-NH2 3.38Å
499	H	74.5	Confident	66.5	Low	24 Å²	24	69.9 Å²	69.9	11%	0.111	40%	0.399	C	S	.	.	H	α-helix	trans	-97.7	-35	178.6	172.3	70.3	0	0	0	112.8	C483 C486 F490 N495 L496 N497 R501 L502 H503	C483-H499 VanDerWaalsContact SG-CD2 3.59Å; C486-H499 PolarHBondContact SG-NE2 2.82Å; F490-H499 HydrophobicContact CE1-CB 4Å; F490-H499 HydrophobicContact CE2-CB 4.19Å; F490-H499 AromaticContact CE2-CD2 3.26Å; F490-H499 WeakPolarHBondContact CE2-CD2 3.16Å; F490-H499 AromaticContact CE2-CG 3.7Å; F490-H499 AromaticContact CE2-NE2 3.77Å; F490-H499 HydrophobicContact CZ-CB 3.63Å; F490-H499 AromaticContact CZ-CD2 3.33Å; F490-H499 WeakPolarHBondContact CZ-CD2 3.47Å; F490-H499 AromaticContact CZ-CG 3.24Å; F490-H499 AromaticContact CZ-ND1 3.71Å; F490-H499 AromaticContact CZ-NE2 3.81Å; N495-H499 WeakPolarHBondContact O-CB 3.47Å; N495-H499 PolarHBondContact O-N 3.15Å; L496-H499 CarbonylContact O-C 3.47Å; L496-H499 WeakPolarHBondContact O-CA 3.45Å; L496-H499 WeakPolarHBondContact O-CB 3.26Å; L496-H499 PolarHBondContact O-N 2.99Å; N497-H499 PolarHBondContact O-N 3.26Å; H499-R501 PolarHBondContact O-N 3.32Å; H499-L502 WeakPolarHBondContact ND1-CD1 3.21Å; H499-L502 VanDerWaalsContact O-CB 3.23Å; H499-L502 WeakPolarHBondContact O-CB 3.43Å; H499-L502 VanDerWaalsContact O-CG 3.22Å; H499-L502 WeakPolarHBondContact O-CG 3.49Å; H499-L502 PolarHBondContact O-N 2.69Å; H499-H503 AromaticContact CD2-NE2 3.85Å; H499-H503 AromaticContact CE1-NE2 3.33Å; H499-H503 PolarHBondContact CE1-NE2 3.35Å; H499-H503 VanDerWaalsContact CE1-NE2 3.33Å; H499-H503 AromaticContact NE2-CD2 3.88Å; H499-H503 AromaticContact NE2-NE2 3.06Å; H499-H503 PolarHBondContact NE2-NE2 3.13Å; H499-H503 PolarHBondContact O-CD2 3.09Å
500	I	70.3	Confident	66.5	Low	70 Å²	70	70.4 Å²	70.4	36%	0.359	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-34.4	172.4	-68.9	170.4	0	0	0	110.5	L496 N497 L502 H503 A504	L496-I500 HydrophobicContact CD1-CD1 3.84Å; L496-I500 HydrophobicContact CD1-CG1 3.85Å; L496-I500 HydrophobicContact CD2-CD1 4.26Å; L496-I500 HydrophobicContact CG-CD1 3.77Å; L496-I500 HydrophobicContact CG-CG1 4.23Å; L496-I500 WeakPolarHBondContact O-CG1 3.48Å; L496-I500 PolarHBondContact O-N 3.28Å; N497-I500 PolarHBondContact O-N 3.18Å; I500-L502 PolarHBondContact O-N 3.36Å; I500-H503 PolarHBondContact O-N 3.21Å; I500-A504 PolarHBondContact O-N 2.59Å; I500-A504 VanDerWaalsContact O-N 3.1Å
501	R	68.4	Low	66.2	Low	160 Å²	160	75.7 Å²	75.7	60%	0.604	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-2.9	170.3	-63.1	179.9	-155.1	-145.7	2.2	114.9	N497 H499 N507	N497-R501 WeakPolarHBondContact O-CG 3.29Å; N497-R501 PolarHBondContact O-N 2.79Å; N497-R501 VanDerWaalsContact O-N 3.17Å; N497-R501 PolarHBondContact OD1-NE 3.22Å; N497-R501 PolarHBondContact OD1-NH2 3.39Å; H499-R501 PolarHBondContact O-N 3.32Å; R501-N507 PolarHBondContact O-ND2 3.18Å
502	L	63.3	Low	66.5	Low	70 Å²	70	75 Å²	75	37%	0.366	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-18.2	168.8	-45.9	-179.6	0	0	0	112.7	H499 I500 V520	H499-L502 WeakPolarHBondContact ND1-CD1 3.21Å; H499-L502 VanDerWaalsContact O-CB 3.23Å; H499-L502 WeakPolarHBondContact O-CB 3.43Å; H499-L502 VanDerWaalsContact O-CG 3.22Å; H499-L502 WeakPolarHBondContact O-CG 3.49Å; H499-L502 PolarHBondContact O-N 2.69Å; I500-L502 PolarHBondContact O-N 3.36Å; L502-V520 HydrophobicContact CD2-CB 4.38Å; L502-V520 HydrophobicContact CD2-CG1 3.22Å; L502-V520 HydrophobicContact CD2-CG2 4.25Å
503	H	61	Low	66.4	Low	67 Å²	67	79.1 Å²	79.1	31%	0.31	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-27	-176.3	-61.2	-66.2	0	0	0	112.7	V485 C486 H499 I500 E505	V485-H503 HydrophobicContact CB-CB 4.13Å; V485-H503 HydrophobicContact CG1-CB 3.97Å; V485-H503 HydrophobicContact CG2-CB 4.01Å; C486-H503 PolarHBondContact SG-NE2 3.06Å; C486-H503 VanDerWaalsContact SG-NE2 3.44Å; H499-H503 AromaticContact CD2-NE2 3.85Å; H499-H503 AromaticContact CE1-NE2 3.33Å; H499-H503 PolarHBondContact CE1-NE2 3.35Å; H499-H503 VanDerWaalsContact CE1-NE2 3.33Å; H499-H503 AromaticContact NE2-CD2 3.88Å; H499-H503 AromaticContact NE2-NE2 3.06Å; H499-H503 PolarHBondContact NE2-NE2 3.13Å; H499-H503 PolarHBondContact O-CD2 3.09Å; I500-H503 PolarHBondContact O-N 3.21Å; H503-E505 VanDerWaalsContact C-N 3.26Å; H503-E505 PolarHBondContact O-N 3.21Å
