A0A087YBE8_POEFO Loading...

Four and a half LIM domains 2

AlphaFold DB (A0A3B3VXK3), UniProt , Accession A0A087YBE8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 279 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.7	Very low	79.4	Confident	240 Å²	240	121.7 Å²	121.7	100%	1.182	57%	0.567	S	S	*	*				0	115.8	0	-69.9	174.3	-142.3	0	0	106.3	E3	M1-E3 PolarHBondContact O-N 3.3Å
2	T	55.7	Low	80.5	Confident	141 Å²	141	120.8 Å²	120.8	87%	0.865	56%	0.563	S	S	*	*			trans	-69.2	115	174.6	22.3	0	0	0	0	108	R4	T2-R4 PolarHBondContact O-N 3.16Å
3	E	60.9	Low	81.4	Confident	187 Å²	187	116.1 Å²	116.1	87%	0.874	55%	0.551	S	S	*	*			trans	-55.9	123.9	170.5	-73.3	-178.6	160.5	0	0	108.3	M1 Y5	M1-E3 PolarHBondContact O-N 3.3Å; E3-Y5 PolarHBondContact O-N 3.02Å; E3-Y5 VanDerWaalsContact O-N 3.16Å
4	R	70.6	Confident	82.1	Confident	222 Å²	222	108.1 Å²	108.1	84%	0.838	51%	0.513	S	S	*	.			trans	-72.7	109.5	178.1	-72.8	-169.2	-169.1	-172.8	4.2	108.4	T2 D6	T2-R4 PolarHBondContact O-N 3.16Å; R4-D6 PolarHBondContact O-N 3.22Å
5	Y	85.2	Confident	82.6	Confident	96 Å²	96	113.3 Å²	113.3	38%	0.376	53%	0.534	S	S	.	.			trans	-97.3	76.1	177.8	-150.6	-103.2	0	0	0	109.5	E3 L14 Y19 P26	E3-Y5 PolarHBondContact O-N 3.02Å; E3-Y5 VanDerWaalsContact O-N 3.16Å; Y5-L14 HydrophobicContact CD1-CB 4.13Å; Y5-L14 HydrophobicContact CD1-CD1 4.44Å; Y5-L14 WeakPolarHBondContact O-CB 3.22Å; Y5-L14 PolarHBondContact O-N 3.21Å; Y5-Y19 HydrophobicContact CE1-CD1 4.22Å; Y5-Y19 HydrophobicContact CE1-CD2 4.26Å; Y5-Y19 AromaticContact CE1-CE1 3.78Å; Y5-Y19 HydrophobicContact CE1-CE1 3.78Å; Y5-Y19 AromaticContact CE1-CE2 3.81Å; Y5-Y19 HydrophobicContact CE1-CE2 3.81Å; Y5-Y19 HydrophobicContact CE1-CG 4.45Å; Y5-Y19 AromaticContact CE1-CZ 3.56Å; Y5-Y19 AromaticContact CZ-CE2 3.93Å; Y5-Y19 AromaticContact CZ-CZ 3.87Å; Y5-Y19 WeakPolarHBondContact OH-CE2 3.16Å; Y5-Y19 VanDerWaalsContact OH-CZ 3.27Å; Y5-Y19 PolarHBondContact OH-OH 2.75Å; Y5-P26 HydrophobicContact CE1-CB 4.44Å
6	D	93.1	Very high	82.9	Confident	44 Å²	44	111.6 Å²	111.6	24%	0.235	56%	0.555	C	S	.	*	B	Isolated β-bridge	trans	-111.9	156.1	-173.8	-59.4	-29.1	0	0	0	111	R4 H8 E12 S13	R4-D6 PolarHBondContact O-N 3.22Å; D6-H8 PolarHBondContact O-N 3.31Å; D6-E12 CarbonylContact C-O 3.48Å; D6-E12 WeakPolarHBondContact CA-O 3.36Å; D6-S13 VanDerWaalsContact OD1-CA 3.24Å; D6-S13 WeakPolarHBondContact OD1-CA 3.44Å
7	C	91.9	Very high	83.2	Confident	1 Å²	1	111.3 Å²	111.3	1%	0.007	55%	0.55	C	S	.	.			trans	-60.6	126.8	175.7	178.8	0	0	0	0	110.5	Y9 C10 K11 E12 L14 P26 C28	C7-Y9 PolarHBondContact O-N 3.39Å; C7-Y9 VanDerWaalsContact O-N 3.15Å; C7-C10 WeakPolarHBondContact CB-SG 3.24Å; C7-K11 WeakPolarHBondContact O-CA 3.39Å; C7-K11 PolarHBondContact O-N 2.99Å; C7-E12 PolarHBondContact N-O 3.32Å; C7-L14 HydrophobicContact CB-CD2 4.01Å; C7-L14 HydrophobicContact CB-CG 4.31Å; C7-P26 CarbonylContact C-O 3.59Å; C7-P26 WeakPolarHBondContact CA-O 3.4Å; C7-C28 HydrophobicContact CB-CB 4.18Å; C7-C28 PolarHBondContact SG-N 3.28Å
8	H	92.3	Very high	83.5	Confident	81 Å²	81	113.8 Å²	113.8	38%	0.375	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57	-33.3	179.7	-178.3	-110.4	0	0	0	112.4	D6 K11 N25 P26 Y27	D6-H8 PolarHBondContact O-N 3.31Å; H8-K11 WeakPolarHBondContact O-CE 3.46Å; H8-K11 PolarHBondContact O-NZ 3.43Å; H8-N25 HydrophobicContact CB-CB 4.04Å; H8-N25 PolarHBondContact CD2-OD1 3.24Å; H8-P26 WeakPolarHBondContact CB-O 3.48Å; H8-P26 PolarHBondContact N-O 3.41Å; H8-Y27 HydrophobicContact CB-CE1 4.22Å; H8-Y27 HydrophobicContact CB-CE2 4.34Å; H8-Y27 AromaticContact ND1-CE1 3.94Å; H8-Y27 AromaticContact ND1-CZ 3.55Å; H8-Y27 PolarHBondContact ND1-OH 3.44Å; H8-Y27 VanDerWaalsContact ND1-OH 3.09Å
9	Y	92.2	Very high	83.8	Confident	142 Å²	142	113 Å²	113	56%	0.557	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-65.4	179.7	-172.4	-101.7	0	0	0	113.7	C7 C31 L35	C7-Y9 PolarHBondContact O-N 3.39Å; C7-Y9 VanDerWaalsContact O-N 3.15Å; Y9-C31 HydrophobicContact CD1-CB 4.12Å; Y9-C31 HydrophobicContact CG-CB 4.45Å; Y9-L35 HydrophobicContact CD1-CD1 4.42Å; Y9-L35 HydrophobicContact CD2-CD1 3.72Å; Y9-L35 HydrophobicContact CD2-CD2 4.42Å; Y9-L35 HydrophobicContact CE2-CD1 4.17Å; Y9-L35 HydrophobicContact CE2-CD2 4.03Å; Y9-L35 HydrophobicContact CG-CD1 3.85Å
10	C	93.1	Very high	83.9	Confident	50 Å²	50	109.1 Å²	109.1	34%	0.338	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.3	-173.5	68.5	0	0	0	0	114.8	C7 E12 C31	C7-C10 WeakPolarHBondContact CB-SG 3.24Å; C10-E12 PolarHBondContact O-N 2.97Å; C10-E12 VanDerWaalsContact O-N 3.08Å; C10-C31 VanDerWaalsContact SG-SG 3.63Å
11	K	92.7	Very high	84.2	Confident	135 Å²	135	108.4 Å²	108.4	59%	0.587	53%	0.53	S	S	*	.			trans	60.3	11.9	-178.4	-47.5	-55.5	-173.9	-171	0	115.4	C7 H8	C7-K11 WeakPolarHBondContact O-CA 3.39Å; C7-K11 PolarHBondContact O-N 2.99Å; H8-K11 WeakPolarHBondContact O-CE 3.46Å; H8-K11 PolarHBondContact O-NZ 3.43Å
12	E	92.6	Very high	86.2	Confident	111 Å²	111	101.2 Å²	101.2	52%	0.519	49%	0.489	S	S	.	.			trans	-72	145.2	171.1	-72.5	-167.4	-174.5	0	0	111.8	D6 C7 C10 L14 K17	D6-E12 CarbonylContact C-O 3.48Å; D6-E12 WeakPolarHBondContact CA-O 3.36Å; C7-E12 PolarHBondContact N-O 3.32Å; C10-E12 PolarHBondContact O-N 2.97Å; C10-E12 VanDerWaalsContact O-N 3.08Å; E12-L14 PolarHBondContact O-N 2.96Å; E12-K17 IonicContact OE2-NZ 3.44Å; E12-K17 PolarHBondContact OE2-NZ 3.02Å
13	S	92.5	Very high	87.8	Confident	59 Å²	59	101.5 Å²	101.5	41%	0.413	48%	0.481	S	S	.	.	B	Isolated β-bridge	trans	-60.4	131.5	173.8	-172.1	0	0	0	0	112.5	D6 F15 K17	D6-S13 VanDerWaalsContact OD1-CA 3.24Å; D6-S13 WeakPolarHBondContact OD1-CA 3.44Å; S13-F15 PolarHBondContact OG-N 3.13Å; S13-K17 WeakPolarHBondContact O-CD 3.4Å; S13-K17 PolarHBondContact O-NZ 3.2Å; S13-K17 VanDerWaalsContact O-NZ 3.13Å
14	L	91.2	Very high	89.1	Confident	4 Å²	4	100 Å²	100	2%	0.021	48%	0.479	C	S	.	.			trans	-94.4	1	176.3	-60.9	175.5	0	0	0	112.9	Y5 C7 E12 G16 K17 Y19 P26 C28	Y5-L14 HydrophobicContact CD1-CB 4.13Å; Y5-L14 HydrophobicContact CD1-CD1 4.44Å; Y5-L14 WeakPolarHBondContact O-CB 3.22Å; Y5-L14 PolarHBondContact O-N 3.21Å; C7-L14 HydrophobicContact CB-CD2 4.01Å; C7-L14 HydrophobicContact CB-CG 4.31Å; E12-L14 PolarHBondContact O-N 2.96Å; L14-G16 PolarHBondContact O-N 3.02Å; L14-K17 PolarHBondContact O-N 3.46Å; L14-Y19 HydrophobicContact CD1-CG 4.23Å; L14-P26 HydrophobicContact CD1-CB 3.64Å; L14-P26 HydrophobicContact CD1-CG 4.22Å; L14-C28 HydrophobicContact CD2-CB 3.5Å
15	F	89.9	Confident	90.1	Very high	187 Å²	187	92 Å²	92	82%	0.82	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	123.7	-178.7	-166.3	-93.9	0	0	0	111	S13 K17	S13-F15 PolarHBondContact OG-N 3.13Å; F15-K17 PolarHBondContact O-N 2.99Å
16	G	86.2	Confident	90.4	Very high	85 Å²	85	88.5 Å²	88.5	88%	0.876	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	6.7	-176.6	0	0	0	0	0	115.4	L14	L14-G16 PolarHBondContact O-N 3.02Å
17	K	88.6	Confident	90.3	Very high	107 Å²	107	87 Å²	87	47%	0.465	43%	0.433	S	S	.	.	S	Bend	trans	-108	152.8	177.7	-63.4	-179.5	-172.9	163.8	0	110.8	E12 S13 L14 F15	E12-K17 IonicContact OE2-NZ 3.44Å; E12-K17 PolarHBondContact OE2-NZ 3.02Å; S13-K17 WeakPolarHBondContact O-CD 3.4Å; S13-K17 PolarHBondContact O-NZ 3.2Å; S13-K17 VanDerWaalsContact O-NZ 3.13Å; L14-K17 PolarHBondContact O-N 3.46Å; F15-K17 PolarHBondContact O-N 2.99Å
18	K	88.4	Confident	90.3	Very high	157 Å²	157	87.6 Å²	87.6	68%	0.683	44%	0.437	S	S	*	.			trans	-67.2	140.3	168.8	-66.8	-174.9	178.8	-176.2	0	109.9	V29	K18-V29 HydrophobicContact CB-CG2 3.84Å
19	Y	88.7	Confident	90.1	Very high	98 Å²	98	85 Å²	85	38%	0.384	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	163.6	177.7	67.5	-86.3	0	0	0	110.2	Y5 L14 L21 P26 Y27	Y5-Y19 HydrophobicContact CE1-CD1 4.22Å; Y5-Y19 HydrophobicContact CE1-CD2 4.26Å; Y5-Y19 AromaticContact CE1-CE1 3.78Å; Y5-Y19 HydrophobicContact CE1-CE1 3.78Å; Y5-Y19 AromaticContact CE1-CE2 3.81Å; Y5-Y19 HydrophobicContact CE1-CE2 3.81Å; Y5-Y19 HydrophobicContact CE1-CG 4.45Å; Y5-Y19 AromaticContact CE1-CZ 3.56Å; Y5-Y19 AromaticContact CZ-CE2 3.93Å; Y5-Y19 AromaticContact CZ-CZ 3.87Å; Y5-Y19 WeakPolarHBondContact OH-CE2 3.16Å; Y5-Y19 VanDerWaalsContact OH-CZ 3.27Å; Y5-Y19 PolarHBondContact OH-OH 2.75Å; L14-Y19 HydrophobicContact CD1-CG 4.23Å; Y19-L21 HydrophobicContact CD2-CD2 4.38Å; Y19-L21 HydrophobicContact CD2-CG 4.22Å; Y19-L21 HydrophobicContact CE2-CD1 4.16Å; Y19-L21 HydrophobicContact CE2-CD2 4.03Å; Y19-L21 HydrophobicContact CE2-CG 3.79Å; Y19-P26 HydrophobicContact CD2-CB 4.09Å; Y19-Y27 CarbonylContact C-O 3.57Å; Y19-Y27 VanDerWaalsContact CA-O 3.25Å; Y19-Y27 WeakPolarHBondContact CA-O 3.25Å; Y19-Y27 VanDerWaalsContact CB-O 3.3Å; Y19-Y27 WeakPolarHBondContact CB-O 3.3Å
20	V	87.4	Confident	89.9	Confident	34 Å²	34	86.5 Å²	86.5	21%	0.206	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.8	177.5	-174.7	0	0	0	0	108.2	Y27 Y32 C49	V20-Y27 PolarHBondContact N-O 3.08Å; V20-Y27 PolarHBondContact O-N 2.82Å; V20-Y32 HydrophobicContact CB-CD1 4.33Å; V20-Y32 HydrophobicContact CB-CD2 3.72Å; V20-Y32 HydrophobicContact CB-CE2 4.16Å; V20-Y32 HydrophobicContact CB-CG 3.82Å; V20-Y32 HydrophobicContact CG1-CD1 4.27Å; V20-Y32 HydrophobicContact CG1-CD2 3.61Å; V20-Y32 HydrophobicContact CG1-CE1 4.19Å; V20-Y32 HydrophobicContact CG1-CE2 3.5Å; V20-Y32 VanDerWaalsContact CG1-CE2 3.5Å; V20-Y32 HydrophobicContact CG1-CG 4Å; V20-Y32 HydrophobicContact CG2-CD1 4.19Å; V20-Y32 HydrophobicContact CG2-CD2 4.44Å; V20-Y32 HydrophobicContact CG2-CG 4.05Å; V20-C49 HydrophobicContact CG2-CB 4.46Å
21	L	89.7	Confident	89.8	Confident	96 Å²	96	84.7 Å²	84.7	50%	0.503	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.9	174.3	-70	167.4	0	0	0	109.6	Y19 P26	Y19-L21 HydrophobicContact CD2-CD2 4.38Å; Y19-L21 HydrophobicContact CD2-CG 4.22Å; Y19-L21 HydrophobicContact CE2-CD1 4.16Å; Y19-L21 HydrophobicContact CE2-CD2 4.03Å; Y19-L21 HydrophobicContact CE2-CG 3.79Å; L21-P26 HydrophobicContact CD2-CB 3.82Å
22	R	87.1	Confident	89.6	Confident	89 Å²	89	80.9 Å²	80.9	34%	0.336	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	121.2	173	-172	178.9	-174	-89.2	0.2	108.2	D24 N25 Y27 Y32 Y36	R22-D24 VanDerWaalsContact C-N 3.25Å; R22-D24 PolarHBondContact O-N 2.85Å; R22-N25 PolarHBondContact N-O 3.15Å; R22-N25 WeakPolarHBondContact O-CB 3.18Å; R22-N25 PolarHBondContact O-N 2.91Å; R22-Y27 HydrophobicContact CB-CD2 4.29Å; R22-Y27 HydrophobicContact CB-CE2 4.13Å; R22-Y32 HydrophobicContact CB-CE2 4.21Å; R22-Y36 VanDerWaalsContact CZ-CE1 3.5Å
23	E	89.8	Confident	89.3	Confident	146 Å²	146	78.2 Å²	78.2	68%	0.682	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	48.5	-177	-59.3	169.5	165.1	0	0	111.2	N25	E23-N25 PolarHBondContact O-N 2.77Å; E23-N25 PolarHBondContact O-ND2 2.88Å
24	D	88.6	Confident	89	Confident	155 Å²	155	80.1 Å²	80.1	83%	0.829	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	2.9	-177	-55.8	-45.1	0	0	0	116.5	R22	R22-D24 VanDerWaalsContact C-N 3.25Å; R22-D24 PolarHBondContact O-N 2.85Å
25	N	91	Very high	88.8	Confident	56 Å²	56	83.2 Å²	83.2	30%	0.299	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.1	176.8	-70	-68.8	0	0	0	111.1	H8 R22 E23 Y27	H8-N25 HydrophobicContact CB-CB 4.04Å; H8-N25 PolarHBondContact CD2-OD1 3.24Å; R22-N25 PolarHBondContact N-O 3.15Å; R22-N25 WeakPolarHBondContact O-CB 3.18Å; R22-N25 PolarHBondContact O-N 2.91Å; E23-N25 PolarHBondContact O-N 2.77Å; E23-N25 PolarHBondContact O-ND2 2.88Å; N25-Y27 HydrophobicContact CB-CD2 4.46Å; N25-Y27 HydrophobicContact CB-CE2 3.67Å; N25-Y27 WeakPolarHBondContact O-CD2 3.48Å; N25-Y27 WeakPolarHBondContact O-CE2 3.5Å
26	P	91.8	Very high	88.7	Confident	21 Å²	21	77.6 Å²	77.6	14%	0.136	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.1	178.7	32.5	-34.3	0	0	0	111.6	Y5 C7 H8 L14 Y19 L21	Y5-P26 HydrophobicContact CE1-CB 4.44Å; C7-P26 CarbonylContact C-O 3.59Å; C7-P26 WeakPolarHBondContact CA-O 3.4Å; H8-P26 WeakPolarHBondContact CB-O 3.48Å; H8-P26 PolarHBondContact N-O 3.41Å; L14-P26 HydrophobicContact CD1-CB 3.64Å; L14-P26 HydrophobicContact CD1-CG 4.22Å; Y19-P26 HydrophobicContact CD2-CB 4.09Å; L21-P26 HydrophobicContact CD2-CB 3.82Å
27	Y	91.3	Very high	88.9	Confident	13 Å²	13	74.6 Å²	74.6	5%	0.051	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.2	175.7	-66.3	-99.6	0	0	0	110	H8 Y19 V20 R22 N25 L35 Y36	H8-Y27 HydrophobicContact CB-CE1 4.22Å; H8-Y27 HydrophobicContact CB-CE2 4.34Å; H8-Y27 AromaticContact ND1-CE1 3.94Å; H8-Y27 AromaticContact ND1-CZ 3.55Å; H8-Y27 PolarHBondContact ND1-OH 3.44Å; H8-Y27 VanDerWaalsContact ND1-OH 3.09Å; Y19-Y27 CarbonylContact C-O 3.57Å; Y19-Y27 VanDerWaalsContact CA-O 3.25Å; Y19-Y27 WeakPolarHBondContact CA-O 3.25Å; Y19-Y27 VanDerWaalsContact CB-O 3.3Å; Y19-Y27 WeakPolarHBondContact CB-O 3.3Å; V20-Y27 PolarHBondContact N-O 3.08Å; V20-Y27 PolarHBondContact O-N 2.82Å; R22-Y27 HydrophobicContact CB-CD2 4.29Å; R22-Y27 HydrophobicContact CB-CE2 4.13Å; N25-Y27 HydrophobicContact CB-CD2 4.46Å; N25-Y27 HydrophobicContact CB-CE2 3.67Å; N25-Y27 WeakPolarHBondContact O-CD2 3.48Å; N25-Y27 WeakPolarHBondContact O-CE2 3.5Å; Y27-L35 HydrophobicContact CD1-CD1 4.15Å; Y27-L35 HydrophobicContact CE1-CD1 3.97Å; Y27-Y36 HydrophobicContact CD1-CE2 4.26Å; Y27-Y36 HydrophobicContact CE1-CE2 4.02Å; Y27-Y36 HydrophobicContact CE2-CE2 4.44Å; Y27-Y36 PolarHBondContact OH-OH 3.23Å
28	C	91.5	Very high	89.1	Confident	14 Å²	14	72.6 Å²	72.6	10%	0.095	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	150.9	167.1	80.5	0	0	0	0	109.2	C7 L14 K30 C31 Y32	C7-C28 HydrophobicContact CB-CB 4.18Å; C7-C28 PolarHBondContact SG-N 3.28Å; L14-C28 HydrophobicContact CD2-CB 3.5Å; C28-K30 PolarHBondContact O-N 3.09Å; C28-K30 VanDerWaalsContact O-N 3.17Å; C28-C31 PolarHBondContact O-N 3.24Å; C28-C31 PolarHBondContact SG-N 3.32Å; C28-C31 VanDerWaalsContact SG-N 3.37Å; C28-C31 PolarHBondContact SG-SG 3.4Å; C28-Y32 PolarHBondContact O-N 3.35Å
29	V	87.9	Confident	89.3	Confident	26 Å²	26	68.9 Å²	68.9	16%	0.158	35%	0.348	C	S	.	.	H	α-helix	trans	-51.4	-44	-177.4	173.7	0	0	0	0	111.7	K18 C31 Y32 E33	K18-V29 HydrophobicContact CB-CG2 3.84Å; V29-C31 PolarHBondContact O-N 3.43Å; V29-Y32 PolarHBondContact O-N 2.84Å; V29-E33 HydrophobicContact CG1-CG 4.12Å; V29-E33 WeakPolarHBondContact CG1-OE1 3.38Å; V29-E33 WeakPolarHBondContact O-CB 3.47Å; V29-E33 VanDerWaalsContact O-CG 3.23Å; V29-E33 WeakPolarHBondContact O-CG 3.31Å; V29-E33 PolarHBondContact O-N 3.37Å
30	K	88.3	Confident	89.6	Confident	173 Å²	173	64.2 Å²	64.2	75%	0.752	33%	0.33	S	S	*	.	H	α-helix	trans	-60.4	-44.6	178.7	-65.1	-177.6	-179.9	178.9	0	113.1	C28 S34	C28-K30 PolarHBondContact O-N 3.09Å; C28-K30 VanDerWaalsContact O-N 3.17Å; K30-S34 VanDerWaalsContact O-CB 3.31Å; K30-S34 WeakPolarHBondContact O-CB 3.42Å; K30-S34 PolarHBondContact O-N 2.88Å
31	C	90	Very high	89.9	Confident	13 Å²	13	65.9 Å²	65.9	9%	0.088	34%	0.335	C	S	.	.	H	α-helix	trans	-70.6	-40.7	179.3	-69.3	0	0	0	0	111.2	Y9 C10 C28 V29 S34 L35	Y9-C31 HydrophobicContact CD1-CB 4.12Å; Y9-C31 HydrophobicContact CG-CB 4.45Å; C10-C31 VanDerWaalsContact SG-SG 3.63Å; C28-C31 PolarHBondContact O-N 3.24Å; C28-C31 PolarHBondContact SG-N 3.32Å; C28-C31 VanDerWaalsContact SG-N 3.37Å; C28-C31 PolarHBondContact SG-SG 3.4Å; V29-C31 PolarHBondContact O-N 3.43Å; C31-S34 PolarHBondContact O-N 2.89Å; C31-L35 WeakPolarHBondContact O-CB 3.19Å; C31-L35 WeakPolarHBondContact O-CD1 3.23Å; C31-L35 WeakPolarHBondContact O-CG 3.34Å; C31-L35 PolarHBondContact O-N 3.05Å
32	Y	88.8	Confident	90	Very high	55 Å²	55	66 Å²	66	22%	0.216	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-49	175.6	-175.2	-88.6	0	0	0	110.9	V20 R22 C28 V29 S34 L35 Y36 C49	V20-Y32 HydrophobicContact CB-CD1 4.33Å; V20-Y32 HydrophobicContact CB-CD2 3.72Å; V20-Y32 HydrophobicContact CB-CE2 4.16Å; V20-Y32 HydrophobicContact CB-CG 3.82Å; V20-Y32 HydrophobicContact CG1-CD1 4.27Å; V20-Y32 HydrophobicContact CG1-CD2 3.61Å; V20-Y32 HydrophobicContact CG1-CE1 4.19Å; V20-Y32 HydrophobicContact CG1-CE2 3.5Å; V20-Y32 VanDerWaalsContact CG1-CE2 3.5Å; V20-Y32 HydrophobicContact CG1-CG 4Å; V20-Y32 HydrophobicContact CG2-CD1 4.19Å; V20-Y32 HydrophobicContact CG2-CD2 4.44Å; V20-Y32 HydrophobicContact CG2-CG 4.05Å; R22-Y32 HydrophobicContact CB-CE2 4.21Å; C28-Y32 PolarHBondContact O-N 3.35Å; V29-Y32 PolarHBondContact O-N 2.84Å; Y32-S34 VanDerWaalsContact C-N 3.34Å; Y32-S34 PolarHBondContact O-N 3.43Å; Y32-L35 PolarHBondContact O-N 3.03Å; Y32-Y36 AromaticContact CD2-CD2 3.59Å; Y32-Y36 HydrophobicContact CD2-CD2 3.59Å; Y32-Y36 HydrophobicContact CD2-CE2 4.26Å; Y32-Y36 AromaticContact CE2-CD2 3.78Å; Y32-Y36 HydrophobicContact CE2-CD2 3.78Å; Y32-Y36 HydrophobicContact CE2-CG 4.36Å; Y32-Y36 HydrophobicContact CG-CD2 4.12Å; Y32-Y36 WeakPolarHBondContact O-CB 3.35Å; Y32-Y36 PolarHBondContact O-N 3.17Å; Y32-C49 HydrophobicContact CD1-CB 4.4Å; Y32-C49 HydrophobicContact CE1-CB 4.43Å
33	E	87.5	Confident	90.4	Very high	54 Å²	54	63.9 Å²	63.9	25%	0.252	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-43.1	178.4	-71.7	176.7	163	0	0	111.6	V29 L35 S37 G48 C49	V29-E33 HydrophobicContact CG1-CG 4.12Å; V29-E33 WeakPolarHBondContact CG1-OE1 3.38Å; V29-E33 WeakPolarHBondContact O-CB 3.47Å; V29-E33 VanDerWaalsContact O-CG 3.23Å; V29-E33 WeakPolarHBondContact O-CG 3.31Å; V29-E33 PolarHBondContact O-N 3.37Å; E33-L35 VanDerWaalsContact C-N 3.3Å; E33-L35 PolarHBondContact O-N 2.98Å; E33-S37 VanDerWaalsContact CA-OG 3.23Å; E33-S37 WeakPolarHBondContact CA-OG 3.15Å; E33-S37 WeakPolarHBondContact O-CB 3.17Å; E33-S37 PolarHBondContact O-N 3.1Å; E33-S37 VanDerWaalsContact O-N 3.13Å; E33-S37 PolarHBondContact O-OG 3.11Å; E33-G48 WeakPolarHBondContact OE1-CA 3.27Å; E33-C49 PolarHBondContact OE1-N 3.05Å
34	S	86.2	Confident	90.5	Very high	100 Å²	100	62.8 Å²	62.8	70%	0.699	33%	0.325	S	S	*	.	H	α-helix	trans	-65.8	-30	178.7	-176.1	0	0	0	0	114.1	K30 C31 Y32	K30-S34 VanDerWaalsContact O-CB 3.31Å; K30-S34 WeakPolarHBondContact O-CB 3.42Å; K30-S34 PolarHBondContact O-N 2.88Å; C31-S34 PolarHBondContact O-N 2.89Å; Y32-S34 VanDerWaalsContact C-N 3.34Å; Y32-S34 PolarHBondContact O-N 3.43Å
35	L	86.9	Confident	90.7	Very high	68 Å²	68	62.1 Å²	62.1	36%	0.356	31%	0.314	S	S	.	.	H	α-helix	trans	-97	-29.2	-173.5	-67.8	169.5	0	0	0	112.7	Y9 Y27 C31 Y32 E33	Y9-L35 HydrophobicContact CD1-CD1 4.42Å; Y9-L35 HydrophobicContact CD2-CD1 3.72Å; Y9-L35 HydrophobicContact CD2-CD2 4.42Å; Y9-L35 HydrophobicContact CE2-CD1 4.17Å; Y9-L35 HydrophobicContact CE2-CD2 4.03Å; Y9-L35 HydrophobicContact CG-CD1 3.85Å; Y27-L35 HydrophobicContact CD1-CD1 4.15Å; Y27-L35 HydrophobicContact CE1-CD1 3.97Å; C31-L35 WeakPolarHBondContact O-CB 3.19Å; C31-L35 WeakPolarHBondContact O-CD1 3.23Å; C31-L35 WeakPolarHBondContact O-CG 3.34Å; C31-L35 PolarHBondContact O-N 3.05Å; Y32-L35 PolarHBondContact O-N 3.03Å; E33-L35 VanDerWaalsContact C-N 3.3Å; E33-L35 PolarHBondContact O-N 2.98Å
36	Y	87.7	Confident	90.7	Very high	69 Å²	69	63 Å²	63	27%	0.271	32%	0.323	S	S	.	.	H	α-helix	trans	-135.7	-5.4	-164.6	-50.5	-62.5	0	0	0	114.8	R22 Y27 Y32	R22-Y36 VanDerWaalsContact CZ-CE1 3.5Å; Y27-Y36 HydrophobicContact CD1-CE2 4.26Å; Y27-Y36 HydrophobicContact CE1-CE2 4.02Å; Y27-Y36 HydrophobicContact CE2-CE2 4.44Å; Y27-Y36 PolarHBondContact OH-OH 3.23Å; Y32-Y36 AromaticContact CD2-CD2 3.59Å; Y32-Y36 HydrophobicContact CD2-CD2 3.59Å; Y32-Y36 HydrophobicContact CD2-CE2 4.26Å; Y32-Y36 AromaticContact CE2-CD2 3.78Å; Y32-Y36 HydrophobicContact CE2-CD2 3.78Å; Y32-Y36 HydrophobicContact CE2-CG 4.36Å; Y32-Y36 HydrophobicContact CG-CD2 4.12Å; Y32-Y36 WeakPolarHBondContact O-CB 3.35Å; Y32-Y36 PolarHBondContact O-N 3.17Å
37	S	89.5	Confident	90.6	Very high	23 Å²	23	62.3 Å²	62.3	16%	0.161	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-69.9	136.4	176.4	-78.9	0	0	0	0	111.8	E33 I47	E33-S37 VanDerWaalsContact CA-OG 3.23Å; E33-S37 WeakPolarHBondContact CA-OG 3.15Å; E33-S37 WeakPolarHBondContact O-CB 3.17Å; E33-S37 PolarHBondContact O-N 3.1Å; E33-S37 VanDerWaalsContact O-N 3.13Å; E33-S37 PolarHBondContact O-OG 3.11Å; S37-I47 WeakPolarHBondContact CB-O 3.46Å; S37-I47 PolarHBondContact OG-O 3.02Å
