A0A3B3UYL1_9TELE Loading...

Ras-related protein Rab-6B

The small GTPases Rab are key regulators of intracellular membrane trafficking, from the formation of transport vesicles to their fusion with membranes. Rabs cycle between active GTP-bound and inactive GDP-bound states. In their active state, drive transport of vesicular carriers from donor organelles to acceptor organelles to regulate the membrane traffic that maintains organelle identity and morphology. Recruits VPS13B to the Golgi membrane. Regulates the compacted morphology of the Golgi. Seems to have a role in retrograde membrane traffic at the level of the Golgi complex. May function in retrograde transport in neuronal cells. Plays a role in neuron projection development.

AlphaFold DB , UniProt , Accession A0A3B3UYL1, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 208 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.7	Very low	49.4	Very low	237 Å²	237	130.7 Å²	130.7	100%	1.167	77%	0.77	S	S	*	*				0	95.5	0	-68.1	178.6	-177.8	0	0	106.9
2	S	35.5	Very low	52.7	Low	126 Å²	126	132.9 Å²	132.9	88%	0.881	76%	0.755	S	S	*	*			trans	-92.2	107.5	-180	-57.4	0	0	0	0	107.9	G4	S2-G4 PolarHBondContact O-N 3.46Å; S2-G4 VanDerWaalsContact O-N 3.14Å
3	V	43.8	Very low	55.7	Low	142 Å²	142	132 Å²	132	86%	0.861	74%	0.738	S	S	*	*			trans	-75.9	99	172.9	-160.3	0	0	0	0	106.2	N5	V3-N5 PolarHBondContact O-N 2.74Å
4	G	40.5	Very low	58.5	Low	65 Å²	65	123.6 Å²	123.6	67%	0.67	69%	0.69	S	S	*	*			trans	-66.3	121.2	175.4	0	0	0	0	0	109.7	S2 D6	S2-G4 PolarHBondContact O-N 3.46Å; S2-G4 VanDerWaalsContact O-N 3.14Å; G4-D6 PolarHBondContact O-N 3.34Å; G4-D6 VanDerWaalsContact O-N 3.1Å
5	N	42	Very low	60.9	Low	131 Å²	131	116.8 Å²	116.8	70%	0.701	65%	0.65	S	S	*	*			trans	-76.6	89.1	179.9	-153.1	42.8	0	0	0	108.9	V3 F7	V3-N5 PolarHBondContact O-N 2.74Å; N5-F7 HydrophobicContact CB-CD2 4.42Å; N5-F7 VanDerWaalsContact ND2-CD2 3.29Å; N5-F7 WeakPolarHBondContact ND2-CD2 3.13Å; N5-F7 PolarHBondContact O-N 3.21Å; N5-F7 WeakPolarHBondContact OD1-CD2 3.45Å; N5-F7 WeakPolarHBondContact OD1-CE2 3.28Å
6	D	43.6	Very low	63.1	Low	169 Å²	169	109.5 Å²	109.5	90%	0.904	61%	0.609	S	S	*	*			trans	-77.3	48.8	-178.4	-121.1	-15.6	0	0	0	112.3	G4 G8	G4-D6 PolarHBondContact O-N 3.34Å; G4-D6 VanDerWaalsContact O-N 3.1Å; D6-G8 PolarHBondContact O-N 2.74Å; D6-G8 VanDerWaalsContact O-N 3.09Å
7	F	46.5	Very low	65.1	Low	175 Å²	175	103.1 Å²	103.1	77%	0.768	57%	0.573	S	S	*	*			trans	-79.2	93.6	175.2	-83.2	-92.7	0	0	0	110.7	N5	N5-F7 HydrophobicContact CB-CD2 4.42Å; N5-F7 VanDerWaalsContact ND2-CD2 3.29Å; N5-F7 WeakPolarHBondContact ND2-CD2 3.13Å; N5-F7 PolarHBondContact O-N 3.21Å; N5-F7 WeakPolarHBondContact OD1-CD2 3.45Å; N5-F7 WeakPolarHBondContact OD1-CE2 3.28Å
8	G	48.8	Very low	66.8	Low	63 Å²	63	97.3 Å²	97.3	65%	0.649	54%	0.542	S	S	*	.			trans	85.5	67.7	131.4	0	0	0	0	0	116.2	D6 P10	D6-G8 PolarHBondContact O-N 2.74Å; D6-G8 VanDerWaalsContact O-N 3.09Å; G8-P10 VanDerWaalsContact O-CD 3.29Å; G8-P10 WeakPolarHBondContact O-CD 3.12Å
9	N	56.2	Low	68.4	Low	156 Å²	156	92.2 Å²	92.2	83%	0.834	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-67.1	117.2	153.6	-151.9	-6.6	0	0	0	107.5	L11	N9-L11 PolarHBondContact O-N 3.42Å
10	P	70.6	Confident	69.7	Low	101 Å²	101	87.6 Å²	87.6	66%	0.656	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-59	128.1	-177.6	20.7	-30.7	0	0	0	109.9	G8 R12	G8-P10 VanDerWaalsContact O-CD 3.29Å; G8-P10 WeakPolarHBondContact O-CD 3.12Å; P10-R12 PolarHBondContact O-N 3.16Å
11	L	78.6	Confident	70.9	Confident	73 Å²	73	84.9 Å²	84.9	38%	0.382	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-47.6	127.6	176.5	-71	174.4	0	0	0	109.9	N9 K13 T54 T61 R63	N9-L11 PolarHBondContact O-N 3.42Å; L11-K13 WeakPolarHBondContact O-CG 3.25Å; L11-K13 PolarHBondContact O-N 3.07Å; L11-T54 HydrophobicContact CD1-CG2 4.07Å; L11-T61 HydrophobicContact CD1-CG2 4.31Å; L11-T61 HydrophobicContact CD2-CG2 3.63Å; L11-R63 HydrophobicContact CB-CB 4.29Å
12	R	88.3	Confident	73.5	Confident	157 Å²	157	77.1 Å²	77.1	59%	0.592	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-56.7	124	176.2	-75.8	-169.7	-175.4	-177	3.4	109.2	P10 F14 R63	P10-R12 PolarHBondContact O-N 3.16Å; R12-F14 HydrophobicContact CB-CE2 3.78Å; R12-F14 HydrophobicContact CB-CZ 4.18Å; R12-R63 PolarHBondContact O-N 3.13Å
13	K	92.1	Very high	76.2	Confident	121 Å²	121	73.8 Å²	73.8	53%	0.526	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.5	-179	-60.6	177	-172.3	169.4	0	109	L11 R63	L11-K13 WeakPolarHBondContact O-CG 3.25Å; L11-K13 PolarHBondContact O-N 3.07Å; K13-R63 CarbonylContact C-O 3.57Å; K13-R63 VanDerWaalsContact CA-O 3.29Å; K13-R63 WeakPolarHBondContact CA-O 3.47Å; K13-R63 HydrophobicContact CG-CB 4.27Å
14	F	94.4	Very high	78.7	Confident	15 Å²	15	67 Å²	67	7%	0.066	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.3	177.3	-65.1	-78.6	0	0	0	110.1	R12 L16 V62 R63 L64 Q65 T87 L174 P175	R12-F14 HydrophobicContact CB-CE2 3.78Å; R12-F14 HydrophobicContact CB-CZ 4.18Å; F14-L16 HydrophobicContact CB-CD1 4.28Å; F14-V62 HydrophobicContact CD2-CB 4.07Å; F14-V62 HydrophobicContact CD2-CG1 4.23Å; F14-V62 HydrophobicContact CE2-CB 4.12Å; F14-V62 HydrophobicContact CE2-CG1 3.78Å; F14-R63 PolarHBondContact N-O 3.18Å; F14-L64 HydrophobicContact CB-CD2 4.16Å; F14-Q65 PolarHBondContact O-N 3.27Å; F14-T87 HydrophobicContact CD1-CG2 3.95Å; F14-T87 HydrophobicContact CE1-CG2 4.49Å; F14-L174 HydrophobicContact CB-CD1 3.87Å; F14-L174 HydrophobicContact CB-CD2 4.03Å; F14-L174 HydrophobicContact CD1-CB 4.41Å; F14-L174 HydrophobicContact CD1-CD1 4.12Å; F14-L174 HydrophobicContact CD1-CD2 3.65Å; F14-L174 HydrophobicContact CD1-CG 4.28Å; F14-L174 HydrophobicContact CD2-CD1 3.62Å; F14-L174 HydrophobicContact CE1-CB 4.16Å; F14-L174 HydrophobicContact CE1-CD2 4.17Å; F14-L174 HydrophobicContact CE2-CB 4.49Å; F14-L174 HydrophobicContact CE2-CD1 4.07Å; F14-L174 HydrophobicContact CG-CD1 3.6Å; F14-L174 HydrophobicContact CG-CD2 3.87Å; F14-L174 HydrophobicContact CG-CG 4.25Å; F14-L174 HydrophobicContact CZ-CB 4.18Å; F14-L174 HydrophobicContact CZ-CD1 4.48Å; F14-P175 HydrophobicContact CE1-CG 4.18Å
15	K	95	Very high	81.4	Confident	21 Å²	21	64.5 Å²	64.5	9%	0.091	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	119.8	-178.3	-178.3	171.9	-179.7	-169.5	0	109.8	W67 Y82 D85 T87 V88	K15-W67 VanDerWaalsContact CE-NE1 3.33Å; K15-W67 VanDerWaalsContact CG-CD1 3.42Å; K15-W67 HydrophobicContact CG-CG 4.48Å; K15-Y82 WeakPolarHBondContact CE-O 3.04Å; K15-Y82 PolarHBondContact NZ-O 2.91Å; K15-D85 HydrophobicContact CD-CB 4Å; K15-D85 WeakPolarHBondContact CD-O 3.27Å; K15-D85 IonicContact NZ-OD2 3.55Å; K15-T87 PolarHBondContact O-N 3.41Å; K15-V88 PolarHBondContact O-N 3.38Å; K15-V88 VanDerWaalsContact O-N 3.11Å
16	L	96.7	Very high	83.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.1	175.7	-79.6	61	0	0	0	107.9	F14 F18 L64 Q65 L66 W67 V88 F167 V170	F14-L16 HydrophobicContact CB-CD1 4.28Å; L16-F18 HydrophobicContact CB-CE2 4.2Å; L16-L64 HydrophobicContact CD1-CD2 3.99Å; L16-L64 HydrophobicContact CD2-CD1 4.06Å; L16-Q65 PolarHBondContact N-O 2.87Å; L16-L66 HydrophobicContact CB-CD2 4.11Å; L16-L66 HydrophobicContact CD2-CD2 3.78Å; L16-W67 PolarHBondContact O-N 3.38Å; L16-V88 WeakPolarHBondContact CA-O 3.46Å; L16-V88 HydrophobicContact CD1-CB 4.18Å; L16-V88 HydrophobicContact CD1-CG2 4.16Å; L16-V88 HydrophobicContact CG-CB 3.89Å; L16-V88 HydrophobicContact CG-CG1 4.26Å; L16-V88 HydrophobicContact CG-CG2 4.32Å; L16-F167 HydrophobicContact CD2-CD1 4.13Å; L16-F167 HydrophobicContact CD2-CE1 4.05Å; L16-V170 HydrophobicContact CD2-CG1 3.97Å; L16-V170 HydrophobicContact CG-CG1 4.3Å
17	V	95.9	Very high	86.4	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	132.6	171.3	65.1	0	0	0	0	110.2	L19 W67 T69 I83 S86 V88 A89 V90	V17-L19 HydrophobicContact CG1-CD1 4.27Å; V17-L19 HydrophobicContact CG1-CG 4.29Å; V17-L19 HydrophobicContact CG2-CD2 3.82Å; V17-L19 HydrophobicContact CG2-CG 4.14Å; V17-W67 HydrophobicContact CG2-CB 4.41Å; V17-T69 HydrophobicContact CG2-CG2 3.79Å; V17-I83 HydrophobicContact CG1-CG1 4.45Å; V17-S86 WeakPolarHBondContact CB-OG 3.41Å; V17-S86 WeakPolarHBondContact CG1-OG 3.48Å; V17-V88 PolarHBondContact N-O 2.57Å; V17-A89 HydrophobicContact CG1-CB 4.09Å; V17-V90 PolarHBondContact O-N 3.3Å
18	F	96.8	Very high	88.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.3	175.5	-74.6	-106.2	0	0	0	109.3	L16 K26 I30 L66 W67 T69 V90 V92 F167	L16-F18 HydrophobicContact CB-CE2 4.2Å; F18-K26 HydrophobicContact CB-CB 4.19Å; F18-K26 HydrophobicContact CB-CD 4.19Å; F18-K26 HydrophobicContact CB-CG 4.42Å; F18-I30 HydrophobicContact CB-CD1 4.22Å; F18-I30 HydrophobicContact CD1-CD1 4.17Å; F18-I30 HydrophobicContact CD1-CG1 4.06Å; F18-I30 HydrophobicContact CD2-CD1 3.63Å; F18-I30 HydrophobicContact CD2-CG1 3.95Å; F18-I30 HydrophobicContact CE1-CG1 3.95Å; F18-I30 HydrophobicContact CE2-CD1 4.04Å; F18-I30 HydrophobicContact CE2-CG1 3.86Å; F18-I30 HydrophobicContact CG-CD1 3.73Å; F18-I30 HydrophobicContact CG-CG1 4.07Å; F18-I30 HydrophobicContact CZ-CD1 4.47Å; F18-I30 HydrophobicContact CZ-CG1 3.87Å; F18-L66 HydrophobicContact CE2-CB 4.34Å; F18-L66 HydrophobicContact CE2-CD2 4.11Å; F18-W67 PolarHBondContact N-O 3.43Å; F18-T69 WeakPolarHBondContact O-CB 3.31Å; F18-T69 WeakPolarHBondContact O-CG2 3.33Å; F18-T69 PolarHBondContact O-OG1 3.15Å; F18-V90 WeakPolarHBondContact CA-O 3.18Å; F18-V90 HydrophobicContact CD1-CB 3.93Å; F18-V90 HydrophobicContact CD1-CG1 3.94Å; F18-V90 HydrophobicContact CE1-CB 3.94Å; F18-V90 HydrophobicContact CE1-CG1 3.77Å; F18-V90 HydrophobicContact CE1-CG2 4.19Å; F18-V90 HydrophobicContact CE2-CG2 4.4Å; F18-V90 HydrophobicContact CG-CB 4.29Å; F18-V90 HydrophobicContact CZ-CB 4.28Å; F18-V90 HydrophobicContact CZ-CG1 4.45Å; F18-V90 HydrophobicContact CZ-CG2 4.06Å; F18-V92 HydrophobicContact CD1-CG2 4.37Å; F18-F167 HydrophobicContact CE1-CZ 4.27Å; F18-F167 HydrophobicContact CE2-CE1 4.48Å; F18-F167 AromaticContact CZ-CE1 3.78Å; F18-F167 HydrophobicContact CZ-CE1 3.78Å; F18-F167 AromaticContact CZ-CZ 3.6Å; F18-F167 HydrophobicContact CZ-CZ 3.6Å
19	L	96	Very high	91	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	160.1	-176	-58.9	175.3	0	0	0	110.6	V17 K26 T69 I79 I83 V90 V91 V92 W107 V111	V17-L19 HydrophobicContact CG1-CD1 4.27Å; V17-L19 HydrophobicContact CG1-CG 4.29Å; V17-L19 HydrophobicContact CG2-CD2 3.82Å; V17-L19 HydrophobicContact CG2-CG 4.14Å; L19-K26 VanDerWaalsContact C-CD 3.49Å; L19-K26 WeakPolarHBondContact O-CD 3.41Å; L19-T69 HydrophobicContact CD2-CG2 4.17Å; L19-I79 HydrophobicContact CD2-CG2 3.54Å; L19-I83 HydrophobicContact CD1-CD1 3.96Å; L19-I83 HydrophobicContact CD1-CG1 4.13Å; L19-V90 PolarHBondContact N-O 3.42Å; L19-V91 HydrophobicContact CB-CG2 4.45Å; L19-V92 PolarHBondContact O-N 3.04Å; L19-W107 HydrophobicContact CB-CD2 4.35Å; L19-W107 HydrophobicContact CB-CE3 4.24Å; L19-W107 HydrophobicContact CD2-CE3 4.44Å; L19-W107 HydrophobicContact CD2-CZ3 4.41Å; L19-V111 HydrophobicContact CD1-CG2 3.33Å
20	G	95.6	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.			trans	136.8	168.3	-176.2	0	0	0	0	0	112	K26 G71 V92	G20-K26 PolarHBondContact O-NZ 3.35Å; G20-G71 WeakPolarHBondContact O-CA 3.45Å; G20-V92 WeakPolarHBondContact CA-O 3.29Å
21	E	94.1	Very high	94.1	Very high	30 Å²	30	33.1 Å²	33.1	14%	0.14	17%	0.167	C	C	.	.	S	Bend	trans	-62.2	166.7	-179.3	-66.6	-60.6	122.6	0	0	112.8	V24 K26 R76 Q103 W107	E21-V24 HydrophobicContact CB-CG1 3.98Å; E21-V24 VanDerWaalsContact O-CG2 3.25Å; E21-V24 WeakPolarHBondContact O-CG2 3.14Å; E21-K26 PolarHBondContact O-NZ 3.46Å; E21-R76 IonicContact OE1-CZ 3.51Å; E21-R76 IonicContact OE1-NH1 3.68Å; E21-R76 IonicContact OE1-NH2 3.42Å; E21-R76 PolarHBondContact OE1-NH2 3.24Å; E21-Q103 HydrophobicContact CG-CB 3.79Å; E21-Q103 HydrophobicContact CG-CG 3.96Å; E21-Q103 PolarHBondContact OE1-NE2 2.73Å; E21-W107 PolarHBondContact OE1-NE1 2.78Å
22	Q	92.1	Very high	94.9	Very high	74 Å²	74	31.3 Å²	31.3	35%	0.346	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	147.8	173.5	-172.2	175.6	13.3	0	0	110.4	V24 Y42 G71 Q72	Q22-V24 PolarHBondContact O-N 3.25Å; Q22-V24 VanDerWaalsContact O-N 3.12Å; Q22-Y42 VanDerWaalsContact CG-OH 3.24Å; Q22-Y42 WeakPolarHBondContact CG-OH 3.38Å; Q22-Y42 PolarHBondContact NE2-OH 2.66Å; Q22-G71 PolarHBondContact N-O 3.46Å; Q22-G71 VanDerWaalsContact N-O 3.15Å; Q22-Q72 HydrophobicContact CG-CG 4.29Å
23	S	93.1	Very high	95.3	Very high	56 Å²	56	24.9 Å²	24.9	39%	0.392	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	3.5	174.5	79.6	0	0	0	0	117.6	G25 K127	S23-G25 PolarHBondContact O-N 3.42Å; S23-K127 VanDerWaalsContact O-CE 3.29Å; S23-K127 WeakPolarHBondContact O-CE 3.46Å; S23-K127 PolarHBondContact O-NZ 3.24Å
24	V	96.3	Very high	95.3	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	11%	0.113	C	C	.	.	S	Bend	trans	-68.6	-15.3	175.6	-56.9	0	0	0	0	113.7	E21 Q22 K26 V92 D94 N126	E21-V24 HydrophobicContact CB-CG1 3.98Å; E21-V24 VanDerWaalsContact O-CG2 3.25Å; E21-V24 WeakPolarHBondContact O-CG2 3.14Å; Q22-V24 PolarHBondContact O-N 3.25Å; Q22-V24 VanDerWaalsContact O-N 3.12Å; V24-K26 HydrophobicContact CG2-CD 4.41Å; V24-K26 HydrophobicContact CG2-CG 3.76Å; V24-V92 HydrophobicContact CB-CG1 4.29Å; V24-V92 HydrophobicContact CG2-CB 3.92Å; V24-V92 HydrophobicContact CG2-CG1 3.91Å; V24-D94 HydrophobicContact CB-CB 4.38Å; V24-D94 HydrophobicContact CG1-CB 4.31Å; V24-N126 PolarHBondContact O-ND2 2.83Å
25	G	95.6	Very high	95.3	Very high	12 Å²	12	26.7 Å²	26.7	12%	0.124	14%	0.137	C	C	.	.	S	Bend	trans	99.9	26.7	173.5	0	0	0	0	0	115.9	S23 S28 L29	S23-G25 PolarHBondContact O-N 3.42Å; G25-S28 PolarHBondContact O-N 2.79Å; G25-L29 WeakPolarHBondContact O-CG 3.16Å; G25-L29 PolarHBondContact O-N 3.47Å
26	K	96.1	Very high	95.2	Very high	9 Å²	9	29.7 Å²	29.7	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-53.5	-56.2	174.1	-60.3	-174	-64.1	-80.7	0	112.2	F18 L19 G20 E21 V24 S28 L29 I30 T69 V92	F18-K26 HydrophobicContact CB-CB 4.19Å; F18-K26 HydrophobicContact CB-CD 4.19Å; F18-K26 HydrophobicContact CB-CG 4.42Å; L19-K26 VanDerWaalsContact C-CD 3.49Å; L19-K26 WeakPolarHBondContact O-CD 3.41Å; G20-K26 PolarHBondContact O-NZ 3.35Å; E21-K26 PolarHBondContact O-NZ 3.46Å; V24-K26 HydrophobicContact CG2-CD 4.41Å; V24-K26 HydrophobicContact CG2-CG 3.76Å; K26-S28 VanDerWaalsContact C-N 3.32Å; K26-S28 PolarHBondContact O-N 3.28Å; K26-L29 WeakPolarHBondContact O-CB 3.11Å; K26-L29 PolarHBondContact O-N 3.49Å; K26-L29 VanDerWaalsContact O-N 3.14Å; K26-I30 WeakPolarHBondContact O-CG1 3.3Å; K26-I30 PolarHBondContact O-N 2.93Å; K26-T69 WeakPolarHBondContact CE-O 3.3Å; K26-V92 HydrophobicContact CG-CB 4.08Å; K26-V92 HydrophobicContact CG-CG2 4.05Å
27	T	95.2	Very high	94.9	Very high	49 Å²	49	32.2 Å²	32.2	30%	0.301	17%	0.172	S	C	.	.	H	α-helix	trans	-56.9	-44.8	176	-44.1	0	0	0	0	111.5	L29 I30 T31 T45 D68	T27-L29 VanDerWaalsContact C-N 3.34Å; T27-L29 PolarHBondContact O-N 2.82Å; T27-I30 PolarHBondContact O-N 3.47Å; T27-T31 WeakPolarHBondContact O-CB 3.2Å; T27-T31 PolarHBondContact O-N 3.16Å; T27-T31 PolarHBondContact O-OG1 2.91Å; T27-T45 PolarHBondContact OG1-OG1 3.24Å; T27-D68 VanDerWaalsContact CB-OD2 3.26Å; T27-D68 WeakPolarHBondContact CB-OD2 3.43Å; T27-D68 WeakPolarHBondContact CG2-OD2 3.31Å; T27-D68 PolarHBondContact N-OD1 2.91Å; T27-D68 PolarHBondContact OG1-OD1 3.41Å; T27-D68 PolarHBondContact OG1-OD2 2.93Å