504	A	63.9	Low	66.4	Low	78 Å²	78	80.3 Å²	80.3	65%	0.645	43%	0.427	S	S	*	.	S	Bend	trans	-56.7	-40.5	-176.2	0	0	0	0	0	112.6	I500	I500-A504 PolarHBondContact O-N 2.59Å; I500-A504 VanDerWaalsContact O-N 3.1Å
505	E	51.2	Low	66.3	Low	145 Å²	145	80.7 Å²	80.7	68%	0.678	43%	0.429	S	S	*	.	S	Bend	trans	-148.4	159.4	171.1	-87.5	170.2	144.5	0	0	108.5	H503 N507	H503-E505 VanDerWaalsContact C-N 3.26Å; H503-E505 PolarHBondContact O-N 3.21Å; E505-N507 PolarHBondContact O-N 3.15Å; E505-N507 PolarHBondContact O-ND2 3.11Å
506	G	53.5	Low	66.1	Low	79 Å²	79	78.8 Å²	78.8	81%	0.814	42%	0.424	S	S	*	.			trans	-70.4	56.1	172.7	0	0	0	0	0	112.9	T508	G506-T508 PolarHBondContact O-N 3.07Å; G506-T508 VanDerWaalsContact O-N 3.08Å
507	N	51.7	Low	65.7	Low	82 Å²	82	83.1 Å²	83.1	44%	0.439	44%	0.441	S	S	.	.			trans	-45.1	113	-173.3	-94.7	-79.7	0	0	0	111.2	R501 E505 P509	R501-N507 PolarHBondContact O-ND2 3.18Å; E505-N507 PolarHBondContact O-N 3.15Å; E505-N507 PolarHBondContact O-ND2 3.11Å; N507-P509 WeakPolarHBondContact O-CD 3.45Å
508	T	52.3	Low	65.5	Low	116 Å²	116	83.4 Å²	83.4	71%	0.712	45%	0.446	S	S	*	.			trans	-56	112.1	-171.9	43.3	0	0	0	0	109.7	G506 Y510	G506-T508 PolarHBondContact O-N 3.07Å; G506-T508 VanDerWaalsContact O-N 3.08Å; T508-Y510 PolarHBondContact O-N 2.98Å
509	P	62.6	Low	65.5	Low	68 Å²	68	80.5 Å²	80.5	44%	0.442	44%	0.435	S	S	.	.			trans	-83.8	94.5	-158.7	32.4	-37	0	0	0	110.4	N507 R511 V518 L519	N507-P509 WeakPolarHBondContact O-CD 3.45Å; P509-R511 PolarHBondContact O-N 3.18Å; P509-V518 HydrophobicContact CB-CG1 3.49Å; P509-V518 VanDerWaalsContact CB-CG1 3.49Å; P509-V518 HydrophobicContact CG-CG1 3.58Å; P509-L519 CarbonylContact C-O 3.53Å; P509-L519 WeakPolarHBondContact CA-O 3.09Å
510	Y	65.3	Low	65.2	Low	72 Å²	72	82.5 Å²	82.5	28%	0.282	45%	0.448	S	S	.	.			trans	-16.9	94.7	171.5	-65.7	-86.6	0	0	0	113.8	T508 L519 R522 L525	T508-Y510 PolarHBondContact O-N 2.98Å; Y510-L519 WeakPolarHBondContact CA-O 3.21Å; Y510-L519 WeakPolarHBondContact CB-O 3.23Å; Y510-L519 PolarHBondContact N-O 3.38Å; Y510-L519 WeakPolarHBondContact O-CB 3.47Å; Y510-L519 PolarHBondContact O-N 2.82Å; Y510-R522 HydrophobicContact CD1-CB 4.04Å; Y510-R522 HydrophobicContact CD1-CG 4.1Å; Y510-R522 HydrophobicContact CE1-CB 3.62Å; Y510-R522 HydrophobicContact CE1-CG 3.68Å; Y510-R522 HydrophobicContact CE2-CB 4.45Å; Y510-L525 HydrophobicContact CD1-CD2 4.43Å
511	R	66.6	Low	65	Low	147 Å²	147	83 Å²	83	56%	0.555	45%	0.445	S	S	*	.	B	Isolated β-bridge	trans	-82.4	134.9	178.3	-168.2	174.7	-175.3	-94.9	5.3	109.4	P509 D513 G516 V518	P509-R511 PolarHBondContact O-N 3.18Å; R511-D513 PolarHBondContact O-N 2.95Å; R511-G516 VanDerWaalsContact CZ-CA 3.46Å; R511-V518 HydrophobicContact CG-CG2 4.48Å
512	C	75.1	Confident	65.2	Low	0 Å²	0	81.2 Å²	81.2	0%	0	44%	0.439	C	S	.	.			trans	-75.5	116	167.6	-174.8	0	0	0	0	109.5	F514 C515 G516 K517 L525 H528	C512-F514 PolarHBondContact O-N 2.9Å; C512-C515 PolarHBondContact O-N 3.02Å; C512-G516 WeakPolarHBondContact O-CA 3.32Å; C512-G516 PolarHBondContact O-N 3.07Å; C512-K517 HydrophobicContact CB-CB 4.32Å; C512-K517 PolarHBondContact N-O 3.49Å; C512-L525 HydrophobicContact CB-CD1 3.55Å; C512-H528 PolarHBondContact SG-NE2 2.95Å; C512-H528 VanDerWaalsContact SG-NE2 3.41Å
513	D	73	Confident	65.8	Low	112 Å²	112	85.9 Å²	85.9	60%	0.599	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.6	179.3	-59.7	-46.3	0	0	0	112.3	R511	R511-D513 PolarHBondContact O-N 2.95Å
