P40_SCHMA Loading...

Major egg antigen

AlphaFold DB , UniProt , Accession P12812, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.3	Very low	57.1	Low	253 Å²	253	123.4 Å²	123.4	100%	1.246	73%	0.734	S	S	*	*				0	88.5	0	-71.4	-177.5	157.7	0	0	107.9
2	S	37	Very low	60.4	Low	126 Å²	126	114.1 Å²	114.1	88%	0.881	68%	0.678	S	S	*	*			trans	-100.7	108.3	171.7	-173.2	0	0	0	0	106.6	G4	S2-G4 PolarHBondContact O-N 2.93Å
3	G	32.4	Very low	63.2	Low	73 Å²	73	112.1 Å²	112.1	75%	0.753	67%	0.67	S	S	*	*			trans	-72.1	108.7	177.4	0	0	0	0	0	109.2	K5	G3-K5 PolarHBondContact O-N 3.34Å
4	G	35.9	Very low	65.6	Low	73 Å²	73	105.9 Å²	105.9	75%	0.753	63%	0.633	S	S	*	*			trans	-62.9	115	172.8	0	0	0	0	0	109.8	S2 Q6	S2-G4 PolarHBondContact O-N 2.93Å; G4-Q6 PolarHBondContact O-N 3.16Å; G4-Q6 VanDerWaalsContact O-N 3.15Å
5	K	43.6	Very low	67.7	Low	175 Å²	175	105 Å²	105	76%	0.761	62%	0.624	S	S	*	*			trans	-64.7	110.8	163.6	-84.4	-179.4	174.4	180	0	106.9	G3 H7	G3-K5 PolarHBondContact O-N 3.34Å; K5-H7 VanDerWaalsContact C-N 3.35Å; K5-H7 PolarHBondContact O-CD2 3.22Å; K5-H7 VanDerWaalsContact O-CD2 3.27Å; K5-H7 PolarHBondContact O-N 3.22Å
6	Q	43	Very low	69.4	Low	177 Å²	177	109 Å²	109	83%	0.827	63%	0.625	S	S	*	*			trans	-61.7	101.8	160.9	-88.9	177.1	-41.7	0	0	107.2	G4 N8	G4-Q6 PolarHBondContact O-N 3.16Å; G4-Q6 VanDerWaalsContact O-N 3.15Å; Q6-N8 PolarHBondContact O-N 3.09Å
7	H	56.8	Low	70.9	Confident	116 Å²	116	104.7 Å²	104.7	54%	0.537	60%	0.598	S	S	.	*			trans	-71.3	97.9	171.7	-76.9	-90.8	0	0	0	107.9	K5 A9 E161	K5-H7 VanDerWaalsContact C-N 3.35Å; K5-H7 PolarHBondContact O-CD2 3.22Å; K5-H7 VanDerWaalsContact O-CD2 3.27Å; K5-H7 PolarHBondContact O-N 3.22Å; H7-A9 PolarHBondContact O-N 2.76Å; H7-E161 HydrophobicContact CB-CG 3.94Å; H7-E161 VanDerWaalsContact CB-OE1 3.28Å; H7-E161 WeakPolarHBondContact CB-OE1 3.17Å; H7-E161 IonicContact CD2-OE1 3.14Å; H7-E161 PolarHBondContact CD2-OE1 3.38Å; H7-E161 IonicContact CG-OE1 3.7Å; H7-E161 WeakPolarHBondContact ND1-CG 3.37Å; H7-E161 IonicContact ND1-OE1 3.41Å
8	N	71.6	Confident	72.3	Confident	132 Å²	132	108.6 Å²	108.6	71%	0.706	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-71.3	120	179.9	-76.4	-16.5	0	0	0	109.9	Q6	Q6-N8 PolarHBondContact O-N 3.09Å
9	A	84.1	Confident	73.6	Confident	62 Å²	62	105.5 Å²	105.5	51%	0.512	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-65.9	133.9	166.8	0	0	0	0	0	109.8	H7 S159	H7-A9 PolarHBondContact O-N 2.76Å; A9-S159 CarbonylContact C-O 3.51Å; A9-S159 WeakPolarHBondContact CA-O 3.44Å
10	V	92.3	Very high	74.8	Confident	93 Å²	93	102.5 Å²	102.5	56%	0.564	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.2	125.9	177.4	-178.3	0	0	0	0	108.5	T158 S159	V10-T158 CarbonylContact O-C 3.55Å; V10-T158 VanDerWaalsContact O-CA 3.29Å; V10-T158 WeakPolarHBondContact O-CA 3.43Å; V10-S159 PolarHBondContact N-O 2.89Å; V10-S159 PolarHBondContact O-N 2.97Å
11	S	94.6	Very high	75.9	Confident	77 Å²	77	97.7 Å²	97.7	54%	0.538	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	134.6	173.3	-176.3	0	0	0	0	110.5	V157	S11-V157 WeakPolarHBondContact CA-O 3.41Å
12	I	96.6	Very high	78.8	Confident	12 Å²	12	89.3 Å²	89.3	6%	0.062	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.3	178.6	-59.6	166.4	0	0	0	107.6	V157 L198 C200 L210	I12-V157 HydrophobicContact CB-CB 4.29Å; I12-V157 HydrophobicContact CB-CG1 4.13Å; I12-V157 HydrophobicContact CD1-CG1 4.22Å; I12-V157 PolarHBondContact N-O 3.39Å; I12-L198 HydrophobicContact CD1-CB 3.64Å; I12-L198 HydrophobicContact CD1-CD1 4Å; I12-L198 HydrophobicContact CD1-CG 4.44Å; I12-C200 HydrophobicContact CG2-CB 3.69Å; I12-L210 HydrophobicContact CD1-CD1 4.1Å; I12-L210 HydrophobicContact CG2-CD1 4.44Å
13	P	96.4	Very high	81.6	Confident	88 Å²	88	88.8 Å²	88.8	57%	0.571	49%	0.487	S	S	*	.			trans	-66.2	136.7	-178.3	26.7	-33.8	0	0	0	111.6	N15	P13-N15 PolarHBondContact O-ND2 2.9Å
14	V	97.5	Very high	84.7	Confident	26 Å²	26	86 Å²	86	16%	0.158	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	104.8	175.5	-177.6	0	0	0	0	109.7	P152 I155 V157 M202 L208	V14-P152 HydrophobicContact CB-CB 4.47Å; V14-P152 HydrophobicContact CG1-CB 3.98Å; V14-I155 HydrophobicContact CG2-CB 4.46Å; V14-I155 HydrophobicContact CG2-CG2 4.26Å; V14-V157 HydrophobicContact CG2-CG2 3.72Å; V14-M202 HydrophobicContact CG1-CB 3.88Å; V14-L208 HydrophobicContact CB-CD1 4.47Å; V14-L208 HydrophobicContact CG1-CD1 3.47Å; V14-L208 VanDerWaalsContact CG1-CD1 3.47Å; V14-L208 HydrophobicContact CG2-CD1 4.17Å
15	N	96.5	Very high	87.6	Confident	92 Å²	92	83 Å²	83	49%	0.492	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.3	-178.5	-58.7	-71.1	0	0	0	111.3	P13 C200 R201 M202	P13-N15 PolarHBondContact O-ND2 2.9Å; N15-C200 PolarHBondContact N-O 3.3Å; N15-C200 VanDerWaalsContact N-O 3.07Å; N15-C200 PolarHBondContact ND2-O 3.15Å; N15-R201 CarbonylContact O-C 3.53Å; N15-R201 WeakPolarHBondContact O-CA 3.32Å; N15-M202 PolarHBondContact O-N 3.41Å
16	R	95.7	Very high	90.2	Very high	169 Å²	169	80 Å²	80	64%	0.638	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.6	176.9	-173.9	176.2	176.2	171	0.1	111.5	P152 D204	R16-P152 HydrophobicContact CB-CG 4.21Å; R16-P152 HydrophobicContact CG-CG 4.49Å; R16-D204 IonicContact CZ-OD1 2.76Å; R16-D204 IonicContact NE-OD1 3.62Å; R16-D204 PolarHBondContact NE-OD1 2.78Å; R16-D204 IonicContact NH2-OD1 3.96Å; R16-D204 PolarHBondContact NH2-OD1 3.01Å
17	E	94.8	Very high	92.7	Very high	36 Å²	36	74.6 Å²	74.6	17%	0.168	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.8	169.3	-70.6	-165.6	-179.1	0	0	110.9	R19 R201 M202 D204	E17-R19 HydrophobicContact CB-CG 4.19Å; E17-R19 PolarHBondContact O-N 3.49Å; E17-R19 IonicContact OE1-NH2 3.99Å; E17-R19 IonicContact OE2-CZ 2.79Å; E17-R19 VanDerWaalsContact OE2-CZ 3.29Å; E17-R19 IonicContact OE2-NE 3.71Å; E17-R19 PolarHBondContact OE2-NE 3.34Å; E17-R19 IonicContact OE2-NH2 3.81Å; E17-R19 PolarHBondContact OE2-NH2 2.62Å; E17-R201 HydrophobicContact CG-CB 4.17Å; E17-R201 WeakPolarHBondContact OE1-CD 3.4Å; E17-R201 IonicContact OE1-CZ 3.66Å; E17-R201 IonicContact OE1-NE 3.32Å; E17-R201 PolarHBondContact OE1-NE 3.14Å; E17-M202 PolarHBondContact N-O 2.64Å; E17-D204 PolarHBondContact O-N 2.89Å
18	Q	95.3	Very high	94.6	Very high	175 Å²	175	69.8 Å²	69.8	82%	0.818	36%	0.359	S	S	*	.	S	Bend	trans	-80.5	53.2	-179.1	-64.3	-176.9	8.4	0	0	112.7	D204	Q18-D204 WeakPolarHBondContact CA-OD2 3.42Å
19	R	96.8	Very high	95.7	Very high	50 Å²	50	63.5 Å²	63.5	19%	0.189	33%	0.325	C	S	.	.	S	Bend	trans	-157.3	155	178.5	57.1	-175.9	177	-177.7	-2.9	110.1	E17 K23 Q24 D27 T203 D204	E17-R19 HydrophobicContact CB-CG 4.19Å; E17-R19 PolarHBondContact O-N 3.49Å; E17-R19 IonicContact OE1-NH2 3.99Å; E17-R19 IonicContact OE2-CZ 2.79Å; E17-R19 VanDerWaalsContact OE2-CZ 3.29Å; E17-R19 IonicContact OE2-NE 3.71Å; E17-R19 PolarHBondContact OE2-NE 3.34Å; E17-R19 IonicContact OE2-NH2 3.81Å; E17-R19 PolarHBondContact OE2-NH2 2.62Å; R19-K23 HydrophobicContact CB-CB 4.14Å; R19-K23 HydrophobicContact CB-CD 3.92Å; R19-K23 HydrophobicContact CB-CG 4.05Å; R19-Q24 HydrophobicContact CG-CB 4.27Å; R19-D27 WeakPolarHBondContact CD-OD2 3.17Å; R19-D27 IonicContact CZ-OD2 3.88Å; R19-D27 IonicContact NE-OD2 2.91Å; R19-D27 IonicContact NH1-OD2 2.8Å; R19-D27 PolarHBondContact NH1-OD2 3.1Å; R19-T203 WeakPolarHBondContact O-CA 3.38Å; R19-T203 WeakPolarHBondContact O-CB 3.24Å; R19-D204 PolarHBondContact N-OD2 2.8Å; R19-D204 PolarHBondContact O-N 3.47Å
20	S	97.8	Very high	96.2	Very high	44 Å²	44	63 Å²	63	31%	0.308	32%	0.316	S	S	.	.			trans	-72.7	163.1	170.4	64.7	0	0	0	0	111.4	E22 K23 Q24 D205	S20-E22 VanDerWaalsContact C-N 3.28Å; S20-E22 PolarHBondContact O-N 2.87Å; S20-K23 PolarHBondContact O-N 3.45Å; S20-K23 PolarHBondContact OG-N 2.97Å; S20-Q24 WeakPolarHBondContact O-CB 3.46Å; S20-Q24 PolarHBondContact O-N 2.95Å; S20-D205 VanDerWaalsContact CA-OD1 3.31Å; S20-D205 WeakPolarHBondContact CA-OD1 3.42Å
21	F	97.6	Very high	96.3	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-58.2	-39.4	174.4	176.9	-123.2	0	0	0	113	Q24 R25 M70 L73 R74 M77 T203 D205 V207 M209	F21-Q24 WeakPolarHBondContact O-CB 3.39Å; F21-Q24 PolarHBondContact O-N 2.81Å; F21-R25 PolarHBondContact O-N 3.22Å; F21-M70 HydrophobicContact CD1-CE 3.48Å; F21-M70 VanDerWaalsContact CD1-CE 3.48Å; F21-M70 HydrophobicContact CE1-CE 3.37Å; F21-M70 HydrophobicContact CE1-SD 4.48Å; F21-M70 HydrophobicContact CG-CE 4.47Å; F21-M70 HydrophobicContact CZ-CE 4.28Å; F21-L73 HydrophobicContact CE1-CB 4.1Å; F21-L73 HydrophobicContact CZ-CB 4Å; F21-L73 HydrophobicContact CZ-CD1 4.09Å; F21-R74 HydrophobicContact CD1-CG 4.5Å; F21-R74 HydrophobicContact CE1-CG 4.39Å; F21-M77 HydrophobicContact CD1-CE 3.42Å; F21-M77 VanDerWaalsContact CD1-CE 3.42Å; F21-M77 HydrophobicContact CE1-CE 3.29Å; F21-M77 HydrophobicContact CE2-CE 4.44Å; F21-M77 HydrophobicContact CG-CE 4.05Å; F21-M77 HydrophobicContact CZ-CE 3.86Å; F21-T203 HydrophobicContact CB-CG2 4.33Å; F21-D205 PolarHBondContact N-OD1 2.85Å; F21-D205 PolarHBondContact N-OD2 3.09Å; F21-V207 HydrophobicContact CB-CB 4.07Å; F21-V207 HydrophobicContact CB-CG2 3.66Å; F21-V207 HydrophobicContact CD1-CG2 4.4Å; F21-V207 HydrophobicContact CD2-CB 4.49Å; F21-V207 HydrophobicContact CD2-CG1 4.1Å; F21-V207 HydrophobicContact CG-CB 4.31Å; F21-V207 HydrophobicContact CG-CG1 4.24Å; F21-V207 HydrophobicContact CG-CG2 3.99Å; F21-M209 HydrophobicContact CD2-CE 3.97Å; F21-M209 HydrophobicContact CE2-CE 3.68Å
22	E	97.9	Very high	96.2	Very high	77 Å²	77	57.2 Å²	57.2	36%	0.36	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-45.1	174.7	-84.5	169.3	-151.2	0	0	112.3	S20 R25 R26 W66 M70 R74	S20-E22 VanDerWaalsContact C-N 3.28Å; S20-E22 PolarHBondContact O-N 2.87Å; E22-R25 PolarHBondContact O-N 2.86Å; E22-R26 WeakPolarHBondContact O-CG 3.21Å; E22-R26 PolarHBondContact O-N 2.89Å; E22-W66 HydrophobicContact CB-CZ2 4.33Å; E22-W66 HydrophobicContact CG-CZ2 4.27Å; E22-M70 HydrophobicContact CB-CE 4.43Å; E22-M70 HydrophobicContact CG-CE 3.46Å; E22-M70 VanDerWaalsContact CG-CE 3.46Å; E22-M70 HydrophobicContact CG-SD 4.31Å; E22-R74 IonicContact OE1-CZ 2.68Å; E22-R74 IonicContact OE1-NE 3.07Å; E22-R74 IonicContact OE1-NH2 2.81Å; E22-R74 PolarHBondContact OE1-NH2 2.95Å
23	K	97.8	Very high	96	Very high	115 Å²	115	60.4 Å²	60.4	50%	0.5	30%	0.3	S	S	.	.	H	α-helix	trans	-64.6	-43.5	177.6	-179.3	170.6	-179.5	178.2	0	111	R19 S20 R25 R26 D27	R19-K23 HydrophobicContact CB-CB 4.14Å; R19-K23 HydrophobicContact CB-CD 3.92Å; R19-K23 HydrophobicContact CB-CG 4.05Å; S20-K23 PolarHBondContact O-N 3.45Å; S20-K23 PolarHBondContact OG-N 2.97Å; K23-R25 VanDerWaalsContact C-N 3.27Å; K23-R25 PolarHBondContact O-N 2.85Å; K23-R26 PolarHBondContact O-N 3.15Å; K23-R26 VanDerWaalsContact O-N 3.15Å; K23-D27 WeakPolarHBondContact O-CB 3.49Å; K23-D27 PolarHBondContact O-N 2.86Å
24	Q	97	Very high	95.4	Very high	15 Å²	15	63.3 Å²	63.3	7%	0.07	31%	0.306	C	S	.	.	H	α-helix	trans	-54.1	-44	173.4	-170.7	-156.4	5.7	0	0	111.8	R19 S20 F21 D27 L28	R19-Q24 HydrophobicContact CG-CB 4.27Å; S20-Q24 WeakPolarHBondContact O-CB 3.46Å; S20-Q24 PolarHBondContact O-N 2.95Å; F21-Q24 WeakPolarHBondContact O-CB 3.39Å; F21-Q24 PolarHBondContact O-N 2.81Å; Q24-D27 PolarHBondContact O-N 3.45Å; Q24-L28 PolarHBondContact O-N 3.42Å; Q24-L28 VanDerWaalsContact O-N 3.09Å
25	R	96.9	Very high	94.1	Very high	9 Å²	9	63 Å²	63	3%	0.034	31%	0.308	C	S	.	.	H	α-helix	trans	-67.9	-39.8	177.5	-177.1	59.5	172.4	-152.8	-5.3	112.6	F21 E22 K23 L28 L29 W66 M70 E132	F21-R25 PolarHBondContact O-N 3.22Å; E22-R25 PolarHBondContact O-N 2.86Å; K23-R25 VanDerWaalsContact C-N 3.27Å; K23-R25 PolarHBondContact O-N 2.85Å; R25-L28 PolarHBondContact O-N 3.41Å; R25-L29 PolarHBondContact O-N 3.13Å; R25-W66 HydrophobicContact CB-CH2 3.89Å; R25-W66 HydrophobicContact CB-CZ3 4.42Å; R25-W66 HydrophobicContact CG-CH2 3.77Å; R25-W66 HydrophobicContact CG-CZ3 3.83Å; R25-M70 HydrophobicContact CB-SD 4.06Å; R25-M70 HydrophobicContact CG-SD 3.89Å; R25-E132 IonicContact CZ-OE2 3.76Å; R25-E132 IonicContact NH1-OE2 3.44Å; R25-E132 PolarHBondContact NH1-OE2 2.85Å; R25-E132 IonicContact NH2-OE2 3.63Å
26	R	97.5	Very high	92	Very high	114 Å²	114	60.6 Å²	60.6	43%	0.43	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-45.1	174.2	-70.6	-175.1	178.8	-90.3	-4.3	111.5	E22 K23 L28 L29 T30 W63 W66	E22-R26 WeakPolarHBondContact O-CG 3.21Å; E22-R26 PolarHBondContact O-N 2.89Å; K23-R26 PolarHBondContact O-N 3.15Å; K23-R26 VanDerWaalsContact O-N 3.15Å; R26-L28 VanDerWaalsContact C-N 3.3Å; R26-L28 PolarHBondContact O-N 2.82Å; R26-L29 PolarHBondContact O-N 2.79Å; R26-T30 VanDerWaalsContact O-CB 3.31Å; R26-T30 WeakPolarHBondContact O-CB 3.45Å; R26-T30 PolarHBondContact O-N 2.89Å; R26-T30 PolarHBondContact O-OG1 3.45Å; R26-W63 HydrophobicContact CB-CH2 3.98Å; R26-W63 HydrophobicContact CG-CH2 3.88Å; R26-W63 HydrophobicContact CG-CZ3 4.01Å; R26-W66 HydrophobicContact CB-CH2 4.31Å; R26-W66 HydrophobicContact CG-CH2 3.29Å; R26-W66 HydrophobicContact CG-CZ2 3.77Å; R26-W66 HydrophobicContact CG-CZ3 3.89Å
27	D	96.1	Very high	89.7	Confident	62 Å²	62	55.1 Å²	55.1	33%	0.332	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-40	179.5	-64	-17.1	0	0	0	111	R19 K23 Q24 G31	R19-D27 WeakPolarHBondContact CD-OD2 3.17Å; R19-D27 IonicContact CZ-OD2 3.88Å; R19-D27 IonicContact NE-OD2 2.91Å; R19-D27 IonicContact NH1-OD2 2.8Å; R19-D27 PolarHBondContact NH1-OD2 3.1Å; K23-D27 WeakPolarHBondContact O-CB 3.49Å; K23-D27 PolarHBondContact O-N 2.86Å; Q24-D27 PolarHBondContact O-N 3.45Å; D27-G31 PolarHBondContact O-N 3.37Å
28	L	95.2	Very high	87.3	Confident	15 Å²	15	56.8 Å²	56.8	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-53.3	174.6	172.7	66.4	0	0	0	111.9	Q24 R25 R26 G31 L32 E135	Q24-L28 PolarHBondContact O-N 3.42Å; Q24-L28 VanDerWaalsContact O-N 3.09Å; R25-L28 PolarHBondContact O-N 3.41Å; R26-L28 VanDerWaalsContact C-N 3.3Å; R26-L28 PolarHBondContact O-N 2.82Å; L28-G31 PolarHBondContact O-N 3.14Å; L28-L32 HydrophobicContact CD1-CD1 3.94Å; L28-L32 HydrophobicContact CD1-CG 4.37Å; L28-L32 HydrophobicContact CG-CD1 4.2Å; L28-L32 WeakPolarHBondContact O-CG 3.29Å; L28-L32 PolarHBondContact O-N 2.89Å; L28-E135 HydrophobicContact CD1-CB 4.38Å; L28-E135 HydrophobicContact CD1-CG 3.68Å
29	L	95.8	Very high	85.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.3	-46.9	-178.8	-66.1	-179.6	0	0	0	110.8	R25 R26 G31 L32 E33 W58 I59 W63 W66	R25-L29 PolarHBondContact O-N 3.13Å; R26-L29 PolarHBondContact O-N 2.79Å; L29-G31 VanDerWaalsContact C-N 3.32Å; L29-G31 PolarHBondContact O-N 2.8Å; L29-L32 PolarHBondContact O-N 2.87Å; L29-E33 WeakPolarHBondContact O-CG 3.35Å; L29-E33 PolarHBondContact O-N 3.13Å; L29-W58 HydrophobicContact CD2-CH2 3.78Å; L29-W58 HydrophobicContact CD2-CZ2 4.38Å; L29-W58 HydrophobicContact CD2-CZ3 3.92Å; L29-I59 HydrophobicContact CD2-CG1 4.41Å; L29-W63 HydrophobicContact CB-CH2 4.26Å; L29-W63 HydrophobicContact CB-CZ2 3.54Å; L29-W63 HydrophobicContact CD1-CD2 3.89Å; L29-W63 HydrophobicContact CD1-CE3 4.13Å; L29-W63 HydrophobicContact CD1-CG 4.44Å; L29-W63 HydrophobicContact CD1-CH2 4.23Å; L29-W63 HydrophobicContact CD1-CZ2 4Å; L29-W63 HydrophobicContact CD1-CZ3 4.28Å; L29-W63 HydrophobicContact CG-CZ2 4.42Å; L29-W66 HydrophobicContact CD1-CE3 4.31Å; L29-W66 HydrophobicContact CD1-CZ3 3.92Å
30	T	95.4	Very high	82.8	Confident	52 Å²	52	56.7 Å²	56.7	32%	0.319	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-43.3	177.5	-52.2	0	0	0	0	111	R26 L32 E33 H34	R26-T30 VanDerWaalsContact O-CB 3.31Å; R26-T30 WeakPolarHBondContact O-CB 3.45Å; R26-T30 PolarHBondContact O-N 2.89Å; R26-T30 PolarHBondContact O-OG1 3.45Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-L32 PolarHBondContact O-N 3.27Å; T30-E33 PolarHBondContact O-N 3.09Å; T30-H34 VanDerWaalsContact CG2-CE1 3.42Å; T30-H34 WeakPolarHBondContact CG2-CE1 3.05Å; T30-H34 WeakPolarHBondContact CG2-ND1 3.46Å; T30-H34 PolarHBondContact O-N 3.28Å; T30-H34 PolarHBondContact O-ND1 3.21Å
31	G	94	Very high	80.3	Confident	41 Å²	41	57.3 Å²	57.3	42%	0.423	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-41.4	178	0	0	0	0	0	112.5	D27 L28 L29 G35	D27-G31 PolarHBondContact O-N 3.37Å; L28-G31 PolarHBondContact O-N 3.14Å; L29-G31 VanDerWaalsContact C-N 3.32Å; L29-G31 PolarHBondContact O-N 2.8Å; G31-G35 WeakPolarHBondContact O-CA 3.26Å; G31-G35 PolarHBondContact O-N 3Å
32	L	92.4	Very high	77.7	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-69.1	-37.9	176.8	-70.9	169.6	0	0	0	112.5	L28 L29 T30 W58 I59 V133	L28-L32 HydrophobicContact CD1-CD1 3.94Å; L28-L32 HydrophobicContact CD1-CG 4.37Å; L28-L32 HydrophobicContact CG-CD1 4.2Å; L28-L32 WeakPolarHBondContact O-CG 3.29Å; L28-L32 PolarHBondContact O-N 2.89Å; L29-L32 PolarHBondContact O-N 2.87Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-L32 PolarHBondContact O-N 3.27Å; L32-W58 HydrophobicContact CD1-CH2 4.3Å; L32-W58 HydrophobicContact CD1-CZ3 3.72Å; L32-I59 HydrophobicContact CB-CD1 3.62Å; L32-I59 HydrophobicContact CB-CG1 4.43Å; L32-V133 HydrophobicContact CD1-CG1 4.02Å
33	E	90.8	Very high	75.4	Confident	79 Å²	79	65.9 Å²	65.9	37%	0.369	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-50	174.3	-71.6	173.7	155	0	0	112.3	L29 T30 I59 W63	L29-E33 WeakPolarHBondContact O-CG 3.35Å; L29-E33 PolarHBondContact O-N 3.13Å; T30-E33 PolarHBondContact O-N 3.09Å; E33-I59 HydrophobicContact CG-CD1 4.38Å; E33-I59 HydrophobicContact CG-CG2 3.46Å; E33-I59 VanDerWaalsContact CG-CG2 3.46Å; E33-I59 VanDerWaalsContact OE1-CG2 3.29Å; E33-I59 WeakPolarHBondContact OE1-CG2 3.43Å; E33-W63 PolarHBondContact OE1-NE1 2.86Å
34	H	85.6	Confident	73.2	Confident	148 Å²	148	61.8 Å²	61.8	69%	0.685	37%	0.37	S	S	*	.	H	α-helix	trans	-78.2	-25.2	-176.5	-65.7	81.6	0	0	0	112.2	T30 G36	T30-H34 VanDerWaalsContact CG2-CE1 3.42Å; T30-H34 WeakPolarHBondContact CG2-CE1 3.05Å; T30-H34 WeakPolarHBondContact CG2-ND1 3.46Å; T30-H34 PolarHBondContact O-N 3.28Å; T30-H34 PolarHBondContact O-ND1 3.21Å; H34-G36 PolarHBondContact O-N 3.02Å
35	G	69.3	Low	71.3	Confident	19 Å²	19	64.1 Å²	64.1	20%	0.196	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	3.1	175.6	0	0	0	0	0	114.4	G31 G37 A38 H39	G31-G35 WeakPolarHBondContact O-CA 3.26Å; G31-G35 PolarHBondContact O-N 3Å; G35-G37 PolarHBondContact O-N 2.75Å; G35-A38 PolarHBondContact O-N 3.11Å; G35-H39 PolarHBondContact O-CD2 3.11Å; G35-H39 PolarHBondContact O-N 3.42Å
36	G	53.2	Low	69.8	Low	42 Å²	42	66 Å²	66	43%	0.433	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	4.1	-177.9	0	0	0	0	0	118	H34	H34-G36 PolarHBondContact O-N 3.02Å
37	G	45.9	Very low	69.2	Low	55 Å²	55	61.5 Å²	61.5	57%	0.567	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-29.8	165.7	0	0	0	0	0	115.3	G35 G41	G35-G37 PolarHBondContact O-N 2.75Å; G37-G41 PolarHBondContact O-N 3.39Å; G37-G41 VanDerWaalsContact O-N 3.1Å
38	A	44.2	Very low	68.7	Low	70 Å²	70	59.2 Å²	59.2	58%	0.579	38%	0.377	S	S	*	.	H	α-helix	trans	-81	-33.1	-178.5	0	0	0	0	0	112.5	G35	G35-A38 PolarHBondContact O-N 3.11Å
39	H	50.6	Low	68.2	Low	46 Å²	46	67.7 Å²	67.7	21%	0.213	42%	0.416	C	S	.	.	H	α-helix	trans	-79.6	-26.2	174.8	-55.3	-67.7	0	0	0	113.2	G35 I44 E135 D136	G35-H39 PolarHBondContact O-CD2 3.11Å; G35-H39 PolarHBondContact O-N 3.42Å; H39-I44 HydrophobicContact CB-CD1 4.49Å; H39-E135 PolarHBondContact CE1-O 3.35Å; H39-E135 VanDerWaalsContact CE1-O 3.29Å; H39-D136 PolarHBondContact CE1-O 3.34Å; H39-D136 VanDerWaalsContact CE1-O 3.3Å; H39-D136 PolarHBondContact ND1-O 2.97Å
40	R	48.9	Very low	67.8	Low	177 Å²	177	70.3 Å²	70.3	67%	0.668	43%	0.43	S	S	*	.	H	α-helix	trans	-85	-25.6	176.2	-70	-171	-178.2	-147.8	0.4	113.5	D56	R40-D56 IonicContact NH2-OD2 3.21Å; R40-D56 PolarHBondContact NH2-OD2 3.11Å
41	G	44.9	Very low	67.6	Low	57 Å²	57	68 Å²	68	59%	0.588	42%	0.415	S	S	*	.	H	α-helix	trans	-91.7	-19.4	-175.9	0	0	0	0	0	116	G37	G37-G41 PolarHBondContact O-N 3.39Å; G37-G41 VanDerWaalsContact O-N 3.1Å
42	N	42	Very low	67.4	Low	131 Å²	131	68.3 Å²	68.3	70%	0.701	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	86.1	178.7	-90.5	-10.9	0	0	0	110.6	I44	N42-I44 VanDerWaalsContact C-N 3.31Å; N42-I44 WeakPolarHBondContact O-CG1 3.4Å; N42-I44 PolarHBondContact O-N 3.05Å
43	S	49.5	Very low	67.3	Low	128 Å²	128	70.6 Å²	70.6	90%	0.895	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.3	43.4	153.9	-157.8	0	0	0	0	118.6
44	I	52.2	Low	67.4	Low	30 Å²	30	67.7 Å²	67.7	15%	0.154	41%	0.414	C	S	.	.			trans	-103.6	70.2	170.8	-61.8	154.5	0	0	0	108	H39 N42 P46 D136 K138	H39-I44 HydrophobicContact CB-CD1 4.49Å; N42-I44 VanDerWaalsContact C-N 3.31Å; N42-I44 WeakPolarHBondContact O-CG1 3.4Å; N42-I44 PolarHBondContact O-N 3.05Å; I44-P46 VanDerWaalsContact CG2-CD 3.4Å; I44-P46 HydrophobicContact CG2-CG 3.82Å; I44-P46 WeakPolarHBondContact O-CD 3.2Å; I44-D136 WeakPolarHBondContact CD1-O 3.49Å; I44-K138 HydrophobicContact CG2-CG 4.15Å
45	A	57.3	Low	67.7	Low	64 Å²	64	61.2 Å²	61.2	53%	0.529	39%	0.385	S	S	.	.			trans	-108.1	65	148.4	0	0	0	0	0	107.5	Y47	A45-Y47 PolarHBondContact O-N 2.9Å
46	P	65.4	Low	68.8	Low	47 Å²	47	63.4 Å²	63.4	31%	0.305	39%	0.392	S	S	.	.	S	Bend	trans	-70.5	-19.7	-167.5	30.3	-36.7	0	0	0	112.1	I44 K138	I44-P46 VanDerWaalsContact CG2-CD 3.4Å; I44-P46 HydrophobicContact CG2-CG 3.82Å; I44-P46 WeakPolarHBondContact O-CD 3.2Å; P46-K138 HydrophobicContact CG-CG 4.41Å
47	Y	84.3	Confident	70.8	Confident	21 Å²	21	66.2 Å²	66.2	8%	0.082	40%	0.397	C	S	.	.	S	Bend	trans	-132	-49.8	-166.5	-50	-45	0	0	0	112.7	A45 W51 V139 V216 L222	A45-Y47 PolarHBondContact O-N 2.9Å; Y47-W51 AromaticContact CD2-CD2 3.69Å; Y47-W51 HydrophobicContact CD2-CD2 3.69Å; Y47-W51 AromaticContact CD2-CE2 3.72Å; Y47-W51 AromaticContact CD2-CE3 3.81Å; Y47-W51 HydrophobicContact CD2-CE3 3.81Å; Y47-W51 HydrophobicContact CD2-CG 4.3Å; Y47-W51 HydrophobicContact CD2-CH2 4.01Å; Y47-W51 AromaticContact CD2-CZ2 3.9Å; Y47-W51 HydrophobicContact CD2-CZ2 3.9Å; Y47-W51 AromaticContact CD2-CZ3 3.96Å; Y47-W51 HydrophobicContact CD2-CZ3 3.96Å; Y47-W51 HydrophobicContact CE2-CD2 4.37Å; Y47-W51 AromaticContact CE2-CE2 3.92Å; Y47-W51 HydrophobicContact CE2-CH2 4.15Å; Y47-W51 AromaticContact CE2-CZ2 3.81Å; Y47-W51 HydrophobicContact CE2-CZ2 3.81Å; Y47-V139 HydrophobicContact CE2-CB 4.27Å; Y47-V139 HydrophobicContact CE2-CG2 3.79Å; Y47-V139 PolarHBondContact OH-N 2.5Å; Y47-V139 VanDerWaalsContact OH-N 3.08Å; Y47-V216 HydrophobicContact CD1-CG1 3.88Å; Y47-V216 HydrophobicContact CE1-CB 3.87Å; Y47-V216 HydrophobicContact CE1-CG1 3.71Å; Y47-V216 HydrophobicContact CE1-CG2 3.57Å; Y47-L222 HydrophobicContact CD1-CB 4.23Å; Y47-L222 HydrophobicContact CD1-CD1 3.8Å; Y47-L222 HydrophobicContact CD1-CG 3.98Å; Y47-L222 HydrophobicContact CD2-CB 3.91Å; Y47-L222 HydrophobicContact CD2-CD1 4.18Å; Y47-L222 HydrophobicContact CD2-CG 4.43Å; Y47-L222 HydrophobicContact CE1-CD1 3.76Å; Y47-L222 HydrophobicContact CE1-CG 4.45Å; Y47-L222 HydrophobicContact CE2-CD1 4.15Å; Y47-L222 HydrophobicContact CG-CB 3.72Å; Y47-L222 HydrophobicContact CG-CD1 4.04Å; Y47-L222 HydrophobicContact CG-CG 4Å
48	T	84.9	Confident	73.1	Confident	14 Å²	14	64.1 Å²	64.1	9%	0.086	37%	0.372	C	S	.	.			trans	-146	158.3	178.5	63.6	0	0	0	0	110.8	D50 W51	T48-D50 WeakPolarHBondContact CB-OD1 3.29Å; T48-D50 PolarHBondContact O-N 3.48Å; T48-D50 PolarHBondContact OG1-OD1 2.87Å; T48-W51 VanDerWaalsContact O-CB 3.26Å; T48-W51 WeakPolarHBondContact O-CB 3.26Å; T48-W51 PolarHBondContact O-N 2.75Å; T48-W51 PolarHBondContact OG1-N 3.45Å
49	E	84.7	Confident	75.5	Confident	192 Å²	192	60.9 Å²	60.9	90%	0.897	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-31.5	179.1	-64.3	-178.2	175.7	0	0	112.7
50	D	88.6	Confident	77.6	Confident	55 Å²	55	62.5 Å²	62.5	29%	0.294	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	7.9	178.5	67.3	-32.3	0	0	0	113.5	T48 S53 T54 R233	T48-D50 WeakPolarHBondContact CB-OD1 3.29Å; T48-D50 PolarHBondContact O-N 3.48Å; T48-D50 PolarHBondContact OG1-OD1 2.87Å; D50-S53 PolarHBondContact O-N 3.17Å; D50-S53 PolarHBondContact O-OG 2.93Å; D50-T54 PolarHBondContact O-N 3.07Å; D50-T54 PolarHBondContact O-OG1 3.1Å; D50-R233 VanDerWaalsContact CG-NH1 3.34Å; D50-R233 IonicContact OD1-CZ 3.78Å; D50-R233 IonicContact OD1-NH1 2.8Å; D50-R233 PolarHBondContact OD1-NH1 2.77Å; D50-R233 IonicContact OD1-NH2 3.98Å; D50-R233 PolarHBondContact OD1-NH2 2.75Å; D50-R233 IonicContact OD2-CZ 3.54Å; D50-R233 IonicContact OD2-NH1 2.85Å; D50-R233 PolarHBondContact OD2-NH1 3.21Å; D50-R233 IonicContact OD2-NH2 3.37Å; D50-R233 PolarHBondContact OD2-NH2 2.62Å
51	W	91	Very high	79.8	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-54.6	-44.6	178.9	178.9	-103.6	0	0	0	113	Y47 T48 S53 T54 V55 V133 G137 V139 L224	Y47-W51 AromaticContact CD2-CD2 3.69Å; Y47-W51 HydrophobicContact CD2-CD2 3.69Å; Y47-W51 AromaticContact CD2-CE2 3.72Å; Y47-W51 AromaticContact CD2-CE3 3.81Å; Y47-W51 HydrophobicContact CD2-CE3 3.81Å; Y47-W51 HydrophobicContact CD2-CG 4.3Å; Y47-W51 HydrophobicContact CD2-CH2 4.01Å; Y47-W51 AromaticContact CD2-CZ2 3.9Å; Y47-W51 HydrophobicContact CD2-CZ2 3.9Å; Y47-W51 AromaticContact CD2-CZ3 3.96Å; Y47-W51 HydrophobicContact CD2-CZ3 3.96Å; Y47-W51 HydrophobicContact CE2-CD2 4.37Å; Y47-W51 AromaticContact CE2-CE2 3.92Å; Y47-W51 HydrophobicContact CE2-CH2 4.15Å; Y47-W51 AromaticContact CE2-CZ2 3.81Å; Y47-W51 HydrophobicContact CE2-CZ2 3.81Å; T48-W51 VanDerWaalsContact O-CB 3.26Å; T48-W51 WeakPolarHBondContact O-CB 3.26Å; T48-W51 PolarHBondContact O-N 2.75Å; T48-W51 PolarHBondContact OG1-N 3.45Å; W51-S53 PolarHBondContact O-N 2.86Å; W51-T54 HydrophobicContact CE3-CG2 4.39Å; W51-T54 HydrophobicContact CZ3-CG2 4.45Å; W51-T54 WeakPolarHBondContact O-CA 3.24Å; W51-T54 VanDerWaalsContact O-CB 3.3Å; W51-T54 WeakPolarHBondContact O-CB 3.12Å; W51-T54 PolarHBondContact O-N 2.73Å; W51-V55 HydrophobicContact CD2-CG2 4.08Å; W51-V55 VanDerWaalsContact CE2-CG2 3.49Å; W51-V55 HydrophobicContact CG-CG2 4.46Å; W51-V55 HydrophobicContact CH2-CG2 4.44Å; W51-V55 HydrophobicContact CZ2-CG2 3.7Å; W51-V55 WeakPolarHBondContact O-CG2 3.46Å; W51-V55 PolarHBondContact O-N 3.05Å; W51-V133 HydrophobicContact CH2-CG2 4.27Å; W51-V133 HydrophobicContact CZ2-CG2 4.09Å; W51-G137 PolarHBondContact NE1-O 2.82Å; W51-V139 HydrophobicContact CH2-CG2 3.8Å; W51-V139 HydrophobicContact CZ2-CG2 4.15Å; W51-L224 HydrophobicContact CH2-CD1 4.42Å; W51-L224 HydrophobicContact CH2-CD2 4.18Å; W51-L224 HydrophobicContact CH2-CG 4.14Å; W51-L224 HydrophobicContact CZ3-CD2 4.48Å; W51-L224 HydrophobicContact CZ3-CG 4.13Å
