A0A087XIB9_POEFO Loading...

PDZ and LIM domain protein 3

May play a role in the organization of actin filament arrays within muscle cells.

AlphaFold DB , UniProt , Accession A0A087XIB9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 315 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	75.3	Confident	88.2	Confident	180 Å²	180	71.6 Å²	71.6	89%	0.887	41%	0.412	S	S	*	.				0	137.2	0	-70.9	-175.6	177.2	0	0	107.9
2	P	84.6	Confident	88.5	Confident	89 Å²	89	75.3 Å²	75.3	58%	0.578	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.7	175.6	29.2	-32.9	0	0	0	110.1	L50 T79 V80	P2-L50 HydrophobicContact CB-CD1 4.14Å; P2-T79 HydrophobicContact CB-CG2 4.11Å; P2-V80 CarbonylContact C-O 3.6Å; P2-V80 WeakPolarHBondContact CA-O 3.47Å
3	L	88.9	Confident	88.7	Confident	73 Å²	73	70.5 Å²	70.5	38%	0.382	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.8	175.8	-177.6	71.5	0	0	0	108.2	V5 T79 V80	L3-V5 HydrophobicContact CD2-CG2 3.7Å; L3-V5 HydrophobicContact CG-CG2 3.89Å; L3-T79 CarbonylContact O-C 3.51Å; L3-T79 WeakPolarHBondContact O-CA 3.3Å; L3-V80 HydrophobicContact CB-CG2 4.13Å; L3-V80 HydrophobicContact CD2-CG2 4.5Å; L3-V80 PolarHBondContact N-O 3.44Å; L3-V80 PolarHBondContact O-N 2.99Å
4	N	91	Very high	88.9	Confident	119 Å²	119	66.7 Å²	66.7	64%	0.636	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.4	171.2	-68.6	-42.2	0	0	0	108.8	T79	N4-T79 WeakPolarHBondContact OD1-CB 3.26Å; N4-T79 WeakPolarHBondContact OD1-CG2 3.46Å; N4-T79 PolarHBondContact OD1-OG1 2.72Å
5	V	91.3	Very high	89.2	Confident	6 Å²	6	64.3 Å²	64.3	4%	0.036	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.7	-179.3	-177.1	0	0	0	0	108.8	L3 A41 L43 L78 V80	L3-V5 HydrophobicContact CD2-CG2 3.7Å; L3-V5 HydrophobicContact CG-CG2 3.89Å; V5-A41 HydrophobicContact CG1-CB 3.53Å; V5-A41 VanDerWaalsContact CG1-O 3.29Å; V5-A41 WeakPolarHBondContact CG1-O 3.45Å; V5-L43 HydrophobicContact CB-CD2 3.94Å; V5-L43 HydrophobicContact CG1-CD1 4.4Å; V5-L43 HydrophobicContact CG1-CD2 3.83Å; V5-L43 HydrophobicContact CG1-CG 3.85Å; V5-L43 HydrophobicContact CG2-CD2 3.87Å; V5-L78 PolarHBondContact N-O 3.33Å; V5-L78 PolarHBondContact O-N 3.48Å; V5-V80 HydrophobicContact CG2-CG2 3.89Å
6	V	92.7	Very high	89.5	Confident	64 Å²	64	71.2 Å²	71.2	39%	0.388	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.7	-179.3	-176.3	0	0	0	0	108.1	Q75	V6-Q75 HydrophobicContact CG1-CG 3.36Å
7	L	90.9	Very high	89.7	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.2	178.8	-63	164.2	0	0	0	108.6	W13 F15 K37 A38 A41 L43 Q75 L76 L78	L7-W13 HydrophobicContact CB-CE3 3.62Å; L7-W13 HydrophobicContact CB-CZ3 3.59Å; L7-W13 HydrophobicContact CD1-CB 4.47Å; L7-W13 HydrophobicContact CD1-CE3 4.2Å; L7-W13 HydrophobicContact CG-CE3 4.49Å; L7-W13 WeakPolarHBondContact O-CZ3 3.39Å; L7-F15 HydrophobicContact CD1-CD1 4.44Å; L7-F15 HydrophobicContact CD1-CE1 3.97Å; L7-K37 HydrophobicContact CD2-CB 4.3Å; L7-K37 VanDerWaalsContact CD2-O 3.3Å; L7-K37 WeakPolarHBondContact CD2-O 3.28Å; L7-A38 HydrophobicContact CD2-CB 4.43Å; L7-A41 HydrophobicContact CD2-CB 3.39Å; L7-A41 HydrophobicContact CG-CB 4.32Å; L7-L43 HydrophobicContact CD1-CD1 3.94Å; L7-L43 HydrophobicContact CD2-CD1 4.13Å; L7-L43 HydrophobicContact CG-CD1 4.41Å; L7-Q75 CarbonylContact O-C 3.42Å; L7-Q75 VanDerWaalsContact O-CA 3.27Å; L7-Q75 WeakPolarHBondContact O-CA 3.42Å; L7-L76 HydrophobicContact CB-CB 4.2Å; L7-L76 HydrophobicContact CD1-CB 4.34Å; L7-L76 HydrophobicContact CD1-CD2 3.78Å; L7-L76 HydrophobicContact CD1-CG 4.19Å; L7-L76 PolarHBondContact N-O 2.96Å; L7-L76 PolarHBondContact O-N 3.16Å; L7-L78 HydrophobicContact CD1-CD1 4.15Å
8	D	90.5	Very high	89.9	Confident	103 Å²	103	67.6 Å²	67.6	55%	0.551	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	139.4	-178.8	-65.2	-55.2	0	0	0	113.5	K37 Q75	D8-K37 VanDerWaalsContact O-CD 3.29Å; D8-K37 WeakPolarHBondContact O-CD 3.36Å; D8-K37 VanDerWaalsContact O-CE 3.31Å; D8-K37 WeakPolarHBondContact O-CE 3.44Å; D8-K37 PolarHBondContact O-NZ 2.77Å; D8-Q75 PolarHBondContact OD1-NE2 2.95Å
9	G	88.3	Confident	90.1	Very high	21 Å²	21	64.4 Å²	64.4	22%	0.216	36%	0.36	C	S	.	.	S	Bend	trans	97.9	-178.3	172.7	0	0	0	0	0	114.8	W13 K37 F73 N74	G9-W13 WeakPolarHBondContact O-CH2 3.31Å; G9-W13 WeakPolarHBondContact O-CZ3 3.37Å; G9-K37 VanDerWaalsContact CA-NZ 3.3Å; G9-K37 PolarHBondContact O-NZ 3.18Å; G9-F73 CarbonylContact C-O 3.56Å; G9-N74 WeakPolarHBondContact CA-O 3.33Å; G9-N74 PolarHBondContact N-O 3.21Å
10	P	90.3	Very high	90.3	Very high	80 Å²	80	61.2 Å²	61.2	52%	0.519	34%	0.342	S	S	.	.	S	Bend	trans	-73.1	158	-173.5	28.5	-36.2	0	0	0	115.9	K37 F73	P10-K37 PolarHBondContact O-NZ 3.4Å; P10-F73 WeakPolarHBondContact CA-O 3.42Å
11	P	86.6	Confident	90.3	Very high	52 Å²	52	63.2 Å²	63.2	34%	0.338	35%	0.347	S	S	.	.	S	Bend	trans	-51.6	142.6	164	-23.6	32.6	0	0	0	110.7	W13 C72	P11-W13 HydrophobicContact CG-CZ2 4.37Å; P11-C72 WeakPolarHBondContact CD-O 2.95Å; P11-C72 VanDerWaalsContact CG-O 3.31Å; P11-C72 WeakPolarHBondContact CG-O 3.43Å
12	P	91.6	Very high	91.2	Very high	116 Å²	116	58.2 Å²	58.2	75%	0.753	32%	0.324	S	S	*	.	P	Polyproline II helix	cis	-85.8	136.6	11.3	32.4	-34.6	0	0	0	114.7
13	W	91.7	Very high	91.5	Very high	13 Å²	13	59.6 Å²	59.6	5%	0.049	32%	0.321	C	S	.	.			trans	-75.2	-26.7	179.6	-57.1	112.7	0	0	0	114.5	L7 G9 P11 F15 K37 A38 I69 C72 L76	L7-W13 HydrophobicContact CB-CE3 3.62Å; L7-W13 HydrophobicContact CB-CZ3 3.59Å; L7-W13 HydrophobicContact CD1-CB 4.47Å; L7-W13 HydrophobicContact CD1-CE3 4.2Å; L7-W13 HydrophobicContact CG-CE3 4.49Å; L7-W13 WeakPolarHBondContact O-CZ3 3.39Å; G9-W13 WeakPolarHBondContact O-CH2 3.31Å; G9-W13 WeakPolarHBondContact O-CZ3 3.37Å; P11-W13 HydrophobicContact CG-CZ2 4.37Å; W13-F15 HydrophobicContact CB-CD1 3.7Å; W13-F15 HydrophobicContact CB-CE1 3.51Å; W13-F15 HydrophobicContact CG-CE1 4.13Å; W13-K37 HydrophobicContact CE3-CD 4.19Å; W13-K37 HydrophobicContact CZ3-CD 4.48Å; W13-A38 WeakPolarHBondContact O-CB 3.29Å; W13-A38 PolarHBondContact O-N 3.26Å; W13-A38 VanDerWaalsContact O-N 3.11Å; W13-I69 PolarHBondContact NE1-O 3.14Å; W13-C72 HydrophobicContact CZ2-CB 3.87Å; W13-C72 WeakPolarHBondContact CZ2-O 3.14Å; W13-L76 HydrophobicContact CD2-CB 4.1Å; W13-L76 HydrophobicContact CD2-CD2 3.86Å; W13-L76 HydrophobicContact CE3-CB 4.2Å; W13-L76 HydrophobicContact CG-CD2 3.87Å; W13-L76 HydrophobicContact CH2-CB 3.53Å; W13-L76 HydrophobicContact CZ2-CB 3.46Å; W13-L76 VanDerWaalsContact CZ2-CB 3.46Å; W13-L76 HydrophobicContact CZ2-CD2 4.38Å; W13-L76 HydrophobicContact CZ3-CB 3.93Å
14	G	91.6	Very high	91.6	Very high	17 Å²	17	63.5 Å²	63.5	18%	0.175	34%	0.342	C	S	.	.			trans	86.9	26.7	175	0	0	0	0	0	115.8	T33 S36	G14-T33 WeakPolarHBondContact O-CB 3.45Å; G14-T33 PolarHBondContact O-N 2.71Å; G14-T33 PolarHBondContact O-OG1 2.87Å; G14-S36 PolarHBondContact O-OG 2.92Å
15	F	93.4	Very high	91.6	Very high	30 Å²	30	63.3 Å²	63.3	13%	0.132	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	162.3	169.5	69.2	-86.5	0	0	0	111.6	L7 W13 I29 R31 I32 A38 L43 I69 L76 L78	L7-F15 HydrophobicContact CD1-CD1 4.44Å; L7-F15 HydrophobicContact CD1-CE1 3.97Å; W13-F15 HydrophobicContact CB-CD1 3.7Å; W13-F15 HydrophobicContact CB-CE1 3.51Å; W13-F15 HydrophobicContact CG-CE1 4.13Å; F15-I29 HydrophobicContact CB-CG2 4.14Å; F15-I29 HydrophobicContact CD2-CG1 4.37Å; F15-I29 HydrophobicContact CD2-CG2 4.43Å; F15-R31 CarbonylContact C-O 3.49Å; F15-R31 VanDerWaalsContact CA-O 3.3Å; F15-R31 WeakPolarHBondContact CA-O 3.18Å; F15-I32 HydrophobicContact CB-CG1 4.15Å; F15-A38 HydrophobicContact CB-CB 3.93Å; F15-A38 HydrophobicContact CD1-CB 4Å; F15-A38 HydrophobicContact CG-CB 4.42Å; F15-L43 HydrophobicContact CD1-CD1 4.47Å; F15-I69 HydrophobicContact CE2-CD1 4.13Å; F15-I69 HydrophobicContact CZ-CD1 3.96Å; F15-I69 HydrophobicContact CZ-CG1 4.48Å; F15-I69 HydrophobicContact CZ-CG2 4.12Å; F15-L76 HydrophobicContact CE1-CD2 3.91Å; F15-L76 HydrophobicContact CZ-CD2 4.02Å; F15-L78 HydrophobicContact CE1-CD1 4.29Å; F15-L78 HydrophobicContact CZ-CD1 3.98Å
16	R	93.3	Very high	91.6	Very high	175 Å²	175	66.8 Å²	66.8	66%	0.66	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	133	174	-67.8	-170.6	-179.8	-170.4	-1.3	110.3	I29 S30 R31	R16-I29 CarbonylContact O-C 3.58Å; R16-I29 WeakPolarHBondContact O-CA 3.5Å; R16-S30 PolarHBondContact O-N 2.8Å; R16-R31 HydrophobicContact CB-CB 4.34Å; R16-R31 PolarHBondContact N-O 2.83Å
17	L	93.6	Very high	91.7	Very high	23 Å²	23	63.9 Å²	63.9	12%	0.12	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.9	177.2	-175	74.1	0	0	0	110.5	L27 I49 A65 Q66 I69	L17-L27 HydrophobicContact CD1-CB 4.35Å; L17-L27 HydrophobicContact CD1-CD2 4.03Å; L17-L27 HydrophobicContact CD2-CD2 3.93Å; L17-L27 HydrophobicContact CG-CD2 4.06Å; L17-I49 HydrophobicContact CD1-CD1 3.41Å; L17-I49 VanDerWaalsContact CD1-CD1 3.41Å; L17-I49 HydrophobicContact CD1-CG1 4.5Å; L17-A65 HydrophobicContact CD2-CB 3.77Å; L17-Q66 HydrophobicContact CD2-CG 4.22Å; L17-I69 HydrophobicContact CD2-CD1 4.22Å
18	T	93.6	Very high	91.8	Very high	54 Å²	54	65.3 Å²	65.3	33%	0.331	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.2	172	44.3	0	0	0	0	110.8	T28 S30	T18-T28 PolarHBondContact N-O 2.73Å; T18-T28 PolarHBondContact O-N 3.08Å; T18-T28 PolarHBondContact O-OG1 2.81Å; T18-T28 PolarHBondContact OG1-O 2.73Å; T18-T28 PolarHBondContact OG1-OG1 2.91Å; T18-T28 VanDerWaalsContact OG1-OG1 3.07Å; T18-S30 VanDerWaalsContact CG2-CB 3.48Å; T18-S30 WeakPolarHBondContact OG1-CB 3.46Å
19	G	93.7	Very high	91.9	Very high	7 Å²	7	60.5 Å²	60.5	7%	0.072	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	83.7	-168.6	-177.2	0	0	0	0	0	112.7	L27 H62	G19-L27 WeakPolarHBondContact O-CD2 3.27Å; G19-H62 WeakPolarHBondContact O-CB 3.43Å; G19-H62 PolarHBondContact O-ND1 3.3Å
20	G	92.4	Very high	92	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137	157.7	-169.3	0	0	0	0	0	110.6	D22 F23 N24 Q25	G20-D22 VanDerWaalsContact C-OD1 3.27Å; G20-D22 WeakPolarHBondContact CA-OD1 3.49Å; G20-D22 PolarHBondContact O-N 2.77Å; G20-F23 PolarHBondContact O-N 3.44Å; G20-N24 PolarHBondContact O-N 2.91Å; G20-Q25 CarbonylContact C-O 3.4Å; G20-Q25 VanDerWaalsContact C-O 3.29Å; G20-Q25 WeakPolarHBondContact CA-O 3.46Å; G20-Q25 PolarHBondContact N-O 3.04Å; G20-Q25 PolarHBondContact O-N 2.79Å
21	K	91.8	Very high	92	Very high	104 Å²	104	66.3 Å²	66.3	45%	0.452	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-58.3	-34.3	179	180	173	-174.1	167.1	0	112.6	F23 N24 D59 M60 L61	K21-F23 PolarHBondContact O-N 2.76Å; K21-N24 PolarHBondContact O-N 2.69Å; K21-N24 VanDerWaalsContact O-N 3.14Å; K21-D59 HydrophobicContact CD-CB 4.48Å; K21-D59 VanDerWaalsContact CD-O 3.28Å; K21-D59 WeakPolarHBondContact CD-O 3.22Å; K21-D59 IonicContact NZ-OD1 2.8Å; K21-D59 PolarHBondContact NZ-OD1 3.43Å; K21-M60 PolarHBondContact N-O 3.22Å; K21-L61 HydrophobicContact CB-CD2 4.3Å
22	D	93.9	Very high	92.4	Very high	74 Å²	74	65.2 Å²	65.2	40%	0.396	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-59.5	-30.7	173.3	50.4	-34.2	0	0	0	113.6	G20 L61 H62	G20-D22 VanDerWaalsContact C-OD1 3.27Å; G20-D22 WeakPolarHBondContact CA-OD1 3.49Å; G20-D22 PolarHBondContact O-N 2.77Å; D22-L61 HydrophobicContact CB-CD2 4.11Å; D22-H62 WeakPolarHBondContact OD1-CB 3.36Å; D22-H62 PolarHBondContact OD1-N 3.16Å; D22-H62 WeakPolarHBondContact OD2-CB 3.22Å
23	F	90.9	Very high	92.5	Very high	119 Å²	119	63.4 Å²	63.4	52%	0.522	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-97.5	4.4	178.2	-64.4	-77.1	0	0	0	113.4	G20 K21 Q25 H62	G20-F23 PolarHBondContact O-N 3.44Å; K21-F23 PolarHBondContact O-N 2.76Å; F23-Q25 HydrophobicContact CB-CB 4.48Å; F23-Q25 PolarHBondContact O-N 2.68Å; F23-Q25 VanDerWaalsContact O-N 3.16Å; F23-H62 HydrophobicContact CD2-CB 4.15Å; F23-H62 HydrophobicContact CE2-CB 3.85Å
24	N	90.8	Very high	92.4	Very high	154 Å²	154	68 Å²	68	82%	0.824	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	34.4	-171.2	-62.8	-66.9	0	0	0	112.7	G20 K21	G20-N24 PolarHBondContact O-N 2.91Å; K21-N24 PolarHBondContact O-N 2.69Å; K21-N24 VanDerWaalsContact O-N 3.14Å
25	Q	91.2	Very high	92.2	Very high	115 Å²	115	71 Å²	71	54%	0.537	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143	179.7	-73	178.4	16.6	0	0	109.3	G20 F23	G20-Q25 CarbonylContact C-O 3.4Å; G20-Q25 VanDerWaalsContact C-O 3.29Å; G20-Q25 WeakPolarHBondContact CA-O 3.46Å; G20-Q25 PolarHBondContact N-O 3.04Å; G20-Q25 PolarHBondContact O-N 2.79Å; F23-Q25 HydrophobicContact CB-CB 4.48Å; F23-Q25 PolarHBondContact O-N 2.68Å; F23-Q25 VanDerWaalsContact O-N 3.16Å
26	P	91.4	Very high	92.1	Very high	79 Å²	79	70.7 Å²	70.7	51%	0.513	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	149.9	175.2	28.2	-34.5	0	0	0	110.5	T28 I48	P26-T28 HydrophobicContact CG-CG2 4.32Å; P26-T28 PolarHBondContact O-N 3.33Å; P26-I48 HydrophobicContact CB-CG2 3.99Å
27	L	93.6	Very high	92	Very high	3 Å²	3	65.8 Å²	65.8	2%	0.016	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	120.3	174.5	-75.3	164.1	0	0	0	109	L17 G19 I48 I49 A57 M60 A65	L17-L27 HydrophobicContact CD1-CB 4.35Å; L17-L27 HydrophobicContact CD1-CD2 4.03Å; L17-L27 HydrophobicContact CD2-CD2 3.93Å; L17-L27 HydrophobicContact CG-CD2 4.06Å; G19-L27 WeakPolarHBondContact O-CD2 3.27Å; L27-I48 CarbonylContact O-C 3.29Å; L27-I48 WeakPolarHBondContact O-CA 3.1Å; L27-I49 HydrophobicContact CB-CB 4.18Å; L27-I49 PolarHBondContact O-N 2.96Å; L27-A57 HydrophobicContact CD1-CB 3.87Å; L27-M60 HydrophobicContact CD1-CB 4.16Å; L27-M60 HydrophobicContact CD1-CE 4.06Å; L27-M60 HydrophobicContact CD1-CG 4.49Å; L27-A65 HydrophobicContact CD1-CB 3.89Å; L27-A65 HydrophobicContact CD2-CB 4.04Å
28	T	93.1	Very high	91.9	Very high	32 Å²	32	64.7 Å²	64.7	20%	0.196	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.6	-174.4	51.5	0	0	0	0	111.6	T18 P26 D47 I48	T18-T28 PolarHBondContact N-O 2.73Å; T18-T28 PolarHBondContact O-N 3.08Å; T18-T28 PolarHBondContact O-OG1 2.81Å; T18-T28 PolarHBondContact OG1-O 2.73Å; T18-T28 PolarHBondContact OG1-OG1 2.91Å; T18-T28 VanDerWaalsContact OG1-OG1 3.07Å; P26-T28 HydrophobicContact CG-CG2 4.32Å; P26-T28 PolarHBondContact O-N 3.33Å; T28-D47 WeakPolarHBondContact CA-O 3.43Å; T28-I48 HydrophobicContact CG2-CB 4.47Å; T28-I48 HydrophobicContact CG2-CG1 3.87Å
29	I	92.8	Very high	91.7	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.6	174.4	-58.8	178.9	0	0	0	109	F15 R16 I32 L43 A45 G46 D47 I49	F15-I29 HydrophobicContact CB-CG2 4.14Å; F15-I29 HydrophobicContact CD2-CG1 4.37Å; F15-I29 HydrophobicContact CD2-CG2 4.43Å; R16-I29 CarbonylContact O-C 3.58Å; R16-I29 WeakPolarHBondContact O-CA 3.5Å; I29-I32 HydrophobicContact CG2-CD1 4.02Å; I29-I32 HydrophobicContact CG2-CG1 3.68Å; I29-L43 HydrophobicContact CD1-CB 4.23Å; I29-L43 HydrophobicContact CD1-CD1 4.15Å; I29-L43 HydrophobicContact CD1-CD2 3.81Å; I29-L43 HydrophobicContact CD1-CG 4.29Å; I29-A45 CarbonylContact O-C 3.54Å; I29-A45 WeakPolarHBondContact O-CA 2.91Å; I29-G46 PolarHBondContact O-N 2.87Å; I29-D47 HydrophobicContact CD1-CB 4.28Å; I29-D47 PolarHBondContact N-O 3.41Å; I29-I49 HydrophobicContact CG1-CD1 4.19Å; I29-I49 HydrophobicContact CG1-CG1 4.25Å