38	N	92.3	Very high	90.3	Very high	64 Å²	64	62.3 Å²	62.3	34%	0.342	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-66.3	149.1	166.4	-65.2	-47.5	0	0	0	110.4	I47 D53 H60	N38-I47 HydrophobicContact CB-CD1 4.5Å; N38-I47 PolarHBondContact O-N 3.41Å; N38-D53 PolarHBondContact ND2-OD2 3.31Å; N38-H60 HydrophobicContact CB-CB 3.76Å; N38-H60 VanDerWaalsContact CB-CG 3.46Å; N38-H60 VanDerWaalsContact CG-CE1 3.46Å; N38-H60 PolarHBondContact ND2-CE1 3.4Å; N38-H60 PolarHBondContact ND2-ND1 3.13Å
39	T	93.1	Very high	89.5	Confident	80 Å²	80	64.2 Å²	64.2	49%	0.491	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-93.9	129.1	177.8	-60.6	0	0	0	0	110	E41	T39-E41 PolarHBondContact O-N 3.05Å
40	C	94.3	Very high	89.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-65.8	128.1	177	177.3	0	0	0	0	111	E42 C43 K44 K45 I47 H60 H62 C65	C40-E42 VanDerWaalsContact C-N 3.33Å; C40-E42 PolarHBondContact O-N 2.79Å; C40-C43 VanDerWaalsContact CB-SG 3.59Å; C40-K44 WeakPolarHBondContact O-CA 3.22Å; C40-K44 PolarHBondContact O-N 3.14Å; C40-K45 WeakPolarHBondContact CB-O 3.49Å; C40-K45 PolarHBondContact N-O 3.35Å; C40-I47 HydrophobicContact CB-CD1 4.21Å; C40-I47 HydrophobicContact CB-CG1 3.92Å; C40-H60 CarbonylContact C-O 3.56Å; C40-H60 WeakPolarHBondContact CA-O 3.49Å; C40-H62 WeakPolarHBondContact CB-ND1 3.23Å; C40-H62 PolarHBondContact SG-ND1 2.84Å; C40-C65 VanDerWaalsContact SG-CB 3.52Å; C40-C65 VanDerWaalsContact SG-SG 3.61Å
41	E	94.1	Very high	88.9	Confident	69 Å²	69	63.6 Å²	63.6	32%	0.322	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-28.9	-176	-171.1	56.5	-141.6	0	0	112.6	T39 K44 H60 W61	T39-E41 PolarHBondContact O-N 3.05Å; E41-K44 VanDerWaalsContact O-CE 3.26Å; E41-K44 WeakPolarHBondContact O-CE 3.11Å; E41-K44 PolarHBondContact O-NZ 2.99Å; E41-K44 IonicContact OE1-NZ 2.84Å; E41-K44 PolarHBondContact OE1-NZ 2.75Å; E41-K44 IonicContact OE2-NZ 2.65Å; E41-K44 PolarHBondContact OE2-NZ 3.28Å; E41-H60 WeakPolarHBondContact CB-O 3.42Å; E41-H60 PolarHBondContact N-O 3.38Å; E41-W61 HydrophobicContact CB-CD2 4.24Å; E41-W61 HydrophobicContact CB-CZ2 3.92Å; E41-W61 HydrophobicContact CG-CZ2 3.97Å
42	E	92.9	Very high	88.8	Confident	97 Å²	97	67.7 Å²	67.7	45%	0.453	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-53.4	178.2	-167.6	-161.2	-154.9	0	0	112.4	C40 C65	C40-E42 VanDerWaalsContact C-N 3.33Å; C40-E42 PolarHBondContact O-N 2.79Å; E42-C65 HydrophobicContact CB-CB 3.84Å; E42-C65 WeakPolarHBondContact OE2-CA 3.41Å; E42-C65 WeakPolarHBondContact OE2-CB 3.4Å; E42-C65 PolarHBondContact OE2-SG 2.94Å
43	C	94	Very high	88.9	Confident	45 Å²	45	67.9 Å²	67.9	30%	0.304	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-4.9	-170.8	73.1	0	0	0	0	114.5	C40 K45 H62	C40-C43 VanDerWaalsContact CB-SG 3.59Å; C43-K45 PolarHBondContact O-N 3.33Å; C43-K45 VanDerWaalsContact O-N 3.13Å; C43-H62 VanDerWaalsContact SG-CE1 3.5Å; C43-H62 PolarHBondContact SG-ND1 3.46Å; C43-H62 VanDerWaalsContact SG-ND1 3.38Å
44	K	93.6	Very high	89.2	Confident	124 Å²	124	66.9 Å²	66.9	54%	0.539	36%	0.356	S	S	.	.			trans	58.7	19.5	-179.9	-50.8	-52.7	-170.6	-168.5	0	114.9	C40 E41	C40-K44 WeakPolarHBondContact O-CA 3.22Å; C40-K44 PolarHBondContact O-N 3.14Å; E41-K44 VanDerWaalsContact O-CE 3.26Å; E41-K44 WeakPolarHBondContact O-CE 3.11Å; E41-K44 PolarHBondContact O-NZ 2.99Å; E41-K44 IonicContact OE1-NZ 2.84Å; E41-K44 PolarHBondContact OE1-NZ 2.75Å; E41-K44 IonicContact OE2-NZ 2.65Å; E41-K44 PolarHBondContact OE2-NZ 3.28Å
45	K	91.7	Very high	89.6	Confident	140 Å²	140	66.2 Å²	66.2	61%	0.609	35%	0.351	S	S	*	.			trans	-97.8	150.1	174.8	-63.6	178.3	-176.4	178.5	0	110.9	C40 C43	C40-K45 WeakPolarHBondContact CB-O 3.49Å; C40-K45 PolarHBondContact N-O 3.35Å; C43-K45 PolarHBondContact O-N 3.33Å; C43-K45 VanDerWaalsContact O-N 3.13Å
46	P	90.5	Very high	89.8	Confident	76 Å²	76	66.9 Å²	66.9	49%	0.494	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-62.8	137.7	174.2	26.1	-33.6	0	0	0	110.9	G48	P46-G48 PolarHBondContact O-N 3.13Å
47	I	91.2	Very high	90	Very high	6 Å²	6	70.1 Å²	70.1	3%	0.031	37%	0.365	C	S	.	.			trans	-84	106.7	174.9	-57.1	172.2	0	0	0	107.2	S37 N38 C40 T51 D53 H60	S37-I47 WeakPolarHBondContact CB-O 3.46Å; S37-I47 PolarHBondContact OG-O 3.02Å; N38-I47 HydrophobicContact CB-CD1 4.5Å; N38-I47 PolarHBondContact O-N 3.41Å; C40-I47 HydrophobicContact CB-CD1 4.21Å; C40-I47 HydrophobicContact CB-CG1 3.92Å; I47-T51 WeakPolarHBondContact CG2-OG1 3.35Å; I47-D53 HydrophobicContact CG2-CB 3.96Å; I47-H60 HydrophobicContact CD1-CB 3.64Å
48	G	83.8	Confident	90	Very high	12 Å²	12	76.6 Å²	76.6	12%	0.124	40%	0.398	C	S	.	.			trans	-64.9	157.7	-177.9	0	0	0	0	0	112.7	E33 P46 N50 T51	E33-G48 WeakPolarHBondContact OE1-CA 3.27Å; P46-G48 PolarHBondContact O-N 3.13Å; G48-N50 PolarHBondContact O-N 3.4Å; G48-T51 PolarHBondContact O-N 3.01Å; G48-T51 VanDerWaalsContact O-N 3.11Å; G48-T51 PolarHBondContact O-OG1 3.07Å; G48-T51 VanDerWaalsContact O-OG1 3.1Å
49	C	76.1	Confident	90	Very high	54 Å²	54	76.7 Å²	76.7	37%	0.365	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-11.7	-178.8	67.3	0	0	0	0	113.8	V20 Y32 E33	V20-C49 HydrophobicContact CG2-CB 4.46Å; Y32-C49 HydrophobicContact CD1-CB 4.4Å; Y32-C49 HydrophobicContact CE1-CB 4.43Å; E33-C49 PolarHBondContact OE1-N 3.05Å
50	N	78.9	Confident	90.1	Very high	114 Å²	114	74.6 Å²	74.6	61%	0.61	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-2.7	179.8	-59.4	-51.6	0	0	0	113.3	G48	G48-N50 PolarHBondContact O-N 3.4Å
51	T	83.1	Confident	90.2	Very high	72 Å²	72	75.3 Å²	75.3	44%	0.442	38%	0.381	S	S	.	.	S	Bend	trans	-111.8	151.5	178.5	57.6	0	0	0	0	110.2	I47 G48 D53	I47-T51 WeakPolarHBondContact CG2-OG1 3.35Å; G48-T51 PolarHBondContact O-N 3.01Å; G48-T51 VanDerWaalsContact O-N 3.11Å; G48-T51 PolarHBondContact O-OG1 3.07Å; G48-T51 VanDerWaalsContact O-OG1 3.1Å; T51-D53 PolarHBondContact O-N 3.27Å
52	R	87.8	Confident	90.2	Very high	99 Å²	99	73.6 Å²	73.6	37%	0.374	37%	0.373	S	S	.	.			trans	-72.9	115.1	179	-164.5	169.9	68.9	155.3	10.3	109.3	L54 E63 D77	R52-L54 HydrophobicContact CG-CD2 4.35Å; R52-E63 IonicContact CZ-OE2 2.74Å; R52-E63 IonicContact NE-OE2 3.89Å; R52-E63 PolarHBondContact NE-OE2 3.47Å; R52-E63 IonicContact NH2-OE1 3.89Å; R52-E63 IonicContact NH2-OE2 3.63Å; R52-D77 IonicContact NH1-OD2 3.72Å
53	D	92.1	Very high	90.3	Very high	60 Å²	60	73 Å²	73	32%	0.321	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	110.3	173.7	-175.3	-1.2	0	0	0	109.6	N38 I47 T51 H60	N38-D53 PolarHBondContact ND2-OD2 3.31Å; I47-D53 HydrophobicContact CG2-CB 3.96Å; T51-D53 PolarHBondContact O-N 3.27Å; D53-H60 VanDerWaalsContact CG-ND1 3.29Å; D53-H60 WeakPolarHBondContact OD1-CB 3.5Å; D53-H60 IonicContact OD1-CE1 3.59Å; D53-H60 IonicContact OD1-CG 2.73Å; D53-H60 IonicContact OD1-ND1 3.05Å; D53-H60 PolarHBondContact OD1-ND1 2.96Å; D53-H60 IonicContact OD2-CE1 3.54Å; D53-H60 IonicContact OD2-ND1 3.98Å; D53-H60 PolarHBondContact OD2-ND1 3.11Å
54	L	94	Very high	90.3	Very high	33 Å²	33	76.8 Å²	76.8	17%	0.173	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.4	174.8	-64.2	176.7	0	0	0	109.3	R52 H60 W61 E63 F66 V76	R52-L54 HydrophobicContact CG-CD2 4.35Å; L54-H60 CarbonylContact O-C 3.53Å; L54-H60 WeakPolarHBondContact O-CA 3.35Å; L54-W61 PolarHBondContact N-O 2.85Å; L54-W61 PolarHBondContact O-N 2.8Å; L54-E63 HydrophobicContact CD1-CB 4.4Å; L54-E63 HydrophobicContact CD1-CG 4.43Å; L54-F66 HydrophobicContact CB-CD2 4.37Å; L54-F66 HydrophobicContact CB-CG 4.44Å; L54-F66 HydrophobicContact CD1-CB 3.59Å; L54-F66 HydrophobicContact CD1-CD1 4.06Å; L54-F66 HydrophobicContact CD1-CG 3.82Å; L54-V76 HydrophobicContact CD1-CG2 3.76Å
55	S	93.4	Very high	90.3	Very high	85 Å²	85	71.6 Å²	71.6	59%	0.594	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	144.6	-176.8	65.8	0	0	0	0	114.1	R59	S55-R59 CarbonylContact C-O 3.53Å; S55-R59 WeakPolarHBondContact CA-O 3.48Å
56	Y	92.4	Very high	90.6	Very high	82 Å²	82	65.5 Å²	65.5	32%	0.322	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	125.8	173.5	179.9	-101.9	0	0	0	110.3	D58 R59 F80 T82	Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 3.29Å; Y56-R59 PolarHBondContact N-O 3.36Å; Y56-R59 WeakPolarHBondContact O-CB 3.37Å; Y56-R59 PolarHBondContact O-N 3.31Å; Y56-R59 VanDerWaalsContact O-N 3.13Å; Y56-F80 HydrophobicContact CD1-CE2 4.03Å; Y56-F80 HydrophobicContact CD1-CZ 4.29Å; Y56-F80 HydrophobicContact CD2-CE2 4.13Å; Y56-F80 AromaticContact CD2-CZ 3.65Å; Y56-F80 HydrophobicContact CD2-CZ 3.65Å; Y56-F80 HydrophobicContact CE1-CE2 4.12Å; Y56-F80 HydrophobicContact CE2-CE2 4.21Å; Y56-F80 AromaticContact CE2-CZ 3.98Å; Y56-F80 HydrophobicContact CE2-CZ 3.98Å; Y56-F80 HydrophobicContact CG-CE2 4.03Å; Y56-F80 AromaticContact CG-CZ 3.81Å; Y56-F80 HydrophobicContact CG-CZ 3.81Å; Y56-T82 HydrophobicContact CD1-CG2 3.97Å; Y56-T82 HydrophobicContact CE1-CG2 3.43Å; Y56-T82 VanDerWaalsContact CE1-CG2 3.43Å
57	K	90.6	Very high	90.8	Very high	137 Å²	137	65.3 Å²	65.3	60%	0.596	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	52.3	-177.2	-66	-179.1	176.5	168.8	0	112.6	R59	K57-R59 PolarHBondContact O-N 3.11Å; K57-R59 VanDerWaalsContact O-N 3.11Å
58	D	89.8	Confident	91.1	Very high	160 Å²	160	65 Å²	65	86%	0.856	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	18.9	178.6	-50.7	-45.5	0	0	0	115.4	Y56	Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 3.29Å
59	R	93.4	Very high	91.6	Very high	66 Å²	66	69 Å²	69	25%	0.249	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	153	171.6	-64	178.5	-168.2	-145.2	-3.1	110	S55 Y56 K57 W61 E85	S55-R59 CarbonylContact C-O 3.53Å; S55-R59 WeakPolarHBondContact CA-O 3.48Å; Y56-R59 PolarHBondContact N-O 3.36Å; Y56-R59 WeakPolarHBondContact O-CB 3.37Å; Y56-R59 PolarHBondContact O-N 3.31Å; Y56-R59 VanDerWaalsContact O-N 3.13Å; K57-R59 PolarHBondContact O-N 3.11Å; K57-R59 VanDerWaalsContact O-N 3.11Å; R59-W61 VanDerWaalsContact C-CZ3 3.43Å; R59-W61 HydrophobicContact CB-CE3 4.3Å; R59-W61 HydrophobicContact CB-CH2 3.23Å; R59-W61 HydrophobicContact CB-CZ2 3.99Å; R59-W61 HydrophobicContact CB-CZ3 3.41Å; R59-W61 VanDerWaalsContact CB-CZ3 3.41Å; R59-W61 HydrophobicContact CG-CH2 4.22Å; R59-W61 VanDerWaalsContact O-CZ3 3.23Å; R59-W61 WeakPolarHBondContact O-CZ3 3.23Å; R59-E85 IonicContact CZ-OE1 2.77Å; R59-E85 IonicContact CZ-OE2 3.63Å; R59-E85 VanDerWaalsContact CZ-OE2 3.31Å; R59-E85 VanDerWaalsContact NH1-CB 3.35Å; R59-E85 VanDerWaalsContact NH1-CD 3.27Å; R59-E85 IonicContact NH1-OE1 3.81Å; R59-E85 IonicContact NH1-OE2 3.82Å; R59-E85 PolarHBondContact NH1-OE2 3.46Å; R59-E85 IonicContact NH2-OE1 3.76Å; R59-E85 PolarHBondContact NH2-OE1 3.38Å; R59-E85 IonicContact NH2-OE2 2.63Å; R59-E85 PolarHBondContact NH2-OE2 2.92Å
60	H	94.9	Very high	92.4	Very high	36 Å²	36	71.2 Å²	71.2	17%	0.167	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.3	-169.3	-66.5	-95.1	0	0	0	111.2	N38 C40 E41 I47 D53 L54	N38-H60 HydrophobicContact CB-CB 3.76Å; N38-H60 VanDerWaalsContact CB-CG 3.46Å; N38-H60 VanDerWaalsContact CG-CE1 3.46Å; N38-H60 PolarHBondContact ND2-CE1 3.4Å; N38-H60 PolarHBondContact ND2-ND1 3.13Å; C40-H60 CarbonylContact C-O 3.56Å; C40-H60 WeakPolarHBondContact CA-O 3.49Å; E41-H60 WeakPolarHBondContact CB-O 3.42Å; E41-H60 PolarHBondContact N-O 3.38Å; I47-H60 HydrophobicContact CD1-CB 3.64Å; D53-H60 VanDerWaalsContact CG-ND1 3.29Å; D53-H60 WeakPolarHBondContact OD1-CB 3.5Å; D53-H60 IonicContact OD1-CE1 3.59Å; D53-H60 IonicContact OD1-CG 2.73Å; D53-H60 IonicContact OD1-ND1 3.05Å; D53-H60 PolarHBondContact OD1-ND1 2.96Å; D53-H60 IonicContact OD2-CE1 3.54Å; D53-H60 IonicContact OD2-ND1 3.98Å; D53-H60 PolarHBondContact OD2-ND1 3.11Å; L54-H60 CarbonylContact O-C 3.53Å; L54-H60 WeakPolarHBondContact O-CA 3.35Å
61	W	95.7	Very high	93.2	Very high	14 Å²	14	67.8 Å²	67.8	5%	0.053	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.9	178.3	-66.2	-100.6	0	0	0	110.5	E41 L54 R59 C65 F66 L87	E41-W61 HydrophobicContact CB-CD2 4.24Å; E41-W61 HydrophobicContact CB-CZ2 3.92Å; E41-W61 HydrophobicContact CG-CZ2 3.97Å; L54-W61 PolarHBondContact N-O 2.85Å; L54-W61 PolarHBondContact O-N 2.8Å; R59-W61 VanDerWaalsContact C-CZ3 3.43Å; R59-W61 HydrophobicContact CB-CE3 4.3Å; R59-W61 HydrophobicContact CB-CH2 3.23Å; R59-W61 HydrophobicContact CB-CZ2 3.99Å; R59-W61 HydrophobicContact CB-CZ3 3.41Å; R59-W61 VanDerWaalsContact CB-CZ3 3.41Å; R59-W61 HydrophobicContact CG-CH2 4.22Å; R59-W61 VanDerWaalsContact O-CZ3 3.23Å; R59-W61 WeakPolarHBondContact O-CZ3 3.23Å; W61-C65 HydrophobicContact CB-CB 4.3Å; W61-F66 HydrophobicContact CB-CB 4.13Å; W61-F66 HydrophobicContact CB-CD2 3.89Å; W61-F66 AromaticContact CD2-CD2 3.85Å; W61-F66 HydrophobicContact CD2-CD2 3.85Å; W61-F66 HydrophobicContact CD2-CE2 4.21Å; W61-F66 AromaticContact CE3-CD2 3.93Å; W61-F66 HydrophobicContact CE3-CD2 3.93Å; W61-F66 AromaticContact CE3-CE2 3.92Å; W61-F66 HydrophobicContact CE3-CE2 3.92Å; W61-F66 AromaticContact CG-CD2 3.85Å; W61-F66 HydrophobicContact CG-CD2 3.85Å; W61-F66 HydrophobicContact CZ3-CE2 4.28Å; W61-L87 HydrophobicContact CD2-CD1 4.16Å; W61-L87 HydrophobicContact CH2-CD1 4.49Å; W61-L87 HydrophobicContact CH2-CD2 4.44Å; W61-L87 HydrophobicContact CZ2-CD1 3.89Å; W61-L87 HydrophobicContact CZ2-CD2 4.42Å; W61-L87 HydrophobicContact CZ2-CG 4.17Å
62	H	95.1	Very high	93.8	Very high	34 Å²	34	69.9 Å²	69.9	16%	0.157	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	153.7	158.3	-59.3	109.9	0	0	0	110	C40 C43 D64 C65 F66	C40-H62 WeakPolarHBondContact CB-ND1 3.23Å; C40-H62 PolarHBondContact SG-ND1 2.84Å; C43-H62 VanDerWaalsContact SG-CE1 3.5Å; C43-H62 PolarHBondContact SG-ND1 3.46Å; C43-H62 VanDerWaalsContact SG-ND1 3.38Å; H62-D64 VanDerWaalsContact C-N 3.26Å; H62-D64 PolarHBondContact O-N 2.9Å; H62-C65 HydrophobicContact CB-CB 3.9Å; H62-C65 CarbonylContact O-C 3.57Å; H62-C65 WeakPolarHBondContact O-CA 3.35Å; H62-C65 WeakPolarHBondContact O-CB 3.44Å; H62-C65 PolarHBondContact O-N 2.78Å; H62-F66 PolarHBondContact O-N 2.98Å
63	E	93.8	Very high	94.2	Very high	84 Å²	84	71.9 Å²	71.9	39%	0.393	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-52.4	-44.7	171.6	-169.1	171.5	158.4	0	0	112.8	R52 L54 C65 F66 V76	R52-E63 IonicContact CZ-OE2 2.74Å; R52-E63 IonicContact NE-OE2 3.89Å; R52-E63 PolarHBondContact NE-OE2 3.47Å; R52-E63 IonicContact NH2-OE1 3.89Å; R52-E63 IonicContact NH2-OE2 3.63Å; L54-E63 HydrophobicContact CD1-CB 4.4Å; L54-E63 HydrophobicContact CD1-CG 4.43Å; E63-C65 PolarHBondContact O-N 2.87Å; E63-F66 PolarHBondContact O-N 3.13Å; E63-V76 HydrophobicContact CG-CG2 3.67Å
64	D	93.8	Very high	94.4	Very high	124 Å²	124	71.1 Å²	71.1	66%	0.663	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-70.2	-16.3	175.5	-72.2	-41.2	0	0	0	113.7	H62 K67	H62-D64 VanDerWaalsContact C-N 3.26Å; H62-D64 PolarHBondContact O-N 2.9Å; D64-K67 WeakPolarHBondContact O-CD 3.37Å; D64-K67 WeakPolarHBondContact O-CE 3.01Å; D64-K67 PolarHBondContact O-NZ 3.48Å
65	C	95.2	Very high	94.5	Very high	15 Å²	15	69.7 Å²	69.7	10%	0.101	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-95.9	-14.5	179.7	-70	0	0	0	0	113	C40 E42 W61 H62 E63 K67	C40-C65 VanDerWaalsContact SG-CB 3.52Å; C40-C65 VanDerWaalsContact SG-SG 3.61Å; E42-C65 HydrophobicContact CB-CB 3.84Å; E42-C65 WeakPolarHBondContact OE2-CA 3.41Å; E42-C65 WeakPolarHBondContact OE2-CB 3.4Å; E42-C65 PolarHBondContact OE2-SG 2.94Å; W61-C65 HydrophobicContact CB-CB 4.3Å; H62-C65 HydrophobicContact CB-CB 3.9Å; H62-C65 CarbonylContact O-C 3.57Å; H62-C65 WeakPolarHBondContact O-CA 3.35Å; H62-C65 WeakPolarHBondContact O-CB 3.44Å; H62-C65 PolarHBondContact O-N 2.78Å; E63-C65 PolarHBondContact O-N 2.87Å; C65-K67 PolarHBondContact O-N 3Å
66	F	96.4	Very high	94.6	Very high	13 Å²	13	66.6 Å²	66.6	6%	0.057	31%	0.313	C	S	.	.			trans	-83.1	70.5	-178.5	-160.5	-103.8	0	0	0	110.9	L54 W61 H62 E63 L75 F80 L87	L54-F66 HydrophobicContact CB-CD2 4.37Å; L54-F66 HydrophobicContact CB-CG 4.44Å; L54-F66 HydrophobicContact CD1-CB 3.59Å; L54-F66 HydrophobicContact CD1-CD1 4.06Å; L54-F66 HydrophobicContact CD1-CG 3.82Å; W61-F66 HydrophobicContact CB-CB 4.13Å; W61-F66 HydrophobicContact CB-CD2 3.89Å; W61-F66 AromaticContact CD2-CD2 3.85Å; W61-F66 HydrophobicContact CD2-CD2 3.85Å; W61-F66 HydrophobicContact CD2-CE2 4.21Å; W61-F66 AromaticContact CE3-CD2 3.93Å; W61-F66 HydrophobicContact CE3-CD2 3.93Å; W61-F66 AromaticContact CE3-CE2 3.92Å; W61-F66 HydrophobicContact CE3-CE2 3.92Å; W61-F66 AromaticContact CG-CD2 3.85Å; W61-F66 HydrophobicContact CG-CD2 3.85Å; W61-F66 HydrophobicContact CZ3-CE2 4.28Å; H62-F66 PolarHBondContact O-N 2.98Å; E63-F66 PolarHBondContact O-N 3.13Å; F66-L75 HydrophobicContact CD1-CB 3.68Å; F66-L75 HydrophobicContact CE1-CB 3.68Å; F66-L75 PolarHBondContact O-N 2.85Å; F66-F80 HydrophobicContact CE1-CD1 4.2Å; F66-F80 HydrophobicContact CE1-CE1 4.11Å; F66-F80 HydrophobicContact CZ-CD1 4.13Å; F66-F80 AromaticContact CZ-CE1 3.72Å; F66-F80 HydrophobicContact CZ-CE1 3.72Å; F66-F80 HydrophobicContact CZ-CE2 4.24Å; F66-F80 AromaticContact CZ-CZ 3.78Å; F66-F80 HydrophobicContact CZ-CZ 3.78Å; F66-L87 HydrophobicContact CD2-CD1 3.53Å; F66-L87 HydrophobicContact CE2-CD1 3.48Å; F66-L87 VanDerWaalsContact CE2-CD1 3.48Å; F66-L87 HydrophobicContact CE2-CD2 3.94Å; F66-L87 HydrophobicContact CE2-CG 4.39Å; F66-L87 HydrophobicContact CG-CD1 4.3Å; F66-L87 HydrophobicContact CZ-CD1 4.2Å; F66-L87 HydrophobicContact CZ-CD2 4.18Å
67	K	96.6	Very high	94.6	Very high	72 Å²	72	69.5 Å²	69.5	31%	0.313	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-123.2	154.4	-172.3	-70.9	169.8	173.6	154.5	0	111.7	D64 C65 F69 K72 R73	D64-K67 WeakPolarHBondContact O-CD 3.37Å; D64-K67 WeakPolarHBondContact O-CE 3.01Å; D64-K67 PolarHBondContact O-NZ 3.48Å; C65-K67 PolarHBondContact O-N 3Å; K67-F69 PolarHBondContact O-N 3.38Å; K67-K72 WeakPolarHBondContact CD-O 3.01Å; K67-R73 CarbonylContact C-O 3.55Å; K67-R73 WeakPolarHBondContact CA-O 3.45Å
68	C	96.4	Very high	94.7	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.33	C	S	.	.			trans	-62.3	127.8	172.6	178.7	0	0	0	0	109.9	Q70 C71 K72 R73 L75 L87 C89	C68-Q70 PolarHBondContact O-N 2.88Å; C68-C71 VanDerWaalsContact CB-SG 3.51Å; C68-K72 WeakPolarHBondContact O-CA 3.35Å; C68-K72 PolarHBondContact O-N 2.69Å; C68-R73 PolarHBondContact N-O 3.41Å; C68-L75 HydrophobicContact CB-CD1 4.38Å; C68-L75 HydrophobicContact CB-CD2 4.11Å; C68-L75 HydrophobicContact CB-CG 4.29Å; C68-L87 CarbonylContact C-O 3.56Å; C68-L87 WeakPolarHBondContact CA-O 3.15Å; C68-C89 HydrophobicContact CB-CB 4.24Å; C68-C89 PolarHBondContact SG-N 2.95Å
69	F	94.6	Very high	94.8	Very high	95 Å²	95	65.7 Å²	65.7	42%	0.417	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-36.8	179.9	-180	-100.5	0	0	0	112.3	K67 K72 Q86 L87 L88	K67-F69 PolarHBondContact O-N 3.38Å; F69-K72 WeakPolarHBondContact O-CE 2.87Å; F69-K72 PolarHBondContact O-NZ 2.88Å; F69-Q86 HydrophobicContact CB-CB 4.05Å; F69-Q86 HydrophobicContact CD1-CB 4.5Å; F69-Q86 HydrophobicContact CD1-CG 4.37Å; F69-Q86 HydrophobicContact CD2-CG 4.27Å; F69-Q86 VanDerWaalsContact CE1-OE1 3.25Å; F69-Q86 HydrophobicContact CG-CB 4.15Å; F69-Q86 HydrophobicContact CG-CG 4.14Å; F69-L87 WeakPolarHBondContact CB-O 3.34Å; F69-L87 PolarHBondContact N-O 3.23Å; F69-L88 HydrophobicContact CB-CD2 4.11Å
70	Q	93.8	Very high	94.8	Very high	101 Å²	101	65.2 Å²	65.2	47%	0.472	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-59.4	-177.2	-67.4	-68.4	-9.4	0	0	112.9	C68 L88 C92	C68-Q70 PolarHBondContact O-N 2.88Å; Q70-L88 HydrophobicContact CB-CD2 4.17Å; Q70-L88 HydrophobicContact CG-CD2 3.44Å; Q70-L88 VanDerWaalsContact CG-CD2 3.44Å; Q70-C92 HydrophobicContact CB-CB 4.06Å; Q70-C92 HydrophobicContact CG-CB 4.36Å
71	C	95.5	Very high	94.6	Very high	41 Å²	41	65.2 Å²	65.2	28%	0.277	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-2.4	-172.7	71.1	0	0	0	0	114.6	C68 R73	C68-C71 VanDerWaalsContact CB-SG 3.51Å; C71-R73 HydrophobicContact CB-CG 4.48Å; C71-R73 PolarHBondContact O-N 3.47Å