28	S	96.2	Very high	94.7	Very high	37 Å²	37	35.3 Å²	35.3	26%	0.259	19%	0.185	S	C	.	.	H	α-helix	trans	-63.1	-37.9	178.3	-50.8	0	0	0	0	112.7	G25 K26 R32	G25-S28 PolarHBondContact O-N 2.79Å; K26-S28 VanDerWaalsContact C-N 3.32Å; K26-S28 PolarHBondContact O-N 3.28Å; S28-R32 WeakPolarHBondContact O-CB 3.5Å; S28-R32 PolarHBondContact O-N 2.98Å
29	L	97.3	Very high	94.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-43.6	174.5	-76.7	170	0	0	0	111.4	G25 K26 T27 F33 V92 V124 N126 T155 A157 V163	G25-L29 WeakPolarHBondContact O-CG 3.16Å; G25-L29 PolarHBondContact O-N 3.47Å; K26-L29 WeakPolarHBondContact O-CB 3.11Å; K26-L29 PolarHBondContact O-N 3.49Å; K26-L29 VanDerWaalsContact O-N 3.14Å; T27-L29 VanDerWaalsContact C-N 3.34Å; T27-L29 PolarHBondContact O-N 2.82Å; L29-F33 WeakPolarHBondContact O-CB 3.35Å; L29-F33 PolarHBondContact O-N 2.79Å; L29-V92 HydrophobicContact CD1-CG1 3.86Å; L29-V92 HydrophobicContact CD1-CG2 4.01Å; L29-V124 HydrophobicContact CD1-CG1 4.16Å; L29-N126 HydrophobicContact CD1-CB 4.36Å; L29-T155 WeakPolarHBondContact CD2-OG1 3.46Å; L29-A157 HydrophobicContact CD2-CB 3.91Å; L29-A157 HydrophobicContact CG-CB 4.1Å; L29-V163 HydrophobicContact CD2-CG2 3.79Å
30	I	95.6	Very high	93.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-52	176.8	-66.2	167.5	0	0	0	110	F18 K26 T27 R32 F33 M34 L51 L66 D68	F18-I30 HydrophobicContact CB-CD1 4.22Å; F18-I30 HydrophobicContact CD1-CD1 4.17Å; F18-I30 HydrophobicContact CD1-CG1 4.06Å; F18-I30 HydrophobicContact CD2-CD1 3.63Å; F18-I30 HydrophobicContact CD2-CG1 3.95Å; F18-I30 HydrophobicContact CE1-CG1 3.95Å; F18-I30 HydrophobicContact CE2-CD1 4.04Å; F18-I30 HydrophobicContact CE2-CG1 3.86Å; F18-I30 HydrophobicContact CG-CD1 3.73Å; F18-I30 HydrophobicContact CG-CG1 4.07Å; F18-I30 HydrophobicContact CZ-CD1 4.47Å; F18-I30 HydrophobicContact CZ-CG1 3.87Å; K26-I30 WeakPolarHBondContact O-CG1 3.3Å; K26-I30 PolarHBondContact O-N 2.93Å; T27-I30 PolarHBondContact O-N 3.47Å; I30-R32 VanDerWaalsContact C-N 3.33Å; I30-R32 PolarHBondContact O-N 3.24Å; I30-F33 PolarHBondContact O-N 3.2Å; I30-F33 VanDerWaalsContact O-N 3.1Å; I30-M34 HydrophobicContact CG2-CG 4.06Å; I30-M34 WeakPolarHBondContact O-CB 3.46Å; I30-M34 WeakPolarHBondContact O-CG 3.32Å; I30-M34 PolarHBondContact O-N 3.11Å; I30-L51 HydrophobicContact CG2-CB 4.48Å; I30-L51 HydrophobicContact CG2-CD1 3.97Å; I30-L51 HydrophobicContact CG2-CD2 4.31Å; I30-L51 HydrophobicContact CG2-CG 4.49Å; I30-L66 HydrophobicContact CG2-CB 4.35Å; I30-L66 HydrophobicContact CG2-CD1 3.86Å; I30-D68 HydrophobicContact CD1-CB 3.46Å; I30-D68 VanDerWaalsContact CD1-CB 3.46Å
31	T	94.6	Very high	92.9	Very high	39 Å²	39	50.2 Å²	50.2	24%	0.239	27%	0.268	C	S	.	.	H	α-helix	trans	-56.7	-45.7	177.6	-61.5	0	0	0	0	111.6	T27 F33 M34 Y35	T27-T31 WeakPolarHBondContact O-CB 3.2Å; T27-T31 PolarHBondContact O-N 3.16Å; T27-T31 PolarHBondContact O-OG1 2.91Å; T31-F33 VanDerWaalsContact C-N 3.32Å; T31-F33 PolarHBondContact O-N 3Å; T31-M34 PolarHBondContact O-N 3.11Å; T31-Y35 HydrophobicContact CG2-CD2 3.97Å; T31-Y35 PolarHBondContact O-N 2.77Å
32	R	96.6	Very high	92	Very high	35 Å²	35	55.2 Å²	55.2	13%	0.132	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-43.1	176.1	174.5	56	70.7	-175.4	-2	111.5	S28 I30 D36 S37 A157 K158 V163	S28-R32 WeakPolarHBondContact O-CB 3.5Å; S28-R32 PolarHBondContact O-N 2.98Å; I30-R32 VanDerWaalsContact C-N 3.33Å; I30-R32 PolarHBondContact O-N 3.24Å; R32-D36 WeakPolarHBondContact CD-OD1 3.46Å; R32-D36 IonicContact CZ-OD1 2.75Å; R32-D36 PolarHBondContact NH1-O 3.2Å; R32-D36 IonicContact NH1-OD1 3.76Å; R32-D36 PolarHBondContact NH1-OD1 2.92Å; R32-D36 WeakPolarHBondContact O-CA 3.46Å; R32-D36 PolarHBondContact O-N 2.93Å; R32-S37 VanDerWaalsContact CA-O 3.31Å; R32-S37 WeakPolarHBondContact CA-O 3.37Å; R32-S37 PolarHBondContact NE-O 3.06Å; R32-A157 PolarHBondContact NE-O 3.3Å; R32-K158 PolarHBondContact NH2-O 2.91Å; R32-V163 HydrophobicContact CB-CG1 4.39Å; R32-V163 HydrophobicContact CG-CB 4.1Å; R32-V163 HydrophobicContact CG-CG1 3.94Å; R32-V163 HydrophobicContact CG-CG2 3.89Å
33	F	95.9	Very high	91.4	Very high	22 Å²	22	58.7 Å²	58.7	10%	0.096	30%	0.303	C	S	.	.	H	α-helix	trans	-68.1	-38.7	176.5	174.5	-113.9	0	0	0	113	L29 I30 T31 K53 M55 L64 L66 V163 F167	L29-F33 WeakPolarHBondContact O-CB 3.35Å; L29-F33 PolarHBondContact O-N 2.79Å; I30-F33 PolarHBondContact O-N 3.2Å; I30-F33 VanDerWaalsContact O-N 3.1Å; T31-F33 VanDerWaalsContact C-N 3.32Å; T31-F33 PolarHBondContact O-N 3Å; F33-K53 HydrophobicContact CD1-CD 4.24Å; F33-K53 HydrophobicContact CE1-CB 4.16Å; F33-K53 HydrophobicContact CE1-CD 3.78Å; F33-K53 HydrophobicContact CE1-CG 4.24Å; F33-K53 HydrophobicContact CZ-CD 4.01Å; F33-K53 HydrophobicContact CZ-CG 4.42Å; F33-K53 PolarHBondContact O-NZ 2.9Å; F33-M55 HydrophobicContact CE2-SD 4.13Å; F33-M55 HydrophobicContact CZ-CG 3.86Å; F33-M55 HydrophobicContact CZ-SD 3.58Å; F33-M55 VanDerWaalsContact CZ-SD 3.58Å; F33-L64 HydrophobicContact CE1-CD1 4.44Å; F33-L64 HydrophobicContact CZ-CD1 4.4Å; F33-L66 HydrophobicContact CD1-CD1 3.83Å; F33-L66 HydrophobicContact CE1-CD1 4.14Å; F33-V163 HydrophobicContact CB-CG1 3.99Å; F33-F167 HydrophobicContact CB-CD2 3.8Å; F33-F167 HydrophobicContact CB-CE2 3.28Å; F33-F167 HydrophobicContact CB-CZ 3.73Å; F33-F167 AromaticContact CD1-CD1 3.92Å; F33-F167 HydrophobicContact CD1-CD1 3.92Å; F33-F167 AromaticContact CD1-CD2 3.99Å; F33-F167 HydrophobicContact CD1-CD2 3.99Å; F33-F167 AromaticContact CD1-CE1 3.68Å; F33-F167 HydrophobicContact CD1-CE1 3.68Å; F33-F167 AromaticContact CD1-CE2 3.81Å; F33-F167 HydrophobicContact CD1-CE2 3.81Å; F33-F167 HydrophobicContact CD1-CG 4.06Å; F33-F167 AromaticContact CD1-CZ 3.62Å; F33-F167 HydrophobicContact CD1-CZ 3.62Å; F33-F167 HydrophobicContact CD2-CB 4.06Å; F33-F167 HydrophobicContact CD2-CD1 4.3Å; F33-F167 AromaticContact CD2-CD2 3.25Å; F33-F167 HydrophobicContact CD2-CD2 3.25Å; F33-F167 AromaticContact CD2-CE2 3.72Å; F33-F167 HydrophobicContact CD2-CE2 3.72Å; F33-F167 AromaticContact CD2-CG 3.61Å; F33-F167 HydrophobicContact CD2-CG 3.61Å; F33-F167 HydrophobicContact CD2-CZ 4.36Å; F33-F167 AromaticContact CE1-CD1 3.79Å; F33-F167 HydrophobicContact CE1-CD1 3.79Å; F33-F167 HydrophobicContact CE1-CD2 4.41Å; F33-F167 AromaticContact CE1-CE1 3.92Å; F33-F167 HydrophobicContact CE1-CE1 3.92Å; F33-F167 HydrophobicContact CE1-CG 4.04Å; F33-F167 HydrophobicContact CE1-CZ 4.32Å; F33-F167 HydrophobicContact CE2-CB 3.65Å; F33-F167 HydrophobicContact CE2-CD1 4.19Å; F33-F167 AromaticContact CE2-CD2 3.77Å; F33-F167 HydrophobicContact CE2-CD2 3.77Å; F33-F167 AromaticContact CE2-CG 3.59Å; F33-F167 HydrophobicContact CE2-CG 3.59Å; F33-F167 HydrophobicContact CG-CD1 4.17Å; F33-F167 AromaticContact CG-CD2 3.39Å; F33-F167 HydrophobicContact CG-CD2 3.39Å; F33-F167 HydrophobicContact CG-CE1 4.06Å; F33-F167 AromaticContact CG-CE2 3.31Å; F33-F167 HydrophobicContact CG-CE2 3.31Å; F33-F167 AromaticContact CG-CG 3.85Å; F33-F167 HydrophobicContact CG-CG 3.85Å; F33-F167 AromaticContact CG-CZ 3.64Å; F33-F167 HydrophobicContact CG-CZ 3.64Å; F33-F167 HydrophobicContact CZ-CB 4Å; F33-F167 AromaticContact CZ-CD1 3.94Å; F33-F167 HydrophobicContact CZ-CD1 3.94Å; F33-F167 HydrophobicContact CZ-CD2 4.32Å; F33-F167 AromaticContact CZ-CG 3.82Å; F33-F167 HydrophobicContact CZ-CG 3.82Å
34	M	93.1	Very high	90.9	Very high	28 Å²	28	57.7 Å²	57.7	14%	0.138	30%	0.298	C	S	.	.	H	α-helix	trans	-70.7	-48.6	-177.5	-71.2	-59.8	-64.9	0	0	112.2	I30 T31 L51 K53 L66	I30-M34 HydrophobicContact CG2-CG 4.06Å; I30-M34 WeakPolarHBondContact O-CB 3.46Å; I30-M34 WeakPolarHBondContact O-CG 3.32Å; I30-M34 PolarHBondContact O-N 3.11Å; T31-M34 PolarHBondContact O-N 3.11Å; M34-L51 HydrophobicContact CE-CB 4.25Å; M34-L51 HydrophobicContact CE-CD2 4.33Å; M34-L51 HydrophobicContact CG-CB 4.48Å; M34-L51 HydrophobicContact CG-CD2 3.93Å; M34-L51 HydrophobicContact SD-CB 4.34Å; M34-K53 HydrophobicContact CE-CB 4.04Å; M34-K53 HydrophobicContact CE-CD 4.34Å; M34-K53 PolarHBondContact O-NZ 3.5Å; M34-K53 HydrophobicContact SD-CB 3.59Å; M34-K53 VanDerWaalsContact SD-CB 3.59Å; M34-K53 HydrophobicContact SD-CD 3.69Å; M34-K53 HydrophobicContact SD-CG 4.25Å; M34-L66 HydrophobicContact CG-CD1 4.18Å; M34-L66 HydrophobicContact SD-CD1 3.71Å
35	Y	93.2	Very high	90	Very high	146 Å²	146	59.1 Å²	59.1	57%	0.573	31%	0.307	S	S	*	.	H	α-helix	trans	-122.2	-0.9	-164.3	-50.8	-61.1	0	0	0	114.3	T31 S37 L51	T31-Y35 HydrophobicContact CG2-CD2 3.97Å; T31-Y35 PolarHBondContact O-N 2.77Å; Y35-S37 PolarHBondContact O-N 3.26Å; Y35-L51 HydrophobicContact CE2-CD2 4.31Å
36	D	93	Very high	89.2	Confident	85 Å²	85	65.4 Å²	65.4	46%	0.455	34%	0.336	S	S	.	.	S	Bend	trans	50	40	-171.5	-145.5	-8.3	0	0	0	112.8	R32 K164	R32-D36 WeakPolarHBondContact CD-OD1 3.46Å; R32-D36 IonicContact CZ-OD1 2.75Å; R32-D36 PolarHBondContact NH1-O 3.2Å; R32-D36 IonicContact NH1-OD1 3.76Å; R32-D36 PolarHBondContact NH1-OD1 2.92Å; R32-D36 WeakPolarHBondContact O-CA 3.46Å; R32-D36 PolarHBondContact O-N 2.93Å; D36-K164 IonicContact OD2-NZ 2.74Å; D36-K164 PolarHBondContact OD2-NZ 3.4Å
37	S	91.5	Very high	88.4	Confident	52 Å²	52	65.5 Å²	65.5	36%	0.364	34%	0.34	S	S	.	.			trans	-129.3	162.9	179.6	69.3	0	0	0	0	111.7	R32 Y35	R32-S37 VanDerWaalsContact CA-O 3.31Å; R32-S37 WeakPolarHBondContact CA-O 3.37Å; R32-S37 PolarHBondContact NE-O 3.06Å; Y35-S37 PolarHBondContact O-N 3.26Å
38	F	90.8	Very high	87.7	Confident	65 Å²	65	65 Å²	65	29%	0.285	34%	0.335	S	S	.	.			trans	-140.9	132.8	174	179.3	-94.7	0	0	0	109.3	N40 A157 K158	F38-N40 VanDerWaalsContact CE1-OD1 3.27Å; F38-N40 WeakPolarHBondContact CE1-OD1 3.28Å; F38-A157 HydrophobicContact CD2-CB 4.26Å; F38-A157 HydrophobicContact CE2-CB 4.25Å; F38-K158 HydrophobicContact CD1-CB 4.35Å; F38-K158 HydrophobicContact CD1-CG 3.98Å; F38-K158 HydrophobicContact CD2-CB 4.26Å; F38-K158 HydrophobicContact CE1-CB 4.18Å; F38-K158 HydrophobicContact CE1-CD 4.49Å; F38-K158 HydrophobicContact CE1-CG 3.87Å; F38-K158 HydrophobicContact CE2-CB 4.09Å; F38-K158 HydrophobicContact CG-CB 4.38Å; F38-K158 HydrophobicContact CG-CG 4.42Å; F38-K158 HydrophobicContact CZ-CB 4.05Å; F38-K158 HydrophobicContact CZ-CG 4.23Å
39	D	86.5	Confident	87.3	Confident	95 Å²	95	67.4 Å²	67.4	51%	0.508	35%	0.345	S	S	.	.			trans	-98.7	126	174.7	-166.7	-18	0	0	0	109.5	T41	D39-T41 VanDerWaalsContact C-N 3.3Å; D39-T41 PolarHBondContact OD1-N 2.83Å; D39-T41 PolarHBondContact OD1-OG1 3.09Å; D39-T41 PolarHBondContact OD2-OG1 3.17Å
40	N	82.3	Confident	87	Confident	132 Å²	132	71.5 Å²	71.5	71%	0.706	36%	0.363	S	S	*	.	S	Bend	trans	-78.2	-18	176.3	-72.2	-47.6	0	0	0	112.3	F38 Y42	F38-N40 VanDerWaalsContact CE1-OD1 3.27Å; F38-N40 WeakPolarHBondContact CE1-OD1 3.28Å; N40-Y42 PolarHBondContact O-N 3.16Å
41	T	82.6	Confident	86.8	Confident	86 Å²	86	72.6 Å²	72.6	53%	0.528	37%	0.369	S	S	.	.	S	Bend	trans	-80.8	116.2	175.5	54.8	0	0	0	0	110.1	D39 Q43	D39-T41 VanDerWaalsContact C-N 3.3Å; D39-T41 PolarHBondContact OD1-N 2.83Å; D39-T41 PolarHBondContact OD1-OG1 3.09Å; D39-T41 PolarHBondContact OD2-OG1 3.17Å; T41-Q43 PolarHBondContact O-N 2.83Å
42	Y	75.4	Confident	86.8	Confident	135 Å²	135	72.2 Å²	72.2	53%	0.529	37%	0.368	S	S	.	.			trans	-70.5	118.5	175	173.9	-106.5	0	0	0	109.9	Q22 N40 A44	Q22-Y42 VanDerWaalsContact CG-OH 3.24Å; Q22-Y42 WeakPolarHBondContact CG-OH 3.38Å; Q22-Y42 PolarHBondContact NE2-OH 2.66Å; N40-Y42 PolarHBondContact O-N 3.16Å; Y42-A44 HydrophobicContact CE1-CB 4.22Å
43	Q	78.9	Confident	86.6	Confident	148 Å²	148	73.8 Å²	73.8	69%	0.692	38%	0.376	S	S	*	.			trans	-119	122.2	169	-66.3	-63.8	-22.5	0	0	108.3	T41 T45	T41-Q43 PolarHBondContact O-N 2.83Å; Q43-T45 PolarHBondContact O-N 3.02Å
44	A	81.3	Confident	86.5	Confident	35 Å²	35	75 Å²	75	29%	0.289	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-72	124.8	177.3	0	0	0	0	0	109.7	Y42 I46	Y42-A44 HydrophobicContact CE1-CB 4.22Å; A44-I46 PolarHBondContact O-N 2.98Å
45	T	78.4	Confident	86.4	Confident	31 Å²	31	74.7 Å²	74.7	19%	0.19	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-60.4	128.2	171.8	-46.5	0	0	0	0	109.8	T27 Q43 D68 A70	T27-T45 PolarHBondContact OG1-OG1 3.24Å; Q43-T45 PolarHBondContact O-N 3.02Å; T45-D68 PolarHBondContact OG1-OD2 3.03Å; T45-A70 WeakPolarHBondContact O-CB 3.44Å
46	I	79.1	Confident	86.2	Confident	143 Å²	143	76.5 Å²	76.5	73%	0.733	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-99.8	121.1	175.2	-58.9	178.7	0	0	0	107.3	A44 I48 F75	A44-I46 PolarHBondContact O-N 2.98Å; I46-I48 PolarHBondContact O-N 2.89Å; I46-F75 HydrophobicContact CG2-CE2 4.48Å; I46-F75 HydrophobicContact CG2-CZ 3.92Å
47	G	78.1	Confident	85.8	Confident	12 Å²	12	74.2 Å²	74.2	12%	0.124	38%	0.378	C	S	.	.	S	Bend	trans	69.5	-126.7	-178.9	0	0	0	0	0	112.8	A70	G47-A70 WeakPolarHBondContact O-CB 3.12Å; G47-A70 PolarHBondContact O-N 3.44Å
48	I	82	Confident	85.3	Confident	39 Å²	39	81.6 Å²	81.6	20%	0.2	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.3	-173.9	-65.6	171.9	0	0	0	108.5	I46 W67 D68 T69 L78 Y82	I46-I48 PolarHBondContact O-N 2.89Å; I48-W67 HydrophobicContact CG2-CE3 3.9Å; I48-D68 CarbonylContact C-O 3.47Å; I48-D68 VanDerWaalsContact CA-O 3.26Å; I48-D68 WeakPolarHBondContact CA-O 3.43Å; I48-D68 WeakPolarHBondContact CG2-O 3.35Å; I48-T69 HydrophobicContact CD1-CG2 4.46Å; I48-T69 HydrophobicContact CG1-CG2 4.35Å; I48-L78 HydrophobicContact CD1-CB 4.16Å; I48-Y82 HydrophobicContact CB-CE1 4.49Å; I48-Y82 HydrophobicContact CD1-CD1 4.23Å; I48-Y82 HydrophobicContact CD1-CD2 3.24Å; I48-Y82 HydrophobicContact CD1-CE1 4.03Å; I48-Y82 HydrophobicContact CD1-CE2 3.03Å; I48-Y82 HydrophobicContact CD1-CG 3.86Å; I48-Y82 VanDerWaalsContact CD1-CZ 3.44Å; I48-Y82 HydrophobicContact CG1-CE2 4.38Å; I48-Y82 HydrophobicContact CG2-CD1 4.08Å; I48-Y82 HydrophobicContact CG2-CE1 3.78Å
49	D	87.1	Confident	84.7	Confident	87 Å²	87	82 Å²	82	47%	0.465	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	153	176.8	-163.7	11.6	0	0	0	111.1	L51 W67 D68	D49-L51 HydrophobicContact CB-CD1 4.46Å; D49-W67 WeakPolarHBondContact O-CA 3.49Å; D49-D68 HydrophobicContact CB-CB 4.24Å; D49-D68 PolarHBondContact N-O 2.94Å; D49-D68 PolarHBondContact O-N 3.34Å
50	F	90.1	Very high	84.6	Confident	85 Å²	85	79.3 Å²	79.3	37%	0.373	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.2	-177.8	168.7	-97.7	0	0	0	110.7	Q65 L66 W67	F50-Q65 HydrophobicContact CE2-CB 3.75Å; F50-Q65 HydrophobicContact CE2-CG 3.72Å; F50-Q65 HydrophobicContact CZ-CB 4.48Å; F50-Q65 HydrophobicContact CZ-CG 4Å; F50-L66 WeakPolarHBondContact CA-O 3.44Å; F50-W67 HydrophobicContact CB-CE3 4.25Å; F50-W67 HydrophobicContact CB-CZ3 4.17Å; F50-W67 HydrophobicContact CD2-CD2 4.05Å; F50-W67 AromaticContact CD2-CE2 3.68Å; F50-W67 HydrophobicContact CD2-CE3 4.35Å; F50-W67 HydrophobicContact CD2-CH2 4.15Å; F50-W67 AromaticContact CD2-CZ2 3.8Å; F50-W67 HydrophobicContact CD2-CZ2 3.8Å; F50-W67 HydrophobicContact CD2-CZ3 4.36Å; F50-W67 AromaticContact CD2-NE1 3.95Å; F50-W67 HydrophobicContact CE2-CZ2 4.22Å
51	L	93.2	Very high	84.9	Confident	25 Å²	25	75.5 Å²	75.5	13%	0.131	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.6	172.8	-64.1	95.2	0	0	0	110.1	I30 M34 Y35 D49 L66	I30-L51 HydrophobicContact CG2-CB 4.48Å; I30-L51 HydrophobicContact CG2-CD1 3.97Å; I30-L51 HydrophobicContact CG2-CD2 4.31Å; I30-L51 HydrophobicContact CG2-CG 4.49Å; M34-L51 HydrophobicContact CE-CB 4.25Å; M34-L51 HydrophobicContact CE-CD2 4.33Å; M34-L51 HydrophobicContact CG-CB 4.48Å; M34-L51 HydrophobicContact CG-CD2 3.93Å; M34-L51 HydrophobicContact SD-CB 4.34Å; Y35-L51 HydrophobicContact CE2-CD2 4.31Å; D49-L51 HydrophobicContact CB-CD1 4.46Å; L51-L66 HydrophobicContact CB-CB 4.36Å; L51-L66 PolarHBondContact N-O 3.07Å; L51-L66 PolarHBondContact O-N 3.41Å