514	F	71.9	Confident	66.5	Low	82 Å²	82	84.8 Å²	84.8	36%	0.36	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-15.1	-173.9	-50.2	-66.6	0	0	0	115.3	C512 V529 H533 Q536	C512-F514 PolarHBondContact O-N 2.9Å; F514-V529 HydrophobicContact CD2-CG1 4.1Å; F514-V529 HydrophobicContact CD2-CG2 4.14Å; F514-V529 HydrophobicContact CE2-CG1 3.92Å; F514-V529 HydrophobicContact CE2-CG2 4.36Å; F514-H533 WeakPolarHBondContact CB-CE1 3.42Å; F514-H533 VanDerWaalsContact CB-ND1 3.3Å; F514-H533 WeakPolarHBondContact CB-ND1 3.36Å; F514-H533 HydrophobicContact CD2-CB 4.38Å; F514-H533 PolarHBondContact O-CE1 3.13Å; F514-Q536 HydrophobicContact CD1-CB 4.4Å; F514-Q536 VanDerWaalsContact CD1-OE1 3.28Å; F514-Q536 HydrophobicContact CD2-CB 4.34Å; F514-Q536 HydrophobicContact CE1-CB 4.06Å; F514-Q536 HydrophobicContact CE1-CG 4.39Å; F514-Q536 HydrophobicContact CE2-CB 4Å; F514-Q536 VanDerWaalsContact CG-OE1 3.26Å; F514-Q536 HydrophobicContact CZ-CB 3.85Å
515	C	73.1	Confident	67.2	Low	69 Å²	69	81.6 Å²	81.6	47%	0.466	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.9	8.5	174.1	66.1	0	0	0	0	115.1	C512 K517 H528 H533	C512-C515 PolarHBondContact O-N 3.02Å; C515-K517 PolarHBondContact O-N 2.96Å; C515-K517 VanDerWaalsContact O-N 3.11Å; C515-H528 PolarHBondContact SG-NE2 3.18Å; C515-H533 PolarHBondContact SG-NE2 3.37Å
516	G	68.4	Low	68.5	Low	21 Å²	21	79 Å²	79	22%	0.216	41%	0.408	C	S	.	.			trans	67.9	2.3	-178.3	0	0	0	0	0	116	R511 C512 V518	R511-G516 VanDerWaalsContact CZ-CA 3.46Å; C512-G516 WeakPolarHBondContact O-CA 3.32Å; C512-G516 PolarHBondContact O-N 3.07Å; G516-V518 PolarHBondContact O-N 3.32Å
517	K	68.4	Low	69.8	Low	112 Å²	112	83.7 Å²	83.7	49%	0.487	40%	0.401	S	S	.	.			trans	-65.6	121	-176.1	-171.7	173.2	-174.9	175.2	0	111.5	C512 C515 L519	C512-K517 HydrophobicContact CB-CB 4.32Å; C512-K517 PolarHBondContact N-O 3.49Å; C515-K517 PolarHBondContact O-N 2.96Å; C515-K517 VanDerWaalsContact O-N 3.11Å; K517-L519 HydrophobicContact CD-CD2 4.29Å; K517-L519 HydrophobicContact CG-CD2 4.36Å; K517-L519 HydrophobicContact CG-CG 4.3Å
518	V	68.8	Low	71.2	Confident	87 Å²	87	80.7 Å²	80.7	53%	0.527	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-81.8	126.4	179	176.9	0	0	0	0	109.9	P509 R511 G516	P509-V518 HydrophobicContact CB-CG1 3.49Å; P509-V518 VanDerWaalsContact CB-CG1 3.49Å; P509-V518 HydrophobicContact CG-CG1 3.58Å; R511-V518 HydrophobicContact CG-CG2 4.48Å; G516-V518 PolarHBondContact O-N 3.32Å
519	L	72.6	Confident	72.5	Confident	30 Å²	30	75.4 Å²	75.4	16%	0.157	35%	0.352	C	S	.	.			trans	-135.2	150.6	-175.8	-66.5	169.9	0	0	0	111	P509 Y510 K517 L525 H528	P509-L519 CarbonylContact C-O 3.53Å; P509-L519 WeakPolarHBondContact CA-O 3.09Å; Y510-L519 WeakPolarHBondContact CA-O 3.21Å; Y510-L519 WeakPolarHBondContact CB-O 3.23Å; Y510-L519 PolarHBondContact N-O 3.38Å; Y510-L519 WeakPolarHBondContact O-CB 3.47Å; Y510-L519 PolarHBondContact O-N 2.82Å; K517-L519 HydrophobicContact CD-CD2 4.29Å; K517-L519 HydrophobicContact CG-CD2 4.36Å; K517-L519 HydrophobicContact CG-CG 4.3Å; L519-L525 HydrophobicContact CD1-CB 4.1Å; L519-L525 HydrophobicContact CD1-CD1 4.17Å; L519-H528 HydrophobicContact CD1-CB 3.62Å
520	V	68.3	Low	73.4	Confident	65 Å²	65	80.9 Å²	80.9	39%	0.394	37%	0.369	S	S	.	.	S	Bend	trans	-78	-26.4	-171.7	170.3	0	0	0	0	113.5	L502	L502-V520 HydrophobicContact CD2-CB 4.38Å; L502-V520 HydrophobicContact CD2-CG1 3.22Å; L502-V520 HydrophobicContact CD2-CG2 4.25Å
521	R	65.9	Low	74	Confident	80 Å²	80	81.2 Å²	81.2	30%	0.302	38%	0.381	S	S	.	.			trans	-138.2	141.2	-169.6	-48.7	-176.7	-172.2	78.9	8.7	111.7	K498 R523 D524 L525	K498-R521 PolarHBondContact O-NH2 3.38Å; R521-R523 VanDerWaalsContact C-N 3.29Å; R521-R523 PolarHBondContact O-N 3.26Å; R521-D524 HydrophobicContact CB-CB 4.23Å; R521-D524 WeakPolarHBondContact CB-OD2 3.32Å; R521-D524 WeakPolarHBondContact CD-OD2 3.49Å; R521-D524 WeakPolarHBondContact CG-OD2 3.13Å; R521-D524 IonicContact CZ-OD2 3.98Å; R521-D524 IonicContact NH1-OD2 2.64Å; R521-D524 PolarHBondContact NH1-OD2 3.33Å; R521-D524 WeakPolarHBondContact O-CA 3.49Å; R521-D524 WeakPolarHBondContact O-CB 3.33Å; R521-D524 PolarHBondContact O-N 3.06Å; R521-L525 PolarHBondContact O-N 3.44Å