30	S	91.8	Very high	91.4	Very high	67 Å²	67	67.2 Å²	67.2	47%	0.469	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-42	-179.6	166.6	0	0	0	0	112.6	R16 T18	R16-S30 PolarHBondContact O-N 2.8Å; T18-S30 VanDerWaalsContact CG2-CB 3.48Å; T18-S30 WeakPolarHBondContact OG1-CB 3.46Å
31	R	90.3	Very high	91.2	Very high	157 Å²	157	68.3 Å²	68.3	59%	0.592	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.4	146.5	-174.1	-173.8	171.5	179.7	154.6	0.3	110.8	F15 R16	F15-R31 CarbonylContact C-O 3.49Å; F15-R31 VanDerWaalsContact CA-O 3.3Å; F15-R31 WeakPolarHBondContact CA-O 3.18Å; R16-R31 HydrophobicContact CB-CB 4.34Å; R16-R31 PolarHBondContact N-O 2.83Å
32	I	93.3	Very high	90.9	Very high	29 Å²	29	68.8 Å²	68.8	15%	0.149	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.1	174	-61.3	176	0	0	0	108.2	F15 I29 A38 L43 C44	F15-I32 HydrophobicContact CB-CG1 4.15Å; I29-I32 HydrophobicContact CG2-CD1 4.02Å; I29-I32 HydrophobicContact CG2-CG1 3.68Å; I32-A38 HydrophobicContact CG2-CB 3.94Å; I32-L43 HydrophobicContact CD1-CB 3.56Å; I32-L43 WeakPolarHBondContact CD1-O 3.22Å; I32-C44 VanDerWaalsContact CD1-CA 3.41Å; I32-C44 VanDerWaalsContact CD1-N 3.31Å
33	T	93.4	Very high	90.7	Very high	78 Å²	78	65.7 Å²	65.7	48%	0.479	39%	0.389	S	S	.	.			trans	-79.8	121.4	174.5	-60	0	0	0	0	108.3	G14 G35 S36	G14-T33 WeakPolarHBondContact O-CB 3.45Å; G14-T33 PolarHBondContact O-N 2.71Å; G14-T33 PolarHBondContact O-OG1 2.87Å; T33-G35 PolarHBondContact O-N 3.42Å; T33-S36 VanDerWaalsContact O-CB 3.26Å; T33-S36 WeakPolarHBondContact O-CB 3.48Å; T33-S36 PolarHBondContact O-N 2.77Å; T33-S36 PolarHBondContact O-OG 2.84Å
34	P	90.3	Very high	90.6	Very high	109 Å²	109	62.7 Å²	62.7	71%	0.708	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	138.4	178.3	26.9	-34	0	0	0	110.3	S36	P34-S36 VanDerWaalsContact C-N 3.27Å; P34-S36 PolarHBondContact O-N 3.17Å
35	G	87.9	Confident	90.5	Very high	81 Å²	81	58.5 Å²	58.5	84%	0.835	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	7.5	-177	0	0	0	0	0	115.1	T33	T33-G35 PolarHBondContact O-N 3.42Å
36	S	91.8	Very high	90.4	Very high	23 Å²	23	55.4 Å²	55.4	16%	0.161	37%	0.368	C	S	.	.	S	Bend	trans	-87	171.9	172	69.5	0	0	0	0	112.8	G14 T33 P34 A38 S39 G40	G14-S36 PolarHBondContact O-OG 2.92Å; T33-S36 VanDerWaalsContact O-CB 3.26Å; T33-S36 WeakPolarHBondContact O-CB 3.48Å; T33-S36 PolarHBondContact O-N 2.77Å; T33-S36 PolarHBondContact O-OG 2.84Å; P34-S36 VanDerWaalsContact C-N 3.27Å; P34-S36 PolarHBondContact O-N 3.17Å; S36-A38 VanDerWaalsContact C-N 3.26Å; S36-A38 PolarHBondContact O-N 2.85Å; S36-S39 WeakPolarHBondContact O-CA 3.29Å; S36-S39 WeakPolarHBondContact O-CB 3.44Å; S36-S39 PolarHBondContact O-N 3.47Å; S36-S39 PolarHBondContact OG-N 3.21Å; S36-G40 PolarHBondContact O-N 3.47Å
37	K	91.1	Very high	90.4	Very high	71 Å²	71	51.9 Å²	51.9	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-56.3	-40.8	174.3	-63.8	170.1	175	-171.1	0	112.1	L7 D8 G9 P10 W13 S39 G40 A41	L7-K37 HydrophobicContact CD2-CB 4.3Å; L7-K37 VanDerWaalsContact CD2-O 3.3Å; L7-K37 WeakPolarHBondContact CD2-O 3.28Å; D8-K37 VanDerWaalsContact O-CD 3.29Å; D8-K37 WeakPolarHBondContact O-CD 3.36Å; D8-K37 VanDerWaalsContact O-CE 3.31Å; D8-K37 WeakPolarHBondContact O-CE 3.44Å; D8-K37 PolarHBondContact O-NZ 2.77Å; G9-K37 VanDerWaalsContact CA-NZ 3.3Å; G9-K37 PolarHBondContact O-NZ 3.18Å; P10-K37 PolarHBondContact O-NZ 3.4Å; W13-K37 HydrophobicContact CE3-CD 4.19Å; W13-K37 HydrophobicContact CZ3-CD 4.48Å; K37-S39 VanDerWaalsContact C-N 3.3Å; K37-S39 PolarHBondContact O-N 2.84Å; K37-G40 PolarHBondContact O-N 3.26Å; K37-G40 VanDerWaalsContact O-N 3.16Å; K37-A41 PolarHBondContact O-N 3.34Å
38	A	91.4	Very high	90.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.8	-40.8	174	0	0	0	0	0	112.9	L7 W13 F15 I32 S36 L43	L7-A38 HydrophobicContact CD2-CB 4.43Å; W13-A38 WeakPolarHBondContact O-CB 3.29Å; W13-A38 PolarHBondContact O-N 3.26Å; W13-A38 VanDerWaalsContact O-N 3.11Å; F15-A38 HydrophobicContact CB-CB 3.93Å; F15-A38 HydrophobicContact CD1-CB 4Å; F15-A38 HydrophobicContact CG-CB 4.42Å; I32-A38 HydrophobicContact CG2-CB 3.94Å; S36-A38 VanDerWaalsContact C-N 3.26Å; S36-A38 PolarHBondContact O-N 2.85Å; A38-L43 HydrophobicContact CB-CD1 3.97Å; A38-L43 WeakPolarHBondContact O-CB 3.31Å; A38-L43 PolarHBondContact O-N 3.27Å; A38-L43 VanDerWaalsContact O-N 3.14Å
39	S	89.2	Confident	90.3	Very high	51 Å²	51	51.9 Å²	51.9	36%	0.357	34%	0.344	S	S	.	.	H	α-helix	trans	-68.4	-38.7	175.3	-170.2	0	0	0	0	112	S36 K37 A41 N42	S36-S39 WeakPolarHBondContact O-CA 3.29Å; S36-S39 WeakPolarHBondContact O-CB 3.44Å; S36-S39 PolarHBondContact O-N 3.47Å; S36-S39 PolarHBondContact OG-N 3.21Å; K37-S39 VanDerWaalsContact C-N 3.3Å; K37-S39 PolarHBondContact O-N 2.84Å; S39-A41 VanDerWaalsContact C-N 3.34Å; S39-N42 PolarHBondContact O-N 3.32Å
40	G	87.1	Confident	90.3	Very high	63 Å²	63	55.2 Å²	55.2	65%	0.649	36%	0.361	S	S	*	.	H	α-helix	trans	-67.8	-31.9	178	0	0	0	0	0	113.4	S36 K37 N42	S36-G40 PolarHBondContact O-N 3.47Å; K37-G40 PolarHBondContact O-N 3.26Å; K37-G40 VanDerWaalsContact O-N 3.16Å; G40-N42 PolarHBondContact O-N 3.14Å
41	A	88.3	Confident	90.4	Very high	24 Å²	24	52.7 Å²	52.7	20%	0.198	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	13.7	177.1	0	0	0	0	0	113.9	V5 L7 K37 S39 L43	V5-A41 HydrophobicContact CG1-CB 3.53Å; V5-A41 VanDerWaalsContact CG1-O 3.29Å; V5-A41 WeakPolarHBondContact CG1-O 3.45Å; L7-A41 HydrophobicContact CD2-CB 3.39Å; L7-A41 HydrophobicContact CG-CB 4.32Å; K37-A41 PolarHBondContact O-N 3.34Å; S39-A41 VanDerWaalsContact C-N 3.34Å; A41-L43 VanDerWaalsContact C-N 3.26Å; A41-L43 PolarHBondContact O-N 2.85Å
42	N	86.2	Confident	90.6	Very high	115 Å²	115	45.2 Å²	45.2	62%	0.615	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	28.4	178.4	-59.8	-63.6	0	0	0	115.2	S39 G40 R82	S39-N42 PolarHBondContact O-N 3.32Å; G40-N42 PolarHBondContact O-N 3.14Å; N42-R82 PolarHBondContact O-NH2 3.33Å
43	L	88.9	Confident	90.4	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.042	33%	0.329	C	S	.	.			trans	-66.3	145.9	166	-69.2	171.5	0	0	0	109.3	V5 L7 F15 I29 I32 A38 A41 L78 V80	V5-L43 HydrophobicContact CB-CD2 3.94Å; V5-L43 HydrophobicContact CG1-CD1 4.4Å; V5-L43 HydrophobicContact CG1-CD2 3.83Å; V5-L43 HydrophobicContact CG1-CG 3.85Å; V5-L43 HydrophobicContact CG2-CD2 3.87Å; L7-L43 HydrophobicContact CD1-CD1 3.94Å; L7-L43 HydrophobicContact CD2-CD1 4.13Å; L7-L43 HydrophobicContact CG-CD1 4.41Å; F15-L43 HydrophobicContact CD1-CD1 4.47Å; I29-L43 HydrophobicContact CD1-CB 4.23Å; I29-L43 HydrophobicContact CD1-CD1 4.15Å; I29-L43 HydrophobicContact CD1-CD2 3.81Å; I29-L43 HydrophobicContact CD1-CG 4.29Å; I32-L43 HydrophobicContact CD1-CB 3.56Å; I32-L43 WeakPolarHBondContact CD1-O 3.22Å; A38-L43 HydrophobicContact CB-CD1 3.97Å; A38-L43 WeakPolarHBondContact O-CB 3.31Å; A38-L43 PolarHBondContact O-N 3.27Å; A38-L43 VanDerWaalsContact O-N 3.14Å; A41-L43 VanDerWaalsContact C-N 3.26Å; A41-L43 PolarHBondContact O-N 2.85Å; L43-L78 HydrophobicContact CD1-CD1 4.19Å; L43-V80 HydrophobicContact CD2-CG1 4.05Å; L43-V80 HydrophobicContact CD2-CG2 4.24Å
44	C	88.2	Confident	89.9	Confident	57 Å²	57	47.6 Å²	47.6	39%	0.385	34%	0.339	S	S	.	.			trans	-123.9	151	176.1	-74.6	0	0	0	0	111.3	I32 G46 D47	I32-C44 VanDerWaalsContact CD1-CA 3.41Å; I32-C44 VanDerWaalsContact CD1-N 3.31Å; C44-G46 PolarHBondContact O-N 3.31Å; C44-D47 PolarHBondContact N-OD2 2.78Å; C44-D47 WeakPolarHBondContact O-CB 2.77Å; C44-D47 PolarHBondContact O-N 2.82Å
45	A	90.3	Very high	89.9	Confident	65 Å²	65	43.8 Å²	43.8	54%	0.537	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	130.6	170	0	0	0	0	0	109	I29	I29-A45 CarbonylContact O-C 3.54Å; I29-A45 WeakPolarHBondContact O-CA 2.91Å
46	G	88.3	Confident	90.1	Very high	50 Å²	50	44.6 Å²	44.6	52%	0.515	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-7.5	-174.3	0	0	0	0	0	114.7	I29 C44	I29-G46 PolarHBondContact O-N 2.87Å; C44-G46 PolarHBondContact O-N 3.31Å
47	D	90.6	Very high	89.9	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.027	30%	0.303	C	S	.	.			trans	-65	135	173.3	-72.2	-17.2	0	0	0	110	T28 I29 C44 V80 R82	T28-D47 WeakPolarHBondContact CA-O 3.43Å; I29-D47 HydrophobicContact CD1-CB 4.28Å; I29-D47 PolarHBondContact N-O 3.41Å; C44-D47 PolarHBondContact N-OD2 2.78Å; C44-D47 WeakPolarHBondContact O-CB 2.77Å; C44-D47 PolarHBondContact O-N 2.82Å; D47-V80 HydrophobicContact CB-CB 4.22Å; D47-V80 HydrophobicContact CB-CG2 4.46Å; D47-R82 IonicContact OD1-NE 3.6Å; D47-R82 PolarHBondContact OD1-NE 3.07Å; D47-R82 IonicContact OD2-NH2 2.69Å
48	I	92.7	Very high	89.8	Confident	32 Å²	32	44.5 Å²	44.5	16%	0.164	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126	179.1	-60.2	167.7	0	0	0	108.4	P26 L27 T28 L50 V80 E81	P26-I48 HydrophobicContact CB-CG2 3.99Å; L27-I48 CarbonylContact O-C 3.29Å; L27-I48 WeakPolarHBondContact O-CA 3.1Å; T28-I48 HydrophobicContact CG2-CB 4.47Å; T28-I48 HydrophobicContact CG2-CG1 3.87Å; I48-L50 PolarHBondContact O-N 2.98Å; I48-V80 CarbonylContact O-C 3.53Å; I48-V80 WeakPolarHBondContact O-CA 3.49Å; I48-E81 PolarHBondContact N-O 3.11Å; I48-E81 VanDerWaalsContact N-O 3.08Å; I48-E81 PolarHBondContact O-N 2.77Å
49	I	93.3	Very high	89.5	Confident	4 Å²	4	50 Å²	50	2%	0.021	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.9	177.2	-53.4	-176.7	0	0	0	108.6	L17 L27 I29 I52 A57 L78 V80	L17-I49 HydrophobicContact CD1-CD1 3.41Å; L17-I49 VanDerWaalsContact CD1-CD1 3.41Å; L17-I49 HydrophobicContact CD1-CG1 4.5Å; L27-I49 HydrophobicContact CB-CB 4.18Å; L27-I49 PolarHBondContact O-N 2.96Å; I29-I49 HydrophobicContact CG1-CD1 4.19Å; I29-I49 HydrophobicContact CG1-CG1 4.25Å; I49-I52 HydrophobicContact CG2-CD1 4.22Å; I49-I52 HydrophobicContact CG2-CG1 3.63Å; I49-A57 HydrophobicContact CG2-CB 4.29Å; I49-A57 WeakPolarHBondContact O-CB 3.46Å; I49-L78 HydrophobicContact CG2-CD2 4.39Å; I49-V80 HydrophobicContact CG1-CG1 4.23Å
50	L	92.8	Very high	89.6	Confident	71 Å²	71	47.8 Å²	47.8	37%	0.372	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-33.3	175.3	-67.1	-179.9	0	0	0	112.3	P2 I48 A57 T79 E81	P2-L50 HydrophobicContact CB-CD1 4.14Å; I48-L50 PolarHBondContact O-N 2.98Å; L50-A57 WeakPolarHBondContact O-CB 3.35Å; L50-A57 PolarHBondContact O-N 3.08Å; L50-T79 WeakPolarHBondContact CA-O 3.34Å; L50-T79 HydrophobicContact CB-CG2 4.35Å; L50-T79 PolarHBondContact N-O 3.27Å; L50-E81 HydrophobicContact CD1-CB 3.78Å; L50-E81 HydrophobicContact CD2-CB 4.47Å; L50-E81 HydrophobicContact CG-CB 3.98Å
51	A	93.4	Very high	89.9	Confident	13 Å²	13	48.2 Å²	48.2	11%	0.107	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	149.3	176.7	0	0	0	0	0	112.1	A55 T79	A51-A55 CarbonylContact C-O 3.55Å; A51-A55 WeakPolarHBondContact CA-O 3.4Å; A51-A55 VanDerWaalsContact CB-O 3.31Å; A51-A55 WeakPolarHBondContact CB-O 3.31Å; A51-T79 PolarHBondContact N-O 2.82Å; A51-T79 VanDerWaalsContact N-O 3.17Å; A51-T79 PolarHBondContact O-N 2.9Å
52	I	93.4	Very high	90.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	122	175.1	-54.7	-175.7	0	0	0	107.5	I49 G54 A55 M60 A65 K68 I69 L76 L78	I49-I52 HydrophobicContact CG2-CD1 4.22Å; I49-I52 HydrophobicContact CG2-CG1 3.63Å; I52-G54 PolarHBondContact O-N 3.1Å; I52-A55 PolarHBondContact N-O 3.27Å; I52-A55 WeakPolarHBondContact O-CB 3.05Å; I52-A55 PolarHBondContact O-N 3.34Å; I52-M60 HydrophobicContact CB-CE 4.05Å; I52-M60 HydrophobicContact CD1-CE 3.38Å; I52-M60 HydrophobicContact CD1-SD 4.39Å; I52-M60 HydrophobicContact CG1-CE 3.64Å; I52-A65 HydrophobicContact CD1-CB 3.86Å; I52-K68 HydrophobicContact CG2-CB 4.21Å; I52-I69 HydrophobicContact CD1-CD1 4.01Å; I52-I69 HydrophobicContact CD1-CG1 4.13Å; I52-I69 HydrophobicContact CG2-CG1 4.21Å; I52-L76 HydrophobicContact CG2-CD1 4.09Å; I52-L78 HydrophobicContact CB-CD2 4.2Å; I52-L78 HydrophobicContact CD1-CD2 4.49Å; I52-L78 HydrophobicContact CG1-CD2 3.84Å; I52-L78 HydrophobicContact CG2-CD2 3.95Å
53	E	89.3	Confident	90.5	Very high	90 Å²	90	46.7 Å²	46.7	42%	0.421	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	32.9	-176.4	-63.4	-58.7	134.5	0	0	113.6	A55 C72 L76 C77	E53-A55 PolarHBondContact O-N 2.82Å; E53-C72 VanDerWaalsContact CD-SG 3.6Å; E53-C72 WeakPolarHBondContact CG-SG 3.47Å; E53-C72 PolarHBondContact OE1-SG 3.5Å; E53-C72 VanDerWaalsContact OE1-SG 3.4Å; E53-L76 VanDerWaalsContact OE1-CA 3.22Å; E53-L76 WeakPolarHBondContact OE1-CA 3.47Å; E53-C77 PolarHBondContact N-O 3.01Å; E53-C77 PolarHBondContact OE1-N 3.4Å
54	G	84.5	Confident	90.8	Very high	67 Å²	67	49.9 Å²	49.9	69%	0.691	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-5.1	-175.7	0	0	0	0	0	115	I52	I52-G54 PolarHBondContact O-N 3.1Å
55	A	89.9	Confident	91	Very high	29 Å²	29	47.2 Å²	47.2	24%	0.24	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.1	171.6	0	0	0	0	0	110.6	A51 I52 E53 A57	A51-A55 CarbonylContact C-O 3.55Å; A51-A55 WeakPolarHBondContact CA-O 3.4Å; A51-A55 VanDerWaalsContact CB-O 3.31Å; A51-A55 WeakPolarHBondContact CB-O 3.31Å; I52-A55 PolarHBondContact N-O 3.27Å; I52-A55 WeakPolarHBondContact O-CB 3.05Å; I52-A55 PolarHBondContact O-N 3.34Å; E53-A55 PolarHBondContact O-N 2.82Å; A55-A57 PolarHBondContact O-N 3.02Å
56	P	91.1	Very high	91.1	Very high	99 Å²	99	47.5 Å²	47.5	64%	0.643	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	133.5	-178.9	26.7	-33.7	0	0	0	111.1
57	A	89	Confident	91.3	Very high	8 Å²	8	47.9 Å²	47.9	7%	0.066	30%	0.295	C	S	.	.	S	Bend	trans	-91.4	2.5	-175.8	0	0	0	0	0	114	L27 I49 L50 A55 D59 M60	L27-A57 HydrophobicContact CD1-CB 3.87Å; I49-A57 HydrophobicContact CG2-CB 4.29Å; I49-A57 WeakPolarHBondContact O-CB 3.46Å; L50-A57 WeakPolarHBondContact O-CB 3.35Å; L50-A57 PolarHBondContact O-N 3.08Å; A55-A57 PolarHBondContact O-N 3.02Å; A57-D59 VanDerWaalsContact C-N 3.35Å; A57-D59 PolarHBondContact O-N 3.38Å; A57-M60 HydrophobicContact CB-CE 3.61Å
58	A	87.3	Confident	91.4	Very high	84 Å²	84	50.2 Å²	50.2	69%	0.694	31%	0.305	S	S	*	.	S	Bend	trans	-62	-40.3	177.4	0	0	0	0	0	112.6
59	D	86.9	Confident	91.3	Very high	116 Å²	116	49.5 Å²	49.5	62%	0.62	30%	0.301	S	S	*	.	S	Bend	trans	-102.9	1.3	-176.5	-75.5	-52	0	0	0	114.6	K21 A57	K21-D59 HydrophobicContact CD-CB 4.48Å; K21-D59 VanDerWaalsContact CD-O 3.28Å; K21-D59 WeakPolarHBondContact CD-O 3.22Å; K21-D59 IonicContact NZ-OD1 2.8Å; K21-D59 PolarHBondContact NZ-OD1 3.43Å; A57-D59 VanDerWaalsContact C-N 3.35Å; A57-D59 PolarHBondContact O-N 3.38Å
60	M	89.6	Confident	91.2	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.015	33%	0.328	C	S	.	.			trans	-80.9	134.5	-171.8	-171.8	157.7	43.4	0	0	111.6	K21 L27 I52 A57 E64 A65 K68	K21-M60 PolarHBondContact N-O 3.22Å; L27-M60 HydrophobicContact CD1-CB 4.16Å; L27-M60 HydrophobicContact CD1-CE 4.06Å; L27-M60 HydrophobicContact CD1-CG 4.49Å; I52-M60 HydrophobicContact CB-CE 4.05Å; I52-M60 HydrophobicContact CD1-CE 3.38Å; I52-M60 HydrophobicContact CD1-SD 4.39Å; I52-M60 HydrophobicContact CG1-CE 3.64Å; A57-M60 HydrophobicContact CB-CE 3.61Å; M60-E64 HydrophobicContact CG-CB 3.84Å; M60-E64 HydrophobicContact CG-CG 3.92Å; M60-E64 HydrophobicContact SD-CG 4.2Å; M60-A65 HydrophobicContact CE-CB 4.01Å; M60-A65 HydrophobicContact CG-CB 3.97Å; M60-A65 HydrophobicContact SD-CB 3.95Å; M60-K68 HydrophobicContact SD-CD 3.79Å