52	S	93.9	Very high	85.3	Confident	31 Å²	31	71.5 Å²	71.5	22%	0.217	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	133.9	176.6	-172.3	0	0	0	0	111.8	R63 L64	S52-R63 WeakPolarHBondContact OG-CG 3.32Å; S52-R63 PolarHBondContact OG-NE 3.33Å; S52-L64 VanDerWaalsContact CA-O 3.23Å; S52-L64 WeakPolarHBondContact CA-O 3.49Å; S52-L64 PolarHBondContact OG-O 3.29Å
53	K	92.8	Very high	86.2	Confident	68 Å²	68	69.9 Å²	69.9	30%	0.296	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	131.5	179.4	-172.9	155.8	-177.4	165.4	0	110.9	F33 M34 L64	F33-K53 HydrophobicContact CD1-CD 4.24Å; F33-K53 HydrophobicContact CE1-CB 4.16Å; F33-K53 HydrophobicContact CE1-CD 3.78Å; F33-K53 HydrophobicContact CE1-CG 4.24Å; F33-K53 HydrophobicContact CZ-CD 4.01Å; F33-K53 HydrophobicContact CZ-CG 4.42Å; F33-K53 PolarHBondContact O-NZ 2.9Å; M34-K53 HydrophobicContact CE-CB 4.04Å; M34-K53 HydrophobicContact CE-CD 4.34Å; M34-K53 PolarHBondContact O-NZ 3.5Å; M34-K53 HydrophobicContact SD-CB 3.59Å; M34-K53 VanDerWaalsContact SD-CB 3.59Å; M34-K53 HydrophobicContact SD-CD 3.69Å; M34-K53 HydrophobicContact SD-CG 4.25Å; K53-L64 PolarHBondContact N-O 2.97Å; K53-L64 PolarHBondContact O-N 3.49Å
54	T	93.5	Very high	87	Confident	47 Å²	47	62.9 Å²	62.9	29%	0.288	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.4	169.3	-57.2	0	0	0	0	108.8	L11 Y56 T61 V62	L11-T54 HydrophobicContact CD1-CG2 4.07Å; T54-Y56 HydrophobicContact CG2-CE1 4.2Å; T54-Y56 HydrophobicContact CG2-CE2 4.28Å; T54-T61 HydrophobicContact CG2-CG2 3.38Å; T54-V62 WeakPolarHBondContact CA-O 3.28Å
55	M	90.9	Very high	87.7	Confident	21 Å²	21	63.4 Å²	63.4	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.8	171.9	-77.3	-169.9	62.4	0	0	109.9	F33 L57 T61 V62 L64 F167 R168 A171	F33-M55 HydrophobicContact CE2-SD 4.13Å; F33-M55 HydrophobicContact CZ-CG 3.86Å; F33-M55 HydrophobicContact CZ-SD 3.58Å; F33-M55 VanDerWaalsContact CZ-SD 3.58Å; M55-L57 HydrophobicContact CE-CD2 4.05Å; M55-T61 WeakPolarHBondContact O-CA 3.32Å; M55-V62 HydrophobicContact CB-CG2 4.02Å; M55-V62 PolarHBondContact N-O 2.94Å; M55-V62 PolarHBondContact O-N 3Å; M55-L64 HydrophobicContact CG-CD1 4.13Å; M55-L64 HydrophobicContact CG-CG 4.35Å; M55-L64 HydrophobicContact SD-CD1 3.33Å; M55-L64 WeakPolarHBondContact SD-CD1 3.39Å; M55-L64 HydrophobicContact SD-CG 4.09Å; M55-F167 HydrophobicContact CE-CB 4.37Å; M55-F167 HydrophobicContact SD-CB 4.09Å; M55-R168 HydrophobicContact CE-CG 4.5Å; M55-A171 HydrophobicContact CE-CB 4.33Å
56	Y	88.8	Confident	88.5	Confident	184 Å²	184	61.9 Å²	61.9	72%	0.722	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	111.2	172.3	-54.6	-84.1	0	0	0	107.7	T54 T61	T54-Y56 HydrophobicContact CG2-CE1 4.2Å; T54-Y56 HydrophobicContact CG2-CE2 4.28Å; Y56-T61 HydrophobicContact CD1-CG2 3.73Å; Y56-T61 WeakPolarHBondContact CD1-OG1 3.35Å; Y56-T61 HydrophobicContact CE1-CG2 3.76Å
57	L	83.8	Confident	89.2	Confident	37 Å²	37	57.7 Å²	57.7	19%	0.194	27%	0.274	C	S	.	.			trans	-96.5	167.8	169.6	-52.6	172.3	0	0	0	108.1	M55 D59 R60 V62 A171 M177	M55-L57 HydrophobicContact CE-CD2 4.05Å; L57-D59 WeakPolarHBondContact CB-OD1 3.48Å; L57-D59 PolarHBondContact O-N 3.37Å; L57-R60 WeakPolarHBondContact CA-O 3.43Å; L57-R60 HydrophobicContact CB-CG 4.29Å; L57-R60 VanDerWaalsContact CB-O 3.3Å; L57-R60 WeakPolarHBondContact CB-O 3.45Å; L57-R60 HydrophobicContact CD1-CG 3.85Å; L57-R60 PolarHBondContact N-O 2.7Å; L57-V62 HydrophobicContact CD1-CG2 4.36Å; L57-A171 HydrophobicContact CD1-CB 3.92Å; L57-A171 HydrophobicContact CD2-CB 3.98Å; L57-M177 HydrophobicContact CD1-CE 3.82Å
58	E	80.9	Confident	89.9	Confident	208 Å²	208	57.2 Å²	57.2	97%	0.972	27%	0.269	S	S	*	.	S	Bend	trans	-61.4	-35.8	-178.1	-64.8	179.6	179.3	0	0	112.3
59	D	79.9	Confident	90.2	Very high	74 Å²	74	55.4 Å²	55.4	40%	0.396	26%	0.26	S	S	.	.	S	Bend	trans	-103.9	-18.4	-172.9	64.2	-32.7	0	0	0	113.7	L57	L57-D59 WeakPolarHBondContact CB-OD1 3.48Å; L57-D59 PolarHBondContact O-N 3.37Å
60	R	84.2	Confident	89.8	Confident	37 Å²	37	51.4 Å²	51.4	14%	0.14	24%	0.239	C	C	.	.			trans	-159.1	159	-175.6	64.8	-172.5	-174.8	174.4	0.9	114.3	L57 V62 A171 L174 P175 G176 M177	L57-R60 WeakPolarHBondContact CA-O 3.43Å; L57-R60 HydrophobicContact CB-CG 4.29Å; L57-R60 VanDerWaalsContact CB-O 3.3Å; L57-R60 WeakPolarHBondContact CB-O 3.45Å; L57-R60 HydrophobicContact CD1-CG 3.85Å; L57-R60 PolarHBondContact N-O 2.7Å; R60-V62 HydrophobicContact CG-CG1 3.99Å; R60-A171 PolarHBondContact NH2-O 3.18Å; R60-L174 PolarHBondContact NH1-O 3.13Å; R60-L174 PolarHBondContact NH2-O 3.22Å; R60-P175 PolarHBondContact NH1-O 2.9Å; R60-G176 PolarHBondContact NH1-O 2.95Å; R60-M177 VanDerWaalsContact NH2-CG 3.28Å
61	T	88.7	Confident	88.9	Confident	53 Å²	53	47.8 Å²	47.8	33%	0.325	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.8	167.6	-57.2	0	0	0	0	109.7	L11 T54 M55 Y56	L11-T61 HydrophobicContact CD1-CG2 4.31Å; L11-T61 HydrophobicContact CD2-CG2 3.63Å; T54-T61 HydrophobicContact CG2-CG2 3.38Å; M55-T61 WeakPolarHBondContact O-CA 3.32Å; Y56-T61 HydrophobicContact CD1-CG2 3.73Å; Y56-T61 WeakPolarHBondContact CD1-OG1 3.35Å; Y56-T61 HydrophobicContact CE1-CG2 3.76Å
62	V	91.2	Very high	87.9	Confident	2 Å²	2	48 Å²	48	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	150.9	-179.9	-60.3	0	0	0	0	111	F14 T54 M55 L57 R60 L64	F14-V62 HydrophobicContact CD2-CB 4.07Å; F14-V62 HydrophobicContact CD2-CG1 4.23Å; F14-V62 HydrophobicContact CE2-CB 4.12Å; F14-V62 HydrophobicContact CE2-CG1 3.78Å; T54-V62 WeakPolarHBondContact CA-O 3.28Å; M55-V62 HydrophobicContact CB-CG2 4.02Å; M55-V62 PolarHBondContact N-O 2.94Å; M55-V62 PolarHBondContact O-N 3Å; L57-V62 HydrophobicContact CD1-CG2 4.36Å; R60-V62 HydrophobicContact CG-CG1 3.99Å; V62-L64 HydrophobicContact CG2-CD2 4.17Å
63	R	93.8	Very high	86.7	Confident	101 Å²	101	53.7 Å²	53.7	38%	0.381	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.2	174.2	-173.3	167.5	-178.8	171	1.8	109.9	L11 R12 K13 F14 S52	L11-R63 HydrophobicContact CB-CB 4.29Å; R12-R63 PolarHBondContact O-N 3.13Å; K13-R63 CarbonylContact C-O 3.57Å; K13-R63 VanDerWaalsContact CA-O 3.29Å; K13-R63 WeakPolarHBondContact CA-O 3.47Å; K13-R63 HydrophobicContact CG-CB 4.27Å; F14-R63 PolarHBondContact N-O 3.18Å; S52-R63 WeakPolarHBondContact OG-CG 3.32Å; S52-R63 PolarHBondContact OG-NE 3.33Å
64	L	95	Very high	85.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	137.9	173.8	-57.2	-168.9	0	0	0	110	F14 L16 F33 S52 K53 M55 V62 L66 F167 L174	F14-L64 HydrophobicContact CB-CD2 4.16Å; L16-L64 HydrophobicContact CD1-CD2 3.99Å; L16-L64 HydrophobicContact CD2-CD1 4.06Å; F33-L64 HydrophobicContact CE1-CD1 4.44Å; F33-L64 HydrophobicContact CZ-CD1 4.4Å; S52-L64 VanDerWaalsContact CA-O 3.23Å; S52-L64 WeakPolarHBondContact CA-O 3.49Å; S52-L64 PolarHBondContact OG-O 3.29Å; K53-L64 PolarHBondContact N-O 2.97Å; K53-L64 PolarHBondContact O-N 3.49Å; M55-L64 HydrophobicContact CG-CD1 4.13Å; M55-L64 HydrophobicContact CG-CG 4.35Å; M55-L64 HydrophobicContact SD-CD1 3.33Å; M55-L64 WeakPolarHBondContact SD-CD1 3.39Å; M55-L64 HydrophobicContact SD-CG 4.09Å; V62-L64 HydrophobicContact CG2-CD2 4.17Å; L64-L66 HydrophobicContact CB-CD2 4.04Å; L64-F167 HydrophobicContact CD1-CD1 3.95Å; L64-L174 HydrophobicContact CD2-CD1 4.08Å
65	Q	95.4	Very high	84.9	Confident	46 Å²	46	59 Å²	59	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	104.9	174.3	-76.1	-174.5	-50.2	0	0	107.6	F14 L16 F50	F14-Q65 PolarHBondContact O-N 3.27Å; L16-Q65 PolarHBondContact N-O 2.87Å; F50-Q65 HydrophobicContact CE2-CB 3.75Å; F50-Q65 HydrophobicContact CE2-CG 3.72Å; F50-Q65 HydrophobicContact CZ-CB 4.48Å; F50-Q65 HydrophobicContact CZ-CG 4Å
66	L	95.4	Very high	84.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	116.1	-173.7	-46.7	178.5	0	0	0	108.4	L16 F18 I30 F33 M34 F50 L51 L64 F167	L16-L66 HydrophobicContact CB-CD2 4.11Å; L16-L66 HydrophobicContact CD2-CD2 3.78Å; F18-L66 HydrophobicContact CE2-CB 4.34Å; F18-L66 HydrophobicContact CE2-CD2 4.11Å; I30-L66 HydrophobicContact CG2-CB 4.35Å; I30-L66 HydrophobicContact CG2-CD1 3.86Å; F33-L66 HydrophobicContact CD1-CD1 3.83Å; F33-L66 HydrophobicContact CE1-CD1 4.14Å; M34-L66 HydrophobicContact CG-CD1 4.18Å; M34-L66 HydrophobicContact SD-CD1 3.71Å; F50-L66 WeakPolarHBondContact CA-O 3.44Å; L51-L66 HydrophobicContact CB-CB 4.36Å; L51-L66 PolarHBondContact N-O 3.07Å; L51-L66 PolarHBondContact O-N 3.41Å; L64-L66 HydrophobicContact CB-CD2 4.04Å; L66-F167 HydrophobicContact CD2-CE1 3.82Å
67	W	94.3	Very high	83.9	Confident	55 Å²	55	56.7 Å²	56.7	21%	0.208	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	101.7	176.2	-65	81.6	0	0	0	108.5	K15 L16 V17 F18 I48 D49 F50 Y82	K15-W67 VanDerWaalsContact CE-NE1 3.33Å; K15-W67 VanDerWaalsContact CG-CD1 3.42Å; K15-W67 HydrophobicContact CG-CG 4.48Å; L16-W67 PolarHBondContact O-N 3.38Å; V17-W67 HydrophobicContact CG2-CB 4.41Å; F18-W67 PolarHBondContact N-O 3.43Å; I48-W67 HydrophobicContact CG2-CE3 3.9Å; D49-W67 WeakPolarHBondContact O-CA 3.49Å; F50-W67 HydrophobicContact CB-CE3 4.25Å; F50-W67 HydrophobicContact CB-CZ3 4.17Å; F50-W67 HydrophobicContact CD2-CD2 4.05Å; F50-W67 AromaticContact CD2-CE2 3.68Å; F50-W67 HydrophobicContact CD2-CE3 4.35Å; F50-W67 HydrophobicContact CD2-CH2 4.15Å; F50-W67 AromaticContact CD2-CZ2 3.8Å; F50-W67 HydrophobicContact CD2-CZ2 3.8Å; F50-W67 HydrophobicContact CD2-CZ3 4.36Å; F50-W67 AromaticContact CD2-NE1 3.95Å; F50-W67 HydrophobicContact CE2-CZ2 4.22Å; W67-Y82 AromaticContact CD2-CD1 3.93Å; W67-Y82 HydrophobicContact CD2-CD1 3.93Å; W67-Y82 HydrophobicContact CD2-CE1 4.37Å; W67-Y82 AromaticContact CE3-CD1 3.4Å; W67-Y82 HydrophobicContact CE3-CD1 3.4Å; W67-Y82 AromaticContact CE3-CE1 3.42Å; W67-Y82 HydrophobicContact CE3-CE1 3.42Å; W67-Y82 VanDerWaalsContact CE3-CE1 3.42Å; W67-Y82 HydrophobicContact CH2-CD1 4.46Å; W67-Y82 HydrophobicContact CH2-CE1 4.18Å; W67-Y82 AromaticContact CZ3-CD1 3.74Å; W67-Y82 HydrophobicContact CZ3-CD1 3.74Å; W67-Y82 AromaticContact CZ3-CE1 3.34Å; W67-Y82 HydrophobicContact CZ3-CE1 3.34Å
68	D	92.3	Very high	83.9	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.011	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	121.8	174.8	-169.1	25.4	0	0	0	109	T27 I30 T45 I48 D49	T27-D68 VanDerWaalsContact CB-OD2 3.26Å; T27-D68 WeakPolarHBondContact CB-OD2 3.43Å; T27-D68 WeakPolarHBondContact CG2-OD2 3.31Å; T27-D68 PolarHBondContact N-OD1 2.91Å; T27-D68 PolarHBondContact OG1-OD1 3.41Å; T27-D68 PolarHBondContact OG1-OD2 2.93Å; I30-D68 HydrophobicContact CD1-CB 3.46Å; I30-D68 VanDerWaalsContact CD1-CB 3.46Å; T45-D68 PolarHBondContact OG1-OD2 3.03Å; I48-D68 CarbonylContact C-O 3.47Å; I48-D68 VanDerWaalsContact CA-O 3.26Å; I48-D68 WeakPolarHBondContact CA-O 3.43Å; I48-D68 WeakPolarHBondContact CG2-O 3.35Å; D49-D68 HydrophobicContact CB-CB 4.24Å; D49-D68 PolarHBondContact N-O 2.94Å; D49-D68 PolarHBondContact O-N 3.34Å
69	T	88.2	Confident	84.1	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.8	178	70.4	0	0	0	0	111	V17 F18 L19 K26 I48 G71	V17-T69 HydrophobicContact CG2-CG2 3.79Å; F18-T69 WeakPolarHBondContact O-CB 3.31Å; F18-T69 WeakPolarHBondContact O-CG2 3.33Å; F18-T69 PolarHBondContact O-OG1 3.15Å; L19-T69 HydrophobicContact CD2-CG2 4.17Å; K26-T69 WeakPolarHBondContact CE-O 3.3Å; I48-T69 HydrophobicContact CD1-CG2 4.46Å; I48-T69 HydrophobicContact CG1-CG2 4.35Å; T69-G71 PolarHBondContact O-N 3.41Å
70	A	80.4	Confident	84.5	Confident	3 Å²	3	47.5 Å²	47.5	3%	0.025	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-62.2	123.1	165	0	0	0	0	0	109.2	T45 G47 Q72 F75	T45-A70 WeakPolarHBondContact O-CB 3.44Å; G47-A70 WeakPolarHBondContact O-CB 3.12Å; G47-A70 PolarHBondContact O-N 3.44Å; A70-Q72 PolarHBondContact O-N 3.32Å; A70-F75 HydrophobicContact CB-CB 4.27Å; A70-F75 HydrophobicContact CB-CD2 3.56Å; A70-F75 HydrophobicContact CB-CE2 4.28Å; A70-F75 HydrophobicContact CB-CG 4.2Å
71	G	69.9	Low	84.7	Confident	8 Å²	8	48.9 Å²	48.9	8%	0.082	24%	0.243	C	C	.	.			trans	-74	12.9	173.3	0	0	0	0	0	114	G20 Q22 T69	G20-G71 WeakPolarHBondContact O-CA 3.45Å; Q22-G71 PolarHBondContact N-O 3.46Å; Q22-G71 VanDerWaalsContact N-O 3.15Å; T69-G71 PolarHBondContact O-N 3.41Å
72	Q	73.7	Confident	84.6	Confident	29 Å²	29	49.1 Å²	49.1	14%	0.136	24%	0.238	C	C	.	.	S	Bend	trans	-86.3	137.1	178.1	-74.7	-176.2	25.2	0	0	110.3	Q22 A70 R74 F75	Q22-Q72 HydrophobicContact CG-CG 4.29Å; A70-Q72 PolarHBondContact O-N 3.32Å; Q72-R74 PolarHBondContact O-N 3.14Å; Q72-R74 VanDerWaalsContact O-N 3.13Å; Q72-F75 HydrophobicContact CB-CD2 4.11Å; Q72-F75 PolarHBondContact O-N 3.09Å
73	E	67.4	Low	84.6	Confident	152 Å²	152	49.1 Å²	49.1	71%	0.71	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-53.4	-32.8	176.5	66.5	-155.2	180	0	0	114.2	F75 R76	E73-F75 PolarHBondContact O-N 3.48Å; E73-F75 VanDerWaalsContact O-N 3.12Å; E73-R76 WeakPolarHBondContact O-CB 3.49Å; E73-R76 PolarHBondContact O-N 3.26Å
74	R	72.8	Confident	84.4	Confident	181 Å²	181	51 Å²	51	68%	0.683	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-61.3	-22.6	179	-64.9	-173.6	-65	177.1	-0.8	113.7	Q72	Q72-R74 PolarHBondContact O-N 3.14Å; Q72-R74 VanDerWaalsContact O-N 3.13Å
75	F	75.4	Confident	84	Confident	45 Å²	45	56 Å²	56	20%	0.197	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-106.8	1.7	178.5	-57.2	-67.7	0	0	0	113	I46 A70 Q72 E73 S77 L78	I46-F75 HydrophobicContact CG2-CE2 4.48Å; I46-F75 HydrophobicContact CG2-CZ 3.92Å; A70-F75 HydrophobicContact CB-CB 4.27Å; A70-F75 HydrophobicContact CB-CD2 3.56Å; A70-F75 HydrophobicContact CB-CE2 4.28Å; A70-F75 HydrophobicContact CB-CG 4.2Å; Q72-F75 HydrophobicContact CB-CD2 4.11Å; Q72-F75 PolarHBondContact O-N 3.09Å; E73-F75 PolarHBondContact O-N 3.48Å; E73-F75 VanDerWaalsContact O-N 3.12Å; F75-S77 PolarHBondContact O-N 2.82Å; F75-L78 HydrophobicContact CD1-CD1 4.36Å; F75-L78 WeakPolarHBondContact O-CB 3.27Å; F75-L78 PolarHBondContact O-N 3.2Å; F75-L78 VanDerWaalsContact O-N 3.09Å
76	R	77.6	Confident	83.9	Confident	52 Å²	52	53.8 Å²	53.8	20%	0.196	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-59.3	-33.2	-179.3	-102.9	-172.1	168.8	112.6	0.2	113.1	E21 E73 L78 I79 P80 W107	E21-R76 IonicContact OE1-CZ 3.51Å; E21-R76 IonicContact OE1-NH1 3.68Å; E21-R76 IonicContact OE1-NH2 3.42Å; E21-R76 PolarHBondContact OE1-NH2 3.24Å; E73-R76 WeakPolarHBondContact O-CB 3.49Å; E73-R76 PolarHBondContact O-N 3.26Å; R76-L78 PolarHBondContact O-N 3.26Å; R76-I79 HydrophobicContact CG-CD1 4Å; R76-I79 WeakPolarHBondContact O-CB 3.29Å; R76-I79 PolarHBondContact O-N 2.92Å; R76-I79 VanDerWaalsContact O-N 3.14Å; R76-P80 WeakPolarHBondContact O-CD 3.44Å; R76-W107 HydrophobicContact CG-CH2 3.78Å; R76-W107 HydrophobicContact CG-CZ3 4.36Å; R76-W107 VanDerWaalsContact CZ-CZ2 3.48Å; R76-W107 VanDerWaalsContact NE-CH2 3.34Å; R76-W107 VanDerWaalsContact NH2-CE2 3.28Å
77	S	81.8	Confident	83.9	Confident	104 Å²	104	55.1 Å²	55.1	73%	0.727	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21.4	178.7	56.1	0	0	0	0	113.7	F75	F75-S77 PolarHBondContact O-N 2.82Å
78	L	82.9	Confident	84	Confident	77 Å²	77	52.5 Å²	52.5	40%	0.403	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-83.2	-28.6	177.8	-60.3	178	0	0	0	112.1	I48 F75 R76 P80 S81 Y82	I48-L78 HydrophobicContact CD1-CB 4.16Å; F75-L78 HydrophobicContact CD1-CD1 4.36Å; F75-L78 WeakPolarHBondContact O-CB 3.27Å; F75-L78 PolarHBondContact O-N 3.2Å; F75-L78 VanDerWaalsContact O-N 3.09Å; R76-L78 PolarHBondContact O-N 3.26Å; L78-P80 VanDerWaalsContact C-CD 3.49Å; L78-S81 PolarHBondContact O-N 3.28Å; L78-S81 PolarHBondContact O-OG 3.31Å; L78-Y82 HydrophobicContact CB-CE2 4.23Å; L78-Y82 VanDerWaalsContact O-CD2 3.23Å; L78-Y82 WeakPolarHBondContact O-CD2 3.47Å
