A0A087XVG9_POEFO Loading...

P2X purinoceptor

ATP-gated nonselective transmembrane cation channel permeable to potassium, sodium and with relatively high calcium permeability. Furthermore, CTP functions as a weak affinity agonist for P2RX1. Receptor for ATP that acts as a ligand-gated ion channel.

AlphaFold DB , UniProt , Accession A0A087XVG9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 397 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.8	Low	67.8	Low	197 Å²	197	107.5 Å²	107.5	97%	0.97	58%	0.576	S	S	*	*				0	-50.5	0	-80.9	179.8	178.5	0	0	113.6	N3 Q4 I5	M1-N3 PolarHBondContact O-N 3.34Å; M1-Q4 PolarHBondContact O-N 2.86Å; M1-I5 WeakPolarHBondContact O-CG1 3.38Å; M1-I5 PolarHBondContact O-N 3.17Å
2	K	54.7	Low	68.6	Low	178 Å²	178	112.3 Å²	112.3	77%	0.774	59%	0.588	S	S	*	*	H	α-helix	trans	-52.1	-48.1	176.8	-93.5	-179.1	173.3	179.5	0	113.8	Q4 I5 T6	K2-Q4 VanDerWaalsContact C-N 3.32Å; K2-Q4 PolarHBondContact O-N 2.91Å; K2-I5 PolarHBondContact O-N 2.84Å; K2-T6 PolarHBondContact O-N 3.32Å; K2-T6 PolarHBondContact O-OG1 3.35Å
3	N	61.2	Low	69.6	Low	141 Å²	141	115 Å²	115	75%	0.754	59%	0.593	S	S	*	*	H	α-helix	trans	-65.9	-29.2	-178	-67.4	6.3	0	0	0	114.5	M1 S7	M1-N3 PolarHBondContact O-N 3.34Å; N3-S7 WeakPolarHBondContact O-CB 3.18Å; N3-S7 PolarHBondContact O-N 3Å; N3-S7 PolarHBondContact O-OG 3.26Å
4	Q	62.3	Low	70.6	Confident	149 Å²	149	119 Å²	119	70%	0.696	60%	0.604	S	S	*	*	H	α-helix	trans	-80.3	-30.7	177.7	-76.9	-165.4	-20.3	0	0	112.7	M1 K2 S7 A8	M1-Q4 PolarHBondContact O-N 2.86Å; K2-Q4 VanDerWaalsContact C-N 3.32Å; K2-Q4 PolarHBondContact O-N 2.91Å; Q4-S7 WeakPolarHBondContact CA-OG 3.46Å; Q4-S7 PolarHBondContact O-OG 3.19Å; Q4-A8 VanDerWaalsContact O-CB 3.24Å; Q4-A8 WeakPolarHBondContact O-CB 3.47Å; Q4-A8 PolarHBondContact O-N 3.08Å
5	I	70.4	Confident	71.7	Confident	105 Å²	105	120.1 Å²	120.1	54%	0.538	61%	0.606	S	S	.	*	H	α-helix	trans	-73.6	-39.4	174.6	-63	167.5	0	0	0	109.7	M1 K2 A8 L9	M1-I5 WeakPolarHBondContact O-CG1 3.38Å; M1-I5 PolarHBondContact O-N 3.17Å; K2-I5 PolarHBondContact O-N 2.84Å; I5-A8 PolarHBondContact O-N 3.34Å; I5-L9 HydrophobicContact CG2-CD1 3.91Å; I5-L9 HydrophobicContact CG2-CG 4.49Å; I5-L9 WeakPolarHBondContact O-CB 3.47Å; I5-L9 WeakPolarHBondContact O-CD1 3.38Å; I5-L9 VanDerWaalsContact O-CG 3.25Å; I5-L9 WeakPolarHBondContact O-CG 3.44Å; I5-L9 PolarHBondContact O-N 2.99Å
6	T	70.1	Confident	72.3	Confident	91 Å²	91	125.1 Å²	125.1	56%	0.558	62%	0.617	S	S	*	*	H	α-helix	trans	-66.9	-38.2	175.3	-50.1	0	0	0	0	112.1	K2 S10	K2-T6 PolarHBondContact O-N 3.32Å; K2-T6 PolarHBondContact O-OG1 3.35Å; T6-S10 WeakPolarHBondContact O-CB 3.47Å; T6-S10 PolarHBondContact O-N 3.1Å
7	S	72.3	Confident	72.9	Confident	53 Å²	53	128.4 Å²	128.4	37%	0.371	63%	0.631	S	S	.	*	H	α-helix	trans	-68.2	-46.3	173.5	66.7	0	0	0	0	111.5	N3 Q4 L9 S10 D11	N3-S7 WeakPolarHBondContact O-CB 3.18Å; N3-S7 PolarHBondContact O-N 3Å; N3-S7 PolarHBondContact O-OG 3.26Å; Q4-S7 WeakPolarHBondContact CA-OG 3.46Å; Q4-S7 PolarHBondContact O-OG 3.19Å; S7-L9 VanDerWaalsContact C-N 3.3Å; S7-L9 PolarHBondContact O-N 3.47Å; S7-S10 CarbonylContact O-C 3.45Å; S7-S10 WeakPolarHBondContact O-CA 3.47Å; S7-S10 WeakPolarHBondContact O-CB 3.26Å; S7-S10 PolarHBondContact O-N 2.88Å; S7-S10 VanDerWaalsContact O-N 3.07Å; S7-D11 WeakPolarHBondContact O-CB 3.4Å; S7-D11 PolarHBondContact O-N 3.25Å
8	A	73.8	Confident	73.6	Confident	57 Å²	57	126.9 Å²	126.9	47%	0.471	63%	0.63	S	S	.	*	H	α-helix	trans	-62.3	-35	178.1	0	0	0	0	0	113.2	Q4 I5 F12	Q4-A8 VanDerWaalsContact O-CB 3.24Å; Q4-A8 WeakPolarHBondContact O-CB 3.47Å; Q4-A8 PolarHBondContact O-N 3.08Å; I5-A8 PolarHBondContact O-N 3.34Å; A8-F12 VanDerWaalsContact O-CB 3.3Å; A8-F12 WeakPolarHBondContact O-CB 3.4Å; A8-F12 PolarHBondContact O-N 3.3Å
9	L	72.4	Confident	74.1	Confident	92 Å²	92	125.6 Å²	125.6	48%	0.482	63%	0.632	S	S	.	*	H	α-helix	trans	-69.7	-41.4	172.6	-75.5	166.4	0	0	0	111.6	I5 S7 F12 F13	I5-L9 HydrophobicContact CG2-CD1 3.91Å; I5-L9 HydrophobicContact CG2-CG 4.49Å; I5-L9 WeakPolarHBondContact O-CB 3.47Å; I5-L9 WeakPolarHBondContact O-CD1 3.38Å; I5-L9 VanDerWaalsContact O-CG 3.25Å; I5-L9 WeakPolarHBondContact O-CG 3.44Å; I5-L9 PolarHBondContact O-N 2.99Å; S7-L9 VanDerWaalsContact C-N 3.3Å; S7-L9 PolarHBondContact O-N 3.47Å; L9-F12 PolarHBondContact O-N 2.76Å; L9-F13 HydrophobicContact CD2-CE2 4.37Å; L9-F13 WeakPolarHBondContact O-CD2 3.46Å; L9-F13 PolarHBondContact O-N 2.92Å
10	S	76.8	Confident	74.5	Confident	51 Å²	51	130.4 Å²	130.4	36%	0.357	64%	0.642	S	S	.	*	H	α-helix	trans	-60.6	-47	174.4	179.2	0	0	0	0	111	T6 S7 F12 F13 F14	T6-S10 WeakPolarHBondContact O-CB 3.47Å; T6-S10 PolarHBondContact O-N 3.1Å; S7-S10 CarbonylContact O-C 3.45Å; S7-S10 WeakPolarHBondContact O-CA 3.47Å; S7-S10 WeakPolarHBondContact O-CB 3.26Å; S7-S10 PolarHBondContact O-N 2.88Å; S7-S10 VanDerWaalsContact O-N 3.07Å; S10-F12 VanDerWaalsContact C-N 3.34Å; S10-F12 PolarHBondContact O-N 3Å; S10-F13 PolarHBondContact O-N 2.68Å; S10-F14 VanDerWaalsContact O-CB 3.29Å; S10-F14 WeakPolarHBondContact O-CB 3.4Å; S10-F14 WeakPolarHBondContact O-CD2 3.09Å; S10-F14 PolarHBondContact O-N 2.88Å
11	D	79.2	Confident	74.8	Confident	69 Å²	69	132.4 Å²	132.4	37%	0.369	65%	0.65	S	S	.	*	H	α-helix	trans	-63.8	-42.4	179.8	-61	-19.5	0	0	0	109.8	S7 F13 F14 E15	S7-D11 WeakPolarHBondContact O-CB 3.4Å; S7-D11 PolarHBondContact O-N 3.25Å; D11-F13 PolarHBondContact O-N 2.83Å; D11-F14 PolarHBondContact O-N 3.41Å; D11-E15 HydrophobicContact CB-CG 4.13Å; D11-E15 WeakPolarHBondContact O-CA 3.34Å; D11-E15 WeakPolarHBondContact O-CB 3.47Å; D11-E15 WeakPolarHBondContact O-CG 3.03Å; D11-E15 PolarHBondContact O-N 2.57Å
12	F	77.3	Confident	76.2	Confident	164 Å²	164	126.8 Å²	126.8	72%	0.719	63%	0.627	S	S	*	*	H	α-helix	trans	-62.6	-37.5	175.2	-175.9	-99.2	0	0	0	114.5	A8 L9 S10	A8-F12 VanDerWaalsContact O-CB 3.3Å; A8-F12 WeakPolarHBondContact O-CB 3.4Å; A8-F12 PolarHBondContact O-N 3.3Å; L9-F12 PolarHBondContact O-N 2.76Å; S10-F12 VanDerWaalsContact C-N 3.34Å; S10-F12 PolarHBondContact O-N 3Å
13	F	81.6	Confident	77.5	Confident	148 Å²	148	126.1 Å²	126.1	65%	0.649	63%	0.631	S	S	*	*	H	α-helix	trans	-86.2	-24.4	-179.3	-80.1	-70.7	0	0	0	113.8	L9 S10 D11	L9-F13 HydrophobicContact CD2-CE2 4.37Å; L9-F13 WeakPolarHBondContact O-CD2 3.46Å; L9-F13 PolarHBondContact O-N 2.92Å; S10-F13 PolarHBondContact O-N 2.68Å; D11-F13 PolarHBondContact O-N 2.83Å
14	F	83.9	Confident	78.5	Confident	171 Å²	171	121.7 Å²	121.7	75%	0.75	61%	0.609	S	S	*	*	H	α-helix	trans	-118.9	-4.8	-171.8	-59.6	-66.3	0	0	0	114.6	S10 D11	S10-F14 VanDerWaalsContact O-CB 3.29Å; S10-F14 WeakPolarHBondContact O-CB 3.4Å; S10-F14 WeakPolarHBondContact O-CD2 3.09Å; S10-F14 PolarHBondContact O-N 2.88Å; D11-F14 PolarHBondContact O-N 3.41Å
15	E	86	Confident	79.4	Confident	136 Å²	136	126.3 Å²	126.3	64%	0.636	62%	0.62	S	S	*	*			trans	-82.8	130.5	167.4	-68.5	-178.2	162.8	0	0	110.9	D11	D11-E15 HydrophobicContact CB-CG 4.13Å; D11-E15 WeakPolarHBondContact O-CA 3.34Å; D11-E15 WeakPolarHBondContact O-CB 3.47Å; D11-E15 WeakPolarHBondContact O-CG 3.03Å; D11-E15 PolarHBondContact O-N 2.57Å
16	Y	82.3	Confident	80.1	Confident	200 Å²	200	124 Å²	124	78%	0.784	61%	0.608	S	S	*	*			trans	-114.2	108.4	174.4	179.1	-110.6	0	0	0	109.2	T18	Y16-T18 HydrophobicContact CD1-CG2 3.51Å; Y16-T18 HydrophobicContact CE1-CG2 3.38Å; Y16-T18 PolarHBondContact O-N 2.95Å
17	E	83.1	Confident	80.9	Confident	181 Å²	181	130.3 Å²	130.3	85%	0.846	62%	0.622	S	S	*	*			trans	-73	119.4	178.6	-66.5	-170.9	168.9	0	0	111.1
18	T	84.6	Confident	81.5	Confident	101 Å²	101	137.7 Å²	137.7	62%	0.62	64%	0.642	S	S	*	*			trans	-110.7	132.6	172.9	59.6	0	0	0	0	111.2	Y16 R20	Y16-T18 HydrophobicContact CD1-CG2 3.51Å; Y16-T18 HydrophobicContact CE1-CG2 3.38Å; Y16-T18 PolarHBondContact O-N 2.95Å; T18-R20 PolarHBondContact O-N 3.32Å
19	P	83.4	Confident	81.9	Confident	103 Å²	103	135.6 Å²	135.6	67%	0.669	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-67.4	134.8	175.8	27.9	-33.7	0	0	0	110.6	Q21	P19-Q21 PolarHBondContact O-N 2.04Å
20	R	81.9	Confident	82.6	Confident	220 Å²	220	132.9 Å²	132.9	83%	0.83	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-70	117.7	172.8	-174.5	176.8	177.8	164.6	1.9	109.8	T18	T18-R20 PolarHBondContact O-N 3.32Å
21	Q	81.4	Confident	83.3	Confident	174 Å²	174	134 Å²	134	81%	0.813	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-94	146.9	-179	-62.1	-175.8	-0.4	0	0	112.3	P19	P19-Q21 PolarHBondContact O-N 2.04Å
22	V	82.3	Confident	83.7	Confident	78 Å²	78	133.8 Å²	133.8	47%	0.473	62%	0.623	S	S	.	*			trans	-107.4	118.4	173.9	179.1	0	0	0	0	109.1	V24	V22-V24 HydrophobicContact CG1-CG2 4.42Å
23	L	81.6	Confident	84.2	Confident	165 Å²	165	127.1 Å²	127.1	86%	0.864	60%	0.596	S	S	*	*			trans	-91.2	108.2	178.8	-174.1	68.1	0	0	0	110.9
24	V	82.1	Confident	84.7	Confident	47 Å²	47	128.4 Å²	128.4	29%	0.285	60%	0.597	S	S	.	*			trans	-89.9	110	177.2	177.8	0	0	0	0	110.9	V22 N26 L355 Y365	V22-V24 HydrophobicContact CG1-CG2 4.42Å; V24-N26 HydrophobicContact CG1-CB 4.26Å; V24-N26 PolarHBondContact O-N 2.92Å; V24-L355 HydrophobicContact CG1-CD1 4.13Å; V24-L355 HydrophobicContact CG2-CD1 4.35Å; V24-L355 HydrophobicContact CG2-CD2 4.32Å; V24-Y365 HydrophobicContact CB-CE1 4.41Å; V24-Y365 HydrophobicContact CG1-CD1 4.04Å; V24-Y365 HydrophobicContact CG1-CE1 3.36Å; V24-Y365 HydrophobicContact CG2-CD1 4.04Å; V24-Y365 HydrophobicContact CG2-CE1 4.18Å
25	R	81	Confident	85.1	Confident	247 Å²	247	125.2 Å²	125.2	93%	0.932	59%	0.587	S	S	*	*			trans	-93.3	82.9	178.6	-158.7	171.2	-177.1	170.2	-0.1	111.3
26	N	84.9	Confident	85.3	Confident	56 Å²	56	121.1 Å²	121.1	30%	0.299	57%	0.569	S	S	.	*			trans	-138.2	125.7	176	-176.2	-26.7	0	0	0	111.2	V24 R28 V29 G30 Y365	V24-N26 HydrophobicContact CG1-CB 4.26Å; V24-N26 PolarHBondContact O-N 2.92Å; N26-R28 PolarHBondContact O-N 2.75Å; N26-R28 PolarHBondContact OD1-N 3.32Å; N26-R28 VanDerWaalsContact OD1-N 3.08Å; N26-V29 HydrophobicContact CB-CB 4.14Å; N26-V29 HydrophobicContact CB-CG2 3.89Å; N26-V29 PolarHBondContact O-N 3.46Å; N26-G30 PolarHBondContact O-N 3.05Å; N26-Y365 PolarHBondContact ND2-OH 3.28Å
27	R	86.6	Confident	85.7	Confident	224 Å²	224	113.9 Å²	113.9	85%	0.845	54%	0.542	S	S	*	.	H	α-helix	trans	-60	-42.8	-175.8	-171.1	175.7	178.8	177.3	-0.3	113.1	V31	R27-V31 VanDerWaalsContact O-CG2 3.23Å; R27-V31 WeakPolarHBondContact O-CG2 3.39Å; R27-V31 PolarHBondContact O-N 3.15Å
28	R	84.7	Confident	86.2	Confident	207 Å²	207	109.7 Å²	109.7	78%	0.781	53%	0.526	S	S	*	.	H	α-helix	trans	-68.3	-45.6	-177.5	-66.9	-175.9	-178.7	178	0.6	111.4	N26 V31 V32	N26-R28 PolarHBondContact O-N 2.75Å; N26-R28 PolarHBondContact OD1-N 3.32Å; N26-R28 VanDerWaalsContact OD1-N 3.08Å; R28-V31 PolarHBondContact O-N 3.01Å; R28-V32 WeakPolarHBondContact O-CG2 3.38Å; R28-V32 PolarHBondContact O-N 2.63Å; R28-V32 VanDerWaalsContact O-N 3.08Å
29	V	83.4	Confident	86.6	Confident	13 Å²	13	106.9 Å²	106.9	8%	0.079	52%	0.517	C	S	.	.	H	α-helix	trans	-64.3	-46.8	178.7	-177.6	0	0	0	0	111	N26 V31 V32 C33 L355 L359	N26-V29 HydrophobicContact CB-CB 4.14Å; N26-V29 HydrophobicContact CB-CG2 3.89Å; N26-V29 PolarHBondContact O-N 3.46Å; V29-V31 VanDerWaalsContact C-N 3.33Å; V29-V31 PolarHBondContact O-N 2.86Å; V29-V32 PolarHBondContact O-N 3.09Å; V29-C33 PolarHBondContact O-N 3.26Å; V29-C33 PolarHBondContact O-SG 3.27Å; V29-L355 HydrophobicContact CB-CD1 4.49Å; V29-L355 HydrophobicContact CG1-CD1 3.44Å; V29-L355 VanDerWaalsContact CG1-CD1 3.44Å; V29-L355 HydrophobicContact CG2-CD1 4.37Å; V29-L359 HydrophobicContact CB-CD1 4.34Å; V29-L359 HydrophobicContact CG1-CD1 4.21Å; V29-L359 HydrophobicContact CG2-CD1 3.26Å; V29-L359 HydrophobicContact CG2-CD2 4.09Å; V29-L359 HydrophobicContact CG2-CG 4.34Å
30	G	87.5	Confident	87.1	Confident	35 Å²	35	103.2 Å²	103.2	36%	0.361	49%	0.492	S	S	.	.	H	α-helix	trans	-58	-45	177.7	0	0	0	0	0	111.8	N26 R34	N26-G30 PolarHBondContact O-N 3.05Å; G30-R34 VanDerWaalsContact O-CB 3.29Å; G30-R34 WeakPolarHBondContact O-CB 3.38Å; G30-R34 WeakPolarHBondContact O-CG 3.49Å; G30-R34 PolarHBondContact O-N 3.27Å
31	V	90.2	Very high	87.7	Confident	76 Å²	76	96.2 Å²	96.2	46%	0.461	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-48.6	176.7	170.3	0	0	0	0	111.4	R27 R28 V29 C33 R34 L35	R27-V31 VanDerWaalsContact O-CG2 3.23Å; R27-V31 WeakPolarHBondContact O-CG2 3.39Å; R27-V31 PolarHBondContact O-N 3.15Å; R28-V31 PolarHBondContact O-N 3.01Å; V29-V31 VanDerWaalsContact C-N 3.33Å; V29-V31 PolarHBondContact O-N 2.86Å; V31-C33 PolarHBondContact O-N 2.93Å; V31-R34 PolarHBondContact O-N 2.91Å; V31-L35 HydrophobicContact CG1-CD1 3.89Å; V31-L35 HydrophobicContact CG1-CG 4.32Å; V31-L35 WeakPolarHBondContact O-CB 3.37Å; V31-L35 VanDerWaalsContact O-CG 3.3Å; V31-L35 WeakPolarHBondContact O-CG 2.98Å; V31-L35 PolarHBondContact O-N 2.87Å
32	V	88.1	Confident	88.3	Confident	64 Å²	64	92.3 Å²	92.3	39%	0.388	46%	0.459	S	S	.	.	H	α-helix	trans	-59.7	-47.7	179.7	172.6	0	0	0	0	111.4	R28 V29 R34 L35 I36 V354	R28-V32 WeakPolarHBondContact O-CG2 3.38Å; R28-V32 PolarHBondContact O-N 2.63Å; R28-V32 VanDerWaalsContact O-N 3.08Å; V29-V32 PolarHBondContact O-N 3.09Å; V32-R34 PolarHBondContact O-N 2.03Å; V32-L35 PolarHBondContact O-N 3.37Å; V32-I36 HydrophobicContact CG1-CD1 4.07Å; V32-I36 WeakPolarHBondContact O-CG1 3.16Å; V32-I36 PolarHBondContact O-N 3.46Å; V32-V354 HydrophobicContact CG1-CG1 4.34Å
33	C	88.3	Confident	88.9	Confident	24 Å²	24	94.3 Å²	94.3	16%	0.162	46%	0.459	C	S	.	.	H	α-helix	trans	-65.9	-39.1	-179.5	-59.5	0	0	0	0	112	V29 V31 I36 Q37 C351	V29-C33 PolarHBondContact O-N 3.26Å; V29-C33 PolarHBondContact O-SG 3.27Å; V31-C33 PolarHBondContact O-N 2.93Å; C33-I36 PolarHBondContact O-N 3.38Å; C33-Q37 WeakPolarHBondContact O-CG 3.39Å; C33-Q37 PolarHBondContact O-N 2.82Å; C33-C351 VanDerWaalsContact CA-SG 3.57Å; C33-C351 HydrophobicContact CB-CB 4.09Å; C33-C351 VanDerWaalsContact CB-SG 3.53Å; C33-C351 VanDerWaalsContact SG-CB 3.55Å
34	R	90.9	Very high	89.5	Confident	174 Å²	174	87 Å²	87	66%	0.657	42%	0.42	S	S	*	.	H	α-helix	trans	-67.5	-35	175.9	-71	-62	-173.5	-170.5	6.4	112.4	G30 V31 V32 Q37 L38	G30-R34 VanDerWaalsContact O-CB 3.29Å; G30-R34 WeakPolarHBondContact O-CB 3.38Å; G30-R34 WeakPolarHBondContact O-CG 3.49Å; G30-R34 PolarHBondContact O-N 3.27Å; V31-R34 PolarHBondContact O-N 2.91Å; V32-R34 PolarHBondContact O-N 2.03Å; R34-Q37 PolarHBondContact O-N 2.88Å; R34-L38 VanDerWaalsContact O-CB 3.26Å; R34-L38 WeakPolarHBondContact O-CB 3.33Å; R34-L38 PolarHBondContact O-N 2.93Å
35	L	92.8	Very high	90	Very high	105 Å²	105	88.8 Å²	88.8	55%	0.55	43%	0.427	S	S	.	.	H	α-helix	trans	-66.8	-41.4	173.9	-73.8	173.6	0	0	0	112	V31 V32 L38 G39	V31-L35 HydrophobicContact CG1-CD1 3.89Å; V31-L35 HydrophobicContact CG1-CG 4.32Å; V31-L35 WeakPolarHBondContact O-CB 3.37Å; V31-L35 VanDerWaalsContact O-CG 3.3Å; V31-L35 WeakPolarHBondContact O-CG 2.98Å; V31-L35 PolarHBondContact O-N 2.87Å; V32-L35 PolarHBondContact O-N 3.37Å; L35-L38 PolarHBondContact O-N 2.94Å; L35-G39 PolarHBondContact O-N 3.1Å
36	I	90.5	Very high	90.7	Very high	50 Å²	50	78.5 Å²	78.5	26%	0.256	40%	0.399	S	S	.	.	H	α-helix	trans	-61.9	-47.7	174.7	-65.8	166.8	0	0	0	110.2	V32 C33 L38 G39 V40 A347	V32-I36 HydrophobicContact CG1-CD1 4.07Å; V32-I36 WeakPolarHBondContact O-CG1 3.16Å; V32-I36 PolarHBondContact O-N 3.46Å; C33-I36 PolarHBondContact O-N 3.38Å; I36-L38 VanDerWaalsContact C-N 3.32Å; I36-L38 PolarHBondContact O-N 2.78Å; I36-G39 PolarHBondContact O-N 3.31Å; I36-V40 WeakPolarHBondContact O-CG2 3.01Å; I36-V40 PolarHBondContact O-N 3.13Å; I36-A347 HydrophobicContact CG2-CB 4.24Å
37	Q	90.3	Very high	91.1	Very high	47 Å²	47	81.4 Å²	81.4	22%	0.22	41%	0.405	C	S	.	.	H	α-helix	trans	-60.2	-41.2	175.8	-72.8	175.7	-9.5	0	0	112.3	C33 R34 V40 L41 F344	C33-Q37 WeakPolarHBondContact O-CG 3.39Å; C33-Q37 PolarHBondContact O-N 2.82Å; R34-Q37 PolarHBondContact O-N 2.88Å; Q37-V40 PolarHBondContact O-N 3.1Å; Q37-L41 WeakPolarHBondContact O-CB 3.01Å; Q37-L41 PolarHBondContact O-N 2.03Å; Q37-F344 HydrophobicContact CB-CE1 4.46Å; Q37-F344 WeakPolarHBondContact O-CE1 3.25Å
38	L	93.8	Very high	91.4	Very high	94 Å²	94	72.2 Å²	72.2	49%	0.492	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-42.1	176.1	-176	68.4	0	0	0	111.3	R34 L35 I36 V40 L41 V42	R34-L38 VanDerWaalsContact O-CB 3.26Å; R34-L38 WeakPolarHBondContact O-CB 3.33Å; R34-L38 PolarHBondContact O-N 2.93Å; L35-L38 PolarHBondContact O-N 2.94Å; I36-L38 VanDerWaalsContact C-N 3.32Å; I36-L38 PolarHBondContact O-N 2.78Å; L38-V40 VanDerWaalsContact C-N 3.34Å; L38-V40 PolarHBondContact O-N 2.74Å; L38-L41 WeakPolarHBondContact O-CB 3.45Å; L38-L41 PolarHBondContact O-N 3.44Å; L38-V42 VanDerWaalsContact O-CG2 3.3Å; L38-V42 WeakPolarHBondContact O-CG2 3.31Å; L38-V42 PolarHBondContact O-N 3.21Å
39	G	94	Very high	91.7	Very high	42 Å²	42	64.2 Å²	64.2	43%	0.433	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-43.3	175.7	0	0	0	0	0	112.3	L35 I36 V42 Y43	L35-G39 PolarHBondContact O-N 3.1Å; I36-G39 PolarHBondContact O-N 3.31Å; G39-V42 PolarHBondContact O-N 3.39Å; G39-Y43 PolarHBondContact O-N 2.83Å
40	V	93.7	Very high	92.1	Very high	26 Å²	26	69.2 Å²	69.2	16%	0.158	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-42.9	174.3	170.4	0	0	0	0	111.6	I36 Q37 L38 V42 Y43 I44 I343 F344 A347	I36-V40 WeakPolarHBondContact O-CG2 3.01Å; I36-V40 PolarHBondContact O-N 3.13Å; Q37-V40 PolarHBondContact O-N 3.1Å; L38-V40 VanDerWaalsContact C-N 3.34Å; L38-V40 PolarHBondContact O-N 2.74Å; V40-V42 VanDerWaalsContact C-N 3.34Å; V40-V42 PolarHBondContact O-N 3.39Å; V40-Y43 PolarHBondContact O-N 3.44Å; V40-I44 HydrophobicContact CG1-CD1 3.72Å; V40-I44 HydrophobicContact CG1-CG1 4.44Å; V40-I44 WeakPolarHBondContact O-CG1 3.33Å; V40-I44 PolarHBondContact O-N 3.32Å; V40-I343 HydrophobicContact CG1-CB 4.43Å; V40-I343 HydrophobicContact CG1-CG2 3.67Å; V40-F344 HydrophobicContact CB-CE1 4.42Å; V40-F344 HydrophobicContact CG1-CD1 4.16Å; V40-F344 HydrophobicContact CG1-CD2 4.38Å; V40-F344 HydrophobicContact CG1-CE1 4.13Å; V40-F344 HydrophobicContact CG1-CE2 4.36Å; V40-F344 HydrophobicContact CG1-CG 4.28Å; V40-F344 HydrophobicContact CG1-CZ 4.22Å; V40-A347 HydrophobicContact CG2-CB 4.06Å
41	L	93.2	Very high	92.4	Very high	72 Å²	72	74.7 Å²	74.7	38%	0.377	38%	0.381	S	S	.	.	H	α-helix	trans	-59.2	-46	175.9	-173.7	65.7	0	0	0	111.6	Q37 L38 Y43 I44 I45 F344	Q37-L41 WeakPolarHBondContact O-CB 3.01Å; Q37-L41 PolarHBondContact O-N 2.03Å; L38-L41 WeakPolarHBondContact O-CB 3.45Å; L38-L41 PolarHBondContact O-N 3.44Å; L41-Y43 VanDerWaalsContact C-N 3.33Å; L41-Y43 PolarHBondContact O-N 2.82Å; L41-I44 PolarHBondContact O-N 2.81Å; L41-I45 HydrophobicContact CD1-CD1 3.75Å; L41-I45 HydrophobicContact CD1-CG1 4.27Å; L41-I45 HydrophobicContact CG-CD1 3.9Å; L41-I45 WeakPolarHBondContact O-CG1 3.48Å; L41-I45 PolarHBondContact O-N 2.87Å; L41-F344 HydrophobicContact CB-CE1 4.35Å; L41-F344 HydrophobicContact CB-CZ 3.74Å; L41-F344 HydrophobicContact CD1-CE2 4.19Å; L41-F344 HydrophobicContact CD1-CZ 3.69Å; L41-F344 HydrophobicContact CG-CZ 4.3Å
42	V	95.4	Very high	92.5	Very high	93 Å²	93	75.5 Å²	75.5	56%	0.564	38%	0.38	S	S	*	.	H	α-helix	trans	-62.4	-41.1	177.7	169.2	0	0	0	0	110.8	L38 G39 V40 G46	L38-V42 VanDerWaalsContact O-CG2 3.3Å; L38-V42 WeakPolarHBondContact O-CG2 3.31Å; L38-V42 PolarHBondContact O-N 3.21Å; G39-V42 PolarHBondContact O-N 3.39Å; V40-V42 VanDerWaalsContact C-N 3.34Å; V40-V42 PolarHBondContact O-N 3.39Å; V42-G46 WeakPolarHBondContact O-CA 3.34Å; V42-G46 PolarHBondContact O-N 3.26Å
43	Y	93.7	Very high	92.7	Very high	119 Å²	119	75.9 Å²	75.9	47%	0.467	38%	0.376	S	S	.	.	I	π-helix	trans	-62.3	-48.5	175.1	172.1	-100.6	0	0	0	112	G39 V40 L41 W47 V48	G39-Y43 PolarHBondContact O-N 2.83Å; V40-Y43 PolarHBondContact O-N 3.44Å; L41-Y43 VanDerWaalsContact C-N 3.33Å; L41-Y43 PolarHBondContact O-N 2.82Å; Y43-W47 HydrophobicContact CD2-CB 3.85Å; Y43-W47 HydrophobicContact CD2-CG 4.31Å; Y43-W47 HydrophobicContact CE2-CB 3.84Å; Y43-W47 AromaticContact CE2-CD1 3.89Å; Y43-W47 AromaticContact CE2-CG 3.83Å; Y43-W47 HydrophobicContact CE2-CG 3.83Å; Y43-W47 WeakPolarHBondContact O-CA 3.23Å; Y43-W47 WeakPolarHBondContact O-CB 3.47Å; Y43-W47 PolarHBondContact O-N 2.87Å; Y43-V48 HydrophobicContact CE1-CG2 4.05Å; Y43-V48 PolarHBondContact O-N 2.96Å