61	L	93.9	Very high	91	Very high	73 Å²	73	58.5 Å²	58.5	38%	0.382	34%	0.339	S	S	.	.			trans	-72.2	156.3	173	-60.6	174.8	0	0	0	110.5	K21 D22 C63 E64 A65	K21-L61 HydrophobicContact CB-CD2 4.3Å; D22-L61 HydrophobicContact CB-CD2 4.11Å; L61-C63 VanDerWaalsContact C-N 3.32Å; L61-C63 PolarHBondContact O-N 3.3Å; L61-E64 HydrophobicContact CB-CB 4.16Å; L61-E64 PolarHBondContact O-N 2.98Å; L61-A65 PolarHBondContact O-N 2.88Å
62	H	94.1	Very high	90.8	Very high	35 Å²	35	58.6 Å²	58.6	16%	0.162	34%	0.339	C	S	.	.	H	α-helix	trans	-55.9	-46.2	176	-174.6	75	0	0	0	112.6	G19 D22 F23 A65 Q66	G19-H62 WeakPolarHBondContact O-CB 3.43Å; G19-H62 PolarHBondContact O-ND1 3.3Å; D22-H62 WeakPolarHBondContact OD1-CB 3.36Å; D22-H62 PolarHBondContact OD1-N 3.16Å; D22-H62 WeakPolarHBondContact OD2-CB 3.22Å; F23-H62 HydrophobicContact CD2-CB 4.15Å; F23-H62 HydrophobicContact CE2-CB 3.85Å; H62-A65 PolarHBondContact O-N 2.97Å; H62-Q66 PolarHBondContact CD2-NE2 3.29Å; H62-Q66 PolarHBondContact NE2-NE2 2.85Å; H62-Q66 WeakPolarHBondContact O-CG 3.5Å; H62-Q66 PolarHBondContact O-N 3.23Å; H62-Q66 VanDerWaalsContact O-N 3.08Å
63	C	94	Very high	90.4	Very high	72 Å²	72	65.2 Å²	65.2	49%	0.486	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-40.2	179	57	0	0	0	0	112.4	L61 Q66 S67	L61-C63 VanDerWaalsContact C-N 3.32Å; L61-C63 PolarHBondContact O-N 3.3Å; C63-Q66 WeakPolarHBondContact O-CB 3.3Å; C63-Q66 PolarHBondContact O-N 3.36Å; C63-S67 PolarHBondContact O-N 3.29Å; C63-S67 PolarHBondContact O-OG 2.96Å
64	E	93.5	Very high	90.3	Very high	75 Å²	75	67.4 Å²	67.4	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-43.4	178.2	-171.8	-166.4	159.8	0	0	111.2	M60 L61 Q66 S67 K68	M60-E64 HydrophobicContact CG-CB 3.84Å; M60-E64 HydrophobicContact CG-CG 3.92Å; M60-E64 HydrophobicContact SD-CG 4.2Å; L61-E64 HydrophobicContact CB-CB 4.16Å; L61-E64 PolarHBondContact O-N 2.98Å; E64-Q66 VanDerWaalsContact C-N 3.3Å; E64-Q66 PolarHBondContact O-N 2.72Å; E64-S67 PolarHBondContact O-N 3.26Å; E64-K68 PolarHBondContact O-N 3.25Å; E64-K68 WeakPolarHBondContact OE1-CE 3.38Å; E64-K68 IonicContact OE1-NZ 2.76Å; E64-K68 PolarHBondContact OE1-NZ 3.22Å
65	A	93.4	Very high	90.6	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-42.2	174.3	0	0	0	0	0	111.5	L17 L27 I52 M60 L61 H62 I69	L17-A65 HydrophobicContact CD2-CB 3.77Å; L27-A65 HydrophobicContact CD1-CB 3.89Å; L27-A65 HydrophobicContact CD2-CB 4.04Å; I52-A65 HydrophobicContact CD1-CB 3.86Å; M60-A65 HydrophobicContact CE-CB 4.01Å; M60-A65 HydrophobicContact CG-CB 3.97Å; M60-A65 HydrophobicContact SD-CB 3.95Å; L61-A65 PolarHBondContact O-N 2.88Å; H62-A65 PolarHBondContact O-N 2.97Å; A65-I69 WeakPolarHBondContact O-CB 3.24Å; A65-I69 WeakPolarHBondContact O-CD1 3.33Å; A65-I69 VanDerWaalsContact O-CG1 3.22Å; A65-I69 WeakPolarHBondContact O-CG1 3.44Å; A65-I69 PolarHBondContact O-N 2.98Å; A65-I69 VanDerWaalsContact O-N 3.1Å
66	Q	92.6	Very high	90.7	Very high	72 Å²	72	67.1 Å²	67.1	34%	0.336	36%	0.358	S	S	.	.	H	α-helix	trans	-64.3	-42.3	175.1	-71.5	-169.6	4.4	0	0	112.8	L17 H62 C63 E64 I69 K70	L17-Q66 HydrophobicContact CD2-CG 4.22Å; H62-Q66 PolarHBondContact CD2-NE2 3.29Å; H62-Q66 PolarHBondContact NE2-NE2 2.85Å; H62-Q66 WeakPolarHBondContact O-CG 3.5Å; H62-Q66 PolarHBondContact O-N 3.23Å; H62-Q66 VanDerWaalsContact O-N 3.08Å; C63-Q66 WeakPolarHBondContact O-CB 3.3Å; C63-Q66 PolarHBondContact O-N 3.36Å; E64-Q66 VanDerWaalsContact C-N 3.3Å; E64-Q66 PolarHBondContact O-N 2.72Å; Q66-I69 PolarHBondContact O-N 3.21Å; Q66-K70 WeakPolarHBondContact O-CB 3.45Å; Q66-K70 VanDerWaalsContact O-CG 3.24Å; Q66-K70 WeakPolarHBondContact O-CG 3.36Å; Q66-K70 PolarHBondContact O-N 3.33Å
67	S	92.9	Very high	90.7	Very high	57 Å²	57	64.1 Å²	64.1	40%	0.399	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-47.4	178.5	-64.9	0	0	0	0	111	C63 E64 I69 K70 E71	C63-S67 PolarHBondContact O-N 3.29Å; C63-S67 PolarHBondContact O-OG 2.96Å; E64-S67 PolarHBondContact O-N 3.26Å; S67-I69 PolarHBondContact O-N 2.91Å; S67-K70 PolarHBondContact O-N 3.36Å; S67-K70 VanDerWaalsContact O-N 3.08Å; S67-E71 WeakPolarHBondContact O-CB 3.35Å; S67-E71 VanDerWaalsContact O-CG 3.3Å; S67-E71 WeakPolarHBondContact O-CG 3.5Å; S67-E71 PolarHBondContact O-N 3.41Å
68	K	91.4	Very high	90.9	Very high	55 Å²	55	63.8 Å²	63.8	24%	0.239	34%	0.336	C	S	.	.	H	α-helix	trans	-58.4	-44.8	176.1	-73.1	-174.5	-173.3	154.7	0	112.5	I52 M60 E64 K70 E71 C72	I52-K68 HydrophobicContact CG2-CB 4.21Å; M60-K68 HydrophobicContact SD-CD 3.79Å; E64-K68 PolarHBondContact O-N 3.25Å; E64-K68 WeakPolarHBondContact OE1-CE 3.38Å; E64-K68 IonicContact OE1-NZ 2.76Å; E64-K68 PolarHBondContact OE1-NZ 3.22Å; K68-K70 VanDerWaalsContact C-N 3.27Å; K68-K70 PolarHBondContact O-N 2.81Å; K68-E71 PolarHBondContact O-N 3.08Å; K68-C72 PolarHBondContact O-N 3.45Å; K68-C72 PolarHBondContact O-SG 3.37Å
69	I	91.9	Very high	91.2	Very high	16 Å²	16	61.3 Å²	61.3	8%	0.082	31%	0.313	C	S	.	.	H	α-helix	trans	-62.9	-34.1	177.6	-70.3	164.9	0	0	0	112.1	W13 F15 L17 I52 A65 Q66 S67 L76	W13-I69 PolarHBondContact NE1-O 3.14Å; F15-I69 HydrophobicContact CE2-CD1 4.13Å; F15-I69 HydrophobicContact CZ-CD1 3.96Å; F15-I69 HydrophobicContact CZ-CG1 4.48Å; F15-I69 HydrophobicContact CZ-CG2 4.12Å; L17-I69 HydrophobicContact CD2-CD1 4.22Å; I52-I69 HydrophobicContact CD1-CD1 4.01Å; I52-I69 HydrophobicContact CD1-CG1 4.13Å; I52-I69 HydrophobicContact CG2-CG1 4.21Å; A65-I69 WeakPolarHBondContact O-CB 3.24Å; A65-I69 WeakPolarHBondContact O-CD1 3.33Å; A65-I69 VanDerWaalsContact O-CG1 3.22Å; A65-I69 WeakPolarHBondContact O-CG1 3.44Å; A65-I69 PolarHBondContact O-N 2.98Å; A65-I69 VanDerWaalsContact O-N 3.1Å; Q66-I69 PolarHBondContact O-N 3.21Å; S67-I69 PolarHBondContact O-N 2.91Å; I69-L76 HydrophobicContact CG1-CD1 4.29Å; I69-L76 HydrophobicContact CG1-CD2 4.33Å; I69-L76 HydrophobicContact CG2-CD2 3.92Å
70	K	90.2	Very high	91.5	Very high	133 Å²	133	55.8 Å²	55.8	58%	0.578	28%	0.283	S	S	*	.	H	α-helix	trans	-78.6	-31.5	179	-73.3	171.5	-175.3	172.8	0	112.7	Q66 S67 K68 C72	Q66-K70 WeakPolarHBondContact O-CB 3.45Å; Q66-K70 VanDerWaalsContact O-CG 3.24Å; Q66-K70 WeakPolarHBondContact O-CG 3.36Å; Q66-K70 PolarHBondContact O-N 3.33Å; S67-K70 PolarHBondContact O-N 3.36Å; S67-K70 VanDerWaalsContact O-N 3.08Å; K68-K70 VanDerWaalsContact C-N 3.27Å; K68-K70 PolarHBondContact O-N 2.81Å; K70-C72 VanDerWaalsContact C-N 3.29Å
71	E	89.5	Confident	91.5	Very high	132 Å²	132	59 Å²	59	62%	0.617	30%	0.298	S	S	*	.	H	α-helix	trans	-72.8	-22.3	176.9	-74.1	168.2	-167.5	0	0	112.5	S67 K68 F73	S67-E71 WeakPolarHBondContact O-CB 3.35Å; S67-E71 VanDerWaalsContact O-CG 3.3Å; S67-E71 WeakPolarHBondContact O-CG 3.5Å; S67-E71 PolarHBondContact O-N 3.41Å; K68-E71 PolarHBondContact O-N 3.08Å; E71-F73 WeakPolarHBondContact O-CD2 3.3Å; E71-F73 WeakPolarHBondContact O-CE2 3.49Å; E71-F73 PolarHBondContact O-N 3.38Å
72	C	88.1	Confident	91.1	Very high	14 Å²	14	59.5 Å²	59.5	10%	0.095	30%	0.295	C	S	.	.			trans	-68	114.6	169.9	-66	0	0	0	0	110.8	P11 W13 E53 K68 K70 Q75 L76	P11-C72 WeakPolarHBondContact CD-O 2.95Å; P11-C72 VanDerWaalsContact CG-O 3.31Å; P11-C72 WeakPolarHBondContact CG-O 3.43Å; W13-C72 HydrophobicContact CZ2-CB 3.87Å; W13-C72 WeakPolarHBondContact CZ2-O 3.14Å; E53-C72 VanDerWaalsContact CD-SG 3.6Å; E53-C72 WeakPolarHBondContact CG-SG 3.47Å; E53-C72 PolarHBondContact OE1-SG 3.5Å; E53-C72 VanDerWaalsContact OE1-SG 3.4Å; K68-C72 PolarHBondContact O-N 3.45Å; K68-C72 PolarHBondContact O-SG 3.37Å; K70-C72 VanDerWaalsContact C-N 3.29Å; C72-Q75 WeakPolarHBondContact CB-O 3.42Å; C72-L76 HydrophobicContact CB-CB 4.16Å; C72-L76 HydrophobicContact CB-CD1 4.12Å
73	F	84.8	Confident	90	Very high	140 Å²	140	61 Å²	61	61%	0.614	30%	0.304	S	S	*	.	S	Bend	trans	-102.8	-39.4	179.4	-71.3	-79.7	0	0	0	114.5	G9 P10 E71	G9-F73 CarbonylContact C-O 3.56Å; P10-F73 WeakPolarHBondContact CA-O 3.42Å; E71-F73 WeakPolarHBondContact O-CD2 3.3Å; E71-F73 WeakPolarHBondContact O-CE2 3.49Å; E71-F73 PolarHBondContact O-N 3.38Å
74	N	87.2	Confident	88.2	Confident	136 Å²	136	65.5 Å²	65.5	73%	0.727	32%	0.318	S	S	*	.	S	Bend	trans	-103	-33.7	-171.9	-68.3	-20.6	0	0	0	112.3	G9	G9-N74 WeakPolarHBondContact CA-O 3.33Å; G9-N74 PolarHBondContact N-O 3.21Å
75	Q	90.9	Very high	86	Confident	89 Å²	89	66.4 Å²	66.4	42%	0.416	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	144.2	-176.8	-172.3	170.8	75.4	0	0	108.9	V6 L7 D8 C72	V6-Q75 HydrophobicContact CG1-CG 3.36Å; L7-Q75 CarbonylContact O-C 3.42Å; L7-Q75 VanDerWaalsContact O-CA 3.27Å; L7-Q75 WeakPolarHBondContact O-CA 3.42Å; D8-Q75 PolarHBondContact OD1-NE2 2.95Å; C72-Q75 WeakPolarHBondContact CB-O 3.42Å
76	L	91.6	Very high	83.9	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	114.5	172.6	172.8	66.7	0	0	0	109.7	L7 W13 F15 I52 E53 I69 C72 L78	L7-L76 HydrophobicContact CB-CB 4.2Å; L7-L76 HydrophobicContact CD1-CB 4.34Å; L7-L76 HydrophobicContact CD1-CD2 3.78Å; L7-L76 HydrophobicContact CD1-CG 4.19Å; L7-L76 PolarHBondContact N-O 2.96Å; L7-L76 PolarHBondContact O-N 3.16Å; W13-L76 HydrophobicContact CD2-CB 4.1Å; W13-L76 HydrophobicContact CD2-CD2 3.86Å; W13-L76 HydrophobicContact CE3-CB 4.2Å; W13-L76 HydrophobicContact CG-CD2 3.87Å; W13-L76 HydrophobicContact CH2-CB 3.53Å; W13-L76 HydrophobicContact CZ2-CB 3.46Å; W13-L76 VanDerWaalsContact CZ2-CB 3.46Å; W13-L76 HydrophobicContact CZ2-CD2 4.38Å; W13-L76 HydrophobicContact CZ3-CB 3.93Å; F15-L76 HydrophobicContact CE1-CD2 3.91Å; F15-L76 HydrophobicContact CZ-CD2 4.02Å; I52-L76 HydrophobicContact CG2-CD1 4.09Å; E53-L76 VanDerWaalsContact OE1-CA 3.22Å; E53-L76 WeakPolarHBondContact OE1-CA 3.47Å; I69-L76 HydrophobicContact CG1-CD1 4.29Å; I69-L76 HydrophobicContact CG1-CD2 4.33Å; I69-L76 HydrophobicContact CG2-CD2 3.92Å; C72-L76 HydrophobicContact CB-CB 4.16Å; C72-L76 HydrophobicContact CB-CD1 4.12Å; L76-L78 HydrophobicContact CD1-CD2 3.99Å; L76-L78 HydrophobicContact CD1-CG 4.4Å; L76-L78 HydrophobicContact CD2-CD1 4.24Å; L76-L78 HydrophobicContact CD2-CD2 4.43Å; L76-L78 HydrophobicContact CD2-CG 4.36Å; L76-L78 HydrophobicContact CG-CD1 4.43Å; L76-L78 HydrophobicContact CG-CD2 4.16Å; L76-L78 HydrophobicContact CG-CG 4.04Å
77	C	92.4	Very high	81.5	Confident	36 Å²	36	80.1 Å²	80.1	24%	0.243	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	117.4	177.1	-65.1	0	0	0	0	110.3	E53	E53-C77 PolarHBondContact N-O 3.01Å; E53-C77 PolarHBondContact OE1-N 3.4Å
78	L	93.1	Very high	78.9	Confident	1 Å²	1	88.7 Å²	88.7	1%	0.005	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.6	176.9	-60.2	174.7	0	0	0	109.5	V5 L7 F15 L43 I49 I52 L76 V80	V5-L78 PolarHBondContact N-O 3.33Å; V5-L78 PolarHBondContact O-N 3.48Å; L7-L78 HydrophobicContact CD1-CD1 4.15Å; F15-L78 HydrophobicContact CE1-CD1 4.29Å; F15-L78 HydrophobicContact CZ-CD1 3.98Å; L43-L78 HydrophobicContact CD1-CD1 4.19Å; I49-L78 HydrophobicContact CG2-CD2 4.39Å; I52-L78 HydrophobicContact CB-CD2 4.2Å; I52-L78 HydrophobicContact CD1-CD2 4.49Å; I52-L78 HydrophobicContact CG1-CD2 3.84Å; I52-L78 HydrophobicContact CG2-CD2 3.95Å; L76-L78 HydrophobicContact CD1-CD2 3.99Å; L76-L78 HydrophobicContact CD1-CG 4.4Å; L76-L78 HydrophobicContact CD2-CD1 4.24Å; L76-L78 HydrophobicContact CD2-CD2 4.43Å; L76-L78 HydrophobicContact CD2-CG 4.36Å; L76-L78 HydrophobicContact CG-CD1 4.43Å; L76-L78 HydrophobicContact CG-CD2 4.16Å; L76-L78 HydrophobicContact CG-CG 4.04Å; L78-V80 HydrophobicContact CB-CG1 4.04Å
79	T	93	Very high	76.4	Confident	32 Å²	32	89.5 Å²	89.5	20%	0.196	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	111.5	164.9	-53.7	0	0	0	0	107.3	P2 L3 N4 L50 A51	P2-T79 HydrophobicContact CB-CG2 4.11Å; L3-T79 CarbonylContact O-C 3.51Å; L3-T79 WeakPolarHBondContact O-CA 3.3Å; N4-T79 WeakPolarHBondContact OD1-CB 3.26Å; N4-T79 WeakPolarHBondContact OD1-CG2 3.46Å; N4-T79 PolarHBondContact OD1-OG1 2.72Å; L50-T79 WeakPolarHBondContact CA-O 3.34Å; L50-T79 HydrophobicContact CB-CG2 4.35Å; L50-T79 PolarHBondContact N-O 3.27Å; A51-T79 PolarHBondContact N-O 2.82Å; A51-T79 VanDerWaalsContact N-O 3.17Å; A51-T79 PolarHBondContact O-N 2.9Å
80	V	92.9	Very high	73.7	Confident	0 Å²	0	93.2 Å²	93.2	0%	0	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.7	-178.1	-58.4	0	0	0	0	111	P2 L3 V5 L43 D47 I48 I49 L78	P2-V80 CarbonylContact C-O 3.6Å; P2-V80 WeakPolarHBondContact CA-O 3.47Å; L3-V80 HydrophobicContact CB-CG2 4.13Å; L3-V80 HydrophobicContact CD2-CG2 4.5Å; L3-V80 PolarHBondContact N-O 3.44Å; L3-V80 PolarHBondContact O-N 2.99Å; V5-V80 HydrophobicContact CG2-CG2 3.89Å; L43-V80 HydrophobicContact CD2-CG1 4.05Å; L43-V80 HydrophobicContact CD2-CG2 4.24Å; D47-V80 HydrophobicContact CB-CB 4.22Å; D47-V80 HydrophobicContact CB-CG2 4.46Å; I48-V80 CarbonylContact O-C 3.53Å; I48-V80 WeakPolarHBondContact O-CA 3.49Å; I49-V80 HydrophobicContact CG1-CG1 4.23Å; L78-V80 HydrophobicContact CB-CG1 4.04Å
81	E	90.6	Very high	71.3	Confident	72 Å²	72	97.4 Å²	97.4	34%	0.336	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.2	168.7	-177.7	168.4	-118.2	0	0	109.6	I48 L50 N83	I48-E81 PolarHBondContact N-O 3.11Å; I48-E81 VanDerWaalsContact N-O 3.08Å; I48-E81 PolarHBondContact O-N 2.77Å; L50-E81 HydrophobicContact CD1-CB 3.78Å; L50-E81 HydrophobicContact CD2-CB 4.47Å; L50-E81 HydrophobicContact CG-CB 3.98Å; E81-N83 PolarHBondContact O-N 2.7Å
82	R	85.9	Confident	69	Low	82 Å²	82	96.4 Å²	96.4	31%	0.309	47%	0.468	S	S	.	.			trans	-81.2	105.4	168.3	-170.7	168	-69.1	164.5	2.2	107.9	N42 D47 E84	N42-R82 PolarHBondContact O-NH2 3.33Å; D47-R82 IonicContact OD1-NE 3.6Å; D47-R82 PolarHBondContact OD1-NE 3.07Å; D47-R82 IonicContact OD2-NH2 2.69Å; R82-E84 VanDerWaalsContact C-N 3.3Å; R82-E84 HydrophobicContact CG-CG 4.08Å; R82-E84 PolarHBondContact O-N 2.86Å
83	N	69.3	Low	66.9	Low	68 Å²	68	102 Å²	102	36%	0.364	50%	0.502	S	S	.	.			trans	-77.4	88.8	168.9	-168.5	-5.7	0	0	0	107.8	E81 S85	E81-N83 PolarHBondContact O-N 2.7Å; N83-S85 PolarHBondContact O-N 3.24Å; N83-S85 PolarHBondContact OD1-N 2.84Å; N83-S85 PolarHBondContact OD1-OG 2.83Å
84	E	57.1	Low	64.9	Low	166 Å²	166	102.7 Å²	102.7	78%	0.776	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	2.2	175.9	-60.3	-172.7	163.9	0	0	113.4	R82	R82-E84 VanDerWaalsContact C-N 3.3Å; R82-E84 HydrophobicContact CG-CG 4.08Å; R82-E84 PolarHBondContact O-N 2.86Å
85	S	48.2	Very low	62.8	Low	94 Å²	94	103.2 Å²	103.2	66%	0.657	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	33.1	-172.6	32.7	0	0	0	0	115	N83	N83-S85 PolarHBondContact O-N 3.24Å; N83-S85 PolarHBondContact OD1-N 2.84Å; N83-S85 PolarHBondContact OD1-OG 2.83Å
86	R	48.4	Very low	60.9	Low	212 Å²	212	103 Å²	103	80%	0.8	53%	0.531	S	S	*	.			trans	-124.4	34.9	162.3	-85.5	-171.7	175.3	161.2	-0.1	114.7	W88	R86-W88 PolarHBondContact O-N 3.48Å
87	L	42.5	Very low	58.8	Low	147 Å²	147	113.8 Å²	113.8	77%	0.77	57%	0.572	S	S	*	*			trans	-60.4	97	133.1	-71.4	166.6	0	0	0	105.8	S89	L87-S89 PolarHBondContact O-N 2.88Å
88	W	37.8	Very low	56.5	Low	237 Å²	237	116.9 Å²	116.9	90%	0.898	60%	0.6	S	S	*	*			trans	-60.3	87.6	158.6	-176.2	-71.6	0	0	0	106.4	R86	R86-W88 PolarHBondContact O-N 3.48Å