79	I	85.6	Confident	84.2	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-56.4	-43	-169.5	-65.8	178.1	0	0	0	114	L19 R76 S81 Y82 I83 W107	L19-I79 HydrophobicContact CD2-CG2 3.54Å; R76-I79 HydrophobicContact CG-CD1 4Å; R76-I79 WeakPolarHBondContact O-CB 3.29Å; R76-I79 PolarHBondContact O-N 2.92Å; R76-I79 VanDerWaalsContact O-N 3.14Å; I79-S81 PolarHBondContact O-N 3.11Å; I79-S81 VanDerWaalsContact O-N 3.16Å; I79-Y82 PolarHBondContact O-N 2.85Å; I79-I83 HydrophobicContact CG2-CD1 3.6Å; I79-I83 HydrophobicContact CG2-CG1 3.95Å; I79-I83 WeakPolarHBondContact O-CG1 3.47Å; I79-I83 PolarHBondContact O-N 3.3Å; I79-W107 HydrophobicContact CD1-CH2 3.43Å; I79-W107 VanDerWaalsContact CD1-CH2 3.43Å; I79-W107 HydrophobicContact CD1-CZ3 3.47Å; I79-W107 VanDerWaalsContact CD1-CZ3 3.47Å; I79-W107 HydrophobicContact CG2-CZ3 4.18Å
80	P	88.8	Confident	84.7	Confident	46 Å²	46	52.4 Å²	52.4	30%	0.299	26%	0.259	S	S	.	.	H	α-helix	trans	-52.1	-40.5	179.2	-30.6	37.1	0	0	0	113.7	R76 L78 Y82 I83 R84 E114	R76-P80 WeakPolarHBondContact O-CD 3.44Å; L78-P80 VanDerWaalsContact C-CD 3.49Å; P80-Y82 VanDerWaalsContact C-N 3.27Å; P80-Y82 PolarHBondContact O-N 2.81Å; P80-I83 PolarHBondContact O-N 3.46Å; P80-R84 PolarHBondContact O-N 3.24Å; P80-E114 HydrophobicContact CB-CG 4.06Å
81	S	87.8	Confident	85.5	Confident	66 Å²	66	52.2 Å²	52.2	46%	0.462	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-30.5	178.8	70.6	0	0	0	0	113.3	L78 I79	L78-S81 PolarHBondContact O-N 3.28Å; L78-S81 PolarHBondContact O-OG 3.31Å; I79-S81 PolarHBondContact O-N 3.11Å; I79-S81 VanDerWaalsContact O-N 3.16Å
82	Y	87.4	Confident	86.8	Confident	57 Å²	57	51.9 Å²	51.9	22%	0.224	25%	0.254	C	S	.	.	H	α-helix	trans	-82	-32.4	177.7	-65.9	-91	0	0	0	111.8	K15 I48 W67 L78 I79 P80 S86	K15-Y82 WeakPolarHBondContact CE-O 3.04Å; K15-Y82 PolarHBondContact NZ-O 2.91Å; I48-Y82 HydrophobicContact CB-CE1 4.49Å; I48-Y82 HydrophobicContact CD1-CD1 4.23Å; I48-Y82 HydrophobicContact CD1-CD2 3.24Å; I48-Y82 HydrophobicContact CD1-CE1 4.03Å; I48-Y82 HydrophobicContact CD1-CE2 3.03Å; I48-Y82 HydrophobicContact CD1-CG 3.86Å; I48-Y82 VanDerWaalsContact CD1-CZ 3.44Å; I48-Y82 HydrophobicContact CG1-CE2 4.38Å; I48-Y82 HydrophobicContact CG2-CD1 4.08Å; I48-Y82 HydrophobicContact CG2-CE1 3.78Å; W67-Y82 AromaticContact CD2-CD1 3.93Å; W67-Y82 HydrophobicContact CD2-CD1 3.93Å; W67-Y82 HydrophobicContact CD2-CE1 4.37Å; W67-Y82 AromaticContact CE3-CD1 3.4Å; W67-Y82 HydrophobicContact CE3-CD1 3.4Å; W67-Y82 AromaticContact CE3-CE1 3.42Å; W67-Y82 HydrophobicContact CE3-CE1 3.42Å; W67-Y82 VanDerWaalsContact CE3-CE1 3.42Å; W67-Y82 HydrophobicContact CH2-CD1 4.46Å; W67-Y82 HydrophobicContact CH2-CE1 4.18Å; W67-Y82 AromaticContact CZ3-CD1 3.74Å; W67-Y82 HydrophobicContact CZ3-CD1 3.74Å; W67-Y82 AromaticContact CZ3-CE1 3.34Å; W67-Y82 HydrophobicContact CZ3-CE1 3.34Å; L78-Y82 HydrophobicContact CB-CE2 4.23Å; L78-Y82 VanDerWaalsContact O-CD2 3.23Å; L78-Y82 WeakPolarHBondContact O-CD2 3.47Å; I79-Y82 PolarHBondContact O-N 2.85Å; P80-Y82 VanDerWaalsContact C-N 3.27Å; P80-Y82 PolarHBondContact O-N 2.81Å; Y82-S86 PolarHBondContact O-OG 3.41Å
83	I	90.8	Very high	88	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-63.5	-43.5	174.2	-65.7	174.8	0	0	0	110.6	V17 L19 I79 P80 D85 S86 D110 V111 E114 R115	V17-I83 HydrophobicContact CG1-CG1 4.45Å; L19-I83 HydrophobicContact CD1-CD1 3.96Å; L19-I83 HydrophobicContact CD1-CG1 4.13Å; I79-I83 HydrophobicContact CG2-CD1 3.6Å; I79-I83 HydrophobicContact CG2-CG1 3.95Å; I79-I83 WeakPolarHBondContact O-CG1 3.47Å; I79-I83 PolarHBondContact O-N 3.3Å; P80-I83 PolarHBondContact O-N 3.46Å; I83-D85 PolarHBondContact O-N 2.93Å; I83-S86 WeakPolarHBondContact O-CB 3.39Å; I83-S86 PolarHBondContact O-N 2.99Å; I83-D110 HydrophobicContact CD1-CB 4.49Å; I83-V111 HydrophobicContact CD1-CG2 3.95Å; I83-V111 HydrophobicContact CG1-CG2 4.35Å; I83-V111 HydrophobicContact CG2-CB 4.41Å; I83-V111 HydrophobicContact CG2-CG1 4.47Å; I83-V111 HydrophobicContact CG2-CG2 4.24Å; I83-E114 HydrophobicContact CB-CB 4.18Å; I83-E114 HydrophobicContact CB-CG 4.45Å; I83-E114 HydrophobicContact CG2-CB 3.6Å; I83-E114 HydrophobicContact CG2-CG 4.28Å; I83-R115 HydrophobicContact CG2-CG 3.84Å; I83-R115 VanDerWaalsContact O-CD 3.27Å; I83-R115 WeakPolarHBondContact O-CD 3.49Å; I83-R115 VanDerWaalsContact O-CG 3.32Å; I83-R115 WeakPolarHBondContact O-CG 3.49Å
84	R	89.6	Confident	89.5	Confident	141 Å²	141	43.5 Å²	43.5	53%	0.532	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-26.8	-171.4	-169.3	170.8	-61	-170.9	1.7	116.6	P80 E114 R115	P80-R84 PolarHBondContact O-N 3.24Å; R84-E114 IonicContact CZ-OE2 2.84Å; R84-E114 IonicContact NE-OE2 3.98Å; R84-E114 PolarHBondContact NE-OE2 3.44Å; R84-E114 IonicContact NH2-OE2 3.27Å; R84-E114 PolarHBondContact NH2-OE2 3.39Å; R84-R115 VanDerWaalsContact C-CD 3.44Å; R84-R115 WeakPolarHBondContact O-CD 3.45Å; R84-R115 PolarHBondContact O-NE 2.88Å; R84-R115 PolarHBondContact O-NH1 2.9Å
85	D	86.7	Confident	90.7	Very high	104 Å²	104	34.9 Å²	34.9	56%	0.556	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.3	6.7	177.6	-52.3	-44.4	0	0	0	113.3	K15 I83	K15-D85 HydrophobicContact CD-CB 4Å; K15-D85 WeakPolarHBondContact CD-O 3.27Å; K15-D85 IonicContact NZ-OD2 3.55Å; I83-D85 PolarHBondContact O-N 2.93Å
86	S	93.3	Very high	91.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.			trans	-80.8	130.1	-175.4	-67.1	0	0	0	0	111.5	V17 Y82 I83 R115	V17-S86 WeakPolarHBondContact CB-OG 3.41Å; V17-S86 WeakPolarHBondContact CG1-OG 3.48Å; Y82-S86 PolarHBondContact O-OG 3.41Å; I83-S86 WeakPolarHBondContact O-CB 3.39Å; I83-S86 PolarHBondContact O-N 2.99Å; S86-R115 PolarHBondContact O-NE 3.15Å; S86-R115 PolarHBondContact O-NH2 3.09Å; S86-R115 VanDerWaalsContact O-NH2 3.15Å
87	T	94.3	Very high	92.8	Very high	28 Å²	28	34.1 Å²	34.1	17%	0.172	19%	0.186	C	C	.	.	S	Bend	trans	-76.6	-31.7	170.6	-41	0	0	0	0	110.7	F14 K15 I120 L174	F14-T87 HydrophobicContact CD1-CG2 3.95Å; F14-T87 HydrophobicContact CE1-CG2 4.49Å; K15-T87 PolarHBondContact O-N 3.41Å; T87-I120 PolarHBondContact O-N 3.44Å; T87-L174 HydrophobicContact CG2-CD2 3.73Å
88	V	96.4	Very high	93.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.2	-176.4	-179	0	0	0	0	109.8	K15 L16 V17 V90 I120 V170 L174	K15-V88 PolarHBondContact O-N 3.38Å; K15-V88 VanDerWaalsContact O-N 3.11Å; L16-V88 WeakPolarHBondContact CA-O 3.46Å; L16-V88 HydrophobicContact CD1-CB 4.18Å; L16-V88 HydrophobicContact CD1-CG2 4.16Å; L16-V88 HydrophobicContact CG-CB 3.89Å; L16-V88 HydrophobicContact CG-CG1 4.26Å; L16-V88 HydrophobicContact CG-CG2 4.32Å; V17-V88 PolarHBondContact N-O 2.57Å; V88-V90 HydrophobicContact CG1-CG2 4.14Å; V88-I120 CarbonylContact C-O 3.53Å; V88-I120 VanDerWaalsContact CA-O 3.23Å; V88-I120 WeakPolarHBondContact CA-O 3.25Å; V88-I120 HydrophobicContact CG1-CG2 4.44Å; V88-I120 HydrophobicContact CG2-CB 4.1Å; V88-I120 HydrophobicContact CG2-CD1 4.31Å; V88-I120 HydrophobicContact CG2-CG2 4.45Å; V88-V170 HydrophobicContact CB-CG1 4.23Å; V88-V170 HydrophobicContact CG1-CG1 3.75Å; V88-V170 HydrophobicContact CG1-CG2 4.24Å; V88-V170 HydrophobicContact CG2-CG1 3.72Å; V88-L174 HydrophobicContact CG2-CD2 3.48Å; V88-L174 VanDerWaalsContact CG2-CD2 3.48Å
89	A	97.1	Very high	94.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123	165.8	0	0	0	0	0	109.9	V17 V111 V119 I120 I121 M122	V17-A89 HydrophobicContact CG1-CB 4.09Å; A89-V111 HydrophobicContact CB-CB 4.43Å; A89-V111 HydrophobicContact CB-CG1 3.82Å; A89-V111 HydrophobicContact CB-CG2 3.73Å; A89-V119 HydrophobicContact CB-CG2 4.28Å; A89-I120 PolarHBondContact N-O 3.05Å; A89-I121 WeakPolarHBondContact O-CA 3.39Å; A89-M122 PolarHBondContact O-N 3.46Å
90	V	98.1	Very high	94.8	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.4	172.9	-174.8	0	0	0	0	107.8	V17 F18 L19 V88 V92 M122 V124	V17-V90 PolarHBondContact O-N 3.3Å; F18-V90 WeakPolarHBondContact CA-O 3.18Å; F18-V90 HydrophobicContact CD1-CB 3.93Å; F18-V90 HydrophobicContact CD1-CG1 3.94Å; F18-V90 HydrophobicContact CE1-CB 3.94Å; F18-V90 HydrophobicContact CE1-CG1 3.77Å; F18-V90 HydrophobicContact CE1-CG2 4.19Å; F18-V90 HydrophobicContact CE2-CG2 4.4Å; F18-V90 HydrophobicContact CG-CB 4.29Å; F18-V90 HydrophobicContact CZ-CB 4.28Å; F18-V90 HydrophobicContact CZ-CG1 4.45Å; F18-V90 HydrophobicContact CZ-CG2 4.06Å; L19-V90 PolarHBondContact N-O 3.42Å; V88-V90 HydrophobicContact CG1-CG2 4.14Å; V90-V92 HydrophobicContact CG1-CG2 4Å; V90-M122 WeakPolarHBondContact CA-O 3.4Å; V90-V124 HydrophobicContact CG1-CB 4.49Å; V90-V124 HydrophobicContact CG1-CG2 3.58Å
91	V	97.9	Very high	95.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	113.2	-178.2	-177.4	0	0	0	0	108.5	L19 T104 W107 I108 I121 M122 L123 V124	L19-V91 HydrophobicContact CB-CG2 4.45Å; V91-T104 HydrophobicContact CG1-CG2 4.13Å; V91-W107 HydrophobicContact CG1-CB 3.86Å; V91-W107 HydrophobicContact CG1-CG 4.48Å; V91-W107 HydrophobicContact CG2-CB 4.43Å; V91-I108 HydrophobicContact CB-CG1 4.45Å; V91-I108 HydrophobicContact CG1-CG1 4.41Å; V91-I108 HydrophobicContact CG2-CG1 3.96Å; V91-I121 HydrophobicContact CG2-CG2 4.19Å; V91-M122 PolarHBondContact N-O 2.91Å; V91-L123 HydrophobicContact CB-CD1 4.47Å; V91-L123 HydrophobicContact CG1-CD1 4.34Å; V91-L123 CarbonylContact O-C 3.58Å; V91-L123 WeakPolarHBondContact O-CA 3.15Å; V91-V124 PolarHBondContact O-N 2.84Å
92	V	98.4	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.3	-171.1	-170.2	0	0	0	0	110.6	F18 L19 G20 V24 K26 L29 V90 V124 N126	F18-V92 HydrophobicContact CD1-CG2 4.37Å; L19-V92 PolarHBondContact O-N 3.04Å; G20-V92 WeakPolarHBondContact CA-O 3.29Å; V24-V92 HydrophobicContact CB-CG1 4.29Å; V24-V92 HydrophobicContact CG2-CB 3.92Å; V24-V92 HydrophobicContact CG2-CG1 3.91Å; K26-V92 HydrophobicContact CG-CB 4.08Å; K26-V92 HydrophobicContact CG-CG2 4.05Å; L29-V92 HydrophobicContact CD1-CG1 3.86Å; L29-V92 HydrophobicContact CD1-CG2 4.01Å; V90-V92 HydrophobicContact CG1-CG2 4Å; V92-V124 WeakPolarHBondContact CA-O 3.27Å; V92-V124 HydrophobicContact CG2-CB 4.28Å; V92-N126 HydrophobicContact CG1-CB 3.81Å
93	Y	98.6	Very high	96	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	166.2	166.2	73	-84.8	0	0	0	110.8	I95 F101 T104 L123 V124 N126 I136 F152	Y93-I95 HydrophobicContact CE2-CG2 4.04Å; Y93-F101 AromaticContact CD1-CD2 3.99Å; Y93-F101 HydrophobicContact CD1-CD2 3.99Å; Y93-F101 HydrophobicContact CD2-CB 3.89Å; Y93-F101 AromaticContact CD2-CD2 3.78Å; Y93-F101 HydrophobicContact CD2-CD2 3.78Å; Y93-F101 HydrophobicContact CD2-CG 4.26Å; Y93-F101 AromaticContact CE1-CD2 3.92Å; Y93-F101 HydrophobicContact CE1-CD2 3.92Å; Y93-F101 HydrophobicContact CE1-CE2 4.19Å; Y93-F101 HydrophobicContact CE2-CB 4.43Å; Y93-F101 AromaticContact CE2-CD2 3.72Å; Y93-F101 HydrophobicContact CE2-CD2 3.72Å; Y93-F101 HydrophobicContact CE2-CE2 4.38Å; Y93-F101 HydrophobicContact CE2-CG 4.38Å; Y93-F101 HydrophobicContact CG-CB 4.27Å; Y93-F101 AromaticContact CG-CD2 3.92Å; Y93-F101 HydrophobicContact CG-CD2 3.92Å; Y93-F101 AromaticContact CZ-CD2 3.79Å; Y93-T104 HydrophobicContact CD1-CG2 4.1Å; Y93-T104 HydrophobicContact CG-CG2 4.27Å; Y93-L123 HydrophobicContact CD1-CD1 3.89Å; Y93-L123 HydrophobicContact CD1-CG 4.34Å; Y93-L123 HydrophobicContact CE1-CD1 4.14Å; Y93-L123 HydrophobicContact CE1-CD2 4.43Å; Y93-L123 HydrophobicContact CE1-CG 4.08Å; Y93-V124 VanDerWaalsContact CD1-O 3.27Å; Y93-V124 WeakPolarHBondContact CD1-O 3.15Å; Y93-V124 PolarHBondContact N-O 2.84Å; Y93-N126 PolarHBondContact O-N 2.85Å; Y93-I136 HydrophobicContact CE2-CB 4.23Å; Y93-I136 HydrophobicContact CE2-CG2 4.05Å; Y93-F152 HydrophobicContact CE1-CE2 4.14Å; Y93-F152 WeakPolarHBondContact OH-CE2 3.32Å
94	D	98.3	Very high	96.3	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.032	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.6	175.7	173.9	-5.5	0	0	0	109	V24 T96 N97 S100 K127	V24-D94 HydrophobicContact CB-CB 4.38Å; V24-D94 HydrophobicContact CG1-CB 4.31Å; D94-T96 PolarHBondContact O-N 2.9Å; D94-T96 WeakPolarHBondContact OD1-CB 3.3Å; D94-T96 PolarHBondContact OD1-N 2.83Å; D94-T96 PolarHBondContact OD1-OG1 2.96Å; D94-T96 PolarHBondContact OD2-OG1 2.67Å; D94-N97 HydrophobicContact CB-CB 4.07Å; D94-N97 PolarHBondContact O-N 2.89Å; D94-S100 PolarHBondContact N-OG 3.36Å; D94-S100 PolarHBondContact O-OG 2.79Å; D94-K127 HydrophobicContact CB-CD 4.39Å; D94-K127 WeakPolarHBondContact OD2-CD 3.44Å; D94-K127 WeakPolarHBondContact OD2-CE 3.45Å; D94-K127 IonicContact OD2-NZ 3.58Å; D94-K127 PolarHBondContact OD2-NZ 3.12Å
95	I	98.6	Very high	96.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.7	-178.7	66.2	155.2	0	0	0	113.6	Y93 N126 K127 T128 R134 Q135 I136	Y93-I95 HydrophobicContact CE2-CG2 4.04Å; I95-N126 PolarHBondContact N-O 3.05Å; I95-N126 VanDerWaalsContact N-O 3.09Å; I95-K127 WeakPolarHBondContact CD1-O 3.45Å; I95-T128 HydrophobicContact CD1-CG2 4.46Å; I95-R134 HydrophobicContact CD1-CB 4.26Å; I95-R134 HydrophobicContact CD1-CG 4.25Å; I95-Q135 PolarHBondContact O-N 2.81Å; I95-I136 VanDerWaalsContact O-CD1 3.28Å; I95-I136 WeakPolarHBondContact O-CD1 3.36Å; I95-I136 PolarHBondContact O-N 2.86Å; I95-I136 VanDerWaalsContact O-N 3.16Å
96	T	98.4	Very high	97	Very high	25 Å²	25	27.1 Å²	27.1	15%	0.153	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	4.2	178	71.9	0	0	0	0	112.9	D94 L130 K133 Q135	D94-T96 PolarHBondContact O-N 2.9Å; D94-T96 WeakPolarHBondContact OD1-CB 3.3Å; D94-T96 PolarHBondContact OD1-N 2.83Å; D94-T96 PolarHBondContact OD1-OG1 2.96Å; D94-T96 PolarHBondContact OD2-OG1 2.67Å; T96-L130 HydrophobicContact CG2-CB 3.64Å; T96-L130 HydrophobicContact CG2-CD1 4.1Å; T96-K133 WeakPolarHBondContact CA-O 3.5Å; T96-K133 WeakPolarHBondContact CB-O 3.38Å; T96-K133 HydrophobicContact CG2-CB 3.84Å; T96-K133 WeakPolarHBondContact CG2-O 3.39Å; T96-Q135 PolarHBondContact O-NE2 3.22Å; T96-Q135 VanDerWaalsContact O-NE2 3.07Å; T96-Q135 PolarHBondContact O-OE1 3.26Å
97	N	97.9	Very high	97	Very high	56 Å²	56	27.2 Å²	27.2	30%	0.299	14%	0.141	S	C	.	.			trans	-138.3	100.7	-174.9	-176.2	-29.2	0	0	0	111.9	D94 N99 S100 F101	D94-N97 HydrophobicContact CB-CB 4.07Å; D94-N97 PolarHBondContact O-N 2.89Å; N97-N99 VanDerWaalsContact C-N 3.31Å; N97-N99 PolarHBondContact O-N 2.8Å; N97-N99 WeakPolarHBondContact OD1-CB 3.34Å; N97-N99 PolarHBondContact OD1-N 3.32Å; N97-N99 VanDerWaalsContact OD1-N 3.08Å; N97-S100 WeakPolarHBondContact O-CB 3.47Å; N97-S100 PolarHBondContact O-N 3.4Å; N97-S100 VanDerWaalsContact O-N 3.13Å; N97-S100 PolarHBondContact O-OG 2.63Å; N97-S100 PolarHBondContact OD1-N 3.1Å; N97-F101 PolarHBondContact O-N 2.64Å
98	V	97.7	Very high	97.1	Very high	54 Å²	54	25.9 Å²	25.9	33%	0.327	13%	0.133	S	C	.	.	H	α-helix	trans	-58	-39	179.9	175.9	0	0	0	0	113	S100 F101 Q102 Q135 I136	V98-S100 VanDerWaalsContact C-N 3.29Å; V98-S100 PolarHBondContact O-N 3.06Å; V98-F101 WeakPolarHBondContact O-CB 3.37Å; V98-F101 PolarHBondContact O-N 3.43Å; V98-F101 VanDerWaalsContact O-N 3.1Å; V98-Q102 HydrophobicContact CG1-CG 4.22Å; V98-Q102 WeakPolarHBondContact O-CG 3.42Å; V98-Q102 PolarHBondContact O-N 3.08Å; V98-Q135 HydrophobicContact CG2-CB 3.74Å; V98-I136 HydrophobicContact CG2-CD1 4.2Å; V98-I136 HydrophobicContact CG2-CG1 4.44Å
99	N	96.8	Very high	97	Very high	85 Å²	85	29.6 Å²	29.6	46%	0.455	15%	0.153	S	C	.	.	H	α-helix	trans	-62.1	-40.2	179	-178.5	62.3	0	0	0	111.1	N97 F101 Q102 Q103	N97-N99 VanDerWaalsContact C-N 3.31Å; N97-N99 PolarHBondContact O-N 2.8Å; N97-N99 WeakPolarHBondContact OD1-CB 3.34Å; N97-N99 PolarHBondContact OD1-N 3.32Å; N97-N99 VanDerWaalsContact OD1-N 3.08Å; N99-F101 PolarHBondContact O-N 3.27Å; N99-Q102 PolarHBondContact O-N 3.14Å; N99-Q103 WeakPolarHBondContact O-CG 3.2Å; N99-Q103 PolarHBondContact O-N 3.4Å; N99-Q103 VanDerWaalsContact O-N 3.1Å