72	K	95.3	Very high	94.4	Very high	117 Å²	117	66.6 Å²	66.6	51%	0.509	33%	0.334	S	S	.	.			trans	59.1	7.2	179.3	-51	-61.4	178.1	-172.9	0	115.9	K67 C68 F69	K67-K72 WeakPolarHBondContact CD-O 3.01Å; C68-K72 WeakPolarHBondContact O-CA 3.35Å; C68-K72 PolarHBondContact O-N 2.69Å; F69-K72 WeakPolarHBondContact O-CE 2.87Å; F69-K72 PolarHBondContact O-NZ 2.88Å
73	R	96.1	Very high	94.1	Very high	141 Å²	141	68.8 Å²	68.8	53%	0.532	34%	0.343	S	S	.	.			trans	-68.2	143.2	173	-61.4	-175.1	-152.8	151.1	8.1	110.3	K67 C68 C71 L75 E91	K67-R73 CarbonylContact C-O 3.55Å; K67-R73 WeakPolarHBondContact CA-O 3.45Å; C68-R73 PolarHBondContact N-O 3.41Å; C71-R73 HydrophobicContact CB-CG 4.48Å; C71-R73 PolarHBondContact O-N 3.47Å; R73-L75 PolarHBondContact O-N 2.88Å; R73-E91 IonicContact CZ-OE2 3.97Å; R73-E91 IonicContact NH1-OE2 3.63Å; R73-E91 PolarHBondContact NH1-OE2 2.78Å; R73-E91 IonicContact NH2-OE2 3.78Å
74	S	96.1	Very high	93.8	Very high	44 Å²	44	70.5 Å²	70.5	31%	0.308	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-60.7	132.9	173.4	175.7	0	0	0	0	111.4	V76 K78	S74-V76 WeakPolarHBondContact OG-CB 3.15Å; S74-V76 VanDerWaalsContact OG-CG2 3.27Å; S74-V76 WeakPolarHBondContact OG-CG2 3.26Å; S74-V76 PolarHBondContact OG-N 3.1Å; S74-K78 PolarHBondContact O-NZ 2.77Å; S74-K78 VanDerWaalsContact O-NZ 3.11Å
75	L	96.3	Very high	93.6	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.016	35%	0.353	C	S	.	.			trans	-98.8	0.9	177.1	-64.1	176	0	0	0	112.8	F66 C68 R73 D77 K78 F80 L87 C89	F66-L75 HydrophobicContact CD1-CB 3.68Å; F66-L75 HydrophobicContact CE1-CB 3.68Å; F66-L75 PolarHBondContact O-N 2.85Å; C68-L75 HydrophobicContact CB-CD1 4.38Å; C68-L75 HydrophobicContact CB-CD2 4.11Å; C68-L75 HydrophobicContact CB-CG 4.29Å; R73-L75 PolarHBondContact O-N 2.88Å; L75-D77 PolarHBondContact O-N 3.28Å; L75-K78 PolarHBondContact O-N 2.88Å; L75-K78 VanDerWaalsContact O-N 3.07Å; L75-F80 HydrophobicContact CD1-CB 4Å; L75-F80 HydrophobicContact CD2-CB 4.18Å; L75-F80 HydrophobicContact CG-CB 4.49Å; L75-L87 HydrophobicContact CD1-CB 3.64Å; L75-C89 HydrophobicContact CD2-CB 3.6Å
76	V	95.1	Very high	93.4	Very high	19 Å²	19	73.3 Å²	73.3	12%	0.115	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	127.1	173.9	167.4	0	0	0	0	110.2	L54 E63 S74 K78	L54-V76 HydrophobicContact CD1-CG2 3.76Å; E63-V76 HydrophobicContact CG-CG2 3.67Å; S74-V76 WeakPolarHBondContact OG-CB 3.15Å; S74-V76 VanDerWaalsContact OG-CG2 3.27Å; S74-V76 WeakPolarHBondContact OG-CG2 3.26Å; S74-V76 PolarHBondContact OG-N 3.1Å; V76-K78 WeakPolarHBondContact O-CG 3.15Å; V76-K78 PolarHBondContact O-N 2.86Å
77	D	92.2	Very high	93.3	Very high	144 Å²	144	73.1 Å²	73.1	77%	0.77	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	19.3	178.3	-53.8	-43.3	0	0	0	114.5	R52 L75	R52-D77 IonicContact NH1-OD2 3.72Å; L75-D77 PolarHBondContact O-N 3.28Å
78	K	93.1	Very high	93.2	Very high	117 Å²	117	69.8 Å²	69.8	51%	0.509	35%	0.348	S	S	.	.	S	Bend	trans	-117.7	148.3	179	-68.7	173.4	-165.5	164.8	0	111	S74 L75 V76 F80	S74-K78 PolarHBondContact O-NZ 2.77Å; S74-K78 VanDerWaalsContact O-NZ 3.11Å; L75-K78 PolarHBondContact O-N 2.88Å; L75-K78 VanDerWaalsContact O-N 3.07Å; V76-K78 WeakPolarHBondContact O-CG 3.15Å; V76-K78 PolarHBondContact O-N 2.86Å; K78-F80 PolarHBondContact O-N 3.36Å
79	P	91.7	Very high	93.1	Very high	99 Å²	99	70.5 Å²	70.5	64%	0.643	35%	0.353	S	S	*	.			trans	-59.2	138	170.3	-21.3	32.5	0	0	0	111.3	T90	P79-T90 HydrophobicContact CB-CG2 3.85Å
80	F	93.4	Very high	92.9	Very high	56 Å²	56	68.6 Å²	68.6	25%	0.246	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	163.3	177.8	68.6	-86.8	0	0	0	110.7	Y56 F66 L75 K78 T82 L87 L88	Y56-F80 HydrophobicContact CD1-CE2 4.03Å; Y56-F80 HydrophobicContact CD1-CZ 4.29Å; Y56-F80 HydrophobicContact CD2-CE2 4.13Å; Y56-F80 AromaticContact CD2-CZ 3.65Å; Y56-F80 HydrophobicContact CD2-CZ 3.65Å; Y56-F80 HydrophobicContact CE1-CE2 4.12Å; Y56-F80 HydrophobicContact CE2-CE2 4.21Å; Y56-F80 AromaticContact CE2-CZ 3.98Å; Y56-F80 HydrophobicContact CE2-CZ 3.98Å; Y56-F80 HydrophobicContact CG-CE2 4.03Å; Y56-F80 AromaticContact CG-CZ 3.81Å; Y56-F80 HydrophobicContact CG-CZ 3.81Å; F66-F80 HydrophobicContact CE1-CD1 4.2Å; F66-F80 HydrophobicContact CE1-CE1 4.11Å; F66-F80 HydrophobicContact CZ-CD1 4.13Å; F66-F80 AromaticContact CZ-CE1 3.72Å; F66-F80 HydrophobicContact CZ-CE1 3.72Å; F66-F80 HydrophobicContact CZ-CE2 4.24Å; F66-F80 AromaticContact CZ-CZ 3.78Å; F66-F80 HydrophobicContact CZ-CZ 3.78Å; L75-F80 HydrophobicContact CD1-CB 4Å; L75-F80 HydrophobicContact CD2-CB 4.18Å; L75-F80 HydrophobicContact CG-CB 4.49Å; K78-F80 PolarHBondContact O-N 3.36Å; F80-T82 HydrophobicContact CD2-CG2 4.26Å; F80-T82 HydrophobicContact CE2-CG2 4.02Å; F80-L87 HydrophobicContact CD2-CD2 3.79Å; F80-L87 HydrophobicContact CE2-CD2 3.68Å; F80-L88 WeakPolarHBondContact CA-O 3.38Å; F80-L88 WeakPolarHBondContact CB-O 3.46Å
81	S	91.7	Very high	92.6	Very high	37 Å²	37	69.5 Å²	69.5	26%	0.259	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.4	172.9	-63.9	0	0	0	0	109.4	L88 Y93	S81-L88 PolarHBondContact N-O 2.88Å; S81-L88 PolarHBondContact O-N 3.2Å; S81-Y93 VanDerWaalsContact CB-CD2 3.49Å
82	T	91.3	Very high	92.4	Very high	43 Å²	43	68.8 Å²	68.8	26%	0.264	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.5	171.6	59.1	0	0	0	0	110.6	Y56 F80 Q86 L87	Y56-T82 HydrophobicContact CD1-CG2 3.97Å; Y56-T82 HydrophobicContact CE1-CG2 3.43Å; Y56-T82 VanDerWaalsContact CE1-CG2 3.43Å; F80-T82 HydrophobicContact CD2-CG2 4.26Å; F80-T82 HydrophobicContact CE2-CG2 4.02Å; T82-Q86 WeakPolarHBondContact CA-O 3.45Å; T82-L87 HydrophobicContact CG2-CD2 3.96Å
83	K	87.8	Confident	92.2	Very high	80 Å²	80	66.1 Å²	66.1	35%	0.348	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	127.7	171	-175.5	59.6	-179.2	170.1	0	108.6	E85 Q86 L88 Y93 Y97	K83-E85 PolarHBondContact O-N 2.91Å; K83-E85 VanDerWaalsContact O-N 3.12Å; K83-Q86 PolarHBondContact N-O 2.65Å; K83-Q86 VanDerWaalsContact N-O 3.13Å; K83-Q86 WeakPolarHBondContact O-CB 3.18Å; K83-Q86 PolarHBondContact O-N 3.2Å; K83-L88 HydrophobicContact CB-CD1 4.09Å; K83-Y93 HydrophobicContact CB-CD2 4.39Å; K83-Y93 HydrophobicContact CB-CE2 4.08Å; K83-Y97 HydrophobicContact CB-CE2 4.22Å; K83-Y97 HydrophobicContact CG-CE1 4.34Å; K83-Y97 HydrophobicContact CG-CE2 4.05Å
84	D	88.8	Confident	91.7	Very high	120 Å²	120	59.8 Å²	59.8	64%	0.642	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	44.9	-178.9	-48.3	-32.7	0	0	0	111	Q86	D84-Q86 PolarHBondContact O-N 3.31Å; D84-Q86 VanDerWaalsContact O-N 3.1Å
85	E	88.2	Confident	91.2	Very high	131 Å²	131	61.3 Å²	61.3	61%	0.612	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	-0.2	-179.9	-52.3	-170.4	161.6	0	0	116.9	R59 K83	R59-E85 IonicContact CZ-OE1 2.77Å; R59-E85 IonicContact CZ-OE2 3.63Å; R59-E85 VanDerWaalsContact CZ-OE2 3.31Å; R59-E85 VanDerWaalsContact NH1-CB 3.35Å; R59-E85 VanDerWaalsContact NH1-CD 3.27Å; R59-E85 IonicContact NH1-OE1 3.81Å; R59-E85 IonicContact NH1-OE2 3.82Å; R59-E85 PolarHBondContact NH1-OE2 3.46Å; R59-E85 IonicContact NH2-OE1 3.76Å; R59-E85 PolarHBondContact NH2-OE1 3.38Å; R59-E85 IonicContact NH2-OE2 2.63Å; R59-E85 PolarHBondContact NH2-OE2 2.92Å; K83-E85 PolarHBondContact O-N 2.91Å; K83-E85 VanDerWaalsContact O-N 3.12Å
86	Q	91.6	Very high	90.6	Very high	67 Å²	67	66.6 Å²	66.6	31%	0.313	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.1	176.8	-62.1	177.9	-5.9	0	0	111.2	F69 T82 K83 D84	F69-Q86 HydrophobicContact CB-CB 4.05Å; F69-Q86 HydrophobicContact CD1-CB 4.5Å; F69-Q86 HydrophobicContact CD1-CG 4.37Å; F69-Q86 HydrophobicContact CD2-CG 4.27Å; F69-Q86 VanDerWaalsContact CE1-OE1 3.25Å; F69-Q86 HydrophobicContact CG-CB 4.15Å; F69-Q86 HydrophobicContact CG-CG 4.14Å; T82-Q86 WeakPolarHBondContact CA-O 3.45Å; K83-Q86 PolarHBondContact N-O 2.65Å; K83-Q86 VanDerWaalsContact N-O 3.13Å; K83-Q86 WeakPolarHBondContact O-CB 3.18Å; K83-Q86 PolarHBondContact O-N 3.2Å; D84-Q86 PolarHBondContact O-N 3.31Å; D84-Q86 VanDerWaalsContact O-N 3.1Å
87	L	94.5	Very high	90	Very high	9 Å²	9	70.7 Å²	70.7	5%	0.047	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	123.3	172.6	-62.6	171	0	0	0	109.8	W61 F66 C68 F69 L75 F80 T82	W61-L87 HydrophobicContact CD2-CD1 4.16Å; W61-L87 HydrophobicContact CH2-CD1 4.49Å; W61-L87 HydrophobicContact CH2-CD2 4.44Å; W61-L87 HydrophobicContact CZ2-CD1 3.89Å; W61-L87 HydrophobicContact CZ2-CD2 4.42Å; W61-L87 HydrophobicContact CZ2-CG 4.17Å; F66-L87 HydrophobicContact CD2-CD1 3.53Å; F66-L87 HydrophobicContact CE2-CD1 3.48Å; F66-L87 VanDerWaalsContact CE2-CD1 3.48Å; F66-L87 HydrophobicContact CE2-CD2 3.94Å; F66-L87 HydrophobicContact CE2-CG 4.39Å; F66-L87 HydrophobicContact CG-CD1 4.3Å; F66-L87 HydrophobicContact CZ-CD1 4.2Å; F66-L87 HydrophobicContact CZ-CD2 4.18Å; C68-L87 CarbonylContact C-O 3.56Å; C68-L87 WeakPolarHBondContact CA-O 3.15Å; F69-L87 WeakPolarHBondContact CB-O 3.34Å; F69-L87 PolarHBondContact N-O 3.23Å; L75-L87 HydrophobicContact CD1-CB 3.64Å; F80-L87 HydrophobicContact CD2-CD2 3.79Å; F80-L87 HydrophobicContact CE2-CD2 3.68Å; T82-L87 HydrophobicContact CG2-CD2 3.96Å
88	L	94.6	Very high	89.7	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137	178.6	-65.5	171.6	0	0	0	110.2	F69 Q70 F80 S81 K83 Y93 Y97	F69-L88 HydrophobicContact CB-CD2 4.11Å; Q70-L88 HydrophobicContact CB-CD2 4.17Å; Q70-L88 HydrophobicContact CG-CD2 3.44Å; Q70-L88 VanDerWaalsContact CG-CD2 3.44Å; F80-L88 WeakPolarHBondContact CA-O 3.38Å; F80-L88 WeakPolarHBondContact CB-O 3.46Å; S81-L88 PolarHBondContact N-O 2.88Å; S81-L88 PolarHBondContact O-N 3.2Å; K83-L88 HydrophobicContact CB-CD1 4.09Å; L88-Y93 HydrophobicContact CD1-CD2 4.1Å; L88-Y97 HydrophobicContact CD1-CE2 3.75Å
89	C	93.8	Very high	89.6	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.101	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	155.8	167.1	69.2	0	0	0	0	109.8	C68 L75 E91 C92 Y93	C68-C89 HydrophobicContact CB-CB 4.24Å; C68-C89 PolarHBondContact SG-N 2.95Å; L75-C89 HydrophobicContact CD2-CB 3.6Å; C89-E91 PolarHBondContact O-N 3.12Å; C89-C92 PolarHBondContact O-N 3.01Å; C89-C92 PolarHBondContact SG-N 2.74Å; C89-C92 VanDerWaalsContact SG-N 3.38Å; C89-C92 PolarHBondContact SG-SG 3.13Å; C89-Y93 WeakPolarHBondContact O-CB 3.33Å; C89-Y93 PolarHBondContact O-N 2.75Å
90	T	89.8	Confident	89.5	Confident	55 Å²	55	62.5 Å²	62.5	34%	0.337	31%	0.311	S	S	.	.	H	α-helix	trans	-55.5	-36	179.7	51.3	0	0	0	0	112.9	P79 S94	P79-T90 HydrophobicContact CB-CG2 3.85Å; T90-S94 WeakPolarHBondContact O-CB 3.42Å; T90-S94 PolarHBondContact O-N 2.89Å; T90-S94 PolarHBondContact O-OG 3.1Å
91	E	88.4	Confident	89.5	Confident	121 Å²	121	59.9 Å²	59.9	57%	0.565	30%	0.3	S	S	*	.	H	α-helix	trans	-63.2	-54	175.9	-67.6	175.2	179.3	0	0	112.2	R73 C89 S94 N95	R73-E91 IonicContact CZ-OE2 3.97Å; R73-E91 IonicContact NH1-OE2 3.63Å; R73-E91 PolarHBondContact NH1-OE2 2.78Å; R73-E91 IonicContact NH2-OE2 3.78Å; C89-E91 PolarHBondContact O-N 3.12Å; E91-S94 PolarHBondContact O-N 2.64Å; E91-N95 WeakPolarHBondContact O-CB 3.41Å; E91-N95 PolarHBondContact O-N 3.47Å
92	C	91.4	Very high	89.6	Confident	25 Å²	25	61.5 Å²	61.5	17%	0.169	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-43.7	-179.4	-71.5	0	0	0	0	111.2	Q70 C89 S94 N95 E96	Q70-C92 HydrophobicContact CB-CB 4.06Å; Q70-C92 HydrophobicContact CG-CB 4.36Å; C89-C92 PolarHBondContact O-N 3.01Å; C89-C92 PolarHBondContact SG-N 2.74Å; C89-C92 VanDerWaalsContact SG-N 3.38Å; C89-C92 PolarHBondContact SG-SG 3.13Å; C92-S94 VanDerWaalsContact C-N 3.33Å; C92-S94 PolarHBondContact O-N 3.43Å; C92-N95 PolarHBondContact O-N 3Å; C92-E96 WeakPolarHBondContact O-CG 3.39Å; C92-E96 PolarHBondContact O-N 2.73Å
93	Y	90.4	Very high	89.7	Confident	62 Å²	62	65.5 Å²	65.5	24%	0.243	32%	0.319	C	S	.	.	H	α-helix	trans	-59.2	-46.6	175.2	-176.9	-87.7	0	0	0	111.1	S81 K83 L88 C89 N95 Y97 P110	S81-Y93 VanDerWaalsContact CB-CD2 3.49Å; K83-Y93 HydrophobicContact CB-CD2 4.39Å; K83-Y93 HydrophobicContact CB-CE2 4.08Å; L88-Y93 HydrophobicContact CD1-CD2 4.1Å; C89-Y93 WeakPolarHBondContact O-CB 3.33Å; C89-Y93 PolarHBondContact O-N 2.75Å; Y93-N95 PolarHBondContact O-N 2.92Å; Y93-Y97 HydrophobicContact CD1-CD2 4.49Å; Y93-Y97 AromaticContact CD2-CD2 3.61Å; Y93-Y97 HydrophobicContact CD2-CD2 3.61Å; Y93-Y97 HydrophobicContact CD2-CE2 4.03Å; Y93-Y97 AromaticContact CE2-CD2 3.76Å; Y93-Y97 HydrophobicContact CE2-CD2 3.76Å; Y93-Y97 HydrophobicContact CE2-CE2 4.31Å; Y93-Y97 HydrophobicContact CE2-CG 4.48Å; Y93-Y97 HydrophobicContact CG-CD2 4Å; Y93-Y97 WeakPolarHBondContact O-CB 3.46Å; Y93-Y97 VanDerWaalsContact O-CD2 3.23Å; Y93-Y97 WeakPolarHBondContact O-CD2 3.32Å; Y93-Y97 PolarHBondContact O-N 3.43Å; Y93-P110 HydrophobicContact CD1-CG 4.4Å; Y93-P110 HydrophobicContact CE1-CG 4.18Å
94	S	86.2	Confident	89.9	Confident	7 Å²	7	64 Å²	64	5%	0.049	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-40	-177.5	-56.6	0	0	0	0	111.6	T90 E91 C92 E96 S98 T107	T90-S94 WeakPolarHBondContact O-CB 3.42Å; T90-S94 PolarHBondContact O-N 2.89Å; T90-S94 PolarHBondContact O-OG 3.1Å; E91-S94 PolarHBondContact O-N 2.64Å; C92-S94 VanDerWaalsContact C-N 3.33Å; C92-S94 PolarHBondContact O-N 3.43Å; S94-E96 PolarHBondContact O-N 3.35Å; S94-S98 WeakPolarHBondContact CA-OG 3.41Å; S94-S98 WeakPolarHBondContact O-CA 3.21Å; S94-S98 WeakPolarHBondContact O-CB 3.5Å; S94-S98 PolarHBondContact O-N 2.9Å; S94-S98 PolarHBondContact O-OG 3.22Å; S94-S98 VanDerWaalsContact O-OG 3.1Å; S94-T107 WeakPolarHBondContact O-CG2 3.08Å
95	N	85.1	Confident	90	Very high	76 Å²	76	64.8 Å²	64.8	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-38.4	-179.6	-173.3	60.1	0	0	0	113.4	E91 C92 Y93	E91-N95 WeakPolarHBondContact O-CB 3.41Å; E91-N95 PolarHBondContact O-N 3.47Å; C92-N95 PolarHBondContact O-N 3Å; Y93-N95 PolarHBondContact O-N 2.92Å
96	E	84.3	Confident	90.2	Very high	114 Å²	114	65.7 Å²	65.7	53%	0.533	32%	0.318	S	S	.	.	H	α-helix	trans	-81.7	-39.5	-179.3	-66.6	-53.5	125.1	0	0	112.7	C92 S94	C92-E96 WeakPolarHBondContact O-CG 3.39Å; C92-E96 PolarHBondContact O-N 2.73Å; S94-E96 PolarHBondContact O-N 3.35Å
97	Y	82.9	Confident	90.1	Very high	105 Å²	105	64.3 Å²	64.3	41%	0.412	31%	0.314	S	S	.	.	H	α-helix	trans	-113.6	-2.8	-165.5	-54.1	-65.2	0	0	0	114.9	K83 L88 Y93	K83-Y97 HydrophobicContact CB-CE2 4.22Å; K83-Y97 HydrophobicContact CG-CE1 4.34Å; K83-Y97 HydrophobicContact CG-CE2 4.05Å; L88-Y97 HydrophobicContact CD1-CE2 3.75Å; Y93-Y97 HydrophobicContact CD1-CD2 4.49Å; Y93-Y97 AromaticContact CD2-CD2 3.61Å; Y93-Y97 HydrophobicContact CD2-CD2 3.61Å; Y93-Y97 HydrophobicContact CD2-CE2 4.03Å; Y93-Y97 AromaticContact CE2-CD2 3.76Å; Y93-Y97 HydrophobicContact CE2-CD2 3.76Å; Y93-Y97 HydrophobicContact CE2-CE2 4.31Å; Y93-Y97 HydrophobicContact CE2-CG 4.48Å; Y93-Y97 HydrophobicContact CG-CD2 4Å; Y93-Y97 WeakPolarHBondContact O-CB 3.46Å; Y93-Y97 VanDerWaalsContact O-CD2 3.23Å; Y93-Y97 WeakPolarHBondContact O-CD2 3.32Å; Y93-Y97 PolarHBondContact O-N 3.43Å
98	S	85.9	Confident	89.9	Confident	20 Å²	20	64.2 Å²	64.2	14%	0.14	31%	0.313	C	S	.	.	S	Bend	trans	-107.2	150.1	-178.4	-45.8	0	0	0	0	112.7	S94 I108 P110	S94-S98 WeakPolarHBondContact CA-OG 3.41Å; S94-S98 WeakPolarHBondContact O-CA 3.21Å; S94-S98 WeakPolarHBondContact O-CB 3.5Å; S94-S98 PolarHBondContact O-N 2.9Å; S94-S98 PolarHBondContact O-OG 3.22Å; S94-S98 VanDerWaalsContact O-OG 3.1Å; S98-I108 VanDerWaalsContact CB-O 3.25Å; S98-I108 WeakPolarHBondContact CB-O 3.37Å; S98-P110 WeakPolarHBondContact OG-CD 3.14Å; S98-P110 WeakPolarHBondContact OG-CG 3.47Å
99	S	89.3	Confident	89.4	Confident	45 Å²	45	69 Å²	69	32%	0.315	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-61.3	139.6	177.1	-51	0	0	0	0	110.9	I108 K114	S99-I108 WeakPolarHBondContact O-CB 3.48Å; S99-I108 PolarHBondContact O-N 3.45Å; S99-K114 PolarHBondContact OG-NZ 3.45Å
100	K	91.4	Very high	88.7	Confident	123 Å²	123	71.6 Å²	71.6	54%	0.535	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-91.3	137.5	172.3	-63.9	-175.7	-179.1	-178.7	0	109.9	H102	K100-H102 PolarHBondContact O-N 3.1Å
101	C	93.4	Very high	88.2	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.007	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-65.5	128.8	175.7	178.2	0	0	0	0	110.1	E103 C104 K105 K106 I108 S121 H123	C101-E103 VanDerWaalsContact C-N 3.27Å; C101-E103 PolarHBondContact O-N 2.98Å; C101-C104 VanDerWaalsContact CB-SG 3.57Å; C101-C104 VanDerWaalsContact SG-SG 3.62Å; C101-K105 WeakPolarHBondContact O-CA 3.25Å; C101-K105 PolarHBondContact O-N 2.84Å; C101-K106 WeakPolarHBondContact CB-O 3.32Å; C101-K106 PolarHBondContact N-O 3.29Å; C101-I108 HydrophobicContact CB-CD1 4.17Å; C101-I108 HydrophobicContact CB-CG1 3.99Å; C101-S121 CarbonylContact C-O 3.52Å; C101-S121 VanDerWaalsContact CA-O 3.32Å; C101-S121 WeakPolarHBondContact CA-O 3.07Å; C101-H123 WeakPolarHBondContact CB-CE1 3.26Å; C101-H123 VanDerWaalsContact CB-ND1 3.28Å; C101-H123 WeakPolarHBondContact CB-ND1 3.32Å; C101-H123 PolarHBondContact SG-ND1 3.02Å; C101-H123 VanDerWaalsContact SG-ND1 3.36Å
102	H	92.9	Very high	88	Confident	71 Å²	71	70 Å²	70	33%	0.329	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-31.1	-177.4	-175.3	93.2	0	0	0	112.2	K100 K105 N120 S121 W122	K100-H102 PolarHBondContact O-N 3.1Å; H102-K105 VanDerWaalsContact O-CE 3.31Å; H102-K105 WeakPolarHBondContact O-CE 3.2Å; H102-K105 PolarHBondContact O-NZ 3.49Å; H102-N120 HydrophobicContact CB-CB 4.06Å; H102-N120 PolarHBondContact CE1-OD1 3.42Å; H102-N120 PolarHBondContact ND1-OD1 2.89Å; H102-S121 PolarHBondContact N-O 3.46Å; H102-W122 HydrophobicContact CB-CD2 4.21Å; H102-W122 HydrophobicContact CB-CZ2 3.99Å
103	E	92.4	Very high	87.8	Confident	128 Å²	128	78.3 Å²	78.3	60%	0.598	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-62.6	179.4	-172	65.2	-157.9	0	0	112.1	C101 C126	C101-E103 VanDerWaalsContact C-N 3.27Å; C101-E103 PolarHBondContact O-N 2.98Å; E103-C126 HydrophobicContact CB-CB 4Å; E103-C126 HydrophobicContact CG-CB 4.42Å
104	C	93.3	Very high	87.8	Confident	49 Å²	49	79.5 Å²	79.5	33%	0.331	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-3.8	-172	72.9	0	0	0	0	114.2	C101 K106 H123	C101-C104 VanDerWaalsContact CB-SG 3.57Å; C101-C104 VanDerWaalsContact SG-SG 3.62Å; C104-K106 PolarHBondContact O-N 3.46Å; C104-H123 PolarHBondContact SG-CE1 3.32Å; C104-H123 PolarHBondContact SG-ND1 3.45Å; C104-H123 VanDerWaalsContact SG-ND1 3.37Å
105	K	91.3	Very high	88.2	Confident	135 Å²	135	80.8 Å²	80.8	59%	0.587	41%	0.413	S	S	*	.			trans	61.2	1.4	-177.5	-50.4	-54.4	-174.4	-169.2	0	115.9	C101 H102	C101-K105 WeakPolarHBondContact O-CA 3.25Å; C101-K105 PolarHBondContact O-N 2.84Å; H102-K105 VanDerWaalsContact O-CE 3.31Å; H102-K105 WeakPolarHBondContact O-CE 3.2Å; H102-K105 PolarHBondContact O-NZ 3.49Å
106	K	90.6	Very high	88.5	Confident	151 Å²	151	82.7 Å²	82.7	66%	0.657	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-78.6	153.1	175.3	-60.8	-179.8	-178.7	179.7	0	111.4	C101 C104	C101-K106 WeakPolarHBondContact CB-O 3.32Å; C101-K106 PolarHBondContact N-O 3.29Å; C104-K106 PolarHBondContact O-N 3.46Å
107	T	90.3	Very high	88.8	Confident	38 Å²	38	80 Å²	80	23%	0.233	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-60.7	137.2	176.1	-50.6	0	0	0	0	111.6	S94 H123	S94-T107 WeakPolarHBondContact O-CG2 3.08Å; T107-H123 PolarHBondContact O-NE2 3.41Å; T107-H123 VanDerWaalsContact O-NE2 3.08Å
108	I	90.3	Very high	89	Confident	6 Å²	6	83 Å²	83	3%	0.031	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-92.8	117.1	170	-57.9	170.1	0	0	0	107	S98 S99 C101 S112 K114	S98-I108 VanDerWaalsContact CB-O 3.25Å; S98-I108 WeakPolarHBondContact CB-O 3.37Å; S99-I108 WeakPolarHBondContact O-CB 3.48Å; S99-I108 PolarHBondContact O-N 3.45Å; C101-I108 HydrophobicContact CB-CD1 4.17Å; C101-I108 HydrophobicContact CB-CG1 3.99Å; I108-S112 WeakPolarHBondContact CG2-OG 3.19Å; I108-K114 HydrophobicContact CD1-CB 4.37Å; I108-K114 HydrophobicContact CG2-CB 3.95Å