89	S	39.7	Very low	54.4	Low	72 Å²	72	124.7 Å²	124.7	50%	0.503	64%	0.636	S	S	.	*			trans	-104.9	114.7	160	45.6	0	0	0	0	103.7	L87 R91	L87-S89 PolarHBondContact O-N 2.88Å; S89-R91 VanDerWaalsContact C-N 3.28Å; S89-R91 PolarHBondContact O-N 3.25Å
90	P	34.4	Very low	52.4	Low	94 Å²	94	128.4 Å²	128.4	61%	0.61	66%	0.661	S	S	*	*			trans	-59	101.8	166.2	-13.9	27.2	0	0	0	106.2	V92	P90-V92 HydrophobicContact CB-CG2 4.19Å; P90-V92 PolarHBondContact O-N 3.15Å
91	R	40.7	Very low	50.1	Low	222 Å²	222	136.6 Å²	136.6	84%	0.838	70%	0.697	S	S	*	*			trans	-74	76.4	163.7	-75.5	-169	-179.7	-150.8	2.9	106.6	S89 V93	S89-R91 VanDerWaalsContact C-N 3.28Å; S89-R91 PolarHBondContact O-N 3.25Å; R91-V93 VanDerWaalsContact C-N 3.33Å; R91-V93 PolarHBondContact O-N 3.05Å
92	V	39.9	Very low	47.9	Very low	110 Å²	110	141.8 Å²	141.8	67%	0.667	72%	0.718	S	S	*	*			trans	-75.7	97.2	158.7	-176.5	0	0	0	0	104.9	P90 E94	P90-V92 HydrophobicContact CB-CG2 4.19Å; P90-V92 PolarHBondContact O-N 3.15Å; V92-E94 HydrophobicContact CG1-CB 4.19Å; V92-E94 PolarHBondContact O-N 3.39Å
93	V	45.2	Very low	46.3	Very low	133 Å²	133	146 Å²	146	81%	0.806	75%	0.746	S	S	*	*			trans	-84	94.7	164.3	-179.6	0	0	0	0	105.4	R91	R91-V93 VanDerWaalsContact C-N 3.33Å; R91-V93 PolarHBondContact O-N 3.05Å
94	E	42	Very low	45	Very low	153 Å²	153	147.2 Å²	147.2	72%	0.715	75%	0.752	S	S	*	*			trans	-113.9	114.3	164.8	-150.2	176.4	159.9	0	0	106.9	V92 G96	V92-E94 HydrophobicContact CG1-CB 4.19Å; V92-E94 PolarHBondContact O-N 3.39Å; E94-G96 PolarHBondContact O-N 3.2Å
95	D	44.1	Very low	44.5	Very low	147 Å²	147	147.9 Å²	147.9	79%	0.786	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	41.6	69.5	169.2	-71.4	-58.5	0	0	0	118.7	R97	D95-R97 PolarHBondContact O-N 3.42Å
96	G	51.1	Low	44.2	Very low	84 Å²	84	150.8 Å²	150.8	87%	0.866	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.5	9.4	145.4	0	0	0	0	0	118.1	E94	E94-G96 PolarHBondContact O-N 3.2Å
97	R	46.6	Very low	44	Very low	227 Å²	227	146.5 Å²	146.5	86%	0.857	77%	0.766	S	S	*	*			trans	-121.4	115.1	172.7	-77.5	-179.6	178.1	172.9	0.9	110.3	D95 H99	D95-R97 PolarHBondContact O-N 3.42Å; R97-H99 PolarHBondContact O-N 3.49Å
98	A	44.9	Very low	44.7	Very low	102 Å²	102	147.2 Å²	147.2	84%	0.843	77%	0.765	S	S	*	*			trans	-61.9	127.2	172.9	0	0	0	0	0	110.2
99	H	48.9	Very low	45.4	Very low	165 Å²	165	145.1 Å²	145.1	76%	0.764	77%	0.766	S	S	*	*			trans	-62	139.2	170.2	-107.4	-79.9	0	0	0	110.2	R97 F101	R97-H99 PolarHBondContact O-N 3.49Å; H99-F101 PolarHBondContact O-N 2.63Å
100	P	50.2	Low	45.9	Very low	109 Å²	109	150.5 Å²	150.5	71%	0.708	78%	0.783	S	S	*	*	S	Bend	trans	-72.8	2.8	-172.8	28.2	-35.5	0	0	0	115.1
101	F	44.5	Very low	47	Very low	172 Å²	172	154 Å²	154	75%	0.754	79%	0.791	S	S	*	*			trans	-106.4	84.4	-179	-63.1	-72	0	0	0	110.8	H99	H99-F101 PolarHBondContact O-N 2.63Å
102	K	44.7	Very low	47.6	Very low	182 Å²	182	153.3 Å²	153.3	79%	0.791	79%	0.79	S	S	*	*			trans	-76.2	111.7	161.8	-101.8	-178	173.8	177.6	0	108.6	N104	K102-N104 PolarHBondContact O-N 3.28Å
103	L	52.3	Low	48.4	Very low	170 Å²	170	155.8 Å²	155.8	89%	0.89	79%	0.792	S	S	*	*			trans	-91.9	76.2	166.5	-89.2	141.6	0	0	0	108.9
104	N	41.4	Very low	48.9	Very low	93 Å²	93	154 Å²	154	50%	0.497	78%	0.783	S	S	.	*			trans	-85.9	121	162.7	-76	-34.4	0	0	0	107.8	K102 Q106	K102-N104 PolarHBondContact O-N 3.28Å; N104-Q106 PolarHBondContact O-N 3.48Å; N104-Q106 VanDerWaalsContact O-N 3.15Å
105	L	45.9	Very low	49.2	Very low	181 Å²	181	155.1 Å²	155.1	95%	0.948	79%	0.792	S	S	*	*	S	Bend	trans	-84	35.1	176.4	-158.9	74.7	0	0	0	112
106	Q	42.5	Very low	49.8	Very low	155 Å²	155	151 Å²	151	72%	0.724	78%	0.784	S	S	*	*	S	Bend	trans	-116.9	121.9	161.4	-81.7	120	-0.5	0	0	106.6	N104 E108	N104-Q106 PolarHBondContact O-N 3.48Å; N104-Q106 VanDerWaalsContact O-N 3.15Å; Q106-E108 PolarHBondContact O-N 2.79Å
107	S	44.3	Very low	50	Low	122 Å²	122	153.6 Å²	153.6	85%	0.853	78%	0.783	S	S	*	*			trans	-63.7	93.9	176.8	54.4	0	0	0	0	109.6	Q109	S107-Q109 PolarHBondContact O-N 2.83Å
108	E	56.5	Low	50.4	Low	161 Å²	161	146.8 Å²	146.8	75%	0.752	78%	0.775	S	S	*	*			trans	-64.9	115.9	160	-83.7	177.8	97.4	0	0	107.1	Q106 Q110	Q106-E108 PolarHBondContact O-N 2.79Å; E108-Q110 PolarHBondContact O-N 3.25Å
109	Q	54.4	Low	50.8	Low	194 Å²	194	150.7 Å²	150.7	91%	0.907	78%	0.776	S	S	*	*			trans	-63.4	100.2	177	-164.7	174.8	18.9	0	0	108	S107 E111	S107-Q109 PolarHBondContact O-N 2.83Å; Q109-E111 PolarHBondContact O-N 2.91Å
110	Q	50.2	Low	51	Low	184 Å²	184	148.8 Å²	148.8	86%	0.86	77%	0.771	S	S	*	*			trans	-67	119.8	178.3	-80.6	-178.6	-27.4	0	0	109.5	E108 Y112	E108-Q110 PolarHBondContact O-N 3.25Å; Q110-Y112 PolarHBondContact O-N 2.8Å
111	E	55.9	Low	51.4	Low	169 Å²	169	155.2 Å²	155.2	79%	0.79	78%	0.782	S	S	*	*			trans	-57.2	120	168.5	-119.4	-177.2	173.6	0	0	109.3	Q109 K113	Q109-E111 PolarHBondContact O-N 2.91Å; E111-K113 PolarHBondContact O-N 3.05Å
112	Y	53.8	Low	51.9	Low	206 Å²	206	155.9 Å²	155.9	81%	0.808	78%	0.784	S	S	*	*			trans	-66.4	102.2	-179.1	-178.7	-94.6	0	0	0	110	Q110 P114	Q110-Y112 PolarHBondContact O-N 2.8Å; Y112-P114 HydrophobicContact CE1-CB 4.14Å
113	K	57.3	Low	52.1	Low	162 Å²	162	151.6 Å²	151.6	70%	0.704	78%	0.783	S	S	*	*			trans	-97.4	118.8	163.8	-71.3	178.9	-178	173.9	0	108.1	E111 I115	E111-K113 PolarHBondContact O-N 3.05Å; K113-I115 PolarHBondContact O-N 2.97Å; K113-I115 VanDerWaalsContact O-N 3.16Å
114	P	55	Low	52.4	Low	95 Å²	95	151.9 Å²	151.9	62%	0.617	78%	0.779	S	S	*	*			trans	-59.8	121.7	179.4	22	-30.3	0	0	0	109.8	Y112 G116	Y112-P114 HydrophobicContact CE1-CB 4.14Å; P114-G116 PolarHBondContact O-N 3.33Å
115	I	47.6	Very low	52.6	Low	178 Å²	178	152.3 Å²	152.3	91%	0.913	79%	0.787	S	S	*	*	S	Bend	trans	-77	111.9	-177.4	-63	165	0	0	0	107.9	K113	K113-I115 PolarHBondContact O-N 2.97Å; K113-I115 VanDerWaalsContact O-N 3.16Å
116	G	57.3	Low	52.6	Low	60 Å²	60	152.7 Å²	152.7	62%	0.619	78%	0.782	S	S	*	*			trans	163.6	12	168.8	0	0	0	0	0	122.4	P114	P114-G116 PolarHBondContact O-N 3.33Å
117	T	56.7	Low	52.7	Low	139 Å²	139	151.7 Å²	151.7	85%	0.853	79%	0.786	S	S	*	*	S	Bend	trans	-108.6	7.8	-172.4	50	0	0	0	0	117.8
118	A	53.8	Low	52.6	Low	83 Å²	83	149.3 Å²	149.3	69%	0.686	77%	0.773	S	S	*	*	S	Bend	trans	-118	-6.7	-174	0	0	0	0	0	117.2
119	H	52.8	Low	51.8	Low	184 Å²	184	146.1 Å²	146.1	85%	0.852	78%	0.775	S	S	*	*			trans	-129.7	58.7	179.4	-66.3	90.6	0	0	0	112.1	R121	H119-R121 VanDerWaalsContact C-N 3.26Å; H119-R121 PolarHBondContact O-N 3.21Å; H119-R121 VanDerWaalsContact O-N 3.1Å
120	N	54.4	Low	51.1	Low	126 Å²	126	140.8 Å²	140.8	67%	0.674	76%	0.764	S	S	*	*			trans	-79.9	70.3	166	-85.4	-65.4	0	0	0	110.6
121	R	58.8	Low	50.8	Low	244 Å²	244	138.8 Å²	138.8	92%	0.921	76%	0.759	S	S	*	*			trans	-96.9	89.8	150.2	-75.1	-178.7	102.2	160.6	3.9	106.1	H119 A123	H119-R121 VanDerWaalsContact C-N 3.26Å; H119-R121 PolarHBondContact O-N 3.21Å; H119-R121 VanDerWaalsContact O-N 3.1Å; R121-A123 PolarHBondContact O-N 3.14Å
122	K	54.2	Low	50.2	Low	185 Å²	185	138.9 Å²	138.9	80%	0.804	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-52.8	124.5	175	-63	-179.5	-179.8	-178.7	0	108.4	Q124	K122-Q124 PolarHBondContact O-N 3.23Å
123	A	48.4	Very low	49.5	Very low	93 Å²	93	135.1 Å²	135.1	77%	0.769	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.3	162.2	0	0	0	0	0	107.5	R121	R121-A123 PolarHBondContact O-N 3.14Å
124	Q	58.7	Low	49.2	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-60	132.8	168.7	-78.4	-74	-18.9	0	0	108.2	K122 F126	K122-Q124 PolarHBondContact O-N 3.23Å; Q124-F126 PolarHBondContact O-N 3.1Å
125	P	46.5	Very low	49.2	Very low	102 Å²	102	139.1 Å²	139.1	66%	0.662	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-63.1	135.2	172.9	26.6	-30.3	0	0	0	108.5	V127	P125-V127 PolarHBondContact O-N 3.04Å; P125-V127 VanDerWaalsContact O-N 3.12Å
126	F	45.7	Very low	49.7	Very low	189 Å²	189	141.9 Å²	141.9	83%	0.829	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59	116.6	168.3	-170.3	-97.3	0	0	0	107.4	Q124 A128	Q124-F126 PolarHBondContact O-N 3.1Å; F126-A128 HydrophobicContact CD1-CB 4.09Å; F126-A128 HydrophobicContact CE1-CB 4.4Å; F126-A128 PolarHBondContact O-N 3.36Å
127	V	45	Very low	49.3	Very low	134 Å²	134	147.6 Å²	147.6	81%	0.812	78%	0.782	S	S	*	*			trans	-71.6	81.6	169.4	-172.3	0	0	0	0	106.2	P125 A129	P125-V127 PolarHBondContact O-N 3.04Å; P125-V127 VanDerWaalsContact O-N 3.12Å; V127-A129 PolarHBondContact O-N 3.16Å
128	A	41.7	Very low	49.1	Very low	72 Å²	72	147.7 Å²	147.7	60%	0.595	78%	0.782	S	S	*	*			trans	-63.6	116.3	158.9	0	0	0	0	0	105.6	F126 A130	F126-A128 HydrophobicContact CD1-CB 4.09Å; F126-A128 HydrophobicContact CE1-CB 4.4Å; F126-A128 PolarHBondContact O-N 3.36Å; A128-A130 PolarHBondContact O-N 3.29Å
129	A	40.2	Very low	48.8	Very low	94 Å²	94	149.1 Å²	149.1	78%	0.777	78%	0.782	S	S	*	*			trans	-43.7	138.2	176.7	0	0	0	0	0	110.8	V127	V127-A129 PolarHBondContact O-N 3.16Å
130	A	38.7	Very low	48.6	Very low	83 Å²	83	144.5 Å²	144.5	69%	0.686	77%	0.771	S	S	*	*			trans	-50.3	158.1	176.5	0	0	0	0	0	113.3	A128	A128-A130 PolarHBondContact O-N 3.29Å
131	N	44	Very low	48.5	Very low	142 Å²	142	145.2 Å²	145.2	76%	0.759	78%	0.78	S	S	*	*			trans	69.1	105.6	155.6	-93.5	-77.4	0	0	0	116.6
132	I	42.7	Very low	48.2	Very low	170 Å²	170	137.5 Å²	137.5	87%	0.872	76%	0.763	S	S	*	*	S	Bend		-156.8	124.4	112.2	-79.1	132.2	0	0	0	107.1
133	D	39.8	Very low	47.6	Very low	128 Å²	128	138.5 Å²	138.5	68%	0.684	76%	0.763	S	S	*	*			trans	84.5	112.2	164.4	-137.6	-120.2	0	0	0	120	K135	D133-K135 VanDerWaalsContact C-N 3.28Å; D133-K135 PolarHBondContact O-N 3.22Å
134	D	51.2	Low	47.9	Very low	161 Å²	161	141.7 Å²	141.7	86%	0.861	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	47.1	-167.5	-143.7	-69	0	0	0	113.2
135	K	55.2	Low	47.5	Very low	180 Å²	180	138.1 Å²	138.1	78%	0.783	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.7	2.7	-177.4	-63.7	-175.4	-176	-175.6	0	116.9	D133	D133-K135 VanDerWaalsContact C-N 3.28Å; D133-K135 PolarHBondContact O-N 3.22Å
136	R	57.3	Low	47.6	Very low	236 Å²	236	137.9 Å²	137.9	89%	0.891	76%	0.756	S	S	*	*			trans	-132	84.5	178.3	-77.5	-179.5	172.1	176.7	-4.5	111.5	V138	R136-V138 PolarHBondContact O-N 2.89Å
137	Q	50.2	Low	47.7	Very low	179 Å²	179	135.6 Å²	135.6	84%	0.836	75%	0.751	S	S	*	*			trans	-80.2	107.2	167.9	-150.7	174.8	22.9	0	0	108.6	V139	Q137-V139 PolarHBondContact O-N 3.21Å; Q137-V139 VanDerWaalsContact O-N 3.15Å
138	V	52.2	Low	48.3	Very low	142 Å²	142	131.2 Å²	131.2	86%	0.861	73%	0.733	S	S	*	*			trans	-75.6	99.3	170.2	178.5	0	0	0	0	107.3	R136 S140	R136-V138 PolarHBondContact O-N 2.89Å; V138-S140 PolarHBondContact O-N 3.1Å
139	V	46.5	Very low	48.9	Very low	112 Å²	112	133.9 Å²	133.9	68%	0.679	74%	0.737	S	S	*	*			trans	-73.4	119.8	177.2	179.1	0	0	0	0	108.7	Q137 T141	Q137-V139 PolarHBondContact O-N 3.21Å; Q137-V139 VanDerWaalsContact O-N 3.15Å; V139-T141 PolarHBondContact O-N 2.96Å
140	S	49.9	Very low	49.4	Very low	87 Å²	87	138.7 Å²	138.7	61%	0.608	74%	0.736	S	S	*	*			trans	-59	121.2	171.5	57.7	0	0	0	0	110	V138 S142	V138-S140 PolarHBondContact O-N 3.1Å; S140-S142 PolarHBondContact O-N 2.77Å; S140-S142 PolarHBondContact OG-OG 3.3Å
141	T	52	Low	50.5	Low	142 Å²	142	137.2 Å²	137.2	87%	0.871	72%	0.721	S	S	*	*			trans	-69.7	65.2	176.1	50.6	0	0	0	0	111.7	V139	V139-T141 PolarHBondContact O-N 2.96Å
142	S	52.4	Low	51.1	Low	81 Å²	81	135.2 Å²	135.2	57%	0.566	72%	0.718	S	S	*	*			trans	-91.8	-1.5	179.8	-47.4	0	0	0	0	113.2	S140	S140-S142 PolarHBondContact O-N 2.77Å; S140-S142 PolarHBondContact OG-OG 3.3Å
143	Y	42	Very low	52.2	Low	207 Å²	207	129.2 Å²	129.2	81%	0.812	70%	0.698	S	S	*	*	S	Bend	trans	-138	119.5	175.1	-72.7	-81.9	0	0	0	111.7	T145	Y143-T145 PolarHBondContact O-N 3.12Å
144	N	53.3	Low	53.3	Low	160 Å²	160	127.5 Å²	127.5	86%	0.856	69%	0.689	S	S	*	*			trans	-79.2	88.4	173.2	-178.2	5.6	0	0	0	109.4
145	T	50	Low	53.6	Low	99 Å²	99	123.8 Å²	123.8	61%	0.607	67%	0.668	S	S	*	*			trans	-115.1	126.3	159.5	35.4	0	0	0	0	108.3	Y143 I147	Y143-T145 PolarHBondContact O-N 3.12Å; T145-I147 PolarHBondContact O-N 3.37Å
146	P	49.4	Very low	54	Low	97 Å²	97	121.4 Å²	121.4	63%	0.63	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-76.9	20	-167.3	32.8	-35.8	0	0	0	113.8
147	I	47.7	Very low	54.4	Low	142 Å²	142	115.7 Å²	115.7	73%	0.728	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-81.9	-23.7	-178.5	-153.6	75.5	0	0	0	112.3	T145 L149	T145-I147 PolarHBondContact O-N 3.37Å; I147-L149 VanDerWaalsContact C-N 3.29Å; I147-L149 PolarHBondContact O-N 3.42Å
148	G	58.1	Low	55.1	Low	42 Å²	42	110.1 Å²	110.1	43%	0.433	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-77.2	-6.6	-175.8	0	0	0	0	0	115.7
149	L	54.4	Low	55.5	Low	128 Å²	128	108.5 Å²	108.5	67%	0.67	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-82.2	-14.6	177.6	-77.9	163.7	0	0	0	113.2	I147	I147-L149 VanDerWaalsContact C-N 3.29Å; I147-L149 PolarHBondContact O-N 3.42Å
150	Y	49.7	Very low	56.4	Low	194 Å²	194	109 Å²	109	76%	0.761	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-119.3	30.7	-177.9	-59.8	-78.2	0	0	0	112.6
151	S	61.9	Low	57.1	Low	53 Å²	53	107.4 Å²	107.4	37%	0.371	61%	0.608	S	S	.	*			trans	-82.3	133.6	168	73.3	0	0	0	0	109.6	G153 N154 I155	S151-G153 PolarHBondContact O-N 2.92Å; S151-G153 VanDerWaalsContact O-N 3.08Å; S151-N154 PolarHBondContact O-N 3.23Å; S151-N154 PolarHBondContact OG-N 3.41Å; S151-I155 WeakPolarHBondContact O-CG1 3.39Å; S151-I155 PolarHBondContact O-N 3.4Å
152	S	58	Low	57.5	Low	99 Å²	99	107.9 Å²	107.9	69%	0.692	60%	0.6	S	S	*	*	H	α-helix	trans	-53.8	-29.9	177.9	51.1	0	0	0	0	112.4	Q156	S152-Q156 VanDerWaalsContact O-CB 3.32Å; S152-Q156 WeakPolarHBondContact O-CB 3.27Å; S152-Q156 PolarHBondContact O-N 3.34Å; S152-Q156 VanDerWaalsContact O-N 3.1Å
153	G	65.9	Low	57.5	Low	44 Å²	44	108.3 Å²	108.3	45%	0.454	60%	0.596	S	S	.	*	H	α-helix	trans	-67.4	-42.7	175.4	0	0	0	0	0	114.5	S151 Q156 D157	S151-G153 PolarHBondContact O-N 2.92Å; S151-G153 VanDerWaalsContact O-N 3.08Å; G153-Q156 PolarHBondContact O-N 3.05Å; G153-D157 WeakPolarHBondContact O-CB 3.18Å; G153-D157 PolarHBondContact O-N 3.18Å; G153-D157 VanDerWaalsContact O-N 3.08Å
154	N	61	Low	58.2	Low	93 Å²	93	108.7 Å²	108.7	50%	0.497	60%	0.596	S	S	.	*	H	α-helix	trans	-72.9	-34.6	179.4	-118.2	22.5	0	0	0	112	S151 Q156 D157 A158	S151-N154 PolarHBondContact O-N 3.23Å; S151-N154 PolarHBondContact OG-N 3.41Å; N154-Q156 VanDerWaalsContact C-N 3.34Å; N154-D157 PolarHBondContact O-N 2.88Å; N154-A158 WeakPolarHBondContact O-CB 3.36Å; N154-A158 PolarHBondContact O-N 3.45Å
155	I	58.9	Low	58.3	Low	83 Å²	83	104.3 Å²	104.3	43%	0.426	59%	0.589	S	S	.	*	H	α-helix	trans	-65.7	-41.8	176.8	-61.3	159.3	0	0	0	109.8	S151 M159	S151-I155 WeakPolarHBondContact O-CG1 3.39Å; S151-I155 PolarHBondContact O-N 3.4Å; I155-M159 VanDerWaalsContact O-CB 3.3Å; I155-M159 WeakPolarHBondContact O-CB 3.42Å; I155-M159 PolarHBondContact O-N 3.32Å
156	Q	63.7	Low	58.3	Low	130 Å²	130	107.1 Å²	107.1	61%	0.607	60%	0.599	S	S	*	*	H	α-helix	trans	-69.2	-38.7	178.8	-157.5	168	17	0	0	111.8	S152 G153 N154 M159 Q160	S152-Q156 VanDerWaalsContact O-CB 3.32Å; S152-Q156 WeakPolarHBondContact O-CB 3.27Å; S152-Q156 PolarHBondContact O-N 3.34Å; S152-Q156 VanDerWaalsContact O-N 3.1Å; G153-Q156 PolarHBondContact O-N 3.05Å; N154-Q156 VanDerWaalsContact C-N 3.34Å; Q156-M159 PolarHBondContact O-N 3.47Å; Q156-Q160 VanDerWaalsContact O-CB 3.27Å; Q156-Q160 WeakPolarHBondContact O-CB 3.44Å; Q156-Q160 PolarHBondContact O-N 3.06Å