52	P	90.1	Very high	82.3	Confident	48 Å²	48	53.7 Å²	53.7	31%	0.312	31%	0.312	S	S	.	.	H	α-helix	trans	-56.8	-46.7	177.1	-26.2	36	0	0	0	113.1	T54 V55 D56	P52-T54 VanDerWaalsContact C-N 3.3Å; P52-T54 PolarHBondContact O-N 3.06Å; P52-V55 PolarHBondContact O-N 2.93Å; P52-D56 VanDerWaalsContact O-CG 3.31Å; P52-D56 PolarHBondContact O-N 3Å
53	S	90.3	Very high	84.9	Confident	56 Å²	56	50.8 Å²	50.8	39%	0.392	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-30.9	175.3	41.3	0	0	0	0	113.2	D50 W51 D56 N57	D50-S53 PolarHBondContact O-N 3.17Å; D50-S53 PolarHBondContact O-OG 2.93Å; W51-S53 PolarHBondContact O-N 2.86Å; S53-D56 PolarHBondContact O-N 3.09Å; S53-N57 WeakPolarHBondContact O-CB 3.47Å; S53-N57 PolarHBondContact O-N 2.79Å; S53-N57 PolarHBondContact O-ND2 3.05Å; S53-N57 VanDerWaalsContact O-ND2 3.11Å
54	T	92.3	Very high	87.1	Confident	18 Å²	18	52.4 Å²	52.4	11%	0.11	28%	0.282	C	S	.	.	H	α-helix	trans	-64.5	-43	174.8	-58.4	0	0	0	0	110.6	D50 W51 P52 W58 L224	D50-T54 PolarHBondContact O-N 3.07Å; D50-T54 PolarHBondContact O-OG1 3.1Å; W51-T54 HydrophobicContact CE3-CG2 4.39Å; W51-T54 HydrophobicContact CZ3-CG2 4.45Å; W51-T54 WeakPolarHBondContact O-CA 3.24Å; W51-T54 VanDerWaalsContact O-CB 3.3Å; W51-T54 WeakPolarHBondContact O-CB 3.12Å; W51-T54 PolarHBondContact O-N 2.73Å; P52-T54 VanDerWaalsContact C-N 3.3Å; P52-T54 PolarHBondContact O-N 3.06Å; T54-W58 WeakPolarHBondContact O-CB 3.41Å; T54-W58 PolarHBondContact O-N 3.19Å; T54-L224 HydrophobicContact CG2-CB 3.92Å; T54-L224 HydrophobicContact CG2-CD1 4.24Å; T54-L224 HydrophobicContact CG2-CG 4Å
55	V	92.9	Very high	89.2	Confident	12 Å²	12	56 Å²	56	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-66.2	-46	174.8	175.3	0	0	0	0	111	W51 P52 N57 W58 I59 V133	W51-V55 HydrophobicContact CD2-CG2 4.08Å; W51-V55 VanDerWaalsContact CE2-CG2 3.49Å; W51-V55 HydrophobicContact CG-CG2 4.46Å; W51-V55 HydrophobicContact CH2-CG2 4.44Å; W51-V55 HydrophobicContact CZ2-CG2 3.7Å; W51-V55 WeakPolarHBondContact O-CG2 3.46Å; W51-V55 PolarHBondContact O-N 3.05Å; P52-V55 PolarHBondContact O-N 2.93Å; V55-N57 VanDerWaalsContact C-N 3.34Å; V55-N57 PolarHBondContact O-N 2.86Å; V55-W58 HydrophobicContact CG1-CE3 4.31Å; V55-W58 WeakPolarHBondContact O-CB 3.33Å; V55-W58 PolarHBondContact O-N 2.89Å; V55-W58 VanDerWaalsContact O-N 3.11Å; V55-I59 HydrophobicContact CG1-CD1 3.98Å; V55-I59 HydrophobicContact CG1-CG1 4.37Å; V55-I59 WeakPolarHBondContact O-CG1 3.47Å; V55-I59 PolarHBondContact O-N 2.98Å; V55-V133 HydrophobicContact CG1-CG1 4.32Å; V55-V133 HydrophobicContact CG2-CG1 4.44Å; V55-V133 HydrophobicContact CG2-CG2 4.41Å
56	D	92.5	Very high	91	Very high	65 Å²	65	54.3 Å²	54.3	35%	0.348	27%	0.274	S	S	.	.	H	α-helix	trans	-56.4	-47.1	177.3	-68.8	-16.9	0	0	0	111.1	R40 P52 S53 W58 I59 D60	R40-D56 IonicContact NH2-OD2 3.21Å; R40-D56 PolarHBondContact NH2-OD2 3.11Å; P52-D56 VanDerWaalsContact O-CG 3.31Å; P52-D56 PolarHBondContact O-N 3Å; S53-D56 PolarHBondContact O-N 3.09Å; D56-W58 VanDerWaalsContact C-N 3.33Å; D56-W58 PolarHBondContact O-N 3.35Å; D56-I59 PolarHBondContact O-N 2.92Å; D56-D60 PolarHBondContact O-N 3.01Å; D56-D60 VanDerWaalsContact O-N 3.11Å
57	N	93.4	Very high	92.5	Very high	101 Å²	101	57.3 Å²	57.3	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-64.6	-35.6	177	-72.5	-31.1	0	0	0	113.1	S53 V55 S61	S53-N57 WeakPolarHBondContact O-CB 3.47Å; S53-N57 PolarHBondContact O-N 2.79Å; S53-N57 PolarHBondContact O-ND2 3.05Å; S53-N57 VanDerWaalsContact O-ND2 3.11Å; V55-N57 VanDerWaalsContact C-N 3.34Å; V55-N57 PolarHBondContact O-N 2.86Å; N57-S61 VanDerWaalsContact O-CB 3.3Å; N57-S61 WeakPolarHBondContact O-CB 3.36Å; N57-S61 PolarHBondContact O-N 2.95Å; N57-S61 PolarHBondContact O-OG 3.28Å
58	W	94.8	Very high	92.9	Very high	10 Å²	10	60 Å²	60	4%	0.038	30%	0.303	C	S	.	.	H	α-helix	trans	-67.1	-43.8	176.4	165.3	75.6	0	0	0	111.6	L29 L32 T54 V55 D56 S61 S62 V133 L224 G228	L29-W58 HydrophobicContact CD2-CH2 3.78Å; L29-W58 HydrophobicContact CD2-CZ2 4.38Å; L29-W58 HydrophobicContact CD2-CZ3 3.92Å; L32-W58 HydrophobicContact CD1-CH2 4.3Å; L32-W58 HydrophobicContact CD1-CZ3 3.72Å; T54-W58 WeakPolarHBondContact O-CB 3.41Å; T54-W58 PolarHBondContact O-N 3.19Å; V55-W58 HydrophobicContact CG1-CE3 4.31Å; V55-W58 WeakPolarHBondContact O-CB 3.33Å; V55-W58 PolarHBondContact O-N 2.89Å; V55-W58 VanDerWaalsContact O-N 3.11Å; D56-W58 VanDerWaalsContact C-N 3.33Å; D56-W58 PolarHBondContact O-N 3.35Å; W58-S61 PolarHBondContact O-N 3.08Å; W58-S62 WeakPolarHBondContact O-CB 3.4Å; W58-S62 PolarHBondContact O-N 2.92Å; W58-V133 HydrophobicContact CD2-CG2 4.41Å; W58-V133 HydrophobicContact CE3-CB 4.27Å; W58-V133 HydrophobicContact CE3-CG2 4.15Å; W58-V133 HydrophobicContact CH2-CB 3.86Å; W58-V133 HydrophobicContact CH2-CG2 4.41Å; W58-V133 HydrophobicContact CZ2-CB 4.4Å; W58-V133 HydrophobicContact CZ3-CB 3.79Å; W58-V133 HydrophobicContact CZ3-CG1 4.22Å; W58-V133 HydrophobicContact CZ3-CG2 4.18Å; W58-L224 HydrophobicContact CB-CD1 3.47Å; W58-L224 VanDerWaalsContact CB-CD1 3.47Å; W58-L224 HydrophobicContact CD2-CD1 4.08Å; W58-L224 HydrophobicContact CG-CD1 3.5Å; W58-L224 VanDerWaalsContact CG-CD1 3.5Å; W58-G228 VanDerWaalsContact CD1-CA 3.42Å
59	I	95	Very high	93.3	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.015	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-52.5	175.2	-67.8	167.1	0	0	0	110.1	L29 L32 E33 V55 D56 S61 S62 W63	L29-I59 HydrophobicContact CD2-CG1 4.41Å; L32-I59 HydrophobicContact CB-CD1 3.62Å; L32-I59 HydrophobicContact CB-CG1 4.43Å; E33-I59 HydrophobicContact CG-CD1 4.38Å; E33-I59 HydrophobicContact CG-CG2 3.46Å; E33-I59 VanDerWaalsContact CG-CG2 3.46Å; E33-I59 VanDerWaalsContact OE1-CG2 3.29Å; E33-I59 WeakPolarHBondContact OE1-CG2 3.43Å; V55-I59 HydrophobicContact CG1-CD1 3.98Å; V55-I59 HydrophobicContact CG1-CG1 4.37Å; V55-I59 WeakPolarHBondContact O-CG1 3.47Å; V55-I59 PolarHBondContact O-N 2.98Å; D56-I59 PolarHBondContact O-N 2.92Å; I59-S61 VanDerWaalsContact C-N 3.25Å; I59-S61 PolarHBondContact O-N 3.42Å; I59-S62 PolarHBondContact O-N 3.42Å; I59-S62 VanDerWaalsContact O-N 3.14Å; I59-W63 PolarHBondContact O-N 3.25Å
60	D	95.2	Very high	93.8	Very high	80 Å²	80	50.9 Å²	50.9	43%	0.428	26%	0.26	S	S	.	.	H	α-helix	trans	-54.9	-42.9	177.3	-89.2	3.1	0	0	0	111.9	D56 K64	D56-D60 PolarHBondContact O-N 3.01Å; D56-D60 VanDerWaalsContact O-N 3.11Å; D60-K64 WeakPolarHBondContact O-CD 3.38Å; D60-K64 VanDerWaalsContact O-CG 3.29Å; D60-K64 WeakPolarHBondContact O-CG 3.3Å; D60-K64 PolarHBondContact O-N 2.83Å; D60-K64 VanDerWaalsContact O-N 3.09Å
61	S	95.7	Very high	94	Very high	48 Å²	48	54.7 Å²	54.7	34%	0.336	27%	0.27	S	S	.	.	H	α-helix	trans	-69.1	-40.3	179.4	-61.3	0	0	0	0	111.8	N57 W58 I59 W63 K64 R65	N57-S61 VanDerWaalsContact O-CB 3.3Å; N57-S61 WeakPolarHBondContact O-CB 3.36Å; N57-S61 PolarHBondContact O-N 2.95Å; N57-S61 PolarHBondContact O-OG 3.28Å; W58-S61 PolarHBondContact O-N 3.08Å; I59-S61 VanDerWaalsContact C-N 3.25Å; I59-S61 PolarHBondContact O-N 3.42Å; S61-W63 VanDerWaalsContact C-N 3.33Å; S61-W63 PolarHBondContact O-N 2.86Å; S61-K64 PolarHBondContact O-N 2.81Å; S61-R65 WeakPolarHBondContact O-CB 3.47Å; S61-R65 WeakPolarHBondContact O-CG 3.08Å; S61-R65 PolarHBondContact O-N 2.97Å
62	S	95.7	Very high	93.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-35.2	176.4	-86.4	0	0	0	0	112.5	W58 I59 R65 W66 D69	W58-S62 WeakPolarHBondContact O-CB 3.4Å; W58-S62 PolarHBondContact O-N 2.92Å; I59-S62 PolarHBondContact O-N 3.42Å; I59-S62 VanDerWaalsContact O-N 3.14Å; S62-R65 CarbonylContact O-C 3.55Å; S62-W66 VanDerWaalsContact O-CA 3.23Å; S62-W66 WeakPolarHBondContact O-CA 3.33Å; S62-W66 PolarHBondContact O-N 3.2Å; S62-D69 VanDerWaalsContact CA-OD2 3.3Å; S62-D69 WeakPolarHBondContact CA-OD2 3.45Å; S62-D69 WeakPolarHBondContact CB-OD2 3.44Å; S62-D69 PolarHBondContact OG-OD2 3.48Å
63	W	96.8	Very high	94	Very high	69 Å²	69	53.9 Å²	53.9	26%	0.261	26%	0.261	S	S	.	.	H	α-helix	trans	-68.6	-44.6	171.4	-74.4	127.6	0	0	0	112.7	R26 L29 E33 I59 S61 R65 W66	R26-W63 HydrophobicContact CB-CH2 3.98Å; R26-W63 HydrophobicContact CG-CH2 3.88Å; R26-W63 HydrophobicContact CG-CZ3 4.01Å; L29-W63 HydrophobicContact CB-CH2 4.26Å; L29-W63 HydrophobicContact CB-CZ2 3.54Å; L29-W63 HydrophobicContact CD1-CD2 3.89Å; L29-W63 HydrophobicContact CD1-CE3 4.13Å; L29-W63 HydrophobicContact CD1-CG 4.44Å; L29-W63 HydrophobicContact CD1-CH2 4.23Å; L29-W63 HydrophobicContact CD1-CZ2 4Å; L29-W63 HydrophobicContact CD1-CZ3 4.28Å; L29-W63 HydrophobicContact CG-CZ2 4.42Å; E33-W63 PolarHBondContact OE1-NE1 2.86Å; I59-W63 PolarHBondContact O-N 3.25Å; S61-W63 VanDerWaalsContact C-N 3.33Å; S61-W63 PolarHBondContact O-N 2.86Å; W63-R65 VanDerWaalsContact C-N 3.27Å; W63-R65 PolarHBondContact O-N 2.82Å; W63-W66 AromaticContact CE3-CE3 3.79Å; W63-W66 HydrophobicContact CE3-CE3 3.79Å; W63-W66 HydrophobicContact CE3-CZ3 4.2Å; W63-W66 HydrophobicContact CH2-CZ3 4.36Å; W63-W66 HydrophobicContact CZ3-CD2 4.47Å; W63-W66 AromaticContact CZ3-CE3 3.69Å; W63-W66 HydrophobicContact CZ3-CE3 3.69Å; W63-W66 HydrophobicContact CZ3-CH2 4.49Å; W63-W66 AromaticContact CZ3-CZ3 3.7Å; W63-W66 HydrophobicContact CZ3-CZ3 3.7Å; W63-W66 PolarHBondContact O-N 2.82Å
64	K	96.8	Very high	94.1	Very high	162 Å²	162	55.8 Å²	55.8	70%	0.704	26%	0.26	S	S	*	.	H	α-helix	trans	-63.7	-32.9	178.4	-73	166.9	-173.4	159.9	0	112.6	D60 S61	D60-K64 WeakPolarHBondContact O-CD 3.38Å; D60-K64 VanDerWaalsContact O-CG 3.29Å; D60-K64 WeakPolarHBondContact O-CG 3.3Å; D60-K64 PolarHBondContact O-N 2.83Å; D60-K64 VanDerWaalsContact O-N 3.09Å; S61-K64 PolarHBondContact O-N 2.81Å
65	R	95.4	Very high	93.9	Very high	106 Å²	106	61.8 Å²	61.8	40%	0.4	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	26.4	-176.4	-57.3	-179.7	70	172.9	4.5	112.5	S61 S62 W63 D67 D68 D69 E226	S61-R65 WeakPolarHBondContact O-CB 3.47Å; S61-R65 WeakPolarHBondContact O-CG 3.08Å; S61-R65 PolarHBondContact O-N 2.97Å; S62-R65 CarbonylContact O-C 3.55Å; W63-R65 VanDerWaalsContact C-N 3.27Å; W63-R65 PolarHBondContact O-N 2.82Å; R65-D67 VanDerWaalsContact C-N 3.31Å; R65-D67 PolarHBondContact O-N 2.98Å; R65-D68 PolarHBondContact O-N 2.85Å; R65-D69 PolarHBondContact O-N 3.24Å; R65-E226 PolarHBondContact NH1-O 2.93Å; R65-E226 VanDerWaalsContact NH1-O 3.1Å
66	W	95.8	Very high	93.8	Very high	28 Å²	28	62.7 Å²	62.7	11%	0.106	29%	0.292	C	S	.	.	H	α-helix	trans	-47.4	-50.5	-172.1	177.2	-95.1	0	0	0	113.5	E22 R25 R26 L29 S62 W63 D68 D69 M70	E22-W66 HydrophobicContact CB-CZ2 4.33Å; E22-W66 HydrophobicContact CG-CZ2 4.27Å; R25-W66 HydrophobicContact CB-CH2 3.89Å; R25-W66 HydrophobicContact CB-CZ3 4.42Å; R25-W66 HydrophobicContact CG-CH2 3.77Å; R25-W66 HydrophobicContact CG-CZ3 3.83Å; R26-W66 HydrophobicContact CB-CH2 4.31Å; R26-W66 HydrophobicContact CG-CH2 3.29Å; R26-W66 HydrophobicContact CG-CZ2 3.77Å; R26-W66 HydrophobicContact CG-CZ3 3.89Å; L29-W66 HydrophobicContact CD1-CE3 4.31Å; L29-W66 HydrophobicContact CD1-CZ3 3.92Å; S62-W66 VanDerWaalsContact O-CA 3.23Å; S62-W66 WeakPolarHBondContact O-CA 3.33Å; S62-W66 PolarHBondContact O-N 3.2Å; W63-W66 AromaticContact CE3-CE3 3.79Å; W63-W66 HydrophobicContact CE3-CE3 3.79Å; W63-W66 HydrophobicContact CE3-CZ3 4.2Å; W63-W66 HydrophobicContact CH2-CZ3 4.36Å; W63-W66 HydrophobicContact CZ3-CD2 4.47Å; W63-W66 AromaticContact CZ3-CE3 3.69Å; W63-W66 HydrophobicContact CZ3-CE3 3.69Å; W63-W66 HydrophobicContact CZ3-CH2 4.49Å; W63-W66 AromaticContact CZ3-CZ3 3.7Å; W63-W66 HydrophobicContact CZ3-CZ3 3.7Å; W63-W66 PolarHBondContact O-N 2.82Å; W66-D68 VanDerWaalsContact C-N 3.35Å; W66-D68 PolarHBondContact O-N 3.22Å; W66-D69 PolarHBondContact O-N 2.97Å; W66-M70 HydrophobicContact CD2-CG 4.04Å; W66-M70 HydrophobicContact CG-CG 4.45Å; W66-M70 HydrophobicContact CH2-CG 4.29Å; W66-M70 HydrophobicContact CH2-SD 3.95Å; W66-M70 HydrophobicContact CZ2-CG 3.71Å; W66-M70 HydrophobicContact CZ2-SD 3.82Å; W66-M70 WeakPolarHBondContact O-CB 3.32Å; W66-M70 VanDerWaalsContact O-CG 3.31Å; W66-M70 WeakPolarHBondContact O-CG 3.42Å; W66-M70 PolarHBondContact O-N 2.68Å
67	D	96.1	Very high	93.9	Very high	110 Å²	110	60.1 Å²	60.1	59%	0.588	28%	0.278	S	S	*	.	H	α-helix	trans	-65.5	-37.7	-177.3	-68.7	-19.6	0	0	0	112.5	R65 R71	R65-D67 VanDerWaalsContact C-N 3.31Å; R65-D67 PolarHBondContact O-N 2.98Å; D67-R71 WeakPolarHBondContact O-CB 3.47Å; D67-R71 PolarHBondContact O-N 3.49Å
68	D	94.1	Very high	93.9	Very high	78 Å²	78	55.4 Å²	55.4	42%	0.417	25%	0.253	S	S	.	.	H	α-helix	trans	-70.8	-43	178.6	-71.5	-16	0	0	0	111.4	R65 W66 R71 R72	R65-D68 PolarHBondContact O-N 2.85Å; W66-D68 VanDerWaalsContact C-N 3.35Å; W66-D68 PolarHBondContact O-N 3.22Å; D68-R71 PolarHBondContact O-N 3.27Å; D68-R71 IonicContact OD1-CZ 2.75Å; D68-R71 IonicContact OD1-NH1 3.42Å; D68-R71 PolarHBondContact OD1-NH1 3.29Å; D68-R72 WeakPolarHBondContact O-CB 3.42Å; D68-R72 PolarHBondContact O-N 3.43Å
69	D	92.7	Very high	93.8	Very high	7 Å²	7	56 Å²	56	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-49.3	176.7	-85	5	0	0	0	110.8	S62 R65 W66 R71 R72 L73	S62-D69 VanDerWaalsContact CA-OD2 3.3Å; S62-D69 WeakPolarHBondContact CA-OD2 3.45Å; S62-D69 WeakPolarHBondContact CB-OD2 3.44Å; S62-D69 PolarHBondContact OG-OD2 3.48Å; R65-D69 PolarHBondContact O-N 3.24Å; W66-D69 PolarHBondContact O-N 2.97Å; D69-R71 VanDerWaalsContact C-N 3.34Å; D69-R71 PolarHBondContact O-N 2.7Å; D69-R72 WeakPolarHBondContact O-CB 3.25Å; D69-R72 PolarHBondContact O-N 3.37Å; D69-R72 IonicContact OD1-CZ 3.56Å; D69-R72 IonicContact OD1-NH1 3.45Å; D69-R72 PolarHBondContact OD1-NH1 2.98Å; D69-R72 IonicContact OD1-NH2 2.75Å; D69-L73 VanDerWaalsContact O-CG 3.31Å; D69-L73 WeakPolarHBondContact O-CG 3.44Å; D69-L73 PolarHBondContact O-N 3.4Å
70	M	94.7	Very high	93.6	Very high	8 Å²	8	56.6 Å²	56.6	4%	0.039	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-41.1	177.6	-72.7	-55	-50.3	0	0	111.8	F21 E22 R25 W66 L73 R74	F21-M70 HydrophobicContact CD1-CE 3.48Å; F21-M70 VanDerWaalsContact CD1-CE 3.48Å; F21-M70 HydrophobicContact CE1-CE 3.37Å; F21-M70 HydrophobicContact CE1-SD 4.48Å; F21-M70 HydrophobicContact CG-CE 4.47Å; F21-M70 HydrophobicContact CZ-CE 4.28Å; E22-M70 HydrophobicContact CB-CE 4.43Å; E22-M70 HydrophobicContact CG-CE 3.46Å; E22-M70 VanDerWaalsContact CG-CE 3.46Å; E22-M70 HydrophobicContact CG-SD 4.31Å; R25-M70 HydrophobicContact CB-SD 4.06Å; R25-M70 HydrophobicContact CG-SD 3.89Å; W66-M70 HydrophobicContact CD2-CG 4.04Å; W66-M70 HydrophobicContact CG-CG 4.45Å; W66-M70 HydrophobicContact CH2-CG 4.29Å; W66-M70 HydrophobicContact CH2-SD 3.95Å; W66-M70 HydrophobicContact CZ2-CG 3.71Å; W66-M70 HydrophobicContact CZ2-SD 3.82Å; W66-M70 WeakPolarHBondContact O-CB 3.32Å; W66-M70 VanDerWaalsContact O-CG 3.31Å; W66-M70 WeakPolarHBondContact O-CG 3.42Å; W66-M70 PolarHBondContact O-N 2.68Å; M70-L73 PolarHBondContact O-N 2.91Å; M70-R74 WeakPolarHBondContact O-CB 3.41Å; M70-R74 WeakPolarHBondContact O-CG 3.45Å; M70-R74 PolarHBondContact O-N 3.19Å
71	R	92.8	Very high	93.4	Very high	135 Å²	135	52.9 Å²	52.9	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-64.8	-40.2	175.9	-169.2	-175.7	-53.8	107.1	4.2	111.7	D67 D68 D69 R75	D67-R71 WeakPolarHBondContact O-CB 3.47Å; D67-R71 PolarHBondContact O-N 3.49Å; D68-R71 PolarHBondContact O-N 3.27Å; D68-R71 IonicContact OD1-CZ 2.75Å; D68-R71 IonicContact OD1-NH1 3.42Å; D68-R71 PolarHBondContact OD1-NH1 3.29Å; D69-R71 VanDerWaalsContact C-N 3.34Å; D69-R71 PolarHBondContact O-N 2.7Å; R71-R75 VanDerWaalsContact O-CB 3.31Å; R71-R75 WeakPolarHBondContact O-CB 3.5Å; R71-R75 PolarHBondContact O-N 2.96Å
72	R	89.9	Confident	93	Very high	29 Å²	29	52.3 Å²	52.3	11%	0.109	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-52.1	174.3	-179.1	-178.2	71.2	-140.8	0.5	110.6	D68 D69 R74 R75 G76 D129 S227	D68-R72 WeakPolarHBondContact O-CB 3.42Å; D68-R72 PolarHBondContact O-N 3.43Å; D69-R72 WeakPolarHBondContact O-CB 3.25Å; D69-R72 PolarHBondContact O-N 3.37Å; D69-R72 IonicContact OD1-CZ 3.56Å; D69-R72 IonicContact OD1-NH1 3.45Å; D69-R72 PolarHBondContact OD1-NH1 2.98Å; D69-R72 IonicContact OD1-NH2 2.75Å; R72-R74 PolarHBondContact O-N 3.36Å; R72-R75 PolarHBondContact O-N 3.41Å; R72-G76 PolarHBondContact O-N 3.43Å; R72-D129 WeakPolarHBondContact CD-OD1 3.43Å; R72-D129 IonicContact NE-OD1 3.86Å; R72-D129 PolarHBondContact NE-OD1 3.23Å; R72-S227 PolarHBondContact NH1-O 3.47Å; R72-S227 PolarHBondContact NH2-O 2.91Å
73	L	92.3	Very high	92.4	Very high	6 Å²	6	53.8 Å²	53.8	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-41.7	-178.7	-68.9	173.7	0	0	0	112.2	F21 D69 M70 G76 M77	F21-L73 HydrophobicContact CE1-CB 4.1Å; F21-L73 HydrophobicContact CZ-CB 4Å; F21-L73 HydrophobicContact CZ-CD1 4.09Å; D69-L73 VanDerWaalsContact O-CG 3.31Å; D69-L73 WeakPolarHBondContact O-CG 3.44Å; D69-L73 PolarHBondContact O-N 3.4Å; M70-L73 PolarHBondContact O-N 2.91Å; L73-G76 PolarHBondContact O-N 2.69Å; L73-M77 WeakPolarHBondContact O-CG 3.25Å; L73-M77 PolarHBondContact O-N 3.3Å
74	R	92.2	Very high	91.3	Very high	95 Å²	95	55.3 Å²	55.3	36%	0.358	26%	0.259	S	S	.	.	H	α-helix	trans	-66	-42.2	175.7	-72.8	-175.2	-174	-77.4	6.1	112.4	F21 E22 M70 R72 G76 M77 D205	F21-R74 HydrophobicContact CD1-CG 4.5Å; F21-R74 HydrophobicContact CE1-CG 4.39Å; E22-R74 IonicContact OE1-CZ 2.68Å; E22-R74 IonicContact OE1-NE 3.07Å; E22-R74 IonicContact OE1-NH2 2.81Å; E22-R74 PolarHBondContact OE1-NH2 2.95Å; M70-R74 WeakPolarHBondContact O-CB 3.41Å; M70-R74 WeakPolarHBondContact O-CG 3.45Å; M70-R74 PolarHBondContact O-N 3.19Å; R72-R74 PolarHBondContact O-N 3.36Å; R74-G76 PolarHBondContact O-N 2.96Å; R74-M77 HydrophobicContact CB-CE 4.47Å; R74-M77 HydrophobicContact CG-CE 3.95Å; R74-M77 WeakPolarHBondContact O-CB 3.43Å; R74-M77 WeakPolarHBondContact O-CG 3.39Å; R74-M77 PolarHBondContact O-N 2.89Å; R74-D205 IonicContact NH2-OD2 3.19Å
75	R	88.3	Confident	89.6	Confident	145 Å²	145	52.4 Å²	52.4	55%	0.547	26%	0.255	S	S	.	.	H	α-helix	trans	-64.6	-29.5	176.9	-174.6	179.3	64.8	-112.2	-0.8	112.5	R71 R72 M77	R71-R75 VanDerWaalsContact O-CB 3.31Å; R71-R75 WeakPolarHBondContact O-CB 3.5Å; R71-R75 PolarHBondContact O-N 2.96Å; R72-R75 PolarHBondContact O-N 3.41Å; R75-M77 VanDerWaalsContact C-N 3.32Å
76	G	89.7	Confident	87.8	Confident	31 Å²	31	49 Å²	49	32%	0.32	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.2	176.8	0	0	0	0	0	114.8	R72 L73 R74	R72-G76 PolarHBondContact O-N 3.43Å; L73-G76 PolarHBondContact O-N 2.69Å; R74-G76 PolarHBondContact O-N 2.96Å
77	M	93.8	Very high	85.6	Confident	11 Å²	11	54 Å²	54	5%	0.054	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-67.6	136.3	177.2	-64.7	179.3	-179	0	0	110.5	F21 L73 R74 R75 R144 D146 V207	F21-M77 HydrophobicContact CD1-CE 3.42Å; F21-M77 VanDerWaalsContact CD1-CE 3.42Å; F21-M77 HydrophobicContact CE1-CE 3.29Å; F21-M77 HydrophobicContact CE2-CE 4.44Å; F21-M77 HydrophobicContact CG-CE 4.05Å; F21-M77 HydrophobicContact CZ-CE 3.86Å; L73-M77 WeakPolarHBondContact O-CG 3.25Å; L73-M77 PolarHBondContact O-N 3.3Å; R74-M77 HydrophobicContact CB-CE 4.47Å; R74-M77 HydrophobicContact CG-CE 3.95Å; R74-M77 WeakPolarHBondContact O-CB 3.43Å; R74-M77 WeakPolarHBondContact O-CG 3.39Å; R74-M77 PolarHBondContact O-N 2.89Å; R75-M77 VanDerWaalsContact C-N 3.32Å; M77-R144 WeakPolarHBondContact CA-O 3.4Å; M77-R144 HydrophobicContact CG-CB 3.82Å; M77-D146 HydrophobicContact CB-CB 4.48Å; M77-V207 HydrophobicContact CE-CB 4.38Å; M77-V207 HydrophobicContact CE-CG1 3.66Å; M77-V207 HydrophobicContact CE-CG2 3.73Å; M77-V207 HydrophobicContact SD-CG1 4.1Å; M77-V207 HydrophobicContact SD-CG2 3.97Å
78	F	94	Very high	83.4	Confident	2 Å²	2	53 Å²	53	1%	0.009	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	131.7	172.2	-70.2	-63.8	0	0	0	111.2	T120 G121 V123 F126 V143 R144 F145 D146 R185 V187	F78-T120 WeakPolarHBondContact CA-O 3.36Å; F78-G121 WeakPolarHBondContact CD1-O 3.35Å; F78-G121 WeakPolarHBondContact CE1-O 3.16Å; F78-V123 HydrophobicContact CE1-CG1 4.21Å; F78-F126 HydrophobicContact CE1-CB 4.2Å; F78-F126 HydrophobicContact CE2-CB 4.01Å; F78-F126 HydrophobicContact CE2-CD2 4.2Å; F78-F126 HydrophobicContact CE2-CG 4.04Å; F78-F126 HydrophobicContact CZ-CB 3.43Å; F78-F126 VanDerWaalsContact CZ-CB 3.43Å; F78-F126 AromaticContact CZ-CD1 3.73Å; F78-F126 HydrophobicContact CZ-CD1 3.73Å; F78-F126 HydrophobicContact CZ-CD2 4.08Å; F78-F126 AromaticContact CZ-CG 3.48Å; F78-F126 HydrophobicContact CZ-CG 3.48Å; F78-F126 VanDerWaalsContact CZ-CG 3.48Å; F78-V143 HydrophobicContact CE2-CB 4.3Å; F78-V143 HydrophobicContact CE2-CG1 4.38Å; F78-R144 PolarHBondContact N-O 2.96Å; F78-F145 HydrophobicContact CB-CD1 3.5Å; F78-F145 HydrophobicContact CB-CE1 3.94Å; F78-F145 HydrophobicContact CB-CG 4.21Å; F78-F145 HydrophobicContact CD2-CD1 4.16Å; F78-F145 AromaticContact CD2-CE1 3.85Å; F78-F145 HydrophobicContact CD2-CE1 3.85Å; F78-F145 HydrophobicContact CD2-CZ 4.2Å; F78-F145 HydrophobicContact CG-CD1 4.22Å; F78-F145 HydrophobicContact CG-CE1 4.18Å; F78-F145 CarbonylContact O-C 3.47Å; F78-F145 WeakPolarHBondContact O-CA 3.34Å; F78-D146 PolarHBondContact O-N 3.18Å; F78-R185 HydrophobicContact CB-CG 3.98Å; F78-R185 HydrophobicContact CD1-CG 4.46Å; F78-R185 HydrophobicContact CG-CG 4.27Å; F78-V187 HydrophobicContact CD2-CG2 3.84Å; F78-V187 HydrophobicContact CE2-CG1 4.24Å; F78-V187 HydrophobicContact CE2-CG2 3.49Å; F78-V187 VanDerWaalsContact CE2-CG2 3.49Å; F78-V187 HydrophobicContact CG-CG2 4.49Å; F78-V187 HydrophobicContact CZ-CG1 4.41Å; F78-V187 HydrophobicContact CZ-CG2 3.86Å
79	A	92.5	Very high	81.1	Confident	21 Å²	21	52 Å²	52	17%	0.174	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	143.1	167.2	0	0	0	0	0	110.4	L81 T120 R185	A79-L81 HydrophobicContact CB-CD2 4.42Å; A79-T120 HydrophobicContact CB-CG2 4.36Å; A79-T120 PolarHBondContact N-O 2.93Å; A79-T120 VanDerWaalsContact N-O 3.07Å; A79-R185 WeakPolarHBondContact O-CD 3.39Å
80	L	92.2	Very high	78.9	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-76	123.3	165.5	-57.1	-175.6	0	0	0	109.3	F145 A147 F150 V166 A168 F183 R185	L80-F145 HydrophobicContact CD2-CB 4.41Å; L80-F145 HydrophobicContact CD2-CD1 4.15Å; L80-A147 HydrophobicContact CD1-CB 4.35Å; L80-F150 HydrophobicContact CD1-CD2 4.31Å; L80-F150 HydrophobicContact CD1-CE2 4.11Å; L80-V166 HydrophobicContact CD1-CG1 4.37Å; L80-V166 HydrophobicContact CD2-CB 4.03Å; L80-V166 HydrophobicContact CD2-CG1 3.65Å; L80-A168 HydrophobicContact CD1-CB 3.76Å; L80-F183 HydrophobicContact CB-CB 3.8Å; L80-R185 HydrophobicContact CD2-CB 3.84Å
81	L	89.5	Confident	76.9	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	137.2	-174	-57.4	-171.9	0	0	0	111.3	A79 L83 M98 M101 I105 T120 F183 C184	A79-L81 HydrophobicContact CB-CD2 4.42Å; L81-L83 PolarHBondContact O-N 2.84Å; L81-M98 HydrophobicContact CD1-SD 4.16Å; L81-M101 HydrophobicContact CB-CE 3.45Å; L81-M101 VanDerWaalsContact CB-CE 3.45Å; L81-M101 HydrophobicContact CB-SD 4.43Å; L81-M101 HydrophobicContact CD1-CB 3.58Å; L81-M101 HydrophobicContact CD1-CE 3.87Å; L81-M101 HydrophobicContact CD1-CG 4.39Å; L81-M101 HydrophobicContact CD1-SD 3.93Å; L81-M101 HydrophobicContact CG-CE 4.34Å; L81-I105 HydrophobicContact CD2-CD1 3.56Å; L81-T120 HydrophobicContact CD2-CG2 3.85Å; L81-F183 CarbonylContact O-C 3.57Å; L81-F183 WeakPolarHBondContact O-CA 3.43Å; L81-C184 PolarHBondContact N-O 3.23Å; L81-C184 PolarHBondContact O-N 3.43Å
82	P	87.2	Confident	75.5	Confident	35 Å²	35	63.3 Å²	63.3	23%	0.227	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	124.5	-179.7	28.5	-33.7	0	0	0	110.7	T85 F86 M101 E182 F183	P82-T85 WeakPolarHBondContact CB-OG1 3.36Å; P82-F86 HydrophobicContact CG-CE2 4.28Å; P82-F86 WeakPolarHBondContact O-CD2 3.43Å; P82-M101 WeakPolarHBondContact O-CE 3.31Å; P82-E182 WeakPolarHBondContact CA-O 3.37Å; P82-F183 HydrophobicContact CB-CD1 3.96Å; P82-F183 HydrophobicContact CB-CE1 3.8Å
83	L	83.1	Confident	74.8	Confident	33 Å²	33	63.9 Å²	63.9	17%	0.173	35%	0.353	C	S	.	.	S	Bend	trans	-75.3	-35.2	178.1	-70.5	177.9	0	0	0	111.9	L81 T85 I88 E182 C184	L81-L83 PolarHBondContact O-N 2.84Å; L83-T85 PolarHBondContact O-N 3.42Å; L83-I88 HydrophobicContact CB-CD1 4.45Å; L83-I88 HydrophobicContact CD2-CD1 4.13Å; L83-E182 HydrophobicContact CB-CB 4.42Å; L83-E182 HydrophobicContact CD1-CB 4.26Å; L83-E182 PolarHBondContact N-O 2.88Å; L83-C184 HydrophobicContact CD1-CB 3.7Å; L83-C184 HydrophobicContact CD2-CB 3.74Å; L83-C184 HydrophobicContact CG-CB 3.76Å
84	D	73.4	Confident	74	Confident	101 Å²	101	64.9 Å²	64.9	54%	0.54	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.7	-174.6	-52	-42.5	0	0	0	113.7	R181 E182	D84-R181 VanDerWaalsContact OD2-CA 3.28Å; D84-R181 WeakPolarHBondContact OD2-CA 3.49Å; D84-E182 PolarHBondContact OD2-N 3.42Å