44	I	93.4	Very high	92.8	Very high	11 Å²	11	75.9 Å²	75.9	6%	0.056	38%	0.38	C	S	.	.	I	π-helix	trans	-62.7	-51.7	-179.3	-67	163.2	0	0	0	110.4	V40 L41 V48 F49 G340 F344	V40-I44 HydrophobicContact CG1-CD1 3.72Å; V40-I44 HydrophobicContact CG1-CG1 4.44Å; V40-I44 WeakPolarHBondContact O-CG1 3.33Å; V40-I44 PolarHBondContact O-N 3.32Å; L41-I44 PolarHBondContact O-N 2.81Å; I44-V48 VanDerWaalsContact O-CB 3.27Å; I44-V48 WeakPolarHBondContact O-CB 3.41Å; I44-V48 PolarHBondContact O-N 3.19Å; I44-F49 HydrophobicContact CG2-CD2 3.89Å; I44-F49 HydrophobicContact CG2-CE2 3.77Å; I44-F49 WeakPolarHBondContact O-CD2 3.04Å; I44-F49 PolarHBondContact O-N 2.83Å; I44-G340 WeakPolarHBondContact CD1-O 3.4Å; I44-F344 HydrophobicContact CD1-CD2 3.79Å; I44-F344 HydrophobicContact CD1-CE2 3.48Å; I44-F344 VanDerWaalsContact CD1-CE2 3.48Å; I44-F344 HydrophobicContact CD1-CZ 4.3Å
45	I	93.9	Very high	92.9	Very high	85 Å²	85	70.7 Å²	70.7	44%	0.436	36%	0.361	S	S	.	.	I	π-helix	trans	-68.8	-48.4	-177.7	-63.5	177.1	0	0	0	110.8	L41 F49 I50	L41-I45 HydrophobicContact CD1-CD1 3.75Å; L41-I45 HydrophobicContact CD1-CG1 4.27Å; L41-I45 HydrophobicContact CG-CD1 3.9Å; L41-I45 WeakPolarHBondContact O-CG1 3.48Å; L41-I45 PolarHBondContact O-N 2.87Å; I45-F49 WeakPolarHBondContact O-CB 3.3Å; I45-I50 HydrophobicContact CG2-CD1 4.06Å; I45-I50 VanDerWaalsContact O-CG1 3.3Å; I45-I50 WeakPolarHBondContact O-CG1 3.32Å; I45-I50 PolarHBondContact O-N 3.11Å
46	G	94.5	Very high	93	Very high	32 Å²	32	66.2 Å²	66.2	33%	0.33	34%	0.337	S	S	.	.	I	π-helix	trans	-73.5	-51	-174.2	0	0	0	0	0	113.4	V42 I50 Y51	V42-G46 WeakPolarHBondContact O-CA 3.34Å; V42-G46 PolarHBondContact O-N 3.26Å; G46-I50 WeakPolarHBondContact O-CB 3.38Å; G46-Y51 PolarHBondContact O-N 3.48Å
47	W	93.7	Very high	93.2	Very high	116 Å²	116	65 Å²	65	44%	0.439	33%	0.334	S	S	.	.	I	π-helix	trans	-82.9	-57.1	-177	-170.5	-89.3	0	0	0	111.7	Y43 Y51 E52	Y43-W47 HydrophobicContact CD2-CB 3.85Å; Y43-W47 HydrophobicContact CD2-CG 4.31Å; Y43-W47 HydrophobicContact CE2-CB 3.84Å; Y43-W47 AromaticContact CE2-CD1 3.89Å; Y43-W47 AromaticContact CE2-CG 3.83Å; Y43-W47 HydrophobicContact CE2-CG 3.83Å; Y43-W47 WeakPolarHBondContact O-CA 3.23Å; Y43-W47 WeakPolarHBondContact O-CB 3.47Å; Y43-W47 PolarHBondContact O-N 2.87Å; W47-Y51 HydrophobicContact CD2-CD1 4.16Å; W47-Y51 HydrophobicContact CE3-CD1 4.09Å; W47-Y51 HydrophobicContact CE3-CG 4.32Å; W47-Y51 AromaticContact CH2-CD1 3.85Å; W47-Y51 HydrophobicContact CH2-CD1 3.85Å; W47-Y51 AromaticContact CH2-CE1 3.61Å; W47-Y51 HydrophobicContact CH2-CE1 3.61Å; W47-Y51 AromaticContact CZ2-CD1 3.9Å; W47-Y51 HydrophobicContact CZ2-CD1 3.9Å; W47-Y51 AromaticContact CZ2-CE1 3.86Å; W47-Y51 HydrophobicContact CZ2-CE1 3.86Å; W47-Y51 AromaticContact CZ3-CD1 3.94Å; W47-Y51 HydrophobicContact CZ3-CD1 3.94Å; W47-Y51 HydrophobicContact CZ3-CE1 4.02Å; W47-Y51 HydrophobicContact CZ3-CG 4.35Å; W47-Y51 WeakPolarHBondContact O-CB 3.26Å; W47-Y51 PolarHBondContact O-N 2.67Å; W47-E52 PolarHBondContact O-N 2.97Å
48	V	93.1	Very high	93.4	Very high	31 Å²	31	66.7 Å²	66.7	19%	0.188	35%	0.347	C	S	.	.	I	π-helix	trans	-72.3	-47.6	-171	-177	0	0	0	0	111.7	Y43 I44 G54 A336	Y43-V48 HydrophobicContact CE1-CG2 4.05Å; Y43-V48 PolarHBondContact O-N 2.96Å; I44-V48 VanDerWaalsContact O-CB 3.27Å; I44-V48 WeakPolarHBondContact O-CB 3.41Å; I44-V48 PolarHBondContact O-N 3.19Å; V48-G54 PolarHBondContact O-N 3.4Å; V48-A336 HydrophobicContact CG1-CB 4.33Å
49	F	92.2	Very high	93.5	Very high	40 Å²	40	63.3 Å²	63.3	18%	0.175	33%	0.329	C	S	.	.	I	π-helix	trans	-83	-47.5	-178.8	-78.2	-79.6	0	0	0	113.1	I44 I45 K53 Y55 T333 A336 I337	I44-F49 HydrophobicContact CG2-CD2 3.89Å; I44-F49 HydrophobicContact CG2-CE2 3.77Å; I44-F49 WeakPolarHBondContact O-CD2 3.04Å; I44-F49 PolarHBondContact O-N 2.83Å; I45-F49 WeakPolarHBondContact O-CB 3.3Å; F49-K53 VanDerWaalsContact O-CA 3.24Å; F49-K53 WeakPolarHBondContact O-CA 3.49Å; F49-K53 PolarHBondContact O-N 2.97Å; F49-Y55 HydrophobicContact CD1-CD1 4.13Å; F49-Y55 WeakPolarHBondContact O-CD1 3.24Å; F49-Y55 WeakPolarHBondContact O-CE1 3.38Å; F49-T333 HydrophobicContact CE1-CG2 4.42Å; F49-A336 HydrophobicContact CE1-CB 4.11Å; F49-A336 HydrophobicContact CE2-CB 4.35Å; F49-A336 HydrophobicContact CZ-CB 3.71Å; F49-I337 HydrophobicContact CZ-CG1 3.75Å
50	I	91.8	Very high	93.6	Very high	117 Å²	117	66 Å²	66	60%	0.6	34%	0.337	S	S	*	.	I	π-helix	trans	-84.3	-52.2	-173.2	-66	167.6	0	0	0	112	I45 G46	I45-I50 HydrophobicContact CG2-CD1 4.06Å; I45-I50 VanDerWaalsContact O-CG1 3.3Å; I45-I50 WeakPolarHBondContact O-CG1 3.32Å; I45-I50 PolarHBondContact O-N 3.11Å; G46-I50 WeakPolarHBondContact O-CB 3.38Å
51	Y	92.9	Very high	93.7	Very high	151 Å²	151	65.5 Å²	65.5	59%	0.592	34%	0.336	S	S	*	.	I	π-helix	trans	-74.4	-54.4	-174.1	-175	-97.7	0	0	0	112.5	G46 W47 K53	G46-Y51 PolarHBondContact O-N 3.48Å; W47-Y51 HydrophobicContact CD2-CD1 4.16Å; W47-Y51 HydrophobicContact CE3-CD1 4.09Å; W47-Y51 HydrophobicContact CE3-CG 4.32Å; W47-Y51 AromaticContact CH2-CD1 3.85Å; W47-Y51 HydrophobicContact CH2-CD1 3.85Å; W47-Y51 AromaticContact CH2-CE1 3.61Å; W47-Y51 HydrophobicContact CH2-CE1 3.61Å; W47-Y51 AromaticContact CZ2-CD1 3.9Å; W47-Y51 HydrophobicContact CZ2-CD1 3.9Å; W47-Y51 AromaticContact CZ2-CE1 3.86Å; W47-Y51 HydrophobicContact CZ2-CE1 3.86Å; W47-Y51 AromaticContact CZ3-CD1 3.94Å; W47-Y51 HydrophobicContact CZ3-CD1 3.94Å; W47-Y51 HydrophobicContact CZ3-CE1 4.02Å; W47-Y51 HydrophobicContact CZ3-CG 4.35Å; W47-Y51 WeakPolarHBondContact O-CB 3.26Å; W47-Y51 PolarHBondContact O-N 2.67Å; Y51-K53 VanDerWaalsContact C-N 3.31Å; Y51-K53 PolarHBondContact O-N 2.89Å
52	E	91.4	Very high	93.8	Very high	93 Å²	93	66.9 Å²	66.9	44%	0.435	35%	0.348	S	S	.	.	S	Bend	trans	-75.9	-21.1	179.9	-71.1	-65.6	169.3	0	0	112.8	W47 R326	W47-E52 PolarHBondContact O-N 2.97Å; E52-R326 PolarHBondContact O-NH1 3.27Å
53	K	93.2	Very high	93.8	Very high	71 Å²	71	65.2 Å²	65.2	31%	0.309	34%	0.34	S	S	.	.			trans	57.5	45.9	-172	-45.8	-176.2	-173.6	175.7	0	112.4	F49 Y51 Y55 Q56	F49-K53 VanDerWaalsContact O-CA 3.24Å; F49-K53 WeakPolarHBondContact O-CA 3.49Å; F49-K53 PolarHBondContact O-N 2.97Å; Y51-K53 VanDerWaalsContact C-N 3.31Å; Y51-K53 PolarHBondContact O-N 2.89Å; K53-Y55 HydrophobicContact CB-CE1 4.04Å; K53-Y55 PolarHBondContact O-N 3.14Å; K53-Q56 HydrophobicContact CB-CG 4.2Å; K53-Q56 PolarHBondContact O-N 2.76Å
54	G	90.3	Very high	93.8	Very high	24 Å²	24	62.1 Å²	62.1	25%	0.247	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-4	-179	0	0	0	0	0	115.8	V48 P332	V48-G54 PolarHBondContact O-N 3.4Å; G54-P332 CarbonylContact O-C 3.52Å
55	Y	93.3	Very high	93.9	Very high	65 Å²	65	62.5 Å²	62.5	26%	0.255	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-7.9	171.6	63.7	-91.4	0	0	0	113.7	F49 K53 D260 F328 D329 T333	F49-Y55 HydrophobicContact CD1-CD1 4.13Å; F49-Y55 WeakPolarHBondContact O-CD1 3.24Å; F49-Y55 WeakPolarHBondContact O-CE1 3.38Å; K53-Y55 HydrophobicContact CB-CE1 4.04Å; K53-Y55 PolarHBondContact O-N 3.14Å; Y55-D260 WeakPolarHBondContact CE2-OD2 3.46Å; Y55-F328 HydrophobicContact CD2-CD2 4.01Å; Y55-D329 PolarHBondContact O-N 3.42Å; Y55-D329 VanDerWaalsContact O-N 3.13Å; Y55-T333 VanDerWaalsContact CA-OG1 3.3Å; Y55-T333 WeakPolarHBondContact CA-OG1 3.37Å; Y55-T333 WeakPolarHBondContact CB-OG1 3.33Å; Y55-T333 PolarHBondContact O-OG1 3.49Å
56	Q	94.9	Very high	93.9	Very high	11 Å²	11	64 Å²	64	5%	0.051	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	139.2	-179	-56.2	-174.1	-47.5	0	0	110.8	K53 N258 D260 R326 K327	K53-Q56 HydrophobicContact CB-CG 4.2Å; K53-Q56 PolarHBondContact O-N 2.76Å; Q56-N258 PolarHBondContact NE2-OD1 3.04Å; Q56-D260 VanDerWaalsContact NE2-CG 3.26Å; Q56-D260 PolarHBondContact NE2-OD2 3.12Å; Q56-R326 HydrophobicContact CB-CB 3.99Å; Q56-R326 HydrophobicContact CG-CB 4.42Å; Q56-K327 CarbonylContact C-O 3.6Å; Q56-K327 VanDerWaalsContact CA-O 3.26Å; Q56-K327 WeakPolarHBondContact CA-O 3.33Å
57	S	94.9	Very high	93.9	Very high	26 Å²	26	63.4 Å²	63.4	18%	0.182	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	152.9	160.6	-172.2	0	0	0	0	109.9	F194 R326 K327	S57-F194 WeakPolarHBondContact O-CZ 3.34Å; S57-R326 VanDerWaalsContact O-CA 3.28Å; S57-R326 WeakPolarHBondContact O-CA 3.47Å; S57-K327 PolarHBondContact N-O 2.89Å; S57-K327 PolarHBondContact O-N 2.82Å
58	T	95.1	Very high	93.9	Very high	81 Å²	81	64.2 Å²	64.2	50%	0.497	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	140.2	-177.4	61.9	0	0	0	0	110.9	A325 R326	T58-A325 CarbonylContact C-O 3.6Å; T58-A325 VanDerWaalsContact CA-O 3.29Å; T58-A325 WeakPolarHBondContact CA-O 3.37Å; T58-R326 HydrophobicContact CG2-CG 4.03Å
59	D	95.8	Very high	94	Very high	24 Å²	24	63.2 Å²	63.2	13%	0.128	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.6	175.1	-166.4	18.4	0	0	0	111	F191 P192 L193 F194 A325	D59-F191 HydrophobicContact CB-CD1 4.31Å; D59-F191 VanDerWaalsContact OD2-CA 3.25Å; D59-F191 WeakPolarHBondContact OD2-CA 3.33Å; D59-F191 WeakPolarHBondContact OD2-CB 3.48Å; D59-P192 VanDerWaalsContact OD2-CD 3.28Å; D59-P192 WeakPolarHBondContact OD2-CD 3.29Å; D59-P192 VanDerWaalsContact OD2-N 3.1Å; D59-L193 HydrophobicContact CB-CB 3.86Å; D59-L193 HydrophobicContact CB-CD2 4.17Å; D59-L193 WeakPolarHBondContact OD2-CB 3.24Å; D59-L193 PolarHBondContact OD2-N 2.76Å; D59-F194 HydrophobicContact CB-CD2 3.79Å; D59-F194 HydrophobicContact CB-CE2 3.33Å; D59-F194 HydrophobicContact CB-CZ 3.79Å; D59-A325 PolarHBondContact N-O 3.48Å; D59-A325 PolarHBondContact O-N 2.87Å
60	T	95.9	Very high	94.1	Very high	97 Å²	97	68 Å²	68	60%	0.595	35%	0.353	S	S	*	.			trans	-107.2	135.5	172.9	53.8	0	0	0	0	109.1
61	A	95.3	Very high	94.2	Very high	17 Å²	17	63.5 Å²	63.5	14%	0.14	34%	0.335	C	S	.	.			trans	-78.9	145	-174.3	0	0	0	0	0	112.3	V189 T190 F191 S323	A61-V189 HydrophobicContact CB-CB 3.77Å; A61-V189 HydrophobicContact CB-CG1 4.3Å; A61-T190 CarbonylContact C-O 3.54Å; A61-T190 VanDerWaalsContact CA-O 3.22Å; A61-T190 WeakPolarHBondContact CA-O 3.27Å; A61-T190 WeakPolarHBondContact CB-O 3.39Å; A61-F191 HydrophobicContact CB-CD1 3.75Å; A61-F191 HydrophobicContact CB-CD2 4.42Å; A61-F191 HydrophobicContact CB-CE1 3.56Å; A61-F191 HydrophobicContact CB-CE2 4.24Å; A61-F191 HydrophobicContact CB-CG 4.21Å; A61-F191 HydrophobicContact CB-CZ 3.83Å; A61-S323 WeakPolarHBondContact CB-OG 3.49Å; A61-S323 PolarHBondContact N-OG 2.96Å
62	V	95.7	Very high	94.3	Very high	101 Å²	101	61 Å²	61	61%	0.612	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	124.5	156.4	-177.9	0	0	0	0	107.4	V189 T190 P192	V62-V189 WeakPolarHBondContact O-CA 3.43Å; V62-T190 PolarHBondContact N-O 3.45Å; V62-T190 PolarHBondContact O-N 2.85Å; V62-P192 HydrophobicContact CG2-CG 4.14Å
63	S	94.8	Very high	94.4	Very high	58 Å²	58	56.7 Å²	56.7	41%	0.406	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	151.9	-175	71	0	0	0	0	112.8	S188	S63-S188 CarbonylContact C-O 3.55Å; S63-S188 WeakPolarHBondContact CA-O 3.47Å
64	S	94.3	Very high	94.5	Very high	54 Å²	54	59.1 Å²	59.1	38%	0.378	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.2	171	-172.3	0	0	0	0	108.5	F66 N187 S188	S64-F66 WeakPolarHBondContact OG-CE2 3.5Å; S64-N187 WeakPolarHBondContact O-CA 3.28Å; S64-N187 PolarHBondContact O-ND2 3.03Å; S64-S188 PolarHBondContact N-O 2.8Å; S64-S188 PolarHBondContact O-N 2.75Å
65	V	95.3	Very high	94.6	Very high	18 Å²	18	58.4 Å²	58.4	11%	0.109	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.7	179.6	179.3	0	0	0	0	108.6	T67 I185 V319 V321	V65-T67 HydrophobicContact CG1-CG2 3.96Å; V65-I185 HydrophobicContact CG1-CG2 4.24Å; V65-V319 HydrophobicContact CG1-CB 4Å; V65-V319 HydrophobicContact CG1-CG1 3.79Å; V65-V319 HydrophobicContact CG1-CG2 4.32Å; V65-V319 HydrophobicContact CG2-CG1 4.11Å; V65-V321 HydrophobicContact CG2-CG2 3.52Å
66	F	92.9	Very high	94.5	Very high	117 Å²	117	59.3 Å²	59.3	51%	0.513	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131	170.1	-61.8	-85.8	0	0	0	108.4	S64 K186	S64-F66 WeakPolarHBondContact OG-CE2 3.5Å; F66-K186 HydrophobicContact CB-CB 4.3Å; F66-K186 PolarHBondContact N-O 3.14Å; F66-K186 PolarHBondContact O-N 3Å
67	T	95.1	Very high	94	Very high	19 Å²	19	61.2 Å²	61.2	12%	0.117	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.7	-179.6	58.4	0	0	0	0	109.7	V65 G95 D96 F99 L183 F184 V319	V65-T67 HydrophobicContact CG1-CG2 3.96Å; T67-G95 PolarHBondContact N-O 2.83Å; T67-G95 WeakPolarHBondContact OG1-CA 3.14Å; T67-D96 PolarHBondContact OG1-O 2.95Å; T67-F99 HydrophobicContact CG2-CD1 4.17Å; T67-F99 HydrophobicContact CG2-CE1 3.71Å; T67-L183 HydrophobicContact CG2-CD1 4.49Å; T67-F184 WeakPolarHBondContact CA-O 3.41Å; T67-V319 HydrophobicContact CG2-CG2 4.08Å
68	K	94.2	Very high	93.3	Very high	134 Å²	134	66.2 Å²	66.2	58%	0.583	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	122	173.6	175.1	172.2	-79.5	-176.7	0	109	F184	K68-F184 HydrophobicContact CB-CB 4.39Å; K68-F184 HydrophobicContact CB-CD1 4.31Å; K68-F184 PolarHBondContact N-O 3.35Å; K68-F184 PolarHBondContact O-N 2.7Å
69	M	94.1	Very high	92.6	Very high	10 Å²	10	65.4 Å²	65.4	5%	0.049	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	150.6	174.7	-163.1	59.2	65.6	0	0	110.6	V86 Y89 V90 F99 V101 T182 L183 L228	M69-V86 HydrophobicContact CB-CG1 4.1Å; M69-V86 HydrophobicContact CB-CG2 4.47Å; M69-V86 VanDerWaalsContact O-CG2 3.28Å; M69-V86 WeakPolarHBondContact O-CG2 3.43Å; M69-Y89 HydrophobicContact CG-CE2 3.78Å; M69-V90 HydrophobicContact CB-CG2 3.86Å; M69-V90 HydrophobicContact CG-CG2 4.06Å; M69-F99 HydrophobicContact CE-CE2 3.68Å; M69-F99 HydrophobicContact CE-CZ 4.33Å; M69-V101 HydrophobicContact CE-CG2 3.69Å; M69-T182 CarbonylContact C-O 3.52Å; M69-T182 WeakPolarHBondContact CA-O 3.27Å; M69-T182 VanDerWaalsContact SD-C 3.57Å; M69-L183 HydrophobicContact CE-CB 3.88Å; M69-L183 HydrophobicContact CE-CD1 3.74Å; M69-L183 HydrophobicContact CE-CG 4.3Å; M69-L183 HydrophobicContact SD-CB 4.09Å; M69-L228 HydrophobicContact CE-CD1 4.27Å; M69-L228 HydrophobicContact CE-CD2 4.02Å; M69-L228 HydrophobicContact SD-CD1 4.19Å; M69-L228 HydrophobicContact SD-CD2 4.31Å; M69-L228 HydrophobicContact SD-CG 4.34Å
70	K	94.6	Very high	92.1	Very high	140 Å²	140	67.1 Å²	67.1	61%	0.609	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	137.8	166.8	-71.1	-175.8	176.1	-178.4	0	110	Y181 T182	K70-Y181 WeakPolarHBondContact O-CA 3.39Å; K70-T182 PolarHBondContact N-O 3.38Å; K70-T182 PolarHBondContact O-N 3.19Å; K70-T182 PolarHBondContact O-OG1 3.02Å
71	G	94.6	Very high	92	Very high	23 Å²	23	68.9 Å²	68.9	24%	0.237	40%	0.395	C	S	.	.			trans	158.7	152.9	-178.9	0	0	0	0	0	109.8	Y89	G71-Y89 VanDerWaalsContact C-OH 3.31Å; G71-Y89 WeakPolarHBondContact CA-OH 3.47Å; G71-Y89 PolarHBondContact N-OH 2.84Å; G71-Y89 WeakPolarHBondContact O-CE1 3.34Å; G71-Y89 PolarHBondContact O-OH 3.23Å
72	V	95.4	Very high	91.8	Very high	98 Å²	98	70.3 Å²	70.3	59%	0.594	40%	0.402	S	S	*	.			trans	-130.4	132.6	176.1	-179.7	0	0	0	0	107.6	V83 W84 Y181	V72-V83 HydrophobicContact CG1-CG1 3.42Å; V72-V83 VanDerWaalsContact CG1-CG1 3.42Å; V72-W84 WeakPolarHBondContact CA-O 3.3Å; V72-Y181 WeakPolarHBondContact O-CE1 3.5Å
73	G	93.4	Very high	91.8	Very high	2 Å²	2	69.9 Å²	69.9	2%	0.021	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	152.3	175.4	0	0	0	0	0	110.9	V83 W84 S177 Y181	G73-V83 CarbonylContact O-C 3.48Å; G73-V83 WeakPolarHBondContact O-CA 3.42Å; G73-W84 PolarHBondContact N-O 2.89Å; G73-W84 PolarHBondContact O-N 2.81Å; G73-S177 WeakPolarHBondContact CA-OG 3.35Å; G73-Y181 WeakPolarHBondContact CA-OH 3.42Å; G73-Y181 PolarHBondContact N-OH 2.94Å
74	Y	94.1	Very high	91.8	Very high	122 Å²	122	67.7 Å²	67.7	48%	0.478	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.4	173.3	171.1	-97.8	0	0	0	108.8	N76 E81 V83	Y74-N76 HydrophobicContact CE1-CB 4.25Å; Y74-E81 HydrophobicContact CE2-CB 4.09Å; Y74-E81 HydrophobicContact CE2-CG 4.36Å; Y74-E81 VanDerWaalsContact OH-CD 3.23Å; Y74-E81 WeakPolarHBondContact OH-CG 3.46Å; Y74-E81 PolarHBondContact OH-OE1 3.18Å; Y74-E81 VanDerWaalsContact OH-OE1 3.13Å; Y74-V83 HydrophobicContact CD2-CG2 4.44Å
75	T	92.9	Very high	91.8	Very high	9 Å²	9	68.9 Å²	68.9	6%	0.055	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	138.9	174.4	61.4	0	0	0	0	109.8	T82 W84 L174 L175	T75-T82 PolarHBondContact N-O 3.42Å; T75-T82 PolarHBondContact O-N 3.13Å; T75-W84 PolarHBondContact OG1-NE1 2.86Å; T75-L174 HydrophobicContact CG2-CB 4.31Å; T75-L175 HydrophobicContact CG2-CD2 3.67Å; T75-L175 HydrophobicContact CG2-CG 4.22Å
76	N	90.6	Very high	91.8	Very high	85 Å²	85	70.5 Å²	70.5	46%	0.455	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	99.4	166.3	-173.8	-25.8	0	0	0	108.1	Y74 G79 S80	Y74-N76 HydrophobicContact CE1-CB 4.25Å; N76-G79 WeakPolarHBondContact OD1-CA 3.09Å; N76-G79 PolarHBondContact OD1-N 3.15Å; N76-S80 WeakPolarHBondContact CA-O 3.35Å
77	V	85.3	Confident	91.8	Very high	50 Å²	50	68.3 Å²	68.3	30%	0.303	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.2	-178.5	-176.9	0	0	0	0	108.1	G79 S80 L174	V77-G79 PolarHBondContact O-N 3.5Å; V77-G79 VanDerWaalsContact O-N 3.13Å; V77-S80 PolarHBondContact N-O 2.98Å; V77-S80 VanDerWaalsContact N-O 3.15Å; V77-S80 PolarHBondContact O-N 2.96Å; V77-L174 HydrophobicContact CG2-CD1 4.28Å; V77-L174 HydrophobicContact CG2-CD2 3.94Å
78	S	79.9	Confident	91.7	Very high	131 Å²	131	69.6 Å²	69.6	92%	0.916	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	30.6	178.8	-55.6	0	0	0	0	114.2	S80	S78-S80 VanDerWaalsContact C-N 3.32Å
79	G	79.7	Confident	91.7	Very high	65 Å²	65	63.2 Å²	63.2	67%	0.67	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	1.3	-179.1	0	0	0	0	0	114.8	N76 V77	N76-G79 WeakPolarHBondContact OD1-CA 3.09Å; N76-G79 PolarHBondContact OD1-N 3.15Å; V77-G79 PolarHBondContact O-N 3.5Å; V77-G79 VanDerWaalsContact O-N 3.13Å
80	S	86.6	Confident	91.8	Very high	60 Å²	60	63.3 Å²	63.3	42%	0.42	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	114.7	171.4	-171	0	0	0	0	109.9	N76 V77 S78	N76-S80 WeakPolarHBondContact CA-O 3.35Å; V77-S80 PolarHBondContact N-O 2.98Å; V77-S80 VanDerWaalsContact N-O 3.15Å; V77-S80 PolarHBondContact O-N 2.96Å; S78-S80 VanDerWaalsContact C-N 3.32Å
81	E	92.7	Very high	91.8	Very high	133 Å²	133	58.6 Å²	58.6	62%	0.621	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.1	173.6	-62.9	-170.3	163	0	0	109.3	Y74	Y74-E81 HydrophobicContact CE2-CB 4.09Å; Y74-E81 HydrophobicContact CE2-CG 4.36Å; Y74-E81 VanDerWaalsContact OH-CD 3.23Å; Y74-E81 WeakPolarHBondContact OH-CG 3.46Å; Y74-E81 PolarHBondContact OH-OE1 3.18Å; Y74-E81 VanDerWaalsContact OH-OE1 3.13Å
82	T	92.5	Very high	91.7	Very high	48 Å²	48	60.6 Å²	60.6	29%	0.294	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132.4	-179.9	-54	0	0	0	0	110	T75 W84	T75-T82 PolarHBondContact N-O 3.42Å; T75-T82 PolarHBondContact O-N 3.13Å; T82-W84 HydrophobicContact CG2-CD2 4.32Å; T82-W84 HydrophobicContact CG2-CZ2 3.89Å
83	V	94.9	Very high	91.2	Very high	91 Å²	91	60.4 Å²	60.4	55%	0.552	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	131.5	171	179.1	0	0	0	0	107.9	V72 G73 Y74	V72-V83 HydrophobicContact CG1-CG1 3.42Å; V72-V83 VanDerWaalsContact CG1-CG1 3.42Å; G73-V83 CarbonylContact O-C 3.48Å; G73-V83 WeakPolarHBondContact O-CA 3.42Å; Y74-V83 HydrophobicContact CD2-CG2 4.44Å
84	W	94.8	Very high	90.7	Very high	13 Å²	13	68.9 Å²	68.9	5%	0.049	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.7	-178.6	-61.9	87.9	0	0	0	109.3	V72 G73 T75 T82 D88 Y89 M102 F105 L175 L310	V72-W84 WeakPolarHBondContact CA-O 3.3Å; G73-W84 PolarHBondContact N-O 2.89Å; G73-W84 PolarHBondContact O-N 2.81Å; T75-W84 PolarHBondContact OG1-NE1 2.86Å; T82-W84 HydrophobicContact CG2-CD2 4.32Å; T82-W84 HydrophobicContact CG2-CZ2 3.89Å; W84-D88 HydrophobicContact CE3-CB 3.55Å; W84-D88 HydrophobicContact CZ3-CB 4.03Å; W84-Y89 HydrophobicContact CB-CD1 4.17Å; W84-M102 HydrophobicContact CD2-CE 4.04Å; W84-M102 HydrophobicContact CE3-CE 3.31Å; W84-M102 HydrophobicContact CH2-CE 4.14Å; W84-M102 HydrophobicContact CZ3-CE 3.38Å; W84-F105 AromaticContact CE2-CE1 3.86Å; W84-F105 AromaticContact CE2-CZ 3.77Å; W84-F105 HydrophobicContact CH2-CE1 4.21Å; W84-F105 HydrophobicContact CH2-CE2 4.25Å; W84-F105 AromaticContact CH2-CZ 3.99Å; W84-F105 HydrophobicContact CH2-CZ 3.99Å; W84-F105 AromaticContact CZ2-CE1 3.66Å; W84-F105 HydrophobicContact CZ2-CE1 3.66Å; W84-F105 AromaticContact CZ2-CE2 3.83Å; W84-F105 HydrophobicContact CZ2-CE2 3.83Å; W84-F105 AromaticContact CZ2-CZ 3.25Å; W84-F105 HydrophobicContact CZ2-CZ 3.25Å; W84-L175 HydrophobicContact CB-CD2 4.18Å; W84-L175 HydrophobicContact CG-CD1 4.49Å; W84-L175 HydrophobicContact CG-CD2 3.93Å; W84-L310 HydrophobicContact CH2-CD2 4.47Å
85	D	95.3	Very high	89.8	Confident	78 Å²	78	63.7 Å²	63.7	42%	0.417	39%	0.391	S	S	.	.			trans	-109.3	-178.7	174.9	83.5	6.8	0	0	0	112.1	A87 D88 Y89	D85-A87 PolarHBondContact O-N 3.31Å; D85-A87 VanDerWaalsContact O-N 3.13Å; D85-A87 WeakPolarHBondContact OD1-CA 3.43Å; D85-A87 VanDerWaalsContact OD1-CB 3.3Å; D85-A87 WeakPolarHBondContact OD1-CB 3.43Å; D85-A87 PolarHBondContact OD1-N 3.02Å; D85-D88 PolarHBondContact O-N 3.37Å; D85-D88 PolarHBondContact OD1-N 2.82Å; D85-Y89 VanDerWaalsContact C-CD1 3.41Å; D85-Y89 WeakPolarHBondContact O-CD1 3.1Å; D85-Y89 WeakPolarHBondContact O-CE1 3.08Å; D85-Y89 PolarHBondContact O-N 3.13Å