157	D	64.8	Low	58	Low	115 Å²	115	107 Å²	107	62%	0.615	60%	0.597	S	S	*	*	H	α-helix	trans	-70.1	-38.3	178.2	-153.6	48.2	0	0	0	112.3	G153 N154 Q160 G161	G153-D157 WeakPolarHBondContact O-CB 3.18Å; G153-D157 PolarHBondContact O-N 3.18Å; G153-D157 VanDerWaalsContact O-N 3.08Å; N154-D157 PolarHBondContact O-N 2.88Å; D157-Q160 PolarHBondContact O-N 3.3Å; D157-G161 PolarHBondContact O-N 3.17Å
158	A	64.4	Low	58	Low	63 Å²	63	107.6 Å²	107.6	52%	0.521	60%	0.6	S	S	.	*	H	α-helix	trans	-65.2	-40.5	172.1	0	0	0	0	0	112.3	N154 G161 Q162	N154-A158 WeakPolarHBondContact O-CB 3.36Å; N154-A158 PolarHBondContact O-N 3.45Å; A158-G161 PolarHBondContact O-N 3.11Å; A158-Q162 PolarHBondContact O-N 3.39Å
159	M	61.9	Low	57.4	Low	107 Å²	107	111.3 Å²	111.3	53%	0.527	62%	0.617	S	S	.	*	H	α-helix	trans	-67.6	-42.8	176.3	-161.8	-164.1	-68.5	0	0	111.1	I155 Q156 G161 Q162 I163	I155-M159 VanDerWaalsContact O-CB 3.3Å; I155-M159 WeakPolarHBondContact O-CB 3.42Å; I155-M159 PolarHBondContact O-N 3.32Å; Q156-M159 PolarHBondContact O-N 3.47Å; M159-G161 VanDerWaalsContact C-N 3.32Å; M159-G161 PolarHBondContact O-N 3.34Å; M159-Q162 PolarHBondContact O-N 3.38Å; M159-I163 HydrophobicContact CG-CD1 3.81Å; M159-I163 WeakPolarHBondContact O-CD1 3.36Å; M159-I163 VanDerWaalsContact O-CG1 3.25Å; M159-I163 WeakPolarHBondContact O-CG1 3.33Å; M159-I163 PolarHBondContact O-N 3.11Å; M159-I163 VanDerWaalsContact O-N 3.09Å; M159-I163 HydrophobicContact SD-CD1 4.28Å
160	Q	64.3	Low	56.8	Low	123 Å²	123	113.5 Å²	113.5	58%	0.575	62%	0.621	S	S	*	*	H	α-helix	trans	-61.1	-40.8	176.3	-164.3	93.8	28.1	0	0	111.4	Q156 D157 Q162 I163 R164	Q156-Q160 VanDerWaalsContact O-CB 3.27Å; Q156-Q160 WeakPolarHBondContact O-CB 3.44Å; Q156-Q160 PolarHBondContact O-N 3.06Å; D157-Q160 PolarHBondContact O-N 3.3Å; Q160-Q162 PolarHBondContact O-N 3.43Å; Q160-I163 PolarHBondContact O-N 3.43Å; Q160-R164 WeakPolarHBondContact O-CB 3.41Å; Q160-R164 PolarHBondContact O-N 3.44Å; Q160-R164 VanDerWaalsContact O-N 3.12Å
161	G	64.4	Low	56.5	Low	54 Å²	54	109.6 Å²	109.6	56%	0.557	62%	0.619	S	S	*	*	H	α-helix	trans	-63.7	-37.2	177.7	0	0	0	0	0	113.7	D157 A158 M159	D157-G161 PolarHBondContact O-N 3.17Å; A158-G161 PolarHBondContact O-N 3.11Å; M159-G161 VanDerWaalsContact C-N 3.32Å; M159-G161 PolarHBondContact O-N 3.34Å
162	Q	60.8	Low	55.7	Low	151 Å²	151	116.3 Å²	116.3	71%	0.706	65%	0.645	S	S	*	*	H	α-helix	trans	-75.4	-35.3	177.5	-70.8	-175.9	-36.4	0	0	112.9	A158 M159 Q160	A158-Q162 PolarHBondContact O-N 3.39Å; M159-Q162 PolarHBondContact O-N 3.38Å; Q160-Q162 PolarHBondContact O-N 3.43Å
163	I	53	Low	55.3	Low	91 Å²	91	115.6 Å²	115.6	47%	0.467	64%	0.64	S	S	.	*	H	α-helix	trans	-76.6	-30.2	-177.8	-62.6	165.6	0	0	0	111.6	M159 Q160 G165 L166 V167	M159-I163 HydrophobicContact CG-CD1 3.81Å; M159-I163 WeakPolarHBondContact O-CD1 3.36Å; M159-I163 VanDerWaalsContact O-CG1 3.25Å; M159-I163 WeakPolarHBondContact O-CG1 3.33Å; M159-I163 PolarHBondContact O-N 3.11Å; M159-I163 VanDerWaalsContact O-N 3.09Å; M159-I163 HydrophobicContact SD-CD1 4.28Å; Q160-I163 PolarHBondContact O-N 3.43Å; I163-G165 PolarHBondContact O-N 3.33Å; I163-L166 PolarHBondContact O-N 3.23Å; I163-V167 HydrophobicContact CG2-CG2 4.02Å; I163-V167 PolarHBondContact O-N 3.33Å
164	R	56.9	Low	54.6	Low	214 Å²	214	119.8 Å²	119.8	81%	0.808	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-21.5	-178.1	-148.3	178.4	-168.5	164.3	3.1	114.1	Q160	Q160-R164 WeakPolarHBondContact O-CB 3.41Å; Q160-R164 PolarHBondContact O-N 3.44Å; Q160-R164 VanDerWaalsContact O-N 3.12Å
165	G	55.2	Low	54.5	Low	69 Å²	69	125.6 Å²	125.6	71%	0.711	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-10.1	177.2	0	0	0	0	0	115.1	I163	I163-G165 PolarHBondContact O-N 3.33Å
166	L	50.2	Low	54.5	Low	157 Å²	157	127.9 Å²	127.9	82%	0.822	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-4.9	-176	-66	174	0	0	0	113.6	I163	I163-L166 PolarHBondContact O-N 3.23Å
167	V	42.5	Very low	53.8	Low	96 Å²	96	126.8 Å²	126.8	58%	0.582	69%	0.69	S	S	*	*			trans	-109.4	99.3	177.7	-177.1	0	0	0	0	109.1	I163	I163-V167 HydrophobicContact CG2-CG2 4.02Å; I163-V167 PolarHBondContact O-N 3.33Å
168	L	48.8	Very low	53.6	Low	154 Å²	154	127.3 Å²	127.3	81%	0.806	70%	0.697	S	S	*	*			trans	-57.7	134	156.3	-125.2	79.9	0	0	0	107.3	K170	L168-K170 VanDerWaalsContact C-N 3.34Å; L168-K170 PolarHBondContact O-N 2.64Å
169	P	45.6	Very low	53.7	Low	120 Å²	120	126.7 Å²	126.7	78%	0.779	69%	0.689	S	S	*	*			trans	-64.9	101.5	169.3	27.4	-30.3	0	0	0	107.3
170	K	41.6	Very low	53.9	Low	173 Å²	173	127.3 Å²	127.3	75%	0.752	69%	0.693	S	S	*	*			trans	-65.6	131.4	172.3	-173	176.7	179.8	177.4	0	107.2	L168 E172	L168-K170 VanDerWaalsContact C-N 3.34Å; L168-K170 PolarHBondContact O-N 2.64Å; K170-E172 PolarHBondContact O-N 2.81Å
171	P	43.3	Very low	54	Low	112 Å²	112	128.2 Å²	128.2	73%	0.727	70%	0.697	S	S	*	*			trans	-61	130.3	172.2	25.4	-31.8	0	0	0	108.6	S173	P171-S173 PolarHBondContact O-N 3.49Å; P171-S173 VanDerWaalsContact O-N 3.09Å
172	E	45.1	Very low	53.8	Low	195 Å²	195	130.9 Å²	130.9	91%	0.911	70%	0.696	S	S	*	*			trans	-55.9	113.6	176.6	-64.6	-177.5	151.5	0	0	109.5	K170	K170-E172 PolarHBondContact O-N 2.81Å
173	S	49.5	Very low	54.4	Low	83 Å²	83	124.8 Å²	124.8	58%	0.58	67%	0.67	S	S	*	*			trans	-86.1	126.7	169.5	55.5	0	0	0	0	108.9	P171 R175	P171-S173 PolarHBondContact O-N 3.49Å; P171-S173 VanDerWaalsContact O-N 3.09Å; S173-R175 PolarHBondContact O-N 2.96Å
174	P	51.5	Low	55.1	Low	133 Å²	133	125.7 Å²	125.7	86%	0.864	68%	0.675	S	S	*	*			trans	-84.5	37.8	-169.1	34.3	-36.3	0	0	0	113.8
175	R	58	Low	55.9	Low	214 Å²	214	120.1 Å²	120.1	81%	0.808	67%	0.665	S	S	*	*			trans	-125.4	106.4	-177.5	-69.5	-173.4	175.1	171.4	-1.9	111.5	S173 L177	S173-R175 PolarHBondContact O-N 2.96Å; R175-L177 PolarHBondContact O-N 3Å
176	T	58.5	Low	56.6	Low	132 Å²	132	121.1 Å²	121.1	81%	0.81	65%	0.648	S	S	*	*			trans	-71.6	115	164.2	49.7	0	0	0	0	108.2	T178	T176-T178 PolarHBondContact O-N 3.05Å
177	L	50	Low	57.7	Low	107 Å²	107	119.2 Å²	119.2	56%	0.56	63%	0.63	S	S	*	*			trans	-67.3	128.1	179.6	-62	172.7	0	0	0	109.8	R175 E182	R175-L177 PolarHBondContact O-N 3Å; L177-E182 HydrophobicContact CD2-CB 4.11Å
178	T	59.9	Low	58.9	Low	126 Å²	126	120.4 Å²	120.4	77%	0.773	63%	0.63	S	S	*	*	S	Bend	trans	-95.7	-17.6	-177.9	40.9	0	0	0	0	113.5	T176 E182	T176-T178 PolarHBondContact O-N 3.05Å; T178-E182 PolarHBondContact N-OE2 2.99Å; T178-E182 PolarHBondContact OG1-OE2 3.03Å; T178-E182 VanDerWaalsContact OG1-OE2 3.1Å
179	S	67.4	Low	60.1	Low	49 Å²	49	118.2 Å²	118.2	34%	0.343	62%	0.619	S	S	.	*	S	Bend	trans	-138	147.7	173.8	-177.6	0	0	0	0	111.1	E181 E182	S179-E181 PolarHBondContact O-N 3.33Å; S179-E182 PolarHBondContact N-OE2 3.12Å; S179-E182 PolarHBondContact O-N 3.02Å; S179-E182 VanDerWaalsContact O-N 3.14Å
180	I	64.9	Low	61	Low	120 Å²	120	116.6 Å²	116.6	62%	0.615	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-59	-28.1	177.2	-168.8	67.8	0	0	0	112.1	E182 S183 Y186	I180-E182 VanDerWaalsContact C-N 3.29Å; I180-E182 PolarHBondContact O-N 3.46Å; I180-S183 WeakPolarHBondContact O-CB 3.38Å; I180-S183 PolarHBondContact O-N 3.32Å; I180-Y186 HydrophobicContact CG1-CD2 4.33Å; I180-Y186 WeakPolarHBondContact O-CB 3.07Å
181	E	65.9	Low	61.9	Low	142 Å²	142	115.6 Å²	115.6	66%	0.664	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-70.8	-22.1	179.8	-67.9	171.2	139.3	0	0	113.3	S179 S183 Y186	S179-E181 PolarHBondContact O-N 3.33Å; E181-S183 VanDerWaalsContact C-N 3.26Å; E181-Y186 HydrophobicContact CG-CE1 4.32Å
182	E	61.5	Low	62.6	Low	111 Å²	111	115 Å²	115	52%	0.519	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-84	-5.6	177.1	-61	178.1	140.3	0	0	112.2	L177 T178 S179 I180 D184	L177-E182 HydrophobicContact CD2-CB 4.11Å; T178-E182 PolarHBondContact N-OE2 2.99Å; T178-E182 PolarHBondContact OG1-OE2 3.03Å; T178-E182 VanDerWaalsContact OG1-OE2 3.1Å; S179-E182 PolarHBondContact N-OE2 3.12Å; S179-E182 PolarHBondContact O-N 3.02Å; S179-E182 VanDerWaalsContact O-N 3.14Å; I180-E182 VanDerWaalsContact C-N 3.29Å; I180-E182 PolarHBondContact O-N 3.46Å; E182-D184 PolarHBondContact O-N 3.08Å
183	S	73.2	Confident	63.3	Low	23 Å²	23	113.6 Å²	113.6	16%	0.161	58%	0.577	C	S	.	*			trans	-71.5	122.6	179.5	-177.2	0	0	0	0	111.2	I180 E181 V185 Y186 R187	I180-S183 WeakPolarHBondContact O-CB 3.38Å; I180-S183 PolarHBondContact O-N 3.32Å; E181-S183 VanDerWaalsContact C-N 3.26Å; S183-V185 PolarHBondContact O-N 3.28Å; S183-V185 VanDerWaalsContact O-N 3.08Å; S183-V185 PolarHBondContact OG-N 2.91Å; S183-Y186 PolarHBondContact O-N 3.04Å; S183-R187 PolarHBondContact O-N 3.39Å; S183-R187 VanDerWaalsContact O-N 3.1Å
184	D	67.8	Low	63.5	Low	109 Å²	109	116.4 Å²	116.4	58%	0.583	59%	0.585	S	S	*	*	H	α-helix	trans	-54	-28.7	172.6	-78.8	-40.7	0	0	0	112.9	E182 R187 M188	E182-D184 PolarHBondContact O-N 3.08Å; D184-R187 IonicContact OD1-CZ 3.52Å; D184-R187 IonicContact OD1-NE 3.96Å; D184-R187 IonicContact OD1-NH2 2.62Å; D184-R187 PolarHBondContact OD1-NH2 3.42Å; D184-M188 WeakPolarHBondContact O-CB 3.39Å; D184-M188 PolarHBondContact O-N 2.9Å
185	V	72.7	Confident	63.7	Low	98 Å²	98	116.3 Å²	116.3	59%	0.594	58%	0.577	S	S	*	*	H	α-helix	trans	-72.9	-43.3	176.6	-178.8	0	0	0	0	111.3	S183 R187 M188 L189	S183-V185 PolarHBondContact O-N 3.28Å; S183-V185 VanDerWaalsContact O-N 3.08Å; S183-V185 PolarHBondContact OG-N 2.91Å; V185-R187 VanDerWaalsContact C-N 3.35Å; V185-R187 PolarHBondContact O-N 3.29Å; V185-M188 PolarHBondContact O-N 3.42Å; V185-L189 HydrophobicContact CG1-CD1 4.47Å; V185-L189 PolarHBondContact O-N 3.22Å; V185-L189 VanDerWaalsContact O-N 3.15Å
186	Y	70.5	Confident	63.7	Low	89 Å²	89	111.6 Å²	111.6	35%	0.349	58%	0.575	S	S	.	*	H	α-helix	trans	-65	-41.3	179.5	-171.6	-103.9	0	0	0	111.3	I180 E181 S183 M188 L189 Q190	I180-Y186 HydrophobicContact CG1-CD2 4.33Å; I180-Y186 WeakPolarHBondContact O-CB 3.07Å; E181-Y186 HydrophobicContact CG-CE1 4.32Å; S183-Y186 PolarHBondContact O-N 3.04Å; Y186-M188 VanDerWaalsContact C-N 3.3Å; Y186-M188 PolarHBondContact O-N 3.23Å; Y186-L189 PolarHBondContact O-N 3.21Å; Y186-Q190 VanDerWaalsContact CE1-CD 3.45Å; Y186-Q190 HydrophobicContact CE1-CG 4.42Å; Y186-Q190 PolarHBondContact O-N 2.93Å; Y186-Q190 VanDerWaalsContact O-N 3.14Å
187	R	74.1	Confident	63.5	Low	118 Å²	118	111.3 Å²	111.3	45%	0.445	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-30	174.6	-170.5	173.2	59.5	177	-0.9	113.4	S183 D184 V185 R191	S183-R187 PolarHBondContact O-N 3.39Å; S183-R187 VanDerWaalsContact O-N 3.1Å; D184-R187 IonicContact OD1-CZ 3.52Å; D184-R187 IonicContact OD1-NE 3.96Å; D184-R187 IonicContact OD1-NH2 2.62Å; D184-R187 PolarHBondContact OD1-NH2 3.42Å; V185-R187 VanDerWaalsContact C-N 3.35Å; V185-R187 PolarHBondContact O-N 3.29Å; R187-R191 WeakPolarHBondContact O-CG 3.24Å; R187-R191 PolarHBondContact O-N 3.48Å
188	M	67.3	Low	63.9	Low	120 Å²	120	114 Å²	114	59%	0.591	57%	0.574	S	S	*	*	H	α-helix	trans	-71.9	-40.7	176.3	-170.6	177.9	156.2	0	0	111.4	D184 V185 Y186 R191 D192	D184-M188 WeakPolarHBondContact O-CB 3.39Å; D184-M188 PolarHBondContact O-N 2.9Å; V185-M188 PolarHBondContact O-N 3.42Å; Y186-M188 VanDerWaalsContact C-N 3.3Å; Y186-M188 PolarHBondContact O-N 3.23Å; M188-R191 PolarHBondContact O-N 3.05Å; M188-D192 PolarHBondContact O-N 3.09Å
189	L	74	Confident	63.8	Low	108 Å²	108	113.7 Å²	113.7	57%	0.565	57%	0.574	S	S	*	*	H	α-helix	trans	-69.1	-31.3	178	-70	169.9	0	0	0	113.7	V185 Y186	V185-L189 HydrophobicContact CG1-CD1 4.47Å; V185-L189 PolarHBondContact O-N 3.22Å; V185-L189 VanDerWaalsContact O-N 3.15Å; Y186-L189 PolarHBondContact O-N 3.21Å
190	Q	64	Low	63.5	Low	87 Å²	87	120.9 Å²	120.9	41%	0.407	59%	0.593	S	S	.	*	H	α-helix	trans	-71.8	-37	173.8	-77.7	174.4	-37.6	0	0	112.1	Y186 D192 Q193	Y186-Q190 VanDerWaalsContact CE1-CD 3.45Å; Y186-Q190 HydrophobicContact CE1-CG 4.42Å; Y186-Q190 PolarHBondContact O-N 2.93Å; Y186-Q190 VanDerWaalsContact O-N 3.14Å; Q190-D192 VanDerWaalsContact C-N 3.29Å; Q190-D192 PolarHBondContact O-N 2.92Å; Q190-Q193 PolarHBondContact O-N 3.14Å; Q190-Q193 VanDerWaalsContact O-N 3.08Å
191	R	60.5	Low	63.4	Low	152 Å²	152	119.3 Å²	119.3	57%	0.574	58%	0.583	S	S	*	*	H	α-helix	trans	-64.2	-30.3	177	-76.9	-175.6	-166.9	121.8	-3.1	113.9	R187 M188 Q193	R187-R191 WeakPolarHBondContact O-CG 3.24Å; R187-R191 PolarHBondContact O-N 3.48Å; M188-R191 PolarHBondContact O-N 3.05Å; R191-Q193 PolarHBondContact O-N 3.32Å
192	D	59.3	Low	63.3	Low	99 Å²	99	115.9 Å²	115.9	53%	0.529	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-11.6	175.7	-77.7	-41.9	0	0	0	113.1	M188 Q190	M188-D192 PolarHBondContact O-N 3.09Å; Q190-D192 VanDerWaalsContact C-N 3.29Å; Q190-D192 PolarHBondContact O-N 2.92Å
193	Q	59.2	Low	63.6	Low	166 Å²	166	113.6 Å²	113.6	78%	0.776	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-24.9	180	-103.1	-178.3	93.7	0	0	114.4	Q190 R191	Q190-Q193 PolarHBondContact O-N 3.14Å; Q190-Q193 VanDerWaalsContact O-N 3.08Å; R191-Q193 PolarHBondContact O-N 3.32Å
194	D	54.1	Low	63.3	Low	142 Å²	142	116.1 Å²	116.1	76%	0.759	60%	0.599	S	S	*	*	S	Bend	trans	-98.7	-4.4	-169.6	-81.6	-63.3	0	0	0	115.2
195	D	55.8	Low	63.5	Low	130 Å²	130	115.9 Å²	115.9	70%	0.695	59%	0.593	S	S	*	*	S	Bend	trans	-120.4	125.4	-179	-127.9	-69.7	0	0	0	111.5	Q197	D195-Q197 PolarHBondContact O-N 3.21Å
196	P	56.4	Low	63.5	Low	116 Å²	116	118.1 Å²	118.1	75%	0.753	59%	0.594	S	S	*	*			trans	-60.7	100.2	171.9	-18.1	29.8	0	0	0	109.9	E198	P196-E198 PolarHBondContact O-N 3.08Å
197	Q	55.1	Low	63.3	Low	125 Å²	125	116.4 Å²	116.4	58%	0.584	60%	0.599	S	S	*	*			trans	-68.8	100.8	179.1	-170.4	174.8	-105.8	0	0	109.8	D195 R200	D195-Q197 PolarHBondContact O-N 3.21Å; Q197-R200 HydrophobicContact CG-CG 4.43Å; Q197-R200 VanDerWaalsContact OE1-CZ 3.3Å
198	E	57.4	Low	63	Low	164 Å²	164	114.6 Å²	114.6	77%	0.766	60%	0.597	S	S	*	*			trans	-53.8	143.7	166.2	-69.7	-169.6	153.8	0	0	109.8	P196 R200	P196-E198 PolarHBondContact O-N 3.08Å; E198-R200 PolarHBondContact O-N 3.21Å
199	P	59.7	Low	63.2	Low	119 Å²	119	113.2 Å²	113.2	77%	0.773	59%	0.59	S	S	*	*			trans	-54.7	117.8	-174.8	20.1	-31.2	0	0	0	110	Q201	P199-Q201 PolarHBondContact O-N 3.06Å
200	R	61.2	Low	62.9	Low	201 Å²	201	113.5 Å²	113.5	76%	0.758	59%	0.588	S	S	*	*			trans	-66.8	80.1	178.9	-68	-167.2	-168.6	-141.4	4.7	110	Q197 E198	Q197-R200 HydrophobicContact CG-CG 4.43Å; Q197-R200 VanDerWaalsContact OE1-CZ 3.3Å; E198-R200 PolarHBondContact O-N 3.21Å
201	Q	61	Low	63.1	Low	86 Å²	86	112.5 Å²	112.5	40%	0.402	58%	0.583	S	S	.	*			trans	-85	138.9	179.6	-174.3	173.2	66.2	0	0	109.5	P199 G203 F205	P199-Q201 PolarHBondContact O-N 3.06Å; Q201-G203 PolarHBondContact O-N 3.34Å; Q201-F205 HydrophobicContact CG-CB 3.64Å; Q201-F205 HydrophobicContact CG-CD1 3.99Å; Q201-F205 HydrophobicContact CG-CG 3.94Å
202	S	64.2	Low	63.6	Low	71 Å²	71	111.2 Å²	111.2	50%	0.497	59%	0.586	S	S	.	*			trans	-54.9	137.9	177.9	63	0	0	0	0	110.3	S204 F205 K206	S202-S204 PolarHBondContact O-N 3.13Å; S202-S204 PolarHBondContact OG-OG 2.81Å; S202-F205 PolarHBondContact O-N 2.97Å; S202-K206 PolarHBondContact O-N 3.44Å