109	M	84.1	Confident	89.1	Confident	101 Å²	101	86 Å²	86	50%	0.498	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-61.7	139.4	-173.4	-69.1	-60.7	-66.7	0	0	111.7	G111 S112	M109-G111 PolarHBondContact O-N 3.01Å; M109-S112 WeakPolarHBondContact O-CB 3.33Å; M109-S112 PolarHBondContact O-N 3.19Å; M109-S112 VanDerWaalsContact O-N 3.1Å; M109-S112 PolarHBondContact O-OG 2.94Å
110	P	79.1	Confident	89.2	Confident	70 Å²	70	86.7 Å²	86.7	46%	0.455	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	137.1	170.5	-26.1	34.6	0	0	0	111.5	Y93 S98 S112	Y93-P110 HydrophobicContact CD1-CG 4.4Å; Y93-P110 HydrophobicContact CE1-CG 4.18Å; S98-P110 WeakPolarHBondContact OG-CD 3.14Å; S98-P110 WeakPolarHBondContact OG-CG 3.47Å; P110-S112 PolarHBondContact O-N 2.86Å
111	G	78.9	Confident	89.3	Confident	91 Å²	91	81.5 Å²	81.5	94%	0.938	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-9.7	-178.6	0	0	0	0	0	115.4	M109	M109-G111 PolarHBondContact O-N 3.01Å
112	S	84.3	Confident	89.3	Confident	53 Å²	53	82 Å²	82	37%	0.371	44%	0.437	S	S	.	.	S	Bend	trans	-76.7	149.9	170.9	69.6	0	0	0	0	111.6	I108 M109 P110 K114	I108-S112 WeakPolarHBondContact CG2-OG 3.19Å; M109-S112 WeakPolarHBondContact O-CB 3.33Å; M109-S112 PolarHBondContact O-N 3.19Å; M109-S112 VanDerWaalsContact O-N 3.1Å; M109-S112 PolarHBondContact O-OG 2.94Å; P110-S112 PolarHBondContact O-N 2.86Å; S112-K114 PolarHBondContact O-N 3.08Å
113	R	87.5	Confident	89.3	Confident	199 Å²	199	80.5 Å²	80.5	75%	0.751	43%	0.43	S	S	*	.			trans	-65.5	130.8	172.6	-70.4	-176.2	-175.3	173.3	1.7	109.4
114	K	91.4	Very high	89.3	Confident	86 Å²	86	78.3 Å²	78.3	37%	0.374	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.6	177.7	67	172.9	171.1	167.1	0	110.8	S99 I108 S112 E116	S99-K114 PolarHBondContact OG-NZ 3.45Å; I108-K114 HydrophobicContact CD1-CB 4.37Å; I108-K114 HydrophobicContact CG2-CB 3.95Å; S112-K114 PolarHBondContact O-N 3.08Å; K114-E116 HydrophobicContact CD-CG 4.09Å; K114-E116 VanDerWaalsContact CE-CD 3.49Å; K114-E116 WeakPolarHBondContact CE-OE1 3.39Å; K114-E116 HydrophobicContact CG-CG 4.2Å; K114-E116 IonicContact NZ-OE1 2.99Å; K114-E116 PolarHBondContact NZ-OE1 3.37Å; K114-E116 IonicContact NZ-OE2 3.55Å
115	M	92.8	Very high	89.3	Confident	34 Å²	34	81 Å²	81	17%	0.167	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.8	171.9	-58.2	-54.1	-55.6	0	0	109.1	S121 W122 F127 G137	M115-S121 CarbonylContact O-C 3.52Å; M115-S121 VanDerWaalsContact O-CA 3.26Å; M115-S121 WeakPolarHBondContact O-CA 3.28Å; M115-W122 HydrophobicContact CB-CB 4.37Å; M115-W122 PolarHBondContact N-O 2.96Å; M115-W122 PolarHBondContact O-N 2.65Å; M115-F127 HydrophobicContact CB-CB 3.85Å; M115-F127 HydrophobicContact CB-CD1 4.09Å; M115-F127 HydrophobicContact CB-CD2 4.07Å; M115-F127 HydrophobicContact CB-CG 3.73Å; M115-F127 HydrophobicContact CE-CD1 4.1Å; M115-F127 HydrophobicContact CE-CE1 4.27Å; M115-F127 HydrophobicContact CG-CB 3.63Å; M115-F127 HydrophobicContact CG-CD1 3.92Å; M115-F127 HydrophobicContact CG-CG 3.82Å; M115-G137 WeakPolarHBondContact CE-O 3.15Å
116	E	92.2	Very high	89.5	Confident	117 Å²	117	75.7 Å²	75.7	55%	0.547	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.1	-179.2	-62.6	-169.5	133.7	0	0	111.6	K114 N120 S121	K114-E116 HydrophobicContact CD-CG 4.09Å; K114-E116 VanDerWaalsContact CE-CD 3.49Å; K114-E116 WeakPolarHBondContact CE-OE1 3.39Å; K114-E116 HydrophobicContact CG-CG 4.2Å; K114-E116 IonicContact NZ-OE1 2.99Å; K114-E116 PolarHBondContact NZ-OE1 3.37Å; K114-E116 IonicContact NZ-OE2 3.55Å; E116-N120 WeakPolarHBondContact CA-O 3.37Å; E116-S121 PolarHBondContact OE1-OG 3.36Å
117	H	89.8	Confident	89.7	Confident	56 Å²	56	68.7 Å²	68.7	26%	0.259	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	131.2	176.6	-173.6	69.1	0	0	0	110.4	G119 N120 W122 F141	H117-G119 VanDerWaalsContact C-N 3.27Å; H117-G119 PolarHBondContact O-N 2.99Å; H117-N120 PolarHBondContact N-O 3.28Å; H117-N120 WeakPolarHBondContact O-CB 2.99Å; H117-N120 PolarHBondContact O-N 2.81Å; H117-W122 HydrophobicContact CB-CH2 4.29Å; H117-W122 HydrophobicContact CB-CZ3 3.91Å; H117-F141 HydrophobicContact CB-CZ 4.15Å; H117-F141 AromaticContact CD2-CZ 3.89Å; H117-F141 AromaticContact CE1-CZ 3.9Å; H117-F141 AromaticContact CG-CZ 3.66Å; H117-F141 AromaticContact ND1-CZ 3.68Å
118	K	88.1	Confident	90	Very high	170 Å²	170	68.3 Å²	68.3	74%	0.739	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	44.1	178.8	-68	-178.5	177.4	-173.1	0	113.8	N120	K118-N120 PolarHBondContact O-N 3.37Å
119	G	87.3	Confident	90.2	Very high	83 Å²	83	68.1 Å²	68.1	86%	0.856	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	0.6	178.3	0	0	0	0	0	115.4	H117	H117-G119 VanDerWaalsContact C-N 3.27Å; H117-G119 PolarHBondContact O-N 2.99Å
120	N	91.2	Very high	90.7	Very high	59 Å²	59	68.6 Å²	68.6	32%	0.316	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.5	173.9	-69.2	-47.8	0	0	0	110.4	H102 E116 H117 K118 W122	H102-N120 HydrophobicContact CB-CB 4.06Å; H102-N120 PolarHBondContact CE1-OD1 3.42Å; H102-N120 PolarHBondContact ND1-OD1 2.89Å; E116-N120 WeakPolarHBondContact CA-O 3.37Å; H117-N120 PolarHBondContact N-O 3.28Å; H117-N120 WeakPolarHBondContact O-CB 2.99Å; H117-N120 PolarHBondContact O-N 2.81Å; K118-N120 PolarHBondContact O-N 3.37Å; N120-W122 VanDerWaalsContact C-CZ3 3.5Å; N120-W122 HydrophobicContact CB-CE3 4.2Å; N120-W122 HydrophobicContact CB-CH2 3.15Å; N120-W122 HydrophobicContact CB-CZ2 3.68Å; N120-W122 HydrophobicContact CB-CZ3 3.44Å; N120-W122 VanDerWaalsContact CB-CZ3 3.44Å; N120-W122 WeakPolarHBondContact O-CZ3 3.45Å
121	S	93.4	Very high	91.4	Very high	13 Å²	13	70.1 Å²	70.1	9%	0.091	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.6	175.4	-51.1	0	0	0	0	110.4	C101 H102 M115 E116	C101-S121 CarbonylContact C-O 3.52Å; C101-S121 VanDerWaalsContact CA-O 3.32Å; C101-S121 WeakPolarHBondContact CA-O 3.07Å; H102-S121 PolarHBondContact N-O 3.46Å; M115-S121 CarbonylContact O-C 3.52Å; M115-S121 VanDerWaalsContact O-CA 3.26Å; M115-S121 WeakPolarHBondContact O-CA 3.28Å; E116-S121 PolarHBondContact OE1-OG 3.36Å
122	W	94.1	Very high	92.2	Very high	13 Å²	13	68.2 Å²	68.2	5%	0.049	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.8	176	-64.2	-104.6	0	0	0	110.9	H102 M115 H117 N120 C126 F127	H102-W122 HydrophobicContact CB-CD2 4.21Å; H102-W122 HydrophobicContact CB-CZ2 3.99Å; M115-W122 HydrophobicContact CB-CB 4.37Å; M115-W122 PolarHBondContact N-O 2.96Å; M115-W122 PolarHBondContact O-N 2.65Å; H117-W122 HydrophobicContact CB-CH2 4.29Å; H117-W122 HydrophobicContact CB-CZ3 3.91Å; N120-W122 VanDerWaalsContact C-CZ3 3.5Å; N120-W122 HydrophobicContact CB-CE3 4.2Å; N120-W122 HydrophobicContact CB-CH2 3.15Å; N120-W122 HydrophobicContact CB-CZ2 3.68Å; N120-W122 HydrophobicContact CB-CZ3 3.44Å; N120-W122 VanDerWaalsContact CB-CZ3 3.44Å; N120-W122 WeakPolarHBondContact O-CZ3 3.45Å; W122-C126 HydrophobicContact CB-CB 4.48Å; W122-F127 HydrophobicContact CB-CB 4.01Å; W122-F127 HydrophobicContact CB-CD2 4.22Å; W122-F127 AromaticContact CD2-CD2 3.82Å; W122-F127 HydrophobicContact CD2-CD2 3.82Å; W122-F127 HydrophobicContact CD2-CE2 4.34Å; W122-F127 AromaticContact CE3-CD2 3.93Å; W122-F127 HydrophobicContact CE3-CD2 3.93Å; W122-F127 HydrophobicContact CE3-CE2 4.14Å; W122-F127 HydrophobicContact CG-CB 4.49Å; W122-F127 AromaticContact CG-CD2 3.97Å; W122-F127 HydrophobicContact CG-CD2 3.97Å; W122-F127 HydrophobicContact CZ3-CD2 4.5Å; W122-F127 HydrophobicContact CZ3-CE2 4.26Å
123	H	93.7	Very high	92.7	Very high	39 Å²	39	70.8 Å²	70.8	18%	0.181	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	148.7	157.9	-56.5	106.1	0	0	0	109.2	C101 C104 T107 T125 C126 F127	C101-H123 WeakPolarHBondContact CB-CE1 3.26Å; C101-H123 VanDerWaalsContact CB-ND1 3.28Å; C101-H123 WeakPolarHBondContact CB-ND1 3.32Å; C101-H123 PolarHBondContact SG-ND1 3.02Å; C101-H123 VanDerWaalsContact SG-ND1 3.36Å; C104-H123 PolarHBondContact SG-CE1 3.32Å; C104-H123 PolarHBondContact SG-ND1 3.45Å; C104-H123 VanDerWaalsContact SG-ND1 3.37Å; T107-H123 PolarHBondContact O-NE2 3.41Å; T107-H123 VanDerWaalsContact O-NE2 3.08Å; H123-T125 PolarHBondContact O-N 2.85Å; H123-C126 HydrophobicContact CB-CB 4.02Å; H123-C126 CarbonylContact O-C 3.53Å; H123-C126 WeakPolarHBondContact O-CA 3.23Å; H123-C126 PolarHBondContact O-N 2.77Å; H123-F127 PolarHBondContact O-N 3.3Å
124	E	92.1	Very high	93.1	Very high	81 Å²	81	67.3 Å²	67.3	38%	0.379	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-38.5	176	-172	170.7	-164.2	0	0	112	C126 F127	E124-C126 VanDerWaalsContact C-N 3.34Å; E124-F127 PolarHBondContact O-N 3.45Å
125	T	93.3	Very high	93.2	Very high	105 Å²	105	66.2 Å²	66.2	64%	0.644	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.8	176.2	54.2	0	0	0	0	114.3	H123 T128	H123-T125 PolarHBondContact O-N 2.85Å; T125-T128 WeakPolarHBondContact O-CG2 3.31Å
126	C	94.6	Very high	93.3	Very high	25 Å²	25	64.9 Å²	64.9	17%	0.169	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-12.9	176.2	-67.6	0	0	0	0	112.5	E103 W122 H123 E124 T128	E103-C126 HydrophobicContact CB-CB 4Å; E103-C126 HydrophobicContact CG-CB 4.42Å; W122-C126 HydrophobicContact CB-CB 4.48Å; H123-C126 HydrophobicContact CB-CB 4.02Å; H123-C126 CarbonylContact O-C 3.53Å; H123-C126 WeakPolarHBondContact O-CA 3.23Å; H123-C126 PolarHBondContact O-N 2.77Å; E124-C126 VanDerWaalsContact C-N 3.34Å; C126-T128 VanDerWaalsContact C-N 3.26Å; C126-T128 PolarHBondContact O-N 3.09Å; C126-T128 VanDerWaalsContact O-N 3.09Å
127	F	95.4	Very high	93.2	Very high	3 Å²	3	59.8 Å²	59.8	1%	0.013	32%	0.321	C	S	.	.	S	Bend	trans	-86.4	70.4	175.7	-164.7	-108.7	0	0	0	110.4	M115 W122 H123 E124 I136 F141 N148	M115-F127 HydrophobicContact CB-CB 3.85Å; M115-F127 HydrophobicContact CB-CD1 4.09Å; M115-F127 HydrophobicContact CB-CD2 4.07Å; M115-F127 HydrophobicContact CB-CG 3.73Å; M115-F127 HydrophobicContact CE-CD1 4.1Å; M115-F127 HydrophobicContact CE-CE1 4.27Å; M115-F127 HydrophobicContact CG-CB 3.63Å; M115-F127 HydrophobicContact CG-CD1 3.92Å; M115-F127 HydrophobicContact CG-CG 3.82Å; W122-F127 HydrophobicContact CB-CB 4.01Å; W122-F127 HydrophobicContact CB-CD2 4.22Å; W122-F127 AromaticContact CD2-CD2 3.82Å; W122-F127 HydrophobicContact CD2-CD2 3.82Å; W122-F127 HydrophobicContact CD2-CE2 4.34Å; W122-F127 AromaticContact CE3-CD2 3.93Å; W122-F127 HydrophobicContact CE3-CD2 3.93Å; W122-F127 HydrophobicContact CE3-CE2 4.14Å; W122-F127 HydrophobicContact CG-CB 4.49Å; W122-F127 AromaticContact CG-CD2 3.97Å; W122-F127 HydrophobicContact CG-CD2 3.97Å; W122-F127 HydrophobicContact CZ3-CD2 4.5Å; W122-F127 HydrophobicContact CZ3-CE2 4.26Å; H123-F127 PolarHBondContact O-N 3.3Å; E124-F127 PolarHBondContact O-N 3.45Å; F127-I136 HydrophobicContact CD1-CB 3.87Å; F127-I136 HydrophobicContact CD1-CG2 4.29Å; F127-I136 HydrophobicContact CE1-CB 3.99Å; F127-I136 HydrophobicContact CE1-CD1 4.27Å; F127-I136 HydrophobicContact CE1-CG2 3.95Å; F127-I136 PolarHBondContact O-N 2.88Å; F127-F141 HydrophobicContact CE1-CD1 4.03Å; F127-F141 HydrophobicContact CE1-CE1 4.18Å; F127-F141 HydrophobicContact CE1-CG 4.31Å; F127-F141 AromaticContact CZ-CD1 3.92Å; F127-F141 HydrophobicContact CZ-CD1 3.92Å; F127-F141 HydrophobicContact CZ-CD2 4.05Å; F127-F141 AromaticContact CZ-CE1 3.73Å; F127-F141 HydrophobicContact CZ-CE1 3.73Å; F127-F141 AromaticContact CZ-CE2 3.85Å; F127-F141 HydrophobicContact CZ-CE2 3.85Å; F127-F141 HydrophobicContact CZ-CG 4.09Å; F127-F141 AromaticContact CZ-CZ 3.7Å; F127-F141 HydrophobicContact CZ-CZ 3.7Å; F127-N148 WeakPolarHBondContact CE2-ND2 3.47Å
128	T	95.9	Very high	93.2	Very high	31 Å²	31	63.9 Å²	63.9	19%	0.19	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-107.9	153.5	-170.5	52.6	0	0	0	0	112.5	T125 C126 K130 Q134 P135	T125-T128 WeakPolarHBondContact O-CG2 3.31Å; C126-T128 VanDerWaalsContact C-N 3.26Å; C126-T128 PolarHBondContact O-N 3.09Å; C126-T128 VanDerWaalsContact O-N 3.09Å; T128-K130 PolarHBondContact O-N 3.36Å; T128-Q134 WeakPolarHBondContact CA-O 3.33Å; T128-P135 HydrophobicContact CG2-CG 4.38Å
129	C	95.6	Very high	93.3	Very high	1 Å²	1	63 Å²	63	1%	0.007	35%	0.346	C	S	.	.			trans	-69.8	128.7	170.8	173.1	0	0	0	0	110.4	R131 C132 Q133 Q134 I136 N148 C150	C129-R131 PolarHBondContact O-N 3.41Å; C129-R131 VanDerWaalsContact O-N 3.12Å; C129-R131 PolarHBondContact SG-N 2.84Å; C129-R131 VanDerWaalsContact SG-N 3.41Å; C129-C132 VanDerWaalsContact CB-SG 3.52Å; C129-Q133 WeakPolarHBondContact O-CA 3.1Å; C129-Q133 PolarHBondContact O-N 3.12Å; C129-Q134 PolarHBondContact N-O 3.27Å; C129-I136 HydrophobicContact CB-CD1 4.23Å; C129-I136 HydrophobicContact CB-CG1 4.12Å; C129-N148 CarbonylContact C-O 3.51Å; C129-N148 VanDerWaalsContact CA-O 3.31Å; C129-N148 WeakPolarHBondContact CA-O 3.36Å; C129-C150 HydrophobicContact CB-CB 4.1Å; C129-C150 PolarHBondContact SG-N 2.97Å
130	K	94.4	Very high	93.5	Very high	111 Å²	111	63.6 Å²	63.6	48%	0.483	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.2	178.6	-177.7	62.3	174.4	179.9	0	114	T128 Q133 Q147 N148 F149	T128-K130 PolarHBondContact O-N 3.36Å; K130-Q133 PolarHBondContact O-NE2 2.77Å; K130-Q147 HydrophobicContact CB-CB 4.15Å; K130-Q147 HydrophobicContact CG-CB 4.34Å; K130-Q147 HydrophobicContact CG-CG 4.28Å; K130-N148 PolarHBondContact N-O 2.95Å; K130-F149 HydrophobicContact CB-CD1 4.47Å; K130-F149 HydrophobicContact CB-CE1 4.03Å; K130-F149 HydrophobicContact CB-CZ 4.07Å; K130-F149 HydrophobicContact CG-CE1 4.5Å; K130-F149 HydrophobicContact CG-CZ 4.35Å
131	R	94	Very high	93.6	Very high	102 Å²	102	63.3 Å²	63.3	39%	0.385	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-56.8	-177.6	-175.9	177.5	177.5	169.2	8	113	C129 F149 C153 K156	C129-R131 PolarHBondContact O-N 3.41Å; C129-R131 VanDerWaalsContact O-N 3.12Å; C129-R131 PolarHBondContact SG-N 2.84Å; C129-R131 VanDerWaalsContact SG-N 3.41Å; R131-F149 HydrophobicContact CB-CD1 4.28Å; R131-F149 HydrophobicContact CB-CE1 4.37Å; R131-C153 HydrophobicContact CB-CB 3.88Å; R131-C153 HydrophobicContact CG-CB 4.27Å; R131-C153 PolarHBondContact NH1-O 3.21Å; R131-K156 VanDerWaalsContact NH1-C 3.29Å; R131-K156 VanDerWaalsContact NH1-CB 3.31Å
132	C	95.3	Very high	93.5	Very high	51 Å²	51	65 Å²	65	35%	0.345	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-6.4	-175.7	66.3	0	0	0	0	114.1	C129 Q134	C129-C132 VanDerWaalsContact CB-SG 3.52Å; C132-Q134 HydrophobicContact CB-CG 4.37Å; C132-Q134 PolarHBondContact O-N 2.91Å
133	Q	95.1	Very high	93.3	Very high	108 Å²	108	67.1 Å²	67.1	51%	0.505	36%	0.356	S	S	.	.			trans	59.5	8.8	-177.9	-59.9	-64.6	-47.1	0	0	114.7	C129 K130	C129-Q133 WeakPolarHBondContact O-CA 3.1Å; C129-Q133 PolarHBondContact O-N 3.12Å; K130-Q133 PolarHBondContact O-NE2 2.77Å
134	Q	95.1	Very high	93	Very high	125 Å²	125	68.2 Å²	68.2	58%	0.584	36%	0.361	S	S	*	.			trans	-80	143.9	177	-63.6	-58.4	-48.7	0	0	111.1	T128 C129 C132 I136	T128-Q134 WeakPolarHBondContact CA-O 3.33Å; C129-Q134 PolarHBondContact N-O 3.27Å; C132-Q134 HydrophobicContact CB-CG 4.37Å; C132-Q134 PolarHBondContact O-N 2.91Å; Q134-I136 PolarHBondContact O-N 3.05Å
135	P	94.8	Very high	92.7	Very high	63 Å²	63	71.8 Å²	71.8	41%	0.409	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-56.5	128.7	170.7	-24.2	34.2	0	0	0	111	T128	T128-P135 HydrophobicContact CG2-CG 4.38Å
136	I	94.8	Very high	92.2	Very high	7 Å²	7	74.7 Å²	74.7	4%	0.036	39%	0.389	C	S	.	.			trans	-77.6	-39.1	176.8	-63.8	173.8	0	0	0	109.5	F127 C129 Q134 K139 F141 N148 C150	F127-I136 HydrophobicContact CD1-CB 3.87Å; F127-I136 HydrophobicContact CD1-CG2 4.29Å; F127-I136 HydrophobicContact CE1-CB 3.99Å; F127-I136 HydrophobicContact CE1-CD1 4.27Å; F127-I136 HydrophobicContact CE1-CG2 3.95Å; F127-I136 PolarHBondContact O-N 2.88Å; C129-I136 HydrophobicContact CB-CD1 4.23Å; C129-I136 HydrophobicContact CB-CG1 4.12Å; Q134-I136 PolarHBondContact O-N 3.05Å; I136-K139 HydrophobicContact CG2-CB 4.28Å; I136-K139 WeakPolarHBondContact CG2-O 3.35Å; I136-K139 WeakPolarHBondContact O-CB 3.37Å; I136-K139 WeakPolarHBondContact O-CG 3.33Å; I136-K139 PolarHBondContact O-N 2.9Å; I136-F141 HydrophobicContact CD1-CB 3.92Å; I136-F141 HydrophobicContact CG2-CB 3.87Å; I136-N148 HydrophobicContact CD1-CB 3.93Å; I136-C150 HydrophobicContact CG1-CB 4.42Å
137	G	89.9	Confident	91.9	Very high	10 Å²	10	77 Å²	77	10%	0.103	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	-135.7	-175.1	0	0	0	0	0	111.2	M115 K139	M115-G137 WeakPolarHBondContact CE-O 3.15Å; G137-K139 VanDerWaalsContact C-N 3.26Å; G137-K139 PolarHBondContact O-N 3.48Å
138	T	89.1	Confident	91.8	Very high	141 Å²	141	77.8 Å²	77.8	87%	0.865	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	0.8	179.8	56.7	0	0	0	0	114.5
139	K	90.5	Very high	91.7	Very high	152 Å²	152	76.6 Å²	76.6	66%	0.661	39%	0.394	S	S	*	.	S	Bend	trans	-70.3	153	179.8	-61.1	173.5	-176.4	170.9	0	110.7	I136 G137	I136-K139 HydrophobicContact CG2-CB 4.28Å; I136-K139 WeakPolarHBondContact CG2-O 3.35Å; I136-K139 WeakPolarHBondContact O-CB 3.37Å; I136-K139 WeakPolarHBondContact O-CG 3.33Å; I136-K139 PolarHBondContact O-N 2.9Å; G137-K139 VanDerWaalsContact C-N 3.26Å; G137-K139 PolarHBondContact O-N 3.48Å
140	S	90.8	Very high	91.7	Very high	96 Å²	96	77.8 Å²	77.8	67%	0.671	40%	0.402	S	S	*	.			trans	-57.8	143.5	172.2	-52.9	0	0	0	0	111.4
141	F	93.3	Very high	91.5	Very high	53 Å²	53	74.4 Å²	74.4	23%	0.232	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	163.8	179.3	74.3	-80.5	0	0	0	110.9	H117 F127 I136 P143 N148 F149	H117-F141 HydrophobicContact CB-CZ 4.15Å; H117-F141 AromaticContact CD2-CZ 3.89Å; H117-F141 AromaticContact CE1-CZ 3.9Å; H117-F141 AromaticContact CG-CZ 3.66Å; H117-F141 AromaticContact ND1-CZ 3.68Å; F127-F141 HydrophobicContact CE1-CD1 4.03Å; F127-F141 HydrophobicContact CE1-CE1 4.18Å; F127-F141 HydrophobicContact CE1-CG 4.31Å; F127-F141 AromaticContact CZ-CD1 3.92Å; F127-F141 HydrophobicContact CZ-CD1 3.92Å; F127-F141 HydrophobicContact CZ-CD2 4.05Å; F127-F141 AromaticContact CZ-CE1 3.73Å; F127-F141 HydrophobicContact CZ-CE1 3.73Å; F127-F141 AromaticContact CZ-CE2 3.85Å; F127-F141 HydrophobicContact CZ-CE2 3.85Å; F127-F141 HydrophobicContact CZ-CG 4.09Å; F127-F141 AromaticContact CZ-CZ 3.7Å; F127-F141 HydrophobicContact CZ-CZ 3.7Å; I136-F141 HydrophobicContact CD1-CB 3.92Å; I136-F141 HydrophobicContact CG2-CB 3.87Å; F141-P143 HydrophobicContact CE2-CB 4.16Å; F141-P143 HydrophobicContact CE2-CG 4.23Å; F141-N148 HydrophobicContact CD2-CB 4.13Å; F141-F149 CarbonylContact C-O 3.56Å; F141-F149 WeakPolarHBondContact CA-O 3.37Å; F141-F149 WeakPolarHBondContact CB-O 3.21Å
142	I	91.1	Very high	91.3	Very high	48 Å²	48	73.7 Å²	73.7	25%	0.246	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	112.6	180	-58.1	173.4	0	0	0	108.2	F149 V151 Y154	I142-F149 PolarHBondContact N-O 3.12Å; I142-F149 PolarHBondContact O-N 3.04Å; I142-V151 HydrophobicContact CD1-CG2 4.36Å; I142-V151 HydrophobicContact CG1-CG2 4.33Å; I142-Y154 HydrophobicContact CB-CD1 4.33Å; I142-Y154 HydrophobicContact CB-CD2 3.76Å; I142-Y154 HydrophobicContact CB-CE2 4.13Å; I142-Y154 HydrophobicContact CB-CG 3.87Å; I142-Y154 HydrophobicContact CD1-CD1 3.36Å; I142-Y154 HydrophobicContact CD1-CD2 4.35Å; I142-Y154 HydrophobicContact CD1-CE1 3.94Å; I142-Y154 HydrophobicContact CD1-CG 3.6Å; I142-Y154 HydrophobicContact CG1-CD1 4.41Å; I142-Y154 HydrophobicContact CG1-CG 4.28Å; I142-Y154 HydrophobicContact CG2-CD1 4.16Å; I142-Y154 HydrophobicContact CG2-CD2 3.58Å; I142-Y154 HydrophobicContact CG2-CE1 4.01Å; I142-Y154 HydrophobicContact CG2-CE2 3.4Å; I142-Y154 HydrophobicContact CG2-CG 3.96Å
143	P	89.8	Confident	91.1	Very high	57 Å²	57	72.1 Å²	72.1	37%	0.37	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131	173.4	29.6	-31.2	0	0	0	110.4	F141 Q147	F141-P143 HydrophobicContact CE2-CB 4.16Å; F141-P143 HydrophobicContact CE2-CG 4.23Å; P143-Q147 WeakPolarHBondContact CA-O 2.96Å