522	R	72.1	Confident	74.5	Confident	123 Å²	123	83 Å²	83	46%	0.464	39%	0.388	S	S	.	.	H	α-helix	trans	-46.8	-49.1	172.9	-150.8	-178.8	-74.5	-157.2	-5.7	112.1	Y510 D524 L525 E526 D543	Y510-R522 HydrophobicContact CD1-CB 4.04Å; Y510-R522 HydrophobicContact CD1-CG 4.1Å; Y510-R522 HydrophobicContact CE1-CB 3.62Å; Y510-R522 HydrophobicContact CE1-CG 3.68Å; Y510-R522 HydrophobicContact CE2-CB 4.45Å; R522-D524 VanDerWaalsContact C-N 3.34Å; R522-D524 PolarHBondContact O-N 2.91Å; R522-L525 CarbonylContact O-C 3.55Å; R522-L525 WeakPolarHBondContact O-CA 3.22Å; R522-L525 WeakPolarHBondContact O-CB 3.49Å; R522-L525 PolarHBondContact O-N 2.79Å; R522-L525 VanDerWaalsContact O-N 3.12Å; R522-E526 WeakPolarHBondContact CG-OE1 3.29Å; R522-E526 WeakPolarHBondContact O-CG 3.38Å; R522-E526 PolarHBondContact O-N 2.94Å; R522-D543 IonicContact NH2-OD1 2.68Å
523	R	75.6	Confident	74.5	Confident	168 Å²	168	84.3 Å²	84.3	63%	0.634	39%	0.394	S	S	*	.	H	α-helix	trans	-60.9	-33.7	176.1	-51.3	-168.9	-53	174.5	2	115	R521 E526 R527	R521-R523 VanDerWaalsContact C-N 3.29Å; R521-R523 PolarHBondContact O-N 3.26Å; R523-E526 WeakPolarHBondContact CA-OE2 3.48Å; R523-R527 WeakPolarHBondContact O-CB 3.38Å; R523-R527 PolarHBondContact O-N 2.78Å
524	D	76.5	Confident	74	Confident	45 Å²	45	84.2 Å²	84.2	24%	0.241	40%	0.4	C	S	.	.	H	α-helix	trans	-77.5	-33	178.6	-64.3	-32.4	0	0	0	109.7	R521 R522 H528	R521-D524 HydrophobicContact CB-CB 4.23Å; R521-D524 WeakPolarHBondContact CB-OD2 3.32Å; R521-D524 WeakPolarHBondContact CD-OD2 3.49Å; R521-D524 WeakPolarHBondContact CG-OD2 3.13Å; R521-D524 IonicContact CZ-OD2 3.98Å; R521-D524 IonicContact NH1-OD2 2.64Å; R521-D524 PolarHBondContact NH1-OD2 3.33Å; R521-D524 WeakPolarHBondContact O-CA 3.49Å; R521-D524 WeakPolarHBondContact O-CB 3.33Å; R521-D524 PolarHBondContact O-N 3.06Å; R522-D524 VanDerWaalsContact C-N 3.34Å; R522-D524 PolarHBondContact O-N 2.91Å; D524-H528 VanDerWaalsContact O-CB 3.25Å; D524-H528 WeakPolarHBondContact O-CB 3.23Å; D524-H528 PolarHBondContact O-N 3.09Å
525	L	77.6	Confident	73.7	Confident	11 Å²	11	84.6 Å²	84.6	6%	0.058	43%	0.427	C	S	.	.	H	α-helix	trans	-68	-49.1	169.9	172.2	60.8	0	0	0	112.6	Y510 C512 L519 R521 R522 R527 H528 V529 L538	Y510-L525 HydrophobicContact CD1-CD2 4.43Å; C512-L525 HydrophobicContact CB-CD1 3.55Å; L519-L525 HydrophobicContact CD1-CB 4.1Å; L519-L525 HydrophobicContact CD1-CD1 4.17Å; R521-L525 PolarHBondContact O-N 3.44Å; R522-L525 CarbonylContact O-C 3.55Å; R522-L525 WeakPolarHBondContact O-CA 3.22Å; R522-L525 WeakPolarHBondContact O-CB 3.49Å; R522-L525 PolarHBondContact O-N 2.79Å; R522-L525 VanDerWaalsContact O-N 3.12Å; L525-R527 VanDerWaalsContact C-N 3.31Å; L525-R527 PolarHBondContact O-N 3.1Å; L525-H528 CarbonylContact O-C 3.3Å; L525-H528 WeakPolarHBondContact O-CA 3.22Å; L525-H528 WeakPolarHBondContact O-CB 3.33Å; L525-H528 PolarHBondContact O-N 2.78Å; L525-V529 HydrophobicContact CD1-CG2 3.82Å; L525-V529 HydrophobicContact CG-CG2 4.44Å; L525-V529 WeakPolarHBondContact O-CG2 3.38Å; L525-V529 PolarHBondContact O-N 2.77Å; L525-L538 HydrophobicContact CD2-CD1 4.49Å; L525-L538 HydrophobicContact CD2-CD2 4.15Å; L525-L538 HydrophobicContact CG-CD1 4.13Å; L525-L538 HydrophobicContact CG-CD2 4.36Å
526	E	79	Confident	73.1	Confident	91 Å²	91	85.6 Å²	85.6	43%	0.425	43%	0.425	S	S	.	.	H	α-helix	trans	-55	-46.3	176.6	-71.8	155.7	-164.8	0	0	111.6	R522 R523 H528 V529 K530 L538	R522-E526 WeakPolarHBondContact CG-OE1 3.29Å; R522-E526 WeakPolarHBondContact O-CG 3.38Å; R522-E526 PolarHBondContact O-N 2.94Å; R523-E526 WeakPolarHBondContact CA-OE2 3.48Å; E526-H528 VanDerWaalsContact C-N 3.35Å; E526-V529 PolarHBondContact O-N 3.5Å; E526-K530 VanDerWaalsContact O-CB 3.28Å; E526-K530 WeakPolarHBondContact O-CB 3.48Å; E526-K530 PolarHBondContact O-N 3.07Å; E526-L538 HydrophobicContact CB-CD1 4.4Å; E526-L538 HydrophobicContact CG-CD1 3.86Å