203	G	68.5	Low	64.2	Low	62 Å²	62	112.5 Å²	112.5	64%	0.639	59%	0.592	S	S	*	*	H	α-helix	trans	-55	-25.2	-176.8	0	0	0	0	0	113.9	Q201 A207	Q201-G203 PolarHBondContact O-N 3.34Å; G203-A207 PolarHBondContact O-N 2.83Å; G203-A207 VanDerWaalsContact O-N 3.13Å
204	S	67.3	Low	64.3	Low	77 Å²	77	105.8 Å²	105.8	54%	0.538	56%	0.564	S	S	.	*	H	α-helix	trans	-63	-36.7	171.6	36.8	0	0	0	0	114.2	S202 L208	S202-S204 PolarHBondContact O-N 3.13Å; S202-S204 PolarHBondContact OG-OG 2.81Å; S204-L208 WeakPolarHBondContact O-CG 3.46Å; S204-L208 PolarHBondContact O-N 3.45Å
205	F	70.8	Confident	64.5	Low	103 Å²	103	106.4 Å²	106.4	45%	0.452	57%	0.567	S	S	.	*	H	α-helix	trans	-82	-34.8	179.6	-165.9	-64.7	0	0	0	111	Q201 S202 A207 L208 Q209	Q201-F205 HydrophobicContact CG-CB 3.64Å; Q201-F205 HydrophobicContact CG-CD1 3.99Å; Q201-F205 HydrophobicContact CG-CG 3.94Å; S202-F205 PolarHBondContact O-N 2.97Å; F205-A207 PolarHBondContact O-N 3.26Å; F205-L208 PolarHBondContact O-N 3.4Å; F205-Q209 PolarHBondContact O-N 2.87Å
206	K	72.6	Confident	64.7	Low	145 Å²	145	102.1 Å²	102.1	63%	0.63	55%	0.554	S	S	*	*	H	α-helix	trans	-57.2	-40.2	170.3	-168.7	170.5	-176.5	169.3	0	111.6	S202 L208 Q209 E210	S202-K206 PolarHBondContact O-N 3.44Å; K206-L208 VanDerWaalsContact C-N 3.34Å; K206-L208 PolarHBondContact O-N 2.86Å; K206-Q209 PolarHBondContact O-N 3.3Å; K206-E210 WeakPolarHBondContact O-CB 3.49Å; K206-E210 PolarHBondContact O-N 2.88Å
207	A	66.8	Low	64.8	Low	53 Å²	53	102.6 Å²	102.6	44%	0.438	56%	0.555	S	S	.	*	H	α-helix	trans	-67.1	-29.1	175	0	0	0	0	0	114.1	G203 F205 F211	G203-A207 PolarHBondContact O-N 2.83Å; G203-A207 VanDerWaalsContact O-N 3.13Å; F205-A207 PolarHBondContact O-N 3.26Å; A207-F211 PolarHBondContact O-N 3.12Å
208	L	68.9	Low	64.9	Low	80 Å²	80	104 Å²	104	42%	0.419	56%	0.555	S	S	.	*	H	α-helix	trans	-77.2	-38.5	174.5	-70.6	171.4	0	0	0	111.8	S204 F205 K206 F211 I212	S204-L208 WeakPolarHBondContact O-CG 3.46Å; S204-L208 PolarHBondContact O-N 3.45Å; F205-L208 PolarHBondContact O-N 3.4Å; K206-L208 VanDerWaalsContact C-N 3.34Å; K206-L208 PolarHBondContact O-N 2.86Å; L208-F211 WeakPolarHBondContact O-CB 3.34Å; L208-F211 PolarHBondContact O-N 2.8Å; L208-I212 WeakPolarHBondContact O-CG1 3.28Å; L208-I212 PolarHBondContact O-N 3.11Å; L208-I212 VanDerWaalsContact O-N 3.11Å
209	Q	71.4	Confident	64.8	Low	91 Å²	91	101.7 Å²	101.7	43%	0.425	55%	0.554	S	S	.	*	H	α-helix	trans	-65.5	-43.3	177.4	-169.9	157.1	-7.9	0	0	111.2	F205 K206 F211 I212 D213	F205-Q209 PolarHBondContact O-N 2.87Å; K206-Q209 PolarHBondContact O-N 3.3Å; Q209-F211 PolarHBondContact O-N 3.44Å; Q209-I212 PolarHBondContact O-N 3.24Å; Q209-I212 VanDerWaalsContact O-N 3.17Å; Q209-D213 PolarHBondContact O-N 2.82Å
210	E	67.6	Low	64.6	Low	115 Å²	115	99.9 Å²	99.9	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-63.9	-27.6	175.5	-164.9	177.6	-179.7	0	0	113.4	K206 S214	K206-E210 WeakPolarHBondContact O-CB 3.49Å; K206-E210 PolarHBondContact O-N 2.88Å; E210-S214 VanDerWaalsContact O-CB 3.26Å; E210-S214 WeakPolarHBondContact O-CB 3.36Å; E210-S214 PolarHBondContact O-N 2.97Å; E210-S214 PolarHBondContact O-OG 3.22Å
211	F	67.8	Low	64.5	Low	66 Å²	66	96.8 Å²	96.8	29%	0.289	54%	0.54	S	S	.	.	H	α-helix	trans	-73.5	-40.6	173.8	177.2	-97.2	0	0	0	112.4	A207 L208 Q209 S214 G216 R218 I220	A207-F211 PolarHBondContact O-N 3.12Å; L208-F211 WeakPolarHBondContact O-CB 3.34Å; L208-F211 PolarHBondContact O-N 2.8Å; Q209-F211 PolarHBondContact O-N 3.44Å; F211-S214 PolarHBondContact O-N 3.08Å; F211-G216 PolarHBondContact O-N 2.72Å; F211-R218 WeakPolarHBondContact CD2-O 3.27Å; F211-R218 VanDerWaalsContact CE2-O 3.24Å; F211-R218 WeakPolarHBondContact CE2-O 3.03Å; F211-I220 HydrophobicContact CB-CG1 4.46Å; F211-I220 HydrophobicContact CD1-CD1 3.84Å; F211-I220 HydrophobicContact CD1-CG1 4.36Å; F211-I220 HydrophobicContact CD2-CD1 4Å; F211-I220 HydrophobicContact CD2-CG1 3.67Å; F211-I220 HydrophobicContact CE1-CD1 3.85Å; F211-I220 HydrophobicContact CE2-CD1 4.01Å; F211-I220 HydrophobicContact CE2-CG1 3.91Å; F211-I220 HydrophobicContact CG-CD1 3.91Å; F211-I220 HydrophobicContact CG-CG1 3.9Å; F211-I220 HydrophobicContact CZ-CD1 3.93Å; F211-I220 HydrophobicContact CZ-CG1 4.35Å
212	I	70.8	Confident	64.2	Low	125 Å²	125	96.8 Å²	96.8	64%	0.641	55%	0.546	S	S	*	.	H	α-helix	trans	-67.6	-42	176.5	-66.8	166.8	0	0	0	110.1	L208 Q209 S214 D215	L208-I212 WeakPolarHBondContact O-CG1 3.28Å; L208-I212 PolarHBondContact O-N 3.11Å; L208-I212 VanDerWaalsContact O-N 3.11Å; Q209-I212 PolarHBondContact O-N 3.24Å; Q209-I212 VanDerWaalsContact O-N 3.17Å; I212-S214 VanDerWaalsContact C-N 3.25Å; I212-S214 PolarHBondContact O-N 3Å; I212-D215 PolarHBondContact O-N 3.2Å
213	D	71	Confident	64	Low	125 Å²	125	104.5 Å²	104.5	67%	0.668	56%	0.564	S	S	*	*	H	α-helix	trans	-71.3	-18.3	179.4	-67.1	-22.3	0	0	0	113.2	Q209	Q209-D213 PolarHBondContact O-N 2.82Å
214	S	62.1	Low	63.6	Low	26 Å²	26	108.1 Å²	108.1	18%	0.182	57%	0.574	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.6	14.4	178.9	-63.4	0	0	0	0	114.5	E210 F211 I212 G216 T217 R218	E210-S214 VanDerWaalsContact O-CB 3.26Å; E210-S214 WeakPolarHBondContact O-CB 3.36Å; E210-S214 PolarHBondContact O-N 2.97Å; E210-S214 PolarHBondContact O-OG 3.22Å; F211-S214 PolarHBondContact O-N 3.08Å; I212-S214 VanDerWaalsContact C-N 3.25Å; I212-S214 PolarHBondContact O-N 3Å; S214-G216 PolarHBondContact O-N 3.01Å; S214-G216 VanDerWaalsContact O-N 3.11Å; S214-T217 PolarHBondContact O-OG1 3.34Å; S214-R218 PolarHBondContact OG-NE 2.89Å; S214-R218 PolarHBondContact OG-NH2 3.5Å
215	D	57.9	Low	62.8	Low	155 Å²	155	111 Å²	111	83%	0.829	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.5	28.4	173.9	-131.3	5.2	0	0	0	115	I212 T217	I212-D215 PolarHBondContact O-N 3.2Å; D215-T217 PolarHBondContact O-N 3.41Å
216	G	59.8	Low	62.4	Low	40 Å²	40	114.9 Å²	114.9	41%	0.412	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	79.5	5.3	169.4	0	0	0	0	0	117.4	F211 S214 R218	F211-G216 PolarHBondContact O-N 2.72Å; S214-G216 PolarHBondContact O-N 3.01Å; S214-G216 VanDerWaalsContact O-N 3.11Å; G216-R218 VanDerWaalsContact C-N 3.3Å; G216-R218 PolarHBondContact O-N 2.83Å
217	T	58.8	Low	61	Low	125 Å²	125	111.6 Å²	111.6	77%	0.767	61%	0.605	S	S	*	*			trans	-81.2	-0.5	-174.3	-15.7	0	0	0	0	114.9	S214 D215	S214-T217 PolarHBondContact O-OG1 3.34Å; D215-T217 PolarHBondContact O-N 3.41Å
218	R	58.3	Low	60.1	Low	154 Å²	154	115 Å²	115	58%	0.581	62%	0.623	S	S	*	*	S	Bend	trans	-115.5	135.9	-177.7	-47.1	-176.2	-163.3	-133.1	3.7	110.5	F211 S214 G216 I220	F211-R218 WeakPolarHBondContact CD2-O 3.27Å; F211-R218 VanDerWaalsContact CE2-O 3.24Å; F211-R218 WeakPolarHBondContact CE2-O 3.03Å; S214-R218 PolarHBondContact OG-NE 2.89Å; S214-R218 PolarHBondContact OG-NH2 3.5Å; G216-R218 VanDerWaalsContact C-N 3.3Å; G216-R218 PolarHBondContact O-N 2.83Å; R218-I220 PolarHBondContact O-N 3.15Å
219	P	53.4	Low	59.1	Low	116 Å²	116	116.4 Å²	116.4	75%	0.753	63%	0.634	S	S	*	*			trans	-66.7	126.8	179.7	26.9	-32.8	0	0	0	110.8	V221	P219-V221 PolarHBondContact O-N 3.43Å; P219-V221 VanDerWaalsContact O-N 3.08Å
220	I	56.8	Low	58.2	Low	82 Å²	82	118.7 Å²	118.7	42%	0.421	66%	0.655	S	S	.	*			trans	-58.4	110.7	170.6	-90.5	169.5	0	0	0	108.8	F211 R218 T222	F211-I220 HydrophobicContact CB-CG1 4.46Å; F211-I220 HydrophobicContact CD1-CD1 3.84Å; F211-I220 HydrophobicContact CD1-CG1 4.36Å; F211-I220 HydrophobicContact CD2-CD1 4Å; F211-I220 HydrophobicContact CD2-CG1 3.67Å; F211-I220 HydrophobicContact CE1-CD1 3.85Å; F211-I220 HydrophobicContact CE2-CD1 4.01Å; F211-I220 HydrophobicContact CE2-CG1 3.91Å; F211-I220 HydrophobicContact CG-CD1 3.91Å; F211-I220 HydrophobicContact CG-CG1 3.9Å; F211-I220 HydrophobicContact CZ-CD1 3.93Å; F211-I220 HydrophobicContact CZ-CG1 4.35Å; R218-I220 PolarHBondContact O-N 3.15Å; I220-T222 HydrophobicContact CG2-CG2 3.74Å; I220-T222 WeakPolarHBondContact CG2-OG1 3.4Å; I220-T222 PolarHBondContact O-N 3.06Å; I220-T222 VanDerWaalsContact O-N 3.12Å
221	V	59.1	Low	57.4	Low	136 Å²	136	121.5 Å²	121.5	82%	0.824	67%	0.665	S	S	*	*			trans	-86.5	58.5	171.4	-169.9	0	0	0	0	108.7	P219	P219-V221 PolarHBondContact O-N 3.43Å; P219-V221 VanDerWaalsContact O-N 3.08Å
222	T	53.9	Low	56.5	Low	86 Å²	86	124.3 Å²	124.3	53%	0.528	69%	0.69	S	S	.	*			trans	-91.2	115.9	163	54.8	0	0	0	0	107.6	I220 T224	I220-T222 HydrophobicContact CG2-CG2 3.74Å; I220-T222 WeakPolarHBondContact CG2-OG1 3.4Å; I220-T222 PolarHBondContact O-N 3.06Å; I220-T222 VanDerWaalsContact O-N 3.12Å; T222-T224 PolarHBondContact O-N 3.08Å
223	R	60.5	Low	55.2	Low	232 Å²	232	124.5 Å²	124.5	88%	0.875	70%	0.697	S	S	*	*			trans	-64.2	110.7	169.1	-69.9	-179.7	83.4	-177.9	6.4	106.8	V225	R223-V225 PolarHBondContact O-N 3.22Å
224	T	60.4	Low	54.3	Low	138 Å²	138	122 Å²	122	85%	0.847	69%	0.694	S	S	*	*			trans	-65	107.8	174.6	43.6	0	0	0	0	108.9	T222 K226	T222-T224 PolarHBondContact O-N 3.08Å; T224-K226 PolarHBondContact O-N 3.21Å
225	V	50.8	Low	53.7	Low	137 Å²	137	126.5 Å²	126.5	83%	0.83	72%	0.723	S	S	*	*			trans	-81.9	108.2	170.9	-176	0	0	0	0	107.2	R223	R223-V225 PolarHBondContact O-N 3.22Å
226	K	61	Low	53.3	Low	186 Å²	186	124.6 Å²	124.6	81%	0.809	72%	0.721	S	S	*	*			trans	-73.6	124.8	173.9	-156	170.2	-173.7	175.3	0	108.2	T224	T224-K226 PolarHBondContact O-N 3.21Å
227	A	43.4	Very low	52.6	Low	75 Å²	75	125.4 Å²	125.4	62%	0.62	73%	0.73	S	S	*	*			trans	-56.3	143.1	176.6	0	0	0	0	0	110.4	T229	A227-T229 PolarHBondContact O-N 3.49Å
228	P	48.5	Very low	52.1	Low	126 Å²	126	126.4 Å²	126.4	82%	0.818	73%	0.731	S	S	*	*			trans	-59.6	104.7	176.2	-18.6	30	0	0	0	109.2	T230	P228-T230 PolarHBondContact O-N 3.01Å
229	T	47.4	Very low	51.8	Low	108 Å²	108	126.2 Å²	126.2	66%	0.663	74%	0.74	S	S	*	*			trans	-72.7	112.8	177	51.8	0	0	0	0	108.2	A227 K231	A227-T229 PolarHBondContact O-N 3.49Å; T229-K231 PolarHBondContact O-N 3.39Å; T229-K231 VanDerWaalsContact O-N 3.1Å
230	T	52.4	Low	51.9	Low	140 Å²	140	129.2 Å²	129.2	86%	0.859	74%	0.744	S	S	*	*			trans	-75.7	20.4	172.8	50.6	0	0	0	0	113.4	P228 P232	P228-T230 PolarHBondContact O-N 3.01Å; T230-P232 WeakPolarHBondContact O-CD 3.49Å
231	K	51.8	Low	52.2	Low	173 Å²	173	135 Å²	135	75%	0.752	77%	0.766	S	S	*	*			trans	-92.3	114.7	172.4	-71.8	-175.8	177.8	-178.6	0	108.8	T229 T233	T229-K231 PolarHBondContact O-N 3.39Å; T229-K231 VanDerWaalsContact O-N 3.1Å; K231-T233 PolarHBondContact O-N 3.5Å; K231-T233 VanDerWaalsContact O-N 3.14Å
232	P	47.8	Very low	52.6	Low	126 Å²	126	132.5 Å²	132.5	82%	0.818	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-62.3	116.7	162.7	25.4	-29.3	0	0	0	107.4	T230 A234	T230-P232 WeakPolarHBondContact O-CD 3.49Å; P232-A234 PolarHBondContact O-N 3Å
233	T	44.4	Very low	53.7	Low	129 Å²	129	130.5 Å²	130.5	79%	0.791	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-59	121.7	169.9	-52.9	0	0	0	0	107.5	K231	K231-T233 PolarHBondContact O-N 3.5Å; K231-T233 VanDerWaalsContact O-N 3.14Å
234	A	50.8	Low	54.9	Low	72 Å²	72	123.3 Å²	123.3	60%	0.595	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-55.2	144.6	171	0	0	0	0	0	109.4	P232 S236	P232-A234 PolarHBondContact O-N 3Å; A234-S236 VanDerWaalsContact C-N 3.29Å; A234-S236 PolarHBondContact O-N 3.23Å
235	P	50.7	Low	56.1	Low	121 Å²	121	116.8 Å²	116.8	79%	0.786	68%	0.678	S	S	*	*			trans	-69.2	93	176.8	29	-32.1	0	0	0	108.1	G237	P235-G237 PolarHBondContact O-N 3.29Å
236	S	48.3	Very low	57.6	Low	114 Å²	114	114 Å²	114	80%	0.797	66%	0.658	S	S	*	*			trans	-57.8	113.7	165.8	-62.7	0	0	0	0	107.3	A234 N238	A234-S236 VanDerWaalsContact C-N 3.29Å; A234-S236 PolarHBondContact O-N 3.23Å; S236-N238 PolarHBondContact O-N 3.46Å
237	G	46.7	Very low	58.4	Low	57 Å²	57	110.2 Å²	110.2	59%	0.588	64%	0.642	S	S	*	*	S	Bend	trans	-53	126.8	-175.2	0	0	0	0	0	112.7	P235	P235-G237 PolarHBondContact O-N 3.29Å
238	N	48.7	Very low	60.2	Low	147 Å²	147	109.1 Å²	109.1	79%	0.786	63%	0.629	S	S	*	*			trans	-154.2	71.2	131.4	-98.4	-62.5	0	0	0	106.7	S236 Q240	S236-N238 PolarHBondContact O-N 3.46Å; N238-Q240 PolarHBondContact O-N 3.24Å
239	L	50.7	Low	61.6	Low	150 Å²	150	105.6 Å²	105.6	79%	0.785	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	17	-176.1	-121.4	125.7	0	0	0	113.5
240	Q	55.9	Low	63.1	Low	178 Å²	178	105.6 Å²	105.6	83%	0.832	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	1.5	-170	-71.3	-169.1	-14.9	0	0	115.4	N238	N238-Q240 PolarHBondContact O-N 3.24Å
241	K	63	Low	64.6	Low	203 Å²	203	100.6 Å²	100.6	88%	0.883	59%	0.588	S	S	*	*			trans	-163.1	53.2	171.7	-116.2	168.4	-167.1	-170.4	0	114.1
242	L	68.1	Low	66	Low	85 Å²	85	92.6 Å²	92.6	45%	0.445	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-75.6	128.4	166.1	-75.8	163.4	0	0	0	108.9	V244	L242-V244 PolarHBondContact O-N 3.2Å
243	P	77.4	Confident	67.4	Low	43 Å²	43	92.5 Å²	92.5	28%	0.279	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-60.9	122.9	177.3	21.8	-28.8	0	0	0	109.5	I252 Y263	P243-I252 WeakPolarHBondContact O-CB 3.35Å; P243-I252 WeakPolarHBondContact O-CG1 3.22Å; P243-I252 PolarHBondContact O-N 3.1Å; P243-Y263 HydrophobicContact CB-CD1 4.11Å; P243-Y263 HydrophobicContact CB-CD2 3.69Å; P243-Y263 HydrophobicContact CB-CE2 4.24Å; P243-Y263 HydrophobicContact CB-CG 3.61Å
244	V	85.4	Confident	69	Low	82 Å²	82	89.6 Å²	89.6	50%	0.497	55%	0.546	S	S	.	.	B	Isolated β-bridge	trans	-84.4	136.2	-177.2	-178.4	0	0	0	0	109.7	L242 D246 G249	L242-V244 PolarHBondContact O-N 3.2Å; V244-D246 PolarHBondContact O-N 3.39Å; V244-G249 VanDerWaalsContact CG1-C 3.47Å; V244-G249 WeakPolarHBondContact CG1-O 3.42Å
245	C	84.9	Confident	70.2	Confident	0 Å²	0	91.4 Å²	91.4	0%	0	55%	0.55	C	S	.	.	B	Isolated β-bridge	trans	-74.4	118.9	175.5	-180	0	0	0	0	111.1	K247 C248 G249 N250 I252 Y263 R264 H265	C245-K247 PolarHBondContact O-N 3.29Å; C245-K247 VanDerWaalsContact O-N 3.12Å; C245-C248 WeakPolarHBondContact CB-SG 3.41Å; C245-C248 PolarHBondContact O-N 3.37Å; C245-C248 PolarHBondContact SG-SG 2.98Å; C245-G249 WeakPolarHBondContact O-CA 3.26Å; C245-G249 PolarHBondContact O-N 2.86Å; C245-N250 WeakPolarHBondContact CB-O 3.39Å; C245-N250 PolarHBondContact N-O 3.45Å; C245-I252 HydrophobicContact CB-CD1 3.93Å; C245-I252 HydrophobicContact CB-CG1 3.75Å; C245-Y263 WeakPolarHBondContact CA-O 3.26Å; C245-R264 WeakPolarHBondContact SG-CD 3.21Å; C245-H265 VanDerWaalsContact CB-CE1 3.42Å; C245-H265 WeakPolarHBondContact CB-CE1 3.44Å; C245-H265 VanDerWaalsContact CB-ND1 3.27Å; C245-H265 WeakPolarHBondContact CB-ND1 3.47Å; C245-H265 PolarHBondContact SG-ND1 3.43Å
246	D	81.8	Confident	71.8	Confident	78 Å²	78	88.9 Å²	88.9	42%	0.417	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-4.6	-178.6	177.8	89.3	0	0	0	114.2	V244 K262 Y263 R264	V244-D246 PolarHBondContact O-N 3.39Å; D246-K262 HydrophobicContact CB-CB 4.43Å; D246-K262 HydrophobicContact CB-CD 4.38Å; D246-K262 HydrophobicContact CB-CG 4.45Å; D246-K262 IonicContact OD1-NZ 2.81Å; D246-K262 PolarHBondContact OD1-NZ 3.42Å; D246-K262 VanDerWaalsContact OD2-CD 3.28Å; D246-K262 WeakPolarHBondContact OD2-CD 3.36Å; D246-K262 WeakPolarHBondContact OD2-CE 3.33Å; D246-K262 IonicContact OD2-NZ 2.64Å; D246-K262 PolarHBondContact OD2-NZ 3.12Å; D246-Y263 PolarHBondContact N-O 3.38Å; D246-R264 VanDerWaalsContact C-CZ 3.48Å; D246-R264 VanDerWaalsContact CB-NE 3.29Å; D246-R264 PolarHBondContact O-NH2 2.99Å; D246-R264 IonicContact OD2-CZ 3.44Å; D246-R264 IonicContact OD2-NE 3.24Å; D246-R264 IonicContact OD2-NH2 3.47Å; D246-R264 PolarHBondContact OD2-NH2 3.23Å