144	K	87.3	Confident	90.9	Very high	63 Å²	63	69.9 Å²	69.9	27%	0.274	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	127	174.3	-173.1	-178.6	178.7	-168.4	0	109.5	N146 Q147 F149 Y154 F158	K144-N146 VanDerWaalsContact C-N 3.34Å; K144-N146 PolarHBondContact O-N 2.99Å; K144-Q147 PolarHBondContact N-O 3.25Å; K144-Q147 WeakPolarHBondContact O-CA 3.16Å; K144-Q147 WeakPolarHBondContact O-CB 3.48Å; K144-Q147 PolarHBondContact O-N 3.39Å; K144-Q147 VanDerWaalsContact O-O 3.12Å; K144-F149 HydrophobicContact CB-CD2 4.32Å; K144-F149 HydrophobicContact CB-CE2 4.19Å; K144-Y154 HydrophobicContact CB-CE2 4.05Å; K144-Y154 HydrophobicContact CD-CE2 3.87Å; K144-Y154 HydrophobicContact CG-CE2 4.5Å; K144-F158 HydrophobicContact CD-CD2 4.48Å; K144-F158 HydrophobicContact CD-CE1 4.29Å; K144-F158 HydrophobicContact CD-CE2 4.11Å; K144-F158 HydrophobicContact CD-CZ 4Å; K144-F158 VanDerWaalsContact NZ-CD1 3.32Å
145	E	86.4	Confident	90.5	Very high	155 Å²	155	66.4 Å²	66.4	72%	0.724	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	47.5	176.3	-64.5	164.6	-148.2	0	0	113.6	Q147	E145-Q147 PolarHBondContact O-N 2.89Å; E145-Q147 VanDerWaalsContact O-N 3.11Å
146	N	82.6	Confident	90	Very high	167 Å²	167	70.8 Å²	70.8	89%	0.893	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	13.5	-174.2	-74.7	-8.5	0	0	0	115.9	K144	K144-N146 VanDerWaalsContact C-N 3.34Å; K144-N146 PolarHBondContact O-N 2.99Å
147	Q	89.4	Confident	89.5	Confident	73 Å²	73	75.3 Å²	75.3	34%	0.341	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	145.9	174.2	-62.9	173	2.9	0	0	110.5	K130 P143 K144 E145 F149	K130-Q147 HydrophobicContact CB-CB 4.15Å; K130-Q147 HydrophobicContact CG-CB 4.34Å; K130-Q147 HydrophobicContact CG-CG 4.28Å; P143-Q147 WeakPolarHBondContact CA-O 2.96Å; K144-Q147 PolarHBondContact N-O 3.25Å; K144-Q147 WeakPolarHBondContact O-CA 3.16Å; K144-Q147 WeakPolarHBondContact O-CB 3.48Å; K144-Q147 PolarHBondContact O-N 3.39Å; K144-Q147 VanDerWaalsContact O-O 3.12Å; E145-Q147 PolarHBondContact O-N 2.89Å; E145-Q147 VanDerWaalsContact O-N 3.11Å; Q147-F149 HydrophobicContact CB-CD2 4.47Å; Q147-F149 HydrophobicContact CB-CE2 3.73Å; Q147-F149 HydrophobicContact CB-CZ 4.26Å
148	N	92.5	Very high	89.3	Confident	20 Å²	20	78 Å²	78	11%	0.107	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.4	177.8	-60.5	-41.8	0	0	0	109.6	F127 C129 K130 I136 F141	F127-N148 WeakPolarHBondContact CE2-ND2 3.47Å; C129-N148 CarbonylContact C-O 3.51Å; C129-N148 VanDerWaalsContact CA-O 3.31Å; C129-N148 WeakPolarHBondContact CA-O 3.36Å; K130-N148 PolarHBondContact N-O 2.95Å; I136-N148 HydrophobicContact CD1-CB 3.93Å; F141-N148 HydrophobicContact CD2-CB 4.13Å
149	F	94.1	Very high	89.1	Confident	6 Å²	6	72.6 Å²	72.6	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.6	174.9	-64.5	-96.3	0	0	0	109.8	K130 R131 F141 I142 K144 Q147 Y154 F158	K130-F149 HydrophobicContact CB-CD1 4.47Å; K130-F149 HydrophobicContact CB-CE1 4.03Å; K130-F149 HydrophobicContact CB-CZ 4.07Å; K130-F149 HydrophobicContact CG-CE1 4.5Å; K130-F149 HydrophobicContact CG-CZ 4.35Å; R131-F149 HydrophobicContact CB-CD1 4.28Å; R131-F149 HydrophobicContact CB-CE1 4.37Å; F141-F149 CarbonylContact C-O 3.56Å; F141-F149 WeakPolarHBondContact CA-O 3.37Å; F141-F149 WeakPolarHBondContact CB-O 3.21Å; I142-F149 PolarHBondContact N-O 3.12Å; I142-F149 PolarHBondContact O-N 3.04Å; K144-F149 HydrophobicContact CB-CD2 4.32Å; K144-F149 HydrophobicContact CB-CE2 4.19Å; Q147-F149 HydrophobicContact CB-CD2 4.47Å; Q147-F149 HydrophobicContact CB-CE2 3.73Å; Q147-F149 HydrophobicContact CB-CZ 4.26Å; F149-Y154 HydrophobicContact CB-CD2 3.94Å; F149-Y154 HydrophobicContact CB-CG 4.36Å; F149-Y154 HydrophobicContact CD2-CD2 4.19Å; F149-Y154 HydrophobicContact CG-CD2 4.13Å; F149-F158 HydrophobicContact CD1-CE2 4.31Å; F149-F158 HydrophobicContact CE1-CE2 4.1Å; F149-F158 HydrophobicContact CE1-CZ 4.45Å; F149-F158 HydrophobicContact CE2-CE2 4.34Å; F149-F158 HydrophobicContact CZ-CE2 4.13Å; F149-F158 HydrophobicContact CZ-CZ 4.24Å
150	C	94.7	Very high	88.9	Confident	26 Å²	26	70.8 Å²	70.8	18%	0.176	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	147.7	164.1	70.6	0	0	0	0	108.8	C129 I136 P152 C153 Y154	C129-C150 HydrophobicContact CB-CB 4.1Å; C129-C150 PolarHBondContact SG-N 2.97Å; I136-C150 HydrophobicContact CG1-CB 4.42Å; C150-P152 VanDerWaalsContact C-CD 3.48Å; C150-P152 VanDerWaalsContact C-N 3.33Å; C150-C153 PolarHBondContact O-N 2.84Å; C150-C153 WeakPolarHBondContact SG-CB 3.49Å; C150-C153 PolarHBondContact SG-SG 2.84Å; C150-Y154 PolarHBondContact O-N 3.04Å
151	V	90.4	Very high	88.9	Confident	40 Å²	40	72.1 Å²	72.1	24%	0.242	36%	0.362	C	S	.	.	H	α-helix	trans	-49	-48.3	-176.6	174.7	0	0	0	0	112.3	I142 C153 Y154 E155	I142-V151 HydrophobicContact CD1-CG2 4.36Å; I142-V151 HydrophobicContact CG1-CG2 4.33Å; V151-C153 VanDerWaalsContact C-N 3.34Å; V151-C153 PolarHBondContact O-N 3.04Å; V151-Y154 PolarHBondContact O-N 2.76Å; V151-E155 HydrophobicContact CG1-CG 4.17Å; V151-E155 WeakPolarHBondContact CG1-OE1 3.31Å; V151-E155 WeakPolarHBondContact O-CB 3.21Å; V151-E155 WeakPolarHBondContact O-CG 3.46Å; V151-E155 PolarHBondContact O-N 3.28Å
152	P	90.1	Very high	88.9	Confident	87 Å²	87	69.6 Å²	69.6	57%	0.565	35%	0.351	S	S	*	.	H	α-helix	trans	-62.4	-37.9	-180	-23	33.8	0	0	0	113.9	C150 K156	C150-P152 VanDerWaalsContact C-CD 3.48Å; C150-P152 VanDerWaalsContact C-N 3.33Å; P152-K156 WeakPolarHBondContact O-CB 3.33Å; P152-K156 PolarHBondContact O-N 3.24Å
153	C	92.2	Very high	89	Confident	17 Å²	17	69.1 Å²	69.1	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-71.8	-39.2	179.5	-81.5	0	0	0	0	112.1	R131 C150 V151 Q157	R131-C153 HydrophobicContact CB-CB 3.88Å; R131-C153 HydrophobicContact CG-CB 4.27Å; R131-C153 PolarHBondContact NH1-O 3.21Å; C150-C153 PolarHBondContact O-N 2.84Å; C150-C153 WeakPolarHBondContact SG-CB 3.49Å; C150-C153 PolarHBondContact SG-SG 2.84Å; V151-C153 VanDerWaalsContact C-N 3.34Å; V151-C153 PolarHBondContact O-N 3.04Å; C153-Q157 WeakPolarHBondContact O-CB 3.19Å; C153-Q157 PolarHBondContact O-N 3.5Å
154	Y	90.7	Very high	89.2	Confident	61 Å²	61	72.2 Å²	72.2	24%	0.239	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-52.8	175.7	-172.8	-87.7	0	0	0	110.3	I142 K144 F149 C150 V151 K156 Q157 F158	I142-Y154 HydrophobicContact CB-CD1 4.33Å; I142-Y154 HydrophobicContact CB-CD2 3.76Å; I142-Y154 HydrophobicContact CB-CE2 4.13Å; I142-Y154 HydrophobicContact CB-CG 3.87Å; I142-Y154 HydrophobicContact CD1-CD1 3.36Å; I142-Y154 HydrophobicContact CD1-CD2 4.35Å; I142-Y154 HydrophobicContact CD1-CE1 3.94Å; I142-Y154 HydrophobicContact CD1-CG 3.6Å; I142-Y154 HydrophobicContact CG1-CD1 4.41Å; I142-Y154 HydrophobicContact CG1-CG 4.28Å; I142-Y154 HydrophobicContact CG2-CD1 4.16Å; I142-Y154 HydrophobicContact CG2-CD2 3.58Å; I142-Y154 HydrophobicContact CG2-CE1 4.01Å; I142-Y154 HydrophobicContact CG2-CE2 3.4Å; I142-Y154 HydrophobicContact CG2-CG 3.96Å; K144-Y154 HydrophobicContact CB-CE2 4.05Å; K144-Y154 HydrophobicContact CD-CE2 3.87Å; K144-Y154 HydrophobicContact CG-CE2 4.5Å; F149-Y154 HydrophobicContact CB-CD2 3.94Å; F149-Y154 HydrophobicContact CB-CG 4.36Å; F149-Y154 HydrophobicContact CD2-CD2 4.19Å; F149-Y154 HydrophobicContact CG-CD2 4.13Å; C150-Y154 PolarHBondContact O-N 3.04Å; V151-Y154 PolarHBondContact O-N 2.76Å; Y154-K156 PolarHBondContact O-N 3.41Å; Y154-Q157 PolarHBondContact O-N 3.36Å; Y154-F158 HydrophobicContact CD1-CB 4.38Å; Y154-F158 HydrophobicContact CD1-CD2 4.16Å; Y154-F158 AromaticContact CD2-CD2 3.41Å; Y154-F158 HydrophobicContact CD2-CD2 3.41Å; Y154-F158 VanDerWaalsContact CD2-CD2 3.41Å; Y154-F158 AromaticContact CD2-CE2 3.77Å; Y154-F158 HydrophobicContact CD2-CE2 3.77Å; Y154-F158 HydrophobicContact CE1-CB 4.04Å; Y154-F158 HydrophobicContact CE1-CD2 4.22Å; Y154-F158 AromaticContact CE2-CD2 3.49Å; Y154-F158 HydrophobicContact CE2-CD2 3.49Å; Y154-F158 VanDerWaalsContact CE2-CD2 3.49Å; Y154-F158 AromaticContact CE2-CE2 3.93Å; Y154-F158 HydrophobicContact CE2-CE2 3.93Å; Y154-F158 HydrophobicContact CE2-CG 4.27Å; Y154-F158 AromaticContact CG-CD2 3.77Å; Y154-F158 HydrophobicContact CG-CD2 3.77Å; Y154-F158 HydrophobicContact CG-CE2 4.45Å; Y154-F158 AromaticContact CZ-CD2 3.91Å; Y154-F158 WeakPolarHBondContact O-CD2 3.41Å; Y154-F158 PolarHBondContact O-N 2.97Å
155	E	86.6	Confident	89.5	Confident	53 Å²	53	71.1 Å²	71.1	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-56.7	-47.8	177.7	-74.3	175.4	167.8	0	0	111.5	V151 Q157 F158 A159 T170	V151-E155 HydrophobicContact CG1-CG 4.17Å; V151-E155 WeakPolarHBondContact CG1-OE1 3.31Å; V151-E155 WeakPolarHBondContact O-CB 3.21Å; V151-E155 WeakPolarHBondContact O-CG 3.46Å; V151-E155 PolarHBondContact O-N 3.28Å; E155-Q157 PolarHBondContact O-N 3.46Å; E155-Q157 VanDerWaalsContact O-N 3.12Å; E155-F158 PolarHBondContact O-N 3.24Å; E155-A159 HydrophobicContact CB-CB 4.46Å; E155-A159 WeakPolarHBondContact O-CA 3.41Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.03Å; E155-T170 HydrophobicContact CB-CG2 3.96Å; E155-T170 HydrophobicContact CG-CG2 4.07Å; E155-T170 WeakPolarHBondContact OE2-CG2 3.42Å
156	K	84.3	Confident	89.8	Confident	155 Å²	155	70.3 Å²	70.3	67%	0.674	35%	0.354	S	S	*	.	H	α-helix	trans	-63.6	-20.7	178.9	-175.1	177.9	179.6	177.3	0	113.5	R131 P152 Y154	R131-K156 VanDerWaalsContact NH1-C 3.29Å; R131-K156 VanDerWaalsContact NH1-CB 3.31Å; P152-K156 WeakPolarHBondContact O-CB 3.33Å; P152-K156 PolarHBondContact O-N 3.24Å; Y154-K156 PolarHBondContact O-N 3.41Å
157	Q	84.2	Confident	90.1	Very high	101 Å²	101	69.3 Å²	69.3	47%	0.472	34%	0.341	S	S	.	.	H	α-helix	trans	-99.9	-34.6	-178.6	-169.3	170.3	-15.6	0	0	112.9	C153 Y154 E155	C153-Q157 WeakPolarHBondContact O-CB 3.19Å; C153-Q157 PolarHBondContact O-N 3.5Å; Y154-Q157 PolarHBondContact O-N 3.36Å; E155-Q157 PolarHBondContact O-N 3.46Å; E155-Q157 VanDerWaalsContact O-N 3.12Å
158	F	84.7	Confident	90	Very high	67 Å²	67	68.3 Å²	68.3	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-124.1	-8.9	-166.9	-54.3	-65	0	0	0	113.9	K144 F149 Y154 E155 M160	K144-F158 HydrophobicContact CD-CD2 4.48Å; K144-F158 HydrophobicContact CD-CE1 4.29Å; K144-F158 HydrophobicContact CD-CE2 4.11Å; K144-F158 HydrophobicContact CD-CZ 4Å; K144-F158 VanDerWaalsContact NZ-CD1 3.32Å; F149-F158 HydrophobicContact CD1-CE2 4.31Å; F149-F158 HydrophobicContact CE1-CE2 4.1Å; F149-F158 HydrophobicContact CE1-CZ 4.45Å; F149-F158 HydrophobicContact CE2-CE2 4.34Å; F149-F158 HydrophobicContact CZ-CE2 4.13Å; F149-F158 HydrophobicContact CZ-CZ 4.24Å; Y154-F158 HydrophobicContact CD1-CB 4.38Å; Y154-F158 HydrophobicContact CD1-CD2 4.16Å; Y154-F158 AromaticContact CD2-CD2 3.41Å; Y154-F158 HydrophobicContact CD2-CD2 3.41Å; Y154-F158 VanDerWaalsContact CD2-CD2 3.41Å; Y154-F158 AromaticContact CD2-CE2 3.77Å; Y154-F158 HydrophobicContact CD2-CE2 3.77Å; Y154-F158 HydrophobicContact CE1-CB 4.04Å; Y154-F158 HydrophobicContact CE1-CD2 4.22Å; Y154-F158 AromaticContact CE2-CD2 3.49Å; Y154-F158 HydrophobicContact CE2-CD2 3.49Å; Y154-F158 VanDerWaalsContact CE2-CD2 3.49Å; Y154-F158 AromaticContact CE2-CE2 3.93Å; Y154-F158 HydrophobicContact CE2-CE2 3.93Å; Y154-F158 HydrophobicContact CE2-CG 4.27Å; Y154-F158 AromaticContact CG-CD2 3.77Å; Y154-F158 HydrophobicContact CG-CD2 3.77Å; Y154-F158 HydrophobicContact CG-CE2 4.45Å; Y154-F158 AromaticContact CZ-CD2 3.91Å; Y154-F158 WeakPolarHBondContact O-CD2 3.41Å; Y154-F158 PolarHBondContact O-N 2.97Å; E155-F158 PolarHBondContact O-N 3.24Å; F158-M160 PolarHBondContact O-N 3.42Å
159	A	84.4	Confident	89.9	Confident	27 Å²	27	68.6 Å²	68.6	22%	0.223	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-67.5	137.2	176.2	0	0	0	0	0	110.5	E155 P168	E155-A159 HydrophobicContact CB-CB 4.46Å; E155-A159 WeakPolarHBondContact O-CA 3.41Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.03Å; A159-P168 HydrophobicContact CB-CB 3.9Å
160	M	86.3	Confident	89.3	Confident	114 Å²	114	71.6 Å²	71.6	56%	0.562	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-63	141.3	171.1	-61.2	179	84.5	0	0	109.6	F158 I169 P180	F158-M160 PolarHBondContact O-N 3.42Å; M160-I169 PolarHBondContact O-N 3.44Å; M160-P180 HydrophobicContact CB-CB 3.92Å; M160-P180 HydrophobicContact CB-CG 3.97Å; M160-P180 HydrophobicContact CE-CB 3.79Å; M160-P180 HydrophobicContact CE-CG 3.82Å; M160-P180 HydrophobicContact SD-CB 4.13Å
161	Q	91.4	Very high	88.5	Confident	124 Å²	124	75.9 Å²	75.9	58%	0.579	39%	0.387	S	S	*	.	B	Isolated β-bridge	trans	-91	129.7	178.7	-67.7	179	-25.2	0	0	109.9	V163 P180	Q161-V163 PolarHBondContact O-N 2.96Å; Q161-P180 VanDerWaalsContact O-CG 3.32Å; Q161-P180 WeakPolarHBondContact O-CG 3.14Å
162	C	93.6	Very high	87.9	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-60.9	128.8	174.6	173	0	0	0	0	110.5	H164 K166 K167 I169 P180 H182	C162-H164 PolarHBondContact O-N 3.25Å; C162-H164 PolarHBondContact SG-N 3.45Å; C162-H164 VanDerWaalsContact SG-N 3.44Å; C162-K166 WeakPolarHBondContact O-CA 3.48Å; C162-K166 PolarHBondContact O-N 3.03Å; C162-K167 PolarHBondContact N-O 2.87Å; C162-I169 HydrophobicContact CB-CD1 3.93Å; C162-I169 HydrophobicContact CB-CG1 3.9Å; C162-P180 WeakPolarHBondContact CA-O 3.42Å; C162-H182 VanDerWaalsContact CB-CE1 3.48Å; C162-H182 WeakPolarHBondContact CB-CE1 3.49Å; C162-H182 WeakPolarHBondContact CB-ND1 3.42Å; C162-H182 PolarHBondContact SG-N 3.24Å
163	V	93.8	Very high	87.9	Confident	38 Å²	38	74 Å²	74	23%	0.23	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.2	-178.3	-68.6	0	0	0	0	113.4	Q161 K166 Q179 P180 W181	Q161-V163 PolarHBondContact O-N 2.96Å; V163-K166 WeakPolarHBondContact O-CE 3.28Å; V163-K166 PolarHBondContact O-NZ 2.83Å; V163-Q179 HydrophobicContact CG1-CB 3.95Å; V163-Q179 HydrophobicContact CG1-CG 4.24Å; V163-Q179 HydrophobicContact CG2-CB 4.16Å; V163-P180 PolarHBondContact N-O 3.43Å; V163-P180 VanDerWaalsContact N-O 3.07Å; V163-W181 HydrophobicContact CG2-CD2 3.46Å; V163-W181 VanDerWaalsContact CG2-CD2 3.46Å; V163-W181 HydrophobicContact CG2-CE3 3.93Å; V163-W181 HydrophobicContact CG2-CG 4.06Å; V163-W181 HydrophobicContact CG2-CH2 3.7Å; V163-W181 HydrophobicContact CG2-CZ2 3.2Å; V163-W181 HydrophobicContact CG2-CZ3 4.05Å
164	H	93.5	Very high	87.9	Confident	122 Å²	122	74.7 Å²	74.7	57%	0.565	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-60.3	176.9	-174.7	-99.7	0	0	0	112.7	C162 W181 C185	C162-H164 PolarHBondContact O-N 3.25Å; C162-H164 PolarHBondContact SG-N 3.45Å; C162-H164 VanDerWaalsContact SG-N 3.44Å; H164-W181 HydrophobicContact CB-CE3 3.79Å; H164-W181 HydrophobicContact CB-CZ3 3.64Å; H164-C185 HydrophobicContact CB-CB 3.87Å
165	C	94.2	Very high	88	Confident	41 Å²	41	76.6 Å²	76.6	28%	0.277	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-5.5	-171.8	73.8	0	0	0	0	114.3	K167 H182	C165-K167 PolarHBondContact O-N 2.91Å; C165-K167 PolarHBondContact SG-N 2.82Å; C165-K167 VanDerWaalsContact SG-N 3.45Å; C165-H182 PolarHBondContact SG-CE1 2.92Å; C165-H182 PolarHBondContact SG-ND1 3.04Å
166	K	91.9	Very high	88.3	Confident	138 Å²	138	75.7 Å²	75.7	60%	0.6	41%	0.408	S	S	*	.			trans	60	7.4	-175.8	-50	-54.5	-173	-167.8	0	115.4	C162 V163	C162-K166 WeakPolarHBondContact O-CA 3.48Å; C162-K166 PolarHBondContact O-N 3.03Å; V163-K166 WeakPolarHBondContact O-CE 3.28Å; V163-K166 PolarHBondContact O-NZ 2.83Å
167	K	89.6	Confident	88.6	Confident	145 Å²	145	74.1 Å²	74.1	63%	0.63	40%	0.397	S	S	*	.			trans	-86	150.6	176.8	-61.2	178.5	-177.4	177.4	0	111.3	C162 C165 H182	C162-K167 PolarHBondContact N-O 2.87Å; C165-K167 PolarHBondContact O-N 2.91Å; C165-K167 PolarHBondContact SG-N 2.82Å; C165-K167 VanDerWaalsContact SG-N 3.45Å; K167-H182 PolarHBondContact O-CE1 2.87Å
168	P	87.5	Confident	88.9	Confident	52 Å²	52	76.5 Å²	76.5	34%	0.338	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-54.2	138.6	172	-27.2	36.2	0	0	0	113	A159 T170 H182	A159-P168 HydrophobicContact CB-CB 3.9Å; P168-T170 HydrophobicContact CB-CG2 4.15Å; P168-T170 PolarHBondContact O-N 2.84Å; P168-H182 PolarHBondContact O-CE1 3.48Å; P168-H182 PolarHBondContact O-NE2 3.07Å
169	I	88.8	Confident	89.3	Confident	26 Å²	26	77.9 Å²	77.9	13%	0.133	42%	0.421	C	S	.	.			trans	-91.5	96.6	170.9	-62.1	158.6	0	0	0	107.8	M160 C162 P180	M160-I169 PolarHBondContact O-N 3.44Å; C162-I169 HydrophobicContact CB-CD1 3.93Å; C162-I169 HydrophobicContact CB-CG1 3.9Å; I169-P180 HydrophobicContact CD1-CB 3.67Å; I169-P180 HydrophobicContact CD1-CG 4.44Å
170	T	81.5	Confident	89.8	Confident	69 Å²	69	77.5 Å²	77.5	42%	0.423	42%	0.416	S	S	.	.			trans	-91.7	-23.1	-175.7	55.7	0	0	0	0	113.2	E155 P168	E155-T170 HydrophobicContact CB-CG2 3.96Å; E155-T170 HydrophobicContact CG-CG2 4.07Å; E155-T170 WeakPolarHBondContact OE2-CG2 3.42Å; P168-T170 HydrophobicContact CB-CG2 4.15Å; P168-T170 PolarHBondContact O-N 2.84Å
171	T	78.1	Confident	90.2	Very high	117 Å²	117	74.3 Å²	74.3	72%	0.718	40%	0.398	S	S	*	.	S	Bend	trans	-140.6	109.4	-177.1	-52.8	0	0	0	0	109.6
172	G	78.3	Confident	90.4	Very high	50 Å²	50	70.1 Å²	70.1	52%	0.515	38%	0.378	S	S	.	.			trans	46.1	95.5	169.6	0	0	0	0	0	115.3	K183	G172-K183 WeakPolarHBondContact O-CE 3.35Å
173	G	89.3	Confident	90.4	Very high	37 Å²	37	74.6 Å²	74.6	38%	0.381	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-174.7	174.2	0	0	0	0	0	114.1	W181	G173-W181 WeakPolarHBondContact CA-O 3.37Å
174	V	93.3	Very high	90.4	Very high	32 Å²	32	78.2 Å²	78.2	19%	0.194	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.8	160.1	-66.8	0	0	0	0	109.6	W181 K183 F186 S196	V174-W181 HydrophobicContact CG2-CB 3.96Å; V174-W181 PolarHBondContact N-O 3.22Å; V174-W181 PolarHBondContact O-N 2.91Å; V174-K183 HydrophobicContact CG1-CG 4.2Å; V174-F186 HydrophobicContact CG2-CB 3.73Å; V174-F186 HydrophobicContact CG2-CD1 4Å; V174-F186 HydrophobicContact CG2-CG 3.93Å; V174-S196 WeakPolarHBondContact CG1-OG 3.46Å
175	T	93.6	Very high	90.5	Very high	101 Å²	101	73.4 Å²	73.4	62%	0.62	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.6	170.6	-55.2	0	0	0	0	108.2	Q179	T175-Q179 WeakPolarHBondContact CA-O 3.34Å
176	Y	92.8	Very high	90.6	Very high	34 Å²	34	71.9 Å²	71.9	13%	0.133	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.2	173.9	175.5	-112.4	0	0	0	108.7	D178 Q179 F186 F200 S202	Y176-D178 VanDerWaalsContact C-N 3.28Å; Y176-D178 PolarHBondContact O-N 2.87Å; Y176-Q179 PolarHBondContact N-O 3.25Å; Y176-Q179 WeakPolarHBondContact O-CB 3.15Å; Y176-Q179 PolarHBondContact O-N 3.29Å; Y176-F186 AromaticContact CD1-CE2 3.54Å; Y176-F186 HydrophobicContact CD1-CE2 3.54Å; Y176-F186 AromaticContact CD1-CZ 3.99Å; Y176-F186 HydrophobicContact CD1-CZ 3.99Å; Y176-F186 HydrophobicContact CD2-CE2 4.28Å; Y176-F186 AromaticContact CD2-CZ 3.89Å; Y176-F186 HydrophobicContact CD2-CZ 3.89Å; Y176-F186 HydrophobicContact CE1-CE2 4.21Å; Y176-F186 HydrophobicContact CE2-CZ 4.44Å; Y176-F186 AromaticContact CG-CE2 3.57Å; Y176-F186 HydrophobicContact CG-CE2 3.57Å; Y176-F186 AromaticContact CG-CZ 3.64Å; Y176-F186 HydrophobicContact CG-CZ 3.64Å; Y176-F200 AromaticContact CD2-CE2 3.99Å; Y176-F200 HydrophobicContact CD2-CE2 3.99Å; Y176-F200 AromaticContact CD2-CZ 3.7Å; Y176-F200 HydrophobicContact CD2-CZ 3.7Å; Y176-F200 AromaticContact CE2-CE2 3.51Å; Y176-F200 HydrophobicContact CE2-CE2 3.51Å; Y176-F200 AromaticContact CE2-CZ 3.65Å; Y176-F200 HydrophobicContact CE2-CZ 3.65Å; Y176-S202 WeakPolarHBondContact OH-CB 3.43Å; Y176-S202 PolarHBondContact OH-OG 3.11Å
177	R	90.7	Very high	90.9	Very high	121 Å²	121	68 Å²	68	46%	0.457	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	48.5	-173.7	-59.2	179.8	177.2	-163.1	0.5	112.4	Q179 S202 D205	R177-Q179 PolarHBondContact O-N 2.79Å; R177-S202 PolarHBondContact NH2-OG 3.08Å; R177-D205 IonicContact CZ-OD1 2.88Å; R177-D205 IonicContact NH1-OD1 2.61Å; R177-D205 PolarHBondContact NH1-OD1 3.43Å; R177-D205 IonicContact NH2-OD1 2.88Å
178	D	90.3	Very high	91.2	Very high	151 Å²	151	61.1 Å²	61.1	81%	0.807	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	8.2	-176.5	-54.5	-48.3	0	0	0	115.7	Y176	Y176-D178 VanDerWaalsContact C-N 3.28Å; Y176-D178 PolarHBondContact O-N 2.87Å