85	T	62.4	Low	73.4	Confident	100 Å²	100	61.6 Å²	61.6	61%	0.613	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-22.5	-175.8	-55.4	0	0	0	0	112.5	P82 L83	P82-T85 WeakPolarHBondContact CB-OG1 3.36Å; L83-T85 PolarHBondContact O-N 3.42Å
86	F	56.2	Low	73	Confident	36 Å²	36	56.5 Å²	56.5	16%	0.158	34%	0.338	C	S	.	.	S	Bend	trans	-113.1	117.6	-177.1	-61.2	-88.4	0	0	0	108.2	P82 I88 M101 Q104	P82-F86 HydrophobicContact CG-CE2 4.28Å; P82-F86 WeakPolarHBondContact O-CD2 3.43Å; F86-I88 VanDerWaalsContact O-CG1 3.23Å; F86-I88 WeakPolarHBondContact O-CG1 3.26Å; F86-I88 PolarHBondContact O-N 2.9Å; F86-M101 HydrophobicContact CD1-CG 4.31Å; F86-M101 HydrophobicContact CD2-CE 3.3Å; F86-M101 HydrophobicContact CD2-CG 4.12Å; F86-M101 HydrophobicContact CD2-SD 4.39Å; F86-M101 HydrophobicContact CE1-CG 4.49Å; F86-M101 HydrophobicContact CE2-CE 3.57Å; F86-M101 HydrophobicContact CE2-CG 4.28Å; F86-M101 HydrophobicContact CG-CE 4.1Å; F86-M101 HydrophobicContact CG-CG 4.1Å; F86-M101 HydrophobicContact CZ-CG 4.47Å; F86-Q104 HydrophobicContact CE1-CB 4.23Å
87	S	50.1	Low	72.6	Confident	131 Å²	131	56 Å²	56	92%	0.916	33%	0.328	S	S	*	.			trans	-61	98.2	177.8	-54.3	0	0	0	0	109.9	G89	S87-G89 VanDerWaalsContact C-N 3.3Å; S87-G89 PolarHBondContact O-N 3.21Å
88	I	49.7	Very low	72.2	Confident	91 Å²	91	55.6 Å²	55.6	47%	0.467	33%	0.326	S	S	.	.			trans	-74.2	85.7	-179.6	-48.8	-178.3	0	0	0	107.8	L83 F86 L97	L83-I88 HydrophobicContact CB-CD1 4.45Å; L83-I88 HydrophobicContact CD2-CD1 4.13Å; F86-I88 VanDerWaalsContact O-CG1 3.23Å; F86-I88 WeakPolarHBondContact O-CG1 3.26Å; F86-I88 PolarHBondContact O-N 2.9Å; I88-L97 HydrophobicContact CD1-CD2 4.37Å; I88-L97 HydrophobicContact CG2-CD2 4.39Å
89	G	46.1	Very low	71.6	Confident	57 Å²	57	57 Å²	57	59%	0.588	33%	0.332	S	S	*	.			trans	-56.8	141.6	148.7	0	0	0	0	0	107.4	S87 L91	S87-G89 VanDerWaalsContact C-N 3.3Å; S87-G89 PolarHBondContact O-N 3.21Å; G89-L91 PolarHBondContact O-N 3.44Å
90	I	46.8	Very low	71.2	Confident	170 Å²	170	59.7 Å²	59.7	87%	0.872	34%	0.341	S	S	*	.			trans	-55.6	85.9	-176.5	-52	166.6	0	0	0	108.9	E92	I90-E92 PolarHBondContact O-N 2.71Å
91	L	52.7	Low	70.8	Confident	81 Å²	81	59 Å²	59	42%	0.424	34%	0.337	S	S	.	.			trans	-85.7	110.6	175.5	-155.4	81.3	0	0	0	105.2	G89 N93 A96 L97	G89-L91 PolarHBondContact O-N 3.44Å; L91-N93 WeakPolarHBondContact CD2-O 3.29Å; L91-N93 PolarHBondContact O-N 3.46Å; L91-N93 VanDerWaalsContact O-N 3.11Å; L91-A96 HydrophobicContact CD2-CB 3.71Å; L91-L97 HydrophobicContact CD2-CB 3.82Å; L91-L97 VanDerWaalsContact CD2-N 3.3Å
92	E	62.9	Low	70.6	Confident	136 Å²	136	59.5 Å²	59.5	64%	0.636	34%	0.34	S	S	*	.	S	Bend	trans	-59.1	-24.3	-177.9	-65.1	177.8	147.7	0	0	111.9	I90 P94 I352 H354	I90-E92 PolarHBondContact O-N 2.71Å; E92-P94 WeakPolarHBondContact O-CD 3.36Å; E92-I352 WeakPolarHBondContact O-CD1 3.48Å; E92-H354 IonicContact OE1-CE1 3.42Å; E92-H354 IonicContact OE2-CE1 3.6Å; E92-H354 PolarHBondContact OE2-CE1 3.35Å; E92-H354 VanDerWaalsContact OE2-CE1 3.29Å; E92-H354 IonicContact OE2-NE2 3.29Å
93	N	74.9	Confident	70.4	Confident	40 Å²	40	66.4 Å²	66.4	21%	0.214	36%	0.362	C	S	.	.			trans	-107.8	104.5	178.9	-171.8	-25.4	0	0	0	112.4	L91 F95 A96 L97	L91-N93 WeakPolarHBondContact CD2-O 3.29Å; L91-N93 PolarHBondContact O-N 3.46Å; L91-N93 VanDerWaalsContact O-N 3.11Å; N93-F95 VanDerWaalsContact C-N 3.29Å; N93-F95 PolarHBondContact O-N 2.83Å; N93-F95 PolarHBondContact OD1-N 2.9Å; N93-A96 HydrophobicContact CB-CB 3.95Å; N93-A96 WeakPolarHBondContact O-CB 3.33Å; N93-A96 PolarHBondContact O-N 2.93Å; N93-A96 VanDerWaalsContact O-N 3.16Å; N93-A96 PolarHBondContact OD1-N 3.14Å; N93-L97 PolarHBondContact O-N 3.1Å
94	P	76.1	Confident	70.5	Confident	28 Å²	28	68.5 Å²	68.5	18%	0.182	37%	0.371	C	S	.	.	H	α-helix	trans	-66.4	-26.1	-177.6	26.9	-35.2	0	0	0	114	E92 L97 M98 M186	E92-P94 WeakPolarHBondContact O-CD 3.36Å; P94-L97 WeakPolarHBondContact O-CB 3.43Å; P94-L97 PolarHBondContact O-N 2.85Å; P94-M98 WeakPolarHBondContact O-CG 3.49Å; P94-M98 PolarHBondContact O-N 2.8Å; P94-M98 VanDerWaalsContact O-N 3.09Å; P94-M186 HydrophobicContact CB-CE 4.01Å; P94-M186 HydrophobicContact CB-SD 3.53Å; P94-M186 VanDerWaalsContact CB-SD 3.53Å; P94-M186 HydrophobicContact CG-SD 4.03Å
95	F	80	Confident	70.9	Confident	25 Å²	25	64.9 Å²	64.9	11%	0.11	35%	0.351	C	S	.	.	H	α-helix	trans	-72.3	-35.4	174.8	-71.8	-72.7	0	0	0	112	N93 L97 M98 H99 R163 M186 Q188	N93-F95 VanDerWaalsContact C-N 3.29Å; N93-F95 PolarHBondContact O-N 2.83Å; N93-F95 PolarHBondContact OD1-N 2.9Å; F95-L97 PolarHBondContact O-N 2.79Å; F95-M98 PolarHBondContact O-N 3.21Å; F95-H99 WeakPolarHBondContact O-CB 3.37Å; F95-H99 PolarHBondContact O-CD2 2.73Å; F95-H99 PolarHBondContact O-N 3.06Å; F95-R163 HydrophobicContact CE2-CB 4.35Å; F95-R163 HydrophobicContact CZ-CB 3.88Å; F95-M186 HydrophobicContact CE1-CB 4.07Å; F95-M186 HydrophobicContact CZ-CB 4.49Å; F95-Q188 HydrophobicContact CE1-CB 3.99Å; F95-Q188 HydrophobicContact CZ-CB 3.81Å
96	A	80	Confident	71.8	Confident	38 Å²	38	63.9 Å²	63.9	31%	0.314	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-35.4	173.4	0	0	0	0	0	111.2	L91 N93 Q100	L91-A96 HydrophobicContact CD2-CB 3.71Å; N93-A96 HydrophobicContact CB-CB 3.95Å; N93-A96 WeakPolarHBondContact O-CB 3.33Å; N93-A96 PolarHBondContact O-N 2.93Å; N93-A96 VanDerWaalsContact O-N 3.16Å; N93-A96 PolarHBondContact OD1-N 3.14Å; A96-Q100 WeakPolarHBondContact O-CB 3.26Å; A96-Q100 PolarHBondContact O-N 2.8Å
97	L	80.9	Confident	73.2	Confident	22 Å²	22	65.2 Å²	65.2	12%	0.115	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-49.6	172.3	177.8	64.2	0	0	0	111.1	I88 L91 N93 P94 F95 H99 Q100 M101	I88-L97 HydrophobicContact CD1-CD2 4.37Å; I88-L97 HydrophobicContact CG2-CD2 4.39Å; L91-L97 HydrophobicContact CD2-CB 3.82Å; L91-L97 VanDerWaalsContact CD2-N 3.3Å; N93-L97 PolarHBondContact O-N 3.1Å; P94-L97 WeakPolarHBondContact O-CB 3.43Å; P94-L97 PolarHBondContact O-N 2.85Å; F95-L97 PolarHBondContact O-N 2.79Å; L97-H99 VanDerWaalsContact C-N 3.3Å; L97-H99 PolarHBondContact O-N 3.31Å; L97-Q100 WeakPolarHBondContact O-CB 3.44Å; L97-Q100 PolarHBondContact O-N 3Å; L97-Q100 VanDerWaalsContact O-N 3.11Å; L97-M101 HydrophobicContact CD1-CG 4.25Å; L97-M101 HydrophobicContact CD1-SD 4.16Å; L97-M101 HydrophobicContact CG-CG 4.48Å; L97-M101 HydrophobicContact CG-SD 3.91Å; L97-M101 VanDerWaalsContact O-CG 3.32Å; L97-M101 WeakPolarHBondContact O-CG 3.36Å; L97-M101 PolarHBondContact O-N 2.88Å
98	M	84.8	Confident	74.7	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-57.1	-44	176.7	-66.1	-61.9	102	0	0	111.7	L81 P94 F95 Q100 M101 D102 V123 M186	L81-M98 HydrophobicContact CD1-SD 4.16Å; P94-M98 WeakPolarHBondContact O-CG 3.49Å; P94-M98 PolarHBondContact O-N 2.8Å; P94-M98 VanDerWaalsContact O-N 3.09Å; F95-M98 PolarHBondContact O-N 3.21Å; M98-Q100 VanDerWaalsContact C-N 3.35Å; M98-Q100 PolarHBondContact O-N 3.47Å; M98-M101 HydrophobicContact CE-SD 3.55Å; M98-M101 VanDerWaalsContact CE-SD 3.55Å; M98-M101 PolarHBondContact O-N 2.91Å; M98-D102 WeakPolarHBondContact O-CB 3.23Å; M98-D102 PolarHBondContact O-N 2.84Å; M98-V123 HydrophobicContact CB-CG1 4.46Å; M98-M186 HydrophobicContact CG-CB 4.36Å
99	H	82.1	Confident	76.1	Confident	31 Å²	31	61.4 Å²	61.4	14%	0.144	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-40.3	174.9	-84.5	-55.3	0	0	0	113.2	F95 L97 R103 V123 N124 Q349	F95-H99 WeakPolarHBondContact O-CB 3.37Å; F95-H99 PolarHBondContact O-CD2 2.73Å; F95-H99 PolarHBondContact O-N 3.06Å; L97-H99 VanDerWaalsContact C-N 3.3Å; L97-H99 PolarHBondContact O-N 3.31Å; H99-R103 WeakPolarHBondContact O-CG 3.3Å; H99-R103 PolarHBondContact O-N 2.9Å; H99-R103 VanDerWaalsContact O-N 3.1Å; H99-V123 WeakPolarHBondContact CE1-CG2 3.13Å; H99-V123 WeakPolarHBondContact NE2-CG2 3.43Å; H99-N124 PolarHBondContact CE1-ND2 2.69Å; H99-N124 PolarHBondContact CE1-OD1 2.9Å; H99-N124 PolarHBondContact NE2-OD1 3.1Å; H99-Q349 PolarHBondContact NE2-NE2 2.97Å; H99-Q349 VanDerWaalsContact NE2-NE2 3.11Å
100	Q	83.4	Confident	77.9	Confident	78 Å²	78	65 Å²	65	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-64.8	-46.8	175.9	-176.3	-178.1	-61.1	0	0	110.9	A96 L97 M98 R103 Q104	A96-Q100 WeakPolarHBondContact O-CB 3.26Å; A96-Q100 PolarHBondContact O-N 2.8Å; L97-Q100 WeakPolarHBondContact O-CB 3.44Å; L97-Q100 PolarHBondContact O-N 3Å; L97-Q100 VanDerWaalsContact O-N 3.11Å; M98-Q100 VanDerWaalsContact C-N 3.35Å; M98-Q100 PolarHBondContact O-N 3.47Å; Q100-R103 PolarHBondContact O-N 2.79Å; Q100-Q104 WeakPolarHBondContact O-CG 3.36Å; Q100-Q104 PolarHBondContact O-N 3.08Å
101	M	84.5	Confident	79.6	Confident	1 Å²	1	66 Å²	66	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-42.9	179.5	-63.8	166.8	82.7	0	0	111.4	L81 P82 F86 L97 M98 R103 Q104 I105	L81-M101 HydrophobicContact CB-CE 3.45Å; L81-M101 VanDerWaalsContact CB-CE 3.45Å; L81-M101 HydrophobicContact CB-SD 4.43Å; L81-M101 HydrophobicContact CD1-CB 3.58Å; L81-M101 HydrophobicContact CD1-CE 3.87Å; L81-M101 HydrophobicContact CD1-CG 4.39Å; L81-M101 HydrophobicContact CD1-SD 3.93Å; L81-M101 HydrophobicContact CG-CE 4.34Å; P82-M101 WeakPolarHBondContact O-CE 3.31Å; F86-M101 HydrophobicContact CD1-CG 4.31Å; F86-M101 HydrophobicContact CD2-CE 3.3Å; F86-M101 HydrophobicContact CD2-CG 4.12Å; F86-M101 HydrophobicContact CD2-SD 4.39Å; F86-M101 HydrophobicContact CE1-CG 4.49Å; F86-M101 HydrophobicContact CE2-CE 3.57Å; F86-M101 HydrophobicContact CE2-CG 4.28Å; F86-M101 HydrophobicContact CG-CE 4.1Å; F86-M101 HydrophobicContact CG-CG 4.1Å; F86-M101 HydrophobicContact CZ-CG 4.47Å; L97-M101 HydrophobicContact CD1-CG 4.25Å; L97-M101 HydrophobicContact CD1-SD 4.16Å; L97-M101 HydrophobicContact CG-CG 4.48Å; L97-M101 HydrophobicContact CG-SD 3.91Å; L97-M101 VanDerWaalsContact O-CG 3.32Å; L97-M101 WeakPolarHBondContact O-CG 3.36Å; L97-M101 PolarHBondContact O-N 2.88Å; M98-M101 HydrophobicContact CE-SD 3.55Å; M98-M101 VanDerWaalsContact CE-SD 3.55Å; M98-M101 PolarHBondContact O-N 2.91Å; M101-R103 VanDerWaalsContact C-N 3.33Å; M101-R103 PolarHBondContact O-N 2.93Å; M101-Q104 PolarHBondContact O-N 2.78Å; M101-I105 WeakPolarHBondContact O-CG1 3.3Å; M101-I105 PolarHBondContact O-N 2.84Å
102	D	84.3	Confident	80.7	Confident	14 Å²	14	67.6 Å²	67.6	8%	0.075	31%	0.314	C	S	.	.	H	α-helix	trans	-57.6	-45.3	174.9	-81.8	-15.8	0	0	0	111.5	M98 Q104 I105 Q106 T120 R185	M98-D102 WeakPolarHBondContact O-CB 3.23Å; M98-D102 PolarHBondContact O-N 2.84Å; D102-Q104 PolarHBondContact O-N 2.76Å; D102-I105 PolarHBondContact O-N 2.94Å; D102-Q106 WeakPolarHBondContact O-CB 3.39Å; D102-Q106 PolarHBondContact O-N 3.04Å; D102-T120 WeakPolarHBondContact OD1-CB 3.46Å; D102-T120 PolarHBondContact OD1-OG1 3.43Å; D102-R185 IonicContact OD1-CZ 2.68Å; D102-R185 IonicContact OD1-NH1 2.66Å; D102-R185 PolarHBondContact OD1-NH1 2.79Å; D102-R185 IonicContact OD1-NH2 3.63Å; D102-R185 PolarHBondContact OD1-NH2 3.39Å; D102-R185 VanDerWaalsContact OD1-NH2 3.07Å; D102-R185 IonicContact OD2-CZ 3.43Å; D102-R185 IonicContact OD2-NH1 2.89Å; D102-R185 PolarHBondContact OD2-NH1 3.26Å; D102-R185 IonicContact OD2-NH2 2.8Å; D102-R185 PolarHBondContact OD2-NH2 3.02Å
103	R	84	Confident	80.9	Confident	179 Å²	179	64.4 Å²	64.4	68%	0.675	32%	0.317	S	S	*	.	H	α-helix	trans	-62.8	-41.8	175.8	-75.9	-173	-66	155.3	-2	112.4	H99 Q100 M101 Q106 D107	H99-R103 WeakPolarHBondContact O-CG 3.3Å; H99-R103 PolarHBondContact O-N 2.9Å; H99-R103 VanDerWaalsContact O-N 3.1Å; Q100-R103 PolarHBondContact O-N 2.79Å; M101-R103 VanDerWaalsContact C-N 3.33Å; M101-R103 PolarHBondContact O-N 2.93Å; R103-Q106 PolarHBondContact O-N 2.83Å; R103-D107 PolarHBondContact O-N 3.1Å
104	Q	84.3	Confident	80.1	Confident	77 Å²	77	64 Å²	64	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-42	178.5	-74.6	-179.5	-54.1	0	0	111.8	F86 Q100 M101 D102 Q106 D107 I108	F86-Q104 HydrophobicContact CE1-CB 4.23Å; Q100-Q104 WeakPolarHBondContact O-CG 3.36Å; Q100-Q104 PolarHBondContact O-N 3.08Å; M101-Q104 PolarHBondContact O-N 2.78Å; D102-Q104 PolarHBondContact O-N 2.76Å; Q104-Q106 VanDerWaalsContact C-N 3.33Å; Q104-D107 PolarHBondContact O-N 2.74Å; Q104-I108 VanDerWaalsContact O-CG1 3.29Å; Q104-I108 WeakPolarHBondContact O-CG1 3.13Å; Q104-I108 PolarHBondContact O-N 3.43Å
105	I	83	Confident	79.2	Confident	25 Å²	25	69.7 Å²	69.7	13%	0.128	35%	0.346	C	S	.	.	H	α-helix	trans	-65.7	-39.6	177.3	-67.8	165.7	0	0	0	110.6	L81 M101 D102 I108 R109 V117 T120	L81-I105 HydrophobicContact CD2-CD1 3.56Å; M101-I105 WeakPolarHBondContact O-CG1 3.3Å; M101-I105 PolarHBondContact O-N 2.84Å; D102-I105 PolarHBondContact O-N 2.94Å; I105-I108 PolarHBondContact O-N 2.73Å; I105-R109 WeakPolarHBondContact O-CB 3.49Å; I105-R109 PolarHBondContact O-N 2.91Å; I105-V117 HydrophobicContact CG2-CG1 3.66Å; I105-T120 HydrophobicContact CB-CG2 4.08Å; I105-T120 HydrophobicContact CD1-CG2 3.61Å; I105-T120 HydrophobicContact CG1-CG2 4.42Å; I105-T120 HydrophobicContact CG2-CG2 3.62Å
106	Q	81.9	Confident	78.2	Confident	79 Å²	79	75.4 Å²	75.4	37%	0.369	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-42.7	175.6	-176.4	58.6	28.1	0	0	112.3	D102 R103 Q104 I108 R109 E110	D102-Q106 WeakPolarHBondContact O-CB 3.39Å; D102-Q106 PolarHBondContact O-N 3.04Å; R103-Q106 PolarHBondContact O-N 2.83Å; Q104-Q106 VanDerWaalsContact C-N 3.33Å; Q106-I108 PolarHBondContact O-N 3.01Å; Q106-R109 WeakPolarHBondContact O-CB 3.31Å; Q106-R109 PolarHBondContact O-N 3.4Å; Q106-E110 WeakPolarHBondContact CG-OE1 3.22Å; Q106-E110 PolarHBondContact NE2-OE1 3.47Å; Q106-E110 WeakPolarHBondContact O-CG 3.36Å; Q106-E110 PolarHBondContact O-N 2.81Å
107	D	84.2	Confident	77.2	Confident	64 Å²	64	74.9 Å²	74.9	34%	0.342	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-42.3	174.5	-178.9	36.1	0	0	0	111.4	R103 Q104 R109 E110 R111	R103-D107 PolarHBondContact O-N 3.1Å; Q104-D107 PolarHBondContact O-N 2.74Å; D107-R109 VanDerWaalsContact C-N 3.31Å; D107-R109 PolarHBondContact O-N 3.32Å; D107-E110 PolarHBondContact O-N 3.33Å; D107-R111 VanDerWaalsContact CG-NE 3.32Å; D107-R111 WeakPolarHBondContact O-CB 3.41Å; D107-R111 VanDerWaalsContact O-CG 3.26Å; D107-R111 WeakPolarHBondContact O-CG 3.42Å; D107-R111 PolarHBondContact O-N 2.97Å; D107-R111 IonicContact OD1-CZ 3.57Å; D107-R111 IonicContact OD1-NE 2.79Å; D107-R111 PolarHBondContact OD1-NE 3.42Å; D107-R111 IonicContact OD1-NH2 2.91Å; D107-R111 PolarHBondContact OD1-NH2 2.85Å; D107-R111 IonicContact OD2-CZ 2.78Å; D107-R111 IonicContact OD2-NE 3.29Å; D107-R111 PolarHBondContact OD2-NE 3.4Å; D107-R111 IonicContact OD2-NH2 3.41Å; D107-R111 PolarHBondContact OD2-NH2 2.71Å
108	I	81.8	Confident	76.1	Confident	77 Å²	77	77.8 Å²	77.8	40%	0.395	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-43.5	173.7	-71.2	165.8	0	0	0	110.9	Q104 I105 Q106 R111 M112 V117	Q104-I108 VanDerWaalsContact O-CG1 3.29Å; Q104-I108 WeakPolarHBondContact O-CG1 3.13Å; Q104-I108 PolarHBondContact O-N 3.43Å; I105-I108 PolarHBondContact O-N 2.73Å; Q106-I108 PolarHBondContact O-N 3.01Å; I108-R111 PolarHBondContact O-N 3.33Å; I108-M112 HydrophobicContact CG2-CE 3.45Å; I108-M112 VanDerWaalsContact CG2-CE 3.45Å; I108-M112 HydrophobicContact CG2-CG 4.28Å; I108-M112 HydrophobicContact CG2-SD 4.04Å; I108-M112 WeakPolarHBondContact O-CB 2.83Å; I108-M112 WeakPolarHBondContact O-CG 3.35Å; I108-M112 PolarHBondContact O-N 3.22Å; I108-V117 HydrophobicContact CG2-CG2 4.45Å
109	R	80.2	Confident	75.4	Confident	66 Å²	66	80 Å²	80	25%	0.249	41%	0.406	C	S	.	.	H	α-helix	trans	-62.2	-45.9	178.1	-171	-178.6	-155.3	-173.9	6	112	I105 Q106 D107 R111 G113 V117	I105-R109 WeakPolarHBondContact O-CB 3.49Å; I105-R109 PolarHBondContact O-N 2.91Å; Q106-R109 WeakPolarHBondContact O-CB 3.31Å; Q106-R109 PolarHBondContact O-N 3.4Å; D107-R109 VanDerWaalsContact C-N 3.31Å; D107-R109 PolarHBondContact O-N 3.32Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-G113 PolarHBondContact O-N 3.02Å; R109-G113 VanDerWaalsContact O-N 3.08Å; R109-V117 HydrophobicContact CB-CB 4.32Å; R109-V117 HydrophobicContact CB-CG1 4.48Å; R109-V117 HydrophobicContact CG-CB 4.29Å; R109-V117 PolarHBondContact NE-O 2.86Å; R109-V117 PolarHBondContact NH2-O 3.23Å
110	E	82.5	Confident	74.8	Confident	131 Å²	131	79.3 Å²	79.3	61%	0.612	40%	0.404	S	S	*	.	H	α-helix	trans	-63.2	-40.1	178	-74	171.4	-167.1	0	0	111.7	Q106 D107	Q106-E110 WeakPolarHBondContact CG-OE1 3.22Å; Q106-E110 PolarHBondContact NE2-OE1 3.47Å; Q106-E110 WeakPolarHBondContact O-CG 3.36Å; Q106-E110 PolarHBondContact O-N 2.81Å; D107-E110 PolarHBondContact O-N 3.33Å
111	R	83.6	Confident	74.2	Confident	191 Å²	191	75.9 Å²	75.9	72%	0.721	39%	0.389	S	S	*	.	H	α-helix	trans	-72.6	-40.8	178	-70.4	177.6	-167.5	-155.8	8.4	113.8	D107 I108 R109 G113	D107-R111 VanDerWaalsContact CG-NE 3.32Å; D107-R111 WeakPolarHBondContact O-CB 3.41Å; D107-R111 VanDerWaalsContact O-CG 3.26Å; D107-R111 WeakPolarHBondContact O-CG 3.42Å; D107-R111 PolarHBondContact O-N 2.97Å; D107-R111 IonicContact OD1-CZ 3.57Å; D107-R111 IonicContact OD1-NE 2.79Å; D107-R111 PolarHBondContact OD1-NE 3.42Å; D107-R111 IonicContact OD1-NH2 2.91Å; D107-R111 PolarHBondContact OD1-NH2 2.85Å; D107-R111 IonicContact OD2-CZ 2.78Å; D107-R111 IonicContact OD2-NE 3.29Å; D107-R111 PolarHBondContact OD2-NE 3.4Å; D107-R111 IonicContact OD2-NH2 3.41Å; D107-R111 PolarHBondContact OD2-NH2 2.71Å; I108-R111 PolarHBondContact O-N 3.33Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R111-G113 VanDerWaalsContact C-N 3.28Å
112	M	76.3	Confident	73.5	Confident	116 Å²	116	78.4 Å²	78.4	57%	0.571	41%	0.407	S	S	*	.	H	α-helix	trans	-79.3	-13.4	-178.1	-66.8	-163.3	-48.8	0	0	112.5	I108 S114 V117	I108-M112 HydrophobicContact CG2-CE 3.45Å; I108-M112 VanDerWaalsContact CG2-CE 3.45Å; I108-M112 HydrophobicContact CG2-CG 4.28Å; I108-M112 HydrophobicContact CG2-SD 4.04Å; I108-M112 WeakPolarHBondContact O-CB 2.83Å; I108-M112 WeakPolarHBondContact O-CG 3.35Å; I108-M112 PolarHBondContact O-N 3.22Å; M112-S114 PolarHBondContact O-N 2.95Å; M112-V117 HydrophobicContact CE-CG2 3.23Å
113	G	65.7	Low	73	Confident	68 Å²	68	78.3 Å²	78.3	70%	0.701	41%	0.407	S	S	*	.			trans	58.7	11.7	-179.7	0	0	0	0	0	113.9	R109 R111	R109-G113 PolarHBondContact O-N 3.02Å; R109-G113 VanDerWaalsContact O-N 3.08Å; R111-G113 VanDerWaalsContact C-N 3.28Å
114	S	58.7	Low	72.2	Confident	31 Å²	31	73 Å²	73	22%	0.217	39%	0.392	C	S	.	.			trans	-105.7	131.1	-173.1	-176.5	0	0	0	0	110.5	M112 D116	M112-S114 PolarHBondContact O-N 2.95Å; S114-D116 PolarHBondContact O-N 3.4Å; S114-D116 WeakPolarHBondContact OG-CB 3.31Å; S114-D116 PolarHBondContact OG-N 3.19Å; S114-D116 PolarHBondContact OG-OD2 3.25Å
115	L	57.7	Low	72	Confident	149 Å²	149	71.9 Å²	71.9	78%	0.78	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.7	166.7	-81.5	95.1	0	0	0	112.5	V117	L115-V117 PolarHBondContact O-N 3.15Å
116	D	58.2	Low	72.1	Confident	145 Å²	145	71.7 Å²	71.7	78%	0.775	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.7	-178.7	-58.8	-31.9	0	0	0	113	S114 P118	S114-D116 PolarHBondContact O-N 3.4Å; S114-D116 WeakPolarHBondContact OG-CB 3.31Å; S114-D116 PolarHBondContact OG-N 3.19Å; S114-D116 PolarHBondContact OG-OD2 3.25Å; D116-P118 VanDerWaalsContact O-CD 3.29Å; D116-P118 WeakPolarHBondContact O-CD 3.42Å
117	V	59.1	Low	72.4	Confident	26 Å²	26	68.4 Å²	68.4	16%	0.158	37%	0.372	C	S	.	.	S	Bend	trans	-85.1	111.3	167	-173.7	0	0	0	0	108.1	I105 I108 R109 M112 L115	I105-V117 HydrophobicContact CG2-CG1 3.66Å; I108-V117 HydrophobicContact CG2-CG2 4.45Å; R109-V117 HydrophobicContact CB-CB 4.32Å; R109-V117 HydrophobicContact CB-CG1 4.48Å; R109-V117 HydrophobicContact CG-CB 4.29Å; R109-V117 PolarHBondContact NE-O 2.86Å; R109-V117 PolarHBondContact NH2-O 3.23Å; M112-V117 HydrophobicContact CE-CG2 3.23Å; L115-V117 PolarHBondContact O-N 3.15Å
118	P	58.8	Low	72.5	Confident	84 Å²	84	67.2 Å²	67.2	55%	0.545	36%	0.364	S	S	.	.			trans	-60.3	145.4	178.6	-21	33.8	0	0	0	110.6	D116 T120	D116-P118 VanDerWaalsContact O-CD 3.29Å; D116-P118 WeakPolarHBondContact O-CD 3.42Å; P118-T120 PolarHBondContact O-N 2.7Å
119	S	69	Low	72.9	Confident	48 Å²	48	64.6 Å²	64.6	34%	0.336	35%	0.35	S	S	.	.			trans	-61.6	134.7	166.8	-170.5	0	0	0	0	108.3	G121	S119-G121 PolarHBondContact O-N 2.83Å
120	T	70	Confident	73.5	Confident	16 Å²	16	61.6 Å²	61.6	10%	0.098	34%	0.339	C	S	.	.			trans	-81	-3	-177.3	56.5	0	0	0	0	113.6	F78 A79 L81 D102 I105 P118 R185	F78-T120 WeakPolarHBondContact CA-O 3.36Å; A79-T120 HydrophobicContact CB-CG2 4.36Å; A79-T120 PolarHBondContact N-O 2.93Å; A79-T120 VanDerWaalsContact N-O 3.07Å; L81-T120 HydrophobicContact CD2-CG2 3.85Å; D102-T120 WeakPolarHBondContact OD1-CB 3.46Å; D102-T120 PolarHBondContact OD1-OG1 3.43Å; I105-T120 HydrophobicContact CB-CG2 4.08Å; I105-T120 HydrophobicContact CD1-CG2 3.61Å; I105-T120 HydrophobicContact CG1-CG2 4.42Å; I105-T120 HydrophobicContact CG2-CG2 3.62Å; P118-T120 PolarHBondContact O-N 2.7Å; T120-R185 PolarHBondContact O-NH2 3.42Å
121	G	69.8	Low	74.1	Confident	6 Å²	6	55.5 Å²	55.5	6%	0.062	31%	0.311	C	S	.	.			trans	62.6	108.1	-167.3	0	0	0	0	0	110.3	F78 S119 V123 R185	F78-G121 WeakPolarHBondContact CD1-O 3.35Å; F78-G121 WeakPolarHBondContact CE1-O 3.16Å; S119-G121 PolarHBondContact O-N 2.83Å; G121-V123 PolarHBondContact O-N 3.43Å; G121-R185 PolarHBondContact O-NH2 3.43Å
122	S	71.4	Confident	74.6	Confident	54 Å²	54	46.9 Å²	46.9	38%	0.378	28%	0.279	S	S	.	.			trans	-64.9	131.5	-175.2	-178.6	0	0	0	0	111.7	N124 D125	S122-N124 PolarHBondContact O-N 2.98Å; S122-N124 PolarHBondContact OG-N 3.23Å; S122-D125 PolarHBondContact O-N 3.02Å
123	V	72	Confident	75.4	Confident	12 Å²	12	41.4 Å²	41.4	7%	0.073	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10	174.5	-55.9	0	0	0	0	113.6	F78 M98 H99 G121 F126 R185	F78-V123 HydrophobicContact CE1-CG1 4.21Å; M98-V123 HydrophobicContact CB-CG1 4.46Å; H99-V123 WeakPolarHBondContact CE1-CG2 3.13Å; H99-V123 WeakPolarHBondContact NE2-CG2 3.43Å; G121-V123 PolarHBondContact O-N 3.43Å; V123-F126 VanDerWaalsContact O-CD1 3.29Å; V123-F126 WeakPolarHBondContact O-CD1 3.4Å; V123-F126 VanDerWaalsContact O-CE1 3.29Å; V123-F126 WeakPolarHBondContact O-CE1 3.48Å; V123-R185 VanDerWaalsContact CG1-NH2 3.27Å
124	N	68.9	Low	76.7	Confident	67 Å²	67	38.2 Å²	38.2	36%	0.358	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-7.3	175	-70.5	-18.1	0	0	0	114.3	H99 S122 Q349	H99-N124 PolarHBondContact CE1-ND2 2.69Å; H99-N124 PolarHBondContact CE1-OD1 2.9Å; H99-N124 PolarHBondContact NE2-OD1 3.1Å; S122-N124 PolarHBondContact O-N 2.98Å; S122-N124 PolarHBondContact OG-N 3.23Å; N124-Q349 PolarHBondContact OD1-NE2 3Å
125	D	78.3	Confident	78.3	Confident	54 Å²	54	42.4 Å²	42.4	29%	0.289	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	9.7	-172.6	-170.2	19.9	0	0	0	113.9	S122 K128 S290	S122-D125 PolarHBondContact O-N 3.02Å; D125-K128 VanDerWaalsContact CG-NZ 3.29Å; D125-K128 WeakPolarHBondContact OD1-CD 3.4Å; D125-K128 WeakPolarHBondContact OD1-CE 3.21Å; D125-K128 IonicContact OD1-NZ 3.2Å; D125-K128 PolarHBondContact OD1-NZ 3.38Å; D125-K128 IonicContact OD2-NZ 2.73Å; D125-K128 PolarHBondContact OD2-NZ 3.01Å; D125-S290 VanDerWaalsContact CG-CB 3.47Å; D125-S290 WeakPolarHBondContact OD1-CB 2.86Å; D125-S290 PolarHBondContact OD1-OG 3.47Å
126	F	86.4	Confident	79.8	Confident	22 Å²	22	38.1 Å²	38.1	10%	0.096	21%	0.213	C	C	.	.			trans	-82.7	-26.9	-175.4	76.4	-82.5	0	0	0	113.1	F78 V123 K128 D129 A130 F141 V143 V187 Q188	F78-F126 HydrophobicContact CE1-CB 4.2Å; F78-F126 HydrophobicContact CE2-CB 4.01Å; F78-F126 HydrophobicContact CE2-CD2 4.2Å; F78-F126 HydrophobicContact CE2-CG 4.04Å; F78-F126 HydrophobicContact CZ-CB 3.43Å; F78-F126 VanDerWaalsContact CZ-CB 3.43Å; F78-F126 AromaticContact CZ-CD1 3.73Å; F78-F126 HydrophobicContact CZ-CD1 3.73Å; F78-F126 HydrophobicContact CZ-CD2 4.08Å; F78-F126 AromaticContact CZ-CG 3.48Å; F78-F126 HydrophobicContact CZ-CG 3.48Å; F78-F126 VanDerWaalsContact CZ-CG 3.48Å; V123-F126 VanDerWaalsContact O-CD1 3.29Å; V123-F126 WeakPolarHBondContact O-CD1 3.4Å; V123-F126 VanDerWaalsContact O-CE1 3.29Å; V123-F126 WeakPolarHBondContact O-CE1 3.48Å; F126-K128 VanDerWaalsContact C-N 3.29Å; F126-K128 PolarHBondContact O-N 3.35Å; F126-D129 PolarHBondContact O-N 3.17Å; F126-D129 VanDerWaalsContact O-N 3.15Å; F126-A130 HydrophobicContact CD2-CB 3.9Å; F126-A130 HydrophobicContact CE2-CB 4.29Å; F126-A130 WeakPolarHBondContact O-CB 3.37Å; F126-A130 PolarHBondContact O-N 3.08Å; F126-A130 VanDerWaalsContact O-N 3.08Å; F126-F141 AromaticContact CE2-CE2 3.94Å; F126-F141 HydrophobicContact CE2-CE2 3.94Å; F126-F141 AromaticContact CE2-CZ 3.93Å; F126-F141 HydrophobicContact CE2-CZ 3.93Å; F126-V143 HydrophobicContact CD2-CG1 3.62Å; F126-V143 HydrophobicContact CE2-CG1 3.84Å; F126-V187 HydrophobicContact CD2-CG1 4.4Å; F126-V187 HydrophobicContact CE1-CG1 4.08Å; F126-V187 HydrophobicContact CE2-CG1 3.7Å; F126-V187 HydrophobicContact CZ-CG1 3.53Å; F126-Q188 WeakPolarHBondContact CZ-O 3.21Å
127	L	88.5	Confident	81.3	Confident	9 Å²	9	31.3 Å²	31.3	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-30.5	-167.7	-72.4	179.8	0	0	0	114.4	D129 A130 Y131 F141 P190 T325 P328	L127-D129 PolarHBondContact O-N 3.41Å; L127-A130 HydrophobicContact CD2-CB 4.47Å; L127-A130 PolarHBondContact O-N 3.28Å; L127-Y131 HydrophobicContact CD2-CE2 4.27Å; L127-Y131 WeakPolarHBondContact O-CD2 3.35Å; L127-F141 HydrophobicContact CD2-CE2 4.24Å; L127-P190 HydrophobicContact CD1-CG 4.31Å; L127-P190 HydrophobicContact CD2-CG 3.3Å; L127-P190 HydrophobicContact CG-CG 4.47Å; L127-T325 HydrophobicContact CD1-CG2 4.1Å; L127-P328 HydrophobicContact CB-CG 4.47Å