247	K	78.6	Confident	73.5	Confident	107 Å²	107	84.8 Å²	84.8	47%	0.465	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-37.7	171.1	-163.5	-177.9	-165.7	-126.6	0	112.6	C245 C268 V270 D275	C245-K247 PolarHBondContact O-N 3.29Å; C245-K247 VanDerWaalsContact O-N 3.12Å; K247-C268 HydrophobicContact CB-CB 3.96Å; K247-C268 HydrophobicContact CD-CB 3.97Å; K247-V270 HydrophobicContact CD-CG2 4.14Å; K247-D275 IonicContact NZ-OD1 3.49Å; K247-D275 PolarHBondContact NZ-OD1 2.92Å
248	C	80.3	Confident	75.2	Confident	52 Å²	52	88.2 Å²	88.2	35%	0.351	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-1.8	-170.1	64.3	0	0	0	0	114.2	C245 N250 H265	C245-C248 WeakPolarHBondContact CB-SG 3.41Å; C245-C248 PolarHBondContact O-N 3.37Å; C245-C248 PolarHBondContact SG-SG 2.98Å; C248-N250 PolarHBondContact O-N 3.16Å; C248-H265 PolarHBondContact SG-CE1 3.44Å; C248-H265 PolarHBondContact SG-ND1 2.94Å
249	G	77.8	Confident	76.5	Confident	53 Å²	53	81.5 Å²	81.5	55%	0.546	47%	0.465	S	S	.	.			trans	67.2	-2.7	178.1	0	0	0	0	0	115.1	V244 C245	V244-G249 VanDerWaalsContact CG1-C 3.47Å; V244-G249 WeakPolarHBondContact CG1-O 3.42Å; C245-G249 WeakPolarHBondContact O-CA 3.26Å; C245-G249 PolarHBondContact O-N 2.86Å
250	N	80.6	Confident	77.7	Confident	107 Å²	107	82 Å²	82	57%	0.572	46%	0.457	S	S	*	.			trans	-89.2	144.4	-178	-67.2	-20.4	0	0	0	111.5	C245 C248 I252	C245-N250 WeakPolarHBondContact CB-O 3.39Å; C245-N250 PolarHBondContact N-O 3.45Å; C248-N250 PolarHBondContact O-N 3.16Å; N250-I252 PolarHBondContact O-N 3.37Å
251	G	83.8	Confident	78.5	Confident	35 Å²	35	80.4 Å²	80.4	36%	0.361	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-60.7	128.2	172.8	0	0	0	0	0	111.2	V253	G251-V253 PolarHBondContact O-N 3.49Å
252	I	81.3	Confident	79.4	Confident	5 Å²	5	73.8 Å²	73.8	3%	0.026	43%	0.425	C	S	.	.			trans	-79.6	110.6	-178.8	-58.4	164.2	0	0	0	108.4	P243 C245 N250 V256	P243-I252 WeakPolarHBondContact O-CB 3.35Å; P243-I252 WeakPolarHBondContact O-CG1 3.22Å; P243-I252 PolarHBondContact O-N 3.1Å; C245-I252 HydrophobicContact CB-CD1 3.93Å; C245-I252 HydrophobicContact CB-CG1 3.75Å; N250-I252 PolarHBondContact O-N 3.37Å; I252-V256 HydrophobicContact CD1-CG2 3.94Å; I252-V256 HydrophobicContact CG2-CB 4.1Å; I252-V256 HydrophobicContact CG2-CG2 4.34Å
253	V	77	Confident	80.3	Confident	125 Å²	125	73.9 Å²	73.9	76%	0.758	42%	0.421	S	S	*	.			trans	-100	113.5	174.1	-174.7	0	0	0	0	108.4	G251	G251-V253 PolarHBondContact O-N 3.49Å
254	G	76.8	Confident	80.6	Confident	67 Å²	67	72.3 Å²	72.3	69%	0.691	41%	0.409	S	S	*	.	S	Bend	trans	106.1	-128.5	177.8	0	0	0	0	0	113.9	V256	G254-V256 PolarHBondContact O-N 3.08Å
255	T	77.2	Confident	80.6	Confident	111 Å²	111	70.5 Å²	70.5	68%	0.681	40%	0.395	S	S	*	.			trans	-73.3	125.6	-174.9	54	0	0	0	0	111.4	P266	T255-P266 WeakPolarHBondContact O-CD 3.49Å; T255-P266 VanDerWaalsContact OG1-CG 3.27Å; T255-P266 WeakPolarHBondContact OG1-CG 3.48Å
256	V	83.9	Confident	80.5	Confident	67 Å²	67	72.2 Å²	72.2	41%	0.406	41%	0.406	S	S	.	.			trans	-113.4	132.3	-177.7	61.9	0	0	0	0	110.8	I252 G254 Y263	I252-V256 HydrophobicContact CD1-CG2 3.94Å; I252-V256 HydrophobicContact CG2-CB 4.1Å; I252-V256 HydrophobicContact CG2-CG2 4.34Å; G254-V256 PolarHBondContact O-N 3.08Å; V256-Y263 HydrophobicContact CG2-CD1 3.51Å; V256-Y263 HydrophobicContact CG2-CE1 4.45Å; V256-Y263 HydrophobicContact CG2-CG 4.13Å
257	V	82.9	Confident	80.4	Confident	28 Å²	28	71.4 Å²	71.4	17%	0.17	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	114.7	169.4	-178	0	0	0	0	107.6	R264 P266 F269	V257-R264 PolarHBondContact N-O 3.09Å; V257-R264 PolarHBondContact O-N 3.44Å; V257-P266 HydrophobicContact CG2-CB 4.45Å; V257-P266 HydrophobicContact CG2-CG 4.42Å; V257-F269 HydrophobicContact CG1-CB 4.35Å; V257-F269 HydrophobicContact CG1-CD1 4.19Å; V257-F269 HydrophobicContact CG1-CD2 3.76Å; V257-F269 HydrophobicContact CG1-CE1 4.44Å; V257-F269 HydrophobicContact CG1-CE2 4.09Å; V257-F269 HydrophobicContact CG1-CG 3.82Å; V257-F269 HydrophobicContact CG1-CZ 4.4Å
258	K	83.3	Confident	80.6	Confident	129 Å²	129	67.4 Å²	67.4	56%	0.561	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	116.6	174.8	-174.2	179.5	179.2	-179.6	0	109	R260 Y263	K258-R260 WeakPolarHBondContact CE-O 3.39Å; K258-Y263 HydrophobicContact CB-CD1 4.23Å; K258-Y263 HydrophobicContact CB-CE1 4.18Å; K258-Y263 HydrophobicContact CD-CE1 4.04Å; K258-Y263 HydrophobicContact CG-CD1 4.27Å; K258-Y263 HydrophobicContact CG-CE1 3.94Å
259	A	76.4	Confident	80.8	Confident	6 Å²	6	65.1 Å²	65.1	5%	0.05	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	104.3	173.4	0	0	0	0	0	108.5	D261 K262 F269 Y283 L290	A259-D261 PolarHBondContact O-N 2.96Å; A259-K262 PolarHBondContact N-O 2.84Å; A259-K262 PolarHBondContact O-N 3.46Å; A259-F269 HydrophobicContact CB-CE2 3.74Å; A259-Y283 HydrophobicContact CB-CE2 4.23Å; A259-L290 HydrophobicContact CB-CD2 4.21Å
260	R	74.8	Confident	81.2	Confident	161 Å²	161	63.3 Å²	63.3	61%	0.608	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	-108.2	-167.3	-67.9	-178	164.5	175.5	-5.4	111.5	K258	K258-R260 WeakPolarHBondContact CE-O 3.39Å
261	D	73.3	Confident	81.5	Confident	144 Å²	144	58.2 Å²	58.2	77%	0.77	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	1.9	-175.5	-59.6	-56.7	0	0	0	113.7	A259	A259-D261 PolarHBondContact O-N 2.96Å
262	K	82.1	Confident	81.5	Confident	64 Å²	64	58.6 Å²	58.6	28%	0.278	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.6	-179.3	-68.6	175.2	165.6	-155.7	0	110.8	D246 A259	D246-K262 HydrophobicContact CB-CB 4.43Å; D246-K262 HydrophobicContact CB-CD 4.38Å; D246-K262 HydrophobicContact CB-CG 4.45Å; D246-K262 IonicContact OD1-NZ 2.81Å; D246-K262 PolarHBondContact OD1-NZ 3.42Å; D246-K262 VanDerWaalsContact OD2-CD 3.28Å; D246-K262 WeakPolarHBondContact OD2-CD 3.36Å; D246-K262 WeakPolarHBondContact OD2-CE 3.33Å; D246-K262 IonicContact OD2-NZ 2.64Å; D246-K262 PolarHBondContact OD2-NZ 3.12Å; A259-K262 PolarHBondContact N-O 2.84Å; A259-K262 PolarHBondContact O-N 3.46Å
263	Y	86.1	Confident	81.5	Confident	88 Å²	88	62 Å²	62	35%	0.345	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	138.1	174.3	-60	-79.4	0	0	0	109.8	P243 C245 D246 V256 K258	P243-Y263 HydrophobicContact CB-CD1 4.11Å; P243-Y263 HydrophobicContact CB-CD2 3.69Å; P243-Y263 HydrophobicContact CB-CE2 4.24Å; P243-Y263 HydrophobicContact CB-CG 3.61Å; C245-Y263 WeakPolarHBondContact CA-O 3.26Å; D246-Y263 PolarHBondContact N-O 3.38Å; V256-Y263 HydrophobicContact CG2-CD1 3.51Å; V256-Y263 HydrophobicContact CG2-CE1 4.45Å; V256-Y263 HydrophobicContact CG2-CG 4.13Å; K258-Y263 HydrophobicContact CB-CD1 4.23Å; K258-Y263 HydrophobicContact CB-CE1 4.18Å; K258-Y263 HydrophobicContact CD-CE1 4.04Å; K258-Y263 HydrophobicContact CG-CD1 4.27Å; K258-Y263 HydrophobicContact CG-CE1 3.94Å
264	R	84.9	Confident	81.7	Confident	10 Å²	10	58.6 Å²	58.6	4%	0.038	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	152.5	178	-65.4	-66.1	-178.6	91	-10.6	111.2	C245 D246 V257	C245-R264 WeakPolarHBondContact SG-CD 3.21Å; D246-R264 VanDerWaalsContact C-CZ 3.48Å; D246-R264 VanDerWaalsContact CB-NE 3.29Å; D246-R264 PolarHBondContact O-NH2 2.99Å; D246-R264 IonicContact OD2-CZ 3.44Å; D246-R264 IonicContact OD2-NE 3.24Å; D246-R264 IonicContact OD2-NH2 3.47Å; D246-R264 PolarHBondContact OD2-NH2 3.23Å; V257-R264 PolarHBondContact N-O 3.09Å; V257-R264 PolarHBondContact O-N 3.44Å
265	H	84.3	Confident	81.9	Confident	43 Å²	43	60.1 Å²	60.1	20%	0.199	33%	0.328	C	S	.	.			trans	-65.6	152.5	168.5	-64.8	101.8	0	0	0	111	C245 C248 G267 C268 F269	C245-H265 VanDerWaalsContact CB-CE1 3.42Å; C245-H265 WeakPolarHBondContact CB-CE1 3.44Å; C245-H265 VanDerWaalsContact CB-ND1 3.27Å; C245-H265 WeakPolarHBondContact CB-ND1 3.47Å; C245-H265 PolarHBondContact SG-ND1 3.43Å; C248-H265 PolarHBondContact SG-CE1 3.44Å; C248-H265 PolarHBondContact SG-ND1 2.94Å; H265-G267 PolarHBondContact O-N 3.3Å; H265-G267 VanDerWaalsContact O-N 3.14Å; H265-C268 HydrophobicContact CB-CB 3.91Å; H265-C268 CarbonylContact O-C 3.57Å; H265-C268 PolarHBondContact O-N 3.2Å; H265-F269 PolarHBondContact O-N 3.01Å; H265-F269 VanDerWaalsContact O-N 3.09Å
266	P	83.8	Confident	82.2	Confident	37 Å²	37	57.9 Å²	57.9	24%	0.24	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.7	174.4	-23.5	32	0	0	0	114.3	T255 V257 N277	T255-P266 WeakPolarHBondContact O-CD 3.49Å; T255-P266 VanDerWaalsContact OG1-CG 3.27Å; T255-P266 WeakPolarHBondContact OG1-CG 3.48Å; V257-P266 HydrophobicContact CG2-CB 4.45Å; V257-P266 HydrophobicContact CG2-CG 4.42Å; P266-N277 PolarHBondContact O-OD1 3.21Å
267	G	80.3	Confident	82.2	Confident	60 Å²	60	58.2 Å²	58.2	62%	0.619	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-16.8	173.8	0	0	0	0	0	114.4	H265 V270	H265-G267 PolarHBondContact O-N 3.3Å; H265-G267 VanDerWaalsContact O-N 3.14Å; G267-V270 WeakPolarHBondContact O-CG1 3.43Å
268	C	82	Confident	82.1	Confident	23 Å²	23	57 Å²	57	16%	0.155	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.7	175.4	-66.4	0	0	0	0	112.7	K247 H265 V270	K247-C268 HydrophobicContact CB-CB 3.96Å; K247-C268 HydrophobicContact CD-CB 3.97Å; H265-C268 HydrophobicContact CB-CB 3.91Å; H265-C268 CarbonylContact O-C 3.57Å; H265-C268 PolarHBondContact O-N 3.2Å; C268-V270 PolarHBondContact O-N 3.39Å
269	F	84.2	Confident	81.7	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.022	31%	0.309	C	S	.	.			trans	-84.5	64.6	177.6	-168.1	-110	0	0	0	111	V257 A259 H265 N277 L278 K279 Y283 L290	V257-F269 HydrophobicContact CG1-CB 4.35Å; V257-F269 HydrophobicContact CG1-CD1 4.19Å; V257-F269 HydrophobicContact CG1-CD2 3.76Å; V257-F269 HydrophobicContact CG1-CE1 4.44Å; V257-F269 HydrophobicContact CG1-CE2 4.09Å; V257-F269 HydrophobicContact CG1-CG 3.82Å; V257-F269 HydrophobicContact CG1-CZ 4.4Å; A259-F269 HydrophobicContact CB-CE2 3.74Å; H265-F269 PolarHBondContact O-N 3.01Å; H265-F269 VanDerWaalsContact O-N 3.09Å; F269-N277 PolarHBondContact O-OD1 3.2Å; F269-L278 HydrophobicContact CD1-CB 3.78Å; F269-L278 VanDerWaalsContact CE1-C 3.45Å; F269-L278 HydrophobicContact CE1-CB 3.45Å; F269-L278 VanDerWaalsContact CE1-CB 3.45Å; F269-L278 HydrophobicContact CZ-CB 4.14Å; F269-L278 PolarHBondContact O-N 3.42Å; F269-K279 HydrophobicContact CD1-CB 4.38Å; F269-Y283 HydrophobicContact CE1-CD1 4.14Å; F269-Y283 HydrophobicContact CE1-CG 4.43Å; F269-Y283 HydrophobicContact CE2-CG 4.48Å; F269-Y283 AromaticContact CZ-CD1 3.52Å; F269-Y283 HydrophobicContact CZ-CD1 3.52Å; F269-Y283 HydrophobicContact CZ-CD2 4.23Å; F269-Y283 HydrophobicContact CZ-CE1 4.04Å; F269-Y283 AromaticContact CZ-CG 3.62Å; F269-Y283 HydrophobicContact CZ-CG 3.62Å; F269-L290 HydrophobicContact CD2-CD1 3.82Å; F269-L290 HydrophobicContact CE2-CD1 3.7Å; F269-L290 HydrophobicContact CE2-CD2 3.74Å; F269-L290 HydrophobicContact CE2-CG 4.34Å; F269-L290 HydrophobicContact CZ-CD2 4.24Å
270	V	86.9	Confident	81.6	Confident	15 Å²	15	66.6 Å²	66.6	9%	0.091	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-122.5	155.5	-172	-62.9	0	0	0	0	111.4	K247 G267 C268 D275 V276	K247-V270 HydrophobicContact CD-CG2 4.14Å; G267-V270 WeakPolarHBondContact O-CG1 3.43Å; C268-V270 PolarHBondContact O-N 3.39Å; V270-D275 WeakPolarHBondContact CB-O 3.49Å; V270-D275 VanDerWaalsContact CG1-O 3.26Å; V270-D275 WeakPolarHBondContact CG1-O 3.48Å; V270-D275 WeakPolarHBondContact CG2-OD1 3.37Å; V270-V276 WeakPolarHBondContact CA-O 3.32Å
271	C	85.6	Confident	81.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.352	C	S	.	.			trans	-66.7	138.4	172.6	179.2	0	0	0	0	110.9	D273 C274 D275 V276 L278 L290 C292 H295	C271-D273 VanDerWaalsContact C-N 3.25Å; C271-D273 PolarHBondContact O-N 3.08Å; C271-C274 WeakPolarHBondContact CB-SG 3.36Å; C271-D275 WeakPolarHBondContact O-CA 3.32Å; C271-D275 PolarHBondContact O-N 2.77Å; C271-V276 PolarHBondContact N-O 2.84Å; C271-V276 VanDerWaalsContact N-O 3.11Å; C271-L278 HydrophobicContact CB-CD1 4.19Å; C271-L278 HydrophobicContact CB-CD2 4.26Å; C271-L278 HydrophobicContact CB-CG 4.37Å; C271-L290 WeakPolarHBondContact CA-O 3.27Å; C271-C292 HydrophobicContact CB-CB 4.36Å; C271-C292 PolarHBondContact SG-N 3.11Å; C271-C292 VanDerWaalsContact SG-N 3.39Å; C271-H295 PolarHBondContact SG-ND1 3Å; C271-H295 VanDerWaalsContact SG-ND1 3.37Å
272	A	83.5	Confident	81.5	Confident	43 Å²	43	61.3 Å²	61.3	36%	0.355	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.8	178.5	0	0	0	0	0	114.7	Q289 L290 Y291	A272-Q289 HydrophobicContact CB-CG 3.67Å; A272-L290 PolarHBondContact N-O 3.35Å; A272-L290 VanDerWaalsContact N-O 3.08Å; A272-Y291 HydrophobicContact CB-CD1 4.38Å; A272-Y291 HydrophobicContact CB-CE1 3.83Å
273	D	81.3	Confident	81.4	Confident	77 Å²	77	63 Å²	63	41%	0.412	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-25.6	-174.1	-67.4	-24.8	0	0	0	113.4	C271 Y291 H295 R299	C271-D273 VanDerWaalsContact C-N 3.25Å; C271-D273 PolarHBondContact O-N 3.08Å; D273-Y291 WeakPolarHBondContact OD2-CD1 3.3Å; D273-Y291 VanDerWaalsContact OD2-CE1 3.22Å; D273-Y291 WeakPolarHBondContact OD2-CE1 3.46Å; D273-H295 VanDerWaalsContact CB-ND1 3.31Å; D273-H295 WeakPolarHBondContact CB-ND1 3.31Å; D273-H295 IonicContact OD2-CG 2.77Å; D273-H295 IonicContact OD2-ND1 3.91Å; D273-R299 IonicContact OD1-NH2 3.94Å; D273-R299 PolarHBondContact OD1-NH2 3.45Å; D273-R299 IonicContact OD2-CZ 3.69Å; D273-R299 IonicContact OD2-NE 3.48Å; D273-R299 PolarHBondContact OD2-NE 3.42Å; D273-R299 IonicContact OD2-NH2 3.55Å; D273-R299 PolarHBondContact OD2-NH2 3Å
274	C	82.1	Confident	81.3	Confident	52 Å²	52	62.8 Å²	62.8	35%	0.351	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	1.2	-179.2	56.1	0	0	0	0	115.2	C271 V276 H295	C271-C274 WeakPolarHBondContact CB-SG 3.36Å; C274-V276 HydrophobicContact CB-CG2 4.07Å; C274-V276 WeakPolarHBondContact O-CG2 3.48Å; C274-V276 PolarHBondContact O-N 3Å; C274-H295 VanDerWaalsContact SG-CE1 3.51Å
275	D	81.1	Confident	81.1	Confident	100 Å²	100	65.8 Å²	65.8	54%	0.535	36%	0.355	S	S	.	.			trans	50.3	16	-178	-74.9	-57.9	0	0	0	115.3	K247 V270 C271	K247-D275 IonicContact NZ-OD1 3.49Å; K247-D275 PolarHBondContact NZ-OD1 2.92Å; V270-D275 WeakPolarHBondContact CB-O 3.49Å; V270-D275 VanDerWaalsContact CG1-O 3.26Å; V270-D275 WeakPolarHBondContact CG1-O 3.48Å; V270-D275 WeakPolarHBondContact CG2-OD1 3.37Å; C271-D275 WeakPolarHBondContact O-CA 3.32Å; C271-D275 PolarHBondContact O-N 2.77Å
276	V	83.3	Confident	80.9	Confident	64 Å²	64	64.7 Å²	64.7	39%	0.388	35%	0.351	S	S	.	.			trans	-73.2	137	178.1	178.4	0	0	0	0	109.6	V270 C271 C274 L278	V270-V276 WeakPolarHBondContact CA-O 3.32Å; C271-V276 PolarHBondContact N-O 2.84Å; C271-V276 VanDerWaalsContact N-O 3.11Å; C274-V276 HydrophobicContact CB-CG2 4.07Å; C274-V276 WeakPolarHBondContact O-CG2 3.48Å; C274-V276 PolarHBondContact O-N 3Å; V276-L278 PolarHBondContact O-N 3.15Å
277	N	83.9	Confident	80.5	Confident	74 Å²	74	70.2 Å²	70.2	40%	0.396	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-66.7	116.5	179.1	-162.9	10.5	0	0	0	111.3	P266 F269 K279	P266-N277 PolarHBondContact O-OD1 3.21Å; F269-N277 PolarHBondContact O-OD1 3.2Å; N277-K279 VanDerWaalsContact C-N 3.26Å; N277-K279 PolarHBondContact O-N 3.32Å