100	S	97.4	Very high	96.8	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-34.3	176.2	79.1	0	0	0	0	112.8	D94 N97 V98 T104	D94-S100 PolarHBondContact N-OG 3.36Å; D94-S100 PolarHBondContact O-OG 2.79Å; N97-S100 WeakPolarHBondContact O-CB 3.47Å; N97-S100 PolarHBondContact O-N 3.4Å; N97-S100 VanDerWaalsContact O-N 3.13Å; N97-S100 PolarHBondContact O-OG 2.63Å; N97-S100 PolarHBondContact OD1-N 3.1Å; V98-S100 VanDerWaalsContact C-N 3.29Å; V98-S100 PolarHBondContact O-N 3.06Å; S100-T104 WeakPolarHBondContact O-CG2 3.48Å
101	F	98.3	Very high	96.7	Very high	13 Å²	13	32.2 Å²	32.2	6%	0.057	17%	0.167	C	C	.	.	H	α-helix	trans	-72.9	-42.8	176.6	179.6	-117.5	0	0	0	112.3	Y93 N97 V98 N99 Q103 T104 I136 E140 R144	Y93-F101 AromaticContact CD1-CD2 3.99Å; Y93-F101 HydrophobicContact CD1-CD2 3.99Å; Y93-F101 HydrophobicContact CD2-CB 3.89Å; Y93-F101 AromaticContact CD2-CD2 3.78Å; Y93-F101 HydrophobicContact CD2-CD2 3.78Å; Y93-F101 HydrophobicContact CD2-CG 4.26Å; Y93-F101 AromaticContact CE1-CD2 3.92Å; Y93-F101 HydrophobicContact CE1-CD2 3.92Å; Y93-F101 HydrophobicContact CE1-CE2 4.19Å; Y93-F101 HydrophobicContact CE2-CB 4.43Å; Y93-F101 AromaticContact CE2-CD2 3.72Å; Y93-F101 HydrophobicContact CE2-CD2 3.72Å; Y93-F101 HydrophobicContact CE2-CE2 4.38Å; Y93-F101 HydrophobicContact CE2-CG 4.38Å; Y93-F101 HydrophobicContact CG-CB 4.27Å; Y93-F101 AromaticContact CG-CD2 3.92Å; Y93-F101 HydrophobicContact CG-CD2 3.92Å; Y93-F101 AromaticContact CZ-CD2 3.79Å; N97-F101 PolarHBondContact O-N 2.64Å; V98-F101 WeakPolarHBondContact O-CB 3.37Å; V98-F101 PolarHBondContact O-N 3.43Å; V98-F101 VanDerWaalsContact O-N 3.1Å; N99-F101 PolarHBondContact O-N 3.27Å; F101-Q103 VanDerWaalsContact C-N 3.26Å; F101-Q103 PolarHBondContact O-N 2.87Å; F101-T104 WeakPolarHBondContact O-CB 3.4Å; F101-T104 WeakPolarHBondContact O-CG2 3.26Å; F101-T104 PolarHBondContact O-N 3.39Å; F101-T104 VanDerWaalsContact O-N 3.16Å; F101-T104 PolarHBondContact O-OG1 3.16Å; F101-I136 HydrophobicContact CB-CD1 4.16Å; F101-I136 HydrophobicContact CB-CG1 3.89Å; F101-I136 HydrophobicContact CD1-CG1 4.05Å; F101-I136 HydrophobicContact CD1-CG2 4.08Å; F101-I136 HydrophobicContact CD2-CG2 4.17Å; F101-I136 HydrophobicContact CE1-CG2 4.07Å; F101-I136 HydrophobicContact CE2-CG2 4.17Å; F101-I136 HydrophobicContact CG-CG1 3.99Å; F101-I136 HydrophobicContact CG-CG2 4.12Å; F101-I136 HydrophobicContact CZ-CG2 4.11Å; F101-E140 HydrophobicContact CZ-CB 4.45Å; F101-R144 HydrophobicContact CE2-CB 4.06Å; F101-R144 HydrophobicContact CE2-CG 4.23Å; F101-R144 HydrophobicContact CZ-CB 3.71Å; F101-R144 HydrophobicContact CZ-CG 4.15Å
102	Q	97	Very high	96.6	Very high	113 Å²	113	36.7 Å²	36.7	53%	0.528	18%	0.184	S	C	.	.	H	α-helix	trans	-60.6	-37.1	176.8	-71.9	175.6	-13.2	0	0	112.2	V98 N99 T104	V98-Q102 HydrophobicContact CG1-CG 4.22Å; V98-Q102 WeakPolarHBondContact O-CG 3.42Å; V98-Q102 PolarHBondContact O-N 3.08Å; N99-Q102 PolarHBondContact O-N 3.14Å; Q102-T104 PolarHBondContact O-N 2.96Å
103	Q	95.4	Very high	96.4	Very high	52 Å²	52	42 Å²	42	24%	0.243	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.1	-179.7	-66.3	-71.5	90.6	0	0	113.7	E21 N99 F101 S105 K106 W107	E21-Q103 HydrophobicContact CG-CB 3.79Å; E21-Q103 HydrophobicContact CG-CG 3.96Å; E21-Q103 PolarHBondContact OE1-NE2 2.73Å; N99-Q103 WeakPolarHBondContact O-CG 3.2Å; N99-Q103 PolarHBondContact O-N 3.4Å; N99-Q103 VanDerWaalsContact O-N 3.1Å; F101-Q103 VanDerWaalsContact C-N 3.26Å; F101-Q103 PolarHBondContact O-N 2.87Å; Q103-S105 VanDerWaalsContact C-N 3.32Å; Q103-S105 PolarHBondContact O-N 3.35Å; Q103-K106 PolarHBondContact O-N 2.99Å; Q103-W107 PolarHBondContact O-N 3.46Å
104	T	96.3	Very high	96.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-37.8	-179.4	60.4	0	0	0	0	112.6	V91 Y93 S100 F101 Q102 K106 W107 I108 L123	V91-T104 HydrophobicContact CG1-CG2 4.13Å; Y93-T104 HydrophobicContact CD1-CG2 4.1Å; Y93-T104 HydrophobicContact CG-CG2 4.27Å; S100-T104 WeakPolarHBondContact O-CG2 3.48Å; F101-T104 WeakPolarHBondContact O-CB 3.4Å; F101-T104 WeakPolarHBondContact O-CG2 3.26Å; F101-T104 PolarHBondContact O-N 3.39Å; F101-T104 VanDerWaalsContact O-N 3.16Å; F101-T104 PolarHBondContact O-OG1 3.16Å; Q102-T104 PolarHBondContact O-N 2.96Å; T104-K106 VanDerWaalsContact C-N 3.34Å; T104-K106 PolarHBondContact O-N 2.95Å; T104-W107 PolarHBondContact O-N 3.22Å; T104-I108 VanDerWaalsContact O-CG1 3.3Å; T104-I108 WeakPolarHBondContact O-CG1 3.31Å; T104-I108 PolarHBondContact O-N 3.26Å; T104-L123 HydrophobicContact CG2-CD1 3.76Å
105	S	95.7	Very high	95.8	Very high	35 Å²	35	48.5 Å²	48.5	25%	0.245	24%	0.243	C	C	.	.	H	α-helix	trans	-58.1	-46.8	176.7	-61.9	0	0	0	0	111.4	Q103 W107 I108 D109	Q103-S105 VanDerWaalsContact C-N 3.32Å; Q103-S105 PolarHBondContact O-N 3.35Å; S105-W107 PolarHBondContact O-N 3.1Å; S105-I108 PolarHBondContact O-N 3.31Å; S105-I108 VanDerWaalsContact O-N 3.14Å; S105-D109 VanDerWaalsContact O-CG 3.23Å; S105-D109 PolarHBondContact O-N 3.33Å
106	K	94.1	Very high	95.4	Very high	100 Å²	100	50.3 Å²	50.3	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-44.9	177	-177	177.5	179.8	174.8	0	112.1	Q103 T104 I108 D109 D110	Q103-K106 PolarHBondContact O-N 2.99Å; T104-K106 VanDerWaalsContact C-N 3.34Å; T104-K106 PolarHBondContact O-N 2.95Å; K106-I108 VanDerWaalsContact C-N 3.29Å; K106-I108 PolarHBondContact O-N 2.9Å; K106-D109 PolarHBondContact O-N 3.49Å; K106-D110 VanDerWaalsContact O-CG 3.25Å; K106-D110 PolarHBondContact O-N 2.85Å
107	W	94.8	Very high	94.7	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-62	-38.1	177.2	-71.4	116	0	0	0	112.4	L19 E21 R76 I79 V91 Q103 T104 S105 V111	L19-W107 HydrophobicContact CB-CD2 4.35Å; L19-W107 HydrophobicContact CB-CE3 4.24Å; L19-W107 HydrophobicContact CD2-CE3 4.44Å; L19-W107 HydrophobicContact CD2-CZ3 4.41Å; E21-W107 PolarHBondContact OE1-NE1 2.78Å; R76-W107 HydrophobicContact CG-CH2 3.78Å; R76-W107 HydrophobicContact CG-CZ3 4.36Å; R76-W107 VanDerWaalsContact CZ-CZ2 3.48Å; R76-W107 VanDerWaalsContact NE-CH2 3.34Å; R76-W107 VanDerWaalsContact NH2-CE2 3.28Å; I79-W107 HydrophobicContact CD1-CH2 3.43Å; I79-W107 VanDerWaalsContact CD1-CH2 3.43Å; I79-W107 HydrophobicContact CD1-CZ3 3.47Å; I79-W107 VanDerWaalsContact CD1-CZ3 3.47Å; I79-W107 HydrophobicContact CG2-CZ3 4.18Å; V91-W107 HydrophobicContact CG1-CB 3.86Å; V91-W107 HydrophobicContact CG1-CG 4.48Å; V91-W107 HydrophobicContact CG2-CB 4.43Å; Q103-W107 PolarHBondContact O-N 3.46Å; T104-W107 PolarHBondContact O-N 3.22Å; S105-W107 PolarHBondContact O-N 3.1Å; W107-V111 VanDerWaalsContact O-CG2 3.25Å; W107-V111 WeakPolarHBondContact O-CG2 3.38Å; W107-V111 PolarHBondContact O-N 2.91Å; W107-V111 VanDerWaalsContact O-N 3.11Å
108	I	95.8	Very high	94.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-69.4	-39.9	177.6	-70	170.2	0	0	0	110.8	V91 T104 S105 K106 V111 R112 I121 L148 V150	V91-I108 HydrophobicContact CB-CG1 4.45Å; V91-I108 HydrophobicContact CG1-CG1 4.41Å; V91-I108 HydrophobicContact CG2-CG1 3.96Å; T104-I108 VanDerWaalsContact O-CG1 3.3Å; T104-I108 WeakPolarHBondContact O-CG1 3.31Å; T104-I108 PolarHBondContact O-N 3.26Å; S105-I108 PolarHBondContact O-N 3.31Å; S105-I108 VanDerWaalsContact O-N 3.14Å; K106-I108 VanDerWaalsContact C-N 3.29Å; K106-I108 PolarHBondContact O-N 2.9Å; I108-V111 WeakPolarHBondContact O-CB 3.2Å; I108-V111 PolarHBondContact O-N 2.99Å; I108-R112 WeakPolarHBondContact O-CG 3.38Å; I108-R112 PolarHBondContact O-N 2.88Å; I108-I121 HydrophobicContact CD1-CG2 4.44Å; I108-I121 HydrophobicContact CG1-CG2 4.06Å; I108-I121 HydrophobicContact CG2-CD1 4.02Å; I108-L148 HydrophobicContact CD1-CD1 3.47Å; I108-L148 VanDerWaalsContact CD1-CD1 3.47Å; I108-V150 HydrophobicContact CD1-CG2 4.35Å; I108-V150 HydrophobicContact CG2-CG1 4.44Å
109	D	94.8	Very high	93.8	Very high	78 Å²	78	56.3 Å²	56.3	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-41.5	176.2	-66.3	-24.4	0	0	0	111.8	S105 K106 V111 R112 T113	S105-D109 VanDerWaalsContact O-CG 3.23Å; S105-D109 PolarHBondContact O-N 3.33Å; K106-D109 PolarHBondContact O-N 3.49Å; D109-V111 VanDerWaalsContact C-N 3.29Å; D109-V111 PolarHBondContact O-N 2.92Å; D109-R112 PolarHBondContact O-N 3.34Å; D109-T113 WeakPolarHBondContact O-CB 3.45Å; D109-T113 PolarHBondContact O-N 3.07Å; D109-T113 PolarHBondContact O-OG1 3.29Å
110	D	93.4	Very high	93.8	Very high	57 Å²	57	53.9 Å²	53.9	31%	0.305	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-41.9	173.6	-69.9	-20.7	0	0	0	110.7	I83 K106 T113 E114	I83-D110 HydrophobicContact CD1-CB 4.49Å; K106-D110 VanDerWaalsContact O-CG 3.25Å; K106-D110 PolarHBondContact O-N 2.85Å; D110-T113 PolarHBondContact O-N 3.31Å; D110-E114 PolarHBondContact O-N 2.87Å
111	V	95.4	Very high	93.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.4	-46.3	176.7	167.6	0	0	0	0	111.8	L19 I83 A89 W107 I108 D109 T113 E114 R115 V119 I121	L19-V111 HydrophobicContact CD1-CG2 3.33Å; I83-V111 HydrophobicContact CD1-CG2 3.95Å; I83-V111 HydrophobicContact CG1-CG2 4.35Å; I83-V111 HydrophobicContact CG2-CB 4.41Å; I83-V111 HydrophobicContact CG2-CG1 4.47Å; I83-V111 HydrophobicContact CG2-CG2 4.24Å; A89-V111 HydrophobicContact CB-CB 4.43Å; A89-V111 HydrophobicContact CB-CG1 3.82Å; A89-V111 HydrophobicContact CB-CG2 3.73Å; W107-V111 VanDerWaalsContact O-CG2 3.25Å; W107-V111 WeakPolarHBondContact O-CG2 3.38Å; W107-V111 PolarHBondContact O-N 2.91Å; W107-V111 VanDerWaalsContact O-N 3.11Å; I108-V111 WeakPolarHBondContact O-CB 3.2Å; I108-V111 PolarHBondContact O-N 2.99Å; D109-V111 VanDerWaalsContact C-N 3.29Å; D109-V111 PolarHBondContact O-N 2.92Å; V111-T113 VanDerWaalsContact C-N 3.32Å; V111-T113 PolarHBondContact O-N 3.3Å; V111-E114 PolarHBondContact O-N 2.96Å; V111-R115 PolarHBondContact O-N 2.96Å; V111-V119 HydrophobicContact CG1-CB 4.32Å; V111-V119 HydrophobicContact CG1-CG1 3.44Å; V111-V119 VanDerWaalsContact CG1-CG1 3.44Å; V111-V119 HydrophobicContact CG1-CG2 3.98Å; V111-I121 HydrophobicContact CB-CD1 4.33Å; V111-I121 HydrophobicContact CG1-CD1 3.7Å; V111-I121 HydrophobicContact CG1-CG1 4Å
112	R	94.9	Very high	93.8	Very high	93 Å²	93	53.9 Å²	53.9	35%	0.351	29%	0.288	S	S	.	.	H	α-helix	trans	-66	-35.1	178	-74.7	173	165.6	172.8	-5.5	112.6	I108 D109 E114 G116 I121 L148	I108-R112 WeakPolarHBondContact O-CG 3.38Å; I108-R112 PolarHBondContact O-N 2.88Å; D109-R112 PolarHBondContact O-N 3.34Å; R112-E114 VanDerWaalsContact C-N 3.34Å; R112-G116 WeakPolarHBondContact O-CA 3.19Å; R112-G116 PolarHBondContact O-N 3.4Å; R112-I121 HydrophobicContact CG-CD1 4.27Å; R112-L148 PolarHBondContact NH2-O 3.5Å
113	T	93.9	Very high	93.9	Very high	113 Å²	113	48.5 Å²	48.5	69%	0.693	26%	0.262	S	S	*	.	H	α-helix	trans	-64.1	-40.8	177.6	-59.8	0	0	0	0	111.2	D109 D110 V111	D109-T113 WeakPolarHBondContact O-CB 3.45Å; D109-T113 PolarHBondContact O-N 3.07Å; D109-T113 PolarHBondContact O-OG1 3.29Å; D110-T113 PolarHBondContact O-N 3.31Å; V111-T113 VanDerWaalsContact C-N 3.32Å; V111-T113 PolarHBondContact O-N 3.3Å
114	E	93.4	Very high	94	Very high	59 Å²	59	46 Å²	46	28%	0.276	25%	0.251	S	S	.	.	H	α-helix	trans	-86.2	-26.6	-178	-69.1	-67.2	145.9	0	0	114.5	P80 I83 R84 D110 V111 R112	P80-E114 HydrophobicContact CB-CG 4.06Å; I83-E114 HydrophobicContact CB-CB 4.18Å; I83-E114 HydrophobicContact CB-CG 4.45Å; I83-E114 HydrophobicContact CG2-CB 3.6Å; I83-E114 HydrophobicContact CG2-CG 4.28Å; R84-E114 IonicContact CZ-OE2 2.84Å; R84-E114 IonicContact NE-OE2 3.98Å; R84-E114 PolarHBondContact NE-OE2 3.44Å; R84-E114 IonicContact NH2-OE2 3.27Å; R84-E114 PolarHBondContact NH2-OE2 3.39Å; D110-E114 PolarHBondContact O-N 2.87Å; V111-E114 PolarHBondContact O-N 2.96Å; R112-E114 VanDerWaalsContact C-N 3.34Å
115	R	92.1	Very high	94.1	Very high	82 Å²	82	46 Å²	46	31%	0.309	25%	0.251	S	S	.	.	H	α-helix	trans	-121.9	-10.7	-173.9	-68.2	-71.7	-78.8	164.3	7.6	115.6	I83 R84 S86 V111 V119	I83-R115 HydrophobicContact CG2-CG 3.84Å; I83-R115 VanDerWaalsContact O-CD 3.27Å; I83-R115 WeakPolarHBondContact O-CD 3.49Å; I83-R115 VanDerWaalsContact O-CG 3.32Å; I83-R115 WeakPolarHBondContact O-CG 3.49Å; R84-R115 VanDerWaalsContact C-CD 3.44Å; R84-R115 WeakPolarHBondContact O-CD 3.45Å; R84-R115 PolarHBondContact O-NE 2.88Å; R84-R115 PolarHBondContact O-NH1 2.9Å; S86-R115 PolarHBondContact O-NE 3.15Å; S86-R115 PolarHBondContact O-NH2 3.09Å; S86-R115 VanDerWaalsContact O-NH2 3.15Å; V111-R115 PolarHBondContact O-N 2.96Å; R115-V119 HydrophobicContact CB-CB 3.79Å; R115-V119 HydrophobicContact CB-CG1 3.74Å; R115-V119 HydrophobicContact CG-CB 4.26Å
116	G	89.3	Confident	94.3	Very high	38 Å²	38	44.5 Å²	44.5	39%	0.392	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	-145.9	-169.8	0	0	0	0	0	112.3	R112	R112-G116 WeakPolarHBondContact O-CA 3.19Å; R112-G116 PolarHBondContact O-N 3.4Å
117	S	84.3	Confident	94.5	Very high	114 Å²	114	42 Å²	42	80%	0.797	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.2	-175.6	47.9	0	0	0	0	115	V119	S117-V119 PolarHBondContact O-N 3.14Å
118	D	84.5	Confident	94.7	Very high	136 Å²	136	43 Å²	43	73%	0.727	24%	0.235	S	C	*	.	S	Bend	trans	-79.7	-8.3	-173	-62.8	-16.9	0	0	0	113.3
119	V	92.9	Very high	94.8	Very high	12 Å²	12	45.5 Å²	45.5	7%	0.073	25%	0.249	C	C	.	.	S	Bend	trans	-88.2	130.7	178.4	62.6	0	0	0	0	110.7	A89 V111 R115 S117 I121	A89-V119 HydrophobicContact CB-CG2 4.28Å; V111-V119 HydrophobicContact CG1-CB 4.32Å; V111-V119 HydrophobicContact CG1-CG1 3.44Å; V111-V119 VanDerWaalsContact CG1-CG1 3.44Å; V111-V119 HydrophobicContact CG1-CG2 3.98Å; R115-V119 HydrophobicContact CB-CB 3.79Å; R115-V119 HydrophobicContact CB-CG1 3.74Å; R115-V119 HydrophobicContact CG-CB 4.26Å; S117-V119 PolarHBondContact O-N 3.14Å; V119-I121 HydrophobicContact CG1-CD1 4.24Å; V119-I121 HydrophobicContact CG1-CG1 4.09Å; V119-I121 PolarHBondContact O-N 3.28Å
120	I	95.6	Very high	94.9	Very high	33 Å²	33	44.4 Å²	44.4	17%	0.169	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122.7	174.2	-63.7	163.1	0	0	0	108.1	T87 V88 A89 M151 A173 L174	T87-I120 PolarHBondContact O-N 3.44Å; V88-I120 CarbonylContact C-O 3.53Å; V88-I120 VanDerWaalsContact CA-O 3.23Å; V88-I120 WeakPolarHBondContact CA-O 3.25Å; V88-I120 HydrophobicContact CG1-CG2 4.44Å; V88-I120 HydrophobicContact CG2-CB 4.1Å; V88-I120 HydrophobicContact CG2-CD1 4.31Å; V88-I120 HydrophobicContact CG2-CG2 4.45Å; A89-I120 PolarHBondContact N-O 3.05Å; I120-M151 HydrophobicContact CG2-CE 3.1Å; I120-A173 HydrophobicContact CD1-CB 3.98Å; I120-A173 WeakPolarHBondContact CD1-O 3.23Å; I120-A173 HydrophobicContact CG2-CB 3.98Å; I120-L174 HydrophobicContact CD1-CD2 4.2Å
121	I	97.8	Very high	95	Very high	13 Å²	13	44.3 Å²	44.3	7%	0.067	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.1	179.7	-52.3	-179.4	0	0	0	109.8	A89 V91 I108 V111 R112 V119 V150 M151	A89-I121 WeakPolarHBondContact O-CA 3.39Å; V91-I121 HydrophobicContact CG2-CG2 4.19Å; I108-I121 HydrophobicContact CD1-CG2 4.44Å; I108-I121 HydrophobicContact CG1-CG2 4.06Å; I108-I121 HydrophobicContact CG2-CD1 4.02Å; V111-I121 HydrophobicContact CB-CD1 4.33Å; V111-I121 HydrophobicContact CG1-CD1 3.7Å; V111-I121 HydrophobicContact CG1-CG1 4Å; R112-I121 HydrophobicContact CG-CD1 4.27Å; V119-I121 HydrophobicContact CG1-CD1 4.24Å; V119-I121 HydrophobicContact CG1-CG1 4.09Å; V119-I121 PolarHBondContact O-N 3.28Å; I121-V150 HydrophobicContact CB-CB 4.1Å; I121-V150 HydrophobicContact CB-CG1 3.67Å; I121-V150 HydrophobicContact CD1-CG1 4.29Å; I121-V150 HydrophobicContact CG2-CB 4.1Å; I121-V150 HydrophobicContact CG2-CG1 3.74Å; I121-M151 PolarHBondContact O-N 3Å