128	K	85.8	Confident	82.8	Confident	40 Å²	40	34.1 Å²	34.1	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-31	178.5	70.7	-171.4	-178.9	-163.1	0	113.9	D125 F126 V288 D289	D125-K128 VanDerWaalsContact CG-NZ 3.29Å; D125-K128 WeakPolarHBondContact OD1-CD 3.4Å; D125-K128 WeakPolarHBondContact OD1-CE 3.21Å; D125-K128 IonicContact OD1-NZ 3.2Å; D125-K128 PolarHBondContact OD1-NZ 3.38Å; D125-K128 IonicContact OD2-NZ 2.73Å; D125-K128 PolarHBondContact OD2-NZ 3.01Å; F126-K128 VanDerWaalsContact C-N 3.29Å; F126-K128 PolarHBondContact O-N 3.35Å; K128-V288 WeakPolarHBondContact CB-O 3.12Å; K128-D289 WeakPolarHBondContact CD-OD1 3.41Å; K128-D289 WeakPolarHBondContact CE-OD1 3.25Å; K128-D289 IonicContact NZ-OD1 3.27Å; K128-D289 PolarHBondContact NZ-OD1 3.24Å
129	D	89.6	Confident	84.5	Confident	22 Å²	22	30.2 Å²	30.2	12%	0.118	16%	0.162	C	C	.	.	H	α-helix	trans	-108.1	-1.8	-178.4	-68.5	-43.4	0	0	0	111.5	R72 F126 L127 Y131 Q229	R72-D129 WeakPolarHBondContact CD-OD1 3.43Å; R72-D129 IonicContact NE-OD1 3.86Å; R72-D129 PolarHBondContact NE-OD1 3.23Å; F126-D129 PolarHBondContact O-N 3.17Å; F126-D129 VanDerWaalsContact O-N 3.15Å; L127-D129 PolarHBondContact O-N 3.41Å; D129-Y131 VanDerWaalsContact C-N 3.34Å; D129-Q229 PolarHBondContact OD1-NE2 3.25Å
130	A	93.6	Very high	85.7	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.017	15%	0.152	C	C	.	.	H	α-helix	trans	-81.9	-12.8	-178.6	0	0	0	0	0	113.2	F126 L127 F141 K142 V143	F126-A130 HydrophobicContact CD2-CB 3.9Å; F126-A130 HydrophobicContact CE2-CB 4.29Å; F126-A130 WeakPolarHBondContact O-CB 3.37Å; F126-A130 PolarHBondContact O-N 3.08Å; F126-A130 VanDerWaalsContact O-N 3.08Å; L127-A130 HydrophobicContact CD2-CB 4.47Å; L127-A130 PolarHBondContact O-N 3.28Å; A130-F141 HydrophobicContact CB-CD2 3.86Å; A130-F141 HydrophobicContact CB-CE2 3.61Å; A130-F141 CarbonylContact O-C 3.55Å; A130-F141 VanDerWaalsContact O-CA 3.24Å; A130-F141 WeakPolarHBondContact O-CA 3.42Å; A130-K142 WeakPolarHBondContact CA-O 3.37Å; A130-K142 PolarHBondContact O-N 3.28Å; A130-V143 HydrophobicContact CB-CG1 4.04Å
131	Y	94.4	Very high	87	Confident	3 Å²	3	28.4 Å²	28.4	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.2	176.9	-63.4	-80.5	0	0	0	110.2	L127 D129 V139 H140 F141 P190 S192 V214 V230 D327 P328 L329	L127-Y131 HydrophobicContact CD2-CE2 4.27Å; L127-Y131 WeakPolarHBondContact O-CD2 3.35Å; D129-Y131 VanDerWaalsContact C-N 3.34Å; Y131-V139 HydrophobicContact CD1-CG1 4.11Å; Y131-H140 WeakPolarHBondContact CA-O 3.39Å; Y131-F141 HydrophobicContact CE1-CB 4.31Å; Y131-F141 HydrophobicContact CE1-CD2 4.08Å; Y131-P190 VanDerWaalsContact OH-CB 3.25Å; Y131-P190 WeakPolarHBondContact OH-CB 3.35Å; Y131-P190 VanDerWaalsContact OH-CG 3.29Å; Y131-P190 WeakPolarHBondContact OH-CG 3.48Å; Y131-S192 PolarHBondContact OH-OG 3.15Å; Y131-V214 HydrophobicContact CD1-CG1 3.84Å; Y131-V214 HydrophobicContact CE1-CG1 3.68Å; Y131-V230 WeakPolarHBondContact O-CG2 3.4Å; Y131-D327 PolarHBondContact OH-OD1 3.2Å; Y131-P328 HydrophobicContact CD2-CB 4.39Å; Y131-P328 HydrophobicContact CD2-CG 3.92Å; Y131-P328 HydrophobicContact CE2-CB 4.47Å; Y131-P328 HydrophobicContact CE2-CG 3.87Å; Y131-L329 HydrophobicContact CD1-CD1 3.54Å; Y131-L329 HydrophobicContact CD1-CG 3.92Å; Y131-L329 HydrophobicContact CE1-CD1 3.35Å; Y131-L329 HydrophobicContact CE1-CG 3.74Å; Y131-L329 HydrophobicContact CG-CD1 4.43Å; Y131-L329 HydrophobicContact CG-CG 4.38Å
132	E	94.3	Very high	88.3	Confident	10 Å²	10	28.6 Å²	28.6	5%	0.047	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	160	-174.3	-67.9	179.9	-96.9	0	0	111.4	R25 G134 V139 H140 K142 R144	R25-E132 IonicContact CZ-OE2 3.76Å; R25-E132 IonicContact NH1-OE2 3.44Å; R25-E132 PolarHBondContact NH1-OE2 2.85Å; R25-E132 IonicContact NH2-OE2 3.63Å; E132-G134 PolarHBondContact O-N 3.13Å; E132-V139 CarbonylContact O-C 3.6Å; E132-V139 WeakPolarHBondContact O-CA 3.4Å; E132-H140 PolarHBondContact N-O 3.41Å; E132-H140 PolarHBondContact O-N 2.84Å; E132-K142 HydrophobicContact CB-CD 4.5Å; E132-R144 IonicContact OE1-CZ 3.35Å; E132-R144 IonicContact OE1-NH1 2.73Å; E132-R144 PolarHBondContact OE1-NH1 3.27Å; E132-R144 IonicContact OE1-NH2 3.06Å; E132-R144 PolarHBondContact OE1-NH2 3.43Å; E132-R144 IonicContact OE2-NH2 3.59Å; E132-R144 PolarHBondContact OE2-NH2 2.89Å
133	V	94	Very high	89.4	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	128.2	173.9	-173.6	0	0	0	0	110.2	L32 W51 V55 W58 K138 K142 L224	L32-V133 HydrophobicContact CD1-CG1 4.02Å; W51-V133 HydrophobicContact CH2-CG2 4.27Å; W51-V133 HydrophobicContact CZ2-CG2 4.09Å; V55-V133 HydrophobicContact CG1-CG1 4.32Å; V55-V133 HydrophobicContact CG2-CG1 4.44Å; V55-V133 HydrophobicContact CG2-CG2 4.41Å; W58-V133 HydrophobicContact CD2-CG2 4.41Å; W58-V133 HydrophobicContact CE3-CB 4.27Å; W58-V133 HydrophobicContact CE3-CG2 4.15Å; W58-V133 HydrophobicContact CH2-CB 3.86Å; W58-V133 HydrophobicContact CH2-CG2 4.41Å; W58-V133 HydrophobicContact CZ2-CB 4.4Å; W58-V133 HydrophobicContact CZ3-CB 3.79Å; W58-V133 HydrophobicContact CZ3-CG1 4.22Å; W58-V133 HydrophobicContact CZ3-CG2 4.18Å; V133-K138 CarbonylContact C-O 3.59Å; V133-K138 WeakPolarHBondContact CA-O 3.13Å; V133-K142 PolarHBondContact O-NZ 2.71Å; V133-L224 HydrophobicContact CG2-CD1 3.95Å
134	G	92.9	Very high	90.6	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	13%	0.13	C	C	.	.			trans	-85	174.7	174.9	0	0	0	0	0	112.7	E132 D136 G137 K138	E132-G134 PolarHBondContact O-N 3.13Å; G134-D136 PolarHBondContact O-N 2.9Å; G134-G137 PolarHBondContact O-N 3.47Å; G134-K138 PolarHBondContact N-O 3.46Å
135	E	91.2	Very high	92	Very high	119 Å²	119	23.3 Å²	23.3	56%	0.556	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-20	176.6	-64.7	177.6	174.8	0	0	112.6	L28 H39 G137	L28-E135 HydrophobicContact CD1-CB 4.38Å; L28-E135 HydrophobicContact CD1-CG 3.68Å; H39-E135 PolarHBondContact CE1-O 3.35Å; H39-E135 VanDerWaalsContact CE1-O 3.29Å; E135-G137 VanDerWaalsContact C-N 3.31Å
136	D	89	Confident	92.8	Very high	58 Å²	58	23.9 Å²	23.9	31%	0.31	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1	175.4	65.4	-5	0	0	0	113.5	H39 I44 G134 K138 H140	H39-D136 PolarHBondContact CE1-O 3.34Å; H39-D136 VanDerWaalsContact CE1-O 3.3Å; H39-D136 PolarHBondContact ND1-O 2.97Å; I44-D136 WeakPolarHBondContact CD1-O 3.49Å; G134-D136 PolarHBondContact O-N 2.9Å; D136-K138 PolarHBondContact O-N 3.01Å; D136-K138 WeakPolarHBondContact OD1-CB 3.06Å; D136-K138 PolarHBondContact OD1-N 3.2Å; D136-H140 VanDerWaalsContact CG-NE2 3.26Å; D136-H140 IonicContact OD1-CD2 3.97Å; D136-H140 PolarHBondContact OD1-CD2 2.71Å; D136-H140 IonicContact OD1-NE2 3.76Å; D136-H140 PolarHBondContact OD1-NE2 3.15Å; D136-H140 IonicContact OD2-CD2 3.77Å; D136-H140 IonicContact OD2-CE1 2.96Å; D136-H140 IonicContact OD2-NE2 2.79Å; D136-H140 PolarHBondContact OD2-NE2 3.37Å
137	G	89.9	Confident	93.2	Very high	3 Å²	3	22.8 Å²	22.8	3%	0.031	11%	0.111	C	C	.	.	S	Bend	trans	74.7	7.1	-177.4	0	0	0	0	0	114.3	W51 G134 E135	W51-G137 PolarHBondContact NE1-O 2.82Å; G134-G137 PolarHBondContact O-N 3.47Å; E135-G137 VanDerWaalsContact C-N 3.31Å
138	K	91.2	Very high	93.5	Very high	84 Å²	84	29.2 Å²	29.2	37%	0.365	14%	0.141	S	C	.	.	S	Bend	trans	-100.2	165.9	175.5	-61.5	-178.1	-178.9	177.1	0	110.4	I44 P46 V133 G134 D136	I44-K138 HydrophobicContact CG2-CG 4.15Å; P46-K138 HydrophobicContact CG-CG 4.41Å; V133-K138 CarbonylContact C-O 3.59Å; V133-K138 WeakPolarHBondContact CA-O 3.13Å; G134-K138 PolarHBondContact N-O 3.46Å; D136-K138 PolarHBondContact O-N 3.01Å; D136-K138 WeakPolarHBondContact OD1-CB 3.06Å; D136-K138 PolarHBondContact OD1-N 3.2Å
139	V	93.9	Very high	93.8	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.8	171.3	174.8	0	0	0	0	109.1	Y47 W51 Y131 E132 V214 L222 V230	Y47-V139 HydrophobicContact CE2-CB 4.27Å; Y47-V139 HydrophobicContact CE2-CG2 3.79Å; Y47-V139 PolarHBondContact OH-N 2.5Å; Y47-V139 VanDerWaalsContact OH-N 3.08Å; W51-V139 HydrophobicContact CH2-CG2 3.8Å; W51-V139 HydrophobicContact CZ2-CG2 4.15Å; Y131-V139 HydrophobicContact CD1-CG1 4.11Å; E132-V139 CarbonylContact O-C 3.6Å; E132-V139 WeakPolarHBondContact O-CA 3.4Å; V139-V214 HydrophobicContact CB-CG2 4.16Å; V139-V214 HydrophobicContact CG1-CG2 4.07Å; V139-V214 WeakPolarHBondContact O-CG2 3.34Å; V139-L222 HydrophobicContact CB-CD1 4.42Å; V139-L222 HydrophobicContact CG2-CD1 4.07Å; V139-V230 HydrophobicContact CG1-CG2 3.98Å; V139-V230 HydrophobicContact CG2-CG2 3.83Å
140	H	95.2	Very high	94	Very high	26 Å²	26	30 Å²	30	12%	0.12	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.8	172.5	-79.7	-115.1	0	0	0	109.1	Y131 E132 D136 K142	Y131-H140 WeakPolarHBondContact CA-O 3.39Å; E132-H140 PolarHBondContact N-O 3.41Å; E132-H140 PolarHBondContact O-N 2.84Å; D136-H140 VanDerWaalsContact CG-NE2 3.26Å; D136-H140 IonicContact OD1-CD2 3.97Å; D136-H140 PolarHBondContact OD1-CD2 2.71Å; D136-H140 IonicContact OD1-NE2 3.76Å; D136-H140 PolarHBondContact OD1-NE2 3.15Å; D136-H140 IonicContact OD2-CD2 3.77Å; D136-H140 IonicContact OD2-CE1 2.96Å; D136-H140 IonicContact OD2-NE2 2.79Å; D136-H140 PolarHBondContact OD2-NE2 3.37Å; H140-K142 HydrophobicContact CB-CG 4.5Å
141	F	96.4	Very high	93.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	130.6	167.1	177	-99.5	0	0	0	109.5	F126 L127 A130 Y131 V143 L189 P190 I193 E211 A212 V214	F126-F141 AromaticContact CE2-CE2 3.94Å; F126-F141 HydrophobicContact CE2-CE2 3.94Å; F126-F141 AromaticContact CE2-CZ 3.93Å; F126-F141 HydrophobicContact CE2-CZ 3.93Å; L127-F141 HydrophobicContact CD2-CE2 4.24Å; A130-F141 HydrophobicContact CB-CD2 3.86Å; A130-F141 HydrophobicContact CB-CE2 3.61Å; A130-F141 CarbonylContact O-C 3.55Å; A130-F141 VanDerWaalsContact O-CA 3.24Å; A130-F141 WeakPolarHBondContact O-CA 3.42Å; Y131-F141 HydrophobicContact CE1-CB 4.31Å; Y131-F141 HydrophobicContact CE1-CD2 4.08Å; F141-V143 HydrophobicContact CE1-CB 4.47Å; F141-V143 HydrophobicContact CE1-CG1 3.8Å; F141-V143 HydrophobicContact CE1-CG2 3.96Å; F141-V143 HydrophobicContact CE2-CG1 3.93Å; F141-V143 HydrophobicContact CZ-CB 4.45Å; F141-V143 HydrophobicContact CZ-CG1 3.37Å; F141-V143 HydrophobicContact CZ-CG2 4.28Å; F141-L189 HydrophobicContact CE1-CD2 3.81Å; F141-L189 HydrophobicContact CZ-CD2 4.08Å; F141-P190 HydrophobicContact CE2-CG 4.31Å; F141-I193 HydrophobicContact CB-CD1 3.9Å; F141-I193 HydrophobicContact CB-CG1 3.75Å; F141-I193 HydrophobicContact CB-CG2 4.25Å; F141-I193 HydrophobicContact CD1-CD1 3.51Å; F141-I193 HydrophobicContact CD1-CG1 4.25Å; F141-I193 HydrophobicContact CD1-CG2 4.4Å; F141-I193 HydrophobicContact CD2-CD1 3.32Å; F141-I193 HydrophobicContact CD2-CG1 3.97Å; F141-I193 HydrophobicContact CE1-CD1 3.69Å; F141-I193 HydrophobicContact CE2-CD1 3.5Å; F141-I193 VanDerWaalsContact CE2-CD1 3.5Å; F141-I193 HydrophobicContact CG-CD1 3.29Å; F141-I193 HydrophobicContact CG-CG1 3.75Å; F141-I193 HydrophobicContact CG-CG2 4.49Å; F141-I193 HydrophobicContact CZ-CD1 3.66Å; F141-E211 CarbonylContact O-C 3.55Å; F141-E211 WeakPolarHBondContact O-CA 3.29Å; F141-E211 WeakPolarHBondContact O-CB 3.29Å; F141-A212 PolarHBondContact N-O 2.65Å; F141-A212 PolarHBondContact O-N 3.19Å; F141-V214 HydrophobicContact CB-CG1 4.1Å
142	K	96.6	Very high	93.9	Very high	11 Å²	11	32.3 Å²	32.3	5%	0.048	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	114.2	-178.5	-66.9	-176	178.7	172.7	0	110.4	A130 E132 V133 H140 M209 L210 E211	A130-K142 WeakPolarHBondContact CA-O 3.37Å; A130-K142 PolarHBondContact O-N 3.28Å; E132-K142 HydrophobicContact CB-CD 4.5Å; V133-K142 PolarHBondContact O-NZ 2.71Å; H140-K142 HydrophobicContact CB-CG 4.5Å; K142-M209 HydrophobicContact CD-SD 4.44Å; K142-L210 WeakPolarHBondContact CA-O 3.37Å; K142-E211 WeakPolarHBondContact CE-OE2 3.31Å; K142-E211 HydrophobicContact CG-CB 3.92Å
143	V	96.1	Very high	93.9	Very high	6 Å²	6	39 Å²	39	4%	0.036	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.2	170	-65.6	0	0	0	0	110.5	F78 F126 A130 F141 F145 M209 L210	F78-V143 HydrophobicContact CE2-CB 4.3Å; F78-V143 HydrophobicContact CE2-CG1 4.38Å; F126-V143 HydrophobicContact CD2-CG1 3.62Å; F126-V143 HydrophobicContact CE2-CG1 3.84Å; A130-V143 HydrophobicContact CB-CG1 4.04Å; F141-V143 HydrophobicContact CE1-CB 4.47Å; F141-V143 HydrophobicContact CE1-CG1 3.8Å; F141-V143 HydrophobicContact CE1-CG2 3.96Å; F141-V143 HydrophobicContact CE2-CG1 3.93Å; F141-V143 HydrophobicContact CZ-CB 4.45Å; F141-V143 HydrophobicContact CZ-CG1 3.37Å; F141-V143 HydrophobicContact CZ-CG2 4.28Å; V143-F145 HydrophobicContact CG2-CE2 3.97Å; V143-F145 HydrophobicContact CG2-CZ 4.25Å; V143-M209 WeakPolarHBondContact O-CA 3.32Å; V143-L210 HydrophobicContact CG2-CB 3.84Å; V143-L210 HydrophobicContact CG2-CD2 4.1Å; V143-L210 PolarHBondContact N-O 3.1Å; V143-L210 PolarHBondContact O-N 3.3Å
144	R	97.1	Very high	93.9	Very high	16 Å²	16	42 Å²	42	6%	0.06	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.5	-172.2	-64.4	163.2	-175.5	85.4	-3.2	109.5	M77 F78 E132 V207 L208 M209	M77-R144 WeakPolarHBondContact CA-O 3.4Å; M77-R144 HydrophobicContact CG-CB 3.82Å; F78-R144 PolarHBondContact N-O 2.96Å; E132-R144 IonicContact OE1-CZ 3.35Å; E132-R144 IonicContact OE1-NH1 2.73Å; E132-R144 PolarHBondContact OE1-NH1 3.27Å; E132-R144 IonicContact OE1-NH2 3.06Å; E132-R144 PolarHBondContact OE1-NH2 3.43Å; E132-R144 IonicContact OE2-NH2 3.59Å; E132-R144 PolarHBondContact OE2-NH2 2.89Å; R144-V207 HydrophobicContact CB-CG1 4.15Å; R144-V207 HydrophobicContact CG-CG1 4.31Å; R144-L208 CarbonylContact C-O 3.58Å; R144-L208 WeakPolarHBondContact CA-O 3.29Å; R144-M209 HydrophobicContact CG-CB 4.39Å; R144-M209 HydrophobicContact CG-CE 4.1Å; R144-M209 HydrophobicContact CG-CG 4.05Å
145	F	96.7	Very high	94.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.2	175.3	-50.7	-103.3	0	0	0	108.6	F78 L80 V143 A147 V166 R185 V187 L208 L210	F78-F145 HydrophobicContact CB-CD1 3.5Å; F78-F145 HydrophobicContact CB-CE1 3.94Å; F78-F145 HydrophobicContact CB-CG 4.21Å; F78-F145 HydrophobicContact CD2-CD1 4.16Å; F78-F145 AromaticContact CD2-CE1 3.85Å; F78-F145 HydrophobicContact CD2-CE1 3.85Å; F78-F145 HydrophobicContact CD2-CZ 4.2Å; F78-F145 HydrophobicContact CG-CD1 4.22Å; F78-F145 HydrophobicContact CG-CE1 4.18Å; F78-F145 CarbonylContact O-C 3.47Å; F78-F145 WeakPolarHBondContact O-CA 3.34Å; L80-F145 HydrophobicContact CD2-CB 4.41Å; L80-F145 HydrophobicContact CD2-CD1 4.15Å; V143-F145 HydrophobicContact CG2-CE2 3.97Å; V143-F145 HydrophobicContact CG2-CZ 4.25Å; F145-A147 PolarHBondContact O-N 3.32Å; F145-V166 HydrophobicContact CD1-CB 4.42Å; F145-V166 HydrophobicContact CD1-CG2 4.06Å; F145-V166 HydrophobicContact CD2-CG2 4.12Å; F145-V166 HydrophobicContact CE1-CB 4.33Å; F145-V166 HydrophobicContact CE1-CG2 3.7Å; F145-V166 HydrophobicContact CE2-CG2 3.77Å; F145-V166 HydrophobicContact CG-CG2 4.28Å; F145-V166 HydrophobicContact CZ-CG2 3.55Å; F145-R185 HydrophobicContact CD1-CB 4.04Å; F145-R185 HydrophobicContact CD1-CG 4.1Å; F145-R185 HydrophobicContact CE1-CB 3.97Å; F145-R185 HydrophobicContact CE1-CG 3.85Å; F145-V187 HydrophobicContact CE1-CG2 3.8Å; F145-V187 HydrophobicContact CZ-CG2 3.76Å; F145-L208 HydrophobicContact CB-CB 4.21Å; F145-L208 HydrophobicContact CB-CD2 4.49Å; F145-L208 HydrophobicContact CD2-CD2 4.13Å; F145-L208 HydrophobicContact CG-CD2 4.48Å; F145-L208 PolarHBondContact N-O 3.36Å; F145-L208 PolarHBondContact O-N 3.24Å; F145-L210 HydrophobicContact CE2-CB 4.41Å
146	D	95.7	Very high	94.3	Very high	65 Å²	65	40.7 Å²	40.7	35%	0.348	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	102.6	165.1	-173.6	-7.9	0	0	0	108	M77 F78 Q148	M77-D146 HydrophobicContact CB-CB 4.48Å; F78-D146 PolarHBondContact O-N 3.18Å; D146-Q148 VanDerWaalsContact OD1-CB 3.26Å; D146-Q148 WeakPolarHBondContact OD1-CB 3.42Å; D146-Q148 PolarHBondContact OD1-N 3.04Å
147	A	96.1	Very high	94.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.			trans	-113.5	27.3	177.2	0	0	0	0	0	110.5	L80 F145 G149 F150 I155 G206 L208	L80-A147 HydrophobicContact CD1-CB 4.35Å; F145-A147 PolarHBondContact O-N 3.32Å; A147-G149 PolarHBondContact O-N 3.43Å; A147-F150 HydrophobicContact CB-CD2 4.46Å; A147-F150 WeakPolarHBondContact O-CD2 3.36Å; A147-F150 PolarHBondContact O-N 3.31Å; A147-I155 HydrophobicContact CB-CD1 3.86Å; A147-G206 CarbonylContact C-O 3.6Å; A147-G206 VanDerWaalsContact CA-O 3.29Å; A147-G206 WeakPolarHBondContact CA-O 3.29Å; A147-G206 WeakPolarHBondContact CB-O 3Å; A147-G206 PolarHBondContact N-O 3.1Å; A147-L208 HydrophobicContact CB-CB 4.03Å
148	Q	93.7	Very high	94.9	Very high	144 Å²	144	39.4 Å²	39.4	67%	0.673	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	131	177.6	-168.7	179.4	12.9	0	0	110.8	D146 G206	D146-Q148 VanDerWaalsContact OD1-CB 3.26Å; D146-Q148 WeakPolarHBondContact OD1-CB 3.42Å; D146-Q148 PolarHBondContact OD1-N 3.04Å; Q148-G206 PolarHBondContact N-O 3.01Å
149	G	91.6	Very high	95	Very high	50 Å²	50	35.9 Å²	35.9	52%	0.515	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	9.1	178.2	0	0	0	0	0	115.6	A147 K170	A147-G149 PolarHBondContact O-N 3.43Å; G149-K170 PolarHBondContact O-NZ 3.04Å
150	F	93.6	Very high	94.7	Very high	27 Å²	27	36.4 Å²	36.4	12%	0.118	20%	0.201	C	C	.	.			trans	-107.2	149.9	163.4	-61.4	-85.9	0	0	0	109.6	L80 A147 I155 A168 K170 F183 M202	L80-F150 HydrophobicContact CD1-CD2 4.31Å; L80-F150 HydrophobicContact CD1-CE2 4.11Å; A147-F150 HydrophobicContact CB-CD2 4.46Å; A147-F150 WeakPolarHBondContact O-CD2 3.36Å; A147-F150 PolarHBondContact O-N 3.31Å; F150-I155 HydrophobicContact CB-CD1 3.95Å; F150-I155 HydrophobicContact CB-CG1 4.02Å; F150-A168 HydrophobicContact CD1-CB 3.66Å; F150-A168 HydrophobicContact CE1-CB 3.62Å; F150-A168 HydrophobicContact CG-CB 4.19Å; F150-A168 HydrophobicContact CZ-CB 4.15Å; F150-K170 HydrophobicContact CD1-CB 4.33Å; F150-K170 HydrophobicContact CE1-CB 3.83Å; F150-K170 HydrophobicContact CE1-CD 4.26Å; F150-F183 AromaticContact CE1-CD2 3.79Å; F150-F183 HydrophobicContact CE1-CD2 3.79Å; F150-F183 HydrophobicContact CE1-CE2 4.18Å; F150-F183 HydrophobicContact CE1-CG 4.45Å; F150-F183 HydrophobicContact CZ-CB 4.25Å; F150-F183 HydrophobicContact CZ-CD1 4.38Å; F150-F183 AromaticContact CZ-CD2 3.5Å; F150-F183 HydrophobicContact CZ-CD2 3.5Å; F150-F183 VanDerWaalsContact CZ-CD2 3.5Å; F150-F183 AromaticContact CZ-CE2 3.85Å; F150-F183 HydrophobicContact CZ-CE2 3.85Å; F150-F183 AromaticContact CZ-CG 3.8Å; F150-F183 HydrophobicContact CZ-CG 3.8Å; F150-F183 HydrophobicContact CZ-CZ 4.44Å; F150-M202 WeakPolarHBondContact O-CE 3.37Å
151	A	92.6	Very high	94	Very high	28 Å²	28	40.1 Å²	40.1	23%	0.231	22%	0.219	C	C	.	.			trans	-93.1	157	166.5	0	0	0	0	0	110.2	Q153 D154	A151-Q153 VanDerWaalsContact CB-CD 3.43Å; A151-Q153 VanDerWaalsContact CB-NE2 3.25Å; A151-Q153 VanDerWaalsContact CB-OE1 3.31Å; A151-Q153 PolarHBondContact O-N 2.91Å; A151-Q153 VanDerWaalsContact O-N 3.13Å; A151-D154 WeakPolarHBondContact CB-OD2 3.44Å; A151-D154 PolarHBondContact N-OD2 2.89Å; A151-D154 WeakPolarHBondContact O-CB 3.46Å; A151-D154 PolarHBondContact O-N 3.18Å
152	P	94.5	Very high	93.4	Very high	26 Å²	26	41.4 Å²	41.4	17%	0.169	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-52.3	-37	179.8	-29.2	35.2	0	0	0	114.4	V14 R16 D154 I155 M202	V14-P152 HydrophobicContact CB-CB 4.47Å; V14-P152 HydrophobicContact CG1-CB 3.98Å; R16-P152 HydrophobicContact CB-CG 4.21Å; R16-P152 HydrophobicContact CG-CG 4.49Å; P152-D154 PolarHBondContact O-N 2.88Å; P152-I155 PolarHBondContact O-N 3.34Å; P152-M202 HydrophobicContact CB-SD 4.43Å; P152-M202 HydrophobicContact CG-SD 3.83Å
153	Q	93.8	Very high	93.1	Very high	152 Å²	152	44 Å²	44	71%	0.71	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-71.4	-15.3	178.7	69.9	-84.2	8.9	0	0	114.4	A151 I155	A151-Q153 VanDerWaalsContact CB-CD 3.43Å; A151-Q153 VanDerWaalsContact CB-NE2 3.25Å; A151-Q153 VanDerWaalsContact CB-OE1 3.31Å; A151-Q153 PolarHBondContact O-N 2.91Å; A151-Q153 VanDerWaalsContact O-N 3.13Å; Q153-I155 VanDerWaalsContact C-N 3.31Å
154	D	94.1	Very high	92.9	Very high	64 Å²	64	43.7 Å²	43.7	34%	0.342	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-87.6	-5.5	178.2	-56.6	-32.7	0	0	0	111.8	A151 P152 A168 K169	A151-D154 WeakPolarHBondContact CB-OD2 3.44Å; A151-D154 PolarHBondContact N-OD2 2.89Å; A151-D154 WeakPolarHBondContact O-CB 3.46Å; A151-D154 PolarHBondContact O-N 3.18Å; P152-D154 PolarHBondContact O-N 2.88Å; D154-A168 VanDerWaalsContact O-CA 3.28Å; D154-A168 WeakPolarHBondContact O-CA 3.42Å; D154-K169 PolarHBondContact O-N 3.41Å
155	I	96.7	Very high	92.8	Very high	13 Å²	13	43.9 Å²	43.9	7%	0.067	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.3	-174.7	-56.1	174.8	0	0	0	109.7	V14 A147 F150 P152 Q153 V157 V166 H167 A168 M202 L208	V14-I155 HydrophobicContact CG2-CB 4.46Å; V14-I155 HydrophobicContact CG2-CG2 4.26Å; A147-I155 HydrophobicContact CB-CD1 3.86Å; F150-I155 HydrophobicContact CB-CD1 3.95Å; F150-I155 HydrophobicContact CB-CG1 4.02Å; P152-I155 PolarHBondContact O-N 3.34Å; Q153-I155 VanDerWaalsContact C-N 3.31Å; I155-V157 HydrophobicContact CG2-CG2 4.05Å; I155-V166 HydrophobicContact CG2-CG1 3.82Å; I155-H167 CarbonylContact C-O 3.53Å; I155-H167 WeakPolarHBondContact CA-O 3.4Å; I155-A168 HydrophobicContact CG1-CB 4.07Å; I155-M202 HydrophobicContact CD1-SD 3.94Å; I155-L208 HydrophobicContact CD1-CD1 4.43Å; I155-L208 HydrophobicContact CG2-CD2 4.06Å
156	N	96.1	Very high	92.7	Very high	80 Å²	80	43.9 Å²	43.9	43%	0.428	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.2	170	-174.3	11.5	0	0	0	109.9	H167	N156-H167 PolarHBondContact N-O 3.18Å; N156-H167 PolarHBondContact O-N 2.92Å
157	V	97	Very high	92.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	125.8	175	-175.4	0	0	0	0	108.6	S11 I12 V14 I155 V164 T165 V166 L208 L210	S11-V157 WeakPolarHBondContact CA-O 3.41Å; I12-V157 HydrophobicContact CB-CB 4.29Å; I12-V157 HydrophobicContact CB-CG1 4.13Å; I12-V157 HydrophobicContact CD1-CG1 4.22Å; I12-V157 PolarHBondContact N-O 3.39Å; V14-V157 HydrophobicContact CG2-CG2 3.72Å; I155-V157 HydrophobicContact CG2-CG2 4.05Å; V157-V164 HydrophobicContact CG1-CG1 3.75Å; V157-T165 WeakPolarHBondContact CA-O 3.47Å; V157-V166 HydrophobicContact CG1-CG2 4.47Å; V157-V166 HydrophobicContact CG2-CG1 4.44Å; V157-V166 HydrophobicContact CG2-CG2 4.3Å; V157-L208 HydrophobicContact CG2-CD2 4.08Å; V157-L210 HydrophobicContact CG1-CD1 4.22Å
158	T	95.1	Very high	92.7	Very high	32 Å²	32	43.2 Å²	43.2	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.6	178.7	55.5	0	0	0	0	110.7	V10 V164 T165	V10-T158 CarbonylContact O-C 3.55Å; V10-T158 VanDerWaalsContact O-CA 3.29Å; V10-T158 WeakPolarHBondContact O-CA 3.43Å; T158-V164 CarbonylContact O-C 3.57Å; T158-V164 VanDerWaalsContact O-CA 3.29Å; T158-V164 WeakPolarHBondContact O-CA 3.35Å; T158-T165 PolarHBondContact N-O 3.48Å; T158-T165 PolarHBondContact O-N 2.85Å
159	S	91.7	Very high	92.6	Very high	11 Å²	11	40.2 Å²	40.2	8%	0.077	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135	171.7	-179.1	0	0	0	0	109.8	A9 V10 R163	A9-S159 CarbonylContact C-O 3.51Å; A9-S159 WeakPolarHBondContact CA-O 3.44Å; V10-S159 PolarHBondContact N-O 2.89Å; V10-S159 PolarHBondContact O-N 2.97Å; S159-R163 WeakPolarHBondContact CA-O 3.35Å
160	S	87.5	Confident	92.6	Very high	12 Å²	12	41.5 Å²	41.5	8%	0.084	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	129.6	176.3	64.7	0	0	0	0	109.9	N162 R163	S160-N162 PolarHBondContact O-N 2.92Å; S160-R163 PolarHBondContact N-O 3.37Å; S160-R163 VanDerWaalsContact O-CG 3.26Å; S160-R163 WeakPolarHBondContact O-CG 3.26Å; S160-R163 PolarHBondContact O-N 3.19Å; S160-R163 WeakPolarHBondContact OG-CG 2.96Å; S160-R163 PolarHBondContact OG-NE 3.41Å; S160-R163 VanDerWaalsContact OG-NE 3.08Å
161	E	80.5	Confident	92.4	Very high	104 Å²	104	46 Å²	46	49%	0.486	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	-72.5	177.8	-65.7	172.3	-169.2	0	0	114.7	H7	H7-E161 HydrophobicContact CB-CG 3.94Å; H7-E161 VanDerWaalsContact CB-OE1 3.28Å; H7-E161 WeakPolarHBondContact CB-OE1 3.17Å; H7-E161 IonicContact CD2-OE1 3.14Å; H7-E161 PolarHBondContact CD2-OE1 3.38Å; H7-E161 IonicContact CG-OE1 3.7Å; H7-E161 WeakPolarHBondContact ND1-CG 3.37Å; H7-E161 IonicContact ND1-OE1 3.41Å
162	N	85	Confident	92.1	Very high	28 Å²	28	47 Å²	47	15%	0.15	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-156.9	21.6	-170.6	60.8	7.5	0	0	0	110.8	S160 Q188 L189 H350	S160-N162 PolarHBondContact O-N 2.92Å; N162-Q188 PolarHBondContact ND2-NE2 2.85Å; N162-Q188 CarbonylContact O-C 3.56Å; N162-Q188 VanDerWaalsContact O-CD 3.24Å; N162-Q188 PolarHBondContact O-NE2 2.84Å; N162-Q188 VanDerWaalsContact O-NE2 3.11Å; N162-Q188 PolarHBondContact OD1-NE2 3.47Å; N162-L189 PolarHBondContact O-N 3.39Å; N162-H350 PolarHBondContact ND2-CE1 2.98Å; N162-H350 PolarHBondContact ND2-NE2 2.75Å
163	R	90	Very high	91.8	Very high	65 Å²	65	50.2 Å²	50.2	25%	0.245	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152.2	179.5	63	169.9	178.9	-121.2	-4.6	111.4	F95 S159 S160 V187	F95-R163 HydrophobicContact CE2-CB 4.35Å; F95-R163 HydrophobicContact CZ-CB 3.88Å; S159-R163 WeakPolarHBondContact CA-O 3.35Å; S160-R163 PolarHBondContact N-O 3.37Å; S160-R163 VanDerWaalsContact O-CG 3.26Å; S160-R163 WeakPolarHBondContact O-CG 3.26Å; S160-R163 PolarHBondContact O-N 3.19Å; S160-R163 WeakPolarHBondContact OG-CG 2.96Å; S160-R163 PolarHBondContact OG-NE 3.41Å; S160-R163 VanDerWaalsContact OG-NE 3.08Å; R163-V187 CarbonylContact C-O 3.57Å; R163-V187 VanDerWaalsContact CA-O 3.24Å; R163-V187 WeakPolarHBondContact CA-O 3.48Å