278	L	80.9	Confident	80.1	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.016	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.3	-173.5	-64.5	169	0	0	0	112.8	F269 C271 V276 Q280 K281 L290 C292	F269-L278 HydrophobicContact CD1-CB 3.78Å; F269-L278 VanDerWaalsContact CE1-C 3.45Å; F269-L278 HydrophobicContact CE1-CB 3.45Å; F269-L278 VanDerWaalsContact CE1-CB 3.45Å; F269-L278 HydrophobicContact CZ-CB 4.14Å; F269-L278 PolarHBondContact O-N 3.42Å; C271-L278 HydrophobicContact CB-CD1 4.19Å; C271-L278 HydrophobicContact CB-CD2 4.26Å; C271-L278 HydrophobicContact CB-CG 4.37Å; V276-L278 PolarHBondContact O-N 3.15Å; L278-Q280 PolarHBondContact O-N 3.39Å; L278-K281 PolarHBondContact O-N 3.2Å; L278-L290 HydrophobicContact CD1-CB 3.89Å; L278-C292 HydrophobicContact CD2-CB 3.7Å
279	K	74.6	Confident	80	Confident	144 Å²	144	72.5 Å²	72.5	63%	0.626	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.7	-177.1	-171.4	177.7	178.1	-174.9	0	113.3	F269 N277	F269-K279 HydrophobicContact CD1-CB 4.38Å; N277-K279 VanDerWaalsContact C-N 3.26Å; N277-K279 PolarHBondContact O-N 3.32Å
280	Q	74.3	Confident	79.9	Confident	191 Å²	191	72.7 Å²	72.7	89%	0.893	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-18.5	-177.6	-71.4	-176.5	-35.7	0	0	114.4	L278	L278-Q280 PolarHBondContact O-N 3.39Å
281	K	70.1	Confident	79.7	Confident	155 Å²	155	72.8 Å²	72.8	67%	0.674	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	12.2	-170.5	-70.7	-169.5	174.2	-175.2	0	114.5	L278	L278-K281 PolarHBondContact O-N 3.2Å
282	G	76.2	Confident	79.7	Confident	39 Å²	39	73.7 Å²	73.7	40%	0.402	38%	0.379	S	S	.	.			trans	68.6	159.2	-170.2	0	0	0	0	0	111.5
283	Y	79.9	Confident	79.7	Confident	100 Å²	100	76 Å²	76	39%	0.392	38%	0.383	S	S	.	.			trans	-135	145.6	179.4	65.6	-84.8	0	0	0	109.9	A259 F269 L290	A259-Y283 HydrophobicContact CB-CE2 4.23Å; F269-Y283 HydrophobicContact CE1-CD1 4.14Å; F269-Y283 HydrophobicContact CE1-CG 4.43Å; F269-Y283 HydrophobicContact CE2-CG 4.48Å; F269-Y283 AromaticContact CZ-CD1 3.52Å; F269-Y283 HydrophobicContact CZ-CD1 3.52Å; F269-Y283 HydrophobicContact CZ-CD2 4.23Å; F269-Y283 HydrophobicContact CZ-CE1 4.04Å; F269-Y283 AromaticContact CZ-CG 3.62Å; F269-Y283 HydrophobicContact CZ-CG 3.62Å; Y283-L290 HydrophobicContact CD2-CD2 3.53Å; Y283-L290 HydrophobicContact CE2-CD2 4.18Å; Y283-L290 HydrophobicContact CG-CD2 4.16Å
284	F	83.2	Confident	79.9	Confident	83 Å²	83	78.6 Å²	78.6	36%	0.364	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.2	174.9	-69.4	-94.3	0	0	0	108.8	Y291 E293 A296 M300	F284-Y291 PolarHBondContact N-O 3.33Å; F284-Y291 PolarHBondContact O-N 3.35Å; F284-E293 HydrophobicContact CD2-CB 4.1Å; F284-E293 HydrophobicContact CD2-CG 4.48Å; F284-E293 HydrophobicContact CE2-CB 3.6Å; F284-E293 HydrophobicContact CE2-CG 3.66Å; F284-E293 HydrophobicContact CZ-CG 4.13Å; F284-A296 HydrophobicContact CB-CB 3.22Å; F284-A296 HydrophobicContact CD2-CB 4.3Å; F284-A296 HydrophobicContact CG-CB 3.8Å; F284-M300 HydrophobicContact CD1-CE 4.43Å
285	F	81.8	Confident	79.9	Confident	74 Å²	74	78.6 Å²	78.6	33%	0.325	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	107.3	-174.4	-166.8	-98.2	0	0	0	109.1	S288 L290	F285-S288 WeakPolarHBondContact CE2-O 3.5Å; F285-L290 HydrophobicContact CD2-CD2 4.29Å
286	V	79.5	Confident	80.1	Confident	19 Å²	19	73.9 Å²	73.9	12%	0.115	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.8	179.7	-175.2	0	0	0	0	106.5	S288 Q289 Y291 A296 R299 M300	V286-S288 PolarHBondContact O-N 2.92Å; V286-Q289 PolarHBondContact N-O 3.5Å; V286-Q289 PolarHBondContact O-N 3.12Å; V286-Q289 VanDerWaalsContact O-N 3.08Å; V286-Y291 HydrophobicContact CB-CD2 3.86Å; V286-Y291 HydrophobicContact CB-CE2 4.01Å; V286-Y291 HydrophobicContact CG2-CD2 4.37Å; V286-Y291 WeakPolarHBondContact O-CE2 3.25Å; V286-A296 HydrophobicContact CG2-CB 3.97Å; V286-R299 HydrophobicContact CG1-CB 4.37Å; V286-M300 HydrophobicContact CG2-CE 4.15Å; V286-M300 HydrophobicContact CG2-CG 4.15Å; V286-M300 HydrophobicContact CG2-SD 4.25Å
287	E	75.2	Confident	80	Confident	154 Å²	154	77.6 Å²	77.6	72%	0.72	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	46	177.1	-62.1	178.1	162.5	0	0	115.3	Q289	E287-Q289 PolarHBondContact O-N 3.41Å
288	S	73.4	Confident	79.8	Confident	65 Å²	65	77.4 Å²	77.4	46%	0.455	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	1.7	178.9	81.7	0	0	0	0	117.3	F285 V286	F285-S288 WeakPolarHBondContact CE2-O 3.5Å; V286-S288 PolarHBondContact O-N 2.92Å
289	Q	78.3	Confident	79.4	Confident	66 Å²	66	82.6 Å²	82.6	31%	0.308	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	152.8	-177	-145.5	68.4	3.4	0	0	112.3	A272 V286 E287 Y291	A272-Q289 HydrophobicContact CB-CG 3.67Å; V286-Q289 PolarHBondContact N-O 3.5Å; V286-Q289 PolarHBondContact O-N 3.12Å; V286-Q289 VanDerWaalsContact O-N 3.08Å; E287-Q289 PolarHBondContact O-N 3.41Å; Q289-Y291 HydrophobicContact CB-CE2 3.75Å; Q289-Y291 WeakPolarHBondContact O-CD2 3.44Å
290	L	82.8	Confident	79.1	Confident	9 Å²	9	81.1 Å²	81.1	5%	0.047	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.2	-178.6	-67.9	154.7	0	0	0	109.8	A259 F269 C271 A272 L278 Y283 F285	A259-L290 HydrophobicContact CB-CD2 4.21Å; F269-L290 HydrophobicContact CD2-CD1 3.82Å; F269-L290 HydrophobicContact CE2-CD1 3.7Å; F269-L290 HydrophobicContact CE2-CD2 3.74Å; F269-L290 HydrophobicContact CE2-CG 4.34Å; F269-L290 HydrophobicContact CZ-CD2 4.24Å; C271-L290 WeakPolarHBondContact CA-O 3.27Å; A272-L290 PolarHBondContact N-O 3.35Å; A272-L290 VanDerWaalsContact N-O 3.08Å; L278-L290 HydrophobicContact CD1-CB 3.89Å; Y283-L290 HydrophobicContact CD2-CD2 3.53Å; Y283-L290 HydrophobicContact CE2-CD2 4.18Å; Y283-L290 HydrophobicContact CG-CD2 4.16Å; F285-L290 HydrophobicContact CD2-CD2 4.29Å
291	Y	83.1	Confident	78.8	Confident	16 Å²	16	79.7 Å²	79.7	6%	0.063	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	155	177.5	-64	-80	0	0	0	111.3	A272 D273 F284 V286 Q289 H295 R299	A272-Y291 HydrophobicContact CB-CD1 4.38Å; A272-Y291 HydrophobicContact CB-CE1 3.83Å; D273-Y291 WeakPolarHBondContact OD2-CD1 3.3Å; D273-Y291 VanDerWaalsContact OD2-CE1 3.22Å; D273-Y291 WeakPolarHBondContact OD2-CE1 3.46Å; F284-Y291 PolarHBondContact N-O 3.33Å; F284-Y291 PolarHBondContact O-N 3.35Å; V286-Y291 HydrophobicContact CB-CD2 3.86Å; V286-Y291 HydrophobicContact CB-CE2 4.01Å; V286-Y291 HydrophobicContact CG2-CD2 4.37Å; V286-Y291 WeakPolarHBondContact O-CE2 3.25Å; Q289-Y291 HydrophobicContact CB-CE2 3.75Å; Q289-Y291 WeakPolarHBondContact O-CD2 3.44Å; Y291-H295 HydrophobicContact CD1-CB 4.12Å; Y291-R299 PolarHBondContact OH-NH1 2.95Å
292	C	86.1	Confident	78.2	Confident	19 Å²	19	77.2 Å²	77.2	13%	0.128	38%	0.383	C	S	.	.			trans	-72.7	164.4	167.9	67.7	0	0	0	0	110.5	C271 L278 I294 H295 A296	C271-C292 HydrophobicContact CB-CB 4.36Å; C271-C292 PolarHBondContact SG-N 3.11Å; C271-C292 VanDerWaalsContact SG-N 3.39Å; L278-C292 HydrophobicContact CD2-CB 3.7Å; C292-I294 PolarHBondContact O-N 3.3Å; C292-I294 VanDerWaalsContact O-N 3.16Å; C292-H295 PolarHBondContact O-N 3.1Å; C292-H295 PolarHBondContact SG-N 3.4Å; C292-H295 VanDerWaalsContact SG-N 3.43Å; C292-H295 PolarHBondContact SG-ND1 3.03Å; C292-A296 WeakPolarHBondContact O-CB 3.24Å; C292-A296 PolarHBondContact O-N 3.01Å
293	E	83.8	Confident	77.2	Confident	93 Å²	93	81.4 Å²	81.4	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-51.1	-39.7	178.4	-173.2	176.5	175.6	0	0	113.1	F284 R297	F284-E293 HydrophobicContact CD2-CB 4.1Å; F284-E293 HydrophobicContact CD2-CG 4.48Å; F284-E293 HydrophobicContact CE2-CB 3.6Å; F284-E293 HydrophobicContact CE2-CG 3.66Å; F284-E293 HydrophobicContact CZ-CG 4.13Å; E293-R297 WeakPolarHBondContact O-CB 3.42Å; E293-R297 PolarHBondContact O-N 3.09Å; E293-R297 VanDerWaalsContact O-N 3.11Å; E293-R297 IonicContact OE1-CZ 2.86Å; E293-R297 IonicContact OE1-NH2 3.86Å; E293-R297 PolarHBondContact OE1-NH2 3.08Å
294	I	84.4	Confident	76.2	Confident	130 Å²	130	85 Å²	85	67%	0.667	42%	0.423	S	S	*	.	H	α-helix	trans	-67.8	-50.8	-178.4	-58.2	171.3	0	0	0	110.5	C292 R297 A298	C292-I294 PolarHBondContact O-N 3.3Å; C292-I294 VanDerWaalsContact O-N 3.16Å; I294-R297 PolarHBondContact O-N 2.62Å; I294-A298 PolarHBondContact O-N 3.39Å
295	H	82.1	Confident	74.9	Confident	53 Å²	53	84.5 Å²	84.5	25%	0.245	44%	0.442	C	S	.	.	H	α-helix	trans	-74.2	-32.6	-175.5	-62.9	161.3	0	0	0	113	C271 D273 C274 Y291 C292 R299	C271-H295 PolarHBondContact SG-ND1 3Å; C271-H295 VanDerWaalsContact SG-ND1 3.37Å; D273-H295 VanDerWaalsContact CB-ND1 3.31Å; D273-H295 WeakPolarHBondContact CB-ND1 3.31Å; D273-H295 IonicContact OD2-CG 2.77Å; D273-H295 IonicContact OD2-ND1 3.91Å; C274-H295 VanDerWaalsContact SG-CE1 3.51Å; Y291-H295 HydrophobicContact CD1-CB 4.12Å; C292-H295 PolarHBondContact O-N 3.1Å; C292-H295 PolarHBondContact SG-N 3.4Å; C292-H295 VanDerWaalsContact SG-N 3.43Å; C292-H295 PolarHBondContact SG-ND1 3.03Å; H295-R299 VanDerWaalsContact O-CG 3.32Å; H295-R299 WeakPolarHBondContact O-CG 3.4Å; H295-R299 PolarHBondContact O-N 3.14Å
296	A	84.6	Confident	73.3	Confident	0 Å²	0	88.6 Å²	88.6	0%	0	46%	0.462	C	S	.	.	H	α-helix	trans	-68.5	-40.3	173.4	0	0	0	0	0	112	F284 V286 C292 R299 M300	F284-A296 HydrophobicContact CB-CB 3.22Å; F284-A296 HydrophobicContact CD2-CB 4.3Å; F284-A296 HydrophobicContact CG-CB 3.8Å; V286-A296 HydrophobicContact CG2-CB 3.97Å; C292-A296 WeakPolarHBondContact O-CB 3.24Å; C292-A296 PolarHBondContact O-N 3.01Å; A296-R299 PolarHBondContact O-N 3.24Å; A296-M300 HydrophobicContact CB-CE 4.15Å; A296-M300 WeakPolarHBondContact O-CB 3.19Å; A296-M300 WeakPolarHBondContact O-CG 3.47Å; A296-M300 PolarHBondContact O-N 2.98Å
297	R	81.4	Confident	71.9	Confident	142 Å²	142	94.6 Å²	94.6	54%	0.536	49%	0.493	S	S	.	.	H	α-helix	trans	-67.6	-35.8	176.7	-171	178.9	-61.1	-174.3	3.9	112.3	E293 I294 R299 R301	E293-R297 WeakPolarHBondContact O-CB 3.42Å; E293-R297 PolarHBondContact O-N 3.09Å; E293-R297 VanDerWaalsContact O-N 3.11Å; E293-R297 IonicContact OE1-CZ 2.86Å; E293-R297 IonicContact OE1-NH2 3.86Å; E293-R297 PolarHBondContact OE1-NH2 3.08Å; I294-R297 PolarHBondContact O-N 2.62Å; R297-R299 VanDerWaalsContact C-N 3.31Å; R297-R301 PolarHBondContact O-N 3.45Å
298	A	79.7	Confident	70.7	Confident	70 Å²	70	94.1 Å²	94.1	58%	0.579	50%	0.495	S	S	*	.	H	α-helix	trans	-63.1	-37.6	173.9	0	0	0	0	0	112.1	I294	I294-A298 PolarHBondContact O-N 3.39Å
299	R	72.9	Confident	69.5	Low	113 Å²	113	96.4 Å²	96.4	43%	0.426	51%	0.506	S	S	.	.	H	α-helix	trans	-82.6	-26.7	-178.4	-68.6	170.9	-178.5	-100.6	4	114.2	D273 V286 Y291 H295 A296 R297	D273-R299 IonicContact OD1-NH2 3.94Å; D273-R299 PolarHBondContact OD1-NH2 3.45Å; D273-R299 IonicContact OD2-CZ 3.69Å; D273-R299 IonicContact OD2-NE 3.48Å; D273-R299 PolarHBondContact OD2-NE 3.42Å; D273-R299 IonicContact OD2-NH2 3.55Å; D273-R299 PolarHBondContact OD2-NH2 3Å; V286-R299 HydrophobicContact CG1-CB 4.37Å; Y291-R299 PolarHBondContact OH-NH1 2.95Å; H295-R299 VanDerWaalsContact O-CG 3.32Å; H295-R299 WeakPolarHBondContact O-CG 3.4Å; H295-R299 PolarHBondContact O-N 3.14Å; A296-R299 PolarHBondContact O-N 3.24Å; R297-R299 VanDerWaalsContact C-N 3.31Å
300	M	68.8	Low	68	Low	113 Å²	113	98.5 Å²	98.5	56%	0.557	52%	0.523	S	S	*	.	S	Bend	trans	-88.7	-0.8	177.6	-71.3	-167.9	-78.5	0	0	113.7	F284 V286 A296 P302	F284-M300 HydrophobicContact CD1-CE 4.43Å; V286-M300 HydrophobicContact CG2-CE 4.15Å; V286-M300 HydrophobicContact CG2-CG 4.15Å; V286-M300 HydrophobicContact CG2-SD 4.25Å; A296-M300 HydrophobicContact CB-CE 4.15Å; A296-M300 WeakPolarHBondContact O-CB 3.19Å; A296-M300 WeakPolarHBondContact O-CG 3.47Å; A296-M300 PolarHBondContact O-N 2.98Å; M300-P302 VanDerWaalsContact O-CD 3.24Å; M300-P302 WeakPolarHBondContact O-CD 3.22Å
301	R	67.3	Low	66.3	Low	160 Å²	160	103.7 Å²	103.7	60%	0.604	56%	0.556	S	S	*	*	S	Bend	trans	-79.4	113.4	174.2	-137.4	-173.6	-91.2	-164.3	-3.2	108.2	R297	R297-R301 PolarHBondContact O-N 3.45Å
302	P	57.8	Low	64.3	Low	103 Å²	103	111.3 Å²	111.3	67%	0.669	59%	0.589	S	S	*	*			trans	-60.3	152.1	172.9	25.1	-32	0	0	0	109.7	M300 E304	M300-P302 VanDerWaalsContact O-CD 3.24Å; M300-P302 WeakPolarHBondContact O-CD 3.22Å; P302-E304 PolarHBondContact O-N 3.47Å; P302-E304 VanDerWaalsContact O-N 3.12Å
303	P	56.3	Low	62.5	Low	127 Å²	127	116.6 Å²	116.6	83%	0.825	62%	0.623	S	S	*	*			trans	-57.9	119.6	-178.1	21.9	-30.7	0	0	0	110.2	G305	P303-G305 VanDerWaalsContact C-N 3.33Å; P303-G305 PolarHBondContact O-N 3.38Å
304	E	58.6	Low	60.7	Low	175 Å²	175	117.4 Å²	117.4	82%	0.818	64%	0.64	S	S	*	*	S	Bend	trans	-65.8	91.6	171.7	-73.5	-170.5	173.2	0	0	109	P302	P302-E304 PolarHBondContact O-N 3.47Å; P302-E304 VanDerWaalsContact O-N 3.12Å
305	G	55.2	Low	59	Low	74 Å²	74	120.7 Å²	120.7	76%	0.763	67%	0.674	S	S	*	*			trans	-164.5	28.9	-176.4	0	0	0	0	0	115.1	P303	P303-G305 VanDerWaalsContact C-N 3.33Å; P303-G305 PolarHBondContact O-N 3.38Å
306	H	48.8	Very low	57.8	Low	159 Å²	159	124.1 Å²	124.1	74%	0.736	70%	0.695	S	S	*	*			trans	-116.4	86.6	161.8	-157.7	-27.4	0	0	0	108.1	L308	H306-L308 PolarHBondContact O-N 3.22Å
307	D	48.6	Very low	56.4	Low	145 Å²	145	130.6 Å²	130.6	78%	0.775	73%	0.732	S	S	*	*			trans	-58.2	108.5	160.3	-85.5	-31.8	0	0	0	106.9	V309	D307-V309 HydrophobicContact CB-CG2 4.5Å; D307-V309 PolarHBondContact O-N 3.14Å
308	L	51.8	Low	55	Low	145 Å²	145	130 Å²	130	76%	0.759	74%	0.743	S	S	*	*			trans	-74.4	86.3	161.9	-74.8	167.1	0	0	0	106.1	H306 T310	H306-L308 PolarHBondContact O-N 3.22Å; L308-T310 PolarHBondContact O-N 3.45Å
309	V	46.6	Very low	53.5	Low	113 Å²	113	133.5 Å²	133.5	69%	0.685	75%	0.753	S	S	*	*			trans	-60.4	106	163.2	179.6	0	0	0	0	106.6	D307 T311	D307-V309 HydrophobicContact CB-CG2 4.5Å; D307-V309 PolarHBondContact O-N 3.14Å; V309-T311 VanDerWaalsContact C-N 3.26Å; V309-T311 HydrophobicContact CG1-CG2 3.93Å; V309-T311 PolarHBondContact O-N 3.3Å
310	T	48.1	Very low	52.3	Low	109 Å²	109	134.8 Å²	134.8	67%	0.669	77%	0.773	S	S	*	*			trans	-70.6	83	168.6	43	0	0	0	0	108.8	L308 F312	L308-T310 PolarHBondContact O-N 3.45Å; T310-F312 PolarHBondContact O-N 3.23Å
311	T	45.9	Very low	51.2	Low	119 Å²	119	136.3 Å²	136.3	73%	0.73	79%	0.787	S	S	*	*			trans	-76.9	101.8	160.1	53.3	0	0	0	0	108.2	V309	V309-T311 VanDerWaalsContact C-N 3.26Å; V309-T311 HydrophobicContact CG1-CG2 3.93Å; V309-T311 PolarHBondContact O-N 3.3Å
312	F	42.5	Very low	50.1	Low	175 Å²	175	134.6 Å²	134.6	77%	0.768	80%	0.801	S	S	*	*			trans	-63.3	126.4	162	-64.8	-90.4	0	0	0	108.9	T310 S314	T310-F312 PolarHBondContact O-N 3.23Å; F312-S314 PolarHBondContact O-N 3.1Å
313	P	48.1	Very low	49.5	Very low	130 Å²	130	137 Å²	137	84%	0.844	81%	0.811	S	S	*	*			trans	-76.2	112.2	161.4	18.4	-6.7	0	0	0	107.7
314	S	45.3	Very low	48.9	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	81%	0.81	S	S	*	*			trans	-81.4	116.2	162.4	28.7	0	0	0	0	107.7	F312	F312-S314 PolarHBondContact O-N 3.1Å
315	S	47.8	Very low	48.1	Very low	199 Å²	199	134.5 Å²	134.5	100%	1.392	81%	0.809	S	S	*	*			trans	-168.7	0	153.6	-72	0	0	0	0	109.1

Retrieved 315 of 315 residues in 263.6 ms (Link to these results)

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