122	M	98.3	Very high	95.1	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	112.7	175.9	178.2	66.1	76.5	0	0	109.6	A89 V90 V91 V124 M151 I153 L166 R169 V170	A89-M122 PolarHBondContact O-N 3.46Å; V90-M122 WeakPolarHBondContact CA-O 3.4Å; V91-M122 PolarHBondContact N-O 2.91Å; M122-V124 HydrophobicContact CG-CG2 3.79Å; M122-M151 HydrophobicContact CB-CE 4.47Å; M122-M151 HydrophobicContact CE-CB 3.6Å; M122-M151 HydrophobicContact CE-CE 3.77Å; M122-M151 HydrophobicContact CE-CG 4.29Å; M122-M151 HydrophobicContact CE-SD 3.7Å; M122-M151 HydrophobicContact SD-CB 3.51Å; M122-M151 VanDerWaalsContact SD-CB 3.51Å; M122-I153 HydrophobicContact CG-CG2 4.41Å; M122-I153 HydrophobicContact SD-CB 4.47Å; M122-I153 HydrophobicContact SD-CG2 3.86Å; M122-L166 HydrophobicContact CE-CD1 4.43Å; M122-L166 HydrophobicContact CG-CD1 3.48Å; M122-L166 VanDerWaalsContact CG-CD1 3.48Å; M122-L166 HydrophobicContact SD-CD1 4.27Å; M122-R169 HydrophobicContact CE-CB 3.9Å; M122-V170 HydrophobicContact CB-CG2 4.3Å; M122-V170 HydrophobicContact CE-CG2 4.11Å; M122-V170 HydrophobicContact CG-CG2 4.37Å
123	L	98.6	Very high	95.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	128.7	170.9	-177.2	64.3	0	0	0	109.8	V91 Y93 T104 R144 A145 V150 M151 F152 I153	V91-L123 HydrophobicContact CB-CD1 4.47Å; V91-L123 HydrophobicContact CG1-CD1 4.34Å; V91-L123 CarbonylContact O-C 3.58Å; V91-L123 WeakPolarHBondContact O-CA 3.15Å; Y93-L123 HydrophobicContact CD1-CD1 3.89Å; Y93-L123 HydrophobicContact CD1-CG 4.34Å; Y93-L123 HydrophobicContact CE1-CD1 4.14Å; Y93-L123 HydrophobicContact CE1-CD2 4.43Å; Y93-L123 HydrophobicContact CE1-CG 4.08Å; T104-L123 HydrophobicContact CG2-CD1 3.76Å; L123-R144 HydrophobicContact CD2-CB 4.45Å; L123-R144 HydrophobicContact CD2-CG 4.19Å; L123-A145 HydrophobicContact CD2-CB 4.18Å; L123-V150 HydrophobicContact CB-CG2 4.07Å; L123-M151 WeakPolarHBondContact CB-O 2.89Å; L123-M151 PolarHBondContact N-O 2.95Å; L123-F152 HydrophobicContact CB-CD2 4.22Å; L123-F152 HydrophobicContact CD2-CD2 4.04Å; L123-F152 HydrophobicContact CD2-CE2 4.46Å; L123-F152 HydrophobicContact CG-CD2 4.04Å; L123-F152 HydrophobicContact CG-CE2 4.5Å; L123-F152 WeakPolarHBondContact O-CA 3.24Å; L123-I153 PolarHBondContact O-N 2.59Å; L123-I153 VanDerWaalsContact O-N 3.11Å
124	V	98.8	Very high	95.4	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.5	-175.3	-176.5	0	0	0	0	111.3	L29 V90 V91 V92 Y93 M122 I153 T155 L166	L29-V124 HydrophobicContact CD1-CG1 4.16Å; V90-V124 HydrophobicContact CG1-CB 4.49Å; V90-V124 HydrophobicContact CG1-CG2 3.58Å; V91-V124 PolarHBondContact O-N 2.84Å; V92-V124 WeakPolarHBondContact CA-O 3.27Å; V92-V124 HydrophobicContact CG2-CB 4.28Å; Y93-V124 VanDerWaalsContact CD1-O 3.27Å; Y93-V124 WeakPolarHBondContact CD1-O 3.15Å; Y93-V124 PolarHBondContact N-O 2.84Å; M122-V124 HydrophobicContact CG-CG2 3.79Å; V124-I153 VanDerWaalsContact CA-O 3.3Å; V124-I153 WeakPolarHBondContact CA-O 3.25Å; V124-I153 HydrophobicContact CG2-CG2 4.1Å; V124-T155 HydrophobicContact CG1-CG2 3.89Å; V124-T155 VanDerWaalsContact CG1-OG1 3.27Å; V124-T155 WeakPolarHBondContact CG1-OG1 3.29Å; V124-L166 HydrophobicContact CG1-CD2 4.45Å; V124-L166 HydrophobicContact CG2-CD1 3.69Å; V124-L166 HydrophobicContact CG2-CD2 4.16Å
125	G	98.7	Very high	95.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	108	167.2	0	0	0	0	0	110.2	I153 E154 T155	G125-I153 PolarHBondContact N-O 3.22Å; G125-I153 VanDerWaalsContact N-O 3.11Å; G125-E154 CarbonylContact O-C 3.59Å; G125-E154 WeakPolarHBondContact O-CA 3.48Å; G125-T155 PolarHBondContact O-N 3.06Å
126	N	98.7	Very high	95.9	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	166.5	-177.9	-169.7	29.6	0	0	0	111.9	V24 L29 V92 Y93 I95 T155 A157	V24-N126 PolarHBondContact O-ND2 2.83Å; L29-N126 HydrophobicContact CD1-CB 4.36Å; V92-N126 HydrophobicContact CG1-CB 3.81Å; Y93-N126 PolarHBondContact O-N 2.85Å; I95-N126 PolarHBondContact N-O 3.05Å; I95-N126 VanDerWaalsContact N-O 3.09Å; N126-T155 CarbonylContact C-O 3.45Å; N126-T155 VanDerWaalsContact CA-O 3.29Å; N126-T155 WeakPolarHBondContact CA-O 3.22Å; N126-T155 PolarHBondContact OD1-O 2.78Å; N126-T155 PolarHBondContact OD1-OG1 3Å; N126-A157 PolarHBondContact OD1-N 3.21Å; N126-A157 VanDerWaalsContact OD1-N 3.15Å
127	K	98.3	Very high	96.4	Very high	46 Å²	46	52.7 Å²	52.7	20%	0.2	28%	0.283	C	S	.	.			trans	71.2	36.2	179.1	-44.1	-169.2	-165.2	171	0	114.2	S23 D94 I95 D129 L130 T155	S23-K127 VanDerWaalsContact O-CE 3.29Å; S23-K127 WeakPolarHBondContact O-CE 3.46Å; S23-K127 PolarHBondContact O-NZ 3.24Å; D94-K127 HydrophobicContact CB-CD 4.39Å; D94-K127 WeakPolarHBondContact OD2-CD 3.44Å; D94-K127 WeakPolarHBondContact OD2-CE 3.45Å; D94-K127 IonicContact OD2-NZ 3.58Å; D94-K127 PolarHBondContact OD2-NZ 3.12Å; I95-K127 WeakPolarHBondContact CD1-O 3.45Å; K127-D129 WeakPolarHBondContact CA-OD1 3.47Å; K127-D129 PolarHBondContact O-N 3.27Å; K127-L130 HydrophobicContact CB-CD1 4.2Å; K127-L130 HydrophobicContact CB-CG 4.44Å; K127-L130 HydrophobicContact CD-CD1 4.21Å; K127-L130 PolarHBondContact O-N 2.97Å; K127-T155 PolarHBondContact N-O 2.83Å
128	T	98.4	Very high	97	Very high	23 Å²	23	50.5 Å²	50.5	14%	0.141	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-59.2	-17.3	174.2	56.7	0	0	0	0	114.7	I95 L130 A131 E154 T155 S156	I95-T128 HydrophobicContact CD1-CG2 4.46Å; T128-L130 PolarHBondContact O-N 3.15Å; T128-A131 PolarHBondContact O-N 3.41Å; T128-E154 HydrophobicContact CG2-CB 3.64Å; T128-E154 HydrophobicContact CG2-CG 4.38Å; T128-E154 VanDerWaalsContact CG2-OE2 3.28Å; T128-E154 WeakPolarHBondContact CG2-OE2 3.5Å; T128-T155 WeakPolarHBondContact CG2-O 3.23Å; T128-T155 PolarHBondContact N-O 3.35Å; T128-T155 PolarHBondContact OG1-O 2.89Å; T128-S156 VanDerWaalsContact OG1-CB 3.32Å; T128-S156 WeakPolarHBondContact OG1-CB 3.44Å
129	D	98.1	Very high	97.6	Very high	53 Å²	53	50 Å²	50	28%	0.283	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-65	-15.3	170.6	57.8	-78.3	0	0	0	113.9	K127 S156 K158 T159	K127-D129 WeakPolarHBondContact CA-OD1 3.47Å; K127-D129 PolarHBondContact O-N 3.27Å; D129-S156 VanDerWaalsContact CG-OG 3.32Å; D129-S156 VanDerWaalsContact OD1-CB 3.3Å; D129-S156 WeakPolarHBondContact OD1-CB 3.39Å; D129-S156 PolarHBondContact OD1-OG 3.19Å; D129-K158 WeakPolarHBondContact OD2-CD 3.23Å; D129-T159 HydrophobicContact CB-CG2 3.85Å
130	L	97.1	Very high	97.9	Very high	55 Å²	55	53.8 Å²	53.8	29%	0.288	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-100.2	40.6	176.1	-57.6	-179.7	0	0	0	111.7	T96 K127 T128 D132 K133 R134	T96-L130 HydrophobicContact CG2-CB 3.64Å; T96-L130 HydrophobicContact CG2-CD1 4.1Å; K127-L130 HydrophobicContact CB-CD1 4.2Å; K127-L130 HydrophobicContact CB-CG 4.44Å; K127-L130 HydrophobicContact CD-CD1 4.21Å; K127-L130 PolarHBondContact O-N 2.97Å; T128-L130 PolarHBondContact O-N 3.15Å; L130-D132 PolarHBondContact O-N 3.28Å; L130-D132 VanDerWaalsContact O-N 3.16Å; L130-K133 CarbonylContact O-C 3.6Å; L130-K133 PolarHBondContact O-N 2.92Å; L130-R134 PolarHBondContact O-N 2.85Å
131	A	95.6	Very high	98	Very high	56 Å²	56	52.2 Å²	52.2	46%	0.463	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-53.4	-36.8	-176.3	0	0	0	0	0	113.4	T128 K133 R134	T128-A131 PolarHBondContact O-N 3.41Å; A131-K133 PolarHBondContact O-N 2.77Å; A131-R134 WeakPolarHBondContact O-CB 3.25Å; A131-R134 PolarHBondContact O-N 3.28Å
132	D	97.3	Very high	98	Very high	171 Å²	171	55.5 Å²	55.5	91%	0.914	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18.6	178.4	-56.9	-34.5	0	0	0	113.7	L130	L130-D132 PolarHBondContact O-N 3.28Å; L130-D132 VanDerWaalsContact O-N 3.16Å
133	K	97.7	Very high	98	Very high	143 Å²	143	60 Å²	60	62%	0.622	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-107.8	11.1	177.8	-60.8	-176.9	-178.9	-179	0	112.1	T96 L130 A131 Q135	T96-K133 WeakPolarHBondContact CA-O 3.5Å; T96-K133 WeakPolarHBondContact CB-O 3.38Å; T96-K133 HydrophobicContact CG2-CB 3.84Å; T96-K133 WeakPolarHBondContact CG2-O 3.39Å; L130-K133 CarbonylContact O-C 3.6Å; L130-K133 PolarHBondContact O-N 2.92Å; A131-K133 PolarHBondContact O-N 2.77Å; K133-Q135 PolarHBondContact O-N 3.41Å
134	R	98.4	Very high	97.9	Very high	73 Å²	73	63 Å²	63	28%	0.275	31%	0.311	S	S	.	.			trans	-59.4	129.2	-179	-179.9	179.5	-76.7	-90.2	9.5	109.9	I95 L130 A131 I136 E154	I95-R134 HydrophobicContact CD1-CB 4.26Å; I95-R134 HydrophobicContact CD1-CG 4.25Å; L130-R134 PolarHBondContact O-N 2.85Å; A131-R134 WeakPolarHBondContact O-CB 3.25Å; A131-R134 PolarHBondContact O-N 3.28Å; R134-I136 VanDerWaalsContact CD-O 3.25Å; R134-I136 WeakPolarHBondContact CD-O 3.3Å; R134-I136 WeakPolarHBondContact CG-O 3.47Å; R134-I136 PolarHBondContact NH1-O 2.75Å; R134-E154 IonicContact CZ-OE1 3.92Å; R134-E154 IonicContact CZ-OE2 2.73Å; R134-E154 IonicContact NH1-OE1 2.91Å; R134-E154 PolarHBondContact NH1-OE1 3.4Å; R134-E154 IonicContact NH1-OE2 2.67Å; R134-E154 IonicContact NH2-OE1 3.62Å; R134-E154 PolarHBondContact NH2-OE1 3.11Å; R134-E154 IonicContact NH2-OE2 2.99Å; R134-E154 PolarHBondContact NH2-OE2 2.94Å
135	Q	98.3	Very high	97.9	Very high	115 Å²	115	63.2 Å²	63.2	54%	0.537	31%	0.313	S	S	.	.			trans	-115.3	-15.6	173.9	-61.3	179.5	8.1	0	0	112.3	I95 T96 V98 K133	I95-Q135 PolarHBondContact O-N 2.81Å; T96-Q135 PolarHBondContact O-NE2 3.22Å; T96-Q135 VanDerWaalsContact O-NE2 3.07Å; T96-Q135 PolarHBondContact O-OE1 3.26Å; V98-Q135 HydrophobicContact CG2-CB 3.74Å; K133-Q135 PolarHBondContact O-N 3.41Å
136	I	98.3	Very high	97.8	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.01	34%	0.341	C	S	.	.	S	Bend	trans	-120.5	123.3	177	-57	91.9	0	0	0	108.4	Y93 I95 V98 F101 R134 E140	Y93-I136 HydrophobicContact CE2-CB 4.23Å; Y93-I136 HydrophobicContact CE2-CG2 4.05Å; I95-I136 VanDerWaalsContact O-CD1 3.28Å; I95-I136 WeakPolarHBondContact O-CD1 3.36Å; I95-I136 PolarHBondContact O-N 2.86Å; I95-I136 VanDerWaalsContact O-N 3.16Å; V98-I136 HydrophobicContact CG2-CD1 4.2Å; V98-I136 HydrophobicContact CG2-CG1 4.44Å; F101-I136 HydrophobicContact CB-CD1 4.16Å; F101-I136 HydrophobicContact CB-CG1 3.89Å; F101-I136 HydrophobicContact CD1-CG1 4.05Å; F101-I136 HydrophobicContact CD1-CG2 4.08Å; F101-I136 HydrophobicContact CD2-CG2 4.17Å; F101-I136 HydrophobicContact CE1-CG2 4.07Å; F101-I136 HydrophobicContact CE2-CG2 4.17Å; F101-I136 HydrophobicContact CG-CG1 3.99Å; F101-I136 HydrophobicContact CG-CG2 4.12Å; F101-I136 HydrophobicContact CZ-CG2 4.11Å; R134-I136 VanDerWaalsContact CD-O 3.25Å; R134-I136 WeakPolarHBondContact CD-O 3.3Å; R134-I136 WeakPolarHBondContact CG-O 3.47Å; R134-I136 PolarHBondContact NH1-O 2.75Å; I136-E140 VanDerWaalsContact CA-OE2 3.31Å; I136-E140 WeakPolarHBondContact CA-OE2 3.42Å; I136-E140 HydrophobicContact CG2-CB 3.91Å
137	T	98.1	Very high	97.7	Very high	56 Å²	56	74.8 Å²	74.8	34%	0.344	37%	0.365	S	S	.	.			trans	-75.5	164.2	177.5	87.1	0	0	0	0	111.6	E139 E140 G141	T137-E139 WeakPolarHBondContact CB-OE2 3.49Å; T137-E139 PolarHBondContact O-N 2.74Å; T137-E139 PolarHBondContact OG1-N 3.23Å; T137-E139 PolarHBondContact OG1-OE2 2.81Å; T137-E140 PolarHBondContact N-OE2 3.21Å; T137-E140 PolarHBondContact O-N 3.45Å; T137-E140 PolarHBondContact OG1-N 2.95Å; T137-G141 PolarHBondContact O-N 2.85Å
138	I	97.4	Very high	97.6	Very high	69 Å²	69	73.9 Å²	73.9	35%	0.354	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-40.5	176.9	-59.5	179.5	0	0	0	109.2	E140 G141 E142 F152 E154	I138-E140 PolarHBondContact O-N 2.82Å; I138-G141 PolarHBondContact O-N 2.82Å; I138-G141 VanDerWaalsContact O-N 3.15Å; I138-E142 HydrophobicContact CG2-CG 4.37Å; I138-E142 WeakPolarHBondContact O-CG 3.22Å; I138-E142 PolarHBondContact O-N 2.87Å; I138-F152 HydrophobicContact CG2-CE1 4.25Å; I138-E154 WeakPolarHBondContact CG1-OE2 3.44Å
139	E	98.3	Very high	97.5	Very high	124 Å²	124	77.7 Å²	77.7	58%	0.579	39%	0.39	S	S	*	.	H	α-helix	trans	-63	-40.1	-179.6	-57.7	72.1	-156.8	0	0	111.6	T137 G141 E142 Q143	T137-E139 WeakPolarHBondContact CB-OE2 3.49Å; T137-E139 PolarHBondContact O-N 2.74Å; T137-E139 PolarHBondContact OG1-N 3.23Å; T137-E139 PolarHBondContact OG1-OE2 2.81Å; E139-G141 VanDerWaalsContact C-N 3.35Å; E139-E142 PolarHBondContact O-N 3.42Å; E139-Q143 WeakPolarHBondContact O-CB 3.4Å; E139-Q143 PolarHBondContact O-N 3.1Å
140	E	98.1	Very high	97.4	Very high	92 Å²	92	76.2 Å²	76.2	43%	0.43	38%	0.382	S	S	.	.	H	α-helix	trans	-62.8	-42	173.9	-70.3	178.3	122	0	0	111.6	F101 I136 T137 I138 Q143 R144	F101-E140 HydrophobicContact CZ-CB 4.45Å; I136-E140 VanDerWaalsContact CA-OE2 3.31Å; I136-E140 WeakPolarHBondContact CA-OE2 3.42Å; I136-E140 HydrophobicContact CG2-CB 3.91Å; T137-E140 PolarHBondContact N-OE2 3.21Å; T137-E140 PolarHBondContact O-N 3.45Å; T137-E140 PolarHBondContact OG1-N 2.95Å; I138-E140 PolarHBondContact O-N 2.82Å; E140-Q143 PolarHBondContact O-N 3.38Å; E140-R144 WeakPolarHBondContact O-CB 3.33Å; E140-R144 PolarHBondContact O-N 2.81Å
141	G	97.8	Very high	97.5	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-46.5	175.2	0	0	0	0	0	112.7	T137 I138 E139 R144 A145	T137-G141 PolarHBondContact O-N 2.85Å; I138-G141 PolarHBondContact O-N 2.82Å; I138-G141 VanDerWaalsContact O-N 3.15Å; E139-G141 VanDerWaalsContact C-N 3.35Å; G141-R144 PolarHBondContact O-N 3.19Å; G141-A145 WeakPolarHBondContact O-CB 3.44Å; G141-A145 PolarHBondContact O-N 2.78Å
142	E	98.1	Very high	97.6	Very high	83 Å²	83	75.2 Å²	75.2	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-63.1	-42.9	175.8	-74	-174.5	175.5	0	0	112.3	I138 E139 A145 K146 F152	I138-E142 HydrophobicContact CG2-CG 4.37Å; I138-E142 WeakPolarHBondContact O-CG 3.22Å; I138-E142 PolarHBondContact O-N 2.87Å; E139-E142 PolarHBondContact O-N 3.42Å; E142-A145 PolarHBondContact O-N 2.89Å; E142-K146 VanDerWaalsContact O-CG 3.31Å; E142-K146 WeakPolarHBondContact O-CG 3.46Å; E142-K146 PolarHBondContact O-N 2.99Å; E142-F152 HydrophobicContact CB-CD1 4.4Å; E142-F152 HydrophobicContact CG-CD1 3.54Å; E142-F152 HydrophobicContact CG-CE1 3.63Å
143	Q	98.3	Very high	97.7	Very high	96 Å²	96	67.4 Å²	67.4	45%	0.449	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-46	179.2	-179	57	31	0	0	110.7	E139 E140 A145 K146 E147	E139-Q143 WeakPolarHBondContact O-CB 3.4Å; E139-Q143 PolarHBondContact O-N 3.1Å; E140-Q143 PolarHBondContact O-N 3.38Å; Q143-A145 VanDerWaalsContact C-N 3.32Å; Q143-A145 PolarHBondContact O-N 3.21Å; Q143-K146 PolarHBondContact O-N 3.03Å; Q143-E147 WeakPolarHBondContact CG-OE1 3.47Å; Q143-E147 PolarHBondContact NE2-OE1 3.43Å; Q143-E147 WeakPolarHBondContact O-CG 3.38Å; Q143-E147 PolarHBondContact O-N 3.01Å
144	R	97.4	Very high	97.7	Very high	63 Å²	63	61.3 Å²	61.3	24%	0.238	30%	0.299	C	S	.	.	H	α-helix	trans	-59.7	-42.4	174	179.5	130.7	-64.3	147.4	4.4	112	F101 L123 E140 G141 K146 E147 L148	F101-R144 HydrophobicContact CE2-CB 4.06Å; F101-R144 HydrophobicContact CE2-CG 4.23Å; F101-R144 HydrophobicContact CZ-CB 3.71Å; F101-R144 HydrophobicContact CZ-CG 4.15Å; L123-R144 HydrophobicContact CD2-CB 4.45Å; L123-R144 HydrophobicContact CD2-CG 4.19Å; E140-R144 WeakPolarHBondContact O-CB 3.33Å; E140-R144 PolarHBondContact O-N 2.81Å; G141-R144 PolarHBondContact O-N 3.19Å; R144-K146 VanDerWaalsContact C-N 3.34Å; R144-K146 PolarHBondContact O-N 3.37Å; R144-E147 PolarHBondContact O-N 2.82Å; R144-L148 HydrophobicContact CG-CD1 3.8Å; R144-L148 HydrophobicContact CG-CG 4.43Å; R144-L148 WeakPolarHBondContact O-CB 3.35Å; R144-L148 WeakPolarHBondContact O-CG 3.26Å; R144-L148 PolarHBondContact O-N 2.69Å