164	V	93	Very high	91.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	136.4	165.7	167.1	0	0	0	0	109.6	V157 T158 V166 M186 V187 L189 L198 L210	V157-V164 HydrophobicContact CG1-CG1 3.75Å; T158-V164 CarbonylContact O-C 3.57Å; T158-V164 VanDerWaalsContact O-CA 3.29Å; T158-V164 WeakPolarHBondContact O-CA 3.35Å; V164-V166 HydrophobicContact CG1-CG2 4.3Å; V164-M186 WeakPolarHBondContact O-CA 3.2Å; V164-V187 PolarHBondContact N-O 3.37Å; V164-V187 PolarHBondContact O-N 3.27Å; V164-L189 HydrophobicContact CG2-CD1 3.71Å; V164-L189 HydrophobicContact CG2-CD2 4.07Å; V164-L189 HydrophobicContact CG2-CG 4.09Å; V164-L198 HydrophobicContact CG2-CD1 3.93Å; V164-L210 HydrophobicContact CB-CD2 3.94Å; V164-L210 HydrophobicContact CG1-CD2 3.72Å; V164-L210 HydrophobicContact CG2-CD2 3.64Å
165	T	93.4	Very high	91.4	Very high	19 Å²	19	52 Å²	52	12%	0.117	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.9	172.7	-56.3	0	0	0	0	108.7	V157 T158 M186	V157-T165 WeakPolarHBondContact CA-O 3.47Å; T158-T165 PolarHBondContact N-O 3.48Å; T158-T165 PolarHBondContact O-N 2.85Å; T165-M186 HydrophobicContact CG2-CE 3.99Å; T165-M186 HydrophobicContact CG2-CG 4.04Å
166	V	96	Very high	91.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	110.1	169.2	-177.1	0	0	0	0	107.2	L80 F145 I155 V157 V164 C184 R185 L208	L80-V166 HydrophobicContact CD1-CG1 4.37Å; L80-V166 HydrophobicContact CD2-CB 4.03Å; L80-V166 HydrophobicContact CD2-CG1 3.65Å; F145-V166 HydrophobicContact CD1-CB 4.42Å; F145-V166 HydrophobicContact CD1-CG2 4.06Å; F145-V166 HydrophobicContact CD2-CG2 4.12Å; F145-V166 HydrophobicContact CE1-CB 4.33Å; F145-V166 HydrophobicContact CE1-CG2 3.7Å; F145-V166 HydrophobicContact CE2-CG2 3.77Å; F145-V166 HydrophobicContact CG-CG2 4.28Å; F145-V166 HydrophobicContact CZ-CG2 3.55Å; I155-V166 HydrophobicContact CG2-CG1 3.82Å; V157-V166 HydrophobicContact CG1-CG2 4.47Å; V157-V166 HydrophobicContact CG2-CG1 4.44Å; V157-V166 HydrophobicContact CG2-CG2 4.3Å; V164-V166 HydrophobicContact CG1-CG2 4.3Å; V166-C184 CarbonylContact O-C 3.6Å; V166-C184 VanDerWaalsContact O-CA 3.26Å; V166-C184 WeakPolarHBondContact O-CA 3.34Å; V166-R185 PolarHBondContact N-O 2.96Å; V166-R185 PolarHBondContact O-N 3.18Å; V166-L208 HydrophobicContact CB-CD2 4.5Å; V166-L208 HydrophobicContact CG1-CD2 3.53Å; V166-L208 HydrophobicContact CG2-CD2 4.12Å
167	H	94.8	Very high	90.7	Very high	52 Å²	52	60.8 Å²	60.8	24%	0.241	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.7	175.8	176.8	-93.8	0	0	0	109.1	I155 N156 E182 F183	I155-H167 CarbonylContact C-O 3.53Å; I155-H167 WeakPolarHBondContact CA-O 3.4Å; N156-H167 PolarHBondContact N-O 3.18Å; N156-H167 PolarHBondContact O-N 2.92Å; H167-E182 IonicContact CD2-OE2 3.21Å; H167-E182 IonicContact CE1-OE2 3.19Å; H167-E182 PolarHBondContact CE1-OE2 3.38Å; H167-E182 IonicContact NE2-OE2 2.75Å; H167-E182 PolarHBondContact NE2-OE2 2.95Å; H167-F183 CarbonylContact C-O 3.54Å; H167-F183 WeakPolarHBondContact CA-O 3.33Å
168	A	95.5	Very high	90.3	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.7	176.7	0	0	0	0	0	110.4	L80 F150 D154 I155 E182 F183	L80-A168 HydrophobicContact CD1-CB 3.76Å; F150-A168 HydrophobicContact CD1-CB 3.66Å; F150-A168 HydrophobicContact CE1-CB 3.62Å; F150-A168 HydrophobicContact CG-CB 4.19Å; F150-A168 HydrophobicContact CZ-CB 4.15Å; D154-A168 VanDerWaalsContact O-CA 3.28Å; D154-A168 WeakPolarHBondContact O-CA 3.42Å; I155-A168 HydrophobicContact CG1-CB 4.07Å; A168-E182 WeakPolarHBondContact O-CA 3.37Å; A168-F183 PolarHBondContact N-O 3.01Å; A168-F183 PolarHBondContact O-N 2.8Å
169	K	93.1	Very high	89.9	Confident	81 Å²	81	69.7 Å²	69.7	35%	0.352	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.7	177.4	-172.4	-172.3	-173.5	-158.3	0	109.7	D154 E171 S180 E182	D154-K169 PolarHBondContact O-N 3.41Å; K169-E171 WeakPolarHBondContact CE-OE1 3.38Å; K169-E171 IonicContact NZ-OE1 2.73Å; K169-E171 PolarHBondContact NZ-OE1 2.83Å; K169-S180 WeakPolarHBondContact CE-OG 3.44Å; K169-E182 HydrophobicContact CG-CG 4.17Å
170	K	90.2	Very high	89.8	Confident	76 Å²	76	71.7 Å²	71.7	33%	0.33	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.8	178.2	-173.1	163.7	-175.6	158	0	110.8	G149 F150 T172 S180 R181 F183	G149-K170 PolarHBondContact O-NZ 3.04Å; F150-K170 HydrophobicContact CD1-CB 4.33Å; F150-K170 HydrophobicContact CE1-CB 3.83Å; F150-K170 HydrophobicContact CE1-CD 4.26Å; K170-T172 HydrophobicContact CG-CG2 4.22Å; K170-S180 CarbonylContact O-C 3.5Å; K170-S180 WeakPolarHBondContact O-CA 3.38Å; K170-R181 PolarHBondContact N-O 3.29Å; K170-R181 PolarHBondContact O-N 3.3Å; K170-F183 HydrophobicContact CB-CE2 4.46Å
171	E	89.6	Confident	89.9	Confident	121 Å²	121	78.1 Å²	78.1	57%	0.565	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.7	171.7	-64.8	-174.2	-174.6	0	0	109.9	K169 C179	K169-E171 WeakPolarHBondContact CE-OE1 3.38Å; K169-E171 IonicContact NZ-OE1 2.73Å; K169-E171 PolarHBondContact NZ-OE1 2.83Å; E171-C179 CarbonylContact C-O 3.6Å; E171-C179 WeakPolarHBondContact CA-O 3.46Å
172	T	85.5	Confident	90.4	Very high	51 Å²	51	76.4 Å²	76.4	31%	0.313	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.1	175.8	51.5	0	0	0	0	109.2	K170 K178 C179	K170-T172 HydrophobicContact CG-CG2 4.22Å; T172-K178 CarbonylContact O-C 3.54Å; T172-K178 WeakPolarHBondContact O-CA 3.26Å; T172-C179 PolarHBondContact N-O 3.24Å; T172-C179 PolarHBondContact O-N 3.18Å; T172-C179 PolarHBondContact OG1-O 3.48Å
173	T	89.6	Confident	90.8	Very high	93 Å²	93	76.9 Å²	76.9	57%	0.571	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	115.6	174.2	-57	0	0	0	0	108.7	R177 K178	T173-R177 WeakPolarHBondContact CA-O 3.44Å; T173-K178 HydrophobicContact CG2-CG 4.49Å
174	T	88	Confident	90.9	Very high	90 Å²	90	74 Å²	74	55%	0.552	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.2	177.1	-52.6	0	0	0	0	108.1	G176 R177	T174-G176 PolarHBondContact O-N 3.32Å; T174-R177 PolarHBondContact N-O 2.87Å; T174-R177 WeakPolarHBondContact O-CB 3.4Å; T174-R177 PolarHBondContact O-N 2.98Å
175	D	91.3	Very high	90.9	Very high	162 Å²	162	74 Å²	74	87%	0.866	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	39.3	-179.1	-54.4	-30.8	0	0	0	114.3	R177	D175-R177 PolarHBondContact O-N 3.09Å
176	G	90.1	Very high	90.7	Very high	72 Å²	72	74.7 Å²	74.7	74%	0.742	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	-3.6	-177.9	0	0	0	0	0	115	T174	T174-G176 PolarHBondContact O-N 3.32Å
177	R	87.5	Confident	90.4	Very high	206 Å²	206	74.8 Å²	74.8	78%	0.777	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.2	173.7	-61.1	-177.2	-171.4	169.9	3.8	109.9	T173 T174 D175	T173-R177 WeakPolarHBondContact CA-O 3.44Å; T174-R177 PolarHBondContact N-O 2.87Å; T174-R177 WeakPolarHBondContact O-CB 3.4Å; T174-R177 PolarHBondContact O-N 2.98Å; D175-R177 PolarHBondContact O-N 3.09Å
178	K	88.4	Confident	90.1	Very high	168 Å²	168	74.6 Å²	74.6	73%	0.73	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.3	170.7	-64.8	-173	177	-172.5	0	109.6	T172 T173	T172-K178 CarbonylContact O-C 3.54Å; T172-K178 WeakPolarHBondContact O-CA 3.26Å; T173-K178 HydrophobicContact CG2-CG 4.49Å
179	C	87.3	Confident	89.9	Confident	53 Å²	53	75 Å²	75	36%	0.358	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.3	171.2	178.7	0	0	0	0	108.2	E171 T172	E171-C179 CarbonylContact C-O 3.6Å; E171-C179 WeakPolarHBondContact CA-O 3.46Å; T172-C179 PolarHBondContact N-O 3.24Å; T172-C179 PolarHBondContact O-N 3.18Å; T172-C179 PolarHBondContact OG1-O 3.48Å
180	S	89.1	Confident	89.8	Confident	53 Å²	53	71.6 Å²	71.6	37%	0.371	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134.6	168.8	-179.1	0	0	0	0	108.4	K169 K170	K169-S180 WeakPolarHBondContact CE-OG 3.44Å; K170-S180 CarbonylContact O-C 3.5Å; K170-S180 WeakPolarHBondContact O-CA 3.38Å
181	R	89.7	Confident	89.7	Confident	147 Å²	147	75.2 Å²	75.2	56%	0.555	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.8	171.1	-66.1	-177.5	-175.4	171.8	-0.2	110	D84 K170 F183	D84-R181 VanDerWaalsContact OD2-CA 3.28Å; D84-R181 WeakPolarHBondContact OD2-CA 3.49Å; K170-R181 PolarHBondContact N-O 3.29Å; K170-R181 PolarHBondContact O-N 3.3Å; R181-F183 HydrophobicContact CB-CE2 3.68Å; R181-F183 HydrophobicContact CB-CZ 4.26Å
182	E	91.5	Very high	89.8	Confident	67 Å²	67	69.9 Å²	69.9	31%	0.313	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.7	177.9	-66.7	-171.8	-159.6	0	0	111.6	P82 L83 D84 H167 A168 K169	P82-E182 WeakPolarHBondContact CA-O 3.37Å; L83-E182 HydrophobicContact CB-CB 4.42Å; L83-E182 HydrophobicContact CD1-CB 4.26Å; L83-E182 PolarHBondContact N-O 2.88Å; D84-E182 PolarHBondContact OD2-N 3.42Å; H167-E182 IonicContact CD2-OE2 3.21Å; H167-E182 IonicContact CE1-OE2 3.19Å; H167-E182 PolarHBondContact CE1-OE2 3.38Å; H167-E182 IonicContact NE2-OE2 2.75Å; H167-E182 PolarHBondContact NE2-OE2 2.95Å; A168-E182 WeakPolarHBondContact O-CA 3.37Å; K169-E182 HydrophobicContact CG-CG 4.17Å
183	F	92.8	Very high	90.1	Very high	38 Å²	38	67.6 Å²	67.6	17%	0.167	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	145.5	-179.9	-59.2	-104.1	0	0	0	109.8	L80 L81 P82 F150 H167 A168 K170 R181	L80-F183 HydrophobicContact CB-CB 3.8Å; L81-F183 CarbonylContact O-C 3.57Å; L81-F183 WeakPolarHBondContact O-CA 3.43Å; P82-F183 HydrophobicContact CB-CD1 3.96Å; P82-F183 HydrophobicContact CB-CE1 3.8Å; F150-F183 AromaticContact CE1-CD2 3.79Å; F150-F183 HydrophobicContact CE1-CD2 3.79Å; F150-F183 HydrophobicContact CE1-CE2 4.18Å; F150-F183 HydrophobicContact CE1-CG 4.45Å; F150-F183 HydrophobicContact CZ-CB 4.25Å; F150-F183 HydrophobicContact CZ-CD1 4.38Å; F150-F183 AromaticContact CZ-CD2 3.5Å; F150-F183 HydrophobicContact CZ-CD2 3.5Å; F150-F183 VanDerWaalsContact CZ-CD2 3.5Å; F150-F183 AromaticContact CZ-CE2 3.85Å; F150-F183 HydrophobicContact CZ-CE2 3.85Å; F150-F183 AromaticContact CZ-CG 3.8Å; F150-F183 HydrophobicContact CZ-CG 3.8Å; F150-F183 HydrophobicContact CZ-CZ 4.44Å; H167-F183 CarbonylContact C-O 3.54Å; H167-F183 WeakPolarHBondContact CA-O 3.33Å; A168-F183 PolarHBondContact N-O 3.01Å; A168-F183 PolarHBondContact O-N 2.8Å; K170-F183 HydrophobicContact CB-CE2 4.46Å; R181-F183 HydrophobicContact CB-CE2 3.68Å; R181-F183 HydrophobicContact CB-CZ 4.26Å
184	C	92.5	Very high	90.3	Very high	5 Å²	5	64.7 Å²	64.7	3%	0.034	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	146.9	-178	-172	0	0	0	0	111.7	L81 L83 V166	L81-C184 PolarHBondContact N-O 3.23Å; L81-C184 PolarHBondContact O-N 3.43Å; L83-C184 HydrophobicContact CD1-CB 3.7Å; L83-C184 HydrophobicContact CD2-CB 3.74Å; L83-C184 HydrophobicContact CG-CB 3.76Å; V166-C184 CarbonylContact O-C 3.6Å; V166-C184 VanDerWaalsContact O-CA 3.26Å; V166-C184 WeakPolarHBondContact O-CA 3.34Å
185	R	92.5	Very high	90.4	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.1	161.3	-166.7	70.5	167.1	174.5	1.7	109.6	F78 A79 L80 D102 T120 G121 V123 F145 V166	F78-R185 HydrophobicContact CB-CG 3.98Å; F78-R185 HydrophobicContact CD1-CG 4.46Å; F78-R185 HydrophobicContact CG-CG 4.27Å; A79-R185 WeakPolarHBondContact O-CD 3.39Å; L80-R185 HydrophobicContact CD2-CB 3.84Å; D102-R185 IonicContact OD1-CZ 2.68Å; D102-R185 IonicContact OD1-NH1 2.66Å; D102-R185 PolarHBondContact OD1-NH1 2.79Å; D102-R185 IonicContact OD1-NH2 3.63Å; D102-R185 PolarHBondContact OD1-NH2 3.39Å; D102-R185 VanDerWaalsContact OD1-NH2 3.07Å; D102-R185 IonicContact OD2-CZ 3.43Å; D102-R185 IonicContact OD2-NH1 2.89Å; D102-R185 PolarHBondContact OD2-NH1 3.26Å; D102-R185 IonicContact OD2-NH2 2.8Å; D102-R185 PolarHBondContact OD2-NH2 3.02Å; T120-R185 PolarHBondContact O-NH2 3.42Å; G121-R185 PolarHBondContact O-NH2 3.43Å; V123-R185 VanDerWaalsContact CG1-NH2 3.27Å; F145-R185 HydrophobicContact CD1-CB 4.04Å; F145-R185 HydrophobicContact CD1-CG 4.1Å; F145-R185 HydrophobicContact CE1-CB 3.97Å; F145-R185 HydrophobicContact CE1-CG 3.85Å; V166-R185 PolarHBondContact N-O 2.96Å; V166-R185 PolarHBondContact O-N 3.18Å
186	M	90.9	Very high	90.4	Very high	34 Å²	34	60.2 Å²	60.2	17%	0.167	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	136.9	173.8	-61.1	-171.7	-168.5	0	0	110.5	P94 F95 M98 V164 T165	P94-M186 HydrophobicContact CB-CE 4.01Å; P94-M186 HydrophobicContact CB-SD 3.53Å; P94-M186 VanDerWaalsContact CB-SD 3.53Å; P94-M186 HydrophobicContact CG-SD 4.03Å; F95-M186 HydrophobicContact CE1-CB 4.07Å; F95-M186 HydrophobicContact CZ-CB 4.49Å; M98-M186 HydrophobicContact CG-CB 4.36Å; V164-M186 WeakPolarHBondContact O-CA 3.2Å; T165-M186 HydrophobicContact CG2-CE 3.99Å; T165-M186 HydrophobicContact CG2-CG 4.04Å
187	V	89.5	Confident	90.6	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.9	178.7	-179	0	0	0	0	108.4	F78 F126 F145 R163 V164	F78-V187 HydrophobicContact CD2-CG2 3.84Å; F78-V187 HydrophobicContact CE2-CG1 4.24Å; F78-V187 HydrophobicContact CE2-CG2 3.49Å; F78-V187 VanDerWaalsContact CE2-CG2 3.49Å; F78-V187 HydrophobicContact CG-CG2 4.49Å; F78-V187 HydrophobicContact CZ-CG1 4.41Å; F78-V187 HydrophobicContact CZ-CG2 3.86Å; F126-V187 HydrophobicContact CD2-CG1 4.4Å; F126-V187 HydrophobicContact CE1-CG1 4.08Å; F126-V187 HydrophobicContact CE2-CG1 3.7Å; F126-V187 HydrophobicContact CZ-CG1 3.53Å; F145-V187 HydrophobicContact CE1-CG2 3.8Å; F145-V187 HydrophobicContact CZ-CG2 3.76Å; R163-V187 CarbonylContact C-O 3.57Å; R163-V187 VanDerWaalsContact CA-O 3.24Å; R163-V187 WeakPolarHBondContact CA-O 3.48Å; V164-V187 PolarHBondContact N-O 3.37Å; V164-V187 PolarHBondContact O-N 3.27Å
188	Q	88.6	Confident	91	Very high	48 Å²	48	52.4 Å²	52.4	22%	0.224	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	128.5	170.9	-173.9	70.1	24.8	0	0	108.5	F95 F126 N162 P190	F95-Q188 HydrophobicContact CE1-CB 3.99Å; F95-Q188 HydrophobicContact CZ-CB 3.81Å; F126-Q188 WeakPolarHBondContact CZ-O 3.21Å; N162-Q188 PolarHBondContact ND2-NE2 2.85Å; N162-Q188 CarbonylContact O-C 3.56Å; N162-Q188 VanDerWaalsContact O-CD 3.24Å; N162-Q188 PolarHBondContact O-NE2 2.84Å; N162-Q188 VanDerWaalsContact O-NE2 3.11Å; N162-Q188 PolarHBondContact OD1-NE2 3.47Å; Q188-P190 WeakPolarHBondContact O-CD 3.49Å
189	L	90.9	Very high	91.5	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.042	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-88.1	125.8	176.4	-63.5	179.3	0	0	0	110.5	F141 N162 V164 I193 D195 L198	F141-L189 HydrophobicContact CE1-CD2 3.81Å; F141-L189 HydrophobicContact CZ-CD2 4.08Å; N162-L189 PolarHBondContact O-N 3.39Å; V164-L189 HydrophobicContact CG2-CD1 3.71Å; V164-L189 HydrophobicContact CG2-CD2 4.07Å; V164-L189 HydrophobicContact CG2-CG 4.09Å; L189-I193 HydrophobicContact CB-CD1 4.45Å; L189-I193 HydrophobicContact CD2-CD1 4.33Å; L189-D195 HydrophobicContact CD1-CB 4.15Å; L189-L198 HydrophobicContact CD1-CD1 3.71Å
190	P	90.1	Very high	92	Very high	11 Å²	11	48.1 Å²	48.1	7%	0.071	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-56.2	149.1	166.1	-26.6	29.5	0	0	0	114	L127 Y131 F141 Q188 S192 I193 D327	L127-P190 HydrophobicContact CD1-CG 4.31Å; L127-P190 HydrophobicContact CD2-CG 3.3Å; L127-P190 HydrophobicContact CG-CG 4.47Å; Y131-P190 VanDerWaalsContact OH-CB 3.25Å; Y131-P190 WeakPolarHBondContact OH-CB 3.35Å; Y131-P190 VanDerWaalsContact OH-CG 3.29Å; Y131-P190 WeakPolarHBondContact OH-CG 3.48Å; F141-P190 HydrophobicContact CE2-CG 4.31Å; Q188-P190 WeakPolarHBondContact O-CD 3.49Å; P190-S192 PolarHBondContact O-N 2.76Å; P190-I193 HydrophobicContact CB-CD1 3.96Å; P190-I193 HydrophobicContact CB-CG1 4.29Å; P190-I193 VanDerWaalsContact CD-CD1 3.44Å; P190-I193 HydrophobicContact CG-CD1 3.87Å; P190-I193 PolarHBondContact O-N 2.78Å; P190-D327 HydrophobicContact CB-CB 4.16Å; P190-D327 VanDerWaalsContact CB-OD2 3.29Å; P190-D327 WeakPolarHBondContact CB-OD2 3.4Å
191	K	88.8	Confident	92.4	Very high	152 Å²	152	46.7 Å²	46.7	66%	0.661	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.8	177.2	-67.6	177.2	-177.2	169.2	0	113.3	I193	K191-I193 PolarHBondContact O-N 3.08Å
192	S	90.5	Very high	92.8	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.063	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-2.7	175.9	59.8	0	0	0	0	114.2	Y131 P190 V214 K215 D327	Y131-S192 PolarHBondContact OH-OG 3.15Å; P190-S192 PolarHBondContact O-N 2.76Å; S192-V214 CarbonylContact O-C 3.55Å; S192-V214 VanDerWaalsContact O-CA 3.31Å; S192-V214 WeakPolarHBondContact O-CA 3.37Å; S192-V214 WeakPolarHBondContact O-CB 3.02Å; S192-K215 PolarHBondContact O-N 3.06Å; S192-D327 WeakPolarHBondContact CB-OD2 3.29Å; S192-D327 PolarHBondContact N-OD2 2.99Å; S192-D327 PolarHBondContact OG-OD1 2.91Å; S192-D327 PolarHBondContact OG-OD2 2.92Å
193	I	92.9	Very high	93.1	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.015	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-96.8	141.8	-177.7	-57.4	162.3	0	0	0	110	F141 L189 P190 K191 D195 A212 K215	F141-I193 HydrophobicContact CB-CD1 3.9Å; F141-I193 HydrophobicContact CB-CG1 3.75Å; F141-I193 HydrophobicContact CB-CG2 4.25Å; F141-I193 HydrophobicContact CD1-CD1 3.51Å; F141-I193 HydrophobicContact CD1-CG1 4.25Å; F141-I193 HydrophobicContact CD1-CG2 4.4Å; F141-I193 HydrophobicContact CD2-CD1 3.32Å; F141-I193 HydrophobicContact CD2-CG1 3.97Å; F141-I193 HydrophobicContact CE1-CD1 3.69Å; F141-I193 HydrophobicContact CE2-CD1 3.5Å; F141-I193 VanDerWaalsContact CE2-CD1 3.5Å; F141-I193 HydrophobicContact CG-CD1 3.29Å; F141-I193 HydrophobicContact CG-CG1 3.75Å; F141-I193 HydrophobicContact CG-CG2 4.49Å; F141-I193 HydrophobicContact CZ-CD1 3.66Å; L189-I193 HydrophobicContact CB-CD1 4.45Å; L189-I193 HydrophobicContact CD2-CD1 4.33Å; P190-I193 HydrophobicContact CB-CD1 3.96Å; P190-I193 HydrophobicContact CB-CG1 4.29Å; P190-I193 VanDerWaalsContact CD-CD1 3.44Å; P190-I193 HydrophobicContact CG-CD1 3.87Å; P190-I193 PolarHBondContact O-N 2.78Å; K191-I193 PolarHBondContact O-N 3.08Å; I193-D195 VanDerWaalsContact C-N 3.3Å; I193-D195 PolarHBondContact O-N 2.85Å; I193-D195 VanDerWaalsContact O-N 3.16Å; I193-A212 HydrophobicContact CG2-CB 3.42Å; I193-A212 VanDerWaalsContact CG2-CB 3.42Å; I193-K215 VanDerWaalsContact O-CE 3.3Å; I193-K215 WeakPolarHBondContact O-CE 3.34Å; I193-K215 PolarHBondContact O-NZ 3.15Å
194	D	92.6	Very high	93.2	Very high	32 Å²	32	39 Å²	39	17%	0.171	20%	0.198	C	C	.	.			trans	-81.7	80.9	162.8	-170.7	6.6	0	0	0	110.2	S196 Q197 P213 K215	D194-S196 PolarHBondContact O-N 2.66Å; D194-S196 WeakPolarHBondContact OD1-CB 3.44Å; D194-S196 PolarHBondContact OD1-N 2.68Å; D194-S196 PolarHBondContact OD1-OG 2.73Å; D194-Q197 PolarHBondContact O-N 3.3Å; D194-Q197 WeakPolarHBondContact OD2-CG 3.48Å; D194-Q197 PolarHBondContact OD2-NE2 2.86Å; D194-P213 HydrophobicContact CB-CG 4.15Å; D194-P213 PolarHBondContact N-O 3.11Å; D194-K215 HydrophobicContact CB-CG 4.31Å
195	D	91	Very high	93.4	Very high	59 Å²	59	41.2 Å²	41.2	32%	0.316	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-58.6	-22.9	180	62.8	-32	0	0	0	113.6	L189 I193 Q197 L198 K215	L189-D195 HydrophobicContact CD1-CB 4.15Å; I193-D195 VanDerWaalsContact C-N 3.3Å; I193-D195 PolarHBondContact O-N 2.85Å; I193-D195 VanDerWaalsContact O-N 3.16Å; D195-Q197 PolarHBondContact O-N 2.86Å; D195-L198 HydrophobicContact CB-CD1 4.08Å; D195-L198 VanDerWaalsContact O-CD1 3.31Å; D195-L198 WeakPolarHBondContact O-CD1 3.31Å; D195-L198 WeakPolarHBondContact O-CG 3.47Å; D195-L198 PolarHBondContact O-N 2.54Å; D195-K215 IonicContact OD1-NZ 3.18Å
196	S	91.7	Very high	93.7	Very high	98 Å²	98	41.4 Å²	41.4	69%	0.685	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-66.9	-19.3	173.6	79.1	0	0	0	0	113.6	D194	D194-S196 PolarHBondContact O-N 2.66Å; D194-S196 WeakPolarHBondContact OD1-CB 3.44Å; D194-S196 PolarHBondContact OD1-N 2.68Å; D194-S196 PolarHBondContact OD1-OG 2.73Å
197	Q	94.5	Very high	94	Very high	98 Å²	98	40 Å²	40	46%	0.458	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-108.8	18.4	-179.4	-67.3	-163.1	54.4	0	0	113.4	D194 D195 K199 P213	D194-Q197 PolarHBondContact O-N 3.3Å; D194-Q197 WeakPolarHBondContact OD2-CG 3.48Å; D194-Q197 PolarHBondContact OD2-NE2 2.86Å; D195-Q197 PolarHBondContact O-N 2.86Å; Q197-K199 PolarHBondContact O-N 2.92Å; Q197-P213 HydrophobicContact CB-CG 3.92Å; Q197-P213 HydrophobicContact CG-CG 4.48Å
198	L	96.2	Very high	94.4	Very high	17 Å²	17	40 Å²	40	9%	0.089	20%	0.204	C	C	.	.			trans	-59.4	127.2	175.6	-75.5	163.4	0	0	0	111.5	I12 V164 L189 D195 L210 E211 A212	I12-L198 HydrophobicContact CD1-CB 3.64Å; I12-L198 HydrophobicContact CD1-CD1 4Å; I12-L198 HydrophobicContact CD1-CG 4.44Å; V164-L198 HydrophobicContact CG2-CD1 3.93Å; L189-L198 HydrophobicContact CD1-CD1 3.71Å; D195-L198 HydrophobicContact CB-CD1 4.08Å; D195-L198 VanDerWaalsContact O-CD1 3.31Å; D195-L198 WeakPolarHBondContact O-CD1 3.31Å; D195-L198 WeakPolarHBondContact O-CG 3.47Å; D195-L198 PolarHBondContact O-N 2.54Å; L198-L210 HydrophobicContact CB-CD1 4.37Å; L198-L210 HydrophobicContact CD2-CD1 4.21Å; L198-L210 HydrophobicContact CD2-CD2 3.85Å; L198-L210 HydrophobicContact CD2-CG 3.8Å; L198-E211 CarbonylContact C-O 3.58Å; L198-E211 WeakPolarHBondContact CA-O 3.33Å; L198-A212 HydrophobicContact CD2-CB 3.62Å; L198-A212 HydrophobicContact CG-CB 4.07Å
199	K	97.2	Very high	94.8	Very high	128 Å²	128	37.8 Å²	37.8	56%	0.557	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.2	174.3	-66.4	176.1	-173.8	172.9	0	109.4	Q197 L210 E211	Q197-K199 PolarHBondContact O-N 2.92Å; K199-L210 WeakPolarHBondContact O-CA 3.41Å; K199-E211 HydrophobicContact CB-CG 4.17Å; K199-E211 PolarHBondContact N-O 2.87Å; K199-E211 PolarHBondContact O-N 3.5Å
200	C	98	Very high	95.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.014	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135.3	175.3	-164.9	0	0	0	0	110.8	I12 N15 L208 M209 L210	I12-C200 HydrophobicContact CG2-CB 3.69Å; N15-C200 PolarHBondContact N-O 3.3Å; N15-C200 VanDerWaalsContact N-O 3.07Å; N15-C200 PolarHBondContact ND2-O 3.15Å; C200-L208 WeakPolarHBondContact SG-CD1 3.41Å; C200-M209 WeakPolarHBondContact CA-O 3.2Å; C200-L210 HydrophobicContact CB-CD1 4.02Å
201	R	97.4	Very high	95.5	Very high	23 Å²	23	38.3 Å²	38.3	9%	0.087	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	156.1	176.4	58.6	163.6	77.2	97.8	-3	109.9	N15 E17 L208 M209 E211	N15-R201 CarbonylContact O-C 3.53Å; N15-R201 WeakPolarHBondContact O-CA 3.32Å; E17-R201 HydrophobicContact CG-CB 4.17Å; E17-R201 WeakPolarHBondContact OE1-CD 3.4Å; E17-R201 IonicContact OE1-CZ 3.66Å; E17-R201 IonicContact OE1-NE 3.32Å; E17-R201 PolarHBondContact OE1-NE 3.14Å; R201-L208 CarbonylContact O-C 3.53Å; R201-L208 WeakPolarHBondContact O-CA 3.29Å; R201-M209 HydrophobicContact CG-CB 3.83Å; R201-M209 PolarHBondContact N-O 2.89Å; R201-M209 PolarHBondContact NH1-SD 3.42Å; R201-M209 PolarHBondContact O-N 3.42Å; R201-E211 VanDerWaalsContact CZ-CD 3.43Å; R201-E211 IonicContact CZ-OE1 3.74Å; R201-E211 IonicContact CZ-OE2 2.83Å; R201-E211 IonicContact NH1-OE1 3.43Å; R201-E211 IonicContact NH1-OE2 2.7Å; R201-E211 PolarHBondContact NH1-OE2 3.36Å; R201-E211 IonicContact NH2-OE1 3.71Å; R201-E211 PolarHBondContact NH2-OE1 3.07Å; R201-E211 IonicContact NH2-OE2 3.61Å; R201-E211 PolarHBondContact NH2-OE2 3.36Å
202	M	98.1	Very high	95.9	Very high	12 Å²	12	31.1 Å²	31.1	6%	0.059	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	125	174.9	-172.8	-179.7	154.3	0	0	110.2	V14 N15 E17 F150 P152 I155 V207 L208	V14-M202 HydrophobicContact CG1-CB 3.88Å; N15-M202 PolarHBondContact O-N 3.41Å; E17-M202 PolarHBondContact N-O 2.64Å; F150-M202 WeakPolarHBondContact O-CE 3.37Å; P152-M202 HydrophobicContact CB-SD 4.43Å; P152-M202 HydrophobicContact CG-SD 3.83Å; I155-M202 HydrophobicContact CD1-SD 3.94Å; M202-V207 WeakPolarHBondContact CA-O 3.43Å; M202-L208 HydrophobicContact CB-CD1 3.97Å; M202-L208 HydrophobicContact CG-CD1 4.37Å
203	T	98.1	Very high	96.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	160.8	176.8	62.6	0	0	0	0	111.4	R19 F21 D205 G206 V207	R19-T203 WeakPolarHBondContact O-CA 3.38Å; R19-T203 WeakPolarHBondContact O-CB 3.24Å; F21-T203 HydrophobicContact CB-CG2 4.33Å; T203-D205 WeakPolarHBondContact CB-OD1 3.25Å; T203-D205 PolarHBondContact O-N 3.49Å; T203-D205 PolarHBondContact OG1-OD1 3.34Å; T203-G206 PolarHBondContact O-N 3.07Å; T203-V207 HydrophobicContact CG2-CB 4.43Å; T203-V207 PolarHBondContact N-O 2.81Å; T203-V207 VanDerWaalsContact OG1-CB 3.31Å; T203-V207 WeakPolarHBondContact OG1-CB 3.49Å; T203-V207 PolarHBondContact OG1-N 3.33Å; T203-V207 PolarHBondContact OG1-O 2.73Å
204	D	96	Very high	96.1	Very high	78 Å²	78	33.2 Å²	33.2	42%	0.417	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.1	179.5	-81.1	-31.8	0	0	0	113.3	R16 E17 Q18 R19 G206	R16-D204 IonicContact CZ-OD1 2.76Å; R16-D204 IonicContact NE-OD1 3.62Å; R16-D204 PolarHBondContact NE-OD1 2.78Å; R16-D204 IonicContact NH2-OD1 3.96Å; R16-D204 PolarHBondContact NH2-OD1 3.01Å; E17-D204 PolarHBondContact O-N 2.89Å; Q18-D204 WeakPolarHBondContact CA-OD2 3.42Å; R19-D204 PolarHBondContact N-OD2 2.8Å; R19-D204 PolarHBondContact O-N 3.47Å; D204-G206 VanDerWaalsContact C-N 3.34Å
205	D	96.7	Very high	96	Very high	51 Å²	51	36.8 Å²	36.8	27%	0.273	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	11	175	65.5	-27.4	0	0	0	113.7	S20 F21 R74 T203	S20-D205 VanDerWaalsContact CA-OD1 3.31Å; S20-D205 WeakPolarHBondContact CA-OD1 3.42Å; F21-D205 PolarHBondContact N-OD1 2.85Å; F21-D205 PolarHBondContact N-OD2 3.09Å; R74-D205 IonicContact NH2-OD2 3.19Å; T203-D205 WeakPolarHBondContact CB-OD1 3.25Å; T203-D205 PolarHBondContact O-N 3.49Å; T203-D205 PolarHBondContact OG1-OD1 3.34Å