179	Q	93.4	Very high	91.5	Very high	97 Å²	97	60.8 Å²	60.8	45%	0.453	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.1	175.5	-67.8	-176.4	1.6	0	0	110.6	V163 T175 Y176 R177 W181	V163-Q179 HydrophobicContact CG1-CB 3.95Å; V163-Q179 HydrophobicContact CG1-CG 4.24Å; V163-Q179 HydrophobicContact CG2-CB 4.16Å; T175-Q179 WeakPolarHBondContact CA-O 3.34Å; Y176-Q179 PolarHBondContact N-O 3.25Å; Y176-Q179 WeakPolarHBondContact O-CB 3.15Å; Y176-Q179 PolarHBondContact O-N 3.29Å; R177-Q179 PolarHBondContact O-N 2.79Å; Q179-W181 PolarHBondContact O-NE1 3.16Å
180	P	94.5	Very high	91.7	Very high	19 Å²	19	62.7 Å²	62.7	12%	0.123	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.9	-179.2	36.7	-40.1	0	0	0	111.6	M160 Q161 C162 V163 I169	M160-P180 HydrophobicContact CB-CB 3.92Å; M160-P180 HydrophobicContact CB-CG 3.97Å; M160-P180 HydrophobicContact CE-CB 3.79Å; M160-P180 HydrophobicContact CE-CG 3.82Å; M160-P180 HydrophobicContact SD-CB 4.13Å; Q161-P180 VanDerWaalsContact O-CG 3.32Å; Q161-P180 WeakPolarHBondContact O-CG 3.14Å; C162-P180 WeakPolarHBondContact CA-O 3.42Å; V163-P180 PolarHBondContact N-O 3.43Å; V163-P180 VanDerWaalsContact N-O 3.07Å; I169-P180 HydrophobicContact CD1-CB 3.67Å; I169-P180 HydrophobicContact CD1-CG 4.44Å
181	W	95.1	Very high	92.4	Very high	47 Å²	47	62.2 Å²	62.2	18%	0.178	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.5	177.8	-55.9	72.8	0	0	0	110.8	V163 H164 G173 V174 Q179 F186	V163-W181 HydrophobicContact CG2-CD2 3.46Å; V163-W181 VanDerWaalsContact CG2-CD2 3.46Å; V163-W181 HydrophobicContact CG2-CE3 3.93Å; V163-W181 HydrophobicContact CG2-CG 4.06Å; V163-W181 HydrophobicContact CG2-CH2 3.7Å; V163-W181 HydrophobicContact CG2-CZ2 3.2Å; V163-W181 HydrophobicContact CG2-CZ3 4.05Å; H164-W181 HydrophobicContact CB-CE3 3.79Å; H164-W181 HydrophobicContact CB-CZ3 3.64Å; G173-W181 WeakPolarHBondContact CA-O 3.37Å; V174-W181 HydrophobicContact CG2-CB 3.96Å; V174-W181 PolarHBondContact N-O 3.22Å; V174-W181 PolarHBondContact O-N 2.91Å; Q179-W181 PolarHBondContact O-NE1 3.16Å; W181-F186 HydrophobicContact CB-CB 4.06Å; W181-F186 HydrophobicContact CD2-CD2 4.1Å; W181-F186 HydrophobicContact CE3-CD2 4.33Å; W181-F186 HydrophobicContact CG-CB 4.48Å; W181-F186 HydrophobicContact CG-CD2 4.21Å
182	H	94.8	Very high	93.2	Very high	36 Å²	36	63 Å²	63	17%	0.167	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	146.9	157.7	-63.1	104.4	0	0	0	108.8	C162 C165 K167 P168 D184 C185 F186	C162-H182 VanDerWaalsContact CB-CE1 3.48Å; C162-H182 WeakPolarHBondContact CB-CE1 3.49Å; C162-H182 WeakPolarHBondContact CB-ND1 3.42Å; C162-H182 PolarHBondContact SG-N 3.24Å; C165-H182 PolarHBondContact SG-CE1 2.92Å; C165-H182 PolarHBondContact SG-ND1 3.04Å; K167-H182 PolarHBondContact O-CE1 2.87Å; P168-H182 PolarHBondContact O-CE1 3.48Å; P168-H182 PolarHBondContact O-NE2 3.07Å; H182-D184 PolarHBondContact O-N 3.44Å; H182-C185 HydrophobicContact CB-CB 3.94Å; H182-C185 PolarHBondContact O-N 2.86Å; H182-F186 PolarHBondContact O-N 2.83Å
183	K	94	Very high	94.1	Very high	93 Å²	93	65.9 Å²	65.9	40%	0.404	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-53	-44.4	173.8	-65.3	-178.9	-179.9	179	0	111.1	G172 V174 C185 F186 Q194	G172-K183 WeakPolarHBondContact O-CE 3.35Å; V174-K183 HydrophobicContact CG1-CG 4.2Å; K183-C185 VanDerWaalsContact C-N 3.27Å; K183-C185 PolarHBondContact O-N 3.48Å; K183-F186 PolarHBondContact O-N 3.29Å; K183-Q194 WeakPolarHBondContact O-CG 3.43Å
184	D	94.3	Very high	94.4	Very high	115 Å²	115	67.7 Å²	67.7	62%	0.615	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-74.1	-14.1	179.6	-47.7	-29.7	0	0	0	113.7	H182 L187	H182-D184 PolarHBondContact O-N 3.44Å; D184-L187 WeakPolarHBondContact O-CD1 3.37Å; D184-L187 WeakPolarHBondContact O-CD2 3.33Å; D184-L187 VanDerWaalsContact O-CG 3.28Å; D184-L187 WeakPolarHBondContact O-CG 3.2Å
185	C	95.6	Very high	94.5	Very high	20 Å²	20	66.3 Å²	66.3	14%	0.135	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-94.3	-16.2	173.8	-72.6	0	0	0	0	112.5	H164 H182 K183 L187	H164-C185 HydrophobicContact CB-CB 3.87Å; H182-C185 HydrophobicContact CB-CB 3.94Å; H182-C185 PolarHBondContact O-N 2.86Å; K183-C185 VanDerWaalsContact C-N 3.27Å; K183-C185 PolarHBondContact O-N 3.48Å; C185-L187 PolarHBondContact O-N 3.42Å; C185-L187 VanDerWaalsContact O-N 3.16Å
186	F	96.4	Very high	94.5	Very high	10 Å²	10	62.6 Å²	62.6	4%	0.044	31%	0.313	C	S	.	.	S	Bend	trans	-88.3	79.6	177.8	-169.1	-120.6	0	0	0	110.2	V174 Y176 W181 H182 K183 L195 F200 A207	V174-F186 HydrophobicContact CG2-CB 3.73Å; V174-F186 HydrophobicContact CG2-CD1 4Å; V174-F186 HydrophobicContact CG2-CG 3.93Å; Y176-F186 AromaticContact CD1-CE2 3.54Å; Y176-F186 HydrophobicContact CD1-CE2 3.54Å; Y176-F186 AromaticContact CD1-CZ 3.99Å; Y176-F186 HydrophobicContact CD1-CZ 3.99Å; Y176-F186 HydrophobicContact CD2-CE2 4.28Å; Y176-F186 AromaticContact CD2-CZ 3.89Å; Y176-F186 HydrophobicContact CD2-CZ 3.89Å; Y176-F186 HydrophobicContact CE1-CE2 4.21Å; Y176-F186 HydrophobicContact CE2-CZ 4.44Å; Y176-F186 AromaticContact CG-CE2 3.57Å; Y176-F186 HydrophobicContact CG-CE2 3.57Å; Y176-F186 AromaticContact CG-CZ 3.64Å; Y176-F186 HydrophobicContact CG-CZ 3.64Å; W181-F186 HydrophobicContact CB-CB 4.06Å; W181-F186 HydrophobicContact CD2-CD2 4.1Å; W181-F186 HydrophobicContact CE3-CD2 4.33Å; W181-F186 HydrophobicContact CG-CB 4.48Å; W181-F186 HydrophobicContact CG-CD2 4.21Å; H182-F186 PolarHBondContact O-N 2.83Å; K183-F186 PolarHBondContact O-N 3.29Å; F186-L195 HydrophobicContact CD1-CB 3.65Å; F186-L195 HydrophobicContact CE1-CB 3.6Å; F186-L195 HydrophobicContact CE1-CD1 4.3Å; F186-L195 HydrophobicContact CZ-CB 4.42Å; F186-L195 HydrophobicContact CZ-CD1 4.33Å; F186-L195 PolarHBondContact O-N 3.43Å; F186-F200 HydrophobicContact CE1-CD1 4.25Å; F186-F200 AromaticContact CE1-CE1 3.82Å; F186-F200 HydrophobicContact CE1-CE1 3.82Å; F186-F200 HydrophobicContact CE1-CE2 4.24Å; F186-F200 AromaticContact CE1-CZ 3.82Å; F186-F200 HydrophobicContact CE1-CZ 3.82Å; F186-F200 HydrophobicContact CZ-CD2 4.29Å; F186-F200 HydrophobicContact CZ-CE1 4.09Å; F186-F200 AromaticContact CZ-CE2 3.7Å; F186-F200 HydrophobicContact CZ-CE2 3.7Å; F186-F200 AromaticContact CZ-CZ 3.59Å; F186-F200 HydrophobicContact CZ-CZ 3.59Å; F186-A207 HydrophobicContact CE2-CB 4.21Å; F186-A207 HydrophobicContact CZ-CB 4.32Å
187	L	96.5	Very high	94.3	Very high	55 Å²	55	64.8 Å²	64.8	29%	0.288	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-112.3	154.5	-169.5	-55.7	-178.9	0	0	0	112.2	D184 C185 T189 K192 Q193 Q194	D184-L187 WeakPolarHBondContact O-CD1 3.37Å; D184-L187 WeakPolarHBondContact O-CD2 3.33Å; D184-L187 VanDerWaalsContact O-CG 3.28Å; D184-L187 WeakPolarHBondContact O-CG 3.2Å; C185-L187 PolarHBondContact O-N 3.42Å; C185-L187 VanDerWaalsContact O-N 3.16Å; L187-T189 PolarHBondContact O-N 3.25Å; L187-K192 HydrophobicContact CD1-CB 4.44Å; L187-K192 WeakPolarHBondContact CD2-O 3.32Å; L187-Q193 CarbonylContact C-O 3.6Å; L187-Q193 WeakPolarHBondContact CA-O 3.2Å; L187-Q194 HydrophobicContact CD2-CB 4.03Å
188	C	96.1	Very high	94.4	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.007	35%	0.351	C	S	.	.			trans	-61.3	130	168.7	178.1	0	0	0	0	110	S190 C191 K192 Q193 L195 C209	C188-S190 PolarHBondContact O-N 3.02Å; C188-S190 PolarHBondContact SG-N 2.87Å; C188-C191 VanDerWaalsContact CB-SG 3.52Å; C188-C191 VanDerWaalsContact SG-SG 3.63Å; C188-K192 WeakPolarHBondContact O-CA 3.37Å; C188-K192 PolarHBondContact O-N 3.33Å; C188-Q193 PolarHBondContact N-O 2.84Å; C188-L195 HydrophobicContact CB-CD2 3.99Å; C188-L195 HydrophobicContact CB-CG 4.39Å; C188-C209 HydrophobicContact CB-CB 4.29Å; C188-C209 PolarHBondContact SG-N 3.38Å
189	T	94.9	Very high	94.3	Very high	45 Å²	45	67.6 Å²	67.6	28%	0.276	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.3	179.7	-57.1	0	0	0	0	112.4	L187 K192 F206 A207 Y208	L187-T189 PolarHBondContact O-N 3.25Å; T189-K192 PolarHBondContact O-NZ 2.86Å; T189-F206 HydrophobicContact CG2-CB 4.14Å; T189-F206 HydrophobicContact CG2-CD1 3.68Å; T189-F206 HydrophobicContact CG2-CE1 4.45Å; T189-F206 HydrophobicContact CG2-CG 4.12Å; T189-A207 WeakPolarHBondContact CB-O 3.49Å; T189-A207 PolarHBondContact N-O 2.95Å; T189-A207 PolarHBondContact OG1-O 3.39Å; T189-Y208 HydrophobicContact CG2-CE1 4.18Å
190	S	93.2	Very high	94.3	Very high	66 Å²	66	66.2 Å²	66.2	46%	0.462	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-59.8	-177.6	175.5	0	0	0	0	113.3	C188	C188-S190 PolarHBondContact O-N 3.02Å; C188-S190 PolarHBondContact SG-N 2.87Å
191	C	95.6	Very high	94.1	Very high	59 Å²	59	67.4 Å²	67.4	40%	0.399	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-2.9	-172.9	68.7	0	0	0	0	115.1	C188 Q193 C212	C188-C191 VanDerWaalsContact CB-SG 3.52Å; C188-C191 VanDerWaalsContact SG-SG 3.63Å; C191-Q193 PolarHBondContact O-N 3.49Å; C191-Q193 VanDerWaalsContact O-N 3.08Å; C191-Q193 VanDerWaalsContact SG-CB 3.51Å; C191-C212 VanDerWaalsContact SG-SG 3.7Å
192	K	95.4	Very high	94	Very high	133 Å²	133	67.1 Å²	67.1	58%	0.578	36%	0.355	S	S	*	.			trans	60.1	12.1	-176.6	-48.7	-53.9	-175.4	-165.1	0	115.5	L187 C188 T189	L187-K192 HydrophobicContact CD1-CB 4.44Å; L187-K192 WeakPolarHBondContact CD2-O 3.32Å; C188-K192 WeakPolarHBondContact O-CA 3.37Å; C188-K192 PolarHBondContact O-N 3.33Å; T189-K192 PolarHBondContact O-NZ 2.86Å
193	Q	95.9	Very high	93.7	Very high	111 Å²	111	70.5 Å²	70.5	52%	0.519	37%	0.366	S	S	.	.			trans	-67.7	141	172.8	-174.5	-179.9	4.4	0	0	111.3	L187 C188 C191 L195	L187-Q193 CarbonylContact C-O 3.6Å; L187-Q193 WeakPolarHBondContact CA-O 3.2Å; C188-Q193 PolarHBondContact N-O 2.84Å; C191-Q193 PolarHBondContact O-N 3.49Å; C191-Q193 VanDerWaalsContact O-N 3.08Å; C191-Q193 VanDerWaalsContact SG-CB 3.51Å; Q193-L195 PolarHBondContact O-N 3.38Å
194	Q	95.9	Very high	93.5	Very high	75 Å²	75	71.6 Å²	71.6	35%	0.35	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-60.2	129.2	174.2	177	176.5	-25.9	0	0	112.2	K183 L187	K183-Q194 WeakPolarHBondContact O-CG 3.43Å; L187-Q194 HydrophobicContact CD2-CB 4.03Å
195	L	95.9	Very high	93.1	Very high	3 Å²	3	72 Å²	72	2%	0.016	38%	0.379	C	S	.	.			trans	-97.2	-14.4	179.5	-60.8	-179.7	0	0	0	113.1	F186 C188 Q193 G197 Q198 F200 A207 C209	F186-L195 HydrophobicContact CD1-CB 3.65Å; F186-L195 HydrophobicContact CE1-CB 3.6Å; F186-L195 HydrophobicContact CE1-CD1 4.3Å; F186-L195 HydrophobicContact CZ-CB 4.42Å; F186-L195 HydrophobicContact CZ-CD1 4.33Å; F186-L195 PolarHBondContact O-N 3.43Å; C188-L195 HydrophobicContact CB-CD2 3.99Å; C188-L195 HydrophobicContact CB-CG 4.39Å; Q193-L195 PolarHBondContact O-N 3.38Å; L195-G197 PolarHBondContact O-N 3.38Å; L195-Q198 PolarHBondContact O-N 3Å; L195-F200 HydrophobicContact CB-CB 4.35Å; L195-F200 HydrophobicContact CB-CD1 4.39Å; L195-F200 HydrophobicContact CB-CG 4.37Å; L195-F200 HydrophobicContact CD1-CB 4.07Å; L195-F200 HydrophobicContact CD1-CD2 4.25Å; L195-F200 HydrophobicContact CD1-CG 4.2Å; L195-F200 HydrophobicContact CD2-CB 3.89Å; L195-F200 HydrophobicContact CG-CB 4.33Å; L195-A207 HydrophobicContact CD1-CB 3.58Å; L195-C209 HydrophobicContact CD2-CB 3.76Å
196	S	93.1	Very high	92.9	Very high	23 Å²	23	76.4 Å²	76.4	16%	0.161	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	123.7	176.8	174.8	0	0	0	0	110.9	V174 Q198	V174-S196 WeakPolarHBondContact CG1-OG 3.46Å; S196-Q198 PolarHBondContact O-N 2.96Å
197	G	89.8	Confident	92.7	Very high	80 Å²	80	76.3 Å²	76.3	83%	0.825	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	1.3	-177.9	0	0	0	0	0	115	L195	L195-G197 PolarHBondContact O-N 3.38Å
198	Q	91.1	Very high	92.6	Very high	121 Å²	121	74.6 Å²	74.6	57%	0.565	39%	0.387	S	S	*	.	S	Bend	trans	-108.8	159.1	179.6	-62.2	-64.8	-14.7	0	0	111.2	L195 S196	L195-Q198 PolarHBondContact O-N 3Å; S196-Q198 PolarHBondContact O-N 2.96Å
199	R	89.7	Confident	92.5	Very high	211 Å²	211	75.2 Å²	75.2	80%	0.796	39%	0.391	S	S	*	.			trans	-73.3	133.1	167.9	-65.5	-174.6	178.8	-174.6	0	109.5	L210	R199-L210 HydrophobicContact CB-CD1 3.63Å; R199-L210 HydrophobicContact CB-CG 4.2Å
200	F	93.3	Very high	92.2	Very high	68 Å²	68	75 Å²	75	30%	0.298	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	169.3	179.3	74.7	-87.3	0	0	0	109.9	Y176 F186 L195 A207 Y208	Y176-F200 AromaticContact CD2-CE2 3.99Å; Y176-F200 HydrophobicContact CD2-CE2 3.99Å; Y176-F200 AromaticContact CD2-CZ 3.7Å; Y176-F200 HydrophobicContact CD2-CZ 3.7Å; Y176-F200 AromaticContact CE2-CE2 3.51Å; Y176-F200 HydrophobicContact CE2-CE2 3.51Å; Y176-F200 AromaticContact CE2-CZ 3.65Å; Y176-F200 HydrophobicContact CE2-CZ 3.65Å; F186-F200 HydrophobicContact CE1-CD1 4.25Å; F186-F200 AromaticContact CE1-CE1 3.82Å; F186-F200 HydrophobicContact CE1-CE1 3.82Å; F186-F200 HydrophobicContact CE1-CE2 4.24Å; F186-F200 AromaticContact CE1-CZ 3.82Å; F186-F200 HydrophobicContact CE1-CZ 3.82Å; F186-F200 HydrophobicContact CZ-CD2 4.29Å; F186-F200 HydrophobicContact CZ-CE1 4.09Å; F186-F200 AromaticContact CZ-CE2 3.7Å; F186-F200 HydrophobicContact CZ-CE2 3.7Å; F186-F200 AromaticContact CZ-CZ 3.59Å; F186-F200 HydrophobicContact CZ-CZ 3.59Å; L195-F200 HydrophobicContact CB-CB 4.35Å; L195-F200 HydrophobicContact CB-CD1 4.39Å; L195-F200 HydrophobicContact CB-CG 4.37Å; L195-F200 HydrophobicContact CD1-CB 4.07Å; L195-F200 HydrophobicContact CD1-CD2 4.25Å; L195-F200 HydrophobicContact CD1-CG 4.2Å; L195-F200 HydrophobicContact CD2-CB 3.89Å; L195-F200 HydrophobicContact CG-CB 4.33Å; F200-A207 HydrophobicContact CD2-CB 4.34Å; F200-Y208 WeakPolarHBondContact CA-O 3.41Å; F200-Y208 WeakPolarHBondContact CB-O 3.44Å
201	T	90.6	Very high	92	Very high	44 Å²	44	77 Å²	77	27%	0.27	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	167.3	172.3	-173.4	0	0	0	0	109.7	Y208 L210 F213	T201-Y208 PolarHBondContact N-O 3.24Å; T201-Y208 PolarHBondContact O-N 2.92Å; T201-Y208 VanDerWaalsContact O-O 3.12Å; T201-L210 HydrophobicContact CG2-CD2 4.31Å; T201-F213 HydrophobicContact CG2-CB 3.57Å; T201-F213 HydrophobicContact CG2-CD1 3.61Å; T201-F213 HydrophobicContact CG2-CD2 3.34Å; T201-F213 HydrophobicContact CG2-CE1 4.1Å; T201-F213 HydrophobicContact CG2-CE2 3.87Å; T201-F213 HydrophobicContact CG2-CG 3.19Å; T201-F213 HydrophobicContact CG2-CZ 4.22Å
202	S	91.6	Very high	91.9	Very high	40 Å²	40	74.8 Å²	74.8	28%	0.28	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.8	-179.8	61.7	0	0	0	0	112.3	Y176 R177 F206	Y176-S202 WeakPolarHBondContact OH-CB 3.43Å; Y176-S202 PolarHBondContact OH-OG 3.11Å; R177-S202 PolarHBondContact NH2-OG 3.08Å; S202-F206 CarbonylContact C-O 3.56Å; S202-F206 WeakPolarHBondContact CA-O 3.27Å
203	R	89.8	Confident	91.6	Very high	108 Å²	108	70.7 Å²	70.7	41%	0.408	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	133.9	174.3	172.5	171.6	-172.5	163.4	8.6	109.3	D205 F206 Y208 F213	R203-D205 PolarHBondContact O-N 2.91Å; R203-F206 PolarHBondContact N-O 3.42Å; R203-F206 WeakPolarHBondContact O-CB 3.44Å; R203-F206 PolarHBondContact O-N 3.17Å; R203-Y208 HydrophobicContact CB-CE2 4.42Å; R203-F213 HydrophobicContact CB-CE2 3.85Å
204	D	88.6	Confident	91.2	Very high	116 Å²	116	65.7 Å²	65.7	62%	0.62	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	45.1	-178.6	-49.8	-40.8	0	0	0	111.8	F206	D204-F206 HydrophobicContact CB-CD2 4.41Å; D204-F206 WeakPolarHBondContact O-CD2 3.4Å; D204-F206 WeakPolarHBondContact O-CE2 3.4Å; D204-F206 PolarHBondContact O-N 3.5Å
205	D	86.2	Confident	90.7	Very high	123 Å²	123	65.9 Å²	65.9	66%	0.658	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	-3.8	-176.5	-53.9	-30.6	0	0	0	116.9	R177 R203	R177-D205 IonicContact CZ-OD1 2.88Å; R177-D205 IonicContact NH1-OD1 2.61Å; R177-D205 PolarHBondContact NH1-OD1 3.43Å; R177-D205 IonicContact NH2-OD1 2.88Å; R203-D205 PolarHBondContact O-N 2.91Å
206	F	90.7	Very high	90.2	Very high	112 Å²	112	70.3 Å²	70.3	49%	0.491	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.9	174.4	-63.3	-72.1	0	0	0	111.4	T189 S202 R203 D204 Y208	T189-F206 HydrophobicContact CG2-CB 4.14Å; T189-F206 HydrophobicContact CG2-CD1 3.68Å; T189-F206 HydrophobicContact CG2-CE1 4.45Å; T189-F206 HydrophobicContact CG2-CG 4.12Å; S202-F206 CarbonylContact C-O 3.56Å; S202-F206 WeakPolarHBondContact CA-O 3.27Å; R203-F206 PolarHBondContact N-O 3.42Å; R203-F206 WeakPolarHBondContact O-CB 3.44Å; R203-F206 PolarHBondContact O-N 3.17Å; D204-F206 HydrophobicContact CB-CD2 4.41Å; D204-F206 WeakPolarHBondContact O-CD2 3.4Å; D204-F206 WeakPolarHBondContact O-CE2 3.4Å; D204-F206 PolarHBondContact O-N 3.5Å; F206-Y208 HydrophobicContact CB-CD2 4.32Å; F206-Y208 HydrophobicContact CB-CE2 3.42Å; F206-Y208 VanDerWaalsContact CB-CE2 3.42Å; F206-Y208 WeakPolarHBondContact CB-OH 3.05Å; F206-Y208 VanDerWaalsContact O-CD2 3.24Å; F206-Y208 WeakPolarHBondContact O-CD2 3.36Å; F206-Y208 VanDerWaalsContact O-CE2 3.32Å; F206-Y208 WeakPolarHBondContact O-CE2 3.46Å
207	A	93.9	Very high	89.8	Confident	9 Å²	9	73 Å²	73	7%	0.074	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135	174.6	0	0	0	0	0	110.8	F186 T189 L195 F200	F186-A207 HydrophobicContact CE2-CB 4.21Å; F186-A207 HydrophobicContact CZ-CB 4.32Å; T189-A207 WeakPolarHBondContact CB-O 3.49Å; T189-A207 PolarHBondContact N-O 2.95Å; T189-A207 PolarHBondContact OG1-O 3.39Å; L195-A207 HydrophobicContact CD1-CB 3.58Å; F200-A207 HydrophobicContact CD2-CB 4.34Å
208	Y	94.1	Very high	89.5	Confident	19 Å²	19	70.3 Å²	70.3	8%	0.075	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.8	-179	-61.4	-87.1	0	0	0	110.7	T189 F200 T201 R203 F206 F213 L216 Y217	T189-Y208 HydrophobicContact CG2-CE1 4.18Å; F200-Y208 WeakPolarHBondContact CA-O 3.41Å; F200-Y208 WeakPolarHBondContact CB-O 3.44Å; T201-Y208 PolarHBondContact N-O 3.24Å; T201-Y208 PolarHBondContact O-N 2.92Å; T201-Y208 VanDerWaalsContact O-O 3.12Å; R203-Y208 HydrophobicContact CB-CE2 4.42Å; F206-Y208 HydrophobicContact CB-CD2 4.32Å; F206-Y208 HydrophobicContact CB-CE2 3.42Å; F206-Y208 VanDerWaalsContact CB-CE2 3.42Å; F206-Y208 WeakPolarHBondContact CB-OH 3.05Å; F206-Y208 VanDerWaalsContact O-CD2 3.24Å; F206-Y208 WeakPolarHBondContact O-CD2 3.36Å; F206-Y208 VanDerWaalsContact O-CE2 3.32Å; F206-Y208 WeakPolarHBondContact O-CE2 3.46Å; Y208-F213 HydrophobicContact CD2-CD2 4.23Å; Y208-F213 HydrophobicContact CG-CD2 4.47Å; Y208-L216 HydrophobicContact CD1-CD1 4.08Å; Y208-L216 HydrophobicContact CE1-CD1 3.87Å; Y208-Y217 HydrophobicContact CD2-CE2 4.37Å; Y208-Y217 HydrophobicContact CE2-CE2 4.13Å; Y208-Y217 PolarHBondContact OH-OH 3.05Å
209	C	94.1	Very high	89.3	Confident	13 Å²	13	70.8 Å²	70.8	9%	0.088	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	154.8	163.7	75.4	0	0	0	0	109	C188 L195 N211 C212 F213	C188-C209 HydrophobicContact CB-CB 4.29Å; C188-C209 PolarHBondContact SG-N 3.38Å; L195-C209 HydrophobicContact CD2-CB 3.76Å; C209-N211 VanDerWaalsContact C-N 3.25Å; C209-N211 PolarHBondContact O-N 2.94Å; C209-C212 PolarHBondContact O-N 2.98Å; C209-C212 PolarHBondContact SG-N 3.23Å; C209-C212 VanDerWaalsContact SG-N 3.42Å; C209-F213 WeakPolarHBondContact O-CB 3.48Å; C209-F213 PolarHBondContact O-N 3.43Å
210	L	88.9	Confident	89.2	Confident	40 Å²	40	66.4 Å²	66.4	21%	0.209	33%	0.329	C	S	.	.	H	α-helix	trans	-56.9	-39.7	-175.6	-63.5	-176.6	0	0	0	112.6	R199 T201 F213 C214 L231	R199-L210 HydrophobicContact CB-CD1 3.63Å; R199-L210 HydrophobicContact CB-CG 4.2Å; T201-L210 HydrophobicContact CG2-CD2 4.31Å; L210-F213 PolarHBondContact O-N 3.29Å; L210-C214 WeakPolarHBondContact O-CB 3.22Å; L210-C214 PolarHBondContact O-N 2.82Å; L210-C214 PolarHBondContact O-SG 3.39Å; L210-L231 HydrophobicContact CB-CD1 3.89Å; L210-L231 HydrophobicContact CD1-CD1 4.03Å; L210-L231 HydrophobicContact CD1-CD2 3.92Å; L210-L231 HydrophobicContact CD1-CG 4.49Å; L210-L231 HydrophobicContact CD2-CD1 3.83Å; L210-L231 HydrophobicContact CD2-CD2 3.57Å; L210-L231 HydrophobicContact CD2-CG 4.35Å; L210-L231 HydrophobicContact CG-CD1 4.11Å; L210-L231 HydrophobicContact CG-CD2 4.31Å