527	R	81.1	Confident	72.9	Confident	176 Å²	176	90.4 Å²	90.4	66%	0.664	45%	0.45	S	S	*	.	H	α-helix	trans	-62.3	-42	174.2	-172.4	-170.5	-54.4	-159.8	-0.6	111.8	R523 L525 S531	R523-R527 WeakPolarHBondContact O-CB 3.38Å; R523-R527 PolarHBondContact O-N 2.78Å; L525-R527 VanDerWaalsContact C-N 3.31Å; L525-R527 PolarHBondContact O-N 3.1Å; R527-S531 VanDerWaalsContact O-CB 3.3Å; R527-S531 WeakPolarHBondContact O-CB 3.22Å; R527-S531 PolarHBondContact O-N 2.73Å; R527-S531 PolarHBondContact O-OG 2.86Å
528	H	80.4	Confident	72.8	Confident	20 Å²	20	87.8 Å²	87.8	9%	0.093	44%	0.441	C	S	.	.	H	α-helix	trans	-64.6	-45.7	178.6	164.3	46	0	0	0	112	C512 C515 L519 D524 L525 E526 S531 R532 H533	C512-H528 PolarHBondContact SG-NE2 2.95Å; C512-H528 VanDerWaalsContact SG-NE2 3.41Å; C515-H528 PolarHBondContact SG-NE2 3.18Å; L519-H528 HydrophobicContact CD1-CB 3.62Å; D524-H528 VanDerWaalsContact O-CB 3.25Å; D524-H528 WeakPolarHBondContact O-CB 3.23Å; D524-H528 PolarHBondContact O-N 3.09Å; L525-H528 CarbonylContact O-C 3.3Å; L525-H528 WeakPolarHBondContact O-CA 3.22Å; L525-H528 WeakPolarHBondContact O-CB 3.33Å; L525-H528 PolarHBondContact O-N 2.78Å; E526-H528 VanDerWaalsContact C-N 3.35Å; H528-S531 PolarHBondContact O-N 3.38Å; H528-S531 PolarHBondContact O-OG 2.85Å; H528-R532 WeakPolarHBondContact ND1-CG 3.49Å; H528-R532 WeakPolarHBondContact O-CB 3.24Å; H528-R532 PolarHBondContact O-N 2.9Å; H528-H533 AromaticContact CE1-NE2 3.99Å
529	V	79.9	Confident	72.4	Confident	4 Å²	4	92.4 Å²	92.4	2%	0.024	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-53.2	174	174.7	0	0	0	0	109.7	F514 L525 E526 S531 R532 H533 Q536 L538	F514-V529 HydrophobicContact CD2-CG1 4.1Å; F514-V529 HydrophobicContact CD2-CG2 4.14Å; F514-V529 HydrophobicContact CE2-CG1 3.92Å; F514-V529 HydrophobicContact CE2-CG2 4.36Å; L525-V529 HydrophobicContact CD1-CG2 3.82Å; L525-V529 HydrophobicContact CG-CG2 4.44Å; L525-V529 WeakPolarHBondContact O-CG2 3.38Å; L525-V529 PolarHBondContact O-N 2.77Å; E526-V529 PolarHBondContact O-N 3.5Å; V529-S531 PolarHBondContact O-N 3.42Å; V529-R532 PolarHBondContact O-N 3.41Å; V529-H533 HydrophobicContact CG1-CB 4.09Å; V529-H533 CarbonylContact O-C 3.49Å; V529-H533 VanDerWaalsContact O-CA 3.3Å; V529-H533 WeakPolarHBondContact O-CA 3.26Å; V529-H533 WeakPolarHBondContact O-CB 3.37Å; V529-H533 PolarHBondContact O-N 3.23Å; V529-Q536 WeakPolarHBondContact CG1-O 3.1Å; V529-L538 HydrophobicContact CB-CD1 4.36Å; V529-L538 HydrophobicContact CB-CG 4.39Å; V529-L538 HydrophobicContact CG1-CG 4.35Å; V529-L538 HydrophobicContact CG2-CD1 4.08Å; V529-L538 HydrophobicContact CG2-CD2 4.1Å; V529-L538 HydrophobicContact CG2-CG 4Å
530	K	81.3	Confident	71.1	Confident	184 Å²	184	100 Å²	100	80%	0.8	49%	0.486	S	S	*	.	H	α-helix	trans	-59.9	-20.9	180	-170.7	168.4	-178.2	173.5	0	114.7	E526	E526-K530 VanDerWaalsContact O-CB 3.28Å; E526-K530 WeakPolarHBondContact O-CB 3.48Å; E526-K530 PolarHBondContact O-N 3.07Å
531	S	79.5	Confident	70.1	Confident	78 Å²	78	104.1 Å²	104.1	55%	0.545	51%	0.505	S	S	.	.	H	α-helix	trans	-108.4	-16.4	-179.2	59.5	0	0	0	0	115.8	R527 H528 V529	R527-S531 VanDerWaalsContact O-CB 3.3Å; R527-S531 WeakPolarHBondContact O-CB 3.22Å; R527-S531 PolarHBondContact O-N 2.73Å; R527-S531 PolarHBondContact O-OG 2.86Å; H528-S531 PolarHBondContact O-N 3.38Å; H528-S531 PolarHBondContact O-OG 2.85Å; V529-S531 PolarHBondContact O-N 3.42Å
532	R	75.3	Confident	68.8	Low	184 Å²	184	107.1 Å²	107.1	69%	0.694	53%	0.527	S	S	*	.	H	α-helix	trans	-120.4	-14.6	179.4	-62.3	-57	-163.4	91.5	-7.2	114.1	H528 V529 P534	H528-R532 WeakPolarHBondContact ND1-CG 3.49Å; H528-R532 WeakPolarHBondContact O-CB 3.24Å; H528-R532 PolarHBondContact O-N 2.9Å; V529-R532 PolarHBondContact O-N 3.41Å; R532-P534 VanDerWaalsContact C-CD 3.44Å