86	V	94.3	Very high	89.5	Confident	52 Å²	52	67.8 Å²	67.8	32%	0.315	41%	0.413	S	S	.	.	H	α-helix	trans	-55.4	-32.1	-176.8	179.9	0	0	0	0	112.5	M69 D88 Y89 V90	M69-V86 HydrophobicContact CB-CG1 4.1Å; M69-V86 HydrophobicContact CB-CG2 4.47Å; M69-V86 VanDerWaalsContact O-CG2 3.28Å; M69-V86 WeakPolarHBondContact O-CG2 3.43Å; V86-D88 VanDerWaalsContact C-N 3.29Å; V86-D88 PolarHBondContact O-N 3.18Å; V86-Y89 WeakPolarHBondContact CG2-OH 3.45Å; V86-V90 HydrophobicContact CG1-CB 4.45Å; V86-V90 HydrophobicContact CG1-CG2 3.98Å; V86-V90 WeakPolarHBondContact O-CB 3.37Å; V86-V90 PolarHBondContact O-N 3.49Å
87	A	92.9	Very high	89.5	Confident	72 Å²	72	65.8 Å²	65.8	60%	0.595	41%	0.405	S	S	*	.	H	α-helix	trans	-74	-23.1	-179.9	0	0	0	0	0	112.5	D85	D85-A87 PolarHBondContact O-N 3.31Å; D85-A87 VanDerWaalsContact O-N 3.13Å; D85-A87 WeakPolarHBondContact OD1-CA 3.43Å; D85-A87 VanDerWaalsContact OD1-CB 3.3Å; D85-A87 WeakPolarHBondContact OD1-CB 3.43Å; D85-A87 PolarHBondContact OD1-N 3.02Å
88	D	93.9	Very high	90	Very high	45 Å²	45	64.9 Å²	64.9	24%	0.241	40%	0.401	C	S	.	.	H	α-helix	trans	-92.2	-36.6	-179.1	-65.9	-56.2	0	0	0	113.9	W84 D85 V86 F91 K297	W84-D88 HydrophobicContact CE3-CB 3.55Å; W84-D88 HydrophobicContact CZ3-CB 4.03Å; D85-D88 PolarHBondContact O-N 3.37Å; D85-D88 PolarHBondContact OD1-N 2.82Å; V86-D88 VanDerWaalsContact C-N 3.29Å; V86-D88 PolarHBondContact O-N 3.18Å; D88-F91 WeakPolarHBondContact O-CE2 3.35Å; D88-F91 WeakPolarHBondContact O-CZ 2.87Å; D88-K297 IonicContact OD1-NZ 3.67Å
89	Y	94.4	Very high	90.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-103.8	-7.3	-172.3	66.1	-113	0	0	0	114.8	M69 G71 W84 D85 V86 V101 M102 Y181	M69-Y89 HydrophobicContact CG-CE2 3.78Å; G71-Y89 VanDerWaalsContact C-OH 3.31Å; G71-Y89 WeakPolarHBondContact CA-OH 3.47Å; G71-Y89 PolarHBondContact N-OH 2.84Å; G71-Y89 WeakPolarHBondContact O-CE1 3.34Å; G71-Y89 PolarHBondContact O-OH 3.23Å; W84-Y89 HydrophobicContact CB-CD1 4.17Å; D85-Y89 VanDerWaalsContact C-CD1 3.41Å; D85-Y89 WeakPolarHBondContact O-CD1 3.1Å; D85-Y89 WeakPolarHBondContact O-CE1 3.08Å; D85-Y89 PolarHBondContact O-N 3.13Å; V86-Y89 WeakPolarHBondContact CG2-OH 3.45Å; Y89-V101 HydrophobicContact CD2-CG1 3.99Å; Y89-V101 HydrophobicContact CE2-CG1 4.42Å; Y89-V101 CarbonylContact O-C 3.57Å; Y89-V101 WeakPolarHBondContact O-CA 3.23Å; Y89-M102 PolarHBondContact O-N 2.7Å; Y89-Y181 HydrophobicContact CD1-CE2 4.01Å; Y89-Y181 HydrophobicContact CD2-CD2 4.37Å; Y89-Y181 HydrophobicContact CD2-CE2 4.11Å; Y89-Y181 HydrophobicContact CE1-CD2 4.27Å; Y89-Y181 AromaticContact CE1-CE2 3.6Å; Y89-Y181 HydrophobicContact CE1-CE2 3.6Å; Y89-Y181 AromaticContact CE2-CD2 3.7Å; Y89-Y181 HydrophobicContact CE2-CD2 3.7Å; Y89-Y181 AromaticContact CE2-CE2 3.72Å; Y89-Y181 HydrophobicContact CE2-CE2 3.72Å; Y89-Y181 HydrophobicContact CG-CE2 4.28Å; Y89-Y181 AromaticContact CZ-CD2 3.66Å; Y89-Y181 AromaticContact CZ-CE2 3.48Å; Y89-Y181 VanDerWaalsContact CZ-CE2 3.48Å
90	V	95.4	Very high	91.4	Very high	13 Å²	13	56.2 Å²	56.2	8%	0.079	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.5	179.5	-174.9	0	0	0	0	112.1	M69 V86 F99 V100	M69-V90 HydrophobicContact CB-CG2 3.86Å; M69-V90 HydrophobicContact CG-CG2 4.06Å; V86-V90 HydrophobicContact CG1-CB 4.45Å; V86-V90 HydrophobicContact CG1-CG2 3.98Å; V86-V90 WeakPolarHBondContact O-CB 3.37Å; V86-V90 PolarHBondContact O-N 3.49Å; V90-F99 HydrophobicContact CG1-CB 4.44Å; V90-F99 HydrophobicContact CG1-CD2 4.2Å; V90-V100 CarbonylContact C-O 3.46Å; V90-V100 WeakPolarHBondContact CA-O 3.34Å
91	F	93.6	Very high	91.9	Very high	41 Å²	41	53.4 Å²	53.4	18%	0.18	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.8	-177.3	-55.2	-89.2	0	0	0	112.6	D88 F99 V100 M102 F293 Y295 V312	D88-F91 WeakPolarHBondContact O-CE2 3.35Å; D88-F91 WeakPolarHBondContact O-CZ 2.87Å; F91-F99 CarbonylContact O-C 3.56Å; F91-F99 VanDerWaalsContact O-CA 3.27Å; F91-F99 WeakPolarHBondContact O-CA 3.36Å; F91-V100 HydrophobicContact CB-CB 4.39Å; F91-V100 PolarHBondContact N-O 2.88Å; F91-V100 PolarHBondContact O-N 3.03Å; F91-M102 HydrophobicContact CE2-CB 4.14Å; F91-F293 HydrophobicContact CB-CZ 4.11Å; F91-F293 HydrophobicContact CD1-CE2 4.44Å; F91-F293 HydrophobicContact CD1-CZ 4.18Å; F91-F293 HydrophobicContact CD2-CE1 4.47Å; F91-F293 AromaticContact CD2-CZ 3.72Å; F91-F293 HydrophobicContact CD2-CZ 3.72Å; F91-F293 HydrophobicContact CE2-CZ 4.14Å; F91-F293 HydrophobicContact CG-CE2 4.41Å; F91-F293 AromaticContact CG-CZ 3.73Å; F91-F293 HydrophobicContact CG-CZ 3.73Å; F91-Y295 HydrophobicContact CE1-CD1 4.37Å; F91-Y295 AromaticContact CE1-CE1 3.87Å; F91-Y295 HydrophobicContact CE1-CE1 3.87Å; F91-Y295 HydrophobicContact CE1-CE2 4.44Å; F91-Y295 AromaticContact CE1-CZ 3.9Å; F91-Y295 AromaticContact CZ-CE1 3.7Å; F91-Y295 HydrophobicContact CZ-CE1 3.7Å; F91-Y295 AromaticContact CZ-CZ 3.86Å; F91-V312 HydrophobicContact CE2-CG1 4.48Å
92	P	92.7	Very high	92	Very high	64 Å²	64	47 Å²	47	42%	0.416	28%	0.28	S	S	.	.	S	Bend	cis	-69.2	154.4	-16	31.7	-34.4	0	0	0	111	Q94	P92-Q94 PolarHBondContact O-N 3.33Å
93	S	85.3	Confident	92.2	Very high	95 Å²	95	44.8 Å²	44.8	66%	0.664	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.1	-178.7	56.5	0	0	0	0	114.7	G95	S93-G95 VanDerWaalsContact C-N 3.28Å; S93-G95 PolarHBondContact O-N 2.87Å
94	Q	83.3	Confident	92.2	Very high	180 Å²	180	40.4 Å²	40.4	84%	0.841	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.5	-175.3	-62.1	-178	25	0	0	113.7	P92	P92-Q94 PolarHBondContact O-N 3.33Å
95	G	75.1	Confident	92.1	Very high	13 Å²	13	40.1 Å²	40.1	13%	0.134	24%	0.239	C	C	.	.			trans	77.4	49.4	177.5	0	0	0	0	0	113.9	T67 S93	T67-G95 PolarHBondContact N-O 2.83Å; T67-G95 WeakPolarHBondContact OG1-CA 3.14Å; S93-G95 VanDerWaalsContact C-N 3.28Å; S93-G95 PolarHBondContact O-N 2.87Å
96	D	85.9	Confident	92.1	Very high	94 Å²	94	37.3 Å²	37.3	50%	0.503	22%	0.224	S	C	.	.			trans	-80.7	178.8	175.6	-158.9	-8.5	0	0	0	111.4	T67 S98	T67-D96 PolarHBondContact OG1-O 2.95Å; D96-S98 PolarHBondContact O-N 2.93Å
97	S	91.9	Very high	92	Very high	43 Å²	43	37.9 Å²	37.9	30%	0.301	22%	0.224	S	C	.	.	S	Bend	trans	-65.8	-19.8	172.9	59.7	0	0	0	0	113.4	V319	S97-V319 PolarHBondContact O-N 2.99Å
98	S	94.3	Very high	92.1	Very high	32 Å²	32	35.2 Å²	35.2	22%	0.224	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.6	176.9	-171	0	0	0	0	110.3	D96 R316 F317 D318	D96-S98 PolarHBondContact O-N 2.93Å; S98-R316 PolarHBondContact OG-NE 3.48Å; S98-R316 PolarHBondContact OG-NH2 3.01Å; S98-F317 WeakPolarHBondContact CA-O 3.44Å; S98-D318 VanDerWaalsContact CB-OD1 3.29Å; S98-D318 WeakPolarHBondContact CB-OD1 3.41Å; S98-D318 PolarHBondContact OG-OD1 3.13Å
99	F	94.9	Very high	92	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	160.5	179.9	63.9	-82.9	0	0	0	111.4	T67 M69 V90 F91 V101 L183 R316 F317 V319	T67-F99 HydrophobicContact CG2-CD1 4.17Å; T67-F99 HydrophobicContact CG2-CE1 3.71Å; M69-F99 HydrophobicContact CE-CE2 3.68Å; M69-F99 HydrophobicContact CE-CZ 4.33Å; V90-F99 HydrophobicContact CG1-CB 4.44Å; V90-F99 HydrophobicContact CG1-CD2 4.2Å; F91-F99 CarbonylContact O-C 3.56Å; F91-F99 VanDerWaalsContact O-CA 3.27Å; F91-F99 WeakPolarHBondContact O-CA 3.36Å; F99-V101 HydrophobicContact CD2-CG2 4.12Å; F99-V101 HydrophobicContact CE2-CG2 3.92Å; F99-L183 HydrophobicContact CE1-CD1 4.22Å; F99-L183 HydrophobicContact CE2-CD1 4.13Å; F99-L183 HydrophobicContact CZ-CD1 3.5Å; F99-L183 VanDerWaalsContact CZ-CD1 3.5Å; F99-L183 HydrophobicContact CZ-CD2 3.77Å; F99-L183 HydrophobicContact CZ-CG 4.28Å; F99-R316 CarbonylContact O-C 3.58Å; F99-R316 WeakPolarHBondContact O-CA 3.39Å; F99-F317 HydrophobicContact CD1-CB 4.42Å; F99-F317 HydrophobicContact CD2-CB 4.49Å; F99-F317 HydrophobicContact CD2-CD2 4.37Å; F99-F317 HydrophobicContact CE1-CB 3.82Å; F99-F317 HydrophobicContact CE2-CB 3.93Å; F99-F317 AromaticContact CE2-CD2 3.68Å; F99-F317 HydrophobicContact CE2-CD2 3.68Å; F99-F317 HydrophobicContact CE2-CG 4.12Å; F99-F317 HydrophobicContact CZ-CB 3.55Å; F99-F317 HydrophobicContact CZ-CD2 4.04Å; F99-F317 HydrophobicContact CZ-CG 4.01Å; F99-F317 PolarHBondContact N-O 3.38Å; F99-F317 PolarHBondContact O-N 3.35Å; F99-V319 HydrophobicContact CE1-CG2 4.34Å
100	V	95.4	Very high	92	Very high	9 Å²	9	40.1 Å²	40.1	6%	0.055	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.4	-178.7	-175.6	0	0	0	0	108.8	V90 F91 Y291 F293 I315 R316	V90-V100 CarbonylContact C-O 3.46Å; V90-V100 WeakPolarHBondContact CA-O 3.34Å; F91-V100 HydrophobicContact CB-CB 4.39Å; F91-V100 PolarHBondContact N-O 2.88Å; F91-V100 PolarHBondContact O-N 3.03Å; V100-Y291 HydrophobicContact CB-CE1 4.36Å; V100-Y291 HydrophobicContact CG1-CD1 4.28Å; V100-Y291 HydrophobicContact CG1-CE1 3.84Å; V100-Y291 HydrophobicContact CG2-CE1 3.55Å; V100-F293 HydrophobicContact CB-CE1 4.46Å; V100-F293 HydrophobicContact CG1-CE1 4.06Å; V100-I315 CarbonylContact C-O 3.56Å; V100-I315 WeakPolarHBondContact CA-O 3.27Å; V100-R316 HydrophobicContact CG2-CB 4.15Å; V100-R316 HydrophobicContact CG2-CG 4.25Å
101	V	95.9	Very high	92	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.4	169.4	-176.7	0	0	0	0	108.2	M69 Y89 F99 T103 L228 G314 I315 F317	M69-V101 HydrophobicContact CE-CG2 3.69Å; Y89-V101 HydrophobicContact CD2-CG1 3.99Å; Y89-V101 HydrophobicContact CE2-CG1 4.42Å; Y89-V101 CarbonylContact O-C 3.57Å; Y89-V101 WeakPolarHBondContact O-CA 3.23Å; F99-V101 HydrophobicContact CD2-CG2 4.12Å; F99-V101 HydrophobicContact CE2-CG2 3.92Å; V101-T103 PolarHBondContact O-N 2.82Å; V101-L228 HydrophobicContact CB-CD1 4.38Å; V101-L228 HydrophobicContact CG1-CD1 3.89Å; V101-L228 HydrophobicContact CG2-CD1 4.17Å; V101-G314 CarbonylContact O-C 3.56Å; V101-G314 WeakPolarHBondContact O-CA 3.41Å; V101-I315 PolarHBondContact N-O 2.91Å; V101-I315 PolarHBondContact O-N 2.85Å; V101-F317 HydrophobicContact CB-CE2 4.2Å; V101-F317 HydrophobicContact CG2-CD2 3.94Å; V101-F317 HydrophobicContact CG2-CE2 3.75Å
102	M	95.8	Very high	92.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	127.1	175.1	172.1	174.3	78.6	0	0	110.5	W84 Y89 F91 F105 L175 V312	W84-M102 HydrophobicContact CD2-CE 4.04Å; W84-M102 HydrophobicContact CE3-CE 3.31Å; W84-M102 HydrophobicContact CH2-CE 4.14Å; W84-M102 HydrophobicContact CZ3-CE 3.38Å; Y89-M102 PolarHBondContact O-N 2.7Å; F91-M102 HydrophobicContact CE2-CB 4.14Å; M102-F105 HydrophobicContact CE-CD1 4.03Å; M102-F105 HydrophobicContact CE-CE1 4.42Å; M102-F105 HydrophobicContact CG-CD1 4.26Å; M102-F105 HydrophobicContact SD-CB 3.92Å; M102-F105 HydrophobicContact SD-CD1 3.8Å; M102-F105 HydrophobicContact SD-CG 4.12Å; M102-L175 HydrophobicContact CE-CD1 3.74Å; M102-L175 HydrophobicContact CG-CD1 4.07Å; M102-V312 HydrophobicContact CB-CG1 3.69Å; M102-V312 HydrophobicContact CG-CG1 3.71Å; M102-V312 HydrophobicContact SD-CG1 4.06Å; M102-V312 HydrophobicContact SD-CG2 3.89Å
103	T	95.3	Very high	92.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-24.8	179.5	51.1	0	0	0	0	112.1	V101 L175 A178 F239 A243 F313 I315	V101-T103 PolarHBondContact O-N 2.82Å; T103-L175 WeakPolarHBondContact O-CB 3.22Å; T103-L175 PolarHBondContact O-N 2.84Å; T103-A178 HydrophobicContact CG2-CB 4.24Å; T103-F239 HydrophobicContact CG2-CZ 4.41Å; T103-A243 WeakPolarHBondContact CB-O 3.44Å; T103-A243 HydrophobicContact CG2-CB 4.21Å; T103-A243 WeakPolarHBondContact OG1-CA 3.29Å; T103-A243 PolarHBondContact OG1-O 3.5Å; T103-F313 PolarHBondContact N-O 2.81Å; T103-F313 PolarHBondContact OG1-O 3.46Å; T103-I315 HydrophobicContact CG2-CD1 4.02Å; T103-I315 HydrophobicContact CG2-CG1 4.02Å
104	N	95.1	Very high	92.7	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	155.4	176.1	-159.9	10.9	0	0	0	109.6	I169 P170 P173 L174 A243 F313	N104-I169 WeakPolarHBondContact ND2-CG2 3.21Å; N104-P170 PolarHBondContact ND2-O 3.26Å; N104-P173 HydrophobicContact CB-CB 4.33Å; N104-L174 WeakPolarHBondContact OD1-CG 3.25Å; N104-L174 PolarHBondContact OD1-N 2.99Å; N104-A243 WeakPolarHBondContact CB-O 3.37Å; N104-F313 HydrophobicContact CB-CB 4.09Å; N104-F313 PolarHBondContact N-O 3.37Å; N104-F313 VanDerWaalsContact N-O 3.1Å; N104-F313 CarbonylContact O-C 3.54Å; N104-F313 PolarHBondContact O-N 3.06Å
105	F	94.1	Very high	93.2	Very high	7 Å²	7	39 Å²	39	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	157.5	-178.9	59.4	-91.8	0	0	0	112.1	W84 M102 I107 L174 L175 K311	W84-F105 AromaticContact CE2-CE1 3.86Å; W84-F105 AromaticContact CE2-CZ 3.77Å; W84-F105 HydrophobicContact CH2-CE1 4.21Å; W84-F105 HydrophobicContact CH2-CE2 4.25Å; W84-F105 AromaticContact CH2-CZ 3.99Å; W84-F105 HydrophobicContact CH2-CZ 3.99Å; W84-F105 AromaticContact CZ2-CE1 3.66Å; W84-F105 HydrophobicContact CZ2-CE1 3.66Å; W84-F105 AromaticContact CZ2-CE2 3.83Å; W84-F105 HydrophobicContact CZ2-CE2 3.83Å; W84-F105 AromaticContact CZ2-CZ 3.25Å; W84-F105 HydrophobicContact CZ2-CZ 3.25Å; M102-F105 HydrophobicContact CE-CD1 4.03Å; M102-F105 HydrophobicContact CE-CE1 4.42Å; M102-F105 HydrophobicContact CG-CD1 4.26Å; M102-F105 HydrophobicContact SD-CB 3.92Å; M102-F105 HydrophobicContact SD-CD1 3.8Å; M102-F105 HydrophobicContact SD-CG 4.12Å; F105-I107 HydrophobicContact CD2-CB 4.31Å; F105-I107 HydrophobicContact CE2-CB 4.49Å; F105-I107 HydrophobicContact CE2-CG2 4.46Å; F105-L174 HydrophobicContact CD1-CD1 4.14Å; F105-L174 HydrophobicContact CD2-CD1 4.09Å; F105-L174 HydrophobicContact CE1-CB 4.14Å; F105-L174 HydrophobicContact CE1-CD1 3.86Å; F105-L174 HydrophobicContact CE2-CD1 3.81Å; F105-L174 HydrophobicContact CG-CD1 4.24Å; F105-L174 HydrophobicContact CZ-CD1 3.67Å; F105-L174 WeakPolarHBondContact O-CD1 3.46Å; F105-L175 HydrophobicContact CD1-CD1 4.19Å; F105-L175 HydrophobicContact CE1-CD1 4.03Å; F105-L175 HydrophobicContact CE1-CG 4.25Å; F105-K311 CarbonylContact C-O 3.51Å; F105-K311 VanDerWaalsContact CA-O 3.22Å; F105-K311 WeakPolarHBondContact CA-O 3.08Å
106	I	93.9	Very high	94.1	Very high	19 Å²	19	39.1 Å²	39.1	10%	0.097	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.1	166.6	-61.8	171.2	0	0	0	106.8	D166 L310 K311 F313	I106-D166 HydrophobicContact CD1-CB 4.37Å; I106-L310 WeakPolarHBondContact O-CA 3.37Å; I106-K311 HydrophobicContact CB-CB 4.32Å; I106-K311 HydrophobicContact CD1-CD 4.5Å; I106-K311 PolarHBondContact N-O 3.37Å; I106-K311 PolarHBondContact O-N 3.1Å; I106-F313 HydrophobicContact CD1-CE2 4.03Å; I106-F313 HydrophobicContact CD1-CZ 4.37Å; I106-F313 HydrophobicContact CG1-CE2 4.13Å
107	I	92.9	Very high	94.5	Very high	63 Å²	63	36.9 Å²	36.9	32%	0.323	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.4	-179.6	-167.5	166.5	0	0	0	109.9	F105 E109 T308 L310	F105-I107 HydrophobicContact CD2-CB 4.31Å; F105-I107 HydrophobicContact CE2-CB 4.49Å; F105-I107 HydrophobicContact CE2-CG2 4.46Å; I107-E109 HydrophobicContact CD1-CG 4.07Å; I107-E109 HydrophobicContact CG1-CG 3.92Å; I107-T308 HydrophobicContact CD1-CG2 3.8Å; I107-T308 HydrophobicContact CG1-CG2 3.6Å; I107-L310 HydrophobicContact CD1-CD2 4.36Å; I107-L310 HydrophobicContact CG1-CG 4.23Å
108	T	94.3	Very high	94.5	Very high	16 Å²	16	35.1 Å²	35.1	10%	0.098	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	100.6	172.5	-52.8	0	0	0	0	108.4	Q111 P162 T308 L309	T108-Q111 HydrophobicContact CG2-CG 3.83Å; T108-P162 HydrophobicContact CG2-CG 4.28Å; T108-T308 WeakPolarHBondContact O-CA 3.46Å; T108-L309 PolarHBondContact N-O 2.85Å; T108-L309 PolarHBondContact O-N 3.09Å
109	E	93.5	Very high	94.2	Very high	123 Å²	123	34.4 Å²	34.4	58%	0.575	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	160	-177	-58.6	-171.1	149.1	0	0	112.2	I107 Q111 T308	I107-E109 HydrophobicContact CD1-CG 4.07Å; I107-E109 HydrophobicContact CG1-CG 3.92Å; E109-Q111 PolarHBondContact O-N 2.52Å; E109-T308 HydrophobicContact CG-CG2 3.98Å
110	G	93.5	Very high	93.7	Very high	25 Å²	25	36.6 Å²	36.6	26%	0.258	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	66.4	19.6	171.2	0	0	0	0	0	115	K112 Y299	G110-K112 PolarHBondContact O-N 3.32Å; G110-Y299 WeakPolarHBondContact CA-OH 3.32Å; G110-Y299 PolarHBondContact N-OH 2.97Å
111	Q	96.2	Very high	92.9	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.014	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	127.2	179.2	-68.5	-164.5	-35.6	0	0	110.2	T108 E109 W160 C161 P162 K306 R307	T108-Q111 HydrophobicContact CG2-CG 3.83Å; E109-Q111 PolarHBondContact O-N 2.52Å; Q111-W160 HydrophobicContact CB-CB 4.14Å; Q111-W160 HydrophobicContact CB-CE3 4.13Å; Q111-W160 PolarHBondContact NE2-O 2.98Å; Q111-C161 CarbonylContact C-O 3.52Å; Q111-C161 VanDerWaalsContact CA-O 3.31Å; Q111-C161 WeakPolarHBondContact CA-O 3.22Å; Q111-P162 WeakPolarHBondContact CG-O 3.48Å; Q111-P162 PolarHBondContact NE2-O 2.87Å; Q111-K306 CarbonylContact O-C 3.57Å; Q111-K306 WeakPolarHBondContact O-CA 3.37Å; Q111-K306 WeakPolarHBondContact O-CB 3.43Å; Q111-R307 HydrophobicContact CB-CG 3.85Å; Q111-R307 WeakPolarHBondContact CB-O 3.32Å; Q111-R307 PolarHBondContact N-O 2.97Å; Q111-R307 PolarHBondContact O-N 3.12Å
112	K	95.8	Very high	92.2	Very high	104 Å²	104	41 Å²	41	45%	0.452	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153.2	172.6	66.5	-177.9	-179.7	-179	0	110	G110 G114 C161 I304 K306	G110-K112 PolarHBondContact O-N 3.32Å; K112-G114 PolarHBondContact O-N 3.1Å; K112-C161 PolarHBondContact N-O 2.99Å; K112-C161 PolarHBondContact O-N 2.82Å; K112-I304 HydrophobicContact CB-CG2 4.44Å; K112-K306 HydrophobicContact CB-CG 4.24Å
113	M	94.8	Very high	91.7	Very high	104 Å²	104	43 Å²	43	51%	0.512	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	125.7	174.5	-158.7	68.3	-160.5	0	0	109.6	L158 W160	M113-L158 HydrophobicContact CE-CD1 4.19Å; M113-L158 HydrophobicContact CE-CG 3.86Å; M113-W160 HydrophobicContact SD-CD2 4.48Å; M113-W160 HydrophobicContact SD-CG 4.49Å
114	G	94.8	Very high	91.4	Very high	21 Å²	21	47.9 Å²	47.9	22%	0.216	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	-172	-176.2	0	0	0	0	0	112.8	K112 L158 A159 C161	K112-G114 PolarHBondContact O-N 3.1Å; G114-L158 WeakPolarHBondContact O-CA 3.43Å; G114-A159 PolarHBondContact N-O 2.77Å; G114-A159 PolarHBondContact O-N 3.35Å; G114-A159 VanDerWaalsContact O-O 3.06Å; G114-C161 PolarHBondContact O-SG 3.39Å; G114-C161 VanDerWaalsContact O-SG 3.35Å
115	K	94.8	Very high	91.2	Very high	137 Å²	137	48.1 Å²	48.1	60%	0.596	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	129	176.2	-62.4	179.8	176.5	-172.4	0	109.6	T145 E156 V157 L158	K115-T145 HydrophobicContact CD-CG2 4.03Å; K115-T145 HydrophobicContact CG-CG2 4.11Å; K115-E156 HydrophobicContact CB-CG 4.01Å; K115-V157 WeakPolarHBondContact CA-O 3.49Å; K115-L158 HydrophobicContact CG-CD1 4.19Å
116	C	93.9	Very high	91	Very high	17 Å²	17	53.2 Å²	53.2	12%	0.115	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	156.9	176.3	53	0	0	0	0	110.5	V157 C161	C116-V157 PolarHBondContact N-O 3.25Å; C116-V157 VanDerWaalsContact N-O 3.1Å; C116-V157 WeakPolarHBondContact O-CG2 3.11Å; C116-V157 PolarHBondContact O-N 2.94Å; C116-C161 HydrophobicContact CB-CB 3.69Å; C116-C161 WeakPolarHBondContact CB-SG 3.05Å; C116-C161 PolarHBondContact N-SG 2.83Å; C116-C161 VanDerWaalsContact N-SG 3.37Å; C116-C161 VanDerWaalsContact SG-CA 3.58Å; C116-C161 WeakPolarHBondContact SG-CB 3.2Å; C116-C161 CovalentContact SG-SG 2.03Å; C116-C161 PolarHBondContact SG-SG 2.78Å
117	P	93.3	Very high	90.9	Very high	46 Å²	46	54.9 Å²	54.9	30%	0.299	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	140.8	172.1	24	-32.8	0	0	0	111.2	V149 T152 T154	P117-V149 HydrophobicContact CB-CB 4.08Å; P117-V149 HydrophobicContact CB-CG1 4.25Å; P117-V149 HydrophobicContact CB-CG2 3.97Å; P117-T152 HydrophobicContact CB-CG2 4.3Å; P117-T152 VanDerWaalsContact CB-OG1 3.26Å; P117-T152 WeakPolarHBondContact CB-OG1 3.36Å; P117-T152 HydrophobicContact CG-CG2 4.29Å; P117-T154 WeakPolarHBondContact CB-OG1 3.34Å
118	E	91.4	Very high	90.8	Very high	7 Å²	7	56.2 Å²	56.2	3%	0.033	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.1	160.9	170.1	-170.4	55.3	-80.1	0	0	111.1	K122 H123 H141 T154 C155 V157	E118-K122 HydrophobicContact CG-CB 4.08Å; E118-H123 HydrophobicContact CG-CB 4.15Å; E118-H141 IonicContact OE1-CE1 3.48Å; E118-H141 PolarHBondContact OE1-CE1 2.91Å; E118-H141 IonicContact OE1-CG 3.76Å; E118-H141 IonicContact OE1-ND1 2.67Å; E118-H141 PolarHBondContact OE1-ND1 2.83Å; E118-H141 PolarHBondContact OE2-N 2.82Å; E118-H141 IonicContact OE2-ND1 3.51Å; E118-T154 VanDerWaalsContact O-CB 3.23Å; E118-T154 WeakPolarHBondContact O-CB 3.42Å; E118-T154 WeakPolarHBondContact O-CG2 3.47Å; E118-T154 PolarHBondContact O-OG1 3.01Å; E118-C155 WeakPolarHBondContact CB-O 3.46Å; E118-C155 PolarHBondContact N-O 3.37Å; E118-V157 HydrophobicContact CB-CG1 4.15Å; E118-V157 HydrophobicContact CB-CG2 4.33Å