206	G	97	Very high	95.5	Very high	4 Å²	4	35.9 Å²	35.9	4%	0.041	19%	0.187	C	C	.	.	S	Bend	trans	88	19	168.4	0	0	0	0	0	115.7	A147 Q148 T203 D204	A147-G206 CarbonylContact C-O 3.6Å; A147-G206 VanDerWaalsContact CA-O 3.29Å; A147-G206 WeakPolarHBondContact CA-O 3.29Å; A147-G206 WeakPolarHBondContact CB-O 3Å; A147-G206 PolarHBondContact N-O 3.1Å; Q148-G206 PolarHBondContact N-O 3.01Å; T203-G206 PolarHBondContact O-N 3.07Å; D204-G206 VanDerWaalsContact C-N 3.34Å
207	V	97.9	Very high	94.9	Very high	4 Å²	4	35 Å²	35	2%	0.024	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	109.1	173.1	-177	0	0	0	0	109	F21 M77 R144 M202 T203	F21-V207 HydrophobicContact CB-CB 4.07Å; F21-V207 HydrophobicContact CB-CG2 3.66Å; F21-V207 HydrophobicContact CD1-CG2 4.4Å; F21-V207 HydrophobicContact CD2-CB 4.49Å; F21-V207 HydrophobicContact CD2-CG1 4.1Å; F21-V207 HydrophobicContact CG-CB 4.31Å; F21-V207 HydrophobicContact CG-CG1 4.24Å; F21-V207 HydrophobicContact CG-CG2 3.99Å; M77-V207 HydrophobicContact CE-CB 4.38Å; M77-V207 HydrophobicContact CE-CG1 3.66Å; M77-V207 HydrophobicContact CE-CG2 3.73Å; M77-V207 HydrophobicContact SD-CG1 4.1Å; M77-V207 HydrophobicContact SD-CG2 3.97Å; R144-V207 HydrophobicContact CB-CG1 4.15Å; R144-V207 HydrophobicContact CG-CG1 4.31Å; M202-V207 WeakPolarHBondContact CA-O 3.43Å; T203-V207 HydrophobicContact CG2-CB 4.43Å; T203-V207 PolarHBondContact N-O 2.81Å; T203-V207 VanDerWaalsContact OG1-CB 3.31Å; T203-V207 WeakPolarHBondContact OG1-CB 3.49Å; T203-V207 PolarHBondContact OG1-N 3.33Å; T203-V207 PolarHBondContact OG1-O 2.73Å
208	L	98.4	Very high	93.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.4	171	-173.7	79	0	0	0	108.3	V14 R144 F145 A147 I155 V157 V166 C200 R201 M202	V14-L208 HydrophobicContact CB-CD1 4.47Å; V14-L208 HydrophobicContact CG1-CD1 3.47Å; V14-L208 VanDerWaalsContact CG1-CD1 3.47Å; V14-L208 HydrophobicContact CG2-CD1 4.17Å; R144-L208 CarbonylContact C-O 3.58Å; R144-L208 WeakPolarHBondContact CA-O 3.29Å; F145-L208 HydrophobicContact CB-CB 4.21Å; F145-L208 HydrophobicContact CB-CD2 4.49Å; F145-L208 HydrophobicContact CD2-CD2 4.13Å; F145-L208 HydrophobicContact CG-CD2 4.48Å; F145-L208 PolarHBondContact N-O 3.36Å; F145-L208 PolarHBondContact O-N 3.24Å; A147-L208 HydrophobicContact CB-CB 4.03Å; I155-L208 HydrophobicContact CD1-CD1 4.43Å; I155-L208 HydrophobicContact CG2-CD2 4.06Å; V157-L208 HydrophobicContact CG2-CD2 4.08Å; V166-L208 HydrophobicContact CB-CD2 4.5Å; V166-L208 HydrophobicContact CG1-CD2 3.53Å; V166-L208 HydrophobicContact CG2-CD2 4.12Å; C200-L208 WeakPolarHBondContact SG-CD1 3.41Å; R201-L208 CarbonylContact O-C 3.53Å; R201-L208 WeakPolarHBondContact O-CA 3.29Å; M202-L208 HydrophobicContact CB-CD1 3.97Å; M202-L208 HydrophobicContact CG-CD1 4.37Å
209	M	97.8	Very high	92.4	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.3	-179.7	-173	-177.3	-51.3	0	0	110.1	F21 K142 V143 R144 C200 R201	F21-M209 HydrophobicContact CD2-CE 3.97Å; F21-M209 HydrophobicContact CE2-CE 3.68Å; K142-M209 HydrophobicContact CD-SD 4.44Å; V143-M209 WeakPolarHBondContact O-CA 3.32Å; R144-M209 HydrophobicContact CG-CB 4.39Å; R144-M209 HydrophobicContact CG-CE 4.1Å; R144-M209 HydrophobicContact CG-CG 4.05Å; C200-M209 WeakPolarHBondContact CA-O 3.2Å; R201-M209 HydrophobicContact CG-CB 3.83Å; R201-M209 PolarHBondContact N-O 2.89Å; R201-M209 PolarHBondContact NH1-SD 3.42Å; R201-M209 PolarHBondContact O-N 3.42Å
210	L	97.6	Very high	91.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.9	172.8	-172.5	78.4	0	0	0	108.5	I12 K142 V143 F145 V157 V164 L198 K199 C200	I12-L210 HydrophobicContact CD1-CD1 4.1Å; I12-L210 HydrophobicContact CG2-CD1 4.44Å; K142-L210 WeakPolarHBondContact CA-O 3.37Å; V143-L210 HydrophobicContact CG2-CB 3.84Å; V143-L210 HydrophobicContact CG2-CD2 4.1Å; V143-L210 PolarHBondContact N-O 3.1Å; V143-L210 PolarHBondContact O-N 3.3Å; F145-L210 HydrophobicContact CE2-CB 4.41Å; V157-L210 HydrophobicContact CG1-CD1 4.22Å; V164-L210 HydrophobicContact CB-CD2 3.94Å; V164-L210 HydrophobicContact CG1-CD2 3.72Å; V164-L210 HydrophobicContact CG2-CD2 3.64Å; L198-L210 HydrophobicContact CB-CD1 4.37Å; L198-L210 HydrophobicContact CD2-CD1 4.21Å; L198-L210 HydrophobicContact CD2-CD2 3.85Å; L198-L210 HydrophobicContact CD2-CG 3.8Å; K199-L210 WeakPolarHBondContact O-CA 3.41Å; C200-L210 HydrophobicContact CB-CD1 4.02Å
211	E	97.4	Very high	91.3	Very high	29 Å²	29	35.9 Å²	35.9	14%	0.136	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.2	180	69.5	174.2	-169.1	0	0	113.2	F141 K142 L198 K199 R201	F141-E211 CarbonylContact O-C 3.55Å; F141-E211 WeakPolarHBondContact O-CA 3.29Å; F141-E211 WeakPolarHBondContact O-CB 3.29Å; K142-E211 WeakPolarHBondContact CE-OE2 3.31Å; K142-E211 HydrophobicContact CG-CB 3.92Å; L198-E211 CarbonylContact C-O 3.58Å; L198-E211 WeakPolarHBondContact CA-O 3.33Å; K199-E211 HydrophobicContact CB-CG 4.17Å; K199-E211 PolarHBondContact N-O 2.87Å; K199-E211 PolarHBondContact O-N 3.5Å; R201-E211 VanDerWaalsContact CZ-CD 3.43Å; R201-E211 IonicContact CZ-OE1 3.74Å; R201-E211 IonicContact CZ-OE2 2.83Å; R201-E211 IonicContact NH1-OE1 3.43Å; R201-E211 IonicContact NH1-OE2 2.7Å; R201-E211 PolarHBondContact NH1-OE2 3.36Å; R201-E211 IonicContact NH2-OE1 3.71Å; R201-E211 PolarHBondContact NH2-OE1 3.07Å; R201-E211 IonicContact NH2-OE2 3.61Å; R201-E211 PolarHBondContact NH2-OE2 3.36Å
212	A	96.8	Very high	91.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	152.8	171.3	0	0	0	0	0	110.8	F141 I193 L198	F141-A212 PolarHBondContact N-O 2.65Å; F141-A212 PolarHBondContact O-N 3.19Å; I193-A212 HydrophobicContact CG2-CB 3.42Å; I193-A212 VanDerWaalsContact CG2-CB 3.42Å; L198-A212 HydrophobicContact CD2-CB 3.62Å; L198-A212 HydrophobicContact CG-CB 4.07Å
213	P	94.7	Very high	90.8	Very high	34 Å²	34	34.4 Å²	34.4	22%	0.221	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	157.4	168.6	27.1	-29.3	0	0	0	110.7	D194 Q197	D194-P213 HydrophobicContact CB-CG 4.15Å; D194-P213 PolarHBondContact N-O 3.11Å; Q197-P213 HydrophobicContact CB-CG 3.92Å; Q197-P213 HydrophobicContact CG-CG 4.48Å
214	V	94.1	Very high	90.6	Very high	21 Å²	21	35 Å²	35	13%	0.127	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-104.5	144.7	178	-61.3	0	0	0	0	111.6	Y131 V139 F141 S192 V216 L329	Y131-V214 HydrophobicContact CD1-CG1 3.84Å; Y131-V214 HydrophobicContact CE1-CG1 3.68Å; V139-V214 HydrophobicContact CB-CG2 4.16Å; V139-V214 HydrophobicContact CG1-CG2 4.07Å; V139-V214 WeakPolarHBondContact O-CG2 3.34Å; F141-V214 HydrophobicContact CB-CG1 4.1Å; S192-V214 CarbonylContact O-C 3.55Å; S192-V214 VanDerWaalsContact O-CA 3.31Å; S192-V214 WeakPolarHBondContact O-CA 3.37Å; S192-V214 WeakPolarHBondContact O-CB 3.02Å; V214-V216 HydrophobicContact CB-CG2 4.39Å; V214-V216 HydrophobicContact CG2-CG2 3.5Å; V214-V216 VanDerWaalsContact CG2-CG2 3.5Å; V214-V216 PolarHBondContact O-N 3.12Å; V214-L329 HydrophobicContact CB-CD1 3.6Å; V214-L329 HydrophobicContact CG1-CD1 3.69Å; V214-L329 HydrophobicContact CG2-CD1 3.73Å
215	K	90	Very high	90.3	Very high	107 Å²	107	33.1 Å²	33.1	47%	0.465	17%	0.17	S	C	.	.			trans	-82.4	88.6	170.9	-63.1	164.7	178.5	151.2	0	108	S192 I193 D194 D195	S192-K215 PolarHBondContact O-N 3.06Å; I193-K215 VanDerWaalsContact O-CE 3.3Å; I193-K215 WeakPolarHBondContact O-CE 3.34Å; I193-K215 PolarHBondContact O-NZ 3.15Å; D194-K215 HydrophobicContact CB-CG 4.31Å; D195-K215 IonicContact OD1-NZ 3.18Å
216	V	80.8	Confident	89.7	Confident	40 Å²	40	36.3 Å²	36.3	24%	0.242	18%	0.184	C	C	.	.			trans	-88	127.6	175.1	-168.3	0	0	0	0	109.4	Y47 V214 Q220 L222	Y47-V216 HydrophobicContact CD1-CG1 3.88Å; Y47-V216 HydrophobicContact CE1-CB 3.87Å; Y47-V216 HydrophobicContact CE1-CG1 3.71Å; Y47-V216 HydrophobicContact CE1-CG2 3.57Å; V214-V216 HydrophobicContact CB-CG2 4.39Å; V214-V216 HydrophobicContact CG2-CG2 3.5Å; V214-V216 VanDerWaalsContact CG2-CG2 3.5Å; V214-V216 PolarHBondContact O-N 3.12Å; V216-Q220 HydrophobicContact CG1-CB 3.81Å; V216-L222 HydrophobicContact CG1-CD1 4.09Å; V216-L222 HydrophobicContact CG1-CG 4.44Å; V216-L222 HydrophobicContact CG2-CD1 4.13Å
217	D	77.3	Confident	89.2	Confident	79 Å²	79	37.6 Å²	37.6	42%	0.422	19%	0.192	S	C	.	.			trans	-64.5	139.1	170.1	-169.9	-24.4	0	0	0	109	N219 Q220	D217-N219 PolarHBondContact O-N 3.46Å; D217-N219 PolarHBondContact OD1-N 2.84Å; D217-N219 VanDerWaalsContact OD1-N 3.1Å; D217-Q220 WeakPolarHBondContact O-CB 3.45Å; D217-Q220 PolarHBondContact O-N 3.3Å
218	Q	68.8	Low	88.8	Confident	193 Å²	193	37.9 Å²	37.9	90%	0.902	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-24	176.2	-64.7	-178.8	0	0	0	112.4	Q220	Q218-Q220 VanDerWaalsContact C-N 3.32Å
219	N	71	Confident	88.5	Confident	42 Å²	42	39.3 Å²	39.3	23%	0.225	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	7.1	178.6	-68.1	-26.5	0	0	0	113.7	D217 K235 Q247	D217-N219 PolarHBondContact O-N 3.46Å; D217-N219 PolarHBondContact OD1-N 2.84Å; D217-N219 VanDerWaalsContact OD1-N 3.1Å; N219-K235 WeakPolarHBondContact O-CE 3.38Å; N219-K235 PolarHBondContact O-NZ 3.28Å; N219-Q247 PolarHBondContact ND2-OE1 3.28Å
220	Q	81.6	Confident	88.2	Confident	19 Å²	19	39.7 Å²	39.7	9%	0.089	20%	0.204	C	C	.	.			trans	-102.2	122.8	-176.6	-146.3	169	57.9	0	0	111.7	V216 D217 Q218 L222 L329 V331	V216-Q220 HydrophobicContact CG1-CB 3.81Å; D217-Q220 WeakPolarHBondContact O-CB 3.45Å; D217-Q220 PolarHBondContact O-N 3.3Å; Q218-Q220 VanDerWaalsContact C-N 3.32Å; Q220-L222 HydrophobicContact CG-CD2 4Å; Q220-L329 PolarHBondContact NE2-O 2.68Å; Q220-L329 PolarHBondContact OE1-O 2.78Å; Q220-V331 PolarHBondContact NE2-O 2.85Å
221	S	89.9	Confident	88.1	Confident	10 Å²	10	39.7 Å²	39.7	7%	0.07	20%	0.204	C	C	.	.			trans	-98.6	102	175.2	-64	0	0	0	0	109.1	R233	S221-R233 PolarHBondContact O-N 2.89Å
222	L	92.8	Very high	88	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	147.9	175.2	-52.3	-178.3	0	0	0	111.3	Y47 V139 V216 Q220 V230 A231 V232 L329	Y47-L222 HydrophobicContact CD1-CB 4.23Å; Y47-L222 HydrophobicContact CD1-CD1 3.8Å; Y47-L222 HydrophobicContact CD1-CG 3.98Å; Y47-L222 HydrophobicContact CD2-CB 3.91Å; Y47-L222 HydrophobicContact CD2-CD1 4.18Å; Y47-L222 HydrophobicContact CD2-CG 4.43Å; Y47-L222 HydrophobicContact CE1-CD1 3.76Å; Y47-L222 HydrophobicContact CE1-CG 4.45Å; Y47-L222 HydrophobicContact CE2-CD1 4.15Å; Y47-L222 HydrophobicContact CG-CB 3.72Å; Y47-L222 HydrophobicContact CG-CD1 4.04Å; Y47-L222 HydrophobicContact CG-CG 4Å; V139-L222 HydrophobicContact CB-CD1 4.42Å; V139-L222 HydrophobicContact CG2-CD1 4.07Å; V216-L222 HydrophobicContact CG1-CD1 4.09Å; V216-L222 HydrophobicContact CG1-CG 4.44Å; V216-L222 HydrophobicContact CG2-CD1 4.13Å; Q220-L222 HydrophobicContact CG-CD2 4Å; L222-V230 HydrophobicContact CB-CG1 4.47Å; L222-V230 HydrophobicContact CD1-CG1 4.44Å; L222-V230 HydrophobicContact CD2-CG1 4.27Å; L222-A231 WeakPolarHBondContact CA-O 3.46Å; L222-V232 HydrophobicContact CD2-CG2 4.19Å; L222-L329 HydrophobicContact CD1-CD2 3.74Å; L222-L329 HydrophobicContact CD2-CD2 3.66Å; L222-L329 HydrophobicContact CG-CD2 4.38Å
223	T	93	Very high	87.9	Confident	4 Å²	4	40 Å²	40	3%	0.025	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	179.1	173.8	-175.4	0	0	0	0	108.6	A231 R233 F285	T223-A231 HydrophobicContact CG2-CB 3.91Å; T223-A231 PolarHBondContact N-O 3.01Å; T223-A231 PolarHBondContact O-N 3.4Å; T223-R233 HydrophobicContact CG2-CB 4.2Å; T223-F285 HydrophobicContact CG2-CD1 3.49Å; T223-F285 VanDerWaalsContact CG2-CD1 3.49Å; T223-F285 HydrophobicContact CG2-CE1 3.84Å
224	L	92.8	Very high	87.9	Confident	16 Å²	16	38.3 Å²	38.3	8%	0.084	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.3	172.9	-57.2	175	0	0	0	109.3	W51 T54 W58 V133 Q229 V230	W51-L224 HydrophobicContact CH2-CD1 4.42Å; W51-L224 HydrophobicContact CH2-CD2 4.18Å; W51-L224 HydrophobicContact CH2-CG 4.14Å; W51-L224 HydrophobicContact CZ3-CD2 4.48Å; W51-L224 HydrophobicContact CZ3-CG 4.13Å; T54-L224 HydrophobicContact CG2-CB 3.92Å; T54-L224 HydrophobicContact CG2-CD1 4.24Å; T54-L224 HydrophobicContact CG2-CG 4Å; W58-L224 HydrophobicContact CB-CD1 3.47Å; W58-L224 VanDerWaalsContact CB-CD1 3.47Å; W58-L224 HydrophobicContact CD2-CD1 4.08Å; W58-L224 HydrophobicContact CG-CD1 3.5Å; W58-L224 VanDerWaalsContact CG-CD1 3.5Å; V133-L224 HydrophobicContact CG2-CD1 3.95Å; L224-Q229 WeakPolarHBondContact CA-O 3.37Å; L224-V230 HydrophobicContact CD2-CG2 3.87Å
225	N	89.3	Confident	87.9	Confident	37 Å²	37	38.1 Å²	38.1	20%	0.198	19%	0.192	C	C	.	.			trans	-83.6	-178	171.3	71	7	0	0	0	111	S227 G228 Q229 N287	N225-S227 PolarHBondContact ND2-OG 2.91Å; N225-S227 PolarHBondContact O-N 2.79Å; N225-S227 PolarHBondContact OD1-N 2.8Å; N225-S227 PolarHBondContact OD1-OG 3.22Å; N225-G228 PolarHBondContact O-N 2.97Å; N225-G228 PolarHBondContact OD1-N 2.99Å; N225-Q229 PolarHBondContact N-O 2.78Å; N225-Q229 PolarHBondContact ND2-OE1 2.95Å; N225-Q229 PolarHBondContact OD1-N 3.28Å; N225-Q229 PolarHBondContact OD1-O 2.91Å; N225-N287 PolarHBondContact ND2-ND2 2.9Å
226	E	85.1	Confident	87.9	Confident	119 Å²	119	34.5 Å²	34.5	56%	0.556	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.1	-178.8	-55	-167.8	154.6	0	0	114.9	R65 G228 R298	R65-E226 PolarHBondContact NH1-O 2.93Å; R65-E226 VanDerWaalsContact NH1-O 3.1Å; E226-G228 VanDerWaalsContact C-N 3.35Å; E226-R298 IonicContact OE1-CZ 3.31Å; E226-R298 VanDerWaalsContact OE1-CZ 3.31Å; E226-R298 IonicContact OE1-NE 3.77Å; E226-R298 IonicContact OE1-NH1 2.62Å; E226-R298 PolarHBondContact OE1-NH1 2.84Å; E226-R298 IonicContact OE2-NH1 3.78Å
227	S	85.7	Confident	88.3	Confident	31 Å²	31	37.1 Å²	37.1	22%	0.217	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-3.7	172.7	68.1	0	0	0	0	112.2	R72 N225 Q229	R72-S227 PolarHBondContact NH1-O 3.47Å; R72-S227 PolarHBondContact NH2-O 2.91Å; N225-S227 PolarHBondContact ND2-OG 2.91Å; N225-S227 PolarHBondContact O-N 2.79Å; N225-S227 PolarHBondContact OD1-N 2.8Å; N225-S227 PolarHBondContact OD1-OG 3.22Å; S227-Q229 VanDerWaalsContact C-N 3.35Å; S227-Q229 WeakPolarHBondContact OG-CG 3.46Å; S227-Q229 PolarHBondContact OG-OE1 2.57Å
228	G	89.5	Confident	88.7	Confident	9 Å²	9	39 Å²	39	9%	0.093	20%	0.202	C	C	.	.	S	Bend	trans	78.9	16.5	-177.7	0	0	0	0	0	114.4	W58 N225 E226	W58-G228 VanDerWaalsContact CD1-CA 3.42Å; N225-G228 PolarHBondContact O-N 2.97Å; N225-G228 PolarHBondContact OD1-N 2.99Å; E226-G228 VanDerWaalsContact C-N 3.35Å
229	Q	91.6	Very high	89.7	Confident	31 Å²	31	33.8 Å²	33.8	15%	0.145	18%	0.178	C	C	.	.			trans	-86.6	148	173	-63.9	168.9	-47.5	0	0	110.1	D129 L224 N225 S227 A231	D129-Q229 PolarHBondContact OD1-NE2 3.25Å; L224-Q229 WeakPolarHBondContact CA-O 3.37Å; N225-Q229 PolarHBondContact N-O 2.78Å; N225-Q229 PolarHBondContact ND2-OE1 2.95Å; N225-Q229 PolarHBondContact OD1-N 3.28Å; N225-Q229 PolarHBondContact OD1-O 2.91Å; S227-Q229 VanDerWaalsContact C-N 3.35Å; S227-Q229 WeakPolarHBondContact OG-CG 3.46Å; S227-Q229 PolarHBondContact OG-OE1 2.57Å; Q229-A231 PolarHBondContact O-N 3.04Å
230	V	93.4	Very high	90.6	Very high	10 Å²	10	33.3 Å²	33.3	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	133	177.5	177.3	0	0	0	0	110.5	Y131 V139 L222 L224 N287 L329	Y131-V230 WeakPolarHBondContact O-CG2 3.4Å; V139-V230 HydrophobicContact CG1-CG2 3.98Å; V139-V230 HydrophobicContact CG2-CG2 3.83Å; L222-V230 HydrophobicContact CB-CG1 4.47Å; L222-V230 HydrophobicContact CD1-CG1 4.44Å; L222-V230 HydrophobicContact CD2-CG1 4.27Å; L224-V230 HydrophobicContact CD2-CG2 3.87Å; V230-N287 PolarHBondContact O-ND2 3.17Å; V230-L329 HydrophobicContact CG1-CD2 3.96Å
231	A	94.4	Very high	90.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	156.5	176.5	0	0	0	0	0	109.9	L222 T223 Q229 F285 V286 N287	L222-A231 WeakPolarHBondContact CA-O 3.46Å; T223-A231 HydrophobicContact CG2-CB 3.91Å; T223-A231 PolarHBondContact N-O 3.01Å; T223-A231 PolarHBondContact O-N 3.4Å; Q229-A231 PolarHBondContact O-N 3.04Å; A231-F285 HydrophobicContact CB-CB 4.28Å; A231-V286 CarbonylContact C-O 3.47Å; A231-V286 WeakPolarHBondContact CA-O 3.09Å; A231-N287 WeakPolarHBondContact CB-ND2 3.35Å
232	V	94.7	Very high	90.8	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.2	170.6	178	0	0	0	0	109.1	L222 V286 V331 A333	L222-V232 HydrophobicContact CD2-CG2 4.19Å; V232-V286 HydrophobicContact CB-CB 4.35Å; V232-V286 PolarHBondContact N-O 3.1Å; V232-V286 PolarHBondContact O-N 3.3Å; V232-V331 HydrophobicContact CG2-CB 4.1Å; V232-V331 HydrophobicContact CG2-CG1 4.49Å; V232-A333 HydrophobicContact CG1-CB 4.14Å
233	R	94.9	Very high	90.5	Very high	29 Å²	29	44.1 Å²	44.1	11%	0.109	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-84.2	125	169	-174.6	179	-70.7	163.2	3.5	108.8	D50 S221 T223 P281	D50-R233 VanDerWaalsContact CG-NH1 3.34Å; D50-R233 IonicContact OD1-CZ 3.78Å; D50-R233 IonicContact OD1-NH1 2.8Å; D50-R233 PolarHBondContact OD1-NH1 2.77Å; D50-R233 IonicContact OD1-NH2 3.98Å; D50-R233 PolarHBondContact OD1-NH2 2.75Å; D50-R233 IonicContact OD2-CZ 3.54Å; D50-R233 IonicContact OD2-NH1 2.85Å; D50-R233 PolarHBondContact OD2-NH1 3.21Å; D50-R233 IonicContact OD2-NH2 3.37Å; D50-R233 PolarHBondContact OD2-NH2 2.62Å; S221-R233 PolarHBondContact O-N 2.89Å; T223-R233 HydrophobicContact CG2-CB 4.2Å; R233-P281 WeakPolarHBondContact CG-O 3.42Å
234	P	95.5	Very high	90.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-59.3	143.2	174.9	-23.5	34.3	0	0	0	112	L284 V286 A333 V335 L340	P234-L284 VanDerWaalsContact CD-O 3.25Å; P234-L284 WeakPolarHBondContact CD-O 3.15Å; P234-L284 HydrophobicContact CG-CB 3.84Å; P234-V286 HydrophobicContact CG-CG2 4.41Å; P234-A333 WeakPolarHBondContact CA-O 3.32Å; P234-A333 HydrophobicContact CB-CB 4.1Å; P234-A333 HydrophobicContact CG-CB 4.11Å; P234-V335 HydrophobicContact CB-CG2 3.9Å; P234-L340 HydrophobicContact CB-CD1 4.37Å; P234-L340 HydrophobicContact CG-CD1 3.52Å; P234-L340 HydrophobicContact CG-CG 4.14Å
235	K	93.1	Very high	90.1	Very high	17 Å²	17	50.7 Å²	50.7	7%	0.074	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-68.2	141.5	173.1	-63.6	-172.4	176.3	87.3	0	111.4	N219 Q239 I240 V243 A333 Q334 V335	N219-K235 WeakPolarHBondContact O-CE 3.38Å; N219-K235 PolarHBondContact O-NZ 3.28Å; K235-Q239 HydrophobicContact CB-CB 4.01Å; K235-Q239 HydrophobicContact CD-CB 4.38Å; K235-Q239 HydrophobicContact CG-CB 4.34Å; K235-I240 HydrophobicContact CB-CG1 3.82Å; K235-V243 HydrophobicContact CD-CG2 3.46Å; K235-V243 VanDerWaalsContact CD-CG2 3.46Å; K235-V243 VanDerWaalsContact CE-CG2 3.43Å; K235-A333 PolarHBondContact N-O 2.68Å; K235-Q334 HydrophobicContact CB-CG 4.18Å; K235-Q334 HydrophobicContact CD-CG 4.41Å; K235-Q334 HydrophobicContact CG-CG 4.46Å; K235-V335 PolarHBondContact O-N 2.66Å
236	S	90.3	Very high	90	Very high	30 Å²	30	54.3 Å²	54.3	21%	0.21	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-77.5	162.1	167	64	0	0	0	0	112.4	N238 Q239 I240	S236-N238 PolarHBondContact O-N 2.79Å; S236-N238 VanDerWaalsContact O-N 3.08Å; S236-Q239 PolarHBondContact O-N 3Å; S236-Q239 PolarHBondContact OG-OE1 3Å; S236-Q239 VanDerWaalsContact OG-OE1 3.09Å; S236-I240 VanDerWaalsContact O-CG1 3.32Å; S236-I240 WeakPolarHBondContact O-CG1 3.29Å; S236-I240 PolarHBondContact O-N 2.87Å
237	D	88.9	Confident	90	Very high	96 Å²	96	52.6 Å²	52.6	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-48.8	-38	174.9	-72.8	-13.6	0	0	0	113.5	K241	D237-K241 WeakPolarHBondContact O-CG 3.39Å; D237-K241 PolarHBondContact O-N 2.78Å
238	N	87.2	Confident	90.2	Very high	118 Å²	118	52.7 Å²	52.7	63%	0.631	31%	0.312	S	S	*	.	H	α-helix	trans	-71.5	-36.6	179.4	-74.2	-24.3	0	0	0	112.5	S236 K241	S236-N238 PolarHBondContact O-N 2.79Å; S236-N238 VanDerWaalsContact O-N 3.08Å; N238-K241 PolarHBondContact OD1-NZ 2.7Å
239	Q	89.4	Confident	90.4	Very high	83 Å²	83	53 Å²	53	39%	0.388	31%	0.311	S	S	.	.	H	α-helix	trans	-73.1	-35.1	176.1	-70.3	167.9	-46.3	0	0	111.5	K235 S236 K241 A242	K235-Q239 HydrophobicContact CB-CB 4.01Å; K235-Q239 HydrophobicContact CD-CB 4.38Å; K235-Q239 HydrophobicContact CG-CB 4.34Å; S236-Q239 PolarHBondContact O-N 3Å; S236-Q239 PolarHBondContact OG-OE1 3Å; S236-Q239 VanDerWaalsContact OG-OE1 3.09Å; Q239-K241 PolarHBondContact O-N 2.94Å; Q239-A242 PolarHBondContact O-N 2.91Å; Q239-A242 VanDerWaalsContact O-N 3.1Å
240	I	89.6	Confident	90.4	Very high	33 Å²	33	56.3 Å²	56.3	17%	0.169	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-35.1	177.8	-65.4	165.7	0	0	0	111.2	K235 S236 A242 V243 Q334 V335	K235-I240 HydrophobicContact CB-CG1 3.82Å; S236-I240 VanDerWaalsContact O-CG1 3.32Å; S236-I240 WeakPolarHBondContact O-CG1 3.29Å; S236-I240 PolarHBondContact O-N 2.87Å; I240-A242 PolarHBondContact O-N 2.91Å; I240-A242 VanDerWaalsContact O-N 3.14Å; I240-V243 WeakPolarHBondContact O-CB 3.07Å; I240-V243 PolarHBondContact O-N 2.95Å; I240-Q334 HydrophobicContact CD1-CB 3.81Å; I240-Q334 HydrophobicContact CD1-CG 4.35Å; I240-Q334 HydrophobicContact CG1-CB 4.19Å; I240-Q334 HydrophobicContact CG1-CG 4.17Å; I240-V335 VanDerWaalsContact CD1-O 3.25Å; I240-V335 WeakPolarHBondContact CD1-O 3.39Å
241	K	88.8	Confident	90.4	Very high	162 Å²	162	57.6 Å²	57.6	70%	0.704	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-25.5	176.7	-68.7	167.3	-170.3	165.8	0	113.9	D237 N238 Q239	D237-K241 WeakPolarHBondContact O-CG 3.39Å; D237-K241 PolarHBondContact O-N 2.78Å; N238-K241 PolarHBondContact OD1-NZ 2.7Å; Q239-K241 PolarHBondContact O-N 2.94Å
242	A	87.4	Confident	90.3	Very high	80 Å²	80	63 Å²	63	66%	0.661	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-11	176.9	0	0	0	0	0	112.9	Q239 I240	Q239-A242 PolarHBondContact O-N 2.91Å; Q239-A242 VanDerWaalsContact O-N 3.1Å; I240-A242 PolarHBondContact O-N 2.91Å; I240-A242 VanDerWaalsContact O-N 3.14Å
243	V	86.8	Confident	90.3	Very high	13 Å²	13	65.4 Å²	65.4	8%	0.079	39%	0.394	C	S	.	.	S	Bend	trans	-78	130.7	179.5	-178.2	0	0	0	0	109.4	K235 I240 A245 Q247 A248	K235-V243 HydrophobicContact CD-CG2 3.46Å; K235-V243 VanDerWaalsContact CD-CG2 3.46Å; K235-V243 VanDerWaalsContact CE-CG2 3.43Å; I240-V243 WeakPolarHBondContact O-CB 3.07Å; I240-V243 PolarHBondContact O-N 2.95Å; V243-A245 PolarHBondContact O-N 3.04Å; V243-Q247 HydrophobicContact CG1-CB 3.68Å; V243-A248 HydrophobicContact CG1-CB 4.47Å
244	P	89.6	Confident	90.1	Very high	62 Å²	62	67.8 Å²	67.8	40%	0.403	41%	0.412	S	S	.	.			trans	-54.6	140	172.2	-25.2	34.3	0	0	0	111.4	S246 Q247 A248	P244-S246 PolarHBondContact O-N 3.21Å; P244-Q247 PolarHBondContact O-N 2.82Å; P244-A248 PolarHBondContact O-N 3.32Å; P244-A248 VanDerWaalsContact O-N 3.15Å
245	A	87.6	Confident	90.1	Very high	96 Å²	96	73.9 Å²	73.9	79%	0.793	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.6	-177.2	0	0	0	0	0	113.8	V243 Q247	V243-A245 PolarHBondContact O-N 3.04Å; A245-Q247 PolarHBondContact O-N 3.31Å
246	S	85.9	Confident	90.2	Very high	114 Å²	114	73.7 Å²	73.7	80%	0.797	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.7	175	54.5	0	0	0	0	114.7	P244	P244-S246 PolarHBondContact O-N 3.21Å
247	Q	85.4	Confident	90.4	Very high	82 Å²	82	74.7 Å²	74.7	38%	0.383	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-9.1	179.8	-63.3	-178.5	-6.3	0	0	112.9	N219 V243 P244 A245 Q334	N219-Q247 PolarHBondContact ND2-OE1 3.28Å; V243-Q247 HydrophobicContact CG1-CB 3.68Å; P244-Q247 PolarHBondContact O-N 2.82Å; A245-Q247 PolarHBondContact O-N 3.31Å; Q247-Q334 PolarHBondContact O-NE2 3.03Å
248	A	90.2	Very high	90.7	Very high	34 Å²	34	71.3 Å²	71.3	28%	0.281	43%	0.43	S	S	.	.			trans	-68.3	135.3	177	0	0	0	0	0	110.2	V243 P244	V243-A248 HydrophobicContact CG1-CB 4.47Å; P244-A248 PolarHBondContact O-N 3.32Å; P244-A248 VanDerWaalsContact O-N 3.15Å
249	L	93.5	Very high	90.9	Very high	15 Å²	15	70.4 Å²	70.4	8%	0.079	42%	0.418	C	S	.	.			trans	-87.1	144.5	178.7	-59.8	-175.6	0	0	0	109.5	S332 Q334 V341 E343	L249-S332 WeakPolarHBondContact CD1-O 3.44Å; L249-Q334 HydrophobicContact CB-CB 4.4Å; L249-Q334 HydrophobicContact CB-CG 4.28Å; L249-Q334 HydrophobicContact CD1-CB 4.45Å; L249-Q334 HydrophobicContact CD1-CG 4.12Å; L249-Q334 HydrophobicContact CG-CG 4.14Å; L249-V341 HydrophobicContact CB-CB 4.25Å; L249-V341 HydrophobicContact CB-CG1 3.92Å; L249-V341 HydrophobicContact CD1-CG1 4.28Å; L249-V341 WeakPolarHBondContact CD1-O 3.28Å; L249-E343 HydrophobicContact CD2-CB 3.96Å; L249-E343 HydrophobicContact CD2-CG 3.89Å
250	V	91.8	Very high	91	Very high	101 Å²	101	67.3 Å²	67.3	61%	0.612	41%	0.405	S	S	*	.			trans	-119.9	127.5	179.8	-178.7	0	0	0	0	108.7	K252 H270	V250-K252 PolarHBondContact O-N 2.91Å; V250-H270 PolarHBondContact O-CE1 3.21Å
251	A	93.2	Very high	90.9	Very high	36 Å²	36	71.3 Å²	71.3	30%	0.298	43%	0.427	S	S	.	.			trans	-67.3	123.3	169.3	0	0	0	0	0	109.2	T339 V341	A251-T339 HydrophobicContact CB-CG2 4.46Å; A251-V341 HydrophobicContact CB-CG2 3.81Å
252	K	93.1	Very high	90.5	Very high	114 Å²	114	66.5 Å²	66.5	50%	0.496	41%	0.409	S	S	.	.			trans	-93.6	-9	-179.8	-54	-174.5	-174	-166.4	0	111.8	V250 V254 V260 E272 E343	V250-K252 PolarHBondContact O-N 2.91Å; K252-V254 VanDerWaalsContact C-N 3.34Å; K252-V260 HydrophobicContact CD-CG1 4.35Å; K252-E272 VanDerWaalsContact CA-OE1 3.26Å; K252-E272 WeakPolarHBondContact CA-OE1 3.42Å; K252-E272 WeakPolarHBondContact CB-OE1 3.46Å; K252-E272 PolarHBondContact N-OE1 3.13Å; K252-E343 IonicContact NZ-OE1 2.66Å
253	G	93.4	Very high	90.1	Very high	58 Å²	58	66.2 Å²	66.2	60%	0.598	41%	0.413	S	S	*	.	S	Bend	trans	80.3	16.6	-177.8	0	0	0	0	0	113	E272	G253-E272 PolarHBondContact N-OE1 2.93Å; G253-E272 PolarHBondContact N-OE2 2.79Å; G253-E272 VanDerWaalsContact N-OE2 3.13Å
254	V	92.5	Very high	89.7	Confident	80 Å²	80	70.3 Å²	70.3	49%	0.485	44%	0.443	S	S	.	.			trans	-107.5	90.9	178.9	-176.3	0	0	0	0	108.5	K252 E272	K252-V254 VanDerWaalsContact C-N 3.34Å; V254-E272 PolarHBondContact N-OE1 3.33Å