533	H	76.9	Confident	67.6	Low	28 Å²	28	107.1 Å²	107.1	13%	0.13	54%	0.536	C	S	.	.	S	Bend	trans	-130.6	60.3	-178.1	-63.5	-77	0	0	0	109.9	F514 C515 H528 V529 G535 Q536	F514-H533 WeakPolarHBondContact CB-CE1 3.42Å; F514-H533 VanDerWaalsContact CB-ND1 3.3Å; F514-H533 WeakPolarHBondContact CB-ND1 3.36Å; F514-H533 HydrophobicContact CD2-CB 4.38Å; F514-H533 PolarHBondContact O-CE1 3.13Å; C515-H533 PolarHBondContact SG-NE2 3.37Å; H528-H533 AromaticContact CE1-NE2 3.99Å; V529-H533 HydrophobicContact CG1-CB 4.09Å; V529-H533 CarbonylContact O-C 3.49Å; V529-H533 VanDerWaalsContact O-CA 3.3Å; V529-H533 WeakPolarHBondContact O-CA 3.26Å; V529-H533 WeakPolarHBondContact O-CB 3.37Å; V529-H533 PolarHBondContact O-N 3.23Å; H533-G535 PolarHBondContact O-N 2.99Å; H533-Q536 HydrophobicContact CB-CB 4.15Å; H533-Q536 PolarHBondContact ND1-OE1 3.29Å; H533-Q536 PolarHBondContact O-N 2.83Å; H533-Q536 VanDerWaalsContact O-N 3.11Å
534	P	62.5	Low	65.6	Low	111 Å²	111	109 Å²	109	72%	0.721	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	133.5	-179.6	26.9	-34.9	0	0	0	110.7	R532 Q536	R532-P534 VanDerWaalsContact C-CD 3.44Å; P534-Q536 VanDerWaalsContact C-N 3.33Å
535	G	63.7	Low	64.1	Low	89 Å²	89	112.8 Å²	112.8	92%	0.918	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	85.3	-7.3	-176.4	0	0	0	0	0	115.4	H533	H533-G535 PolarHBondContact O-N 2.99Å
536	Q	62.3	Low	61.9	Low	91 Å²	91	116.3 Å²	116.3	43%	0.425	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-102	119.5	177.6	-64.6	176	-16.1	0	0	110.4	F514 V529 H533 P534	F514-Q536 HydrophobicContact CD1-CB 4.4Å; F514-Q536 VanDerWaalsContact CD1-OE1 3.28Å; F514-Q536 HydrophobicContact CD2-CB 4.34Å; F514-Q536 HydrophobicContact CE1-CB 4.06Å; F514-Q536 HydrophobicContact CE1-CG 4.39Å; F514-Q536 HydrophobicContact CE2-CB 4Å; F514-Q536 VanDerWaalsContact CG-OE1 3.26Å; F514-Q536 HydrophobicContact CZ-CB 3.85Å; V529-Q536 WeakPolarHBondContact CG1-O 3.1Å; H533-Q536 HydrophobicContact CB-CB 4.15Å; H533-Q536 PolarHBondContact ND1-OE1 3.29Å; H533-Q536 PolarHBondContact O-N 2.83Å; H533-Q536 VanDerWaalsContact O-N 3.11Å; P534-Q536 VanDerWaalsContact C-N 3.33Å
537	T	62.6	Low	59.7	Low	121 Å²	121	115.3 Å²	115.3	74%	0.742	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-91.3	137.5	175.1	45.6	0	0	0	0	110.6	K539	T537-K539 PolarHBondContact O-N 3.21Å
538	L	67.6	Low	57.9	Low	57 Å²	57	112.2 Å²	112.2	30%	0.298	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-63.1	125.2	164.7	-77.2	159.3	0	0	0	108.1	L525 E526 V529 K540	L525-L538 HydrophobicContact CD2-CD1 4.49Å; L525-L538 HydrophobicContact CD2-CD2 4.15Å; L525-L538 HydrophobicContact CG-CD1 4.13Å; L525-L538 HydrophobicContact CG-CD2 4.36Å; E526-L538 HydrophobicContact CB-CD1 4.4Å; E526-L538 HydrophobicContact CG-CD1 3.86Å; V529-L538 HydrophobicContact CB-CD1 4.36Å; V529-L538 HydrophobicContact CB-CG 4.39Å; V529-L538 HydrophobicContact CG1-CG 4.35Å; V529-L538 HydrophobicContact CG2-CD1 4.08Å; V529-L538 HydrophobicContact CG2-CD2 4.1Å; V529-L538 HydrophobicContact CG2-CG 4Å; L538-K540 PolarHBondContact O-N 3.08Å
539	K	59	Low	55.6	Low	185 Å²	185	121.6 Å²	121.6	80%	0.804	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-64.1	132.3	164.9	-68	-178.4	178.5	-178.6	0	107.4	T537 L541	T537-K539 PolarHBondContact O-N 3.21Å; K539-L541 PolarHBondContact O-N 3.45Å
540	K	45.2	Very low	53.4	Low	189 Å²	189	128.4 Å²	128.4	82%	0.822	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-61.6	120.7	160	-68.4	-176.8	178.7	-177.3	0	106.2	L538	L538-K540 PolarHBondContact O-N 3.08Å
541	L	47.5	Very low	51	Low	152 Å²	152	127.2 Å²	127.2	80%	0.796	71%	0.711	S	S	*	*			trans	-89	113.8	160.2	-71.9	170.2	0	0	0	104.8	K539	K539-L541 PolarHBondContact O-N 3.45Å
542	D	39.5	Very low	48.9	Very low	142 Å²	142	127.3 Å²	127.3	76%	0.759	72%	0.716	S	S	*	*			trans	-66.7	134.7	-179	-56.2	-70.1	0	0	0	110	K544	D542-K544 PolarHBondContact O-N 3.26Å
543	D	46.3	Very low	46.9	Very low	124 Å²	124	126.5 Å²	126.5	66%	0.663	73%	0.726	S	S	*	*			trans	-67.4	126.6	-173	-64.2	-79.9	0	0	0	111.2	R522	R522-D543 IonicContact NH2-OD1 2.68Å
544	K	33.9	Very low	44.9	Very low	208 Å²	208	133.1 Å²	133.1	90%	0.904	76%	0.757	S	S	*	*			trans	-130	89.8	165.9	-115.9	-170	179.3	-173.4	0	110.7	D542	D542-K544 PolarHBondContact O-N 3.26Å
545	P	45.8	Very low	44	Very low	124 Å²	124	136.3 Å²	136.3	81%	0.805	76%	0.759	S	S	*	*			trans	-83.8	164.4	173.5	35.3	-34.9	0	0	0	111.8