119	L	89.1	Confident	90.5	Very high	17 Å²	17	59.6 Å²	59.6	9%	0.089	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-63.1	142.7	175.1	-71.7	-175.8	0	0	0	112.5	G121 K122 V163 E164 D165	L119-G121 PolarHBondContact O-N 3.03Å; L119-K122 HydrophobicContact CB-CD 4.28Å; L119-K122 HydrophobicContact CB-CG 4.34Å; L119-K122 HydrophobicContact CD1-CD 4.29Å; L119-K122 PolarHBondContact O-N 2.57Å; L119-K122 VanDerWaalsContact O-N 3.14Å; L119-V163 HydrophobicContact CD2-CG2 3.95Å; L119-V163 HydrophobicContact CG-CG2 3.96Å; L119-E164 WeakPolarHBondContact CD1-O 3.17Å; L119-E164 WeakPolarHBondContact CG-O 3.36Å; L119-D165 HydrophobicContact CD2-CB 4.04Å
120	A	83.3	Confident	90.2	Very high	49 Å²	49	57.1 Å²	57.1	41%	0.405	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	131.1	172.1	0	0	0	0	0	111.2	T154	A120-T154 HydrophobicContact CB-CG2 4.48Å
121	G	79.1	Confident	90.1	Very high	62 Å²	62	56.2 Å²	56.2	64%	0.639	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	-19.6	-177.5	0	0	0	0	0	114.6	L119 N124	L119-G121 PolarHBondContact O-N 3.03Å; G121-N124 WeakPolarHBondContact CA-OD1 3.38Å; G121-N124 PolarHBondContact N-OD1 2.84Å
122	K	82.1	Confident	89.8	Confident	42 Å²	42	60.6 Å²	60.6	18%	0.183	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-45.4	175.4	-70.8	-167.7	178.2	-170.6	0	111.8	E118 L119 K137 T139 H141 D166	E118-K122 HydrophobicContact CG-CB 4.08Å; L119-K122 HydrophobicContact CB-CD 4.28Å; L119-K122 HydrophobicContact CB-CG 4.34Å; L119-K122 HydrophobicContact CD1-CD 4.29Å; L119-K122 PolarHBondContact O-N 2.57Å; L119-K122 VanDerWaalsContact O-N 3.14Å; K122-K137 PolarHBondContact O-NZ 2.77Å; K122-T139 WeakPolarHBondContact CD-O 3.28Å; K122-H141 PolarHBondContact NZ-CE1 2.79Å; K122-H141 PolarHBondContact NZ-NE2 3.47Å; K122-D166 IonicContact NZ-OD1 3.87Å; K122-D166 PolarHBondContact NZ-OD1 3.19Å
123	H	84.7	Confident	89.5	Confident	40 Å²	40	57.9 Å²	57.9	19%	0.185	36%	0.362	C	S	.	.	S	Bend	trans	-151.2	83	177.7	-162.8	23.3	0	0	0	111.3	E118 T154 C155	E118-H123 HydrophobicContact CG-CB 4.15Å; H123-T154 VanDerWaalsContact O-CA 3.3Å; H123-T154 WeakPolarHBondContact O-CA 3.33Å; H123-T154 WeakPolarHBondContact O-CB 3.48Å; H123-C155 VanDerWaalsContact CD2-CB 3.41Å; H123-C155 WeakPolarHBondContact CD2-CB 3.45Å; H123-C155 PolarHBondContact CD2-SG 2.91Å; H123-C155 PolarHBondContact NE2-SG 3.23Å; H123-C155 PolarHBondContact O-N 2.96Å; H123-C155 VanDerWaalsContact O-N 3.13Å
124	N	89.5	Confident	89.2	Confident	103 Å²	103	55 Å²	55	55%	0.551	36%	0.359	S	S	*	.	B	Isolated β-bridge	trans	-78.4	146.4	176.9	-62.2	-2.9	0	0	0	110.3	G121 Q153	G121-N124 WeakPolarHBondContact CA-OD1 3.38Å; G121-N124 PolarHBondContact N-OD1 2.84Å; N124-Q153 CarbonylContact C-O 3.58Å; N124-Q153 VanDerWaalsContact CA-O 3.28Å; N124-Q153 WeakPolarHBondContact CA-O 3.29Å
125	C	90.4	Very high	88.9	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.034	36%	0.364	C	S	.	.			trans	-140.8	153.2	176.2	59.2	0	0	0	0	110	D130 C131 C148 Q153 T154 C155	C125-D130 HydrophobicContact CB-CB 3.86Å; C125-C131 VanDerWaalsContact CB-SG 3.56Å; C125-C148 HydrophobicContact CB-CB 3.82Å; C125-C148 WeakPolarHBondContact CB-SG 3.21Å; C125-C148 PolarHBondContact O-SG 3.28Å; C125-C148 WeakPolarHBondContact SG-CA 3.27Å; C125-C148 WeakPolarHBondContact SG-CB 3.42Å; C125-C148 CovalentContact SG-SG 2.03Å; C125-C148 PolarHBondContact SG-SG 3.07Å; C125-Q153 PolarHBondContact N-O 3.36Å; C125-Q153 CarbonylContact O-C 3.53Å; C125-T154 PolarHBondContact SG-O 2.85Å; C125-C155 PolarHBondContact SG-N 2.79Å; C125-C155 VanDerWaalsContact SG-N 3.39Å
126	T	90.6	Very high	88.5	Confident	115 Å²	115	57.6 Å²	57.6	71%	0.706	37%	0.371	S	S	*	.	S	Bend	trans	-110.4	-28.9	171.8	57.4	0	0	0	0	111.5	D130	T126-D130 PolarHBondContact N-OD2 2.94Å; T126-D130 PolarHBondContact OG1-OD2 3.02Å
127	S	90.9	Very high	88	Confident	54 Å²	54	61.6 Å²	61.6	38%	0.378	39%	0.386	S	S	.	.	S	Bend	trans	-141.5	163	177.1	71.2	0	0	0	0	111.1	A129 D130	S127-A129 PolarHBondContact O-N 3.28Å; S127-A129 VanDerWaalsContact O-N 3.15Å; S127-D130 PolarHBondContact N-OD2 2.71Å; S127-D130 WeakPolarHBondContact O-CB 3.39Å; S127-D130 PolarHBondContact O-N 2.86Å
128	D	90.6	Very high	87.6	Confident	91 Å²	91	71.1 Å²	71.1	49%	0.487	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-58.6	-27	178.1	-66.7	-13.9	0	0	0	112.7	D130 C131 C148	D128-D130 PolarHBondContact O-N 2.87Å; D128-C131 PolarHBondContact O-N 2.81Å; D128-C131 VanDerWaalsContact O-N 3.09Å; D128-C148 WeakPolarHBondContact OD1-CB 3.36Å; D128-C148 PolarHBondContact OD1-N 3.29Å
129	A	87.9	Confident	87.2	Confident	86 Å²	86	74.5 Å²	74.5	71%	0.711	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-65	-23.6	177.5	0	0	0	0	0	113.5	S127 C131	S127-A129 PolarHBondContact O-N 3.28Å; S127-A129 VanDerWaalsContact O-N 3.15Å; A129-C131 PolarHBondContact O-N 2.83Å
130	D	88.4	Confident	87	Confident	72 Å²	72	74.8 Å²	74.8	39%	0.385	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-73.9	-19.9	177	-58.1	-35.8	0	0	0	111.8	C125 T126 S127 D128	C125-D130 HydrophobicContact CB-CB 3.86Å; T126-D130 PolarHBondContact N-OD2 2.94Å; T126-D130 PolarHBondContact OG1-OD2 3.02Å; S127-D130 PolarHBondContact N-OD2 2.71Å; S127-D130 WeakPolarHBondContact O-CB 3.39Å; S127-D130 PolarHBondContact O-N 2.86Å; D128-D130 PolarHBondContact O-N 2.87Å
131	C	90.1	Very high	87.4	Confident	6 Å²	6	75.5 Å²	75.5	4%	0.041	44%	0.439	C	S	.	.	S	Bend	trans	-100.6	101.6	-179.3	-54.4	0	0	0	0	108.9	C125 D128 A129 G133 G146 C155	C125-C131 VanDerWaalsContact CB-SG 3.56Å; D128-C131 PolarHBondContact O-N 2.81Å; D128-C131 VanDerWaalsContact O-N 3.09Å; A129-C131 PolarHBondContact O-N 2.83Å; C131-G133 PolarHBondContact O-N 3.02Å; C131-G146 WeakPolarHBondContact O-CA 3.49Å; C131-C155 VanDerWaalsContact CA-SG 3.57Å; C131-C155 HydrophobicContact CB-CB 3.88Å; C131-C155 WeakPolarHBondContact CB-SG 3.21Å; C131-C155 WeakPolarHBondContact SG-CA 3.28Å; C131-C155 WeakPolarHBondContact SG-CB 3.34Å; C131-C155 CovalentContact SG-SG 2.04Å; C131-C155 PolarHBondContact SG-SG 2.89Å
132	V	89.9	Confident	87.9	Confident	95 Å²	95	73.5 Å²	73.5	58%	0.576	42%	0.419	S	S	*	.			trans	-78	112.7	176.5	-178.4	0	0	0	0	109.2	S135 T144	V132-S135 WeakPolarHBondContact O-CB 3.46Å; V132-S135 PolarHBondContact O-N 2.95Å; V132-S135 PolarHBondContact O-OG 3.08Å; V132-T144 PolarHBondContact O-OG1 2.94Å
133	G	90.8	Very high	88.5	Confident	46 Å²	46	76 Å²	76	47%	0.474	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	137.2	178.3	0	0	0	0	0	112.6	C131 S135	C131-G133 PolarHBondContact O-N 3.02Å; G133-S135 PolarHBondContact O-N 2.8Å
134	G	87.6	Confident	88.9	Confident	43 Å²	43	74.3 Å²	74.3	44%	0.443	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-5.9	178.8	0	0	0	0	0	115.2	Q143 T144	G134-Q143 PolarHBondContact O-NE2 3.01Å; G134-T144 PolarHBondContact N-O 3.06Å
135	S	88.6	Confident	89	Confident	45 Å²	45	71.3 Å²	71.3	32%	0.315	41%	0.409	S	S	.	.			trans	-79.2	160.9	175.6	80.5	0	0	0	0	112.1	V132 G133 Q143 T144	V132-S135 WeakPolarHBondContact O-CB 3.46Å; V132-S135 PolarHBondContact O-N 2.95Å; V132-S135 PolarHBondContact O-OG 3.08Å; G133-S135 PolarHBondContact O-N 2.8Å; S135-Q143 CarbonylContact O-C 3.53Å; S135-Q143 WeakPolarHBondContact O-CA 3.34Å; S135-Q143 WeakPolarHBondContact O-CG 3.4Å; S135-T144 PolarHBondContact N-OG1 3.1Å; S135-T144 PolarHBondContact O-N 3.48Å; S135-T144 PolarHBondContact O-OG1 2.76Å; S135-T144 PolarHBondContact OG-OG1 2.85Å
136	F	86.4	Confident	89.1	Confident	169 Å²	169	72 Å²	72	74%	0.741	42%	0.417	S	S	*	.	B	Isolated β-bridge	trans	-135.5	143	171.2	68.3	-87.1	0	0	0	109.4
137	K	84.3	Confident	89.2	Confident	101 Å²	101	69.5 Å²	69.5	44%	0.439	40%	0.402	S	S	.	.			trans	-102.5	138.9	177	-169.6	173.3	-179.2	175.6	0	109.2	K122 T139 G140	K122-K137 PolarHBondContact O-NZ 2.77Å; K137-T139 WeakPolarHBondContact CE-OG1 3.25Å; K137-T139 PolarHBondContact O-N 3.21Å; K137-T139 VanDerWaalsContact O-N 3.1Å; K137-G140 PolarHBondContact O-N 2.94Å
138	R	83.8	Confident	89.3	Confident	246 Å²	246	67.4 Å²	67.4	93%	0.928	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.7	178.9	-165	-175.6	105.4	160.5	4.1	113.4
139	T	83.2	Confident	89.4	Confident	77 Å²	77	64.8 Å²	64.8	47%	0.472	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-3.9	179.3	58.5	0	0	0	0	113.6	K122 K137	K122-T139 WeakPolarHBondContact CD-O 3.28Å; K137-T139 WeakPolarHBondContact CE-OG1 3.25Å; K137-T139 PolarHBondContact O-N 3.21Å; K137-T139 VanDerWaalsContact O-N 3.1Å
140	G	85.5	Confident	89.4	Confident	24 Å²	24	67.2 Å²	67.2	25%	0.247	38%	0.375	C	S	.	.	S	Bend	trans	-84.9	164.7	178.3	0	0	0	0	0	112	K137	K137-G140 PolarHBondContact O-N 2.94Å
141	H	90.3	Very high	89.3	Confident	63 Å²	63	73.4 Å²	73.4	29%	0.292	40%	0.399	S	S	.	.	S	Bend	trans	-94.6	-11.4	-175.8	-56.8	106.2	0	0	0	113.9	E118 K122 V163	E118-H141 IonicContact OE1-CE1 3.48Å; E118-H141 PolarHBondContact OE1-CE1 2.91Å; E118-H141 IonicContact OE1-CG 3.76Å; E118-H141 IonicContact OE1-ND1 2.67Å; E118-H141 PolarHBondContact OE1-ND1 2.83Å; E118-H141 PolarHBondContact OE2-N 2.82Å; E118-H141 IonicContact OE2-ND1 3.51Å; K122-H141 PolarHBondContact NZ-CE1 2.79Å; K122-H141 PolarHBondContact NZ-NE2 3.47Å; H141-V163 HydrophobicContact CB-CG1 3.99Å
142	G	91.1	Very high	89.2	Confident	20 Å²	20	76.1 Å²	76.1	21%	0.206	42%	0.415	C	S	.	.	S	Bend	trans	-165.4	-168.6	-178	0	0	0	0	0	114.1
143	Q	93.3	Very high	89.2	Confident	94 Å²	94	77.5 Å²	77.5	44%	0.439	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	132.6	179.6	-174.1	178.7	39.5	0	0	110	G134 S135 V157 L158	G134-Q143 PolarHBondContact O-NE2 3.01Å; S135-Q143 CarbonylContact O-C 3.53Å; S135-Q143 WeakPolarHBondContact O-CA 3.34Å; S135-Q143 WeakPolarHBondContact O-CG 3.4Å; Q143-V157 CarbonylContact O-C 3.59Å; Q143-V157 VanDerWaalsContact O-CA 3.26Å; Q143-V157 WeakPolarHBondContact O-CA 3.48Å; Q143-L158 PolarHBondContact N-O 2.89Å; Q143-L158 PolarHBondContact O-N 3.37Å
144	T	92.9	Very high	89.3	Confident	6 Å²	6	75.3 Å²	75.3	4%	0.037	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.7	179.2	48	0	0	0	0	111.4	V132 G134 S135 C155 E156 V157	V132-T144 PolarHBondContact O-OG1 2.94Å; G134-T144 PolarHBondContact N-O 3.06Å; S135-T144 PolarHBondContact N-OG1 3.1Å; S135-T144 PolarHBondContact O-N 3.48Å; S135-T144 PolarHBondContact O-OG1 2.76Å; S135-T144 PolarHBondContact OG-OG1 2.85Å; T144-C155 HydrophobicContact CG2-CB 4.37Å; T144-E156 WeakPolarHBondContact CA-O 3.42Å; T144-V157 HydrophobicContact CG2-CG1 4.07Å
145	T	93.1	Very high	89.5	Confident	39 Å²	39	73.2 Å²	73.2	24%	0.239	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-19.7	178.4	62.8	0	0	0	0	112.7	K115 E156 L158	K115-T145 HydrophobicContact CD-CG2 4.03Å; K115-T145 HydrophobicContact CG-CG2 4.11Å; T145-E156 WeakPolarHBondContact CB-OE2 3.46Å; T145-E156 HydrophobicContact CG2-CG 4.14Å; T145-E156 WeakPolarHBondContact CG2-OE2 3.44Å; T145-E156 PolarHBondContact N-O 3.36Å; T145-E156 WeakPolarHBondContact OG1-CB 3.05Å; T145-E156 PolarHBondContact OG1-O 3.35Å; T145-E156 PolarHBondContact OG1-OE2 3.35Å; T145-L158 HydrophobicContact CG2-CB 4.36Å
146	G	91.5	Very high	89.8	Confident	19 Å²	19	73 Å²	73	20%	0.196	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	96.2	10.1	-177.3	0	0	0	0	0	114.7	C131	C131-G146 WeakPolarHBondContact O-CA 3.49Å
147	V	93.8	Very high	90.2	Very high	64 Å²	64	65 Å²	65	39%	0.388	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	135.4	178.4	-178.8	0	0	0	0	109.7	E156	V147-E156 HydrophobicContact CB-CB 4.34Å; V147-E156 PolarHBondContact O-N 2.96Å
148	C	92.8	Very high	90.7	Very high	9 Å²	9	63.3 Å²	63.3	6%	0.061	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.2	173	-174.9	0	0	0	0	110.5	C125 D128 N150	C125-C148 HydrophobicContact CB-CB 3.82Å; C125-C148 WeakPolarHBondContact CB-SG 3.21Å; C125-C148 PolarHBondContact O-SG 3.28Å; C125-C148 WeakPolarHBondContact SG-CA 3.27Å; C125-C148 WeakPolarHBondContact SG-CB 3.42Å; C125-C148 CovalentContact SG-SG 2.03Å; C125-C148 PolarHBondContact SG-SG 3.07Å; D128-C148 WeakPolarHBondContact OD1-CB 3.36Å; D128-C148 PolarHBondContact OD1-N 3.29Å; C148-N150 PolarHBondContact O-N 3.13Å
149	V	93	Very high	91.2	Very high	36 Å²	36	51.8 Å²	51.8	22%	0.218	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	107.1	-179.3	-177.6	0	0	0	0	109.8	P117 K151 T152 Q153 T154 E156	P117-V149 HydrophobicContact CB-CB 4.08Å; P117-V149 HydrophobicContact CB-CG1 4.25Å; P117-V149 HydrophobicContact CB-CG2 3.97Å; V149-K151 HydrophobicContact CG1-CB 4.49Å; V149-K151 PolarHBondContact O-N 3.24Å; V149-K151 VanDerWaalsContact O-N 3.1Å; V149-T152 PolarHBondContact O-N 3.45Å; V149-Q153 WeakPolarHBondContact O-CA 3.36Å; V149-Q153 PolarHBondContact O-N 3.26Å; V149-T154 PolarHBondContact N-O 2.72Å; V149-E156 HydrophobicContact CG2-CB 3.89Å
150	N	86.5	Confident	91.8	Very high	138 Å²	138	51.2 Å²	51.2	74%	0.738	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.2	-176.6	-82.3	-13	0	0	0	115.2	C148	C148-N150 PolarHBondContact O-N 3.13Å
151	K	87.4	Confident	92.2	Very high	202 Å²	202	50.7 Å²	50.7	88%	0.878	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-38.8	-178.2	-174.7	177.2	179.1	-178.8	0	112.8	V149	V149-K151 HydrophobicContact CG1-CB 4.49Å; V149-K151 PolarHBondContact O-N 3.24Å; V149-K151 VanDerWaalsContact O-N 3.1Å
152	T	86.7	Confident	92.4	Very high	62 Å²	62	51.1 Å²	51.1	38%	0.38	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-10.7	-177.3	50.6	0	0	0	0	112.5	P117 V149 T154	P117-T152 HydrophobicContact CB-CG2 4.3Å; P117-T152 VanDerWaalsContact CB-OG1 3.26Å; P117-T152 WeakPolarHBondContact CB-OG1 3.36Å; P117-T152 HydrophobicContact CG-CG2 4.29Å; V149-T152 PolarHBondContact O-N 3.45Å; T152-T154 WeakPolarHBondContact CB-OG1 3.5Å; T152-T154 PolarHBondContact O-N 2.96Å; T152-T154 PolarHBondContact OG1-OG1 2.87Å
153	Q	91.4	Very high	92.5	Very high	124 Å²	124	51.1 Å²	51.1	58%	0.579	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	39.4	-171.6	-62.5	-174.4	-47	0	0	111.9	N124 C125 V149	N124-Q153 CarbonylContact C-O 3.58Å; N124-Q153 VanDerWaalsContact CA-O 3.28Å; N124-Q153 WeakPolarHBondContact CA-O 3.29Å; C125-Q153 PolarHBondContact N-O 3.36Å; C125-Q153 CarbonylContact O-C 3.53Å; V149-Q153 WeakPolarHBondContact O-CA 3.36Å; V149-Q153 PolarHBondContact O-N 3.26Å
154	T	92.7	Very high	92.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	149.8	179.7	54	0	0	0	0	111	P117 E118 A120 H123 C125 V149 T152	P117-T154 WeakPolarHBondContact CB-OG1 3.34Å; E118-T154 VanDerWaalsContact O-CB 3.23Å; E118-T154 WeakPolarHBondContact O-CB 3.42Å; E118-T154 WeakPolarHBondContact O-CG2 3.47Å; E118-T154 PolarHBondContact O-OG1 3.01Å; A120-T154 HydrophobicContact CB-CG2 4.48Å; H123-T154 VanDerWaalsContact O-CA 3.3Å; H123-T154 WeakPolarHBondContact O-CA 3.33Å; H123-T154 WeakPolarHBondContact O-CB 3.48Å; C125-T154 PolarHBondContact SG-O 2.85Å; V149-T154 PolarHBondContact N-O 2.72Å; T152-T154 WeakPolarHBondContact CB-OG1 3.5Å; T152-T154 PolarHBondContact O-N 2.96Å; T152-T154 PolarHBondContact OG1-OG1 2.87Å
155	C	92.3	Very high	92.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	140.9	178.3	-66.7	0	0	0	0	110.7	E118 H123 C125 C131 T144	E118-C155 WeakPolarHBondContact CB-O 3.46Å; E118-C155 PolarHBondContact N-O 3.37Å; H123-C155 VanDerWaalsContact CD2-CB 3.41Å; H123-C155 WeakPolarHBondContact CD2-CB 3.45Å; H123-C155 PolarHBondContact CD2-SG 2.91Å; H123-C155 PolarHBondContact NE2-SG 3.23Å; H123-C155 PolarHBondContact O-N 2.96Å; H123-C155 VanDerWaalsContact O-N 3.13Å; C125-C155 PolarHBondContact SG-N 2.79Å; C125-C155 VanDerWaalsContact SG-N 3.39Å; C131-C155 VanDerWaalsContact CA-SG 3.57Å; C131-C155 HydrophobicContact CB-CB 3.88Å; C131-C155 WeakPolarHBondContact CB-SG 3.21Å; C131-C155 WeakPolarHBondContact SG-CA 3.28Å; C131-C155 WeakPolarHBondContact SG-CB 3.34Å; C131-C155 CovalentContact SG-SG 2.04Å; C131-C155 PolarHBondContact SG-SG 2.89Å; T144-C155 HydrophobicContact CG2-CB 4.37Å
156	E	94.3	Very high	91.9	Very high	40 Å²	40	49.2 Å²	49.2	19%	0.187	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.3	170.1	-176.4	-171.2	-118	0	0	110	K115 T144 T145 V147 V149	K115-E156 HydrophobicContact CB-CG 4.01Å; T144-E156 WeakPolarHBondContact CA-O 3.42Å; T145-E156 WeakPolarHBondContact CB-OE2 3.46Å; T145-E156 HydrophobicContact CG2-CG 4.14Å; T145-E156 WeakPolarHBondContact CG2-OE2 3.44Å; T145-E156 PolarHBondContact N-O 3.36Å; T145-E156 WeakPolarHBondContact OG1-CB 3.05Å; T145-E156 PolarHBondContact OG1-O 3.35Å; T145-E156 PolarHBondContact OG1-OE2 3.35Å; V147-E156 HydrophobicContact CB-CB 4.34Å; V147-E156 PolarHBondContact O-N 2.96Å; V149-E156 HydrophobicContact CG2-CB 3.89Å
157	V	94.6	Very high	91.6	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.8	179	-65.9	0	0	0	0	111	K115 C116 E118 Q143 T144 A159 V163	K115-V157 WeakPolarHBondContact CA-O 3.49Å; C116-V157 PolarHBondContact N-O 3.25Å; C116-V157 VanDerWaalsContact N-O 3.1Å; C116-V157 WeakPolarHBondContact O-CG2 3.11Å; C116-V157 PolarHBondContact O-N 2.94Å; E118-V157 HydrophobicContact CB-CG1 4.15Å; E118-V157 HydrophobicContact CB-CG2 4.33Å; Q143-V157 CarbonylContact O-C 3.59Å; Q143-V157 VanDerWaalsContact O-CA 3.26Å; Q143-V157 WeakPolarHBondContact O-CA 3.48Å; T144-V157 HydrophobicContact CG2-CG1 4.07Å; V157-A159 HydrophobicContact CG2-CB 4Å; V157-A159 PolarHBondContact O-N 2.87Å; V157-V163 HydrophobicContact CG2-CG1 4.38Å
158	L	94.8	Very high	91.2	Very high	66 Å²	66	57.6 Å²	57.6	35%	0.346	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	103.1	165.3	-178.7	64.8	0	0	0	107.9	M113 G114 K115 Q143 T145	M113-L158 HydrophobicContact CE-CD1 4.19Å; M113-L158 HydrophobicContact CE-CG 3.86Å; G114-L158 WeakPolarHBondContact O-CA 3.43Å; K115-L158 HydrophobicContact CG-CD1 4.19Å; Q143-L158 PolarHBondContact N-O 2.89Å; Q143-L158 PolarHBondContact O-N 3.37Å; T145-L158 HydrophobicContact CG2-CB 4.36Å
159	A	94.7	Very high	90.9	Very high	4 Å²	4	59.9 Å²	59.9	3%	0.033	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	-175	-172.1	0	0	0	0	0	111.6	G114 V157 C161 V163	G114-A159 PolarHBondContact N-O 2.77Å; G114-A159 PolarHBondContact O-N 3.35Å; G114-A159 VanDerWaalsContact O-O 3.06Å; V157-A159 HydrophobicContact CG2-CB 4Å; V157-A159 PolarHBondContact O-N 2.87Å; A159-C161 PolarHBondContact O-N 2.77Å; A159-V163 HydrophobicContact CB-CG1 4.45Å
160	W	95.4	Very high	90.8	Very high	64 Å²	64	59.8 Å²	59.8	24%	0.242	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	107.2	164.3	-73.1	94.3	0	0	0	109	Q111 M113 P162 Y298 R307	Q111-W160 HydrophobicContact CB-CB 4.14Å; Q111-W160 HydrophobicContact CB-CE3 4.13Å; Q111-W160 PolarHBondContact NE2-O 2.98Å; M113-W160 HydrophobicContact SD-CD2 4.48Å; M113-W160 HydrophobicContact SD-CG 4.49Å; W160-P162 CarbonylContact O-C 3.49Å; W160-Y298 HydrophobicContact CH2-CD1 4.38Å; W160-Y298 HydrophobicContact CH2-CE1 4.04Å; W160-Y298 AromaticContact CZ2-CE1 3.94Å; W160-Y298 HydrophobicContact CZ2-CE1 3.94Å; W160-R307 VanDerWaalsContact CD1-NH2 3.27Å; W160-R307 HydrophobicContact CD2-CG 4.09Å; W160-R307 HydrophobicContact CE3-CG 3.66Å; W160-R307 VanDerWaalsContact CG-NE 3.3Å; W160-R307 VanDerWaalsContact CG-NH2 3.3Å; W160-R307 HydrophobicContact CH2-CG 4.47Å; W160-R307 HydrophobicContact CZ3-CB 4.29Å; W160-R307 HydrophobicContact CZ3-CG 3.88Å
161	C	94.6	Very high	90.9	Very high	13 Å²	13	58.3 Å²	58.3	9%	0.088	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137	-171.9	-67.7	0	0	0	0	111.4	Q111 K112 G114 C116 A159	Q111-C161 CarbonylContact C-O 3.52Å; Q111-C161 VanDerWaalsContact CA-O 3.31Å; Q111-C161 WeakPolarHBondContact CA-O 3.22Å; K112-C161 PolarHBondContact N-O 2.99Å; K112-C161 PolarHBondContact O-N 2.82Å; G114-C161 PolarHBondContact O-SG 3.39Å; G114-C161 VanDerWaalsContact O-SG 3.35Å; C116-C161 HydrophobicContact CB-CB 3.69Å; C116-C161 WeakPolarHBondContact CB-SG 3.05Å; C116-C161 PolarHBondContact N-SG 2.83Å; C116-C161 VanDerWaalsContact N-SG 3.37Å; C116-C161 VanDerWaalsContact SG-CA 3.58Å; C116-C161 WeakPolarHBondContact SG-CB 3.2Å; C116-C161 CovalentContact SG-SG 2.03Å; C116-C161 PolarHBondContact SG-SG 2.78Å; A159-C161 PolarHBondContact O-N 2.77Å
162	P	94.4	Very high	91	Very high	73 Å²	73	53.1 Å²	53.1	47%	0.474	28%	0.281	S	S	.	.	S	Bend	cis	-71.1	149.3	0.1	30.4	-35.1	0	0	0	112.7	T108 Q111 W160	T108-P162 HydrophobicContact CG2-CG 4.28Å; Q111-P162 WeakPolarHBondContact CG-O 3.48Å; Q111-P162 PolarHBondContact NE2-O 2.87Å; W160-P162 CarbonylContact O-C 3.49Å