211	N	89.1	Confident	89	Confident	109 Å²	109	63.3 Å²	63.3	58%	0.583	32%	0.315	S	S	*	.	H	α-helix	trans	-62.2	-51.1	178.6	-174.2	54.2	0	0	0	112.2	C209 F213 C214 N215	C209-N211 VanDerWaalsContact C-N 3.25Å; C209-N211 PolarHBondContact O-N 2.94Å; N211-F213 VanDerWaalsContact C-N 3.32Å; N211-F213 PolarHBondContact O-N 3.31Å; N211-C214 PolarHBondContact O-N 3.26Å; N211-N215 WeakPolarHBondContact O-CB 3.36Å; N211-N215 VanDerWaalsContact O-CG 3.25Å; N211-N215 PolarHBondContact O-N 3.03Å; N211-N215 PolarHBondContact O-ND2 3.02Å; N211-N215 VanDerWaalsContact O-ND2 3.17Å; N211-N215 PolarHBondContact OD1-ND2 3Å
212	C	91.9	Very high	89	Confident	12 Å²	12	63.7 Å²	63.7	8%	0.081	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-41	177.3	-75.3	0	0	0	0	111.6	C191 C209 N215 L216	C191-C212 VanDerWaalsContact SG-SG 3.7Å; C209-C212 PolarHBondContact O-N 2.98Å; C209-C212 PolarHBondContact SG-N 3.23Å; C209-C212 VanDerWaalsContact SG-N 3.42Å; C212-N215 PolarHBondContact O-N 3.25Å; C212-L216 WeakPolarHBondContact O-CB 3.32Å; C212-L216 WeakPolarHBondContact O-CD1 3.21Å; C212-L216 WeakPolarHBondContact O-CG 3.24Å; C212-L216 PolarHBondContact O-N 2.63Å
213	F	90.2	Very high	89	Confident	48 Å²	48	65.4 Å²	65.4	21%	0.211	34%	0.335	C	S	.	.	H	α-helix	trans	-62	-47.8	178	-173.9	-94.6	0	0	0	111.9	T201 R203 Y208 C209 L210 N211 N215 L216 Y217	T201-F213 HydrophobicContact CG2-CB 3.57Å; T201-F213 HydrophobicContact CG2-CD1 3.61Å; T201-F213 HydrophobicContact CG2-CD2 3.34Å; T201-F213 HydrophobicContact CG2-CE1 4.1Å; T201-F213 HydrophobicContact CG2-CE2 3.87Å; T201-F213 HydrophobicContact CG2-CG 3.19Å; T201-F213 HydrophobicContact CG2-CZ 4.22Å; R203-F213 HydrophobicContact CB-CE2 3.85Å; Y208-F213 HydrophobicContact CD2-CD2 4.23Å; Y208-F213 HydrophobicContact CG-CD2 4.47Å; C209-F213 WeakPolarHBondContact O-CB 3.48Å; C209-F213 PolarHBondContact O-N 3.43Å; L210-F213 PolarHBondContact O-N 3.29Å; N211-F213 VanDerWaalsContact C-N 3.32Å; N211-F213 PolarHBondContact O-N 3.31Å; F213-N215 PolarHBondContact O-N 3.19Å; F213-L216 PolarHBondContact O-N 2.87Å; F213-Y217 HydrophobicContact CD1-CD2 4.49Å; F213-Y217 AromaticContact CD2-CD2 3.37Å; F213-Y217 HydrophobicContact CD2-CD2 3.37Å; F213-Y217 AromaticContact CD2-CE2 3.77Å; F213-Y217 HydrophobicContact CD2-CE2 3.77Å; F213-Y217 HydrophobicContact CD2-CG 4.48Å; F213-Y217 AromaticContact CE2-CD2 3.46Å; F213-Y217 HydrophobicContact CE2-CD2 3.46Å; F213-Y217 VanDerWaalsContact CE2-CD2 3.46Å; F213-Y217 AromaticContact CE2-CE2 3.97Å; F213-Y217 HydrophobicContact CE2-CE2 3.97Å; F213-Y217 HydrophobicContact CE2-CG 4.26Å; F213-Y217 AromaticContact CG-CD2 3.93Å; F213-Y217 HydrophobicContact CG-CD2 3.93Å; F213-Y217 HydrophobicContact CZ-CD2 4.09Å; F213-Y217 WeakPolarHBondContact O-CB 3.03Å; F213-Y217 WeakPolarHBondContact O-CD2 3.17Å; F213-Y217 PolarHBondContact O-N 2.91Å
214	C	86.4	Confident	89	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.034	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-43	178	-70.8	0	0	0	0	111.7	L210 N211 L216 A218 P227 S229 L231	L210-C214 WeakPolarHBondContact O-CB 3.22Å; L210-C214 PolarHBondContact O-N 2.82Å; L210-C214 PolarHBondContact O-SG 3.39Å; N211-C214 PolarHBondContact O-N 3.26Å; C214-L216 VanDerWaalsContact C-N 3.3Å; C214-L216 PolarHBondContact O-N 2.96Å; C214-A218 HydrophobicContact CB-CB 4.14Å; C214-A218 VanDerWaalsContact O-CB 3.26Å; C214-A218 WeakPolarHBondContact O-CB 3.44Å; C214-A218 PolarHBondContact O-N 2.96Å; C214-P227 HydrophobicContact CB-CB 4.12Å; C214-P227 WeakPolarHBondContact O-CB 3.35Å; C214-S229 PolarHBondContact SG-OG 2.84Å; C214-L231 VanDerWaalsContact SG-CD1 3.56Å
215	N	86.4	Confident	88.9	Confident	80 Å²	80	62.8 Å²	62.8	43%	0.428	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-35	177.6	-73	-28.5	0	0	0	113.3	N211 C212 F213 P227	N211-N215 WeakPolarHBondContact O-CB 3.36Å; N211-N215 VanDerWaalsContact O-CG 3.25Å; N211-N215 PolarHBondContact O-N 3.03Å; N211-N215 PolarHBondContact O-ND2 3.02Å; N211-N215 VanDerWaalsContact O-ND2 3.17Å; N211-N215 PolarHBondContact OD1-ND2 3Å; C212-N215 PolarHBondContact O-N 3.25Å; F213-N215 PolarHBondContact O-N 3.19Å; N215-P227 VanDerWaalsContact OD1-CG 3.27Å; N215-P227 WeakPolarHBondContact OD1-CG 3.35Å
216	L	85.6	Confident	88.9	Confident	95 Å²	95	60.3 Å²	60.3	50%	0.497	32%	0.321	S	S	.	.	H	α-helix	trans	-84.5	-33.8	-178.5	-69.5	169.5	0	0	0	113.3	Y208 C212 F213 C214	Y208-L216 HydrophobicContact CD1-CD1 4.08Å; Y208-L216 HydrophobicContact CE1-CD1 3.87Å; C212-L216 WeakPolarHBondContact O-CB 3.32Å; C212-L216 WeakPolarHBondContact O-CD1 3.21Å; C212-L216 WeakPolarHBondContact O-CG 3.24Å; C212-L216 PolarHBondContact O-N 2.63Å; F213-L216 PolarHBondContact O-N 2.87Å; C214-L216 VanDerWaalsContact C-N 3.3Å; C214-L216 PolarHBondContact O-N 2.96Å
217	Y	83.9	Confident	88.7	Confident	79 Å²	79	56 Å²	56	31%	0.31	30%	0.304	S	S	.	.	H	α-helix	trans	-131.8	-17.8	-164.4	-53.2	-63.8	0	0	0	115.8	Y208 F213	Y208-Y217 HydrophobicContact CD2-CE2 4.37Å; Y208-Y217 HydrophobicContact CE2-CE2 4.13Å; Y208-Y217 PolarHBondContact OH-OH 3.05Å; F213-Y217 HydrophobicContact CD1-CD2 4.49Å; F213-Y217 AromaticContact CD2-CD2 3.37Å; F213-Y217 HydrophobicContact CD2-CD2 3.37Å; F213-Y217 AromaticContact CD2-CE2 3.77Å; F213-Y217 HydrophobicContact CD2-CE2 3.77Å; F213-Y217 HydrophobicContact CD2-CG 4.48Å; F213-Y217 AromaticContact CE2-CD2 3.46Å; F213-Y217 HydrophobicContact CE2-CD2 3.46Å; F213-Y217 VanDerWaalsContact CE2-CD2 3.46Å; F213-Y217 AromaticContact CE2-CE2 3.97Å; F213-Y217 HydrophobicContact CE2-CE2 3.97Å; F213-Y217 HydrophobicContact CE2-CG 4.26Å; F213-Y217 AromaticContact CG-CD2 3.93Å; F213-Y217 HydrophobicContact CG-CD2 3.93Å; F213-Y217 HydrophobicContact CZ-CD2 4.09Å; F213-Y217 WeakPolarHBondContact O-CB 3.03Å; F213-Y217 WeakPolarHBondContact O-CD2 3.17Å; F213-Y217 PolarHBondContact O-N 2.91Å
218	A	84.6	Confident	88.3	Confident	25 Å²	25	56.4 Å²	56.4	21%	0.207	31%	0.305	C	S	.	.	S	Bend	trans	-77	146.2	178.2	0	0	0	0	0	110.3	C214 P227	C214-A218 HydrophobicContact CB-CB 4.14Å; C214-A218 VanDerWaalsContact O-CB 3.26Å; C214-A218 WeakPolarHBondContact O-CB 3.44Å; C214-A218 PolarHBondContact O-N 2.96Å; A218-P227 HydrophobicContact CB-CB 4Å
219	K	85	Confident	87.4	Confident	130 Å²	130	58 Å²	58	57%	0.565	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-63.3	145.7	173	-55.4	-164.2	-177.9	-171.8	0	109.7	I228 Q243	K219-I228 PolarHBondContact O-N 2.82Å; K219-Q243 HydrophobicContact CD-CG 4.29Å; K219-Q243 VanDerWaalsContact CD-NE2 3.27Å
220	K	88.5	Confident	86	Confident	120 Å²	120	60 Å²	60	52%	0.522	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-95.5	142	-177.7	-67.3	-179.6	178.4	-178.4	0	110.2	A222 I225	K220-A222 PolarHBondContact O-N 3.15Å; K220-I225 HydrophobicContact CD-CG2 4.31Å; K220-I225 WeakPolarHBondContact CD-O 3.45Å
221	C	89.7	Confident	84.7	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.014	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-64.6	131.3	173.5	171.9	0	0	0	0	110.2	S223 C224 I225 T226 I228 Q243 H245	C221-S223 PolarHBondContact O-N 3.39Å; C221-S223 PolarHBondContact SG-N 3.22Å; C221-C224 VanDerWaalsContact CB-SG 3.54Å; C221-I225 WeakPolarHBondContact O-CA 3.26Å; C221-I225 PolarHBondContact O-N 2.95Å; C221-T226 PolarHBondContact N-O 3.37Å; C221-I228 HydrophobicContact CB-CD1 4.2Å; C221-I228 HydrophobicContact CB-CG1 4.07Å; C221-Q243 CarbonylContact C-O 3.55Å; C221-Q243 VanDerWaalsContact CA-O 3.3Å; C221-Q243 WeakPolarHBondContact CA-O 3.48Å; C221-H245 VanDerWaalsContact CB-CE1 3.49Å; C221-H245 WeakPolarHBondContact CB-CE1 3.41Å; C221-H245 VanDerWaalsContact CB-ND1 3.28Å; C221-H245 WeakPolarHBondContact CB-ND1 3.48Å
222	A	90.9	Very high	83.1	Confident	53 Å²	53	61.1 Å²	61.1	44%	0.438	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.7	179.4	0	0	0	0	0	113.2	K220 R242 Q243 W244	K220-A222 PolarHBondContact O-N 3.15Å; A222-R242 HydrophobicContact CB-CB 4.14Å; A222-R242 HydrophobicContact CB-CG 4.28Å; A222-Q243 PolarHBondContact N-O 2.91Å; A222-W244 HydrophobicContact CB-CD2 4.33Å; A222-W244 HydrophobicContact CB-CZ2 3.98Å
223	S	89.7	Confident	81.5	Confident	75 Å²	75	63.7 Å²	63.7	52%	0.524	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-53.4	178	171.9	0	0	0	0	113.2	C221	C221-S223 PolarHBondContact O-N 3.39Å; C221-S223 PolarHBondContact SG-N 3.22Å
224	C	89.9	Confident	80.3	Confident	49 Å²	49	64.3 Å²	64.3	33%	0.331	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-4.8	-174	71.2	0	0	0	0	114.2	C221 T226 H245	C221-C224 VanDerWaalsContact CB-SG 3.54Å; C224-T226 PolarHBondContact O-N 3.13Å; C224-T226 PolarHBondContact SG-OG1 2.89Å; C224-H245 VanDerWaalsContact SG-CE1 3.56Å; C224-H245 PolarHBondContact SG-ND1 3.32Å; C224-H245 VanDerWaalsContact SG-ND1 3.39Å
225	I	87.9	Confident	79.9	Confident	120 Å²	120	72.8 Å²	72.8	62%	0.615	44%	0.442	S	S	*	.			trans	64.9	-4.3	178.9	-50.2	172.7	0	0	0	113.6	K220 C221	K220-I225 HydrophobicContact CD-CG2 4.31Å; K220-I225 WeakPolarHBondContact CD-O 3.45Å; C221-I225 WeakPolarHBondContact O-CA 3.26Å; C221-I225 PolarHBondContact O-N 2.95Å
226	T	86.3	Confident	79.9	Confident	71 Å²	71	74.6 Å²	74.6	44%	0.436	44%	0.443	S	S	.	.			trans	-75.8	150.5	176.5	71.8	0	0	0	0	111.4	C221 C224 H245	C221-T226 PolarHBondContact N-O 3.37Å; C224-T226 PolarHBondContact O-N 3.13Å; C224-T226 PolarHBondContact SG-OG1 2.89Å; T226-H245 PolarHBondContact OG1-CE1 2.77Å
227	P	85.9	Confident	80.2	Confident	23 Å²	23	71.8 Å²	71.8	15%	0.149	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-63.1	140	179.6	-17.2	28.2	0	0	0	112.8	C214 N215 A218 S229 H245	C214-P227 HydrophobicContact CB-CB 4.12Å; C214-P227 WeakPolarHBondContact O-CB 3.35Å; N215-P227 VanDerWaalsContact OD1-CG 3.27Å; N215-P227 WeakPolarHBondContact OD1-CG 3.35Å; A218-P227 HydrophobicContact CB-CB 4Å; P227-S229 PolarHBondContact O-N 3.24Å; P227-S229 VanDerWaalsContact O-N 3.13Å; P227-H245 PolarHBondContact O-NE2 3.32Å
228	I	85.8	Confident	80.5	Confident	16 Å²	16	71.3 Å²	71.3	8%	0.082	44%	0.437	C	S	.	.			trans	-85.1	86.3	171.5	-58.4	173.2	0	0	0	107.5	K219 C221 G230 Y236 Q243	K219-I228 PolarHBondContact O-N 2.82Å; C221-I228 HydrophobicContact CB-CD1 4.2Å; C221-I228 HydrophobicContact CB-CG1 4.07Å; I228-G230 PolarHBondContact O-N 3.42Å; I228-Y236 HydrophobicContact CG2-CD1 4.19Å; I228-Y236 HydrophobicContact CG2-CG 3.94Å; I228-Q243 HydrophobicContact CD1-CB 3.4Å
229	S	74.4	Confident	80.8	Confident	52 Å²	52	73.4 Å²	73.4	36%	0.364	44%	0.441	S	S	.	.			trans	-66.9	93.5	177.6	-59.5	0	0	0	0	110.1	C214 P227 L231 S234	C214-S229 PolarHBondContact SG-OG 2.84Å; P227-S229 PolarHBondContact O-N 3.24Å; P227-S229 VanDerWaalsContact O-N 3.13Å; S229-L231 PolarHBondContact O-N 3.16Å; S229-S234 PolarHBondContact O-OG 2.82Å
230	G	65.9	Low	80.9	Confident	55 Å²	55	73.4 Å²	73.4	57%	0.567	44%	0.443	S	S	*	.			trans	-66	17.5	176	0	0	0	0	0	115.4	I228 G232	I228-G230 PolarHBondContact O-N 3.42Å; G230-G232 PolarHBondContact O-N 3.36Å
231	L	60.2	Low	80.8	Confident	91 Å²	91	76.3 Å²	76.3	48%	0.476	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	108.4	-179	-76.7	144.6	0	0	0	109.1	L210 C214 S229	L210-L231 HydrophobicContact CB-CD1 3.89Å; L210-L231 HydrophobicContact CD1-CD1 4.03Å; L210-L231 HydrophobicContact CD1-CD2 3.92Å; L210-L231 HydrophobicContact CD1-CG 4.49Å; L210-L231 HydrophobicContact CD2-CD1 3.83Å; L210-L231 HydrophobicContact CD2-CD2 3.57Å; L210-L231 HydrophobicContact CD2-CG 4.35Å; L210-L231 HydrophobicContact CG-CD1 4.11Å; L210-L231 HydrophobicContact CG-CD2 4.31Å; C214-L231 VanDerWaalsContact SG-CD1 3.56Å; S229-L231 PolarHBondContact O-N 3.16Å
232	G	55.3	Low	80.9	Confident	82 Å²	82	78.4 Å²	78.4	85%	0.845	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.5	14.2	178.3	0	0	0	0	0	115.4	G230 S234	G230-G232 PolarHBondContact O-N 3.36Å; G232-S234 VanDerWaalsContact C-N 3.3Å; G232-S234 PolarHBondContact O-N 2.96Å
233	G	57.9	Low	80.9	Confident	66 Å²	66	76.6 Å²	76.6	68%	0.68	45%	0.449	S	S	*	.			trans	75.5	17.9	176.1	0	0	0	0	0	114.3	K235	G233-K235 PolarHBondContact O-N 2.99Å; G233-K235 VanDerWaalsContact O-N 3.13Å
234	S	66.1	Low	81.1	Confident	62 Å²	62	73.4 Å²	73.4	43%	0.434	43%	0.425	S	S	.	.			trans	-58.5	114.4	174.8	50.9	0	0	0	0	110.5	S229 G232	S229-S234 PolarHBondContact O-OG 2.82Å; G232-S234 VanDerWaalsContact C-N 3.3Å; G232-S234 PolarHBondContact O-N 2.96Å
235	K	77.2	Confident	81.1	Confident	183 Å²	183	73.2 Å²	73.2	80%	0.796	42%	0.42	S	S	*	.			trans	-69.7	129.6	177.8	-62.8	-179.7	-178.8	178.9	0	109.5	G233	G233-K235 PolarHBondContact O-N 2.99Å; G233-K235 VanDerWaalsContact O-N 3.13Å
236	Y	88.1	Confident	81.2	Confident	117 Å²	117	70.3 Å²	70.3	46%	0.459	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	155.7	175	62	-83.8	0	0	0	109.8	I228 S238 Q243 W244	I228-Y236 HydrophobicContact CG2-CD1 4.19Å; I228-Y236 HydrophobicContact CG2-CG 3.94Å; Y236-S238 WeakPolarHBondContact CD2-OG 3.49Å; Y236-S238 WeakPolarHBondContact CE2-OG 3.28Å; Y236-Q243 HydrophobicContact CD2-CB 4.15Å; Y236-Q243 HydrophobicContact CD2-CG 4.03Å; Y236-Q243 HydrophobicContact CE2-CG 3.97Å; Y236-W244 WeakPolarHBondContact CB-O 3.18Å
237	I	90.1	Very high	81.4	Confident	37 Å²	37	73.5 Å²	73.5	19%	0.19	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	131.6	176.9	-53	-57.6	0	0	0	108.1	Q243 W244 F249 V259	I237-Q243 CarbonylContact O-C 3.58Å; I237-Q243 VanDerWaalsContact O-CA 3.27Å; I237-Q243 WeakPolarHBondContact O-CA 3.3Å; I237-W244 PolarHBondContact N-O 3.34Å; I237-W244 PolarHBondContact O-N 3.17Å; I237-F249 HydrophobicContact CB-CB 4.34Å; I237-F249 HydrophobicContact CB-CD1 4.5Å; I237-F249 HydrophobicContact CB-CD2 4.13Å; I237-F249 HydrophobicContact CB-CG 4.07Å; I237-F249 HydrophobicContact CG1-CB 3.95Å; I237-F249 HydrophobicContact CG1-CD1 4.21Å; I237-F249 HydrophobicContact CG1-CG 3.99Å; I237-F249 HydrophobicContact CG2-CD1 4Å; I237-F249 HydrophobicContact CG2-CD2 3.77Å; I237-F249 HydrophobicContact CG2-CE1 4.04Å; I237-F249 HydrophobicContact CG2-CE2 3.8Å; I237-F249 HydrophobicContact CG2-CG 3.89Å; I237-F249 HydrophobicContact CG2-CZ 3.94Å; I237-V259 HydrophobicContact CD1-CG1 4.21Å; I237-V259 HydrophobicContact CD1-CG2 4.27Å; I237-V259 HydrophobicContact CG1-CG2 4.21Å
238	S	90.6	Very high	81.7	Confident	68 Å²	68	73.6 Å²	73.6	48%	0.476	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.9	174.4	-60.7	0	0	0	0	109.3	Y236	Y236-S238 WeakPolarHBondContact CD2-OG 3.49Å; Y236-S238 WeakPolarHBondContact CE2-OG 3.28Å
239	F	90.2	Very high	82.2	Confident	70 Å²	70	73 Å²	73	31%	0.307	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	128	171.8	-179.1	-101.4	0	0	0	108.2	E241 R242 W244 F263 T265	F239-E241 PolarHBondContact O-N 3.3Å; F239-R242 PolarHBondContact N-O 2.87Å; F239-R242 VanDerWaalsContact N-O 3.16Å; F239-R242 PolarHBondContact O-N 2.8Å; F239-R242 VanDerWaalsContact O-N 3.1Å; F239-R242 VanDerWaalsContact O-O 3.11Å; F239-W244 HydrophobicContact CB-CH2 4.47Å; F239-W244 HydrophobicContact CB-CZ3 3.95Å; F239-F263 HydrophobicContact CB-CZ 4.16Å; F239-F263 AromaticContact CD1-CE2 3.92Å; F239-F263 HydrophobicContact CD1-CE2 3.92Å; F239-F263 HydrophobicContact CD1-CZ 4.01Å; F239-F263 HydrophobicContact CD2-CE2 4.29Å; F239-F263 AromaticContact CD2-CZ 3.6Å; F239-F263 HydrophobicContact CD2-CZ 3.6Å; F239-F263 HydrophobicContact CE1-CE2 4.05Å; F239-F263 HydrophobicContact CE1-CZ 4.32Å; F239-F263 HydrophobicContact CE2-CE2 4.38Å; F239-F263 AromaticContact CE2-CZ 3.91Å; F239-F263 HydrophobicContact CE2-CZ 3.91Å; F239-F263 HydrophobicContact CG-CE2 4.04Å; F239-F263 AromaticContact CG-CZ 3.63Å; F239-F263 HydrophobicContact CG-CZ 3.63Å; F239-F263 HydrophobicContact CZ-CE2 4.27Å; F239-F263 HydrophobicContact CZ-CZ 4.26Å; F239-T265 HydrophobicContact CD1-CG2 4.16Å; F239-T265 HydrophobicContact CE1-CG2 3.58Å; F239-T265 HydrophobicContact CZ-CG2 4.37Å
240	E	88.4	Confident	83.1	Confident	129 Å²	129	73 Å²	73	60%	0.603	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	-131.9	-168.6	-58.8	168.9	150.7	0	0	110.9	R242	E240-R242 IonicContact OE2-CZ 3.84Å; E240-R242 IonicContact OE2-NE 3.31Å; E240-R242 IonicContact OE2-NH2 3.01Å; E240-R242 PolarHBondContact OE2-NH2 3.38Å
241	E	87.1	Confident	84.5	Confident	182 Å²	182	70.4 Å²	70.4	85%	0.85	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.2	177	-57.2	-147.1	141.5	0	0	113.5	F239 Q243	F239-E241 PolarHBondContact O-N 3.3Å; E241-Q243 PolarHBondContact O-NE2 2.85Å
242	R	90.7	Very high	86	Confident	46 Å²	46	72.1 Å²	72.1	17%	0.174	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	148.8	-176	-67.2	178.6	-73.9	-172.7	-10.2	111.4	A222 F239 E240 W244 R267 D268	A222-R242 HydrophobicContact CB-CB 4.14Å; A222-R242 HydrophobicContact CB-CG 4.28Å; F239-R242 PolarHBondContact N-O 2.87Å; F239-R242 VanDerWaalsContact N-O 3.16Å; F239-R242 PolarHBondContact O-N 2.8Å; F239-R242 VanDerWaalsContact O-N 3.1Å; F239-R242 VanDerWaalsContact O-O 3.11Å; E240-R242 IonicContact OE2-CZ 3.84Å; E240-R242 IonicContact OE2-NE 3.31Å; E240-R242 IonicContact OE2-NH2 3.01Å; E240-R242 PolarHBondContact OE2-NH2 3.38Å; R242-W244 HydrophobicContact CB-CE3 4.3Å; R242-W244 HydrophobicContact CB-CH2 3.18Å; R242-W244 HydrophobicContact CB-CZ2 3.76Å; R242-W244 HydrophobicContact CB-CZ3 3.48Å; R242-W244 VanDerWaalsContact CB-CZ3 3.48Å; R242-W244 HydrophobicContact CG-CH2 4.13Å; R242-W244 HydrophobicContact CG-CZ2 4.44Å; R242-W244 WeakPolarHBondContact O-CZ3 3.2Å; R242-R267 PolarHBondContact NH1-O 3.01Å; R242-D268 VanDerWaalsContact NH1-C 3.33Å; R242-D268 PolarHBondContact NH1-O 2.88Å
243	Q	91.9	Very high	87.8	Confident	14 Å²	14	74 Å²	74	7%	0.065	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	153.1	172.1	-58.2	90.3	31.6	0	0	111.5	K219 C221 A222 I228 Y236 I237 E241	K219-Q243 HydrophobicContact CD-CG 4.29Å; K219-Q243 VanDerWaalsContact CD-NE2 3.27Å; C221-Q243 CarbonylContact C-O 3.55Å; C221-Q243 VanDerWaalsContact CA-O 3.3Å; C221-Q243 WeakPolarHBondContact CA-O 3.48Å; A222-Q243 PolarHBondContact N-O 2.91Å; I228-Q243 HydrophobicContact CD1-CB 3.4Å; Y236-Q243 HydrophobicContact CD2-CB 4.15Å; Y236-Q243 HydrophobicContact CD2-CG 4.03Å; Y236-Q243 HydrophobicContact CE2-CG 3.97Å; I237-Q243 CarbonylContact O-C 3.58Å; I237-Q243 VanDerWaalsContact O-CA 3.27Å; I237-Q243 WeakPolarHBondContact O-CA 3.3Å; E241-Q243 PolarHBondContact O-NE2 2.85Å
244	W	92.2	Very high	89.6	Confident	9 Å²	9	73.9 Å²	73.9	3%	0.034	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.5	175.9	-61	-105.3	0	0	0	110.9	A222 Y236 I237 F239 R242 F249 I270	A222-W244 HydrophobicContact CB-CD2 4.33Å; A222-W244 HydrophobicContact CB-CZ2 3.98Å; Y236-W244 WeakPolarHBondContact CB-O 3.18Å; I237-W244 PolarHBondContact N-O 3.34Å; I237-W244 PolarHBondContact O-N 3.17Å; F239-W244 HydrophobicContact CB-CH2 4.47Å; F239-W244 HydrophobicContact CB-CZ3 3.95Å; R242-W244 HydrophobicContact CB-CE3 4.3Å; R242-W244 HydrophobicContact CB-CH2 3.18Å; R242-W244 HydrophobicContact CB-CZ2 3.76Å; R242-W244 HydrophobicContact CB-CZ3 3.48Å; R242-W244 VanDerWaalsContact CB-CZ3 3.48Å; R242-W244 HydrophobicContact CG-CH2 4.13Å; R242-W244 HydrophobicContact CG-CZ2 4.44Å; R242-W244 WeakPolarHBondContact O-CZ3 3.2Å; W244-F249 HydrophobicContact CB-CB 4.09Å; W244-F249 HydrophobicContact CB-CD2 4.03Å; W244-F249 AromaticContact CD2-CD2 3.71Å; W244-F249 HydrophobicContact CD2-CD2 3.71Å; W244-F249 HydrophobicContact CD2-CE2 4.11Å; W244-F249 AromaticContact CE3-CD2 3.87Å; W244-F249 HydrophobicContact CE3-CD2 3.87Å; W244-F249 AromaticContact CE3-CE2 3.94Å; W244-F249 HydrophobicContact CE3-CE2 3.94Å; W244-F249 AromaticContact CG-CD2 3.8Å; W244-F249 HydrophobicContact CG-CD2 3.8Å; W244-F249 HydrophobicContact CH2-CE2 4.5Å; W244-F249 HydrophobicContact CZ3-CE2 4.16Å; W244-I270 HydrophobicContact CH2-CG2 4.46Å; W244-I270 HydrophobicContact CZ2-CG2 4.08Å