145	A	97.7	Very high	97.7	Very high	4 Å²	4	57.9 Å²	57.9	3%	0.033	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-39.3	178.6	0	0	0	0	0	112.4	L123 G141 E142 Q143 L148 S149 V150 F152	L123-A145 HydrophobicContact CD2-CB 4.18Å; G141-A145 WeakPolarHBondContact O-CB 3.44Å; G141-A145 PolarHBondContact O-N 2.78Å; E142-A145 PolarHBondContact O-N 2.89Å; Q143-A145 VanDerWaalsContact C-N 3.32Å; Q143-A145 PolarHBondContact O-N 3.21Å; A145-L148 CarbonylContact O-C 3.4Å; A145-L148 PolarHBondContact O-N 3.11Å; A145-S149 WeakPolarHBondContact O-CA 3.4Å; A145-S149 PolarHBondContact O-N 3.26Å; A145-V150 HydrophobicContact CB-CG2 4.05Å; A145-V150 PolarHBondContact O-N 2.9Å; A145-F152 HydrophobicContact CB-CB 3.56Å; A145-F152 HydrophobicContact CB-CD2 4.4Å; A145-F152 HydrophobicContact CB-CG 4.18Å
146	K	97.6	Very high	97.7	Very high	136 Å²	136	52.4 Å²	52.4	59%	0.591	26%	0.26	S	S	*	.	H	α-helix	trans	-64	-48.7	173.8	-71.8	168.6	-172.5	167	0	111.6	E142 Q143 R144 L148 S149	E142-K146 VanDerWaalsContact O-CG 3.31Å; E142-K146 WeakPolarHBondContact O-CG 3.46Å; E142-K146 PolarHBondContact O-N 2.99Å; Q143-K146 PolarHBondContact O-N 3.03Å; R144-K146 VanDerWaalsContact C-N 3.34Å; R144-K146 PolarHBondContact O-N 3.37Å; K146-L148 VanDerWaalsContact C-N 3.27Å; K146-L148 PolarHBondContact O-N 2.58Å; K146-S149 PolarHBondContact O-N 3.15Å
147	E	96.7	Very high	97.7	Very high	111 Å²	111	52.4 Å²	52.4	52%	0.519	26%	0.26	S	S	.	.	H	α-helix	trans	-56	-43.5	176.9	-75.2	167.3	-172.2	0	0	111.8	Q143 R144 S149	Q143-E147 WeakPolarHBondContact CG-OE1 3.47Å; Q143-E147 PolarHBondContact NE2-OE1 3.43Å; Q143-E147 WeakPolarHBondContact O-CG 3.38Å; Q143-E147 PolarHBondContact O-N 3.01Å; R144-E147 PolarHBondContact O-N 2.82Å; E147-S149 VanDerWaalsContact C-N 3.3Å
148	L	94.9	Very high	97.6	Very high	26 Å²	26	54.4 Å²	54.4	14%	0.136	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.1	178.9	-61.7	176.2	0	0	0	112.6	I108 R112 R144 A145 K146 V150	I108-L148 HydrophobicContact CD1-CD1 3.47Å; I108-L148 VanDerWaalsContact CD1-CD1 3.47Å; R112-L148 PolarHBondContact NH2-O 3.5Å; R144-L148 HydrophobicContact CG-CD1 3.8Å; R144-L148 HydrophobicContact CG-CG 4.43Å; R144-L148 WeakPolarHBondContact O-CB 3.35Å; R144-L148 WeakPolarHBondContact O-CG 3.26Å; R144-L148 PolarHBondContact O-N 2.69Å; A145-L148 CarbonylContact O-C 3.4Å; A145-L148 PolarHBondContact O-N 3.11Å; K146-L148 VanDerWaalsContact C-N 3.27Å; K146-L148 PolarHBondContact O-N 2.58Å; L148-V150 VanDerWaalsContact C-N 3.33Å; L148-V150 HydrophobicContact CB-CG1 4.24Å; L148-V150 HydrophobicContact CB-CG2 4.16Å; L148-V150 WeakPolarHBondContact O-CG1 3.45Å; L148-V150 PolarHBondContact O-N 2.9Å
149	S	95.6	Very high	97.6	Very high	104 Å²	104	55.4 Å²	55.4	73%	0.727	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	48.2	-176.6	-57.8	0	0	0	0	113.2	A145 K146 E147	A145-S149 WeakPolarHBondContact O-CA 3.4Å; A145-S149 PolarHBondContact O-N 3.26Å; K146-S149 PolarHBondContact O-N 3.15Å; E147-S149 VanDerWaalsContact C-N 3.3Å
150	V	97.3	Very high	97.6	Very high	22 Å²	22	50.5 Å²	50.5	13%	0.133	26%	0.257	C	S	.	.			trans	-123.7	162.6	178.4	-58.3	0	0	0	0	110.8	I108 I121 L123 A145 L148	I108-V150 HydrophobicContact CD1-CG2 4.35Å; I108-V150 HydrophobicContact CG2-CG1 4.44Å; I121-V150 HydrophobicContact CB-CB 4.1Å; I121-V150 HydrophobicContact CB-CG1 3.67Å; I121-V150 HydrophobicContact CD1-CG1 4.29Å; I121-V150 HydrophobicContact CG2-CB 4.1Å; I121-V150 HydrophobicContact CG2-CG1 3.74Å; L123-V150 HydrophobicContact CB-CG2 4.07Å; A145-V150 HydrophobicContact CB-CG2 4.05Å; A145-V150 PolarHBondContact O-N 2.9Å; L148-V150 VanDerWaalsContact C-N 3.33Å; L148-V150 HydrophobicContact CB-CG1 4.24Å; L148-V150 HydrophobicContact CB-CG2 4.16Å; L148-V150 WeakPolarHBondContact O-CG1 3.45Å; L148-V150 PolarHBondContact O-N 2.9Å
151	M	98	Very high	97.6	Very high	61 Å²	61	52.2 Å²	52.2	30%	0.3	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	156.8	174	-68.4	-177.4	-72.2	0	0	111.5	I120 I121 M122 L123 A173	I120-M151 HydrophobicContact CG2-CE 3.1Å; I121-M151 PolarHBondContact O-N 3Å; M122-M151 HydrophobicContact CB-CE 4.47Å; M122-M151 HydrophobicContact CE-CB 3.6Å; M122-M151 HydrophobicContact CE-CE 3.77Å; M122-M151 HydrophobicContact CE-CG 4.29Å; M122-M151 HydrophobicContact CE-SD 3.7Å; M122-M151 HydrophobicContact SD-CB 3.51Å; M122-M151 VanDerWaalsContact SD-CB 3.51Å; L123-M151 WeakPolarHBondContact CB-O 2.89Å; L123-M151 PolarHBondContact N-O 2.95Å; M151-A173 HydrophobicContact CE-CB 3.99Å; M151-A173 HydrophobicContact SD-CB 4.21Å
152	F	98.6	Very high	97.6	Very high	29 Å²	29	53.9 Å²	53.9	13%	0.127	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.2	179.1	-178.8	-112.7	0	0	0	113	Y93 L123 I138 E142 A145 E154 R169	Y93-F152 HydrophobicContact CE1-CE2 4.14Å; Y93-F152 WeakPolarHBondContact OH-CE2 3.32Å; L123-F152 HydrophobicContact CB-CD2 4.22Å; L123-F152 HydrophobicContact CD2-CD2 4.04Å; L123-F152 HydrophobicContact CD2-CE2 4.46Å; L123-F152 HydrophobicContact CG-CD2 4.04Å; L123-F152 HydrophobicContact CG-CE2 4.5Å; L123-F152 WeakPolarHBondContact O-CA 3.24Å; I138-F152 HydrophobicContact CG2-CE1 4.25Å; E142-F152 HydrophobicContact CB-CD1 4.4Å; E142-F152 HydrophobicContact CG-CD1 3.54Å; E142-F152 HydrophobicContact CG-CE1 3.63Å; A145-F152 HydrophobicContact CB-CB 3.56Å; A145-F152 HydrophobicContact CB-CD2 4.4Å; A145-F152 HydrophobicContact CB-CG 4.18Å; F152-E154 HydrophobicContact CE1-CG 4.09Å; F152-E154 HydrophobicContact CE2-CG 4.47Å; F152-E154 HydrophobicContact CZ-CG 3.62Å; F152-R169 PolarHBondContact O-NH1 2.9Å
153	I	98.6	Very high	97.6	Very high	6 Å²	6	50 Å²	50	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	143.6	167	-169	168.1	0	0	0	110.7	M122 L123 V124 G125 T155 N162 Q165 L166	M122-I153 HydrophobicContact CG-CG2 4.41Å; M122-I153 HydrophobicContact SD-CB 4.47Å; M122-I153 HydrophobicContact SD-CG2 3.86Å; L123-I153 PolarHBondContact O-N 2.59Å; L123-I153 VanDerWaalsContact O-N 3.11Å; V124-I153 VanDerWaalsContact CA-O 3.3Å; V124-I153 WeakPolarHBondContact CA-O 3.25Å; V124-I153 HydrophobicContact CG2-CG2 4.1Å; G125-I153 PolarHBondContact N-O 3.22Å; G125-I153 VanDerWaalsContact N-O 3.11Å; I153-T155 HydrophobicContact CG2-CG2 4.28Å; I153-N162 HydrophobicContact CD1-CB 3.9Å; I153-N162 HydrophobicContact CG1-CB 4.18Å; I153-Q165 HydrophobicContact CD1-CB 4.06Å; I153-Q165 HydrophobicContact CD1-CG 4.01Å; I153-L166 HydrophobicContact CD1-CB 4.39Å; I153-L166 HydrophobicContact CG2-CB 4.19Å; I153-L166 HydrophobicContact CG2-CD1 3.71Å; I153-L166 HydrophobicContact CG2-CG 4.49Å
154	E	98.6	Very high	97.4	Very high	16 Å²	16	51.2 Å²	51.2	8%	0.075	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	145.5	166.3	-66.5	-158.5	151.2	0	0	112.1	G125 T128 R134 I138 F152 N162	G125-E154 CarbonylContact O-C 3.59Å; G125-E154 WeakPolarHBondContact O-CA 3.48Å; T128-E154 HydrophobicContact CG2-CB 3.64Å; T128-E154 HydrophobicContact CG2-CG 4.38Å; T128-E154 VanDerWaalsContact CG2-OE2 3.28Å; T128-E154 WeakPolarHBondContact CG2-OE2 3.5Å; R134-E154 IonicContact CZ-OE1 3.92Å; R134-E154 IonicContact CZ-OE2 2.73Å; R134-E154 IonicContact NH1-OE1 2.91Å; R134-E154 PolarHBondContact NH1-OE1 3.4Å; R134-E154 IonicContact NH1-OE2 2.67Å; R134-E154 IonicContact NH2-OE1 3.62Å; R134-E154 PolarHBondContact NH2-OE1 3.11Å; R134-E154 IonicContact NH2-OE2 2.99Å; R134-E154 PolarHBondContact NH2-OE2 2.94Å; I138-E154 WeakPolarHBondContact CG1-OE2 3.44Å; F152-E154 HydrophobicContact CE1-CG 4.09Å; F152-E154 HydrophobicContact CE2-CG 4.47Å; F152-E154 HydrophobicContact CZ-CG 3.62Å; E154-N162 WeakPolarHBondContact O-CB 3.18Å; E154-N162 PolarHBondContact O-ND2 2.8Å
155	T	98.7	Very high	97.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.26	C	S	.	.			trans	-141.2	160.8	-174.2	61.3	0	0	0	0	112.2	L29 V124 G125 N126 K127 T128 I153 Y161 N162 L166	L29-T155 WeakPolarHBondContact CD2-OG1 3.46Å; V124-T155 HydrophobicContact CG1-CG2 3.89Å; V124-T155 VanDerWaalsContact CG1-OG1 3.27Å; V124-T155 WeakPolarHBondContact CG1-OG1 3.29Å; G125-T155 PolarHBondContact O-N 3.06Å; N126-T155 CarbonylContact C-O 3.45Å; N126-T155 VanDerWaalsContact CA-O 3.29Å; N126-T155 WeakPolarHBondContact CA-O 3.22Å; N126-T155 PolarHBondContact OD1-O 2.78Å; N126-T155 PolarHBondContact OD1-OG1 3Å; K127-T155 PolarHBondContact N-O 2.83Å; T128-T155 WeakPolarHBondContact CG2-O 3.23Å; T128-T155 PolarHBondContact N-O 3.35Å; T128-T155 PolarHBondContact OG1-O 2.89Å; I153-T155 HydrophobicContact CG2-CG2 4.28Å; T155-Y161 WeakPolarHBondContact CA-O 3.35Å; T155-N162 HydrophobicContact CG2-CB 3.98Å; T155-L166 HydrophobicContact CG2-CB 4.25Å; T155-L166 HydrophobicContact CG2-CD2 4.34Å
156	S	98.4	Very high	97.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.259	C	S	.	.			trans	-131.2	110.5	162.1	163.1	0	0	0	0	108.9	T128 D129 K158 T159 G160 Y161	T128-S156 VanDerWaalsContact OG1-CB 3.32Å; T128-S156 WeakPolarHBondContact OG1-CB 3.44Å; D129-S156 VanDerWaalsContact CG-OG 3.32Å; D129-S156 VanDerWaalsContact OD1-CB 3.3Å; D129-S156 WeakPolarHBondContact OD1-CB 3.39Å; D129-S156 PolarHBondContact OD1-OG 3.19Å; S156-K158 PolarHBondContact O-N 3.38Å; S156-K158 PolarHBondContact OG-N 3.49Å; S156-T159 WeakPolarHBondContact CB-OG1 3.45Å; S156-T159 PolarHBondContact OG-N 3.37Å; S156-T159 VanDerWaalsContact OG-N 3.09Å; S156-T159 PolarHBondContact OG-OG1 2.86Å; S156-G160 CarbonylContact O-C 3.59Å; S156-G160 VanDerWaalsContact O-CA 3.28Å; S156-G160 WeakPolarHBondContact O-CA 3.48Å; S156-G160 PolarHBondContact O-N 2.92Å; S156-Y161 PolarHBondContact N-O 2.76Å; S156-Y161 PolarHBondContact O-N 3.03Å
157	A	97.7	Very high	97.3	Very high	2 Å²	2	45.1 Å²	45.1	2%	0.017	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-32.1	171.9	0	0	0	0	0	112.4	L29 R32 F38 N126	L29-A157 HydrophobicContact CD2-CB 3.91Å; L29-A157 HydrophobicContact CG-CB 4.1Å; R32-A157 PolarHBondContact NE-O 3.3Å; F38-A157 HydrophobicContact CD2-CB 4.26Å; F38-A157 HydrophobicContact CE2-CB 4.25Å; N126-A157 PolarHBondContact OD1-N 3.21Å; N126-A157 VanDerWaalsContact OD1-N 3.15Å
158	K	96.9	Very high	97.1	Very high	98 Å²	98	47.8 Å²	47.8	43%	0.426	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-52.6	-179.3	-172.4	-177.5	-174.4	-179.7	0	111.7	R32 F38 D129 S156	R32-K158 PolarHBondContact NH2-O 2.91Å; F38-K158 HydrophobicContact CD1-CB 4.35Å; F38-K158 HydrophobicContact CD1-CG 3.98Å; F38-K158 HydrophobicContact CD2-CB 4.26Å; F38-K158 HydrophobicContact CE1-CB 4.18Å; F38-K158 HydrophobicContact CE1-CD 4.49Å; F38-K158 HydrophobicContact CE1-CG 3.87Å; F38-K158 HydrophobicContact CE2-CB 4.09Å; F38-K158 HydrophobicContact CG-CB 4.38Å; F38-K158 HydrophobicContact CG-CG 4.42Å; F38-K158 HydrophobicContact CZ-CB 4.05Å; F38-K158 HydrophobicContact CZ-CG 4.23Å; D129-K158 WeakPolarHBondContact OD2-CD 3.23Å; S156-K158 PolarHBondContact O-N 3.38Å; S156-K158 PolarHBondContact OG-N 3.49Å
159	T	97.2	Very high	97.1	Very high	90 Å²	90	51.7 Å²	51.7	55%	0.552	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-17.3	-177.5	61.8	0	0	0	0	113.2	D129 S156 Y161	D129-T159 HydrophobicContact CB-CG2 3.85Å; S156-T159 WeakPolarHBondContact CB-OG1 3.45Å; S156-T159 PolarHBondContact OG-N 3.37Å; S156-T159 VanDerWaalsContact OG-N 3.09Å; S156-T159 PolarHBondContact OG-OG1 2.86Å; T159-Y161 VanDerWaalsContact C-N 3.27Å; T159-Y161 WeakPolarHBondContact OG1-CB 3.48Å; T159-Y161 PolarHBondContact OG1-N 2.95Å
160	G	97.3	Very high	97	Very high	22 Å²	22	46.7 Å²	46.7	23%	0.227	21%	0.214	C	C	.	.			trans	82.8	-0.1	-170.5	0	0	0	0	0	113.8	S156 N162 V163	S156-G160 CarbonylContact O-C 3.59Å; S156-G160 VanDerWaalsContact O-CA 3.28Å; S156-G160 WeakPolarHBondContact O-CA 3.48Å; S156-G160 PolarHBondContact O-N 2.92Å; G160-N162 PolarHBondContact O-N 3.17Å; G160-V163 PolarHBondContact O-N 2.86Å
161	Y	98.3	Very high	96.7	Very high	127 Å²	127	45.7 Å²	45.7	50%	0.498	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	126.3	179.2	179.4	-105.6	0	0	0	111	T155 S156 T159 V163	T155-Y161 WeakPolarHBondContact CA-O 3.35Å; S156-Y161 PolarHBondContact N-O 2.76Å; S156-Y161 PolarHBondContact O-N 3.03Å; T159-Y161 VanDerWaalsContact C-N 3.27Å; T159-Y161 WeakPolarHBondContact OG1-CB 3.48Å; T159-Y161 PolarHBondContact OG1-N 2.95Å; Y161-V163 PolarHBondContact O-N 2.82Å
162	N	98.1	Very high	96.3	Very high	36 Å²	36	45.3 Å²	45.3	19%	0.193	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	3.4	-179.2	-73.8	-6.9	0	0	0	117.3	I153 E154 T155 G160 K164 Q165 L166	I153-N162 HydrophobicContact CD1-CB 3.9Å; I153-N162 HydrophobicContact CG1-CB 4.18Å; E154-N162 WeakPolarHBondContact O-CB 3.18Å; E154-N162 PolarHBondContact O-ND2 2.8Å; T155-N162 HydrophobicContact CG2-CB 3.98Å; G160-N162 PolarHBondContact O-N 3.17Å; N162-K164 PolarHBondContact O-N 2.93Å; N162-Q165 HydrophobicContact CB-CB 4.5Å; N162-Q165 CarbonylContact O-C 3.51Å; N162-Q165 PolarHBondContact O-N 2.72Å; N162-Q165 VanDerWaalsContact O-N 3.14Å; N162-Q165 PolarHBondContact OD1-OE1 2.73Å; N162-L166 WeakPolarHBondContact O-CB 3.41Å; N162-L166 PolarHBondContact O-N 3.45Å
163	V	97.9	Very high	96	Very high	2 Å²	2	46 Å²	46	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-47.8	180	-179.5	0	0	0	0	110.7	L29 R32 F33 G160 Y161 Q165 L166 F167	L29-V163 HydrophobicContact CD2-CG2 3.79Å; R32-V163 HydrophobicContact CB-CG1 4.39Å; R32-V163 HydrophobicContact CG-CB 4.1Å; R32-V163 HydrophobicContact CG-CG1 3.94Å; R32-V163 HydrophobicContact CG-CG2 3.89Å; F33-V163 HydrophobicContact CB-CG1 3.99Å; G160-V163 PolarHBondContact O-N 2.86Å; Y161-V163 PolarHBondContact O-N 2.82Å; V163-Q165 VanDerWaalsContact C-N 3.26Å; V163-Q165 PolarHBondContact O-N 2.87Å; V163-L166 WeakPolarHBondContact O-CB 3.26Å; V163-L166 PolarHBondContact O-N 3Å; V163-F167 HydrophobicContact CG1-CD2 4.3Å; V163-F167 HydrophobicContact CG1-CE2 4.04Å; V163-F167 VanDerWaalsContact O-CD2 3.25Å; V163-F167 WeakPolarHBondContact O-CD2 3.01Å; V163-F167 PolarHBondContact O-N 3.06Å
164	K	95	Very high	95.6	Very high	120 Å²	120	45.7 Å²	45.7	52%	0.522	22%	0.224	S	C	.	.	H	α-helix	trans	-62.1	-35.4	175.3	-67.8	175.2	-176.3	166.2	0	111.7	D36 N162 R168	D36-K164 IonicContact OD2-NZ 2.74Å; D36-K164 PolarHBondContact OD2-NZ 3.4Å; N162-K164 PolarHBondContact O-N 2.93Å; K164-R168 VanDerWaalsContact O-CG 3.32Å; K164-R168 WeakPolarHBondContact O-CG 3.27Å; K164-R168 PolarHBondContact O-N 2.9Å; K164-R168 VanDerWaalsContact O-N 3.09Å
165	Q	96.6	Very high	94.8	Very high	74 Å²	74	48.6 Å²	48.6	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-69.8	-39.3	178.7	-168.4	-179.4	21.9	0	0	112.2	I153 N162 V163 F167 R168 R169	I153-Q165 HydrophobicContact CD1-CB 4.06Å; I153-Q165 HydrophobicContact CD1-CG 4.01Å; N162-Q165 HydrophobicContact CB-CB 4.5Å; N162-Q165 CarbonylContact O-C 3.51Å; N162-Q165 PolarHBondContact O-N 2.72Å; N162-Q165 VanDerWaalsContact O-N 3.14Å; N162-Q165 PolarHBondContact OD1-OE1 2.73Å; V163-Q165 VanDerWaalsContact C-N 3.26Å; V163-Q165 PolarHBondContact O-N 2.87Å; Q165-F167 PolarHBondContact O-N 2.93Å; Q165-R168 PolarHBondContact O-N 3.32Å; Q165-R169 HydrophobicContact CG-CG 4.39Å; Q165-R169 WeakPolarHBondContact O-CG 3.09Å; Q165-R169 PolarHBondContact O-N 3.07Å