163	V	93.2	Very high	91.3	Very high	20 Å²	20	50.4 Å²	50.4	12%	0.121	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-65.6	149.6	175.3	-67.2	0	0	0	0	110.7	L119 H141 V157 A159	L119-V163 HydrophobicContact CD2-CG2 3.95Å; L119-V163 HydrophobicContact CG-CG2 3.96Å; H141-V163 HydrophobicContact CB-CG1 3.99Å; V157-V163 HydrophobicContact CG2-CG1 4.38Å; A159-V163 HydrophobicContact CB-CG1 4.45Å
164	E	92.7	Very high	91.4	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.014	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-60.1	136.2	174.6	-176.8	-169.4	120	0	0	109.9	L119 D166 R294 L309 K311	L119-E164 WeakPolarHBondContact CD1-O 3.17Å; L119-E164 WeakPolarHBondContact CG-O 3.36Å; E164-D166 WeakPolarHBondContact OE1-CB 3.38Å; E164-R294 VanDerWaalsContact CD-NE 3.34Å; E164-R294 IonicContact OE1-CZ 2.99Å; E164-R294 IonicContact OE1-NE 3.03Å; E164-R294 PolarHBondContact OE1-NE 2.84Å; E164-R294 IonicContact OE1-NH2 3.5Å; E164-R294 PolarHBondContact OE1-NH2 2.98Å; E164-R294 WeakPolarHBondContact OE2-CD 3.42Å; E164-R294 IonicContact OE2-CZ 2.84Å; E164-R294 IonicContact OE2-NE 2.8Å; E164-R294 PolarHBondContact OE2-NE 2.91Å; E164-R294 IonicContact OE2-NH2 3.7Å; E164-L309 HydrophobicContact CB-CD2 4.03Å; E164-L309 HydrophobicContact CG-CD2 4.48Å; E164-L309 WeakPolarHBondContact OE2-CD2 3.44Å; E164-K311 WeakPolarHBondContact OE1-CD 3.47Å
165	D	89.1	Confident	91.4	Very high	57 Å²	57	46.9 Å²	46.9	31%	0.305	25%	0.249	S	C	.	.			trans	-103	105	170	-168.9	-6.9	0	0	0	110.2	L119 R167	L119-D165 HydrophobicContact CD2-CB 4.04Å; D165-R167 WeakPolarHBondContact OD1-CB 3.29Å; D165-R167 WeakPolarHBondContact OD1-CG 3.31Å; D165-R167 IonicContact OD1-CZ 3.56Å; D165-R167 PolarHBondContact OD1-N 3.11Å; D165-R167 IonicContact OD1-NE 2.9Å; D165-R167 PolarHBondContact OD1-NE 2.91Å; D165-R167 IonicContact OD1-NH2 2.75Å; D165-R167 IonicContact OD2-CZ 3.66Å; D165-R167 IonicContact OD2-NE 2.76Å; D165-R167 PolarHBondContact OD2-NE 2.93Å; D165-R167 IonicContact OD2-NH2 3.82Å; D165-R167 PolarHBondContact OD2-NH2 3.14Å
166	D	84.9	Confident	91.5	Very high	39 Å²	39	49.9 Å²	49.9	21%	0.209	26%	0.264	C	S	.	.			trans	-106.3	16.9	-178.5	71.6	-23.3	0	0	0	114.7	I106 K122 E164 R294 K311	I106-D166 HydrophobicContact CD1-CB 4.37Å; K122-D166 IonicContact NZ-OD1 3.87Å; K122-D166 PolarHBondContact NZ-OD1 3.19Å; E164-D166 WeakPolarHBondContact OE1-CB 3.38Å; D166-R294 IonicContact OD2-NH2 3.93Å; D166-R294 PolarHBondContact OD2-NH2 2.93Å; D166-K311 HydrophobicContact CB-CD 4.33Å; D166-K311 IonicContact OD2-NZ 3.37Å; D166-K311 PolarHBondContact OD2-NZ 3Å
167	R	84.2	Confident	91.4	Very high	153 Å²	153	49.9 Å²	49.9	58%	0.577	27%	0.268	S	S	*	.	S	Bend	trans	-71.2	-33.1	-179.1	-65.9	177.4	-67.5	172.4	1.4	113.1	D165	D165-R167 WeakPolarHBondContact OD1-CB 3.29Å; D165-R167 WeakPolarHBondContact OD1-CG 3.31Å; D165-R167 IonicContact OD1-CZ 3.56Å; D165-R167 PolarHBondContact OD1-N 3.11Å; D165-R167 IonicContact OD1-NE 2.9Å; D165-R167 PolarHBondContact OD1-NE 2.91Å; D165-R167 IonicContact OD1-NH2 2.75Å; D165-R167 IonicContact OD2-CZ 3.66Å; D165-R167 IonicContact OD2-NE 2.76Å; D165-R167 PolarHBondContact OD2-NE 2.93Å; D165-R167 IonicContact OD2-NH2 3.82Å; D165-R167 PolarHBondContact OD2-NH2 3.14Å
168	T	84.9	Confident	91.5	Very high	106 Å²	106	49.8 Å²	49.8	65%	0.65	27%	0.268	S	S	*	.			trans	-121.3	109.1	-178.8	53.6	0	0	0	0	109.8
169	I	87.6	Confident	91.5	Very high	56 Å²	56	50.3 Å²	50.3	29%	0.287	27%	0.268	S	S	.	.			trans	-77.3	129.8	169	-59.1	174.6	0	0	0	107.4	N104 N171 Q244 F313	N104-I169 WeakPolarHBondContact ND2-CG2 3.21Å; I169-N171 PolarHBondContact O-N 3.18Å; I169-Q244 HydrophobicContact CG2-CG 4.25Å; I169-F313 HydrophobicContact CD1-CE1 3.82Å; I169-F313 HydrophobicContact CD1-CZ 3.86Å; I169-F313 HydrophobicContact CG1-CE1 4.38Å; I169-F313 HydrophobicContact CG1-CE2 4.49Å; I169-F313 HydrophobicContact CG1-CZ 3.91Å; I169-F313 HydrophobicContact CG2-CE2 4.35Å; I169-F313 HydrophobicContact CG2-CZ 4.41Å
170	P	90	Very high	91.6	Very high	35 Å²	35	54.8 Å²	54.8	23%	0.227	29%	0.292	C	S	.	.			trans	-53.4	128.7	177.4	-26.1	34.1	0	0	0	111.8	N104 P172 L174	N104-P170 PolarHBondContact ND2-O 3.26Å; P170-P172 CarbonylContact C-O 3.45Å; P170-L174 HydrophobicContact CB-CD1 4.4Å; P170-L174 HydrophobicContact CB-CD2 4.13Å; P170-L174 HydrophobicContact CB-CG 3.96Å; P170-L174 HydrophobicContact CG-CD1 4.18Å; P170-L174 HydrophobicContact CG-CG 4.29Å
171	N	88.8	Confident	91.6	Very high	107 Å²	107	52 Å²	52	57%	0.572	28%	0.282	S	S	*	.	S	Bend	trans	-139.2	115.6	176.5	-172.8	10	0	0	0	108.5	I169	I169-N171 PolarHBondContact O-N 3.18Å
172	P	90.3	Very high	91.7	Very high	92 Å²	92	53.4 Å²	53.4	60%	0.597	29%	0.29	S	S	*	.	S	Bend	cis	-67	161.8	6.7	29	-36.5	0	0	0	114	P170	P170-P172 CarbonylContact C-O 3.45Å
173	P	91.9	Very high	91.8	Very high	6 Å²	6	50 Å²	50	4%	0.039	27%	0.267	C	S	.	.			trans	-56.1	141.9	174.7	-23.5	33.5	0	0	0	112.2	N104 L175 M176 A243 Q244	N104-P173 HydrophobicContact CB-CB 4.33Å; P173-L175 PolarHBondContact O-N 3.08Å; P173-M176 HydrophobicContact CB-CG 4.35Å; P173-M176 HydrophobicContact CB-SD 3.89Å; P173-M176 HydrophobicContact CG-SD 3.81Å; P173-M176 WeakPolarHBondContact O-CG 3.41Å; P173-A243 HydrophobicContact CB-CB 3.95Å; P173-A243 HydrophobicContact CG-CB 3.85Å; P173-Q244 HydrophobicContact CG-CB 3.99Å
174	L	93.1	Very high	91.9	Very high	49 Å²	49	51.4 Å²	51.4	26%	0.257	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-37.3	-175	-65	175.9	0	0	0	113.5	T75 V77 N104 F105 P170	T75-L174 HydrophobicContact CG2-CB 4.31Å; V77-L174 HydrophobicContact CG2-CD1 4.28Å; V77-L174 HydrophobicContact CG2-CD2 3.94Å; N104-L174 WeakPolarHBondContact OD1-CG 3.25Å; N104-L174 PolarHBondContact OD1-N 2.99Å; F105-L174 HydrophobicContact CD1-CD1 4.14Å; F105-L174 HydrophobicContact CD2-CD1 4.09Å; F105-L174 HydrophobicContact CE1-CB 4.14Å; F105-L174 HydrophobicContact CE1-CD1 3.86Å; F105-L174 HydrophobicContact CE2-CD1 3.81Å; F105-L174 HydrophobicContact CG-CD1 4.24Å; F105-L174 HydrophobicContact CZ-CD1 3.67Å; F105-L174 WeakPolarHBondContact O-CD1 3.46Å; P170-L174 HydrophobicContact CB-CD1 4.4Å; P170-L174 HydrophobicContact CB-CD2 4.13Å; P170-L174 HydrophobicContact CB-CG 3.96Å; P170-L174 HydrophobicContact CG-CD1 4.18Å; P170-L174 HydrophobicContact CG-CG 4.29Å
175	L	94.3	Very high	92.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	57.1	-175.9	-66.8	165.5	0	0	0	112	T75 W84 M102 T103 F105 P173 S177 A178	T75-L175 HydrophobicContact CG2-CD2 3.67Å; T75-L175 HydrophobicContact CG2-CG 4.22Å; W84-L175 HydrophobicContact CB-CD2 4.18Å; W84-L175 HydrophobicContact CG-CD1 4.49Å; W84-L175 HydrophobicContact CG-CD2 3.93Å; M102-L175 HydrophobicContact CE-CD1 3.74Å; M102-L175 HydrophobicContact CG-CD1 4.07Å; T103-L175 WeakPolarHBondContact O-CB 3.22Å; T103-L175 PolarHBondContact O-N 2.84Å; F105-L175 HydrophobicContact CD1-CD1 4.19Å; F105-L175 HydrophobicContact CE1-CD1 4.03Å; F105-L175 HydrophobicContact CE1-CG 4.25Å; P173-L175 PolarHBondContact O-N 3.08Å; L175-S177 PolarHBondContact O-N 3.34Å; L175-A178 WeakPolarHBondContact O-CB 3.43Å; L175-A178 PolarHBondContact O-N 2.92Å; L175-A178 VanDerWaalsContact O-N 3.08Å
176	M	92.8	Very high	92.3	Very high	63 Å²	63	53 Å²	53	31%	0.31	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-61.9	-23	173.4	-73.9	-59.3	-64.1	0	0	113.2	P173 A178 E179 F239 E240 A243	P173-M176 HydrophobicContact CB-CG 4.35Å; P173-M176 HydrophobicContact CB-SD 3.89Å; P173-M176 HydrophobicContact CG-SD 3.81Å; P173-M176 WeakPolarHBondContact O-CG 3.41Å; M176-A178 PolarHBondContact O-N 2.98Å; M176-A178 VanDerWaalsContact O-N 3.08Å; M176-E179 PolarHBondContact O-N 3.31Å; M176-F239 HydrophobicContact CE-CD1 4.06Å; M176-F239 HydrophobicContact CE-CE1 4.43Å; M176-F239 HydrophobicContact SD-CD1 4.44Å; M176-F239 HydrophobicContact SD-CE1 4.41Å; M176-E240 HydrophobicContact CE-CB 4.49Å; M176-A243 HydrophobicContact SD-CB 4.45Å
177	S	93.8	Very high	92.9	Very high	40 Å²	40	51.1 Å²	51.1	28%	0.28	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-57.1	-22.5	172.8	57.1	0	0	0	0	113.3	G73 L175 E179 N180 Y181	G73-S177 WeakPolarHBondContact CA-OG 3.35Å; L175-S177 PolarHBondContact O-N 3.34Å; S177-E179 PolarHBondContact O-N 3.49Å; S177-E179 VanDerWaalsContact O-N 3.14Å; S177-N180 PolarHBondContact O-N 2.94Å; S177-Y181 WeakPolarHBondContact O-CD1 3.48Å; S177-Y181 VanDerWaalsContact O-CE1 3.27Å; S177-Y181 WeakPolarHBondContact O-CE1 3.33Å; S177-Y181 PolarHBondContact OG-OH 3.22Å
178	A	95.3	Very high	93.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-59.3	-23	178.3	0	0	0	0	0	113.3	T103 L175 M176 N180 Y181 L228 F239	T103-A178 HydrophobicContact CG2-CB 4.24Å; L175-A178 WeakPolarHBondContact O-CB 3.43Å; L175-A178 PolarHBondContact O-N 2.92Å; L175-A178 VanDerWaalsContact O-N 3.08Å; M176-A178 PolarHBondContact O-N 2.98Å; M176-A178 VanDerWaalsContact O-N 3.08Å; A178-N180 PolarHBondContact O-N 3.27Å; A178-Y181 HydrophobicContact CB-CD2 3.89Å; A178-Y181 HydrophobicContact CB-CE2 3.74Å; A178-Y181 HydrophobicContact CB-CG 4.46Å; A178-Y181 WeakPolarHBondContact O-CB 3.3Å; A178-Y181 PolarHBondContact O-N 2.8Å; A178-Y181 VanDerWaalsContact O-N 3.11Å; A178-L228 WeakPolarHBondContact O-CB 3.37Å; A178-F239 HydrophobicContact CB-CZ 3.97Å
179	E	95.7	Very high	93.9	Very high	76 Å²	76	40.7 Å²	40.7	36%	0.355	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-58.4	-30.7	173.9	-167.8	176.6	-172.6	0	0	112.2	M176 S177 K227 G229 F239	M176-E179 PolarHBondContact O-N 3.31Å; S177-E179 PolarHBondContact O-N 3.49Å; S177-E179 VanDerWaalsContact O-N 3.14Å; E179-K227 WeakPolarHBondContact O-CE 3.46Å; E179-K227 WeakPolarHBondContact O-CG 3.4Å; E179-G229 PolarHBondContact O-N 3.02Å; E179-F239 VanDerWaalsContact CA-CZ 3.49Å; E179-F239 HydrophobicContact CB-CD1 3.9Å; E179-F239 HydrophobicContact CB-CD2 4.19Å; E179-F239 HydrophobicContact CB-CE1 3.73Å; E179-F239 HydrophobicContact CB-CE2 4.04Å; E179-F239 HydrophobicContact CB-CG 4.15Å; E179-F239 HydrophobicContact CB-CZ 3.81Å; E179-F239 HydrophobicContact CG-CD1 4.18Å; E179-F239 HydrophobicContact CG-CD2 4.06Å; E179-F239 HydrophobicContact CG-CE1 4.46Å; E179-F239 HydrophobicContact CG-CE2 4.36Å; E179-F239 HydrophobicContact CG-CG 3.99Å
180	N	96.1	Very high	94.4	Very high	99 Å²	99	40.3 Å²	40.3	53%	0.529	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-95.4	3.7	-179	-65	-49.5	0	0	0	114	S177 A178 K227	S177-N180 PolarHBondContact O-N 2.94Å; A178-N180 PolarHBondContact O-N 3.27Å; N180-K227 WeakPolarHBondContact OD1-CE 3.42Å; N180-K227 PolarHBondContact OD1-NZ 3.41Å
181	Y	96.5	Very high	94.7	Very high	5 Å²	5	38.6 Å²	38.6	2%	0.02	21%	0.211	C	C	.	.			trans	-72.4	154	176.7	-63.7	-4.2	0	0	0	110.8	K70 V72 G73 Y89 S177 A178 K227 L228	K70-Y181 WeakPolarHBondContact O-CA 3.39Å; V72-Y181 WeakPolarHBondContact O-CE1 3.5Å; G73-Y181 WeakPolarHBondContact CA-OH 3.42Å; G73-Y181 PolarHBondContact N-OH 2.94Å; Y89-Y181 HydrophobicContact CD1-CE2 4.01Å; Y89-Y181 HydrophobicContact CD2-CD2 4.37Å; Y89-Y181 HydrophobicContact CD2-CE2 4.11Å; Y89-Y181 HydrophobicContact CE1-CD2 4.27Å; Y89-Y181 AromaticContact CE1-CE2 3.6Å; Y89-Y181 HydrophobicContact CE1-CE2 3.6Å; Y89-Y181 AromaticContact CE2-CD2 3.7Å; Y89-Y181 HydrophobicContact CE2-CD2 3.7Å; Y89-Y181 AromaticContact CE2-CE2 3.72Å; Y89-Y181 HydrophobicContact CE2-CE2 3.72Å; Y89-Y181 HydrophobicContact CG-CE2 4.28Å; Y89-Y181 AromaticContact CZ-CD2 3.66Å; Y89-Y181 AromaticContact CZ-CE2 3.48Å; Y89-Y181 VanDerWaalsContact CZ-CE2 3.48Å; S177-Y181 WeakPolarHBondContact O-CD1 3.48Å; S177-Y181 VanDerWaalsContact O-CE1 3.27Å; S177-Y181 WeakPolarHBondContact O-CE1 3.33Å; S177-Y181 PolarHBondContact OG-OH 3.22Å; A178-Y181 HydrophobicContact CB-CD2 3.89Å; A178-Y181 HydrophobicContact CB-CE2 3.74Å; A178-Y181 HydrophobicContact CB-CG 4.46Å; A178-Y181 WeakPolarHBondContact O-CB 3.3Å; A178-Y181 PolarHBondContact O-N 2.8Å; A178-Y181 VanDerWaalsContact O-N 3.11Å; Y181-K227 WeakPolarHBondContact O-CA 3.44Å; Y181-L228 PolarHBondContact O-N 2.83Å
182	T	96.6	Very high	95	Very high	43 Å²	43	37.3 Å²	37.3	26%	0.264	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.9	-177	53.3	0	0	0	0	110.6	M69 K70 I225 F226	M69-T182 CarbonylContact C-O 3.52Å; M69-T182 WeakPolarHBondContact CA-O 3.27Å; M69-T182 VanDerWaalsContact SD-C 3.57Å; K70-T182 PolarHBondContact N-O 3.38Å; K70-T182 PolarHBondContact O-N 3.19Å; K70-T182 PolarHBondContact O-OG1 3.02Å; T182-I225 HydrophobicContact CG2-CG2 4.22Å; T182-F226 CarbonylContact C-O 3.59Å; T182-F226 VanDerWaalsContact CA-O 3.3Å; T182-F226 WeakPolarHBondContact CA-O 3.44Å
183	L	96.4	Very high	95.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.1	175.6	172.6	63	0	0	0	108.8	T67 M69 F99 I185 I225 F226 L228 I231 I251	T67-L183 HydrophobicContact CG2-CD1 4.49Å; M69-L183 HydrophobicContact CE-CB 3.88Å; M69-L183 HydrophobicContact CE-CD1 3.74Å; M69-L183 HydrophobicContact CE-CG 4.3Å; M69-L183 HydrophobicContact SD-CB 4.09Å; F99-L183 HydrophobicContact CE1-CD1 4.22Å; F99-L183 HydrophobicContact CE2-CD1 4.13Å; F99-L183 HydrophobicContact CZ-CD1 3.5Å; F99-L183 VanDerWaalsContact CZ-CD1 3.5Å; F99-L183 HydrophobicContact CZ-CD2 3.77Å; F99-L183 HydrophobicContact CZ-CG 4.28Å; L183-I185 HydrophobicContact CD1-CG1 4.34Å; L183-I185 HydrophobicContact CD2-CD1 3.89Å; L183-I185 HydrophobicContact CD2-CG1 3.96Å; L183-I185 HydrophobicContact CG-CD1 4.32Å; L183-I185 HydrophobicContact CG-CG1 3.84Å; L183-I225 CarbonylContact O-C 3.57Å; L183-I225 WeakPolarHBondContact O-CA 3.48Å; L183-F226 HydrophobicContact CB-CB 4.49Å; L183-F226 PolarHBondContact N-O 2.97Å; L183-F226 PolarHBondContact O-N 3.38Å; L183-L228 HydrophobicContact CB-CD2 4.16Å; L183-I231 HydrophobicContact CD2-CD1 3.97Å; L183-I251 HydrophobicContact CD2-CD1 3.66Å
184	F	95.3	Very high	95.2	Very high	50 Å²	50	39 Å²	39	22%	0.219	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.3	167.8	175	-107.5	0	0	0	109.6	T67 K68 K186 L201 I210 P224 I225	T67-F184 WeakPolarHBondContact CA-O 3.41Å; K68-F184 HydrophobicContact CB-CB 4.39Å; K68-F184 HydrophobicContact CB-CD1 4.31Å; K68-F184 PolarHBondContact N-O 3.35Å; K68-F184 PolarHBondContact O-N 2.7Å; F184-K186 HydrophobicContact CE1-CB 3.83Å; F184-K186 HydrophobicContact CZ-CB 4.13Å; F184-L201 HydrophobicContact CE2-CD2 4.37Å; F184-L201 HydrophobicContact CZ-CD2 4.38Å; F184-I210 HydrophobicContact CE2-CG2 4.41Å; F184-P224 WeakPolarHBondContact CA-O 3.25Å; F184-P224 HydrophobicContact CD2-CB 4.1Å; F184-P224 HydrophobicContact CD2-CG 4.01Å; F184-P224 HydrophobicContact CE2-CB 3.89Å; F184-P224 HydrophobicContact CE2-CG 3.6Å; F184-I225 HydrophobicContact CB-CG1 4.49Å; F184-I225 HydrophobicContact CD2-CG1 3.85Å
185	I	96.1	Very high	95.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.6	175.5	-54.5	179.9	0	0	0	108.2	V65 L183 N200 P224 F226 I251 V319	V65-I185 HydrophobicContact CG1-CG2 4.24Å; L183-I185 HydrophobicContact CD1-CG1 4.34Å; L183-I185 HydrophobicContact CD2-CD1 3.89Å; L183-I185 HydrophobicContact CD2-CG1 3.96Å; L183-I185 HydrophobicContact CG-CD1 4.32Å; L183-I185 HydrophobicContact CG-CG1 3.84Å; I185-N200 PolarHBondContact O-ND2 2.81Å; I185-P224 PolarHBondContact N-O 2.88Å; I185-P224 WeakPolarHBondContact O-CB 3.28Å; I185-F226 HydrophobicContact CB-CE2 4.17Å; I185-F226 HydrophobicContact CD1-CD2 3.95Å; I185-F226 HydrophobicContact CD1-CE2 3.78Å; I185-F226 HydrophobicContact CG1-CD2 4.06Å; I185-F226 HydrophobicContact CG1-CE2 3.97Å; I185-I251 HydrophobicContact CD1-CD1 4.02Å; I185-I251 HydrophobicContact CD1-CG2 3.91Å; I185-V319 HydrophobicContact CD1-CG2 4.23Å; I185-V319 HydrophobicContact CG2-CG1 4.28Å
186	K	94.6	Very high	95.2	Very high	93 Å²	93	40.9 Å²	40.9	40%	0.404	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.4	167.4	-179.9	-179.1	-179.8	-177.7	0	108.1	F66 F184 L201	F66-K186 HydrophobicContact CB-CB 4.3Å; F66-K186 PolarHBondContact N-O 3.14Å; F66-K186 PolarHBondContact O-N 3Å; F184-K186 HydrophobicContact CE1-CB 3.83Å; F184-K186 HydrophobicContact CZ-CB 4.13Å; K186-L201 HydrophobicContact CG-CD1 4.49Å
187	N	96.1	Very high	95.3	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.6	179.9	172.8	-119.4	0	0	0	110.2	S64 S199 N200 W255 V321	S64-N187 WeakPolarHBondContact O-CA 3.28Å; S64-N187 PolarHBondContact O-ND2 3.03Å; N187-S199 CarbonylContact O-C 3.58Å; N187-S199 VanDerWaalsContact O-CA 3.31Å; N187-S199 WeakPolarHBondContact O-CA 3.34Å; N187-N200 HydrophobicContact CB-CB 4.48Å; N187-N200 PolarHBondContact N-OD1 3.24Å; N187-N200 PolarHBondContact O-N 3.12Å; N187-N200 PolarHBondContact O-OD1 3.33Å; N187-W255 PolarHBondContact OD1-NE1 3.43Å; N187-V321 WeakPolarHBondContact ND2-CG2 3.19Å
188	S	95	Very high	95.4	Very high	40 Å²	40	41.1 Å²	41.1	28%	0.28	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.8	171.9	-174	0	0	0	0	110	S63 S64 R198	S63-S188 CarbonylContact C-O 3.55Å; S63-S188 WeakPolarHBondContact CA-O 3.47Å; S64-S188 PolarHBondContact N-O 2.8Å; S64-S188 PolarHBondContact O-N 2.75Å; S188-R198 CarbonylContact C-O 3.58Å; S188-R198 VanDerWaalsContact CA-O 3.29Å; S188-R198 WeakPolarHBondContact CA-O 3.37Å; S188-R198 PolarHBondContact OG-O 3.47Å
189	V	96.4	Very high	95.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	136.3	179.5	-65.6	0	0	0	0	109.2	A61 V62 F191 T197 R198 W255 V321	A61-V189 HydrophobicContact CB-CB 3.77Å; A61-V189 HydrophobicContact CB-CG1 4.3Å; V62-V189 WeakPolarHBondContact O-CA 3.43Å; V189-F191 HydrophobicContact CG2-CE2 4.09Å; V189-T197 CarbonylContact O-C 3.59Å; V189-T197 WeakPolarHBondContact O-CA 3.46Å; V189-R198 HydrophobicContact CG2-CB 3.88Å; V189-R198 PolarHBondContact N-O 3.27Å; V189-R198 PolarHBondContact O-N 2.98Å; V189-W255 HydrophobicContact CG1-CD2 4.43Å; V189-W255 HydrophobicContact CG1-CG 4.06Å; V189-W255 HydrophobicContact CG2-CD2 3.68Å; V189-W255 HydrophobicContact CG2-CE3 4.06Å; V189-W255 HydrophobicContact CG2-CG 3.93Å; V189-W255 HydrophobicContact CG2-CZ2 4.23Å; V189-W255 HydrophobicContact CG2-CZ3 4.49Å; V189-V321 HydrophobicContact CG1-CG1 3.81Å
190	T	96.6	Very high	95.1	Very high	48 Å²	48	39.1 Å²	39.1	29%	0.294	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.7	173.8	-62	0	0	0	0	108.8	A61 V62 P192 V196 T197	A61-T190 CarbonylContact C-O 3.54Å; A61-T190 VanDerWaalsContact CA-O 3.22Å; A61-T190 WeakPolarHBondContact CA-O 3.27Å; A61-T190 WeakPolarHBondContact CB-O 3.39Å; V62-T190 PolarHBondContact N-O 3.45Å; V62-T190 PolarHBondContact O-N 2.85Å; T190-P192 VanDerWaalsContact O-CD 3.25Å; T190-P192 WeakPolarHBondContact O-CD 3.1Å; T190-V196 WeakPolarHBondContact CA-O 3.42Å; T190-T197 WeakPolarHBondContact CG2-OG1 3.49Å; T190-T197 WeakPolarHBondContact OG1-CG2 3.26Å; T190-T197 PolarHBondContact OG1-OG1 3.39Å
191	F	96.6	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	93.9	172.5	-63.8	-80.8	0	0	0	108.1	D59 A61 V189 L193 F194 G195 V196 W255 F259 A325	D59-F191 HydrophobicContact CB-CD1 4.31Å; D59-F191 VanDerWaalsContact OD2-CA 3.25Å; D59-F191 WeakPolarHBondContact OD2-CA 3.33Å; D59-F191 WeakPolarHBondContact OD2-CB 3.48Å; A61-F191 HydrophobicContact CB-CD1 3.75Å; A61-F191 HydrophobicContact CB-CD2 4.42Å; A61-F191 HydrophobicContact CB-CE1 3.56Å; A61-F191 HydrophobicContact CB-CE2 4.24Å; A61-F191 HydrophobicContact CB-CG 4.21Å; A61-F191 HydrophobicContact CB-CZ 3.83Å; V189-F191 HydrophobicContact CG2-CE2 4.09Å; F191-L193 VanDerWaalsContact C-N 3.3Å; F191-L193 PolarHBondContact O-N 3.45Å; F191-F194 HydrophobicContact CB-CD2 4.17Å; F191-F194 PolarHBondContact O-N 3.16Å; F191-G195 PolarHBondContact O-N 3.4Å; F191-V196 PolarHBondContact N-O 3.04Å; F191-V196 PolarHBondContact O-N 3.43Å; F191-W255 HydrophobicContact CZ-CB 4.38Å; F191-F259 HydrophobicContact CB-CE2 4.25Å; F191-F259 AromaticContact CD2-CE2 3.69Å; F191-F259 HydrophobicContact CD2-CE2 3.69Å; F191-F259 AromaticContact CD2-CZ 3.61Å; F191-F259 HydrophobicContact CD2-CZ 3.61Å; F191-F259 HydrophobicContact CE2-CE2 4.16Å; F191-F259 AromaticContact CE2-CZ 3.78Å; F191-F259 HydrophobicContact CE2-CZ 3.78Å; F191-F259 AromaticContact CG-CE2 3.95Å; F191-F259 HydrophobicContact CG-CE2 3.95Å; F191-F259 HydrophobicContact CG-CZ 4.33Å; F191-A325 HydrophobicContact CD1-CB 3.32Å; F191-A325 HydrophobicContact CD2-CB 4.23Å; F191-A325 HydrophobicContact CE1-CB 3.28Å; F191-A325 HydrophobicContact CE2-CB 4.21Å; F191-A325 HydrophobicContact CG-CB 3.8Å; F191-A325 HydrophobicContact CZ-CB 3.75Å