546	G	31.6	Very low	42.4	Very low	84 Å²	84	136.9 Å²	136.9	87%	0.866	75%	0.749	S	S	*	*			trans	-174.5	117.7	158.3	0	0	0	0	0	107.9
547	G	31.6	Very low	41.4	Very low	71 Å²	71	139.7 Å²	139.7	73%	0.732	77%	0.767	S	S	*	*			cis	150.6	-176.7	0.6	0	0	0	0	0	108.8
548	P	44.5	Very low	39.9	Very low	110 Å²	110	139.9 Å²	139.9	71%	0.714	76%	0.763	S	S	*	*			cis	-114	144.3	-18.2	37.1	-25	0	0	0	111.8
549	F	31.1	Very low	38.8	Very low	218 Å²	218	145.9 Å²	145.9	96%	0.956	80%	0.796	S	S	*	*			trans	-161.1	103.7	152.1	-103	-68.2	0	0	0	107.9
550	D	33.9	Very low	37.7	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	78%	0.778	S	S	*	*			trans	-72.9	133.3	167.7	-63.5	-83	0	0	0	109.5
551	D	31.8	Very low	37.6	Very low	160 Å²	160	135.8 Å²	135.8	86%	0.856	76%	0.764	S	S	*	*				-161.5	114.2	129.4	-111.9	-32	0	0	0	112.6
552	A	34	Very low	36.9	Very low	79 Å²	79	134.3 Å²	134.3	65%	0.653	76%	0.762	S	S	*	*			trans	23.2	100.3	162.1	0	0	0	0	0	120.4	H554	A552-H554 PolarHBondContact O-N 2.76Å
553	D	34.5	Very low	36.8	Very low	167 Å²	167	132.7 Å²	132.7	89%	0.893	75%	0.753	S	S	*	*			trans	-72.4	86.2	162.8	-154.6	-8	0	0	0	110.7	K555	D553-K555 PolarHBondContact O-N 3.17Å
554	H	34.7	Very low	36.1	Very low	168 Å²	168	132 Å²	132	78%	0.778	75%	0.752	S	S	*	*			trans	-78.4	83.1	-174.6	-132	-53.5	0	0	0	112.4	A552 S556	A552-H554 PolarHBondContact O-N 2.76Å; H554-S556 PolarHBondContact O-N 3.4Å; H554-S556 VanDerWaalsContact O-N 3.13Å
555	K	43	Very low	36	Very low	178 Å²	178	127 Å²	127	77%	0.774	74%	0.743	S	S	*	*			trans	-40.2	111.4	175.7	-177.3	179.6	-177.8	176.9	0	113.6	D553	D553-K555 PolarHBondContact O-N 3.17Å
556	S	31	Very low	35	Very low	100 Å²	100	130 Å²	130	70%	0.699	74%	0.744	S	S	*	*			trans	-145.2	107.8	163.7	49.3	0	0	0	0	111.6	H554 N558	H554-S556 PolarHBondContact O-N 3.4Å; H554-S556 VanDerWaalsContact O-N 3.13Å; S556-N558 PolarHBondContact O-N 3.24Å; S556-N558 VanDerWaalsContact O-N 3.15Å
557	D	41.3	Very low	35.1	Very low	150 Å²	150	131.5 Å²	131.5	80%	0.802	74%	0.736	S	S	*	*			trans	-71.1	99.5	166.1	-65.8	-78.9	0	0	0	108.9
558	N	30.7	Very low	35	Very low	126 Å²	126	135.8 Å²	135.8	67%	0.674	74%	0.742	S	S	*	*			trans	-142.8	77.9	174.8	-113.2	-16.5	0	0	0	111.7	S556 S560	S556-N558 PolarHBondContact O-N 3.24Å; S556-N558 VanDerWaalsContact O-N 3.15Å; N558-S560 PolarHBondContact O-N 3.45Å
559	D	43.4	Very low	34.4	Very low	183 Å²	183	137 Å²	137	98%	0.979	74%	0.743	S	S	*	*			trans	-72.6	71.2	157.5	-110.9	-40.7	0	0	0	108.1
560	S	35.9	Very low	34.6	Very low	63 Å²	63	135.6 Å²	135.6	44%	0.441	74%	0.739	S	S	.	*			trans	-129.1	144.9	-178.1	62.6	0	0	0	0	111.2	N558 V562	N558-S560 PolarHBondContact O-N 3.45Å; S560-V562 PolarHBondContact O-N 2.92Å; S560-V562 VanDerWaalsContact O-N 3.11Å
561	D	43.5	Very low	34.5	Very low	99 Å²	99	132.8 Å²	132.8	53%	0.529	73%	0.731	S	S	.	*			trans	-64.1	109.1	-166.8	-73	-18.5	0	0	0	114.2	R464 D563	R464-D561 IonicContact CZ-OD1 2.73Å; R464-D561 IonicContact CZ-OD2 3.13Å; R464-D561 IonicContact NE-OD1 3.83Å; R464-D561 IonicContact NE-OD2 2.77Å; R464-D561 PolarHBondContact NE-OD2 3.1Å; R464-D561 IonicContact NH1-OD1 3.38Å; R464-D561 PolarHBondContact NH1-OD1 2.98Å; R464-D561 IonicContact NH1-OD2 3.16Å; R464-D561 PolarHBondContact NH1-OD2 3.17Å; R464-D561 VanDerWaalsContact NH2-CG 3.28Å; R464-D561 IonicContact NH2-OD1 2.72Å; R464-D561 PolarHBondContact NH2-OD1 3.33Å; R464-D561 IonicContact NH2-OD2 2.78Å; R464-D561 PolarHBondContact NH2-OD2 2.83Å; D561-D563 PolarHBondContact O-N 3.05Å
562	V	33.5	Very low	34.6	Very low	121 Å²	121	132.8 Å²	132.8	73%	0.733	73%	0.731	S	S	*	*			trans	-84.3	82.9	169.6	-166.1	0	0	0	0	109.4	S560 V564	S560-V562 PolarHBondContact O-N 2.92Å; S560-V562 VanDerWaalsContact O-N 3.11Å; V562-V564 HydrophobicContact CG1-CG2 3.69Å; V562-V564 PolarHBondContact O-N 2.64Å; V562-V564 VanDerWaalsContact O-N 3.07Å
563	D	37.8	Very low	34.5	Very low	108 Å²	108	137 Å²	137	58%	0.578	74%	0.737	S	S	*	*			trans	-71.8	92.9	163.6	-79.7	-33.9	0	0	0	108.9	D561 C565	D561-D563 PolarHBondContact O-N 3.05Å; D563-C565 PolarHBondContact O-N 2.68Å