255	H	93.9	Very high	88.9	Confident	127 Å²	127	70 Å²	70	59%	0.588	45%	0.45	S	S	*	.			trans	-62.5	137.8	179.3	-69	-64.3	0	0	0	112.5
256	G	95.5	Very high	88.5	Confident	14 Å²	14	65.7 Å²	65.7	14%	0.144	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	92.2	-165.1	-177.3	0	0	0	0	0	113.6	V271 E272	G256-V271 WeakPolarHBondContact O-CA 3.45Å; G256-E272 PolarHBondContact N-O 2.78Å; G256-E272 PolarHBondContact O-N 2.95Å
257	L	94.9	Very high	88.5	Confident	51 Å²	51	66.5 Å²	66.5	27%	0.267	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.5	-177.6	176.1	67.8	0	0	0	111.4	L269 V271 Y320 A321 I322	L257-L269 HydrophobicContact CD1-CB 4.11Å; L257-V271 HydrophobicContact CB-CG2 4.28Å; L257-V271 HydrophobicContact CD1-CG2 3.58Å; L257-Y320 HydrophobicContact CB-CD1 3.82Å; L257-Y320 HydrophobicContact CB-CG 4.17Å; L257-A321 WeakPolarHBondContact CD2-O 3.23Å; L257-I322 HydrophobicContact CD1-CG2 4.29Å; L257-I322 HydrophobicContact CD2-CG2 4.12Å
258	S	95	Very high	88.8	Confident	25 Å²	25	65.7 Å²	65.7	18%	0.175	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	178.7	170.4	66.4	0	0	0	0	110.3	H270	S258-H270 PolarHBondContact N-O 3.09Å; S258-H270 PolarHBondContact O-N 3.22Å; S258-H270 PolarHBondContact OG-CD2 3.29Å; S258-H270 PolarHBondContact OG-O 3.38Å
259	Y	92	Very high	88.9	Confident	99 Å²	99	64 Å²	64	39%	0.388	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142.3	178.2	-58.6	-84.9	0	0	0	110.1	R268 P323 L346	Y259-R268 WeakPolarHBondContact CA-O 3.19Å; Y259-P323 HydrophobicContact CE1-CG 4.25Å; Y259-P323 WeakPolarHBondContact OH-CD 3.31Å; Y259-L346 HydrophobicContact CD1-CD1 3.95Å; Y259-L346 HydrophobicContact CE1-CD1 3.88Å
260	V	91.1	Very high	89	Confident	17 Å²	17	63.3 Å²	63.3	10%	0.103	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.7	-177.2	-53.1	0	0	0	0	108.5	K252 K267 R268 H270	K252-V260 HydrophobicContact CD-CG1 4.35Å; V260-K267 WeakPolarHBondContact O-CA 3.31Å; V260-R268 HydrophobicContact CG2-CB 3.7Å; V260-R268 PolarHBondContact N-O 2.87Å; V260-R268 PolarHBondContact O-N 3.36Å; V260-H270 HydrophobicContact CG1-CB 3.52Å; V260-H270 HydrophobicContact CG2-CB 4.32Å
261	D	86.8	Confident	89.2	Confident	117 Å²	117	58.5 Å²	58.5	63%	0.626	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	138.7	177	-163.6	-73.6	0	0	0	109.6	G263	D261-G263 VanDerWaalsContact C-N 3.33Å; D261-G263 WeakPolarHBondContact OD1-CA 3.21Å; D261-G263 PolarHBondContact OD1-N 2.71Å
262	D	81.1	Confident	89.5	Confident	62 Å²	62	57 Å²	57	33%	0.332	34%	0.338	S	S	.	.			trans	-88.9	3.3	-179.7	72.9	7.6	0	0	0	114.3	S264 G265 G266 R268	D262-S264 PolarHBondContact O-N 2.95Å; D262-S264 VanDerWaalsContact OD1-CA 3.32Å; D262-S264 WeakPolarHBondContact OD1-CA 3.45Å; D262-S264 WeakPolarHBondContact OD1-CB 3.49Å; D262-S264 PolarHBondContact OD1-N 3.32Å; D262-S264 PolarHBondContact OD1-OG 2.97Å; D262-S264 PolarHBondContact OD2-OG 3.3Å; D262-G265 PolarHBondContact OD1-N 3.32Å; D262-G266 VanDerWaalsContact CG-CA 3.4Å; D262-G266 PolarHBondContact N-O 3.11Å; D262-G266 VanDerWaalsContact N-O 3.12Å; D262-G266 WeakPolarHBondContact OD1-CA 3.29Å; D262-G266 PolarHBondContact OD1-N 2.9Å; D262-G266 WeakPolarHBondContact OD2-CA 3.33Å; D262-G266 PolarHBondContact OD2-N 3.46Å; D262-R268 HydrophobicContact CB-CG 3.93Å
263	G	78.2	Confident	89.6	Confident	73 Å²	73	51.7 Å²	51.7	75%	0.753	32%	0.315	S	S	*	.	S	Bend	trans	80	-5.6	-177.6	0	0	0	0	0	114.3	D261	D261-G263 VanDerWaalsContact C-N 3.33Å; D261-G263 WeakPolarHBondContact OD1-CA 3.21Å; D261-G263 PolarHBondContact OD1-N 2.71Å
264	S	78.6	Confident	89.7	Confident	100 Å²	100	52.2 Å²	52.2	70%	0.699	31%	0.314	S	S	*	.	S	Bend	trans	-118.5	10.9	-179.5	71.8	0	0	0	0	113.4	D262 G266	D262-S264 PolarHBondContact O-N 2.95Å; D262-S264 VanDerWaalsContact OD1-CA 3.32Å; D262-S264 WeakPolarHBondContact OD1-CA 3.45Å; D262-S264 WeakPolarHBondContact OD1-CB 3.49Å; D262-S264 PolarHBondContact OD1-N 3.32Å; D262-S264 PolarHBondContact OD1-OG 2.97Å; D262-S264 PolarHBondContact OD2-OG 3.3Å; S264-G266 VanDerWaalsContact C-N 3.32Å
265	G	73.5	Confident	89.8	Confident	54 Å²	54	49 Å²	49	56%	0.557	29%	0.294	S	S	*	.	S	Bend	trans	80.2	11.7	-175.2	0	0	0	0	0	113.8	D262 K348	D262-G265 PolarHBondContact OD1-N 3.32Å; G265-K348 PolarHBondContact O-NZ 3.22Å; G265-K348 VanDerWaalsContact O-NZ 3.13Å
266	G	78.5	Confident	89.8	Confident	6 Å²	6	47.5 Å²	47.5	6%	0.062	29%	0.291	C	S	.	.			trans	-95.8	175.9	164	0	0	0	0	0	111.9	D262 S264	D262-G266 VanDerWaalsContact CG-CA 3.4Å; D262-G266 PolarHBondContact N-O 3.11Å; D262-G266 VanDerWaalsContact N-O 3.12Å; D262-G266 WeakPolarHBondContact OD1-CA 3.29Å; D262-G266 PolarHBondContact OD1-N 2.9Å; D262-G266 WeakPolarHBondContact OD2-CA 3.33Å; D262-G266 PolarHBondContact OD2-N 3.46Å; S264-G266 VanDerWaalsContact C-N 3.32Å
267	K	86.1	Confident	89.7	Confident	132 Å²	132	51.5 Å²	51.5	57%	0.574	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	140.7	178.3	-68.7	-176.7	-178.8	-179.2	0	108.7	V260 L346	V260-K267 WeakPolarHBondContact O-CA 3.31Å; K267-L346 HydrophobicContact CB-CD1 4.09Å; K267-L346 PolarHBondContact O-N 3.42Å
268	R	90.8	Very high	89.6	Confident	64 Å²	64	51.1 Å²	51.1	24%	0.242	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.2	165.2	-59.7	167.5	70.7	84	8.9	108.3	Y259 V260 D262 E343 A344	Y259-R268 WeakPolarHBondContact CA-O 3.19Å; V260-R268 HydrophobicContact CG2-CB 3.7Å; V260-R268 PolarHBondContact N-O 2.87Å; V260-R268 PolarHBondContact O-N 3.36Å; D262-R268 HydrophobicContact CB-CG 3.93Å; R268-E343 IonicContact NE-OE2 3.47Å; R268-E343 PolarHBondContact NE-OE2 2.99Å; R268-A344 CarbonylContact C-O 3.56Å; R268-A344 WeakPolarHBondContact CA-O 3.4Å; R268-A344 WeakPolarHBondContact CB-O 3.02Å
269	L	93.6	Very high	89.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	147.5	163.3	72.1	95.1	0	0	0	109	L257 V271 V293 I322 V326 L342 E343 A344 L346	L257-L269 HydrophobicContact CD1-CB 4.11Å; L269-V271 HydrophobicContact CD1-CG2 4.01Å; L269-V293 HydrophobicContact CD1-CG2 4.36Å; L269-V293 HydrophobicContact CD2-CG2 4.16Å; L269-I322 HydrophobicContact CD2-CG2 4.44Å; L269-V326 HydrophobicContact CD2-CB 4.34Å; L269-V326 HydrophobicContact CD2-CG1 4.34Å; L269-V326 HydrophobicContact CD2-CG2 3.24Å; L269-L342 HydrophobicContact CD1-CD1 3.32Å; L269-E343 WeakPolarHBondContact O-CA 3.39Å; L269-A344 HydrophobicContact CD1-CB 4.44Å; L269-A344 HydrophobicContact CD2-CB 3.84Å; L269-A344 HydrophobicContact CG-CB 4.01Å; L269-A344 PolarHBondContact N-O 2.81Å; L269-A344 PolarHBondContact O-N 2.79Å; L269-L346 HydrophobicContact CB-CD2 4.31Å; L269-L346 HydrophobicContact CD2-CD2 4.22Å
270	H	95.4	Very high	89.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	124.7	173.8	-179.6	94.2	0	0	0	108.4	V250 S258 V260 E272 V341 L342 E343	V250-H270 PolarHBondContact O-CE1 3.21Å; S258-H270 PolarHBondContact N-O 3.09Å; S258-H270 PolarHBondContact O-N 3.22Å; S258-H270 PolarHBondContact OG-CD2 3.29Å; S258-H270 PolarHBondContact OG-O 3.38Å; V260-H270 HydrophobicContact CG1-CB 3.52Å; V260-H270 HydrophobicContact CG2-CB 4.32Å; H270-E272 WeakPolarHBondContact NE2-CG 3.38Å; H270-E272 IonicContact NE2-OE1 3.02Å; H270-E272 PolarHBondContact NE2-OE1 3.35Å; H270-V341 VanDerWaalsContact CE1-CG1 3.43Å; H270-V341 WeakPolarHBondContact CE1-CG1 3.28Å; H270-L342 WeakPolarHBondContact CA-O 3.38Å; H270-E343 HydrophobicContact CB-CG 4.13Å; H270-E343 IonicContact CE1-OE1 3.43Å; H270-E343 IonicContact CG-OE1 3.1Å; H270-E343 WeakPolarHBondContact ND1-CG 3.46Å; H270-E343 IonicContact ND1-OE1 3.94Å; H270-E343 PolarHBondContact ND1-OE1 3.18Å
271	V	96.9	Very high	89.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.4	179	-176.4	0	0	0	0	109.7	G256 L257 L269 V273 Y320 V341 L342	G256-V271 WeakPolarHBondContact O-CA 3.45Å; L257-V271 HydrophobicContact CB-CG2 4.28Å; L257-V271 HydrophobicContact CD1-CG2 3.58Å; L269-V271 HydrophobicContact CD1-CG2 4.01Å; V271-V273 HydrophobicContact CG1-CG2 3.92Å; V271-Y320 HydrophobicContact CG1-CD2 3.69Å; V271-Y320 HydrophobicContact CG1-CE1 4.38Å; V271-Y320 HydrophobicContact CG1-CE2 3.34Å; V271-Y320 HydrophobicContact CG1-CG 4.32Å; V271-Y320 HydrophobicContact CG2-CD2 4.47Å; V271-V341 WeakPolarHBondContact O-CA 3.26Å; V271-L342 HydrophobicContact CB-CD1 3.93Å; V271-L342 HydrophobicContact CB-CD2 3.99Å; V271-L342 HydrophobicContact CB-CG 3.76Å; V271-L342 HydrophobicContact CG1-CD2 4.41Å; V271-L342 HydrophobicContact CG2-CD1 3.93Å; V271-L342 HydrophobicContact CG2-CG 4.33Å; V271-L342 PolarHBondContact N-O 3.16Å; V271-L342 PolarHBondContact O-N 3.29Å
272	E	97.5	Very high	89.9	Confident	3 Å²	3	51 Å²	51	1%	0.014	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.6	170.3	-66.2	-176.2	-134.1	0	0	110.7	K252 G253 V254 G256 H270 T339 L340 V341	K252-E272 VanDerWaalsContact CA-OE1 3.26Å; K252-E272 WeakPolarHBondContact CA-OE1 3.42Å; K252-E272 WeakPolarHBondContact CB-OE1 3.46Å; K252-E272 PolarHBondContact N-OE1 3.13Å; G253-E272 PolarHBondContact N-OE1 2.93Å; G253-E272 PolarHBondContact N-OE2 2.79Å; G253-E272 VanDerWaalsContact N-OE2 3.13Å; V254-E272 PolarHBondContact N-OE1 3.33Å; G256-E272 PolarHBondContact N-O 2.78Å; G256-E272 PolarHBondContact O-N 2.95Å; H270-E272 WeakPolarHBondContact NE2-CG 3.38Å; H270-E272 IonicContact NE2-OE1 3.02Å; H270-E272 PolarHBondContact NE2-OE1 3.35Å; E272-T339 HydrophobicContact CB-CG2 3.86Å; E272-T339 HydrophobicContact CG-CG2 4.18Å; E272-L340 CarbonylContact C-O 3.56Å; E272-L340 WeakPolarHBondContact CA-O 3.35Å; E272-V341 HydrophobicContact CG-CG2 4.38Å
273	V	96.6	Very high	90.4	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.7	176.9	-173.6	0	0	0	0	108.8	V271 V275 V295 F316 Y320 T339 L340	V271-V273 HydrophobicContact CG1-CG2 3.92Å; V273-V275 PolarHBondContact O-N 2.8Å; V273-V295 HydrophobicContact CG2-CB 4.23Å; V273-V295 HydrophobicContact CG2-CG1 4.25Å; V273-V295 HydrophobicContact CG2-CG2 3.98Å; V273-F316 HydrophobicContact CG1-CE2 4.31Å; V273-Y320 HydrophobicContact CG2-CE2 4.02Å; V273-T339 CarbonylContact O-C 3.56Å; V273-T339 WeakPolarHBondContact O-CA 3.45Å; V273-L340 HydrophobicContact CB-CB 4.44Å; V273-L340 PolarHBondContact N-O 2.96Å; V273-L340 PolarHBondContact O-N 3.21Å
274	A	95.4	Very high	91.2	Very high	69 Å²	69	45.8 Å²	45.8	57%	0.57	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	125.4	169.5	0	0	0	0	0	108.9
275	V	94.6	Very high	92	Very high	12 Å²	12	42.9 Å²	42.9	7%	0.073	24%	0.239	C	C	.	.			trans	-111.3	131	-177.3	179.7	0	0	0	0	109.1	V273 Y279 L284 F316 N338 L340	V273-V275 PolarHBondContact O-N 2.8Å; V275-Y279 HydrophobicContact CG1-CD2 4.1Å; V275-Y279 HydrophobicContact CG1-CG 4.29Å; V275-L284 HydrophobicContact CG1-CD1 4.06Å; V275-L284 HydrophobicContact CG1-CD2 4.05Å; V275-L284 HydrophobicContact CG2-CD1 4.28Å; V275-F316 HydrophobicContact CG2-CZ 4.45Å; V275-N338 PolarHBondContact N-O 3.41Å; V275-L340 HydrophobicContact CG2-CB 3.7Å
276	D	94.3	Very high	93	Very high	96 Å²	96	40.4 Å²	40.4	51%	0.513	21%	0.213	S	C	.	.			trans	-62.3	134.6	173.4	-173.9	-70.3	0	0	0	109.7	V278 Y279	D276-V278 HydrophobicContact CB-CG1 4.13Å; D276-V278 PolarHBondContact O-N 2.8Å; D276-V278 VanDerWaalsContact OD1-CB 3.29Å; D276-V278 WeakPolarHBondContact OD1-CB 3.31Å; D276-V278 WeakPolarHBondContact OD1-CG1 3.26Å; D276-V278 PolarHBondContact OD1-N 3.01Å; D276-Y279 HydrophobicContact CB-CD2 3.93Å; D276-Y279 HydrophobicContact CB-CE2 4.02Å; D276-Y279 PolarHBondContact O-N 3.07Å
277	P	92.3	Very high	93.7	Very high	98 Å²	98	40.9 Å²	40.9	64%	0.636	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-18.4	-179.6	-21.4	24.9	0	0	0	115.7	Y279 N338	P277-Y279 PolarHBondContact O-N 3.29Å; P277-N338 WeakPolarHBondContact CG-ND2 3.13Å
278	V	92.6	Very high	94	Very high	44 Å²	44	35.1 Å²	35.1	27%	0.267	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.8	175.1	76.1	0	0	0	0	112.6	D276 H299	D276-V278 HydrophobicContact CB-CG1 4.13Å; D276-V278 PolarHBondContact O-N 2.8Å; D276-V278 VanDerWaalsContact OD1-CB 3.29Å; D276-V278 WeakPolarHBondContact OD1-CB 3.31Å; D276-V278 WeakPolarHBondContact OD1-CG1 3.26Å; D276-V278 PolarHBondContact OD1-N 3.01Å; V278-H299 PolarHBondContact O-ND1 2.87Å
279	Y	94.4	Very high	93.6	Very high	29 Å²	29	34.9 Å²	34.9	11%	0.114	19%	0.193	C	C	.	.			trans	-86.5	124	179.4	-60	-79.8	0	0	0	110.1	V275 D276 P277 D283 L284 H299 A314 E315 F316	V275-Y279 HydrophobicContact CG1-CD2 4.1Å; V275-Y279 HydrophobicContact CG1-CG 4.29Å; D276-Y279 HydrophobicContact CB-CD2 3.93Å; D276-Y279 HydrophobicContact CB-CE2 4.02Å; D276-Y279 PolarHBondContact O-N 3.07Å; P277-Y279 PolarHBondContact O-N 3.29Å; Y279-D283 HydrophobicContact CD1-CB 4.15Å; Y279-L284 HydrophobicContact CG-CD2 4.3Å; Y279-H299 HydrophobicContact CD1-CB 3.79Å; Y279-H299 HydrophobicContact CE1-CB 3.92Å; Y279-A314 HydrophobicContact CE1-CB 4.37Å; Y279-A314 VanDerWaalsContact OH-C 3.27Å; Y279-A314 WeakPolarHBondContact OH-CB 3.24Å; Y279-E315 VanDerWaalsContact OH-C 3.27Å; Y279-E315 WeakPolarHBondContact OH-CA 3.49Å; Y279-E315 PolarHBondContact OH-N 3.28Å; Y279-E315 VanDerWaalsContact OH-N 3.14Å; Y279-F316 HydrophobicContact CD1-CD1 4.35Å; Y279-F316 HydrophobicContact CD1-CE1 4.19Å; Y279-F316 HydrophobicContact CD2-CD1 4.04Å; Y279-F316 AromaticContact CD2-CE1 3.86Å; Y279-F316 HydrophobicContact CD2-CE1 3.86Å; Y279-F316 AromaticContact CE1-CD1 3.92Å; Y279-F316 HydrophobicContact CE1-CD1 3.92Å; Y279-F316 HydrophobicContact CE1-CE1 4.22Å; Y279-F316 AromaticContact CE2-CD1 3.56Å; Y279-F316 HydrophobicContact CE2-CD1 3.56Å; Y279-F316 AromaticContact CE2-CE1 3.89Å; Y279-F316 HydrophobicContact CE2-CE1 3.89Å; Y279-F316 HydrophobicContact CG-CD1 4.41Å; Y279-F316 HydrophobicContact CG-CE1 4.02Å; Y279-F316 AromaticContact CZ-CD1 3.51Å
280	K	92.6	Very high	92.9	Very high	110 Å²	110	35.9 Å²	35.9	48%	0.478	20%	0.2	S	C	.	.			trans	-90.1	162.8	169.9	-57.9	179.9	-178.5	177.7	0	110	E282 D283 L284	K280-E282 HydrophobicContact CB-CG 4.1Å; K280-E282 VanDerWaalsContact CB-OE2 3.26Å; K280-E282 WeakPolarHBondContact CB-OE2 3.47Å; K280-E282 WeakPolarHBondContact CD-OE1 3.38Å; K280-E282 PolarHBondContact O-N 2.84Å; K280-E282 VanDerWaalsContact O-N 3.13Å; K280-D283 PolarHBondContact N-OD2 3.37Å; K280-D283 WeakPolarHBondContact O-CA 3.32Å; K280-D283 WeakPolarHBondContact O-CB 3.45Å; K280-D283 PolarHBondContact O-N 2.93Å; K280-L284 WeakPolarHBondContact O-CG 3.17Å
281	P	92.8	Very high	92.3	Very high	25 Å²	25	39.7 Å²	39.7	16%	0.162	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-52.9	-34	176.9	-27.8	36.4	0	0	0	114.1	R233 D283 L284 V335	R233-P281 WeakPolarHBondContact CG-O 3.42Å; P281-D283 VanDerWaalsContact C-N 3.27Å; P281-D283 PolarHBondContact O-N 2.85Å; P281-L284 PolarHBondContact O-N 2.99Å; P281-V335 HydrophobicContact CB-CG2 4.35Å; P281-V335 HydrophobicContact CG-CB 4.33Å; P281-V335 HydrophobicContact CG-CG2 4.09Å
282	E	91.3	Very high	92	Very high	92 Å²	92	44.6 Å²	44.6	43%	0.43	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-67.8	-21.2	174.2	61.8	-94	-148.4	0	0	114.8	K280 L284	K280-E282 HydrophobicContact CB-CG 4.1Å; K280-E282 VanDerWaalsContact CB-OE2 3.26Å; K280-E282 WeakPolarHBondContact CB-OE2 3.47Å; K280-E282 WeakPolarHBondContact CD-OE1 3.38Å; K280-E282 PolarHBondContact O-N 2.84Å; K280-E282 VanDerWaalsContact O-N 3.13Å; E282-L284 VanDerWaalsContact C-N 3.32Å
283	D	93.2	Very high	91.8	Very high	23 Å²	23	44.5 Å²	44.5	12%	0.123	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-84.6	-7.8	175.6	-58.5	-49.6	0	0	0	112	Y279 K280 P281 F285 G297 R298 H299	Y279-D283 HydrophobicContact CD1-CB 4.15Å; K280-D283 PolarHBondContact N-OD2 3.37Å; K280-D283 WeakPolarHBondContact O-CA 3.32Å; K280-D283 WeakPolarHBondContact O-CB 3.45Å; K280-D283 PolarHBondContact O-N 2.93Å; P281-D283 VanDerWaalsContact C-N 3.27Å; P281-D283 PolarHBondContact O-N 2.85Å; D283-F285 VanDerWaalsContact O-CE2 3.24Å; D283-F285 WeakPolarHBondContact O-CE2 3.12Å; D283-G297 CarbonylContact O-C 3.42Å; D283-G297 WeakPolarHBondContact O-CA 3.41Å; D283-R298 PolarHBondContact O-N 2.86Å; D283-H299 HydrophobicContact CB-CB 4.43Å; D283-H299 IonicContact OD1-ND1 3.49Å; D283-H299 PolarHBondContact OD1-ND1 2.94Å; D283-H299 IonicContact OD2-CE1 3.82Å; D283-H299 IonicContact OD2-CG 3.66Å; D283-H299 IonicContact OD2-ND1 2.8Å; D283-H299 PolarHBondContact OD2-ND1 2.98Å
284	L	95.1	Very high	91.8	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	144.3	-170.6	-59.9	173.6	0	0	0	112.7	P234 V275 Y279 K280 P281 E282 S296 F316 V335 L340	P234-L284 VanDerWaalsContact CD-O 3.25Å; P234-L284 WeakPolarHBondContact CD-O 3.15Å; P234-L284 HydrophobicContact CG-CB 3.84Å; V275-L284 HydrophobicContact CG1-CD1 4.06Å; V275-L284 HydrophobicContact CG1-CD2 4.05Å; V275-L284 HydrophobicContact CG2-CD1 4.28Å; Y279-L284 HydrophobicContact CG-CD2 4.3Å; K280-L284 WeakPolarHBondContact O-CG 3.17Å; P281-L284 PolarHBondContact O-N 2.99Å; E282-L284 VanDerWaalsContact C-N 3.32Å; L284-S296 WeakPolarHBondContact CA-O 3.45Å; L284-F316 HydrophobicContact CD2-CE1 3.6Å; L284-F316 HydrophobicContact CD2-CZ 3.67Å; L284-V335 HydrophobicContact CD1-CG2 3.69Å; L284-L340 HydrophobicContact CB-CD1 4.31Å; L284-L340 HydrophobicContact CD1-CD1 4.02Å
285	F	94.2	Very high	91.8	Very high	39 Å²	39	42.3 Å²	42.3	17%	0.171	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	136.2	-177.9	-46	-79.4	0	0	0	111	T223 A231 D283 V295 S296	T223-F285 HydrophobicContact CG2-CD1 3.49Å; T223-F285 VanDerWaalsContact CG2-CD1 3.49Å; T223-F285 HydrophobicContact CG2-CE1 3.84Å; A231-F285 HydrophobicContact CB-CB 4.28Å; D283-F285 VanDerWaalsContact O-CE2 3.24Å; D283-F285 WeakPolarHBondContact O-CE2 3.12Å; F285-V295 WeakPolarHBondContact O-CA 3.4Å; F285-S296 PolarHBondContact N-O 2.9Å; F285-S296 PolarHBondContact O-N 2.78Å
286	V	95.7	Very high	91.8	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	119.9	169.4	-176.8	0	0	0	0	108.7	A231 V232 P234 V293 V294 V295 V331 A333 L340 L342	A231-V286 CarbonylContact C-O 3.47Å; A231-V286 WeakPolarHBondContact CA-O 3.09Å; V232-V286 HydrophobicContact CB-CB 4.35Å; V232-V286 PolarHBondContact N-O 3.1Å; V232-V286 PolarHBondContact O-N 3.3Å; P234-V286 HydrophobicContact CG-CG2 4.41Å; V286-V293 HydrophobicContact CG1-CG1 3.74Å; V286-V294 WeakPolarHBondContact CA-O 3.49Å; V286-V295 HydrophobicContact CG2-CG2 4.43Å; V286-V331 HydrophobicContact CG1-CG1 3.89Å; V286-A333 HydrophobicContact CG2-CB 3.9Å; V286-L340 HydrophobicContact CG2-CD1 4.42Å; V286-L340 HydrophobicContact CG2-CD2 4.34Å; V286-L342 HydrophobicContact CG1-CD2 3.88Å; V286-L342 HydrophobicContact CG2-CD2 3.97Å
287	N	93.6	Very high	91.8	Very high	15 Å²	15	38.3 Å²	38.3	8%	0.08	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	149.6	175.2	-71.3	99.4	0	0	0	110.2	N225 V230 A231 V293 V294	N225-N287 PolarHBondContact ND2-ND2 2.9Å; V230-N287 PolarHBondContact O-ND2 3.17Å; A231-N287 WeakPolarHBondContact CB-ND2 3.35Å; N287-V293 WeakPolarHBondContact O-CA 3.12Å; N287-V294 HydrophobicContact CB-CB 4.47Å; N287-V294 PolarHBondContact N-O 3.16Å; N287-V294 PolarHBondContact O-N 3.3Å
288	V	90.7	Very high	91.8	Very high	11 Å²	11	37.8 Å²	37.8	7%	0.067	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.9	168.2	-177.8	0	0	0	0	107.8	K128 R292 V326 P328 V331	K128-V288 WeakPolarHBondContact CB-O 3.12Å; V288-R292 WeakPolarHBondContact CA-O 3.35Å; V288-V326 HydrophobicContact CG1-CB 4.15Å; V288-V326 HydrophobicContact CG2-CB 4.39Å; V288-V326 HydrophobicContact CG2-CG1 4.19Å; V288-P328 HydrophobicContact CB-CB 4.42Å; V288-P328 HydrophobicContact CB-CG 4.17Å; V288-P328 HydrophobicContact CG2-CB 4.49Å; V288-V331 HydrophobicContact CG2-CG2 3.77Å
289	D	83.9	Confident	91.7	Very high	59 Å²	59	37.6 Å²	37.6	32%	0.316	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	99.8	179.5	-178.8	18.3	0	0	0	108.2	K128 N291 R292	K128-D289 WeakPolarHBondContact CD-OD1 3.41Å; K128-D289 WeakPolarHBondContact CE-OD1 3.25Å; K128-D289 IonicContact NZ-OD1 3.27Å; K128-D289 PolarHBondContact NZ-OD1 3.24Å; D289-N291 PolarHBondContact O-N 3.46Å; D289-R292 PolarHBondContact N-O 3.23Å; D289-R292 PolarHBondContact O-N 2.62Å
290	S	78	Confident	91.4	Very high	22 Å²	22	40.7 Å²	40.7	15%	0.154	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	-88.3	-173.4	5.6	0	0	0	0	114.4	D125 T325	D125-S290 VanDerWaalsContact CG-CB 3.47Å; D125-S290 WeakPolarHBondContact OD1-CB 2.86Å; D125-S290 PolarHBondContact OD1-OG 3.47Å; S290-T325 PolarHBondContact O-OG1 3.3Å
291	N	83	Confident	91	Very high	80 Å²	80	39.6 Å²	39.6	43%	0.428	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	25.9	-173.1	67	-7.8	0	0	0	110.4	D289 A321 I322	D289-N291 PolarHBondContact O-N 3.46Å; N291-A321 CarbonylContact O-C 3.55Å; N291-A321 WeakPolarHBondContact O-CA 3.36Å; N291-I322 VanDerWaalsContact O-CG1 3.25Å; N291-I322 WeakPolarHBondContact O-CG1 3.44Å; N291-I322 PolarHBondContact O-N 2.88Å
292	R	91.1	Very high	90.2	Very high	103 Å²	103	46 Å²	46	39%	0.389	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.1	176.8	-64.6	174.2	-173.3	-86.6	-4.2	110.9	V288 D289 V294 Y320	V288-R292 WeakPolarHBondContact CA-O 3.35Å; D289-R292 PolarHBondContact N-O 3.23Å; D289-R292 PolarHBondContact O-N 2.62Å; R292-V294 HydrophobicContact CB-CG2 4.49Å; R292-Y320 CarbonylContact C-O 3.47Å; R292-Y320 WeakPolarHBondContact CA-O 3.5Å
293	V	93.6	Very high	89	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.2	159.1	-177.9	0	0	0	0	107.3	L269 V286 N287 S319 Y320 I322 L342	L269-V293 HydrophobicContact CD1-CG2 4.36Å; L269-V293 HydrophobicContact CD2-CG2 4.16Å; V286-V293 HydrophobicContact CG1-CG1 3.74Å; N287-V293 WeakPolarHBondContact O-CA 3.12Å; V293-S319 CarbonylContact O-C 3.48Å; V293-S319 WeakPolarHBondContact O-CA 3.43Å; V293-Y320 PolarHBondContact N-O 3.06Å; V293-Y320 PolarHBondContact O-N 3.36Å; V293-I322 HydrophobicContact CG2-CD1 4.06Å; V293-I322 HydrophobicContact CG2-CG2 4.07Å; V293-L342 HydrophobicContact CG1-CD1 4.04Å; V293-L342 HydrophobicContact CG1-CD2 4.02Å
294	V	94.8	Very high	87.5	Confident	27 Å²	27	51.8 Å²	51.8	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.8	178.3	-175.3	0	0	0	0	108.2	V286 N287 R292 Q318	V286-V294 WeakPolarHBondContact CA-O 3.49Å; N287-V294 HydrophobicContact CB-CB 4.47Å; N287-V294 PolarHBondContact N-O 3.16Å; N287-V294 PolarHBondContact O-N 3.3Å; R292-V294 HydrophobicContact CB-CG2 4.49Å; V294-Q318 WeakPolarHBondContact CA-O 3.43Å
295	V	95.8	Very high	86.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.3	170.2	-179	0	0	0	0	107.2	V273 F285 V286 F316 S317 Q318 L340 L342	V273-V295 HydrophobicContact CG2-CB 4.23Å; V273-V295 HydrophobicContact CG2-CG1 4.25Å; V273-V295 HydrophobicContact CG2-CG2 3.98Å; F285-V295 WeakPolarHBondContact O-CA 3.4Å; V286-V295 HydrophobicContact CG2-CG2 4.43Å; V295-F316 HydrophobicContact CG1-CE2 4.11Å; V295-F316 HydrophobicContact CG1-CZ 4.33Å; V295-S317 CarbonylContact O-C 3.52Å; V295-S317 WeakPolarHBondContact O-CA 3.35Å; V295-Q318 PolarHBondContact N-O 2.9Å; V295-Q318 PolarHBondContact O-N 3.11Å; V295-L340 HydrophobicContact CG1-CD1 3.63Å; V295-L340 HydrophobicContact CG1-CD2 4.26Å; V295-L340 HydrophobicContact CG2-CD2 4.28Å; V295-L342 HydrophobicContact CG2-CD2 3.54Å
296	S	95.1	Very high	85	Confident	22 Å²	22	64.4 Å²	64.4	15%	0.154	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.6	178	57	0	0	0	0	110.6	L284 F285 F316	L284-S296 WeakPolarHBondContact CA-O 3.45Å; F285-S296 PolarHBondContact N-O 2.9Å; F285-S296 PolarHBondContact O-N 2.78Å; S296-F316 VanDerWaalsContact CA-O 3.26Å; S296-F316 WeakPolarHBondContact CA-O 3.49Å
297	G	93.8	Very high	83.6	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	141.3	172.3	0	0	0	0	0	111.3	D283 E315 F316	D283-G297 CarbonylContact O-C 3.42Å; D283-G297 WeakPolarHBondContact O-CA 3.41Å; G297-E315 CarbonylContact O-C 3.19Å; G297-E315 WeakPolarHBondContact O-CA 3.17Å; G297-F316 VanDerWaalsContact CA-CE1 3.5Å; G297-F316 PolarHBondContact N-O 2.83Å; G297-F316 PolarHBondContact O-N 3.18Å
298	R	92.6	Very high	82.3	Confident	88 Å²	88	74.6 Å²	74.6	33%	0.332	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	112.2	178.4	-175.5	171.7	174.5	154	-11.5	110.5	E226 D283 F313 A314	E226-R298 IonicContact OE1-CZ 3.31Å; E226-R298 VanDerWaalsContact OE1-CZ 3.31Å; E226-R298 IonicContact OE1-NE 3.77Å; E226-R298 IonicContact OE1-NH1 2.62Å; E226-R298 PolarHBondContact OE1-NH1 2.84Å; E226-R298 IonicContact OE2-NH1 3.78Å; D283-R298 PolarHBondContact O-N 2.86Å; R298-F313 HydrophobicContact CG-CB 4.43Å; R298-F313 HydrophobicContact CG-CD2 4.16Å; R298-A314 CarbonylContact C-O 3.53Å; R298-A314 WeakPolarHBondContact CA-O 3.29Å
299	H	91.8	Very high	81	Confident	39 Å²	39	85.1 Å²	85.1	18%	0.181	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.1	-178.5	-178.2	79.1	0	0	0	111	V278 Y279 D283 F313 A314	V278-H299 PolarHBondContact O-ND1 2.87Å; Y279-H299 HydrophobicContact CD1-CB 3.79Å; Y279-H299 HydrophobicContact CE1-CB 3.92Å; D283-H299 HydrophobicContact CB-CB 4.43Å; D283-H299 IonicContact OD1-ND1 3.49Å; D283-H299 PolarHBondContact OD1-ND1 2.94Å; D283-H299 IonicContact OD2-CE1 3.82Å; D283-H299 IonicContact OD2-CG 3.66Å; D283-H299 IonicContact OD2-ND1 2.8Å; D283-H299 PolarHBondContact OD2-ND1 2.98Å; H299-F313 CarbonylContact O-C 3.56Å; H299-F313 WeakPolarHBondContact O-CA 3.5Å; H299-F313 WeakPolarHBondContact O-CB 3.26Å; H299-A314 PolarHBondContact N-O 3.02Å; H299-A314 PolarHBondContact O-N 3.36Å
300	H	87.7	Confident	80.3	Confident	95 Å²	95	85.9 Å²	85.9	44%	0.44	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.2	-178.7	-164.6	87.6	0	0	0	111.9	S311	H300-S311 VanDerWaalsContact CE1-CB 3.42Å; H300-S311 WeakPolarHBondContact CE1-CB 3.33Å; H300-S311 WeakPolarHBondContact NE2-CB 3.3Å