192	P	95.3	Very high	94.2	Very high	79 Å²	79	37 Å²	37	51%	0.513	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-32.9	-169.6	-20.1	35.2	0	0	0	112.8	D59 V62 T190 F194 G195	D59-P192 VanDerWaalsContact OD2-CD 3.28Å; D59-P192 WeakPolarHBondContact OD2-CD 3.29Å; D59-P192 VanDerWaalsContact OD2-N 3.1Å; V62-P192 HydrophobicContact CG2-CG 4.14Å; T190-P192 VanDerWaalsContact O-CD 3.25Å; T190-P192 WeakPolarHBondContact O-CD 3.1Å; P192-F194 PolarHBondContact O-N 3.15Å; P192-G195 PolarHBondContact O-N 3.13Å
193	L	94	Very high	93.5	Very high	105 Å²	105	39.9 Å²	39.9	55%	0.55	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-34.5	179.9	-173.1	63.5	0	0	0	111.4	D59 F191	D59-L193 HydrophobicContact CB-CB 3.86Å; D59-L193 HydrophobicContact CB-CD2 4.17Å; D59-L193 WeakPolarHBondContact OD2-CB 3.24Å; D59-L193 PolarHBondContact OD2-N 2.76Å; F191-L193 VanDerWaalsContact C-N 3.3Å; F191-L193 PolarHBondContact O-N 3.45Å
194	F	93.3	Very high	92.5	Very high	29 Å²	29	43.2 Å²	43.2	13%	0.127	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.6	-178.3	-52.6	-42	0	0	0	113.6	S57 D59 F191 P192 V196 F259 A325 K327	S57-F194 WeakPolarHBondContact O-CZ 3.34Å; D59-F194 HydrophobicContact CB-CD2 3.79Å; D59-F194 HydrophobicContact CB-CE2 3.33Å; D59-F194 HydrophobicContact CB-CZ 3.79Å; F191-F194 HydrophobicContact CB-CD2 4.17Å; F191-F194 PolarHBondContact O-N 3.16Å; P192-F194 PolarHBondContact O-N 3.15Å; F194-V196 VanDerWaalsContact C-N 3.28Å; F194-V196 HydrophobicContact CB-CG2 4.14Å; F194-V196 PolarHBondContact O-N 3.27Å; F194-F259 HydrophobicContact CB-CD2 4.35Å; F194-F259 AromaticContact CD2-CD2 3.6Å; F194-F259 HydrophobicContact CD2-CD2 3.6Å; F194-F259 AromaticContact CD2-CE2 3.86Å; F194-F259 HydrophobicContact CD2-CE2 3.86Å; F194-F259 HydrophobicContact CE2-CD2 4.25Å; F194-F259 HydrophobicContact CG-CD2 4.23Å; F194-A325 HydrophobicContact CD2-CB 3.92Å; F194-A325 HydrophobicContact CE2-CB 3.7Å; F194-K327 HydrophobicContact CB-CD 4.37Å; F194-K327 HydrophobicContact CD1-CB 3.89Å; F194-K327 HydrophobicContact CD1-CD 3.84Å; F194-K327 HydrophobicContact CD2-CB 4.41Å; F194-K327 HydrophobicContact CE1-CB 3.65Å; F194-K327 HydrophobicContact CE1-CD 4.4Å; F194-K327 HydrophobicContact CE2-CB 4.17Å; F194-K327 HydrophobicContact CG-CB 4.27Å; F194-K327 HydrophobicContact CG-CD 4.13Å; F194-K327 HydrophobicContact CZ-CB 3.8Å
195	G	93.6	Very high	92	Very high	66 Å²	66	42 Å²	42	68%	0.68	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	28.9	-176.4	0	0	0	0	0	113.5	F191 P192	F191-G195 PolarHBondContact O-N 3.4Å; P192-G195 PolarHBondContact O-N 3.13Å
196	V	94.2	Very high	91.6	Very high	22 Å²	22	45.6 Å²	45.6	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.7	-176.4	179.1	0	0	0	0	110.2	T190 F191 F194 R198 F259 V263	T190-V196 WeakPolarHBondContact CA-O 3.42Å; F191-V196 PolarHBondContact N-O 3.04Å; F191-V196 PolarHBondContact O-N 3.43Å; F194-V196 VanDerWaalsContact C-N 3.28Å; F194-V196 HydrophobicContact CB-CG2 4.14Å; F194-V196 PolarHBondContact O-N 3.27Å; V196-R198 HydrophobicContact CG1-CG 4.23Å; V196-F259 HydrophobicContact CB-CE2 4.16Å; V196-F259 HydrophobicContact CB-CZ 4.12Å; V196-F259 HydrophobicContact CG1-CE1 4.01Å; V196-F259 HydrophobicContact CG1-CE2 4.3Å; V196-F259 HydrophobicContact CG1-CZ 3.75Å; V196-F259 HydrophobicContact CG2-CE2 4.37Å; V196-V263 HydrophobicContact CG1-CG1 3.82Å; V196-V263 HydrophobicContact CG1-CG2 4.49Å
197	T	94.4	Very high	91.1	Very high	86 Å²	86	44 Å²	44	53%	0.528	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132.2	171.2	-59.7	0	0	0	0	110.1	V189 T190	V189-T197 CarbonylContact O-C 3.59Å; V189-T197 WeakPolarHBondContact O-CA 3.46Å; T190-T197 WeakPolarHBondContact CG2-OG1 3.49Å; T190-T197 WeakPolarHBondContact OG1-CG2 3.26Å; T190-T197 PolarHBondContact OG1-OG1 3.39Å
198	R	94.4	Very high	90.7	Very high	23 Å²	23	50.1 Å²	50.1	9%	0.087	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	159.4	174.3	-66.9	-66.2	-76.6	168.4	-3.8	111	S188 V189 V196 E203 W255 V263 C266	S188-R198 CarbonylContact C-O 3.58Å; S188-R198 VanDerWaalsContact CA-O 3.29Å; S188-R198 WeakPolarHBondContact CA-O 3.37Å; S188-R198 PolarHBondContact OG-O 3.47Å; V189-R198 HydrophobicContact CG2-CB 3.88Å; V189-R198 PolarHBondContact N-O 3.27Å; V189-R198 PolarHBondContact O-N 2.98Å; V196-R198 HydrophobicContact CG1-CG 4.23Å; R198-E203 IonicContact CZ-OE1 2.68Å; R198-E203 IonicContact CZ-OE2 3.7Å; R198-E203 IonicContact NH1-OE1 3.49Å; R198-E203 PolarHBondContact NH1-OE1 3.41Å; R198-E203 IonicContact NH1-OE2 2.72Å; R198-E203 PolarHBondContact NH1-OE2 2.86Å; R198-E203 IonicContact NH2-OE1 2.88Å; R198-E203 IonicContact NH2-OE2 3.78Å; R198-E203 PolarHBondContact NH2-OE2 2.78Å; R198-W255 HydrophobicContact CB-CE3 4.45Å; R198-W255 HydrophobicContact CB-CH2 3.98Å; R198-W255 HydrophobicContact CB-CZ3 3.8Å; R198-W255 HydrophobicContact CG-CZ3 4.4Å; R198-V263 HydrophobicContact CG-CG1 4.36Å; R198-C266 PolarHBondContact NE-O 3.14Å; R198-C266 PolarHBondContact NH2-O 3.29Å; R198-C266 VanDerWaalsContact NH2-O 3.12Å
199	S	93.5	Very high	90.4	Very high	33 Å²	33	51.6 Å²	51.6	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.4	174.7	175.5	0	0	0	0	107.9	N187 L201 V202 W255	N187-S199 CarbonylContact O-C 3.58Å; N187-S199 VanDerWaalsContact O-CA 3.31Å; N187-S199 WeakPolarHBondContact O-CA 3.34Å; S199-L201 PolarHBondContact O-N 2.97Å; S199-L201 PolarHBondContact OG-N 3.42Å; S199-V202 WeakPolarHBondContact O-CG1 3.32Å; S199-W255 WeakPolarHBondContact O-CH2 3.3Å
200	N	92.3	Very high	90.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.333	C	S	.	.	S	Bend	trans	-65.2	-17.9	175.6	70.5	-31.9	0	0	0	113.1	I185 N187 V202 W255 P268 Y270	I185-N200 PolarHBondContact O-ND2 2.81Å; N187-N200 HydrophobicContact CB-CB 4.48Å; N187-N200 PolarHBondContact N-OD1 3.24Å; N187-N200 PolarHBondContact O-N 3.12Å; N187-N200 PolarHBondContact O-OD1 3.33Å; N200-V202 PolarHBondContact O-N 3.22Å; N200-W255 HydrophobicContact CB-CZ2 4.1Å; N200-P268 HydrophobicContact CB-CG 3.88Å; N200-Y270 WeakPolarHBondContact CB-OH 3.06Å; N200-Y270 PolarHBondContact ND2-OH 3.41Å
201	L	90.3	Very high	89.6	Confident	53 Å²	53	54 Å²	54	28%	0.277	35%	0.348	S	S	.	.	S	Bend	trans	-76	72.1	164.7	-51.6	-179.4	0	0	0	109.3	F184 K186 S199 I205 I210 P224	F184-L201 HydrophobicContact CE2-CD2 4.37Å; F184-L201 HydrophobicContact CZ-CD2 4.38Å; K186-L201 HydrophobicContact CG-CD1 4.49Å; S199-L201 PolarHBondContact O-N 2.97Å; S199-L201 PolarHBondContact OG-N 3.42Å; L201-I205 HydrophobicContact CD2-CG2 4.06Å; L201-I210 HydrophobicContact CD2-CD1 4.02Å; L201-P224 HydrophobicContact CD2-CB 4.31Å; L201-P224 HydrophobicContact CD2-CG 3.82Å
202	V	83.6	Confident	89.3	Confident	6 Å²	6	61 Å²	61	4%	0.036	39%	0.385	C	S	.	.			trans	-72.8	171.8	-178.3	-62.7	0	0	0	0	112.1	S199 N200 G204 I205 L222 K267	S199-V202 WeakPolarHBondContact O-CG1 3.32Å; N200-V202 PolarHBondContact O-N 3.22Å; V202-G204 PolarHBondContact O-N 3.44Å; V202-I205 HydrophobicContact CG2-CD1 3.76Å; V202-I205 HydrophobicContact CG2-CG1 4.02Å; V202-I205 PolarHBondContact O-N 3Å; V202-L222 HydrophobicContact CG2-CD1 4.15Å; V202-K267 HydrophobicContact CG1-CG 4.37Å
203	E	80.9	Confident	89.3	Confident	104 Å²	104	57.6 Å²	57.6	49%	0.486	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	121	178.3	-60.3	81.8	178	0	0	111	R198	R198-E203 IonicContact CZ-OE1 2.68Å; R198-E203 IonicContact CZ-OE2 3.7Å; R198-E203 IonicContact NH1-OE1 3.49Å; R198-E203 PolarHBondContact NH1-OE1 3.41Å; R198-E203 IonicContact NH1-OE2 2.72Å; R198-E203 PolarHBondContact NH1-OE2 2.86Å; R198-E203 IonicContact NH2-OE1 2.88Å; R198-E203 IonicContact NH2-OE2 3.78Å; R198-E203 PolarHBondContact NH2-OE2 2.78Å
204	G	76.4	Confident	89.3	Confident	70 Å²	70	55.8 Å²	55.8	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.5	-4.5	-177.8	0	0	0	0	0	115.1	V202 D206	V202-G204 PolarHBondContact O-N 3.44Å; G204-D206 PolarHBondContact O-N 2.96Å
205	I	85.1	Confident	89.4	Confident	24 Å²	24	55.1 Å²	55.1	12%	0.123	35%	0.35	C	S	.	.			trans	-92.3	90.2	168.5	-57.4	-172.8	0	0	0	108.2	L201 V202 Y209 I210 L222	L201-I205 HydrophobicContact CD2-CG2 4.06Å; V202-I205 HydrophobicContact CG2-CD1 3.76Å; V202-I205 HydrophobicContact CG2-CG1 4.02Å; V202-I205 PolarHBondContact O-N 3Å; I205-Y209 HydrophobicContact CG1-CD1 4.43Å; I205-Y209 HydrophobicContact CG1-CE1 4.48Å; I205-Y209 HydrophobicContact CG2-CD1 4.02Å; I205-I210 HydrophobicContact CG2-CD1 3.88Å; I205-I210 HydrophobicContact CG2-CG1 3.63Å; I205-L222 HydrophobicContact CD1-CB 4.04Å; I205-L222 WeakPolarHBondContact CD1-O 3.3Å
206	D	85.9	Confident	89.5	Confident	76 Å²	76	55 Å²	55	41%	0.406	33%	0.334	S	S	.	.			trans	-96.7	174.8	177	72.7	-20.2	0	0	0	112.1	G204 N208 Y209 I210	G204-D206 PolarHBondContact O-N 2.96Å; D206-N208 PolarHBondContact O-N 2.95Å; D206-N208 PolarHBondContact OD2-ND2 2.93Å; D206-Y209 PolarHBondContact O-N 2.98Å; D206-Y209 WeakPolarHBondContact OD1-CB 3.44Å; D206-Y209 PolarHBondContact OD1-N 2.78Å; D206-I210 VanDerWaalsContact O-CG1 3.3Å; D206-I210 WeakPolarHBondContact O-CG1 3.47Å; D206-I210 PolarHBondContact O-N 3.49Å
207	G	85.3	Confident	89.4	Confident	61 Å²	61	57.1 Å²	57.1	63%	0.629	35%	0.348	S	S	*	.	H	α-helix	trans	-60.5	-30.9	179.1	0	0	0	0	0	113.3	G211	G207-G211 PolarHBondContact O-N 2.86Å
208	N	87.4	Confident	89.3	Confident	127 Å²	127	62.2 Å²	62.2	68%	0.679	36%	0.363	S	S	*	.	H	α-helix	trans	-70.3	-46	177.3	-60.4	-37.2	0	0	0	111	D206 I210 G211	D206-N208 PolarHBondContact O-N 2.95Å; D206-N208 PolarHBondContact OD2-ND2 2.93Å; N208-I210 VanDerWaalsContact C-N 3.34Å; N208-I210 PolarHBondContact O-N 2.82Å; N208-G211 PolarHBondContact O-N 2.92Å; N208-G211 VanDerWaalsContact O-N 3.14Å
209	Y	89.2	Confident	89.2	Confident	72 Å²	72	68.8 Å²	68.8	28%	0.282	40%	0.395	S	S	.	.	H	α-helix	trans	-60	-45.1	174.4	-176.7	-93.5	0	0	0	111.3	I205 D206 G211 D212 C213 C223	I205-Y209 HydrophobicContact CG1-CD1 4.43Å; I205-Y209 HydrophobicContact CG1-CE1 4.48Å; I205-Y209 HydrophobicContact CG2-CD1 4.02Å; D206-Y209 PolarHBondContact O-N 2.98Å; D206-Y209 WeakPolarHBondContact OD1-CB 3.44Å; D206-Y209 PolarHBondContact OD1-N 2.78Å; Y209-G211 PolarHBondContact O-N 2.87Å; Y209-D212 PolarHBondContact O-N 2.78Å; Y209-C213 HydrophobicContact CD1-CB 3.8Å; Y209-C213 HydrophobicContact CE1-CB 3.48Å; Y209-C213 VanDerWaalsContact CE1-CB 3.48Å; Y209-C213 VanDerWaalsContact CE1-SG 3.53Å; Y209-C213 HydrophobicContact CE2-CB 4.28Å; Y209-C213 HydrophobicContact CG-CB 4.33Å; Y209-C213 WeakPolarHBondContact O-CB 3.5Å; Y209-C213 PolarHBondContact O-N 3.04Å; Y209-C223 HydrophobicContact CE1-CB 4.13Å
210	I	89.3	Confident	89.2	Confident	41 Å²	41	71 Å²	71	21%	0.21	40%	0.4	C	S	.	.	H	α-helix	trans	-63.6	-28	177.7	-64.6	170.2	0	0	0	111.7	F184 L201 I205 D206 N208 D212 I225	F184-I210 HydrophobicContact CE2-CG2 4.41Å; L201-I210 HydrophobicContact CD2-CD1 4.02Å; I205-I210 HydrophobicContact CG2-CD1 3.88Å; I205-I210 HydrophobicContact CG2-CG1 3.63Å; D206-I210 VanDerWaalsContact O-CG1 3.3Å; D206-I210 WeakPolarHBondContact O-CG1 3.47Å; D206-I210 PolarHBondContact O-N 3.49Å; N208-I210 VanDerWaalsContact C-N 3.34Å; N208-I210 PolarHBondContact O-N 2.82Å; I210-D212 VanDerWaalsContact C-N 3.31Å; I210-D212 PolarHBondContact O-N 3Å; I210-I225 HydrophobicContact CG2-CD1 3.9Å; I210-I225 WeakPolarHBondContact O-CD1 3.35Å
211	G	87.1	Confident	89.2	Confident	58 Å²	58	73.9 Å²	73.9	60%	0.598	42%	0.419	S	S	*	.	H	α-helix	trans	-59.8	-40	177.6	0	0	0	0	0	113.4	G207 N208 Y209	G207-G211 PolarHBondContact O-N 2.86Å; N208-G211 PolarHBondContact O-N 2.92Å; N208-G211 VanDerWaalsContact O-N 3.14Å; Y209-G211 PolarHBondContact O-N 2.87Å
212	D	90.2	Very high	89.4	Confident	146 Å²	146	73.2 Å²	73.2	78%	0.781	42%	0.416	S	S	*	.	H	α-helix	trans	-119.8	-7.1	-169.9	-63.6	-26.8	0	0	0	114.1	Y209 I210	Y209-D212 PolarHBondContact O-N 2.78Å; I210-D212 VanDerWaalsContact C-N 3.31Å; I210-D212 PolarHBondContact O-N 3Å
213	C	93.9	Very high	90	Very high	7 Å²	7	73 Å²	73	5%	0.047	41%	0.414	C	S	.	.			trans	-74.4	141.2	-177.5	85.5	0	0	0	0	111.6	Y209 C223	Y209-C213 HydrophobicContact CD1-CB 3.8Å; Y209-C213 HydrophobicContact CE1-CB 3.48Å; Y209-C213 VanDerWaalsContact CE1-CB 3.48Å; Y209-C213 VanDerWaalsContact CE1-SG 3.53Å; Y209-C213 HydrophobicContact CE2-CB 4.28Å; Y209-C213 HydrophobicContact CG-CB 4.33Å; Y209-C213 WeakPolarHBondContact O-CB 3.5Å; Y209-C213 PolarHBondContact O-N 3.04Å; C213-C223 HydrophobicContact CB-CB 3.75Å; C213-C223 WeakPolarHBondContact CB-SG 3.36Å; C213-C223 PolarHBondContact O-SG 2.79Å; C213-C223 VanDerWaalsContact O-SG 3.38Å; C213-C223 WeakPolarHBondContact SG-CB 2.92Å; C213-C223 CovalentContact SG-SG 2.05Å; C213-C223 PolarHBondContact SG-SG 3.07Å
214	L	95.3	Very high	90.6	Very high	67 Å²	67	68 Å²	68	35%	0.351	39%	0.391	S	S	.	.			trans	-127.5	136.4	163.9	-169.5	68	0	0	0	107.2	D216 I225 K227	L214-D216 PolarHBondContact O-N 3.08Å; L214-I225 HydrophobicContact CD1-CG2 4.32Å; L214-K227 HydrophobicContact CD1-CB 4.13Å; L214-K227 HydrophobicContact CD2-CB 4.47Å
215	F	95.9	Very high	91.6	Very high	16 Å²	16	66 Å²	66	7%	0.07	36%	0.363	C	S	.	.			trans	-62	128.6	179.3	174.2	-94.3	0	0	0	111.1	P217 P221 C223 I225 F226 L234 Y270 F272	F215-P217 HydrophobicContact CE1-CG 3.91Å; F215-P217 HydrophobicContact CZ-CG 4.24Å; F215-P221 WeakPolarHBondContact CE2-O 3.4Å; F215-C223 HydrophobicContact CB-CB 4.38Å; F215-I225 VanDerWaalsContact CB-O 3.27Å; F215-I225 WeakPolarHBondContact CB-O 3.29Å; F215-I225 PolarHBondContact N-O 2.84Å; F215-F226 HydrophobicContact CB-CD1 3.46Å; F215-F226 VanDerWaalsContact CB-CD1 3.46Å; F215-F226 HydrophobicContact CB-CE1 3.63Å; F215-F226 HydrophobicContact CB-CG 4.23Å; F215-F226 HydrophobicContact CB-CZ 4.49Å; F215-F226 AromaticContact CD1-CD1 3.6Å; F215-F226 HydrophobicContact CD1-CD1 3.6Å; F215-F226 AromaticContact CD1-CE1 3.67Å; F215-F226 HydrophobicContact CD1-CE1 3.67Å; F215-F226 HydrophobicContact CD2-CD1 4.1Å; F215-F226 AromaticContact CD2-CE1 3.42Å; F215-F226 HydrophobicContact CD2-CE1 3.42Å; F215-F226 VanDerWaalsContact CD2-CE1 3.42Å; F215-F226 HydrophobicContact CD2-CZ 4.18Å; F215-F226 HydrophobicContact CE1-CD1 4.36Å; F215-F226 HydrophobicContact CE1-CE1 4.16Å; F215-F226 AromaticContact CE2-CE1 3.93Å; F215-F226 HydrophobicContact CE2-CE1 3.93Å; F215-F226 AromaticContact CG-CD1 3.44Å; F215-F226 HydrophobicContact CG-CD1 3.44Å; F215-F226 VanDerWaalsContact CG-CD1 3.44Å; F215-F226 AromaticContact CG-CE1 3.26Å; F215-F226 HydrophobicContact CG-CE1 3.26Å; F215-F226 HydrophobicContact CG-CZ 4.31Å; F215-F226 HydrophobicContact CZ-CE1 4.27Å; F215-L234 HydrophobicContact CE1-CD1 4.12Å; F215-Y270 HydrophobicContact CD2-CD2 4.22Å; F215-Y270 AromaticContact CE2-CD2 3.72Å; F215-Y270 HydrophobicContact CE2-CD2 3.72Å; F215-Y270 HydrophobicContact CE2-CG 4.26Å; F215-F272 HydrophobicContact CD1-CE2 4.36Å; F215-F272 HydrophobicContact CD1-CZ 4.35Å; F215-F272 AromaticContact CE1-CE2 3.58Å; F215-F272 HydrophobicContact CE1-CE2 3.58Å; F215-F272 AromaticContact CE1-CZ 3.94Å; F215-F272 HydrophobicContact CE1-CZ 3.94Å; F215-F272 HydrophobicContact CZ-CE2 4.01Å; F215-F272 HydrophobicContact CZ-CZ 4.39Å
216	D	94.3	Very high	92.2	Very high	62 Å²	62	65 Å²	65	33%	0.332	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-136.4	132.7	166.6	-179.9	-85.7	0	0	0	108.2	L214 K218 E219 K220 P221	L214-D216 PolarHBondContact O-N 3.08Å; D216-K218 PolarHBondContact O-N 3.29Å; D216-K218 VanDerWaalsContact O-N 3.1Å; D216-K218 WeakPolarHBondContact OD1-CA 3.38Å; D216-K218 PolarHBondContact OD1-N 3.13Å; D216-E219 HydrophobicContact CB-CB 4.18Å; D216-E219 PolarHBondContact OD1-N 3.37Å; D216-K220 PolarHBondContact N-O 2.95Å; D216-K220 CarbonylContact O-C 3Å; D216-K220 PolarHBondContact O-N 3.35Å; D216-K220 VanDerWaalsContact O-N 3.09Å; D216-P221 WeakPolarHBondContact O-CA 3.28Å; D216-P221 VanDerWaalsContact O-N 3.09Å
217	P	92.7	Very high	92.7	Very high	68 Å²	68	64 Å²	64	44%	0.442	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.7	-176.8	-25.3	33.3	0	0	0	115	F215 L234	F215-P217 HydrophobicContact CE1-CG 3.91Å; F215-P217 HydrophobicContact CZ-CG 4.24Å; P217-L234 HydrophobicContact CG-CD1 4.2Å; P217-L234 HydrophobicContact CG-CD2 4.17Å
218	K	92.1	Very high	93.2	Very high	192 Å²	192	61.2 Å²	61.2	84%	0.835	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-46.8	-176.5	-63.9	-178.8	-179.4	179	0	112.1	D216	D216-K218 PolarHBondContact O-N 3.29Å; D216-K218 VanDerWaalsContact O-N 3.1Å; D216-K218 WeakPolarHBondContact OD1-CA 3.38Å; D216-K218 PolarHBondContact OD1-N 3.13Å
219	E	92.6	Very high	93.6	Very high	161 Å²	161	55.4 Å²	55.4	75%	0.752	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-43.3	-173.6	-61.3	-169.2	170.8	0	0	112.7	D216	D216-E219 HydrophobicContact CB-CB 4.18Å; D216-E219 PolarHBondContact OD1-N 3.37Å
220	K	93.4	Very high	93.9	Very high	80 Å²	80	54.7 Å²	54.7	35%	0.348	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-137.2	62	-172.7	-65	-178.4	-174.5	173.8	0	111.7	D216 L222 C223	D216-K220 PolarHBondContact N-O 2.95Å; D216-K220 CarbonylContact O-C 3Å; D216-K220 PolarHBondContact O-N 3.35Å; D216-K220 VanDerWaalsContact O-N 3.09Å; K220-L222 PolarHBondContact O-N 3.06Å; K220-L222 VanDerWaalsContact O-N 3.17Å; K220-C223 HydrophobicContact CB-CB 4.39Å; K220-C223 PolarHBondContact O-N 3.28Å
221	P	93.4	Very high	94.2	Very high	60 Å²	60	52.9 Å²	52.9	39%	0.39	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-15.5	-172.9	27.4	-36.1	0	0	0	114.1	F215 D216 Y270	F215-P221 WeakPolarHBondContact CE2-O 3.4Å; D216-P221 WeakPolarHBondContact O-CA 3.28Å; D216-P221 VanDerWaalsContact O-N 3.09Å; P221-Y270 WeakPolarHBondContact O-CD2 3.27Å
222	L	93.4	Very high	94.6	Very high	40 Å²	40	50.1 Å²	50.1	21%	0.209	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-5	-177.8	-59.5	173.5	0	0	0	113.2	V202 I205 K220 P224 K267	V202-L222 HydrophobicContact CG2-CD1 4.15Å; I205-L222 HydrophobicContact CD1-CB 4.04Å; I205-L222 WeakPolarHBondContact CD1-O 3.3Å; K220-L222 PolarHBondContact O-N 3.06Å; K220-L222 VanDerWaalsContact O-N 3.17Å; L222-P224 WeakPolarHBondContact O-CD 3.48Å; L222-K267 HydrophobicContact CD1-CD 3.92Å; L222-K267 HydrophobicContact CD2-CB 4Å; L222-K267 HydrophobicContact CD2-CD 4.04Å
223	C	95.4	Very high	94.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.			trans	-67.4	128.3	-179.3	177.4	0	0	0	0	110.6	Y209 C213 F215 K220 I225	Y209-C223 HydrophobicContact CE1-CB 4.13Å; C213-C223 HydrophobicContact CB-CB 3.75Å; C213-C223 WeakPolarHBondContact CB-SG 3.36Å; C213-C223 PolarHBondContact O-SG 2.79Å; C213-C223 VanDerWaalsContact O-SG 3.38Å; C213-C223 WeakPolarHBondContact SG-CB 2.92Å; C213-C223 CovalentContact SG-SG 2.05Å; C213-C223 PolarHBondContact SG-SG 3.07Å; F215-C223 HydrophobicContact CB-CB 4.38Å; K220-C223 HydrophobicContact CB-CB 4.39Å; K220-C223 PolarHBondContact O-N 3.28Å; C223-I225 VanDerWaalsContact C-N 3.27Å; C223-I225 PolarHBondContact O-N 3.3Å; C223-I225 PolarHBondContact SG-N 2.99Å
224	P	95.3	Very high	94.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.			trans	-84.4	5.1	-179.2	34.9	-38.4	0	0	0	114	F184 I185 L201 L222 F226	F184-P224 WeakPolarHBondContact CA-O 3.25Å; F184-P224 HydrophobicContact CD2-CB 4.1Å; F184-P224 HydrophobicContact CD2-CG 4.01Å; F184-P224 HydrophobicContact CE2-CB 3.89Å; F184-P224 HydrophobicContact CE2-CG 3.6Å; I185-P224 PolarHBondContact N-O 2.88Å; I185-P224 WeakPolarHBondContact O-CB 3.28Å; L201-P224 HydrophobicContact CD2-CB 4.31Å; L201-P224 HydrophobicContact CD2-CG 3.82Å; L222-P224 WeakPolarHBondContact O-CD 3.48Å; P224-F226 VanDerWaalsContact C-CE2 3.46Å; P224-F226 WeakPolarHBondContact O-CD2 3.34Å; P224-F226 VanDerWaalsContact O-CE2 3.28Å; P224-F226 WeakPolarHBondContact O-CE2 3.33Å
225	I	96.3	Very high	94.5	Very high	27 Å²	27	52.1 Å²	52.1	14%	0.138	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.6	-179.8	-60	175.9	0	0	0	109.2	T182 L183 F184 I210 L214 F215 C223	T182-I225 HydrophobicContact CG2-CG2 4.22Å; L183-I225 CarbonylContact O-C 3.57Å; L183-I225 WeakPolarHBondContact O-CA 3.48Å; F184-I225 HydrophobicContact CB-CG1 4.49Å; F184-I225 HydrophobicContact CD2-CG1 3.85Å; I210-I225 HydrophobicContact CG2-CD1 3.9Å; I210-I225 WeakPolarHBondContact O-CD1 3.35Å; L214-I225 HydrophobicContact CD1-CG2 4.32Å; F215-I225 VanDerWaalsContact CB-O 3.27Å; F215-I225 WeakPolarHBondContact CB-O 3.29Å; F215-I225 PolarHBondContact N-O 2.84Å; C223-I225 VanDerWaalsContact C-N 3.27Å; C223-I225 PolarHBondContact O-N 3.3Å; C223-I225 PolarHBondContact SG-N 2.99Å