564	V	31.5	Very low	34.4	Very low	108 Å²	108	138.6 Å²	138.6	66%	0.655	74%	0.739	S	S	*	*			trans	-76.1	82.1	169.2	-172.9	0	0	0	0	108.5	V562 F566	V562-V564 HydrophobicContact CG1-CG2 3.69Å; V562-V564 PolarHBondContact O-N 2.64Å; V562-V564 VanDerWaalsContact O-N 3.07Å; V564-F566 HydrophobicContact CG1-CD2 4.16Å; V564-F566 HydrophobicContact CG1-CE2 4.24Å; V564-F566 PolarHBondContact O-N 2.91Å
565	C	30.5	Very low	34.1	Very low	105 Å²	105	135.4 Å²	135.4	71%	0.709	74%	0.736	S	S	*	*			trans	-67.6	106.3	165.5	-65.9	0	0	0	0	109	D563	D563-C565 PolarHBondContact O-N 2.68Å
566	F	26.1	Very low	33.5	Very low	187 Å²	187	132.6 Å²	132.6	82%	0.82	74%	0.739	S	S	*	*			trans	-74.8	120.1	149.4	-93.3	-98	0	0	0	106.9	V564	V564-F566 HydrophobicContact CG1-CD2 4.16Å; V564-F566 HydrophobicContact CG1-CE2 4.24Å; V564-F566 PolarHBondContact O-N 2.91Å
567	T	33.2	Very low	33.5	Very low	114 Å²	114	137.4 Å²	137.4	70%	0.699	75%	0.747	S	S	*	*			trans	-84.1	107.8	170.6	45.4	0	0	0	0	108.4	D569	T567-D569 PolarHBondContact O-N 3.31Å
568	D	30	Very low	32.9	Very low	162 Å²	162	137.1 Å²	137.1	87%	0.866	75%	0.745	S	S	*	*			trans	-70	111.7	160.9	-72.2	-55.8	0	0	0	107.4	Q570	D568-Q570 PolarHBondContact O-N 2.96Å
569	D	31.7	Very low	32.8	Very low	136 Å²	136	137.5 Å²	137.5	73%	0.727	75%	0.748	S	S	*	*			trans	-87.6	89.9	-170.3	-153.4	-52.4	0	0	0	110.9	T567	T567-D569 PolarHBondContact O-N 3.31Å
570	Q	34.8	Very low	32.2	Very low	187 Å²	187	135.3 Å²	135.3	87%	0.874	74%	0.736	S	S	*	*			trans	-135.5	93.2	161.9	-71.8	-167.3	-14	0	0	108.6	D568	D568-Q570 PolarHBondContact O-N 2.96Å
571	S	30.7	Very low	31.9	Very low	87 Å²	87	140 Å²	140	61%	0.608	76%	0.755	S	S	*	*			trans	-102.7	114.6	166.1	55.9	0	0	0	0	109.7
572	D	35.1	Very low	31.3	Very low	160 Å²	160	140.6 Å²	140.6	86%	0.856	76%	0.762	S	S	*	*			trans	-60.7	136.3	169.6	-60	-68.6	0	0	0	110
573	Q	32.1	Very low	31.2	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	77%	0.767	S	S	*	*			trans	-126.1	81.1	167.3	-76.7	-167.1	30.3	0	0	111.1	S575	Q573-S575 PolarHBondContact O-N 3.31Å
574	E	31.4	Very low	30.8	Very low	202 Å²	202	141.6 Å²	141.6	94%	0.944	77%	0.769	S	S	*	*			trans	-69	109.4	149.1	-72.2	-166.4	106.9	0	0	108.9
575	S	29.5	Very low	30.9	Very low	100 Å²	100	144.8 Å²	144.8	70%	0.699	78%	0.777	S	S	*	*			trans	-143.6	123.7	156.7	71.7	0	0	0	0	110.6	Q573	Q573-S575 PolarHBondContact O-N 3.31Å
576	S	29.1	Very low	31.1	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	81%	0.808	S	S	*	*			trans	-71.7	133	-168.4	-42.4	0	0	0	0	112.6
577	K	31.6	Very low	31.4	Very low	200 Å²	200	148.5 Å²	148.5	87%	0.87	81%	0.807	S	S	*	*			trans	-135.8	118.7	151.8	-72.5	-172	-180	173.6	0	109.8
578	N	29.2	Very low	31.3	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	81%	0.813	S	S	*	*			trans	-74	143.5	164.9	-59.2	-22.5	0	0	0	108.7
579	N	29.1	Very low	31.4	Very low	135 Å²	135	149.6 Å²	149.6	72%	0.722	81%	0.81	S	S	*	*				161.6	120.3	120.9	-80.5	3.5	0	0	0	110.8
580	D	29.5	Very low	31.3	Very low	137 Å²	137	150.4 Å²	150.4	73%	0.733	82%	0.815	S	S	*	*			trans	56.3	141.6	132.4	-56.6	-36.9	0	0	0	123.3
581	L	30.3	Very low	31.1	Very low	162 Å²	162	148.1 Å²	148.1	85%	0.848	81%	0.811	S	S	*	*			trans	69.1	148.6	159	-62.1	161.8	0	0	0	117.1
582	V	31.8	Very low	31.1	Very low	110 Å²	110	152.2 Å²	152.2	67%	0.667	82%	0.824	S	S	*	*			cis	166.4	125.7	-26	128.3	0	0	0	0	104.2
583	L	30.3	Very low	30.9	Very low	161 Å²	161	151.6 Å²	151.6	84%	0.843	82%	0.822	S	S	*	*			trans	55.1	160.6	168.5	-86.8	80.5	0	0	0	116.7
584	S	30.1	Very low	30.8	Very low	89 Å²	89	150.5 Å²	150.5	62%	0.622	83%	0.825	S	S	*	*			cis	-155.1	165.9	-3.2	38.9	0	0	0	0	109.9
585	E	32.2	Very low	30.7	Very low	176 Å²	176	146.2 Å²	146.2	82%	0.822	82%	0.815	S	S	*	*			trans	13.2	122.7	146.5	-57	173.5	134.6	0	0	119.2
586	T	36	Very low	30.8	Very low	220 Å²	220	150.4 Å²	150.4	100%	1.35	83%	0.826	S	S	*	*				-163.4	0	110.8	10.9	0	0	0	0	111.2

Retrieved 586 of 586 residues in 67.1 ms (Link to these results)

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