166	L	97.5	Very high	93.6	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-52.1	-54.6	173.6	163.8	63.3	0	0	0	110.6	M122 V124 I153 T155 N162 V163 R168 R169 V170	M122-L166 HydrophobicContact CE-CD1 4.43Å; M122-L166 HydrophobicContact CG-CD1 3.48Å; M122-L166 VanDerWaalsContact CG-CD1 3.48Å; M122-L166 HydrophobicContact SD-CD1 4.27Å; V124-L166 HydrophobicContact CG1-CD2 4.45Å; V124-L166 HydrophobicContact CG2-CD1 3.69Å; V124-L166 HydrophobicContact CG2-CD2 4.16Å; I153-L166 HydrophobicContact CD1-CB 4.39Å; I153-L166 HydrophobicContact CG2-CB 4.19Å; I153-L166 HydrophobicContact CG2-CD1 3.71Å; I153-L166 HydrophobicContact CG2-CG 4.49Å; T155-L166 HydrophobicContact CG2-CB 4.25Å; T155-L166 HydrophobicContact CG2-CD2 4.34Å; N162-L166 WeakPolarHBondContact O-CB 3.41Å; N162-L166 PolarHBondContact O-N 3.45Å; V163-L166 WeakPolarHBondContact O-CB 3.26Å; V163-L166 PolarHBondContact O-N 3Å; L166-R168 VanDerWaalsContact C-N 3.35Å; L166-R168 PolarHBondContact O-N 3.22Å; L166-R169 PolarHBondContact O-N 2.93Å; L166-V170 HydrophobicContact CD1-CG2 4.22Å; L166-V170 WeakPolarHBondContact O-CG2 3.19Å; L166-V170 PolarHBondContact O-N 2.84Å
167	F	95.1	Very high	91.7	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-68.8	-32	-179	-71.1	-84.3	0	0	0	113	L16 F18 F33 M55 L64 L66 V163 Q165 A171	L16-F167 HydrophobicContact CD2-CD1 4.13Å; L16-F167 HydrophobicContact CD2-CE1 4.05Å; F18-F167 HydrophobicContact CE1-CZ 4.27Å; F18-F167 HydrophobicContact CE2-CE1 4.48Å; F18-F167 AromaticContact CZ-CE1 3.78Å; F18-F167 HydrophobicContact CZ-CE1 3.78Å; F18-F167 AromaticContact CZ-CZ 3.6Å; F18-F167 HydrophobicContact CZ-CZ 3.6Å; F33-F167 HydrophobicContact CB-CD2 3.8Å; F33-F167 HydrophobicContact CB-CE2 3.28Å; F33-F167 HydrophobicContact CB-CZ 3.73Å; F33-F167 AromaticContact CD1-CD1 3.92Å; F33-F167 HydrophobicContact CD1-CD1 3.92Å; F33-F167 AromaticContact CD1-CD2 3.99Å; F33-F167 HydrophobicContact CD1-CD2 3.99Å; F33-F167 AromaticContact CD1-CE1 3.68Å; F33-F167 HydrophobicContact CD1-CE1 3.68Å; F33-F167 AromaticContact CD1-CE2 3.81Å; F33-F167 HydrophobicContact CD1-CE2 3.81Å; F33-F167 HydrophobicContact CD1-CG 4.06Å; F33-F167 AromaticContact CD1-CZ 3.62Å; F33-F167 HydrophobicContact CD1-CZ 3.62Å; F33-F167 HydrophobicContact CD2-CB 4.06Å; F33-F167 HydrophobicContact CD2-CD1 4.3Å; F33-F167 AromaticContact CD2-CD2 3.25Å; F33-F167 HydrophobicContact CD2-CD2 3.25Å; F33-F167 AromaticContact CD2-CE2 3.72Å; F33-F167 HydrophobicContact CD2-CE2 3.72Å; F33-F167 AromaticContact CD2-CG 3.61Å; F33-F167 HydrophobicContact CD2-CG 3.61Å; F33-F167 HydrophobicContact CD2-CZ 4.36Å; F33-F167 AromaticContact CE1-CD1 3.79Å; F33-F167 HydrophobicContact CE1-CD1 3.79Å; F33-F167 HydrophobicContact CE1-CD2 4.41Å; F33-F167 AromaticContact CE1-CE1 3.92Å; F33-F167 HydrophobicContact CE1-CE1 3.92Å; F33-F167 HydrophobicContact CE1-CG 4.04Å; F33-F167 HydrophobicContact CE1-CZ 4.32Å; F33-F167 HydrophobicContact CE2-CB 3.65Å; F33-F167 HydrophobicContact CE2-CD1 4.19Å; F33-F167 AromaticContact CE2-CD2 3.77Å; F33-F167 HydrophobicContact CE2-CD2 3.77Å; F33-F167 AromaticContact CE2-CG 3.59Å; F33-F167 HydrophobicContact CE2-CG 3.59Å; F33-F167 HydrophobicContact CG-CD1 4.17Å; F33-F167 AromaticContact CG-CD2 3.39Å; F33-F167 HydrophobicContact CG-CD2 3.39Å; F33-F167 HydrophobicContact CG-CE1 4.06Å; F33-F167 AromaticContact CG-CE2 3.31Å; F33-F167 HydrophobicContact CG-CE2 3.31Å; F33-F167 AromaticContact CG-CG 3.85Å; F33-F167 HydrophobicContact CG-CG 3.85Å; F33-F167 AromaticContact CG-CZ 3.64Å; F33-F167 HydrophobicContact CG-CZ 3.64Å; F33-F167 HydrophobicContact CZ-CB 4Å; F33-F167 AromaticContact CZ-CD1 3.94Å; F33-F167 HydrophobicContact CZ-CD1 3.94Å; F33-F167 HydrophobicContact CZ-CD2 4.32Å; F33-F167 AromaticContact CZ-CG 3.82Å; F33-F167 HydrophobicContact CZ-CG 3.82Å; M55-F167 HydrophobicContact CE-CB 4.37Å; M55-F167 HydrophobicContact SD-CB 4.09Å; L64-F167 HydrophobicContact CD1-CD1 3.95Å; L66-F167 HydrophobicContact CD2-CE1 3.82Å; V163-F167 HydrophobicContact CG1-CD2 4.3Å; V163-F167 HydrophobicContact CG1-CE2 4.04Å; V163-F167 VanDerWaalsContact O-CD2 3.25Å; V163-F167 WeakPolarHBondContact O-CD2 3.01Å; V163-F167 PolarHBondContact O-N 3.06Å; Q165-F167 PolarHBondContact O-N 2.93Å; F167-A171 WeakPolarHBondContact O-CB 3.43Å; F167-A171 PolarHBondContact O-N 3.14Å
168	R	93	Very high	89.5	Confident	166 Å²	166	62.4 Å²	62.4	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-65.1	-45	172.1	-75.7	176.2	-178.6	168.3	-1.3	112.2	M55 K164 Q165 L166 A171 A172	M55-R168 HydrophobicContact CE-CG 4.5Å; K164-R168 VanDerWaalsContact O-CG 3.32Å; K164-R168 WeakPolarHBondContact O-CG 3.27Å; K164-R168 PolarHBondContact O-N 2.9Å; K164-R168 VanDerWaalsContact O-N 3.09Å; Q165-R168 PolarHBondContact O-N 3.32Å; L166-R168 VanDerWaalsContact C-N 3.35Å; L166-R168 PolarHBondContact O-N 3.22Å; R168-A171 PolarHBondContact O-N 3.24Å; R168-A172 WeakPolarHBondContact O-CB 3.47Å; R168-A172 PolarHBondContact O-N 3.09Å
169	R	94.5	Very high	87.2	Confident	108 Å²	108	61.7 Å²	61.7	41%	0.408	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-43.3	176.8	-73.6	-173.1	-177.5	-165.9	-0.7	111.6	M122 F152 Q165 L166 A172 A173	M122-R169 HydrophobicContact CE-CB 3.9Å; F152-R169 PolarHBondContact O-NH1 2.9Å; Q165-R169 HydrophobicContact CG-CG 4.39Å; Q165-R169 WeakPolarHBondContact O-CG 3.09Å; Q165-R169 PolarHBondContact O-N 3.07Å; L166-R169 PolarHBondContact O-N 2.93Å; R169-A172 WeakPolarHBondContact O-CB 3.46Å; R169-A172 PolarHBondContact O-N 3.3Å; R169-A173 PolarHBondContact O-N 3.16Å; R169-A173 VanDerWaalsContact O-N 3.11Å
170	V	93.9	Very high	84.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.4	-49.9	173.6	167.4	0	0	0	0	110.3	L16 V88 M122 L166 A172 A173 L174	L16-V170 HydrophobicContact CD2-CG1 3.97Å; L16-V170 HydrophobicContact CG-CG1 4.3Å; V88-V170 HydrophobicContact CB-CG1 4.23Å; V88-V170 HydrophobicContact CG1-CG1 3.75Å; V88-V170 HydrophobicContact CG1-CG2 4.24Å; V88-V170 HydrophobicContact CG2-CG1 3.72Å; M122-V170 HydrophobicContact CB-CG2 4.3Å; M122-V170 HydrophobicContact CE-CG2 4.11Å; M122-V170 HydrophobicContact CG-CG2 4.37Å; L166-V170 HydrophobicContact CD1-CG2 4.22Å; L166-V170 WeakPolarHBondContact O-CG2 3.19Å; L166-V170 PolarHBondContact O-N 2.84Å; V170-A172 PolarHBondContact O-N 3.12Å; V170-A173 PolarHBondContact O-N 3.05Å; V170-L174 WeakPolarHBondContact O-CG 3.38Å; V170-L174 PolarHBondContact O-N 3.27Å
171	A	91.3	Very high	82.4	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-34.3	180	0	0	0	0	0	112.5	M55 L57 R60 F167 R168 A173 L174 M177	M55-A171 HydrophobicContact CE-CB 4.33Å; L57-A171 HydrophobicContact CD1-CB 3.92Å; L57-A171 HydrophobicContact CD2-CB 3.98Å; R60-A171 PolarHBondContact NH2-O 3.18Å; F167-A171 WeakPolarHBondContact O-CB 3.43Å; F167-A171 PolarHBondContact O-N 3.14Å; R168-A171 PolarHBondContact O-N 3.24Å; A171-A173 VanDerWaalsContact C-N 3.33Å; A171-L174 WeakPolarHBondContact O-CB 3.4Å; A171-L174 PolarHBondContact O-N 3.05Å; A171-M177 VanDerWaalsContact O-CE 3.26Å; A171-M177 WeakPolarHBondContact O-CE 3.2Å
172	A	89.8	Confident	79.9	Confident	53 Å²	53	76.3 Å²	76.3	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-66.5	-30.2	175	0	0	0	0	0	113.9	R168 R169 V170 M177	R168-A172 WeakPolarHBondContact O-CB 3.47Å; R168-A172 PolarHBondContact O-N 3.09Å; R169-A172 WeakPolarHBondContact O-CB 3.46Å; R169-A172 PolarHBondContact O-N 3.3Å; V170-A172 PolarHBondContact O-N 3.12Å; A172-M177 VanDerWaalsContact C-SD 3.51Å; A172-M177 VanDerWaalsContact CA-CE 3.47Å; A172-M177 WeakPolarHBondContact CA-SD 3.12Å; A172-M177 HydrophobicContact CB-CE 4.4Å; A172-M177 HydrophobicContact CB-SD 4.17Å; A172-M177 WeakPolarHBondContact O-CG 3.29Å
173	A	91	Very high	77.2	Confident	43 Å²	43	80.8 Å²	80.8	36%	0.355	42%	0.418	S	S	.	.	H	α-helix	trans	-83.2	-14.9	177.3	0	0	0	0	0	113.1	I120 M151 R169 V170 A171	I120-A173 HydrophobicContact CD1-CB 3.98Å; I120-A173 WeakPolarHBondContact CD1-O 3.23Å; I120-A173 HydrophobicContact CG2-CB 3.98Å; M151-A173 HydrophobicContact CE-CB 3.99Å; M151-A173 HydrophobicContact SD-CB 4.21Å; R169-A173 PolarHBondContact O-N 3.16Å; R169-A173 VanDerWaalsContact O-N 3.11Å; V170-A173 PolarHBondContact O-N 3.05Å; A171-A173 VanDerWaalsContact C-N 3.33Å
174	L	90.4	Very high	74.7	Confident	1 Å²	1	85.9 Å²	85.9	1%	0.005	45%	0.454	C	S	.	.	S	Bend	trans	-67.8	136.7	-174.9	-70.1	171.6	0	0	0	111.8	F14 R60 L64 T87 V88 I120 V170 A171 M177	F14-L174 HydrophobicContact CB-CD1 3.87Å; F14-L174 HydrophobicContact CB-CD2 4.03Å; F14-L174 HydrophobicContact CD1-CB 4.41Å; F14-L174 HydrophobicContact CD1-CD1 4.12Å; F14-L174 HydrophobicContact CD1-CD2 3.65Å; F14-L174 HydrophobicContact CD1-CG 4.28Å; F14-L174 HydrophobicContact CD2-CD1 3.62Å; F14-L174 HydrophobicContact CE1-CB 4.16Å; F14-L174 HydrophobicContact CE1-CD2 4.17Å; F14-L174 HydrophobicContact CE2-CB 4.49Å; F14-L174 HydrophobicContact CE2-CD1 4.07Å; F14-L174 HydrophobicContact CG-CD1 3.6Å; F14-L174 HydrophobicContact CG-CD2 3.87Å; F14-L174 HydrophobicContact CG-CG 4.25Å; F14-L174 HydrophobicContact CZ-CB 4.18Å; F14-L174 HydrophobicContact CZ-CD1 4.48Å; R60-L174 PolarHBondContact NH1-O 3.13Å; R60-L174 PolarHBondContact NH2-O 3.22Å; L64-L174 HydrophobicContact CD2-CD1 4.08Å; T87-L174 HydrophobicContact CG2-CD2 3.73Å; V88-L174 HydrophobicContact CG2-CD2 3.48Å; V88-L174 VanDerWaalsContact CG2-CD2 3.48Å; I120-L174 HydrophobicContact CD1-CD2 4.2Å; V170-L174 WeakPolarHBondContact O-CG 3.38Å; V170-L174 PolarHBondContact O-N 3.27Å; A171-L174 WeakPolarHBondContact O-CB 3.4Å; A171-L174 PolarHBondContact O-N 3.05Å; L174-M177 WeakPolarHBondContact O-CG 3.29Å
175	P	81.6	Confident	72.3	Confident	76 Å²	76	89.5 Å²	89.5	49%	0.494	47%	0.47	S	S	.	.	S	Bend	trans	-57.2	150.7	-175.4	22.1	-32.7	0	0	0	113.3	F14 R60	F14-P175 HydrophobicContact CE1-CG 4.18Å; R60-P175 PolarHBondContact NH1-O 2.9Å
176	G	73.8	Confident	69.8	Low	37 Å²	37	95.4 Å²	95.4	38%	0.381	50%	0.497	S	S	.	.			trans	80.3	29.1	-172.4	0	0	0	0	0	114.2	R60	R60-G176 PolarHBondContact NH1-O 2.95Å
177	M	58.4	Low	67.2	Low	62 Å²	62	98.8 Å²	98.8	31%	0.305	53%	0.532	S	S	.	.			trans	-86.3	-10.3	159.5	-74	-132	146.9	0	0	112.6	L57 R60 A171 A172 L174 S179	L57-M177 HydrophobicContact CD1-CE 3.82Å; R60-M177 VanDerWaalsContact NH2-CG 3.28Å; A171-M177 VanDerWaalsContact O-CE 3.26Å; A171-M177 WeakPolarHBondContact O-CE 3.2Å; A172-M177 VanDerWaalsContact C-SD 3.51Å; A172-M177 VanDerWaalsContact CA-CE 3.47Å; A172-M177 WeakPolarHBondContact CA-SD 3.12Å; A172-M177 HydrophobicContact CB-CE 4.4Å; A172-M177 HydrophobicContact CB-SD 4.17Å; A172-M177 WeakPolarHBondContact O-CG 3.29Å; L174-M177 WeakPolarHBondContact O-CG 3.29Å; M177-S179 PolarHBondContact O-N 3.45Å
178	E	52.7	Low	64.6	Low	193 Å²	193	107.5 Å²	107.5	90%	0.902	58%	0.575	S	S	*	*			trans	-79.6	71	177	-61.6	-175.5	157.3	0	0	110.5
179	S	47.9	Very low	62.5	Low	84 Å²	84	107 Å²	107	59%	0.587	58%	0.583	S	S	*	*	S	Bend	trans	-167.2	77.3	159.9	58.7	0	0	0	0	109.6	M177	M177-S179 PolarHBondContact O-N 3.45Å
180	M	49.3	Very low	60	Low	163 Å²	163	108.8 Å²	108.8	80%	0.803	60%	0.601	S	S	*	*	S	Bend	trans	-171.1	-0.7	150.8	-108.3	170.7	175.8	0	0	116.4
181	Q	43.5	Very low	57.6	Low	192 Å²	192	115.6 Å²	115.6	90%	0.897	64%	0.636	S	S	*	*	S	Bend	trans	-111.4	-6.4	179.2	-75.6	-173.2	-16.3	0	0	116.6
182	E	45.7	Very low	55.3	Low	190 Å²	190	124.5 Å²	124.5	89%	0.888	68%	0.675	S	S	*	*	S	Bend	trans	-115	-5.1	-177.5	-68.1	-165.4	157	0	0	116.3	S184	E182-S184 PolarHBondContact O-N 2.68Å
183	T	41.5	Very low	53.1	Low	131 Å²	131	129.7 Å²	129.7	80%	0.804	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	10.6	-176.2	-2.7	0	0	0	0	116
184	S	45.9	Very low	51	Low	108 Å²	108	135.2 Å²	135.2	76%	0.755	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	14.4	-177.8	62	0	0	0	0	115.7	E182	E182-S184 PolarHBondContact O-N 2.68Å
185	K	45.7	Very low	48.6	Very low	197 Å²	197	144.2 Å²	144.2	86%	0.857	76%	0.757	S	S	*	*	S	Bend	trans	-127.3	-2.5	178.7	-77	-165.4	176.8	-177.7	0	118.2
186	E	44.2	Very low	46.6	Very low	198 Å²	198	146.6 Å²	146.6	93%	0.925	77%	0.772	S	S	*	*	S	Bend	trans	-121.4	90	173.6	-68.7	-168.5	159.9	0	0	110.5
187	G	41.8	Very low	45	Very low	72 Å²	72	154.1 Å²	154.1	74%	0.742	80%	0.797	S	S	*	*			trans	169.1	22.8	177.8	0	0	0	0	0	116.9
188	M	40.3	Very low	44	Very low	184 Å²	184	160 Å²	160	91%	0.906	82%	0.824	S	S	*	*			trans	-103.8	97	162.6	-77.8	-170.9	-78.5	0	0	108.4	D190	M188-D190 PolarHBondContact O-N 3.2Å
189	I	49	Very low	43.4	Very low	155 Å²	155	156.6 Å²	156.6	80%	0.795	82%	0.818	S	S	*	*			trans	-78.6	106.6	164.2	-57.9	171.3	0	0	0	105.7	I191	I189-I191 PolarHBondContact O-N 3.14Å
190	D	41.7	Very low	43	Very low	146 Å²	146	161.7 Å²	161.7	78%	0.781	83%	0.833	S	S	*	*			trans	-65.9	100.1	170.9	-92.5	-29.8	0	0	0	109.3	M188 K192	M188-D190 PolarHBondContact O-N 3.2Å; D190-K192 PolarHBondContact O-N 3.1Å; D190-K192 VanDerWaalsContact O-N 3.16Å
191	I	43.9	Very low	42.5	Very low	142 Å²	142	160.8 Å²	160.8	73%	0.728	84%	0.837	S	S	*	*			trans	-76.8	98.6	167.6	-58.8	174.2	0	0	0	107.1	I189 L193	I189-I191 PolarHBondContact O-N 3.14Å; I191-L193 PolarHBondContact O-N 3.38Å
192	K	43.3	Very low	42.5	Very low	188 Å²	188	157.7 Å²	157.7	82%	0.817	83%	0.831	S	S	*	*			trans	-68.5	111.5	168	-73.7	-176	177.6	179.8	0	109.2	D190	D190-K192 PolarHBondContact O-N 3.1Å; D190-K192 VanDerWaalsContact O-N 3.16Å
193	L	44.5	Very low	42.2	Very low	161 Å²	161	158.1 Å²	158.1	84%	0.843	83%	0.833	S	S	*	*			trans	-82.5	106.1	166.9	-79.4	150.7	0	0	0	108.4	I191 K195	I191-L193 PolarHBondContact O-N 3.38Å; L193-K195 PolarHBondContact O-N 2.9Å
194	D	46	Very low	42.4	Very low	159 Å²	159	157.8 Å²	157.8	85%	0.85	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-65.9	127.4	169.7	-84.6	-33.7	0	0	0	110.1
195	K	40.9	Very low	42	Very low	191 Å²	191	156.6 Å²	156.6	83%	0.83	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-79.7	143.6	172.3	-75.2	-177.8	177.1	179.2	0	109.9	L193	L193-K195 PolarHBondContact O-N 2.9Å
196	P	39.4	Very low	42.2	Very low	126 Å²	126	153.9 Å²	153.9	82%	0.818	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-64.1	138.8	178	-14.2	28.1	0	0	0	111.4
197	Q	39.8	Very low	42.5	Very low	195 Å²	195	149.2 Å²	149.2	91%	0.911	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-70.2	132	174.8	-71.9	177	-28	0	0	111.1
198	E	37.8	Very low	42.9	Very low	186 Å²	186	155.1 Å²	155.1	87%	0.869	86%	0.862	S	S	*	*			trans	-107.4	154.4	161	-86	-174.1	175.1	0	0	110.6
199	P	40	Very low	43	Very low	120 Å²	120	153.7 Å²	153.7	78%	0.779	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-80.6	147.8	-145.2	-12.4	28.6	0	0	0	115.4	T201	P199-T201 PolarHBondContact O-N 3.09Å
200	Q	39.9	Very low	42.7	Very low	192 Å²	192	153.6 Å²	153.6	90%	0.897	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-64.6	124.2	173	-68.1	178.2	-17.6	0	0	111.5
201	T	37.8	Very low	42.7	Very low	143 Å²	143	154.1 Å²	154.1	88%	0.877	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-92.1	126.8	161	29.7	0	0	0	0	109.1	P199	P199-T201 PolarHBondContact O-N 3.09Å
202	T	42.7	Very low	42.7	Very low	127 Å²	127	154.8 Å²	154.8	78%	0.779	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-77.9	126.8	179.4	41.8	0	0	0	0	111.2
203	E	41	Very low	42.6	Very low	200 Å²	200	152.7 Å²	152.7	94%	0.935	88%	0.88	S	S	*	*			trans	-134.1	130.5	149.7	-81.2	-162.7	157.9	0	0	111.3
204	S	44.1	Very low	42.5	Very low	123 Å²	123	152.1 Å²	152.1	86%	0.86	88%	0.883	S	S	*	*			trans	-97.4	142.6	-172.9	-34.6	0	0	0	0	108.8
205	G	39	Very low	42.3	Very low	83 Å²	83	151.6 Å²	151.6	86%	0.856	89%	0.885	S	S	*	*			trans	164.4	91.7	166.1	0	0	0	0	0	113.7
206	C	48.3	Very low	42.4	Very low	140 Å²	140	148.6 Å²	148.6	95%	0.946	89%	0.889	S	S	*	*			trans	-99	139.6	161.7	-154.9	0	0	0	0	108.8
207	S	51.3	Low	42.6	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	90%	0.895	S	S	*	*			trans	-98.2	147.1	-172	-179	0	0	0	0	111.7
208	C	49.7	Very low	42.9	Very low	196 Å²	196	146.5 Å²	146.5	100%	1.324	89%	0.894	S	S	*	*			trans	69.1	0	161.6	-63.4	0	0	0	0	118.4

Retrieved 208 of 208 residues in 365.4 ms (Link to these results)

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