226	F	97.1	Very high	94.2	Very high	3 Å²	3	54.3 Å²	54.3	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.3	-174.3	-55.5	-89.9	0	0	0	110.3	T182 L183 I185 F215 P224 I231 Y270 F272	T182-F226 CarbonylContact C-O 3.59Å; T182-F226 VanDerWaalsContact CA-O 3.3Å; T182-F226 WeakPolarHBondContact CA-O 3.44Å; L183-F226 HydrophobicContact CB-CB 4.49Å; L183-F226 PolarHBondContact N-O 2.97Å; L183-F226 PolarHBondContact O-N 3.38Å; I185-F226 HydrophobicContact CB-CE2 4.17Å; I185-F226 HydrophobicContact CD1-CD2 3.95Å; I185-F226 HydrophobicContact CD1-CE2 3.78Å; I185-F226 HydrophobicContact CG1-CD2 4.06Å; I185-F226 HydrophobicContact CG1-CE2 3.97Å; F215-F226 HydrophobicContact CB-CD1 3.46Å; F215-F226 VanDerWaalsContact CB-CD1 3.46Å; F215-F226 HydrophobicContact CB-CE1 3.63Å; F215-F226 HydrophobicContact CB-CG 4.23Å; F215-F226 HydrophobicContact CB-CZ 4.49Å; F215-F226 AromaticContact CD1-CD1 3.6Å; F215-F226 HydrophobicContact CD1-CD1 3.6Å; F215-F226 AromaticContact CD1-CE1 3.67Å; F215-F226 HydrophobicContact CD1-CE1 3.67Å; F215-F226 HydrophobicContact CD2-CD1 4.1Å; F215-F226 AromaticContact CD2-CE1 3.42Å; F215-F226 HydrophobicContact CD2-CE1 3.42Å; F215-F226 VanDerWaalsContact CD2-CE1 3.42Å; F215-F226 HydrophobicContact CD2-CZ 4.18Å; F215-F226 HydrophobicContact CE1-CD1 4.36Å; F215-F226 HydrophobicContact CE1-CE1 4.16Å; F215-F226 AromaticContact CE2-CE1 3.93Å; F215-F226 HydrophobicContact CE2-CE1 3.93Å; F215-F226 AromaticContact CG-CD1 3.44Å; F215-F226 HydrophobicContact CG-CD1 3.44Å; F215-F226 VanDerWaalsContact CG-CD1 3.44Å; F215-F226 AromaticContact CG-CE1 3.26Å; F215-F226 HydrophobicContact CG-CE1 3.26Å; F215-F226 HydrophobicContact CG-CZ 4.31Å; F215-F226 HydrophobicContact CZ-CE1 4.27Å; P224-F226 VanDerWaalsContact C-CE2 3.46Å; P224-F226 WeakPolarHBondContact O-CD2 3.34Å; P224-F226 VanDerWaalsContact O-CE2 3.28Å; P224-F226 WeakPolarHBondContact O-CE2 3.33Å; F226-I231 HydrophobicContact CB-CD1 3.69Å; F226-I231 HydrophobicContact CB-CG1 3.93Å; F226-I231 HydrophobicContact CG-CD1 4.49Å; F226-Y270 HydrophobicContact CE1-CD1 4.34Å; F226-Y270 HydrophobicContact CE1-CD2 4.3Å; F226-Y270 HydrophobicContact CE1-CG 4.09Å; F226-Y270 HydrophobicContact CE2-CE1 4.4Å; F226-Y270 AromaticContact CZ-CD1 3.73Å; F226-Y270 HydrophobicContact CZ-CD1 3.73Å; F226-Y270 HydrophobicContact CZ-CD2 4Å; F226-Y270 AromaticContact CZ-CE1 3.76Å; F226-Y270 HydrophobicContact CZ-CE1 3.76Å; F226-Y270 HydrophobicContact CZ-CE2 4.02Å; F226-Y270 AromaticContact CZ-CG 3.84Å; F226-Y270 HydrophobicContact CZ-CG 3.84Å; F226-Y270 AromaticContact CZ-CZ 3.89Å; F226-F272 HydrophobicContact CD1-CE1 4.23Å; F226-F272 AromaticContact CD1-CZ 3.69Å; F226-F272 HydrophobicContact CD1-CZ 3.69Å; F226-F272 HydrophobicContact CE1-CE1 4.42Å; F226-F272 AromaticContact CE1-CZ 3.71Å; F226-F272 HydrophobicContact CE1-CZ 3.71Å
227	K	96.9	Very high	93.8	Very high	57 Å²	57	52.2 Å²	52.2	25%	0.248	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.2	169.5	-165.7	-180	-178.4	-173.5	0	109.7	E179 N180 Y181 L214 G229 D230 I231	E179-K227 WeakPolarHBondContact O-CE 3.46Å; E179-K227 WeakPolarHBondContact O-CG 3.4Å; N180-K227 WeakPolarHBondContact OD1-CE 3.42Å; N180-K227 PolarHBondContact OD1-NZ 3.41Å; Y181-K227 WeakPolarHBondContact O-CA 3.44Å; L214-K227 HydrophobicContact CD1-CB 4.13Å; L214-K227 HydrophobicContact CD2-CB 4.47Å; K227-G229 VanDerWaalsContact C-N 3.33Å; K227-G229 PolarHBondContact O-N 3.46Å; K227-D230 HydrophobicContact CB-CB 4.19Å; K227-D230 VanDerWaalsContact CB-OD2 3.3Å; K227-D230 WeakPolarHBondContact CB-OD2 3.48Å; K227-D230 PolarHBondContact O-N 3.26Å; K227-D230 VanDerWaalsContact O-N 3.13Å; K227-I231 WeakPolarHBondContact O-CG1 3.5Å; K227-I231 PolarHBondContact O-N 3.41Å; K227-I231 VanDerWaalsContact O-N 3.08Å
228	L	96.4	Very high	93.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-40.1	-178.6	-66.3	-167.6	0	0	0	112.9	M69 V101 A178 Y181 L183 D230 I231 V232 F317	M69-L228 HydrophobicContact CE-CD1 4.27Å; M69-L228 HydrophobicContact CE-CD2 4.02Å; M69-L228 HydrophobicContact SD-CD1 4.19Å; M69-L228 HydrophobicContact SD-CD2 4.31Å; M69-L228 HydrophobicContact SD-CG 4.34Å; V101-L228 HydrophobicContact CB-CD1 4.38Å; V101-L228 HydrophobicContact CG1-CD1 3.89Å; V101-L228 HydrophobicContact CG2-CD1 4.17Å; A178-L228 WeakPolarHBondContact O-CB 3.37Å; Y181-L228 PolarHBondContact O-N 2.83Å; L183-L228 HydrophobicContact CB-CD2 4.16Å; L228-D230 VanDerWaalsContact C-N 3.28Å; L228-D230 PolarHBondContact O-N 3.37Å; L228-I231 HydrophobicContact CD2-CD1 3.99Å; L228-I231 PolarHBondContact O-N 2.76Å; L228-V232 VanDerWaalsContact O-CG2 3.29Å; L228-V232 WeakPolarHBondContact O-CG2 3.44Å; L228-V232 PolarHBondContact O-N 3.4Å; L228-F317 HydrophobicContact CD1-CE2 4.47Å; L228-F317 HydrophobicContact CD2-CE1 4.46Å; L228-F317 HydrophobicContact CD2-CE2 3.99Å; L228-F317 HydrophobicContact CD2-CZ 3.77Å
229	G	95.6	Very high	93.7	Very high	6 Å²	6	43.2 Å²	43.2	6%	0.062	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-40.4	174.7	0	0	0	0	0	113.2	E179 K227 V232 K233	E179-G229 PolarHBondContact O-N 3.02Å; K227-G229 VanDerWaalsContact C-N 3.33Å; K227-G229 PolarHBondContact O-N 3.46Å; G229-V232 PolarHBondContact O-N 2.76Å; G229-K233 WeakPolarHBondContact O-CB 3.39Å; G229-K233 PolarHBondContact O-N 2.78Å
230	D	95.7	Very high	93.6	Very high	57 Å²	57	40.5 Å²	40.5	31%	0.305	22%	0.222	S	C	.	.	H	α-helix	trans	-70.3	-41.2	179.6	-63.3	-27.7	0	0	0	111.2	K227 L228 V232 K233 L234	K227-D230 HydrophobicContact CB-CB 4.19Å; K227-D230 VanDerWaalsContact CB-OD2 3.3Å; K227-D230 WeakPolarHBondContact CB-OD2 3.48Å; K227-D230 PolarHBondContact O-N 3.26Å; K227-D230 VanDerWaalsContact O-N 3.13Å; L228-D230 VanDerWaalsContact C-N 3.28Å; L228-D230 PolarHBondContact O-N 3.37Å; D230-V232 VanDerWaalsContact C-N 3.33Å; D230-V232 PolarHBondContact O-N 2.63Å; D230-K233 PolarHBondContact O-N 2.91Å; D230-L234 VanDerWaalsContact O-CB 3.31Å; D230-L234 WeakPolarHBondContact O-CB 3.45Å; D230-L234 WeakPolarHBondContact O-CG 3.37Å; D230-L234 PolarHBondContact O-N 3.46Å
231	I	96.1	Very high	93.3	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-57.3	-48.2	174.2	-64	172.1	0	0	0	110.6	L183 F226 K227 L228 L234 S235 I249 I251 F272 F317	L183-I231 HydrophobicContact CD2-CD1 3.97Å; F226-I231 HydrophobicContact CB-CD1 3.69Å; F226-I231 HydrophobicContact CB-CG1 3.93Å; F226-I231 HydrophobicContact CG-CD1 4.49Å; K227-I231 WeakPolarHBondContact O-CG1 3.5Å; K227-I231 PolarHBondContact O-N 3.41Å; K227-I231 VanDerWaalsContact O-N 3.08Å; L228-I231 HydrophobicContact CD2-CD1 3.99Å; L228-I231 PolarHBondContact O-N 2.76Å; I231-L234 PolarHBondContact O-N 3Å; I231-S235 WeakPolarHBondContact O-CB 3.36Å; I231-S235 PolarHBondContact O-N 3.4Å; I231-S235 PolarHBondContact O-OG 2.97Å; I231-I249 HydrophobicContact CG2-CD1 4.45Å; I231-I249 HydrophobicContact CG2-CG2 3.86Å; I231-I251 HydrophobicContact CD1-CD1 4.11Å; I231-F272 HydrophobicContact CB-CD1 4.34Å; I231-F272 HydrophobicContact CB-CE1 4.45Å; I231-F272 HydrophobicContact CG1-CD1 4.24Å; I231-F272 HydrophobicContact CG1-CE1 3.86Å; I231-F272 HydrophobicContact CG2-CD1 3.71Å; I231-F272 HydrophobicContact CG2-CE1 4.17Å; I231-F272 HydrophobicContact CG2-CG 4.46Å; I231-F317 HydrophobicContact CB-CE1 4.47Å; I231-F317 HydrophobicContact CD1-CE1 4.41Å; I231-F317 HydrophobicContact CG2-CD1 4.3Å; I231-F317 HydrophobicContact CG2-CE1 3.71Å
232	V	94.2	Very high	93.2	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-43.5	-178.2	175.5	0	0	0	0	110.8	L228 G229 D230 S235 G236 F237 F239 L242 I249 I315	L228-V232 VanDerWaalsContact O-CG2 3.29Å; L228-V232 WeakPolarHBondContact O-CG2 3.44Å; L228-V232 PolarHBondContact O-N 3.4Å; G229-V232 PolarHBondContact O-N 2.76Å; D230-V232 VanDerWaalsContact C-N 3.33Å; D230-V232 PolarHBondContact O-N 2.63Å; V232-S235 PolarHBondContact O-N 2.71Å; V232-G236 PolarHBondContact O-N 3.43Å; V232-F237 HydrophobicContact CG1-CB 3.76Å; V232-F237 PolarHBondContact O-N 3.4Å; V232-F237 VanDerWaalsContact O-N 3.08Å; V232-F239 HydrophobicContact CB-CD2 4.16Å; V232-F239 HydrophobicContact CG1-CB 4.24Å; V232-F239 HydrophobicContact CG1-CD2 4.33Å; V232-F239 HydrophobicContact CG2-CD2 3.86Å; V232-F239 HydrophobicContact CG2-CE2 4.32Å; V232-L242 HydrophobicContact CG1-CD2 3.86Å; V232-L242 HydrophobicContact CG2-CD2 4.06Å; V232-I249 HydrophobicContact CB-CD1 4.25Å; V232-I249 HydrophobicContact CG2-CD1 3.65Å; V232-I315 HydrophobicContact CG2-CD1 3.97Å
233	K	93.6	Very high	93.1	Very high	166 Å²	166	38.4 Å²	38.4	72%	0.722	21%	0.205	S	C	*	.	H	α-helix	trans	-64	-44.4	176.9	-174.4	-179.7	179.3	-177.2	0	112.3	G229 D230 S235 G236	G229-K233 WeakPolarHBondContact O-CB 3.39Å; G229-K233 PolarHBondContact O-N 2.78Å; D230-K233 PolarHBondContact O-N 2.91Å; K233-S235 PolarHBondContact O-N 3.34Å; K233-G236 PolarHBondContact O-N 3.43Å; K233-G236 VanDerWaalsContact O-N 3.1Å
234	L	93.1	Very high	92.9	Very high	80 Å²	80	40.4 Å²	40.4	42%	0.419	22%	0.215	S	C	.	.	H	α-helix	trans	-66.3	-27.6	177.6	-71	171.4	0	0	0	112.3	F215 P217 D230 I231 G236 F272	F215-L234 HydrophobicContact CE1-CD1 4.12Å; P217-L234 HydrophobicContact CG-CD1 4.2Å; P217-L234 HydrophobicContact CG-CD2 4.17Å; D230-L234 VanDerWaalsContact O-CB 3.31Å; D230-L234 WeakPolarHBondContact O-CB 3.45Å; D230-L234 WeakPolarHBondContact O-CG 3.37Å; D230-L234 PolarHBondContact O-N 3.46Å; I231-L234 PolarHBondContact O-N 3Å; L234-G236 PolarHBondContact O-N 3.03Å; L234-F272 HydrophobicContact CB-CB 4.15Å; L234-F272 HydrophobicContact CB-CD2 3.82Å; L234-F272 HydrophobicContact CB-CG 4.21Å; L234-F272 HydrophobicContact CD1-CD2 3.68Å; L234-F272 HydrophobicContact CD1-CE2 3.68Å; L234-F272 HydrophobicContact CG-CD2 4.39Å
235	S	91.6	Very high	92.5	Very high	15 Å²	15	44.2 Å²	44.2	11%	0.105	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-6.3	174.3	-55.3	0	0	0	0	113.6	I231 V232 K233 I249 F272	I231-S235 WeakPolarHBondContact O-CB 3.36Å; I231-S235 PolarHBondContact O-N 3.4Å; I231-S235 PolarHBondContact O-OG 2.97Å; V232-S235 PolarHBondContact O-N 2.71Å; K233-S235 PolarHBondContact O-N 3.34Å; S235-I249 VanDerWaalsContact OG-CG2 3.26Å; S235-I249 WeakPolarHBondContact OG-CG2 3.4Å; S235-F272 WeakPolarHBondContact OG-CB 3.44Å
236	G	88.8	Confident	92.2	Very high	63 Å²	63	43.1 Å²	43.1	65%	0.649	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.6	13.1	-177.9	0	0	0	0	0	114.7	V232 K233 L234	V232-G236 PolarHBondContact O-N 3.43Å; K233-G236 PolarHBondContact O-N 3.43Å; K233-G236 VanDerWaalsContact O-N 3.1Å; L234-G236 PolarHBondContact O-N 3.03Å
237	F	87.1	Confident	91.9	Very high	17 Å²	17	43 Å²	43	8%	0.075	23%	0.227	C	C	.	.			trans	-102.3	160.2	179.1	-67.5	-37.5	0	0	0	113	V232 L242 I249 N278	V232-F237 HydrophobicContact CG1-CB 3.76Å; V232-F237 PolarHBondContact O-N 3.4Å; V232-F237 VanDerWaalsContact O-N 3.08Å; F237-L242 HydrophobicContact CB-CD2 4.32Å; F237-L242 HydrophobicContact CD2-CD1 4.33Å; F237-L242 HydrophobicContact CD2-CD2 4.05Å; F237-I249 HydrophobicContact CD2-CD1 4.19Å; F237-I249 HydrophobicContact CD2-CG1 4.02Å; F237-I249 HydrophobicContact CE2-CG1 4.12Å; F237-N278 VanDerWaalsContact CE1-CA 3.41Å; F237-N278 HydrophobicContact CE1-CB 3.55Å; F237-N278 HydrophobicContact CZ-CB 4.12Å
238	S	89.5	Confident	91.7	Very high	59 Å²	59	40.7 Å²	40.7	41%	0.413	22%	0.219	S	C	.	.			trans	-95.8	127.1	168.7	172.5	0	0	0	0	109.4	E240 L242	S238-E240 PolarHBondContact O-N 2.97Å; S238-L242 WeakPolarHBondContact O-CB 3.19Å; S238-L242 PolarHBondContact O-N 2.98Å; S238-L242 VanDerWaalsContact O-N 3.12Å
239	F	91.8	Very high	91.6	Very high	13 Å²	13	40.7 Å²	40.7	6%	0.057	22%	0.219	C	C	.	.	H	α-helix	trans	-59.1	-44.8	-177	-169.7	-86.8	0	0	0	112.7	T103 M176 A178 E179 V232 K241 L242 A243 I315	T103-F239 HydrophobicContact CG2-CZ 4.41Å; M176-F239 HydrophobicContact CE-CD1 4.06Å; M176-F239 HydrophobicContact CE-CE1 4.43Å; M176-F239 HydrophobicContact SD-CD1 4.44Å; M176-F239 HydrophobicContact SD-CE1 4.41Å; A178-F239 HydrophobicContact CB-CZ 3.97Å; E179-F239 VanDerWaalsContact CA-CZ 3.49Å; E179-F239 HydrophobicContact CB-CD1 3.9Å; E179-F239 HydrophobicContact CB-CD2 4.19Å; E179-F239 HydrophobicContact CB-CE1 3.73Å; E179-F239 HydrophobicContact CB-CE2 4.04Å; E179-F239 HydrophobicContact CB-CG 4.15Å; E179-F239 HydrophobicContact CB-CZ 3.81Å; E179-F239 HydrophobicContact CG-CD1 4.18Å; E179-F239 HydrophobicContact CG-CD2 4.06Å; E179-F239 HydrophobicContact CG-CE1 4.46Å; E179-F239 HydrophobicContact CG-CE2 4.36Å; E179-F239 HydrophobicContact CG-CG 3.99Å; V232-F239 HydrophobicContact CB-CD2 4.16Å; V232-F239 HydrophobicContact CG1-CB 4.24Å; V232-F239 HydrophobicContact CG1-CD2 4.33Å; V232-F239 HydrophobicContact CG2-CD2 3.86Å; V232-F239 HydrophobicContact CG2-CE2 4.32Å; F239-K241 PolarHBondContact O-N 2.84Å; F239-L242 PolarHBondContact O-N 3.08Å; F239-A243 HydrophobicContact CD1-CB 4.15Å; F239-A243 HydrophobicContact CE1-CB 3.91Å; F239-A243 WeakPolarHBondContact O-CB 3.29Å; F239-A243 PolarHBondContact O-N 3.45Å; F239-I315 HydrophobicContact CE2-CD1 4.04Å
240	E	90.9	Very high	91.6	Very high	103 Å²	103	40.4 Å²	40.4	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-59.5	-48.4	-177.2	-174.5	179.3	-170.7	0	0	112.6	M176 S238 A243 Q244	M176-E240 HydrophobicContact CE-CB 4.49Å; S238-E240 PolarHBondContact O-N 2.97Å; E240-A243 PolarHBondContact O-N 3.1Å; E240-Q244 PolarHBondContact O-N 3.3Å; E240-Q244 VanDerWaalsContact O-N 3.13Å
241	K	87.6	Confident	91.7	Very high	128 Å²	128	37.7 Å²	37.7	56%	0.557	20%	0.202	S	C	*	.	H	α-helix	trans	-65.2	-44.8	178.3	-66.4	-174.6	178.1	-177.6	0	111.6	F239 A243 Q244 E245 P279	F239-K241 PolarHBondContact O-N 2.84Å; K241-A243 VanDerWaalsContact C-N 3.3Å; K241-A243 PolarHBondContact O-N 3.38Å; K241-Q244 PolarHBondContact O-N 3.4Å; K241-E245 PolarHBondContact O-N 2.92Å; K241-P279 HydrophobicContact CD-CG 4.38Å
242	L	89.9	Confident	91.7	Very high	8 Å²	8	38.6 Å²	38.6	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-34.1	179.9	-164.5	70	0	0	0	111.6	V232 F237 S238 F239 Q244 G246 I249 I315	V232-L242 HydrophobicContact CG1-CD2 3.86Å; V232-L242 HydrophobicContact CG2-CD2 4.06Å; F237-L242 HydrophobicContact CB-CD2 4.32Å; F237-L242 HydrophobicContact CD2-CD1 4.33Å; F237-L242 HydrophobicContact CD2-CD2 4.05Å; S238-L242 WeakPolarHBondContact O-CB 3.19Å; S238-L242 PolarHBondContact O-N 2.98Å; S238-L242 VanDerWaalsContact O-N 3.12Å; F239-L242 PolarHBondContact O-N 3.08Å; L242-Q244 VanDerWaalsContact C-N 3.34Å; L242-G246 CarbonylContact O-C 3.54Å; L242-G246 WeakPolarHBondContact O-CA 3.42Å; L242-G246 PolarHBondContact O-N 3.24Å; L242-I249 HydrophobicContact CD2-CD1 3.8Å; L242-I249 HydrophobicContact CD2-CG1 4.39Å; L242-I315 HydrophobicContact CD2-CD1 3.79Å; L242-I315 HydrophobicContact CD2-CG1 3.94Å; L242-I315 HydrophobicContact CD2-CG2 4.03Å; L242-I315 HydrophobicContact CG-CD1 4.2Å; L242-I315 HydrophobicContact CG-CG1 4.01Å
243	A	92.6	Very high	91.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.9	-31.3	177.2	0	0	0	0	0	112.5	T103 N104 P173 M176 F239 E240 K241	T103-A243 WeakPolarHBondContact CB-O 3.44Å; T103-A243 HydrophobicContact CG2-CB 4.21Å; T103-A243 WeakPolarHBondContact OG1-CA 3.29Å; T103-A243 PolarHBondContact OG1-O 3.5Å; N104-A243 WeakPolarHBondContact CB-O 3.37Å; P173-A243 HydrophobicContact CB-CB 3.95Å; P173-A243 HydrophobicContact CG-CB 3.85Å; M176-A243 HydrophobicContact SD-CB 4.45Å; F239-A243 HydrophobicContact CD1-CB 4.15Å; F239-A243 HydrophobicContact CE1-CB 3.91Å; F239-A243 WeakPolarHBondContact O-CB 3.29Å; F239-A243 PolarHBondContact O-N 3.45Å; E240-A243 PolarHBondContact O-N 3.1Å; K241-A243 VanDerWaalsContact C-N 3.3Å; K241-A243 PolarHBondContact O-N 3.38Å
244	Q	90.7	Very high	92	Very high	43 Å²	43	31.3 Å²	31.3	20%	0.201	18%	0.176	C	C	.	.	H	α-helix	trans	-71.7	-51.5	-179.8	-171.2	179.6	2.5	0	0	112.6	I169 P173 E240 K241 L242	I169-Q244 HydrophobicContact CG2-CG 4.25Å; P173-Q244 HydrophobicContact CG-CB 3.99Å; E240-Q244 PolarHBondContact O-N 3.3Å; E240-Q244 VanDerWaalsContact O-N 3.13Å; K241-Q244 PolarHBondContact O-N 3.4Å; L242-Q244 VanDerWaalsContact C-N 3.34Å
245	E	86.9	Confident	92.2	Very high	80 Å²	80	27.5 Å²	27.5	37%	0.374	16%	0.156	S	C	.	.	H	α-helix	trans	-102.6	-16.6	-172.1	-61.5	-176.8	165.6	0	0	113.1	K241 V289 G290 Y291	K241-E245 PolarHBondContact O-N 2.92Å; E245-V289 WeakPolarHBondContact OE2-CG1 3.44Å; E245-G290 CarbonylContact O-C 3.59Å; E245-G290 WeakPolarHBondContact O-CA 3.41Å; E245-Y291 PolarHBondContact O-N 3.4Å
246	G	90.4	Very high	92.3	Very high	3 Å²	3	30.7 Å²	30.7	3%	0.031	18%	0.175	C	C	.	.			trans	82.1	172.6	-171.6	0	0	0	0	0	112.9	L242 G290 G314	L242-G246 CarbonylContact O-C 3.54Å; L242-G246 WeakPolarHBondContact O-CA 3.42Å; L242-G246 PolarHBondContact O-N 3.24Å; G246-G290 WeakPolarHBondContact O-CA 3.43Å; G246-G314 WeakPolarHBondContact CA-O 3.42Å
247	G	91.1	Very high	92.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-168.5	173.8	0	0	0	0	0	112.1	Y276 G314 I315 R316	G247-Y276 WeakPolarHBondContact CA-O 3.45Å; G247-G314 PolarHBondContact N-O 2.83Å; G247-G314 VanDerWaalsContact N-O 3.1Å; G247-I315 WeakPolarHBondContact O-CA 3.43Å; G247-R316 PolarHBondContact O-N 3.22Å
248	A	91.9	Very high	93	Very high	10 Å²	10	29.9 Å²	29.9	8%	0.083	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136.9	-179.3	0	0	0	0	0	112.3	L275 Y276 R316	A248-L275 HydrophobicContact CB-CB 4.09Å; A248-L275 PolarHBondContact O-N 2.71Å; A248-Y276 PolarHBondContact N-O 2.9Å; A248-Y276 PolarHBondContact O-N 3.27Å; A248-Y276 VanDerWaalsContact O-N 3.14Å; A248-R316 CarbonylContact C-O 3.59Å; A248-R316 VanDerWaalsContact CA-O 3.29Å; A248-R316 WeakPolarHBondContact CA-O 3.44Å; A248-R316 HydrophobicContact CB-CB 4.18Å
249	I	94.4	Very high	93.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.7	178.7	-65.8	177.2	0	0	0	109.4	I231 V232 S235 F237 L242 H273 I315 R316 F317 D318	I231-I249 HydrophobicContact CG2-CD1 4.45Å; I231-I249 HydrophobicContact CG2-CG2 3.86Å; V232-I249 HydrophobicContact CB-CD1 4.25Å; V232-I249 HydrophobicContact CG2-CD1 3.65Å; S235-I249 VanDerWaalsContact OG-CG2 3.26Å; S235-I249 WeakPolarHBondContact OG-CG2 3.4Å; F237-I249 HydrophobicContact CD2-CD1 4.19Å; F237-I249 HydrophobicContact CD2-CG1 4.02Å; F237-I249 HydrophobicContact CE2-CG1 4.12Å; L242-I249 HydrophobicContact CD2-CD1 3.8Å; L242-I249 HydrophobicContact CD2-CG1 4.39Å; I249-H273 WeakPolarHBondContact CA-O 3.14Å; I249-I315 HydrophobicContact CD1-CG2 3.98Å; I249-I315 HydrophobicContact CG1-CG2 4.21Å; I249-R316 PolarHBondContact N-O 2.91Å; I249-F317 HydrophobicContact CB-CD1 4Å; I249-F317 HydrophobicContact CB-CE1 4.09Å; I249-F317 HydrophobicContact CD1-CE1 4.05Å; I249-F317 HydrophobicContact CG2-CD1 4.2Å; I249-F317 HydrophobicContact CG2-CE1 4.29Å; I249-F317 WeakPolarHBondContact O-CA 3.15Å; I249-D318 PolarHBondContact O-N 2.91Å
250	G	95.6	Very high	93.3	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.5	172.8	0	0	0	0	0	110.5	F272 H273 D318	G250-F272 WeakPolarHBondContact O-CA 3.19Å; G250-H273 PolarHBondContact N-O 3.45Å; G250-H273 PolarHBondContact O-N 2.72Å; G250-D318 CarbonylContact C-O 3.56Å; G250-D318 WeakPolarHBondContact CA-O 3.34Å
251	I	97.1	Very high	93.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	103	172.1	-54.1	176.4	0	0	0	107.2	L183 I185 I231 F272 F317 D318 V319 I320	L183-I251 HydrophobicContact CD2-CD1 3.66Å; I185-I251 HydrophobicContact CD1-CD1 4.02Å; I185-I251 HydrophobicContact CD1-CG2 3.91Å; I231-I251 HydrophobicContact CD1-CD1 4.11Å; I251-F272 HydrophobicContact CB-CD1 4.42Å; I251-F272 HydrophobicContact CB-CE1 4.48Å; I251-F272 HydrophobicContact CG1-CD1 4.06Å; I251-F272 HydrophobicContact CG1-CE1 4.23Å; I251-F272 HydrophobicContact CG2-CD1 4.11Å; I251-F272 HydrophobicContact CG2-CE1 3.75Å; I251-F317 HydrophobicContact CD1-CB 4.4Å; I251-F317 HydrophobicContact CD1-CD1 3.94Å; I251-F317 HydrophobicContact CD1-CG 4.49Å; I251-F317 HydrophobicContact CG1-CD1 4.34Å; I251-D318 PolarHBondContact N-O 3.46Å; I251-V319 HydrophobicContact CB-CG2 4.44Å; I251-V319 HydrophobicContact CD1-CG2 4.45Å; I251-V319 CarbonylContact O-C 3.58Å; I251-V319 WeakPolarHBondContact O-CA 3.24Å; I251-I320 PolarHBondContact O-N 3.03Å
252	V	96.9	Very high	93.6	Very high	20 Å²	20	27 Å²	27	12%	0.121	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	120.4	-178.4	-179.7	0	0	0	0	109.5	Y270 N271 I320 K322	V252-Y270 WeakPolarHBondContact O-CA 3.43Å; V252-N271 HydrophobicContact CB-CB 4.28Å; V252-N271 PolarHBondContact N-O 2.86Å; V252-N271 PolarHBondContact O-N 3.38Å; V252-I320 CarbonylContact C-O 3.52Å; V252-I320 VanDerWaalsContact CA-O 3.27Å; V252-I320 WeakPolarHBondContact CA-O 3.36Å; V252-I320 HydrophobicContact CG2-CB 4.28Å; V252-K322 HydrophobicContact CG1-CB 4.21Å
253	V	97.2	Very high	93.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	103.9	171.5	-169	0	0	0	0	107.7	P268 Y270 V319 I320 K322	V253-P268 HydrophobicContact CG1-CB 3.77Å; V253-Y270 HydrophobicContact CB-CD1 4.45Å; V253-Y270 HydrophobicContact CB-CE1 4.39Å; V253-Y270 HydrophobicContact CG1-CD1 4.23Å; V253-Y270 HydrophobicContact CG1-CE1 3.84Å; V253-Y270 HydrophobicContact CG2-CD1 3.9Å; V253-Y270 HydrophobicContact CG2-CE1 3.82Å; V253-V319 HydrophobicContact CG2-CG1 3.96Å; V253-I320 PolarHBondContact N-O 3.17Å; V253-K322 PolarHBondContact O-N 3.03Å