301	K	84	Confident	80.3	Confident	87 Å²	87	88.8 Å²	88.8	38%	0.378	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	107.1	177	-64.7	-179.9	-179.1	176.6	0	109.6	S312	K301-S312 WeakPolarHBondContact CA-O 3.49Å; K301-S312 PolarHBondContact N-O 3.27Å; K301-S312 PolarHBondContact O-N 3.43Å; K301-S312 VanDerWaalsContact O-N 3.09Å; K301-S312 VanDerWaalsContact O-O 3.12Å
302	Q	75.7	Confident	80.5	Confident	159 Å²	159	87.4 Å²	87.4	74%	0.743	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	119.5	168.2	-66.3	-170.6	-7	0	0	109.7
303	K	64.9	Low	80.3	Confident	131 Å²	131	87.1 Å²	87.1	57%	0.57	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.5	164.2	-73.5	-171.8	177.3	-175.7	0	109	S310	K303-S310 PolarHBondContact N-O 3.49Å; K303-S310 PolarHBondContact O-N 2.84Å
304	S	62.8	Low	80.2	Confident	105 Å²	105	88 Å²	88	73%	0.734	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	102.2	166.4	58.9	0	0	0	0	108.3
305	D	66.5	Low	80.1	Confident	107 Å²	107	91.6 Å²	91.6	57%	0.572	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	160	167.6	-66.3	-17.1	0	0	0	109	H307 G308	D305-H307 PolarHBondContact O-N 3.11Å; D305-G308 PolarHBondContact O-N 2.72Å; D305-G308 VanDerWaalsContact O-N 3.16Å
306	Q	71.1	Confident	80.1	Confident	198 Å²	198	93.7 Å²	93.7	93%	0.925	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-11.7	-178.5	-67.7	-176	-4.9	0	0	114.1
307	H	65.5	Low	80	Confident	188 Å²	188	96.8 Å²	96.8	87%	0.87	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	8.6	-177	-67.9	82.9	0	0	0	114.4	D305	D305-H307 PolarHBondContact O-N 3.11Å
308	G	66.4	Low	80.1	Confident	44 Å²	44	100.8 Å²	100.8	45%	0.454	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	135.8	163.2	176.2	0	0	0	0	0	113.4	D305 S310	D305-G308 PolarHBondContact O-N 2.72Å; D305-G308 VanDerWaalsContact O-N 3.16Å; G308-S310 PolarHBondContact O-N 3.35Å
309	R	62.9	Low	80.2	Confident	233 Å²	233	99.6 Å²	99.6	88%	0.879	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	114.7	172.1	-81.4	-178.5	179.3	163.2	-0.1	109
310	S	69.4	Low	80.3	Confident	74 Å²	74	99 Å²	99	52%	0.517	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118.9	166.1	-173.4	0	0	0	0	108.6	K303 G308	K303-S310 PolarHBondContact N-O 3.49Å; K303-S310 PolarHBondContact O-N 2.84Å; G308-S310 PolarHBondContact O-N 3.35Å
311	S	78.7	Confident	80.5	Confident	83 Å²	83	97.1 Å²	97.1	58%	0.58	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.5	171.9	56.4	0	0	0	0	109.3	H300	H300-S311 VanDerWaalsContact CE1-CB 3.42Å; H300-S311 WeakPolarHBondContact CE1-CB 3.33Å; H300-S311 WeakPolarHBondContact NE2-CB 3.3Å
312	S	86.6	Confident	80.7	Confident	52 Å²	52	93.4 Å²	93.4	36%	0.364	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	167.3	165	54.7	0	0	0	0	109.3	K301	K301-S312 WeakPolarHBondContact CA-O 3.49Å; K301-S312 PolarHBondContact N-O 3.27Å; K301-S312 PolarHBondContact O-N 3.43Å; K301-S312 VanDerWaalsContact O-N 3.09Å; K301-S312 VanDerWaalsContact O-O 3.12Å
313	F	86.8	Confident	80.9	Confident	97 Å²	97	90.1 Å²	90.1	43%	0.425	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150	172	58.3	-89.5	0	0	0	109.5	R298 H299 E315	R298-F313 HydrophobicContact CG-CB 4.43Å; R298-F313 HydrophobicContact CG-CD2 4.16Å; H299-F313 CarbonylContact O-C 3.56Å; H299-F313 WeakPolarHBondContact O-CA 3.5Å; H299-F313 WeakPolarHBondContact O-CB 3.26Å; F313-E315 HydrophobicContact CD2-CB 3.92Å; F313-E315 HydrophobicContact CE2-CB 4.03Å; F313-E315 WeakPolarHBondContact CE2-OE2 3.33Å
314	A	91.3	Very high	81.6	Confident	17 Å²	17	87.4 Å²	87.4	14%	0.14	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.6	162.6	0	0	0	0	0	107.7	Y279 R298 H299	Y279-A314 HydrophobicContact CE1-CB 4.37Å; Y279-A314 VanDerWaalsContact OH-C 3.27Å; Y279-A314 WeakPolarHBondContact OH-CB 3.24Å; R298-A314 CarbonylContact C-O 3.53Å; R298-A314 WeakPolarHBondContact CA-O 3.29Å; H299-A314 PolarHBondContact N-O 3.02Å; H299-A314 PolarHBondContact O-N 3.36Å
315	E	93.6	Very high	82.3	Confident	103 Å²	103	84 Å²	84	48%	0.481	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	146.5	178.6	179.8	171.2	-140.8	0	0	110.9	Y279 G297 F313	Y279-E315 VanDerWaalsContact OH-C 3.27Å; Y279-E315 WeakPolarHBondContact OH-CA 3.49Å; Y279-E315 PolarHBondContact OH-N 3.28Å; Y279-E315 VanDerWaalsContact OH-N 3.14Å; G297-E315 CarbonylContact O-C 3.19Å; G297-E315 WeakPolarHBondContact O-CA 3.17Å; F313-E315 HydrophobicContact CD2-CB 3.92Å; F313-E315 HydrophobicContact CE2-CB 4.03Å; F313-E315 WeakPolarHBondContact CE2-OE2 3.33Å
316	F	94.7	Very high	83.4	Confident	45 Å²	45	79 Å²	79	20%	0.197	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	156	166.3	78.9	-82.9	0	0	0	110.8	V273 V275 Y279 L284 V295 S296 G297	V273-F316 HydrophobicContact CG1-CE2 4.31Å; V275-F316 HydrophobicContact CG2-CZ 4.45Å; Y279-F316 HydrophobicContact CD1-CD1 4.35Å; Y279-F316 HydrophobicContact CD1-CE1 4.19Å; Y279-F316 HydrophobicContact CD2-CD1 4.04Å; Y279-F316 AromaticContact CD2-CE1 3.86Å; Y279-F316 HydrophobicContact CD2-CE1 3.86Å; Y279-F316 AromaticContact CE1-CD1 3.92Å; Y279-F316 HydrophobicContact CE1-CD1 3.92Å; Y279-F316 HydrophobicContact CE1-CE1 4.22Å; Y279-F316 AromaticContact CE2-CD1 3.56Å; Y279-F316 HydrophobicContact CE2-CD1 3.56Å; Y279-F316 AromaticContact CE2-CE1 3.89Å; Y279-F316 HydrophobicContact CE2-CE1 3.89Å; Y279-F316 HydrophobicContact CG-CD1 4.41Å; Y279-F316 HydrophobicContact CG-CE1 4.02Å; Y279-F316 AromaticContact CZ-CD1 3.51Å; L284-F316 HydrophobicContact CD2-CE1 3.6Å; L284-F316 HydrophobicContact CD2-CZ 3.67Å; V295-F316 HydrophobicContact CG1-CE2 4.11Å; V295-F316 HydrophobicContact CG1-CZ 4.33Å; S296-F316 VanDerWaalsContact CA-O 3.26Å; S296-F316 WeakPolarHBondContact CA-O 3.49Å; G297-F316 VanDerWaalsContact CA-CE1 3.5Å; G297-F316 PolarHBondContact N-O 2.83Å; G297-F316 PolarHBondContact O-N 3.18Å
317	S	94.5	Very high	84.3	Confident	86 Å²	86	69.6 Å²	69.6	60%	0.601	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144	132.6	170.7	-175.3	0	0	0	0	109.5	V295	V295-S317 CarbonylContact O-C 3.52Å; V295-S317 WeakPolarHBondContact O-CA 3.35Å
318	Q	94.7	Very high	85.5	Confident	85 Å²	85	61.1 Å²	61.1	40%	0.397	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	126	176.7	-169.7	161.9	3.3	0	0	109.6	V294 V295 Y320	V294-Q318 WeakPolarHBondContact CA-O 3.43Å; V295-Q318 PolarHBondContact N-O 2.9Å; V295-Q318 PolarHBondContact O-N 3.11Å; Q318-Y320 HydrophobicContact CB-CE2 4.46Å; Q318-Y320 HydrophobicContact CG-CE1 4.47Å; Q318-Y320 HydrophobicContact CG-CE2 3.79Å; Q318-Y320 PolarHBondContact NE2-OH 2.91Å
319	S	94.8	Very high	86.7	Confident	63 Å²	63	59.4 Å²	59.4	44%	0.441	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	141.8	-177.4	72.3	0	0	0	0	111.7	V293	V293-S319 CarbonylContact O-C 3.48Å; V293-S319 WeakPolarHBondContact O-CA 3.43Å
320	Y	94.6	Very high	88	Confident	26 Å²	26	49.5 Å²	49.5	10%	0.102	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	124.2	176.8	-58.6	-86	0	0	0	109.9	L257 V271 V273 R292 V293 Q318	L257-Y320 HydrophobicContact CB-CD1 3.82Å; L257-Y320 HydrophobicContact CB-CG 4.17Å; V271-Y320 HydrophobicContact CG1-CD2 3.69Å; V271-Y320 HydrophobicContact CG1-CE1 4.38Å; V271-Y320 HydrophobicContact CG1-CE2 3.34Å; V271-Y320 HydrophobicContact CG1-CG 4.32Å; V271-Y320 HydrophobicContact CG2-CD2 4.47Å; V273-Y320 HydrophobicContact CG2-CE2 4.02Å; R292-Y320 CarbonylContact C-O 3.47Å; R292-Y320 WeakPolarHBondContact CA-O 3.5Å; V293-Y320 PolarHBondContact N-O 3.06Å; V293-Y320 PolarHBondContact O-N 3.36Å; Q318-Y320 HydrophobicContact CB-CE2 4.46Å; Q318-Y320 HydrophobicContact CG-CE1 4.47Å; Q318-Y320 HydrophobicContact CG-CE2 3.79Å; Q318-Y320 PolarHBondContact NE2-OH 2.91Å
321	A	91.9	Very high	89.1	Confident	57 Å²	57	46.1 Å²	46.1	47%	0.471	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	130.1	172.8	0	0	0	0	0	110.2	L257 N291	L257-A321 WeakPolarHBondContact CD2-O 3.23Å; N291-A321 CarbonylContact O-C 3.55Å; N291-A321 WeakPolarHBondContact O-CA 3.36Å
322	I	88.6	Confident	89.8	Confident	8 Å²	8	43.8 Å²	43.8	4%	0.041	26%	0.255	C	S	.	.			trans	-114.5	145.2	177.2	55.4	170.7	0	0	0	109.6	L257 L269 N291 V293 E324 V326	L257-I322 HydrophobicContact CD1-CG2 4.29Å; L257-I322 HydrophobicContact CD2-CG2 4.12Å; L269-I322 HydrophobicContact CD2-CG2 4.44Å; N291-I322 VanDerWaalsContact O-CG1 3.25Å; N291-I322 WeakPolarHBondContact O-CG1 3.44Å; N291-I322 PolarHBondContact O-N 2.88Å; V293-I322 HydrophobicContact CG2-CD1 4.06Å; V293-I322 HydrophobicContact CG2-CG2 4.07Å; I322-E324 WeakPolarHBondContact CD1-O 3.35Å; I322-E324 WeakPolarHBondContact CG1-O 3.38Å; I322-V326 HydrophobicContact CD1-CB 4.14Å; I322-V326 HydrophobicContact CD1-CG2 3.58Å
323	P	79.1	Confident	90.2	Very high	91 Å²	91	41.4 Å²	41.4	59%	0.591	24%	0.238	S	C	*	.	S	Bend	trans	-75.8	-27.7	-172.4	28.8	-35.9	0	0	0	112.9	Y259	Y259-P323 HydrophobicContact CE1-CG 4.25Å; Y259-P323 WeakPolarHBondContact OH-CD 3.31Å
324	E	79.1	Confident	90.6	Very high	74 Å²	74	36.8 Å²	36.8	35%	0.346	22%	0.218	S	C	.	.	S	Bend	trans	-129.8	153	-177.4	-66.4	177.5	-173.6	0	0	108.4	I322 L346	I322-E324 WeakPolarHBondContact CD1-O 3.35Å; I322-E324 WeakPolarHBondContact CG1-O 3.38Å; E324-L346 HydrophobicContact CB-CD2 4.48Å
325	T	78.4	Confident	90.8	Very high	34 Å²	34	36.7 Å²	36.7	21%	0.209	22%	0.216	C	C	.	.			trans	-65.5	155.2	176.7	-165.8	0	0	0	0	110.5	L127 S290 E347	L127-T325 HydrophobicContact CD1-CG2 4.1Å; S290-T325 PolarHBondContact O-OG1 3.3Å; T325-E347 HydrophobicContact CG2-CB 4.26Å; T325-E347 PolarHBondContact O-N 3.13Å
326	V	88.5	Confident	90.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.209	C	C	.	.			trans	-122.6	136.4	174.9	169	0	0	0	0	107.1	L269 V288 I322 P328 V331 A344 L346	L269-V326 HydrophobicContact CD2-CB 4.34Å; L269-V326 HydrophobicContact CD2-CG1 4.34Å; L269-V326 HydrophobicContact CD2-CG2 3.24Å; V288-V326 HydrophobicContact CG1-CB 4.15Å; V288-V326 HydrophobicContact CG2-CB 4.39Å; V288-V326 HydrophobicContact CG2-CG1 4.19Å; I322-V326 HydrophobicContact CD1-CB 4.14Å; I322-V326 HydrophobicContact CD1-CG2 3.58Å; V326-P328 VanDerWaalsContact O-CD 3.26Å; V326-P328 WeakPolarHBondContact O-CD 3.5Å; V326-V331 HydrophobicContact CG1-CG2 3.76Å; V326-A344 HydrophobicContact CG1-CB 3.45Å; V326-A344 VanDerWaalsContact CG1-CB 3.45Å; V326-L346 HydrophobicContact CG2-CD2 4.14Å
327	D	89.6	Confident	90.7	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.011	22%	0.224	C	C	.	.			trans	-64.4	117	166.4	176	-6.5	0	0	0	108.4	Y131 P190 S192 L329 S330	Y131-D327 PolarHBondContact OH-OD1 3.2Å; P190-D327 HydrophobicContact CB-CB 4.16Å; P190-D327 VanDerWaalsContact CB-OD2 3.29Å; P190-D327 WeakPolarHBondContact CB-OD2 3.4Å; S192-D327 WeakPolarHBondContact CB-OD2 3.29Å; S192-D327 PolarHBondContact N-OD2 2.99Å; S192-D327 PolarHBondContact OG-OD1 2.91Å; S192-D327 PolarHBondContact OG-OD2 2.92Å; D327-L329 PolarHBondContact O-N 2.93Å; D327-L329 VanDerWaalsContact O-N 3.13Å; D327-L329 PolarHBondContact OD1-N 2.84Å; D327-S330 WeakPolarHBondContact O-CB 3.28Å; D327-S330 PolarHBondContact O-N 2.83Å; D327-S330 PolarHBondContact O-OG 3.35Å
328	P	91.1	Very high	90.6	Very high	10 Å²	10	35.1 Å²	35.1	7%	0.065	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-52	-34.6	178.1	-22.8	31	0	0	0	113.2	L127 Y131 V288 V326 S330 V331	L127-P328 HydrophobicContact CB-CG 4.47Å; Y131-P328 HydrophobicContact CD2-CB 4.39Å; Y131-P328 HydrophobicContact CD2-CG 3.92Å; Y131-P328 HydrophobicContact CE2-CB 4.47Å; Y131-P328 HydrophobicContact CE2-CG 3.87Å; V288-P328 HydrophobicContact CB-CB 4.42Å; V288-P328 HydrophobicContact CB-CG 4.17Å; V288-P328 HydrophobicContact CG2-CB 4.49Å; V326-P328 VanDerWaalsContact O-CD 3.26Å; V326-P328 WeakPolarHBondContact O-CD 3.5Å; P328-S330 VanDerWaalsContact C-N 3.26Å; P328-S330 PolarHBondContact O-N 3.25Å; P328-V331 PolarHBondContact O-N 2.78Å
329	L	91.2	Very high	90.6	Very high	8 Å²	8	32.4 Å²	32.4	4%	0.042	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-84.3	5.8	178.3	-57	-170.4	0	0	0	113.3	Y131 V214 Q220 L222 V230 D327	Y131-L329 HydrophobicContact CD1-CD1 3.54Å; Y131-L329 HydrophobicContact CD1-CG 3.92Å; Y131-L329 HydrophobicContact CE1-CD1 3.35Å; Y131-L329 HydrophobicContact CE1-CG 3.74Å; Y131-L329 HydrophobicContact CG-CD1 4.43Å; Y131-L329 HydrophobicContact CG-CG 4.38Å; V214-L329 HydrophobicContact CB-CD1 3.6Å; V214-L329 HydrophobicContact CG1-CD1 3.69Å; V214-L329 HydrophobicContact CG2-CD1 3.73Å; Q220-L329 PolarHBondContact NE2-O 2.68Å; Q220-L329 PolarHBondContact OE1-O 2.78Å; L222-L329 HydrophobicContact CD1-CD2 3.74Å; L222-L329 HydrophobicContact CD2-CD2 3.66Å; L222-L329 HydrophobicContact CG-CD2 4.38Å; V230-L329 HydrophobicContact CG1-CD2 3.96Å; D327-L329 PolarHBondContact O-N 2.93Å; D327-L329 VanDerWaalsContact O-N 3.13Å; D327-L329 PolarHBondContact OD1-N 2.84Å
330	S	90.5	Very high	90.7	Very high	25 Å²	25	29.4 Å²	29.4	18%	0.175	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-99.4	-7.7	169.5	75.5	0	0	0	0	113	D327 P328 S332	D327-S330 WeakPolarHBondContact O-CB 3.28Å; D327-S330 PolarHBondContact O-N 2.83Å; D327-S330 PolarHBondContact O-OG 3.35Å; P328-S330 VanDerWaalsContact C-N 3.26Å; P328-S330 PolarHBondContact O-N 3.25Å; S330-S332 PolarHBondContact O-N 2.83Å
331	V	93.1	Very high	90.8	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.012	18%	0.183	C	C	.	.			trans	-73.6	125.6	-178.6	179.9	0	0	0	0	110	Q220 V232 V286 V288 V326 P328 L342 A344	Q220-V331 PolarHBondContact NE2-O 2.85Å; V232-V331 HydrophobicContact CG2-CB 4.1Å; V232-V331 HydrophobicContact CG2-CG1 4.49Å; V286-V331 HydrophobicContact CG1-CG1 3.89Å; V288-V331 HydrophobicContact CG2-CG2 3.77Å; V326-V331 HydrophobicContact CG1-CG2 3.76Å; P328-V331 PolarHBondContact O-N 2.78Å; V331-L342 HydrophobicContact CG1-CB 4.49Å; V331-A344 HydrophobicContact CB-CB 4.39Å; V331-A344 HydrophobicContact CG2-CB 3.88Å
332	S	93.2	Very high	91	Very high	34 Å²	34	25.4 Å²	25.4	24%	0.238	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.9	165.8	-74.1	0	0	0	0	108.7	L249 S330 L342 E343	L249-S332 WeakPolarHBondContact CD1-O 3.44Å; S330-S332 PolarHBondContact O-N 2.83Å; S332-L342 CarbonylContact O-C 3.39Å; S332-L342 WeakPolarHBondContact O-CA 3.43Å; S332-L342 WeakPolarHBondContact O-CB 3.22Å; S332-E343 PolarHBondContact N-O 2.84Å; S332-E343 PolarHBondContact O-N 2.78Å
333	A	95.6	Very high	91.3	Very high	2 Å²	2	26.2 Å²	26.2	2%	0.017	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.4	176.4	0	0	0	0	0	111.3	V232 P234 K235 V286 V341 L342	V232-A333 HydrophobicContact CG1-CB 4.14Å; P234-A333 WeakPolarHBondContact CA-O 3.32Å; P234-A333 HydrophobicContact CB-CB 4.1Å; P234-A333 HydrophobicContact CG-CB 4.11Å; K235-A333 PolarHBondContact N-O 2.68Å; V286-A333 HydrophobicContact CG2-CB 3.9Å; A333-V341 CarbonylContact C-O 3.59Å; A333-V341 WeakPolarHBondContact CA-O 3.4Å; A333-L342 HydrophobicContact CB-CB 3.97Å
334	Q	95.5	Very high	92	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	142.5	-176.4	-59.6	-175.3	13.1	0	0	109.4	K235 I240 Q247 L249 V341	K235-Q334 HydrophobicContact CB-CG 4.18Å; K235-Q334 HydrophobicContact CD-CG 4.41Å; K235-Q334 HydrophobicContact CG-CG 4.46Å; I240-Q334 HydrophobicContact CD1-CB 3.81Å; I240-Q334 HydrophobicContact CD1-CG 4.35Å; I240-Q334 HydrophobicContact CG1-CB 4.19Å; I240-Q334 HydrophobicContact CG1-CG 4.17Å; Q247-Q334 PolarHBondContact O-NE2 3.03Å; L249-Q334 HydrophobicContact CB-CB 4.4Å; L249-Q334 HydrophobicContact CB-CG 4.28Å; L249-Q334 HydrophobicContact CD1-CB 4.45Å; L249-Q334 HydrophobicContact CD1-CG 4.12Å; L249-Q334 HydrophobicContact CG-CG 4.14Å; Q334-V341 PolarHBondContact N-O 2.83Å; Q334-V341 PolarHBondContact O-N 3.08Å
335	V	95.4	Very high	92.4	Very high	15 Å²	15	20 Å²	20	9%	0.091	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.6	167.4	-178.7	0	0	0	0	107.9	P234 K235 I240 P281 L284 G337 T339	P234-V335 HydrophobicContact CB-CG2 3.9Å; K235-V335 PolarHBondContact O-N 2.66Å; I240-V335 VanDerWaalsContact CD1-O 3.25Å; I240-V335 WeakPolarHBondContact CD1-O 3.39Å; P281-V335 HydrophobicContact CB-CG2 4.35Å; P281-V335 HydrophobicContact CG-CB 4.33Å; P281-V335 HydrophobicContact CG-CG2 4.09Å; L284-V335 HydrophobicContact CD1-CG2 3.69Å; V335-G337 WeakPolarHBondContact CG1-O 3.46Å; V335-T339 WeakPolarHBondContact CA-O 3.42Å
336	V	93.4	Very high	92.7	Very high	56 Å²	56	19.5 Å²	19.5	34%	0.339	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	103.1	177	-177.8	0	0	0	0	107.8	N338 T339 V341	V336-N338 PolarHBondContact O-N 2.76Å; V336-N338 VanDerWaalsContact O-N 3.15Å; V336-T339 PolarHBondContact N-O 2.83Å; V336-T339 PolarHBondContact O-N 2.65Å; V336-T339 VanDerWaalsContact O-N 3.1Å; V336-V341 HydrophobicContact CB-CG2 4.47Å; V336-V341 HydrophobicContact CG2-CG2 4.26Å
337	G	91.4	Very high	91.9	Very high	50 Å²	50	20.9 Å²	20.9	52%	0.515	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-112.5	-169.3	0	0	0	0	0	110.7	V335	V335-G337 WeakPolarHBondContact CG1-O 3.46Å
338	N	92.9	Very high	90.6	Very high	95 Å²	95	26.3 Å²	26.3	51%	0.508	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	14.5	178.1	-66	37.4	0	0	0	112.5	V275 P277 V336	V275-N338 PolarHBondContact N-O 3.41Å; P277-N338 WeakPolarHBondContact CG-ND2 3.13Å; V336-N338 PolarHBondContact O-N 2.76Å; V336-N338 VanDerWaalsContact O-N 3.15Å
339	T	95.4	Very high	88.8	Confident	27 Å²	27	30.8 Å²	30.8	17%	0.166	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120	-178.3	-57.9	0	0	0	0	109.1	A251 E272 V273 V335 V336 V341	A251-T339 HydrophobicContact CB-CG2 4.46Å; E272-T339 HydrophobicContact CB-CG2 3.86Å; E272-T339 HydrophobicContact CG-CG2 4.18Å; V273-T339 CarbonylContact O-C 3.56Å; V273-T339 WeakPolarHBondContact O-CA 3.45Å; V335-T339 WeakPolarHBondContact CA-O 3.42Å; V336-T339 PolarHBondContact N-O 2.83Å; V336-T339 PolarHBondContact O-N 2.65Å; V336-T339 VanDerWaalsContact O-N 3.1Å; T339-V341 HydrophobicContact CG2-CG2 4.04Å; T339-V341 PolarHBondContact O-N 3.39Å
340	L	97.1	Very high	86.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.7	163.9	-177.3	159.6	0	0	0	107.8	P234 E272 V273 V275 L284 V286 V295 L342	P234-L340 HydrophobicContact CB-CD1 4.37Å; P234-L340 HydrophobicContact CG-CD1 3.52Å; P234-L340 HydrophobicContact CG-CG 4.14Å; E272-L340 CarbonylContact C-O 3.56Å; E272-L340 WeakPolarHBondContact CA-O 3.35Å; V273-L340 HydrophobicContact CB-CB 4.44Å; V273-L340 PolarHBondContact N-O 2.96Å; V273-L340 PolarHBondContact O-N 3.21Å; V275-L340 HydrophobicContact CG2-CB 3.7Å; L284-L340 HydrophobicContact CB-CD1 4.31Å; L284-L340 HydrophobicContact CD1-CD1 4.02Å; V286-L340 HydrophobicContact CG2-CD1 4.42Å; V286-L340 HydrophobicContact CG2-CD2 4.34Å; V295-L340 HydrophobicContact CG1-CD1 3.63Å; V295-L340 HydrophobicContact CG1-CD2 4.26Å; V295-L340 HydrophobicContact CG2-CD2 4.28Å; L340-L342 HydrophobicContact CD2-CB 4.21Å; L340-L342 HydrophobicContact CD2-CD2 3.73Å; L340-L342 HydrophobicContact CD2-CG 4.35Å
341	V	96.8	Very high	84	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.3	174.3	-170.6	0	0	0	0	107.9	L249 A251 H270 V271 E272 A333 Q334 V336 T339	L249-V341 HydrophobicContact CB-CB 4.25Å; L249-V341 HydrophobicContact CB-CG1 3.92Å; L249-V341 HydrophobicContact CD1-CG1 4.28Å; L249-V341 WeakPolarHBondContact CD1-O 3.28Å; A251-V341 HydrophobicContact CB-CG2 3.81Å; H270-V341 VanDerWaalsContact CE1-CG1 3.43Å; H270-V341 WeakPolarHBondContact CE1-CG1 3.28Å; V271-V341 WeakPolarHBondContact O-CA 3.26Å; E272-V341 HydrophobicContact CG-CG2 4.38Å; A333-V341 CarbonylContact C-O 3.59Å; A333-V341 WeakPolarHBondContact CA-O 3.4Å; Q334-V341 PolarHBondContact N-O 2.83Å; Q334-V341 PolarHBondContact O-N 3.08Å; V336-V341 HydrophobicContact CB-CG2 4.47Å; V336-V341 HydrophobicContact CG2-CG2 4.26Å; T339-V341 HydrophobicContact CG2-CG2 4.04Å; T339-V341 PolarHBondContact O-N 3.39Å
342	L	95.8	Very high	81.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	146.2	171.5	70.4	92.8	0	0	0	111.2	L269 H270 V271 V286 V293 V295 V331 S332 A333 L340	L269-L342 HydrophobicContact CD1-CD1 3.32Å; H270-L342 WeakPolarHBondContact CA-O 3.38Å; V271-L342 HydrophobicContact CB-CD1 3.93Å; V271-L342 HydrophobicContact CB-CD2 3.99Å; V271-L342 HydrophobicContact CB-CG 3.76Å; V271-L342 HydrophobicContact CG1-CD2 4.41Å; V271-L342 HydrophobicContact CG2-CD1 3.93Å; V271-L342 HydrophobicContact CG2-CG 4.33Å; V271-L342 PolarHBondContact N-O 3.16Å; V271-L342 PolarHBondContact O-N 3.29Å; V286-L342 HydrophobicContact CG1-CD2 3.88Å; V286-L342 HydrophobicContact CG2-CD2 3.97Å; V293-L342 HydrophobicContact CG1-CD1 4.04Å; V293-L342 HydrophobicContact CG1-CD2 4.02Å; V295-L342 HydrophobicContact CG2-CD2 3.54Å; V331-L342 HydrophobicContact CG1-CB 4.49Å; S332-L342 CarbonylContact O-C 3.39Å; S332-L342 WeakPolarHBondContact O-CA 3.43Å; S332-L342 WeakPolarHBondContact O-CB 3.22Å; A333-L342 HydrophobicContact CB-CB 3.97Å; L340-L342 HydrophobicContact CD2-CB 4.21Å; L340-L342 HydrophobicContact CD2-CD2 3.73Å; L340-L342 HydrophobicContact CD2-CG 4.35Å
343	E	94.8	Very high	78.1	Confident	24 Å²	24	46.6 Å²	46.6	11%	0.112	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	146.4	172.4	-68.3	-166.2	177.7	0	0	111.6	L249 K252 R268 L269 H270 S332	L249-E343 HydrophobicContact CD2-CB 3.96Å; L249-E343 HydrophobicContact CD2-CG 3.89Å; K252-E343 IonicContact NZ-OE1 2.66Å; R268-E343 IonicContact NE-OE2 3.47Å; R268-E343 PolarHBondContact NE-OE2 2.99Å; L269-E343 WeakPolarHBondContact O-CA 3.39Å; H270-E343 HydrophobicContact CB-CG 4.13Å; H270-E343 IonicContact CE1-OE1 3.43Å; H270-E343 IonicContact CG-OE1 3.1Å; H270-E343 WeakPolarHBondContact ND1-CG 3.46Å; H270-E343 IonicContact ND1-OE1 3.94Å; H270-E343 PolarHBondContact ND1-OE1 3.18Å; S332-E343 PolarHBondContact N-O 2.84Å; S332-E343 PolarHBondContact O-N 2.78Å
344	A	92.5	Very high	75.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	146.4	172.4	0	0	0	0	0	111.1	R268 L269 V326 V331	R268-A344 CarbonylContact C-O 3.56Å; R268-A344 WeakPolarHBondContact CA-O 3.4Å; R268-A344 WeakPolarHBondContact CB-O 3.02Å; L269-A344 HydrophobicContact CD1-CB 4.44Å; L269-A344 HydrophobicContact CD2-CB 3.84Å; L269-A344 HydrophobicContact CG-CB 4.01Å; L269-A344 PolarHBondContact N-O 2.81Å; L269-A344 PolarHBondContact O-N 2.79Å; V326-A344 HydrophobicContact CG1-CB 3.45Å; V326-A344 VanDerWaalsContact CG1-CB 3.45Å; V331-A344 HydrophobicContact CB-CB 4.39Å; V331-A344 HydrophobicContact CG2-CB 3.88Å
345	P	89.5	Confident	74	Confident	36 Å²	36	59.2 Å²	59.2	23%	0.234	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	139.3	170.1	29.2	-34.1	0	0	0	110.3
346	L	83	Confident	72.9	Confident	23 Å²	23	61.5 Å²	61.5	12%	0.12	34%	0.341	C	S	.	.			trans	-77.4	127.9	166.7	-64.8	174.8	0	0	0	108.6	Y259 K267 L269 E324 V326 K348	Y259-L346 HydrophobicContact CD1-CD1 3.95Å; Y259-L346 HydrophobicContact CE1-CD1 3.88Å; K267-L346 HydrophobicContact CB-CD1 4.09Å; K267-L346 PolarHBondContact O-N 3.42Å; L269-L346 HydrophobicContact CB-CD2 4.31Å; L269-L346 HydrophobicContact CD2-CD2 4.22Å; E324-L346 HydrophobicContact CB-CD2 4.48Å; V326-L346 HydrophobicContact CG2-CD2 4.14Å; L346-K348 PolarHBondContact O-N 3.37Å
347	E	71.5	Confident	71.8	Confident	29 Å²	29	61.8 Å²	61.8	14%	0.136	34%	0.341	C	S	.	.			trans	-76	92.4	173.9	-70.5	-64.6	158.1	0	0	108.7	T325 Q349	T325-E347 HydrophobicContact CG2-CB 4.26Å; T325-E347 PolarHBondContact O-N 3.13Å; E347-Q349 PolarHBondContact O-N 3.04Å; E347-Q349 VanDerWaalsContact O-N 3.1Å
348	K	63.2	Low	70.6	Confident	115 Å²	115	62.5 Å²	62.5	50%	0.5	33%	0.33	S	S	.	.			trans	-54.9	121.1	170.4	-68.8	-176.3	-177.6	176	0	107.6	G265 L346 H350	G265-K348 PolarHBondContact O-NZ 3.22Å; G265-K348 VanDerWaalsContact O-NZ 3.13Å; L346-K348 PolarHBondContact O-N 3.37Å; K348-H350 PolarHBondContact O-N 3.27Å; K348-H350 PolarHBondContact O-ND1 3.15Å
349	Q	53.8	Low	69.2	Low	105 Å²	105	60.5 Å²	60.5	49%	0.491	32%	0.319	S	S	.	.			trans	-55.9	114.2	160.7	-71.9	-173.4	-12.3	0	0	105.5	H99 N124 E347 A351	H99-Q349 PolarHBondContact NE2-NE2 2.97Å; H99-Q349 VanDerWaalsContact NE2-NE2 3.11Å; N124-Q349 PolarHBondContact OD1-NE2 3Å; E347-Q349 PolarHBondContact O-N 3.04Å; E347-Q349 VanDerWaalsContact O-N 3.1Å; Q349-A351 PolarHBondContact O-N 2.91Å
350	H	47.2	Very low	67.5	Low	94 Å²	94	62.7 Å²	62.7	44%	0.435	33%	0.33	S	S	.	.			trans	-58.8	105.1	-176.3	-76.3	56.7	0	0	0	107.1	N162 K348 I352	N162-H350 PolarHBondContact ND2-CE1 2.98Å; N162-H350 PolarHBondContact ND2-NE2 2.75Å; K348-H350 PolarHBondContact O-N 3.27Å; K348-H350 PolarHBondContact O-ND1 3.15Å; H350-I352 PolarHBondContact O-N 2.73Å
351	A	33.3	Very low	65.4	Low	77 Å²	77	67.2 Å²	67.2	64%	0.636	35%	0.353	S	S	*	.			trans	-60.1	116.2	152.8	0	0	0	0	0	104	Q349 T353	Q349-A351 PolarHBondContact O-N 2.91Å; A351-T353 PolarHBondContact O-N 3.19Å
352	I	33.8	Very low	63	Low	94 Å²	94	72.4 Å²	72.4	48%	0.482	38%	0.38	S	S	.	.			trans	-58.7	107.4	172.8	-62.6	168.8	0	0	0	105	E92 H350 H354	E92-I352 WeakPolarHBondContact O-CD1 3.48Å; H350-I352 PolarHBondContact O-N 2.73Å; I352-H354 PolarHBondContact O-N 3.25Å
353	T	28.3	Very low	60.2	Low	136 Å²	136	78.4 Å²	78.4	83%	0.834	41%	0.412	S	S	*	.			trans	-65.9	117.2	171.7	-41.7	0	0	0	0	106.4	A351	A351-T353 PolarHBondContact O-N 3.19Å
354	H	32	Very low	57.1	Low	208 Å²	208	83.4 Å²	83.4	96%	0.963	44%	0.439	S	S	*	.			trans	-56.6	0	176.8	-70.6	-83.6	0	0	0	113.2	E92 I352	E92-H354 IonicContact OE1-CE1 3.42Å; E92-H354 IonicContact OE2-CE1 3.6Å; E92-H354 PolarHBondContact OE2-CE1 3.35Å; E92-H354 VanDerWaalsContact OE2-CE1 3.29Å; E92-H354 IonicContact OE2-NE2 3.29Å; I352-H354 PolarHBondContact O-N 3.25Å

Retrieved 354 of 354 residues in 140 ms (Link to these results)

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