245	H	90.7	Very high	90.9	Very high	45 Å²	45	75.2 Å²	75.2	21%	0.208	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	152.5	157.1	-54.9	99	0	0	0	109	C221 C224 T226 P227 D247 C248 F249	C221-H245 VanDerWaalsContact CB-CE1 3.49Å; C221-H245 WeakPolarHBondContact CB-CE1 3.41Å; C221-H245 VanDerWaalsContact CB-ND1 3.28Å; C221-H245 WeakPolarHBondContact CB-ND1 3.48Å; C224-H245 VanDerWaalsContact SG-CE1 3.56Å; C224-H245 PolarHBondContact SG-ND1 3.32Å; C224-H245 VanDerWaalsContact SG-ND1 3.39Å; T226-H245 PolarHBondContact OG1-CE1 2.77Å; P227-H245 PolarHBondContact O-NE2 3.32Å; H245-D247 PolarHBondContact O-N 3.26Å; H245-C248 HydrophobicContact CB-CB 4.07Å; H245-C248 PolarHBondContact O-N 3.29Å; H245-F249 PolarHBondContact O-N 3.28Å
246	N	90.2	Very high	91.7	Very high	59 Å²	59	69 Å²	69	32%	0.316	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-53.9	-45.2	178.4	-140	-93.6	0	0	0	111.2	C248 F249 V259	N246-C248 PolarHBondContact O-N 2.98Å; N246-F249 PolarHBondContact O-N 2.98Å; N246-V259 WeakPolarHBondContact O-CG2 3.35Å; N246-V259 WeakPolarHBondContact OD1-CG2 3.25Å
247	D	91	Very high	92	Very high	137 Å²	137	65.8 Å²	65.8	73%	0.733	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-73.5	-12.8	-179.8	-53.4	-36	0	0	0	113.8	H245 N250	H245-D247 PolarHBondContact O-N 3.26Å; D247-N250 PolarHBondContact O-ND2 3.04Å
248	C	92.4	Very high	92.3	Very high	26 Å²	26	64.1 Å²	64.1	18%	0.176	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-100.3	-2	179.3	-62.7	0	0	0	0	112.9	H245 N246 N250	H245-C248 HydrophobicContact CB-CB 4.07Å; H245-C248 PolarHBondContact O-N 3.29Å; N246-C248 PolarHBondContact O-N 2.98Å; C248-N250 VanDerWaalsContact C-N 3.34Å; C248-N250 PolarHBondContact O-N 3.15Å; C248-N250 VanDerWaalsContact O-N 3.17Å
249	F	94.4	Very high	92.4	Very high	4 Å²	4	63 Å²	63	2%	0.018	33%	0.326	C	S	.	.			trans	-89.8	70.9	179.5	-164.9	-110.1	0	0	0	110.7	I237 W244 H245 N246 L258 V259 F263 I270	I237-F249 HydrophobicContact CB-CB 4.34Å; I237-F249 HydrophobicContact CB-CD1 4.5Å; I237-F249 HydrophobicContact CB-CD2 4.13Å; I237-F249 HydrophobicContact CB-CG 4.07Å; I237-F249 HydrophobicContact CG1-CB 3.95Å; I237-F249 HydrophobicContact CG1-CD1 4.21Å; I237-F249 HydrophobicContact CG1-CG 3.99Å; I237-F249 HydrophobicContact CG2-CD1 4Å; I237-F249 HydrophobicContact CG2-CD2 3.77Å; I237-F249 HydrophobicContact CG2-CE1 4.04Å; I237-F249 HydrophobicContact CG2-CE2 3.8Å; I237-F249 HydrophobicContact CG2-CG 3.89Å; I237-F249 HydrophobicContact CG2-CZ 3.94Å; W244-F249 HydrophobicContact CB-CB 4.09Å; W244-F249 HydrophobicContact CB-CD2 4.03Å; W244-F249 AromaticContact CD2-CD2 3.71Å; W244-F249 HydrophobicContact CD2-CD2 3.71Å; W244-F249 HydrophobicContact CD2-CE2 4.11Å; W244-F249 AromaticContact CE3-CD2 3.87Å; W244-F249 HydrophobicContact CE3-CD2 3.87Å; W244-F249 AromaticContact CE3-CE2 3.94Å; W244-F249 HydrophobicContact CE3-CE2 3.94Å; W244-F249 AromaticContact CG-CD2 3.8Å; W244-F249 HydrophobicContact CG-CD2 3.8Å; W244-F249 HydrophobicContact CH2-CE2 4.5Å; W244-F249 HydrophobicContact CZ3-CE2 4.16Å; H245-F249 PolarHBondContact O-N 3.28Å; N246-F249 PolarHBondContact O-N 2.98Å; F249-L258 HydrophobicContact CD1-CB 3.57Å; F249-L258 HydrophobicContact CE1-CB 3.49Å; F249-L258 VanDerWaalsContact CE1-CB 3.49Å; F249-L258 HydrophobicContact CZ-CB 4.38Å; F249-L258 PolarHBondContact O-N 3.31Å; F249-V259 HydrophobicContact CB-CG2 4.1Å; F249-V259 HydrophobicContact CD1-CG2 4.19Å; F249-F263 HydrophobicContact CE1-CD1 4.07Å; F249-F263 HydrophobicContact CE1-CE1 4.24Å; F249-F263 AromaticContact CZ-CD1 3.82Å; F249-F263 HydrophobicContact CZ-CD1 3.82Å; F249-F263 HydrophobicContact CZ-CD2 4.27Å; F249-F263 AromaticContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE2 4.18Å; F249-F263 HydrophobicContact CZ-CG 4.1Å; F249-F263 AromaticContact CZ-CZ 3.91Å; F249-F263 HydrophobicContact CZ-CZ 3.91Å; F249-I270 HydrophobicContact CD2-CD1 3.47Å; F249-I270 VanDerWaalsContact CD2-CD1 3.47Å; F249-I270 HydrophobicContact CE2-CD1 3.48Å; F249-I270 VanDerWaalsContact CE2-CD1 3.48Å; F249-I270 HydrophobicContact CG-CD1 4.16Å; F249-I270 HydrophobicContact CZ-CD1 4.18Å
250	N	94.6	Very high	92.4	Very high	50 Å²	50	63.9 Å²	63.9	27%	0.267	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-122.9	150.8	-173.2	-56.9	-38.2	0	0	0	111.8	D247 C248 K252 V256 S257 I270	D247-N250 PolarHBondContact O-ND2 3.04Å; C248-N250 VanDerWaalsContact C-N 3.34Å; C248-N250 PolarHBondContact O-N 3.15Å; C248-N250 VanDerWaalsContact O-N 3.17Å; N250-K252 PolarHBondContact O-N 2.9Å; N250-V256 CarbonylContact C-O 3.49Å; N250-V256 VanDerWaalsContact CA-O 3.25Å; N250-V256 WeakPolarHBondContact CA-O 3.48Å; N250-S257 WeakPolarHBondContact OD1-CA 3.4Å; N250-I270 WeakPolarHBondContact O-CG1 3.44Å
251	C	94.7	Very high	92.5	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.007	35%	0.354	C	S	.	.			trans	-57.5	130.7	173.6	177	0	0	0	0	110.7	K253 C254 S255 V256 L258 I270 C272	C251-K253 VanDerWaalsContact C-N 3.3Å; C251-K253 PolarHBondContact O-N 3.29Å; C251-C254 VanDerWaalsContact CB-SG 3.6Å; C251-S255 WeakPolarHBondContact O-CA 3.34Å; C251-S255 PolarHBondContact O-N 3.16Å; C251-V256 HydrophobicContact CB-CG1 3.9Å; C251-V256 PolarHBondContact N-O 3.02Å; C251-L258 HydrophobicContact CB-CD1 4.32Å; C251-L258 HydrophobicContact CB-CD2 4.23Å; C251-L258 HydrophobicContact CB-CG 4.38Å; C251-I270 WeakPolarHBondContact CA-O 3.19Å; C251-C272 HydrophobicContact CB-CB 4.17Å; C251-C272 PolarHBondContact SG-N 2.93Å
252	K	92.9	Very high	92.7	Very high	127 Å²	127	59 Å²	59	55%	0.552	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-39.2	179.5	-178.3	63.9	165.8	-120.5	0	113.6	N250 D269 I270 L271	N250-K252 PolarHBondContact O-N 2.9Å; K252-D269 HydrophobicContact CB-CB 4.03Å; K252-D269 WeakPolarHBondContact CD-OD1 3.27Å; K252-D269 WeakPolarHBondContact CE-OD1 3.48Å; K252-D269 HydrophobicContact CG-CB 4.12Å; K252-D269 WeakPolarHBondContact CG-OD1 3.43Å; K252-D269 IonicContact NZ-OD1 3.79Å; K252-D269 PolarHBondContact NZ-OD1 3.44Å; K252-D269 IonicContact NZ-OD2 3.47Å; K252-I270 PolarHBondContact N-O 3.13Å; K252-L271 HydrophobicContact CB-CD2 3.84Å
253	K	92.7	Very high	92.8	Very high	123 Å²	123	59.6 Å²	59.6	54%	0.535	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-42.6	-174	-70.1	-176.2	-168.9	168.9	0	113.6	C251 L271 C275	C251-K253 VanDerWaalsContact C-N 3.3Å; C251-K253 PolarHBondContact O-N 3.29Å; K253-L271 HydrophobicContact CB-CD2 4.27Å; K253-L271 HydrophobicContact CD-CD2 4.17Å; K253-L271 HydrophobicContact CG-CD2 3.77Å; K253-C275 HydrophobicContact CB-CB 4.16Å; K253-C275 HydrophobicContact CD-CB 4.11Å; K253-C275 PolarHBondContact NZ-O 2.89Å
254	C	94.3	Very high	92.9	Very high	63 Å²	63	62.7 Å²	62.7	43%	0.426	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-0.1	-172.4	68.8	0	0	0	0	114.6	C251 V256 C275	C251-C254 VanDerWaalsContact CB-SG 3.6Å; C254-V256 PolarHBondContact O-N 3.1Å; C254-V256 WeakPolarHBondContact SG-CG1 3.01Å; C254-C275 VanDerWaalsContact SG-SG 3.61Å
255	S	94.2	Very high	92.8	Very high	89 Å²	89	65.2 Å²	65.2	62%	0.622	38%	0.376	S	S	*	.			trans	59.3	11.7	178.5	-51.3	0	0	0	0	115.7	C251	C251-S255 WeakPolarHBondContact O-CA 3.34Å; C251-S255 PolarHBondContact O-N 3.16Å
256	V	94.7	Very high	92.6	Very high	53 Å²	53	66.9 Å²	66.9	32%	0.321	38%	0.384	S	S	.	.			trans	-66.9	138.8	174.7	76.9	0	0	0	0	110.5	N250 C251 C254 L258 R261 C272	N250-V256 CarbonylContact C-O 3.49Å; N250-V256 VanDerWaalsContact CA-O 3.25Å; N250-V256 WeakPolarHBondContact CA-O 3.48Å; C251-V256 HydrophobicContact CB-CG1 3.9Å; C251-V256 PolarHBondContact N-O 3.02Å; C254-V256 PolarHBondContact O-N 3.1Å; C254-V256 WeakPolarHBondContact SG-CG1 3.01Å; V256-L258 HydrophobicContact CG1-CD2 4.35Å; V256-L258 PolarHBondContact O-N 3.41Å; V256-R261 VanDerWaalsContact CG2-NH1 3.27Å; V256-C272 HydrophobicContact CG1-CB 4Å
257	S	94.7	Very high	92.3	Very high	50 Å²	50	75.1 Å²	75.1	35%	0.35	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-61.4	131.2	173.4	-175.3	0	0	0	0	111.4	N250 V259 R261	N250-S257 WeakPolarHBondContact OD1-CA 3.4Å; S257-V259 PolarHBondContact OG-N 2.95Å; S257-R261 WeakPolarHBondContact O-CD 3.47Å; S257-R261 PolarHBondContact O-NH1 3.47Å
258	L	94.9	Very high	92	Very high	1 Å²	1	75.3 Å²	75.3	1%	0.005	41%	0.412	C	S	.	.			trans	-100	1.8	178	-61.3	176	0	0	0	111.9	F249 C251 V256 G260 R261 F263 I270 C272	F249-L258 HydrophobicContact CD1-CB 3.57Å; F249-L258 HydrophobicContact CE1-CB 3.49Å; F249-L258 VanDerWaalsContact CE1-CB 3.49Å; F249-L258 HydrophobicContact CZ-CB 4.38Å; F249-L258 PolarHBondContact O-N 3.31Å; C251-L258 HydrophobicContact CB-CD1 4.32Å; C251-L258 HydrophobicContact CB-CD2 4.23Å; C251-L258 HydrophobicContact CB-CG 4.38Å; V256-L258 HydrophobicContact CG1-CD2 4.35Å; V256-L258 PolarHBondContact O-N 3.41Å; L258-G260 PolarHBondContact O-N 2.89Å; L258-R261 PolarHBondContact O-N 3.44Å; L258-F263 HydrophobicContact CB-CB 4.49Å; L258-F263 HydrophobicContact CD1-CB 3.92Å; L258-F263 HydrophobicContact CD2-CB 4.36Å; L258-F263 HydrophobicContact CG-CB 4.49Å; L258-I270 HydrophobicContact CD1-CB 4.13Å; L258-I270 HydrophobicContact CD1-CD1 3.97Å; L258-I270 HydrophobicContact CD1-CG1 3.92Å; L258-C272 HydrophobicContact CD2-CB 3.58Å
259	V	92.6	Very high	91.8	Very high	46 Å²	46	76.8 Å²	76.8	28%	0.279	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	123.8	-179.4	178.3	0	0	0	0	109.9	I237 N246 F249 S257 R261	I237-V259 HydrophobicContact CD1-CG1 4.21Å; I237-V259 HydrophobicContact CD1-CG2 4.27Å; I237-V259 HydrophobicContact CG1-CG2 4.21Å; N246-V259 WeakPolarHBondContact O-CG2 3.35Å; N246-V259 WeakPolarHBondContact OD1-CG2 3.25Å; F249-V259 HydrophobicContact CB-CG2 4.1Å; F249-V259 HydrophobicContact CD1-CG2 4.19Å; S257-V259 PolarHBondContact OG-N 2.95Å; V259-R261 PolarHBondContact O-N 2.88Å
260	G	90.3	Very high	91.8	Very high	88 Å²	88	77.1 Å²	77.1	91%	0.907	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	11.8	-177.9	0	0	0	0	0	114.6	L258	L258-G260 PolarHBondContact O-N 2.89Å
261	R	90.8	Very high	91.7	Very high	156 Å²	156	74.8 Å²	74.8	59%	0.589	41%	0.407	S	S	*	.	S	Bend	trans	-115.9	156.1	177.6	-60.7	-178.1	-179	179	-3.4	110.3	V256 S257 L258 V259	V256-R261 VanDerWaalsContact CG2-NH1 3.27Å; S257-R261 WeakPolarHBondContact O-CD 3.47Å; S257-R261 PolarHBondContact O-NH1 3.47Å; L258-R261 PolarHBondContact O-N 3.44Å; V259-R261 PolarHBondContact O-N 2.88Å
262	G	90.9	Very high	91.7	Very high	53 Å²	53	75.3 Å²	75.3	55%	0.546	41%	0.411	S	S	.	.			trans	-64	145	167.1	0	0	0	0	0	110.6	P273	G262-P273 VanDerWaalsContact O-CD 3.27Å; G262-P273 WeakPolarHBondContact O-CD 3.34Å
263	F	94.3	Very high	91.8	Very high	58 Å²	58	72.4 Å²	72.4	25%	0.254	41%	0.405	S	S	.	.			trans	-143.7	161.3	177.8	65.7	-84.8	0	0	0	110.4	F239 F249 L258 T265 I270 L271	F239-F263 HydrophobicContact CB-CZ 4.16Å; F239-F263 AromaticContact CD1-CE2 3.92Å; F239-F263 HydrophobicContact CD1-CE2 3.92Å; F239-F263 HydrophobicContact CD1-CZ 4.01Å; F239-F263 HydrophobicContact CD2-CE2 4.29Å; F239-F263 AromaticContact CD2-CZ 3.6Å; F239-F263 HydrophobicContact CD2-CZ 3.6Å; F239-F263 HydrophobicContact CE1-CE2 4.05Å; F239-F263 HydrophobicContact CE1-CZ 4.32Å; F239-F263 HydrophobicContact CE2-CE2 4.38Å; F239-F263 AromaticContact CE2-CZ 3.91Å; F239-F263 HydrophobicContact CE2-CZ 3.91Å; F239-F263 HydrophobicContact CG-CE2 4.04Å; F239-F263 AromaticContact CG-CZ 3.63Å; F239-F263 HydrophobicContact CG-CZ 3.63Å; F239-F263 HydrophobicContact CZ-CE2 4.27Å; F239-F263 HydrophobicContact CZ-CZ 4.26Å; F249-F263 HydrophobicContact CE1-CD1 4.07Å; F249-F263 HydrophobicContact CE1-CE1 4.24Å; F249-F263 AromaticContact CZ-CD1 3.82Å; F249-F263 HydrophobicContact CZ-CD1 3.82Å; F249-F263 HydrophobicContact CZ-CD2 4.27Å; F249-F263 AromaticContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE2 4.18Å; F249-F263 HydrophobicContact CZ-CG 4.1Å; F249-F263 AromaticContact CZ-CZ 3.91Å; F249-F263 HydrophobicContact CZ-CZ 3.91Å; L258-F263 HydrophobicContact CB-CB 4.49Å; L258-F263 HydrophobicContact CD1-CB 3.92Å; L258-F263 HydrophobicContact CD2-CB 4.36Å; L258-F263 HydrophobicContact CG-CB 4.49Å; F263-T265 HydrophobicContact CD2-CG2 4.12Å; F263-T265 HydrophobicContact CE2-CG2 3.8Å; F263-I270 HydrophobicContact CD2-CG2 4.47Å; F263-L271 WeakPolarHBondContact CA-O 3.46Å; F263-L271 WeakPolarHBondContact CB-O 3.31Å
264	L	92.4	Very high	91.8	Very high	79 Å²	79	72.6 Å²	72.6	41%	0.414	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	147.9	175.3	-61.9	167.8	0	0	0	109	L271	L264-L271 PolarHBondContact N-O 3.42Å; L264-L271 PolarHBondContact O-N 3.01Å
265	T	91.1	Very high	91.7	Very high	61 Å²	61	70.9 Å²	70.9	37%	0.374	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.2	174.5	51.3	0	0	0	0	110.4	F239 F263 I270	F239-T265 HydrophobicContact CD1-CG2 4.16Å; F239-T265 HydrophobicContact CE1-CG2 3.58Å; F239-T265 HydrophobicContact CZ-CG2 4.37Å; F263-T265 HydrophobicContact CD2-CG2 4.12Å; F263-T265 HydrophobicContact CE2-CG2 3.8Å; T265-I270 HydrophobicContact CG2-CG2 4.34Å
266	E	87.3	Confident	91.4	Very high	81 Å²	81	66.8 Å²	66.8	38%	0.379	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	103.2	173.4	-173.9	-174.8	-161.2	0	0	107.9	D268 D269 L271 I279	E266-D268 PolarHBondContact O-N 2.91Å; E266-D268 VanDerWaalsContact O-N 3.15Å; E266-D269 PolarHBondContact N-O 3.43Å; E266-D269 PolarHBondContact O-N 3.44Å; E266-L271 HydrophobicContact CB-CD1 4.35Å; E266-I279 HydrophobicContact CB-CD1 4.11Å; E266-I279 HydrophobicContact CG-CD1 4.34Å; E266-I279 HydrophobicContact CG-CG2 4.27Å; E266-I279 WeakPolarHBondContact OE2-CD1 3.23Å
267	R	83.7	Confident	90.9	Very high	232 Å²	232	70.5 Å²	70.5	88%	0.875	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	-118.5	-171.3	-54.2	176.7	-178.7	178.9	0.8	111	R242	R242-R267 PolarHBondContact NH1-O 3.01Å
268	D	83.6	Confident	89.8	Confident	141 Å²	141	75.3 Å²	75.3	75%	0.754	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.7	-179.5	-68.4	-40.9	0	0	0	113.7	R242 E266	R242-D268 VanDerWaalsContact NH1-C 3.33Å; R242-D268 PolarHBondContact NH1-O 2.88Å; E266-D268 PolarHBondContact O-N 2.91Å; E266-D268 VanDerWaalsContact O-N 3.15Å
269	D	89	Confident	88.4	Confident	57 Å²	57	81 Å²	81	31%	0.305	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	148.3	-176.1	-71.4	-39.9	0	0	0	112.2	K252 E266	K252-D269 HydrophobicContact CB-CB 4.03Å; K252-D269 WeakPolarHBondContact CD-OD1 3.27Å; K252-D269 WeakPolarHBondContact CE-OD1 3.48Å; K252-D269 HydrophobicContact CG-CB 4.12Å; K252-D269 WeakPolarHBondContact CG-OD1 3.43Å; K252-D269 IonicContact NZ-OD1 3.79Å; K252-D269 PolarHBondContact NZ-OD1 3.44Å; K252-D269 IonicContact NZ-OD2 3.47Å; E266-D269 PolarHBondContact N-O 3.43Å; E266-D269 PolarHBondContact O-N 3.44Å
270	I	93.4	Very high	88.2	Confident	10 Å²	10	82.8 Å²	82.8	5%	0.051	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.5	173.8	60.4	177.9	0	0	0	109.1	W244 F249 N250 C251 K252 L258 F263 T265	W244-I270 HydrophobicContact CH2-CG2 4.46Å; W244-I270 HydrophobicContact CZ2-CG2 4.08Å; F249-I270 HydrophobicContact CD2-CD1 3.47Å; F249-I270 VanDerWaalsContact CD2-CD1 3.47Å; F249-I270 HydrophobicContact CE2-CD1 3.48Å; F249-I270 VanDerWaalsContact CE2-CD1 3.48Å; F249-I270 HydrophobicContact CG-CD1 4.16Å; F249-I270 HydrophobicContact CZ-CD1 4.18Å; N250-I270 WeakPolarHBondContact O-CG1 3.44Å; C251-I270 WeakPolarHBondContact CA-O 3.19Å; K252-I270 PolarHBondContact N-O 3.13Å; L258-I270 HydrophobicContact CD1-CB 4.13Å; L258-I270 HydrophobicContact CD1-CD1 3.97Å; L258-I270 HydrophobicContact CD1-CG1 3.92Å; F263-I270 HydrophobicContact CD2-CG2 4.47Å; T265-I270 HydrophobicContact CG2-CG2 4.34Å
271	L	94	Very high	88.1	Confident	2 Å²	2	82.5 Å²	82.5	1%	0.01	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.9	-172.8	-63.8	172.1	0	0	0	111.2	K252 K253 F263 L264 E266 C275 I279	K252-L271 HydrophobicContact CB-CD2 3.84Å; K253-L271 HydrophobicContact CB-CD2 4.27Å; K253-L271 HydrophobicContact CD-CD2 4.17Å; K253-L271 HydrophobicContact CG-CD2 3.77Å; F263-L271 WeakPolarHBondContact CA-O 3.46Å; F263-L271 WeakPolarHBondContact CB-O 3.31Å; L264-L271 PolarHBondContact N-O 3.42Å; L264-L271 PolarHBondContact O-N 3.01Å; E266-L271 HydrophobicContact CB-CD1 4.35Å; L271-C275 HydrophobicContact CD2-CB 4.42Å; L271-I279 HydrophobicContact CD1-CD1 3.12Å
272	C	94.8	Very high	88	Confident	12 Å²	12	78.4 Å²	78.4	8%	0.081	40%	0.404	C	S	.	.			trans	-70.9	156.3	167.1	69.9	0	0	0	0	109.7	C251 V256 L258 E274 C275 G276	C251-C272 HydrophobicContact CB-CB 4.17Å; C251-C272 PolarHBondContact SG-N 2.93Å; V256-C272 HydrophobicContact CG1-CB 4Å; L258-C272 HydrophobicContact CD2-CB 3.58Å; C272-E274 PolarHBondContact O-N 3.13Å; C272-E274 VanDerWaalsContact O-N 3.13Å; C272-C275 PolarHBondContact O-N 3.22Å; C272-C275 VanDerWaalsContact SG-CB 3.57Å; C272-C275 PolarHBondContact SG-N 3.11Å; C272-C275 VanDerWaalsContact SG-N 3.42Å; C272-C275 PolarHBondContact SG-SG 3.3Å; C272-G276 PolarHBondContact O-N 3.04Å; C272-G276 VanDerWaalsContact O-N 3.11Å
273	P	93.3	Very high	87.8	Confident	66 Å²	66	79.9 Å²	79.9	43%	0.429	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-35.3	180	-28.2	36.3	0	0	0	113.2	G262 G276 K277	G262-P273 VanDerWaalsContact O-CD 3.27Å; G262-P273 WeakPolarHBondContact O-CD 3.34Å; P273-G276 PolarHBondContact O-N 3.37Å; P273-K277 VanDerWaalsContact O-CG 3.31Å; P273-K277 WeakPolarHBondContact O-CG 3.27Å; P273-K277 PolarHBondContact O-N 3.46Å
274	E	92.8	Very high	87.4	Confident	126 Å²	126	81.3 Å²	81.3	59%	0.589	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-39.5	177.5	-63.9	-60.3	120	0	0	113.2	C272 G276 K277	C272-E274 PolarHBondContact O-N 3.13Å; C272-E274 VanDerWaalsContact O-N 3.13Å; E274-G276 VanDerWaalsContact C-N 3.34Å; E274-K277 VanDerWaalsContact OE1-CE 3.23Å; E274-K277 WeakPolarHBondContact OE1-CE 3.38Å; E274-K277 IonicContact OE1-NZ 2.75Å; E274-K277 PolarHBondContact OE1-NZ 3.25Å; E274-K277 WeakPolarHBondContact OE2-CE 3.43Å; E274-K277 IonicContact OE2-NZ 2.92Å; E274-K277 PolarHBondContact OE2-NZ 3.34Å
275	C	93.1	Very high	87	Confident	28 Å²	28	81.5 Å²	81.5	19%	0.189	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.2	-179.1	-75.7	0	0	0	0	113.8	K253 C254 L271 C272	K253-C275 HydrophobicContact CB-CB 4.16Å; K253-C275 HydrophobicContact CD-CB 4.11Å; K253-C275 PolarHBondContact NZ-O 2.89Å; C254-C275 VanDerWaalsContact SG-SG 3.61Å; L271-C275 HydrophobicContact CD2-CB 4.42Å; C272-C275 PolarHBondContact O-N 3.22Å; C272-C275 VanDerWaalsContact SG-CB 3.57Å; C272-C275 PolarHBondContact SG-N 3.11Å; C272-C275 VanDerWaalsContact SG-N 3.42Å; C272-C275 PolarHBondContact SG-SG 3.3Å
276	G	87.4	Confident	86.7	Confident	2 Å²	2	82.9 Å²	82.9	2%	0.021	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	14.2	178.5	0	0	0	0	0	114.3	C272 P273 E274 D278 I279	C272-G276 PolarHBondContact O-N 3.04Å; C272-G276 VanDerWaalsContact O-N 3.11Å; P273-G276 PolarHBondContact O-N 3.37Å; E274-G276 VanDerWaalsContact C-N 3.34Å; G276-D278 PolarHBondContact O-N 2.61Å; G276-I279 PolarHBondContact O-N 2.92Å
277	K	83.7	Confident	86.7	Confident	131 Å²	131	83.1 Å²	83.1	57%	0.57	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.4	176.6	-72.6	-177.6	171.8	168.9	0	113.9	P273 E274	P273-K277 VanDerWaalsContact O-CG 3.31Å; P273-K277 WeakPolarHBondContact O-CG 3.27Å; P273-K277 PolarHBondContact O-N 3.46Å; E274-K277 VanDerWaalsContact OE1-CE 3.23Å; E274-K277 WeakPolarHBondContact OE1-CE 3.38Å; E274-K277 IonicContact OE1-NZ 2.75Å; E274-K277 PolarHBondContact OE1-NZ 3.25Å; E274-K277 WeakPolarHBondContact OE2-CE 3.43Å; E274-K277 IonicContact OE2-NZ 2.92Å; E274-K277 PolarHBondContact OE2-NZ 3.34Å
278	D	71.9	Confident	87	Confident	152 Å²	152	70.7 Å²	70.7	81%	0.813	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	17.3	-175.8	-52.4	-47.4	0	0	0	113.2	G276	G276-D278 PolarHBondContact O-N 2.61Å
279	I	66.6	Low	87.3	Confident	121 Å²	121	64.3 Å²	64.3	62%	0.621	33%	0.334	S	S	*	.			trans	-107.3	0	178.1	-59.5	171.4	0	0	0	108.5	E266 L271 G276	E266-I279 HydrophobicContact CB-CD1 4.11Å; E266-I279 HydrophobicContact CG-CD1 4.34Å; E266-I279 HydrophobicContact CG-CG2 4.27Å; E266-I279 WeakPolarHBondContact OE2-CD1 3.23Å; L271-I279 HydrophobicContact CD1-CD1 3.12Å; G276-I279 PolarHBondContact O-N 2.92Å

Retrieved 279 of 279 residues in 125.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).