254	D	97.1	Very high	93.6	Very high	15 Å²	15	34.6 Å²	34.6	8%	0.08	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.6	-177.6	-161.6	-26.9	0	0	0	111.2	T256 P268 E269 K322	D254-T256 WeakPolarHBondContact OD1-CB 3.31Å; D254-T256 PolarHBondContact OD1-N 2.85Å; D254-T256 PolarHBondContact OD1-OG1 2.88Å; D254-P268 WeakPolarHBondContact O-CA 3.13Å; D254-E269 HydrophobicContact CB-CB 4.39Å; D254-E269 PolarHBondContact N-O 3.29Å; D254-E269 PolarHBondContact O-N 3.43Å; D254-K322 CarbonylContact C-O 3.6Å; D254-K322 WeakPolarHBondContact CA-O 3.42Å; D254-K322 WeakPolarHBondContact OD2-CD 3.27Å; D254-K322 WeakPolarHBondContact OD2-CE 3.37Å; D254-K322 IonicContact OD2-NZ 2.7Å; D254-K322 PolarHBondContact OD2-NZ 3.43Å
255	W	96.5	Very high	93.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	64.6	173.2	-69.9	95.1	0	0	0	110	N187 V189 F191 R198 S199 N200 C257 P268 K322 L324	N187-W255 PolarHBondContact OD1-NE1 3.43Å; V189-W255 HydrophobicContact CG1-CD2 4.43Å; V189-W255 HydrophobicContact CG1-CG 4.06Å; V189-W255 HydrophobicContact CG2-CD2 3.68Å; V189-W255 HydrophobicContact CG2-CE3 4.06Å; V189-W255 HydrophobicContact CG2-CG 3.93Å; V189-W255 HydrophobicContact CG2-CZ2 4.23Å; V189-W255 HydrophobicContact CG2-CZ3 4.49Å; F191-W255 HydrophobicContact CZ-CB 4.38Å; R198-W255 HydrophobicContact CB-CE3 4.45Å; R198-W255 HydrophobicContact CB-CH2 3.98Å; R198-W255 HydrophobicContact CB-CZ3 3.8Å; R198-W255 HydrophobicContact CG-CZ3 4.4Å; S199-W255 WeakPolarHBondContact O-CH2 3.3Å; N200-W255 HydrophobicContact CB-CZ2 4.1Å; W255-C257 PolarHBondContact O-N 3.31Å; W255-P268 HydrophobicContact CD2-CB 4.27Å; W255-P268 HydrophobicContact CH2-CB 4.13Å; W255-P268 HydrophobicContact CH2-CG 4.01Å; W255-P268 HydrophobicContact CZ2-CB 3.72Å; W255-P268 HydrophobicContact CZ2-CG 3.92Å; W255-K322 PolarHBondContact N-O 3.37Å; W255-L324 PolarHBondContact O-N 3.24Å
256	T	95.4	Very high	94	Very high	82 Å²	82	35.7 Å²	35.7	50%	0.503	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	103.2	170.6	-63.7	0	0	0	0	109.1	D254 L324	D254-T256 WeakPolarHBondContact OD1-CB 3.31Å; D254-T256 PolarHBondContact OD1-N 2.85Å; D254-T256 PolarHBondContact OD1-OG1 2.88Å; T256-L324 CarbonylContact C-O 3.43Å; T256-L324 WeakPolarHBondContact CA-O 3.43Å
257	C	95.2	Very high	94.1	Very high	9 Å²	9	40.1 Å²	40.1	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.1	-170.7	-63.9	0	0	0	0	112.9	W255 F259 C266 L324 A325 R326	W255-C257 PolarHBondContact O-N 3.31Å; C257-F259 HydrophobicContact CB-CD1 4.49Å; C257-F259 HydrophobicContact CB-CE1 3.96Å; C257-F259 HydrophobicContact CB-CZ 4.13Å; C257-C266 HydrophobicContact CB-CB 3.68Å; C257-C266 WeakPolarHBondContact CB-SG 3.34Å; C257-C266 WeakPolarHBondContact SG-CA 3.21Å; C257-C266 WeakPolarHBondContact SG-CB 3.03Å; C257-C266 CovalentContact SG-SG 2.02Å; C257-C266 PolarHBondContact SG-SG 2.02Å; C257-L324 PolarHBondContact N-O 3.08Å; C257-A325 CarbonylContact O-C 3.48Å; C257-A325 WeakPolarHBondContact O-CA 3.39Å; C257-R326 PolarHBondContact O-N 3.16Å
258	N	95.1	Very high	94.4	Very high	53 Å²	53	40.3 Å²	40.3	28%	0.283	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.7	169.3	-174.9	10.5	0	0	0	108.9	Q56 D260 V261	Q56-N258 PolarHBondContact NE2-OD1 3.04Å; N258-D260 VanDerWaalsContact C-N 3.33Å; N258-D260 WeakPolarHBondContact OD1-CB 3.19Å; N258-D260 PolarHBondContact OD1-N 3.01Å; N258-V261 WeakPolarHBondContact O-CG2 3.3Å
259	F	95.3	Very high	94.5	Very high	15 Å²	15	46.1 Å²	46.1	7%	0.066	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	11.3	-179.6	-63.9	-41.1	0	0	0	113.8	F191 F194 V196 C257 V261 V263 C266 A325 R326 K327	F191-F259 HydrophobicContact CB-CE2 4.25Å; F191-F259 AromaticContact CD2-CE2 3.69Å; F191-F259 HydrophobicContact CD2-CE2 3.69Å; F191-F259 AromaticContact CD2-CZ 3.61Å; F191-F259 HydrophobicContact CD2-CZ 3.61Å; F191-F259 HydrophobicContact CE2-CE2 4.16Å; F191-F259 AromaticContact CE2-CZ 3.78Å; F191-F259 HydrophobicContact CE2-CZ 3.78Å; F191-F259 AromaticContact CG-CE2 3.95Å; F191-F259 HydrophobicContact CG-CE2 3.95Å; F191-F259 HydrophobicContact CG-CZ 4.33Å; F194-F259 HydrophobicContact CB-CD2 4.35Å; F194-F259 AromaticContact CD2-CD2 3.6Å; F194-F259 HydrophobicContact CD2-CD2 3.6Å; F194-F259 AromaticContact CD2-CE2 3.86Å; F194-F259 HydrophobicContact CD2-CE2 3.86Å; F194-F259 HydrophobicContact CE2-CD2 4.25Å; F194-F259 HydrophobicContact CG-CD2 4.23Å; V196-F259 HydrophobicContact CB-CE2 4.16Å; V196-F259 HydrophobicContact CB-CZ 4.12Å; V196-F259 HydrophobicContact CG1-CE1 4.01Å; V196-F259 HydrophobicContact CG1-CE2 4.3Å; V196-F259 HydrophobicContact CG1-CZ 3.75Å; V196-F259 HydrophobicContact CG2-CE2 4.37Å; C257-F259 HydrophobicContact CB-CD1 4.49Å; C257-F259 HydrophobicContact CB-CE1 3.96Å; C257-F259 HydrophobicContact CB-CZ 4.13Å; F259-V261 CarbonylContact C-O 3.6Å; F259-V263 HydrophobicContact CD1-CG2 4.25Å; F259-V263 HydrophobicContact CE1-CG1 4.41Å; F259-C266 HydrophobicContact CE1-CB 3.88Å; F259-A325 HydrophobicContact CD2-CB 3.76Å; F259-A325 HydrophobicContact CE2-CB 3.32Å; F259-A325 HydrophobicContact CZ-CB 4.1Å; F259-R326 PolarHBondContact N-O 3.22Å; F259-K327 HydrophobicContact CB-CB 4.09Å; F259-K327 HydrophobicContact CB-CD 4.27Å; F259-K327 HydrophobicContact CB-CG 4.06Å
260	D	92.3	Very high	94.6	Very high	65 Å²	65	46.9 Å²	46.9	35%	0.348	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-25.8	163.6	-67.3	-1.6	0	0	0	111.7	Y55 Q56 N258 K327 F328	Y55-D260 WeakPolarHBondContact CE2-OD2 3.46Å; Q56-D260 VanDerWaalsContact NE2-CG 3.26Å; Q56-D260 PolarHBondContact NE2-OD2 3.12Å; N258-D260 VanDerWaalsContact C-N 3.33Å; N258-D260 WeakPolarHBondContact OD1-CB 3.19Å; N258-D260 PolarHBondContact OD1-N 3.01Å; D260-K327 WeakPolarHBondContact OD1-CA 3.07Å; D260-F328 WeakPolarHBondContact OD1-CB 3.37Å; D260-F328 PolarHBondContact OD1-N 3.43Å
261	V	91.4	Very high	94.6	Very high	77 Å²	77	50 Å²	50	47%	0.467	26%	0.256	S	S	.	.	S	Bend	trans	-97.5	174.6	171.3	-60.7	0	0	0	0	110.4	N258 F259 V263 H265	N258-V261 WeakPolarHBondContact O-CG2 3.3Å; F259-V261 CarbonylContact C-O 3.6Å; V261-V263 PolarHBondContact O-N 3.49Å; V261-H265 HydrophobicContact CG2-CB 4.21Å
262	D	91.8	Very high	94.6	Very high	86 Å²	86	51 Å²	51	46%	0.46	26%	0.26	S	S	.	.			trans	-58.9	135.9	177.3	-170.6	-76.9	0	0	0	111.7	K264 H265	D262-K264 PolarHBondContact O-N 3.21Å; D262-K264 WeakPolarHBondContact OD1-CB 3.36Å; D262-K264 WeakPolarHBondContact OD1-CD 3.21Å; D262-K264 WeakPolarHBondContact OD1-CG 3.13Å; D262-K264 PolarHBondContact OD1-N 2.77Å; D262-H265 PolarHBondContact O-N 2.05Å; D262-H265 PolarHBondContact O-ND1 3.12Å; D262-H265 VanDerWaalsContact O-ND1 3.12Å
263	V	91.7	Very high	94.3	Very high	49 Å²	49	54.7 Å²	54.7	30%	0.297	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-55.4	-24.7	-177.4	176	0	0	0	0	112.9	V196 R198 F259 V261 H265 C266	V196-V263 HydrophobicContact CG1-CG1 3.82Å; V196-V263 HydrophobicContact CG1-CG2 4.49Å; R198-V263 HydrophobicContact CG-CG1 4.36Å; F259-V263 HydrophobicContact CD1-CG2 4.25Å; F259-V263 HydrophobicContact CE1-CG1 4.41Å; V261-V263 PolarHBondContact O-N 3.49Å; V263-H265 PolarHBondContact O-N 3.38Å; V263-C266 WeakPolarHBondContact O-CB 3.16Å; V263-C266 PolarHBondContact O-N 2.67Å
264	K	90.9	Very high	93.9	Very high	118 Å²	118	56.4 Å²	56.4	51%	0.513	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-62.4	-22.8	176.8	-67.9	169.6	-176.3	176.2	0	114.1	D262 K267	D262-K264 PolarHBondContact O-N 3.21Å; D262-K264 WeakPolarHBondContact OD1-CB 3.36Å; D262-K264 WeakPolarHBondContact OD1-CD 3.21Å; D262-K264 WeakPolarHBondContact OD1-CG 3.13Å; D262-K264 PolarHBondContact OD1-N 2.77Å; K264-K267 WeakPolarHBondContact O-CE 3.1Å
265	H	91.8	Very high	93.2	Very high	142 Å²	142	59.5 Å²	59.5	66%	0.657	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-76.7	-15.4	175.7	-61.4	92.2	0	0	0	112.5	V261 D262 V263 K267	V261-H265 HydrophobicContact CG2-CB 4.21Å; D262-H265 PolarHBondContact O-N 2.05Å; D262-H265 PolarHBondContact O-ND1 3.12Å; D262-H265 VanDerWaalsContact O-ND1 3.12Å; V263-H265 PolarHBondContact O-N 3.38Å; H265-K267 PolarHBondContact O-N 3.17Å; H265-K267 VanDerWaalsContact O-N 3.12Å
266	C	94.1	Very high	92.2	Very high	5 Å²	5	63.3 Å²	63.3	3%	0.034	32%	0.324	C	S	.	.			trans	-75.8	99.2	171.6	-176.4	0	0	0	0	109.1	R198 C257 F259 V263	R198-C266 PolarHBondContact NE-O 3.14Å; R198-C266 PolarHBondContact NH2-O 3.29Å; R198-C266 VanDerWaalsContact NH2-O 3.12Å; C257-C266 HydrophobicContact CB-CB 3.68Å; C257-C266 WeakPolarHBondContact CB-SG 3.34Å; C257-C266 WeakPolarHBondContact SG-CA 3.21Å; C257-C266 WeakPolarHBondContact SG-CB 3.03Å; C257-C266 CovalentContact SG-SG 2.02Å; C257-C266 PolarHBondContact SG-SG 2.02Å; F259-C266 HydrophobicContact CE1-CB 3.88Å; V263-C266 WeakPolarHBondContact O-CB 3.16Å; V263-C266 PolarHBondContact O-N 2.67Å
267	K	94.4	Very high	90.6	Very high	95 Å²	95	60.4 Å²	60.4	41%	0.413	31%	0.311	S	S	.	.			trans	-127	149.8	180	-62.5	-174.7	179.5	-178.3	0	109.2	V202 L222 K264 H265	V202-K267 HydrophobicContact CG1-CG 4.37Å; L222-K267 HydrophobicContact CD1-CD 3.92Å; L222-K267 HydrophobicContact CD2-CB 4Å; L222-K267 HydrophobicContact CD2-CD 4.04Å; K264-K267 WeakPolarHBondContact O-CE 3.1Å; H265-K267 PolarHBondContact O-N 3.17Å; H265-K267 VanDerWaalsContact O-N 3.12Å
268	P	95.6	Very high	88.9	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.032	32%	0.323	C	S	.	.			trans	-75.4	143.7	179.5	30.7	-32.4	0	0	0	111	N200 V253 D254 W255 Y270	N200-P268 HydrophobicContact CB-CG 3.88Å; V253-P268 HydrophobicContact CG1-CB 3.77Å; D254-P268 WeakPolarHBondContact O-CA 3.13Å; W255-P268 HydrophobicContact CD2-CB 4.27Å; W255-P268 HydrophobicContact CH2-CB 4.13Å; W255-P268 HydrophobicContact CH2-CG 4.01Å; W255-P268 HydrophobicContact CZ2-CB 3.72Å; W255-P268 HydrophobicContact CZ2-CG 3.92Å; P268-Y270 HydrophobicContact CB-CE2 4.48Å; P268-Y270 HydrophobicContact CG-CE2 4.21Å
269	E	95.4	Very high	86.8	Confident	131 Å²	131	64.7 Å²	64.7	61%	0.612	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.6	165.2	-65.1	-176.4	175.7	0	0	109.6	D254	D254-E269 HydrophobicContact CB-CB 4.39Å; D254-E269 PolarHBondContact N-O 3.29Å; D254-E269 PolarHBondContact O-N 3.43Å
270	Y	96.6	Very high	84.8	Confident	16 Å²	16	68.5 Å²	68.5	6%	0.063	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.8	-178.2	-60.4	-78.7	0	0	0	110.8	N200 F215 P221 F226 V252 V253 P268	N200-Y270 WeakPolarHBondContact CB-OH 3.06Å; N200-Y270 PolarHBondContact ND2-OH 3.41Å; F215-Y270 HydrophobicContact CD2-CD2 4.22Å; F215-Y270 AromaticContact CE2-CD2 3.72Å; F215-Y270 HydrophobicContact CE2-CD2 3.72Å; F215-Y270 HydrophobicContact CE2-CG 4.26Å; P221-Y270 WeakPolarHBondContact O-CD2 3.27Å; F226-Y270 HydrophobicContact CE1-CD1 4.34Å; F226-Y270 HydrophobicContact CE1-CD2 4.3Å; F226-Y270 HydrophobicContact CE1-CG 4.09Å; F226-Y270 HydrophobicContact CE2-CE1 4.4Å; F226-Y270 AromaticContact CZ-CD1 3.73Å; F226-Y270 HydrophobicContact CZ-CD1 3.73Å; F226-Y270 HydrophobicContact CZ-CD2 4Å; F226-Y270 AromaticContact CZ-CE1 3.76Å; F226-Y270 HydrophobicContact CZ-CE1 3.76Å; F226-Y270 HydrophobicContact CZ-CE2 4.02Å; F226-Y270 AromaticContact CZ-CG 3.84Å; F226-Y270 HydrophobicContact CZ-CG 3.84Å; F226-Y270 AromaticContact CZ-CZ 3.89Å; V252-Y270 WeakPolarHBondContact O-CA 3.43Å; V253-Y270 HydrophobicContact CB-CD1 4.45Å; V253-Y270 HydrophobicContact CB-CE1 4.39Å; V253-Y270 HydrophobicContact CG1-CD1 4.23Å; V253-Y270 HydrophobicContact CG1-CE1 3.84Å; V253-Y270 HydrophobicContact CG2-CD1 3.9Å; V253-Y270 HydrophobicContact CG2-CE1 3.82Å; P268-Y270 HydrophobicContact CB-CE2 4.48Å; P268-Y270 HydrophobicContact CG-CE2 4.21Å
271	N	95.7	Very high	82.9	Confident	68 Å²	68	71 Å²	71	36%	0.364	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.3	175.2	-65.7	-48.4	0	0	0	110.3	V252	V252-N271 HydrophobicContact CB-CB 4.28Å; V252-N271 PolarHBondContact N-O 2.86Å; V252-N271 PolarHBondContact O-N 3.38Å
272	F	95.4	Very high	80.9	Confident	21 Å²	21	72.7 Å²	72.7	9%	0.092	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.3	-176	-53.5	-83.2	0	0	0	110	F215 F226 I231 L234 S235 G250 I251	F215-F272 HydrophobicContact CD1-CE2 4.36Å; F215-F272 HydrophobicContact CD1-CZ 4.35Å; F215-F272 AromaticContact CE1-CE2 3.58Å; F215-F272 HydrophobicContact CE1-CE2 3.58Å; F215-F272 AromaticContact CE1-CZ 3.94Å; F215-F272 HydrophobicContact CE1-CZ 3.94Å; F215-F272 HydrophobicContact CZ-CE2 4.01Å; F215-F272 HydrophobicContact CZ-CZ 4.39Å; F226-F272 HydrophobicContact CD1-CE1 4.23Å; F226-F272 AromaticContact CD1-CZ 3.69Å; F226-F272 HydrophobicContact CD1-CZ 3.69Å; F226-F272 HydrophobicContact CE1-CE1 4.42Å; F226-F272 AromaticContact CE1-CZ 3.71Å; F226-F272 HydrophobicContact CE1-CZ 3.71Å; I231-F272 HydrophobicContact CB-CD1 4.34Å; I231-F272 HydrophobicContact CB-CE1 4.45Å; I231-F272 HydrophobicContact CG1-CD1 4.24Å; I231-F272 HydrophobicContact CG1-CE1 3.86Å; I231-F272 HydrophobicContact CG2-CD1 3.71Å; I231-F272 HydrophobicContact CG2-CE1 4.17Å; I231-F272 HydrophobicContact CG2-CG 4.46Å; L234-F272 HydrophobicContact CB-CB 4.15Å; L234-F272 HydrophobicContact CB-CD2 3.82Å; L234-F272 HydrophobicContact CB-CG 4.21Å; L234-F272 HydrophobicContact CD1-CD2 3.68Å; L234-F272 HydrophobicContact CD1-CE2 3.68Å; L234-F272 HydrophobicContact CG-CD2 4.39Å; S235-F272 WeakPolarHBondContact OG-CB 3.44Å; G250-F272 WeakPolarHBondContact O-CA 3.19Å; I251-F272 HydrophobicContact CB-CD1 4.42Å; I251-F272 HydrophobicContact CB-CE1 4.48Å; I251-F272 HydrophobicContact CG1-CD1 4.06Å; I251-F272 HydrophobicContact CG1-CE1 4.23Å; I251-F272 HydrophobicContact CG2-CD1 4.11Å; I251-F272 HydrophobicContact CG2-CE1 3.75Å
273	H	91.5	Very high	78.7	Confident	97 Å²	97	74.9 Å²	74.9	45%	0.449	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	134.2	-176.7	-60.5	-72.1	0	0	0	110.7	I249 G250 L275	I249-H273 WeakPolarHBondContact CA-O 3.14Å; G250-H273 PolarHBondContact N-O 3.45Å; G250-H273 PolarHBondContact O-N 2.72Å; H273-L275 PolarHBondContact O-N 3.14Å
274	G	88.5	Confident	76.6	Confident	35 Å²	35	76.4 Å²	76.4	36%	0.361	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	118.3	166.9	0	0	0	0	0	111
275	L	83.5	Confident	74.7	Confident	80 Å²	80	73.1 Å²	73.1	42%	0.419	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-36.6	-179.2	-62.7	176.6	0	0	0	112.4	A248 H273 D318	A248-L275 HydrophobicContact CB-CB 4.09Å; A248-L275 PolarHBondContact O-N 2.71Å; H273-L275 PolarHBondContact O-N 3.14Å; L275-D318 HydrophobicContact CD1-CB 4.31Å
276	Y	74.4	Confident	72.8	Confident	81 Å²	81	76.7 Å²	76.7	32%	0.318	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	140.9	-177.5	-168.4	-98.9	0	0	0	111.5	G247 A248 S288 G290	G247-Y276 WeakPolarHBondContact CA-O 3.45Å; A248-Y276 PolarHBondContact N-O 2.9Å; A248-Y276 PolarHBondContact O-N 3.27Å; A248-Y276 VanDerWaalsContact O-N 3.14Å; Y276-S288 PolarHBondContact OH-O 3.32Å; Y276-G290 WeakPolarHBondContact CE1-O 3.43Å
277	G	62.1	Low	70.9	Confident	21 Å²	21	81.4 Å²	81.4	22%	0.216	47%	0.465	C	S	.	.			trans	99	25.3	178.6	0	0	0	0	0	114.3	P279	G277-P279 WeakPolarHBondContact O-CD 3.04Å
278	N	59.7	Low	69.2	Low	61 Å²	61	80 Å²	80	33%	0.326	47%	0.468	S	S	.	.			trans	-74.6	119.7	177	-164.7	-17.7	0	0	0	111.6	F237 S280 E281	F237-N278 VanDerWaalsContact CE1-CA 3.41Å; F237-N278 HydrophobicContact CE1-CB 3.55Å; F237-N278 HydrophobicContact CZ-CB 4.12Å; N278-S280 PolarHBondContact O-N 3.31Å; N278-S280 VanDerWaalsContact O-N 3.15Å; N278-S280 WeakPolarHBondContact OD1-CB 3.03Å; N278-S280 PolarHBondContact OD1-N 3.13Å; N278-E281 HydrophobicContact CB-CB 4.24Å; N278-E281 HydrophobicContact CB-CG 3.99Å; N278-E281 PolarHBondContact O-N 3.36Å; N278-E281 VanDerWaalsContact O-N 3.16Å
279	P	50.8	Low	68	Low	90 Å²	90	84 Å²	84	58%	0.584	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.4	174.1	-18.7	31.3	0	0	0	113.5	K241 G277	K241-P279 HydrophobicContact CD-CG 4.38Å; G277-P279 WeakPolarHBondContact O-CD 3.04Å
280	S	52.4	Low	67.2	Low	95 Å²	95	78 Å²	78	66%	0.664	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-5.9	179.6	-56.3	0	0	0	0	113.8	N278 T282	N278-S280 PolarHBondContact O-N 3.31Å; N278-S280 VanDerWaalsContact O-N 3.15Å; N278-S280 WeakPolarHBondContact OD1-CB 3.03Å; N278-S280 PolarHBondContact OD1-N 3.13Å; S280-T282 PolarHBondContact O-N 2.93Å; S280-T282 VanDerWaalsContact O-N 3.13Å
281	E	53.7	Low	66.8	Low	117 Å²	117	80.4 Å²	80.4	55%	0.547	48%	0.475	S	S	.	.			trans	-74.8	102.6	171.5	-88.2	178.1	151.8	0	0	109.7	N278 D283	N278-E281 HydrophobicContact CB-CB 4.24Å; N278-E281 HydrophobicContact CB-CG 3.99Å; N278-E281 PolarHBondContact O-N 3.36Å; N278-E281 VanDerWaalsContact O-N 3.16Å; E281-D283 PolarHBondContact O-N 2.82Å
282	T	49.8	Very low	66.6	Low	113 Å²	113	79.8 Å²	79.8	69%	0.693	47%	0.471	S	S	*	.			trans	-72.7	-7.7	172.3	43.3	0	0	0	0	113.5	S280	S280-T282 PolarHBondContact O-N 2.93Å; S280-T282 VanDerWaalsContact O-N 3.13Å
283	D	45.3	Very low	66.5	Low	133 Å²	133	81.2 Å²	81.2	71%	0.711	48%	0.477	S	S	*	.	S	Bend	trans	-98.1	106	-166.4	-73.9	-3.6	0	0	0	112.1	E281 A285	E281-D283 PolarHBondContact O-N 2.82Å; D283-A285 PolarHBondContact O-N 3.27Å
284	G	46.8	Very low	66.7	Low	80 Å²	80	81.9 Å²	81.9	83%	0.825	48%	0.476	S	S	*	.	S	Bend	trans	66.3	-23.1	149.8	0	0	0	0	0	120	R286	G284-R286 VanDerWaalsContact C-N 3.3Å; G284-R286 PolarHBondContact O-N 3.41Å
285	A	51.3	Low	67	Low	49 Å²	49	82.6 Å²	82.6	41%	0.405	47%	0.468	S	S	.	.			trans	-88.1	19.8	-169.6	0	0	0	0	0	114.6	D283 A287	D283-A285 PolarHBondContact O-N 3.27Å; A285-A287 PolarHBondContact O-N 2.82Å; A285-A287 VanDerWaalsContact O-N 3.07Å
286	R	51.8	Low	67.6	Low	218 Å²	218	80 Å²	80	82%	0.823	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-9.1	178	-65.8	-174.7	-173.8	171.1	2.8	114.3	G284 S288	G284-R286 VanDerWaalsContact C-N 3.3Å; G284-R286 PolarHBondContact O-N 3.41Å; R286-S288 VanDerWaalsContact C-N 3.34Å
287	A	54.8	Low	68.6	Low	103 Å²	103	80.6 Å²	80.6	85%	0.851	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.4	-178	0	0	0	0	0	113.6	A285	A285-A287 PolarHBondContact O-N 2.82Å; A285-A287 VanDerWaalsContact O-N 3.07Å
288	S	59.2	Low	70.3	Confident	67 Å²	67	86.7 Å²	86.7	47%	0.469	48%	0.48	S	S	.	.	S	Bend	trans	-154	93.3	177.8	179.8	0	0	0	0	110.3	Y276 R286	Y276-S288 PolarHBondContact OH-O 3.32Å; R286-S288 VanDerWaalsContact C-N 3.34Å
289	V	69.8	Low	72	Confident	89 Å²	89	87.7 Å²	87.7	54%	0.539	48%	0.48	S	S	.	.			trans	-80.9	132.1	177.7	-156.2	0	0	0	0	109.5	E245	E245-V289 WeakPolarHBondContact OE2-CG1 3.44Å
290	G	78	Confident	74.1	Confident	5 Å²	5	89.4 Å²	89.4	5%	0.052	48%	0.482	C	S	.	.	S	Bend	trans	81.4	-175.1	175.3	0	0	0	0	0	116.6	E245 G246 Y276	E245-G290 CarbonylContact O-C 3.59Å; E245-G290 WeakPolarHBondContact O-CA 3.41Å; G246-G290 WeakPolarHBondContact O-CA 3.43Å; Y276-G290 WeakPolarHBondContact CE1-O 3.43Å
291	Y	87.9	Confident	76.1	Confident	66 Å²	66	89 Å²	89	26%	0.259	47%	0.469	S	S	.	.			trans	-124.7	119.7	-176.7	179.1	-94.6	0	0	0	110.5	V100 E245 F293 G314 R316	V100-Y291 HydrophobicContact CB-CE1 4.36Å; V100-Y291 HydrophobicContact CG1-CD1 4.28Å; V100-Y291 HydrophobicContact CG1-CE1 3.84Å; V100-Y291 HydrophobicContact CG2-CE1 3.55Å; E245-Y291 PolarHBondContact O-N 3.4Å; Y291-F293 AromaticContact CE1-CD1 3.93Å; Y291-F293 HydrophobicContact CE1-CD1 3.93Å; Y291-F293 HydrophobicContact CE1-CE1 4.38Å; Y291-G314 PolarHBondContact O-N 3.49Å; Y291-R316 HydrophobicContact CD1-CB 4.41Å; Y291-R316 HydrophobicContact CE1-CB 4.4Å
292	N	91.9	Very high	78	Confident	55 Å²	55	90.1 Å²	90.1	29%	0.294	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	154.6	177	67.1	91.2	0	0	0	112.2	V312 F313	N292-V312 CarbonylContact C-O 3.57Å; N292-V312 WeakPolarHBondContact CA-O 3.38Å; N292-V312 VanDerWaalsContact CB-O 3.23Å; N292-V312 WeakPolarHBondContact CB-O 3.46Å; N292-F313 HydrophobicContact CB-CD1 3.56Å; N292-F313 HydrophobicContact CB-CE1 3.76Å; N292-F313 HydrophobicContact CB-CG 4.22Å
293	F	94	Very high	80.2	Confident	50 Å²	50	94.1 Å²	94.1	22%	0.219	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	163.9	173	68.3	-82.1	0	0	0	110.5	F91 V100 Y291 Y295 V312	F91-F293 HydrophobicContact CB-CZ 4.11Å; F91-F293 HydrophobicContact CD1-CE2 4.44Å; F91-F293 HydrophobicContact CD1-CZ 4.18Å; F91-F293 HydrophobicContact CD2-CE1 4.47Å; F91-F293 AromaticContact CD2-CZ 3.72Å; F91-F293 HydrophobicContact CD2-CZ 3.72Å; F91-F293 HydrophobicContact CE2-CZ 4.14Å; F91-F293 HydrophobicContact CG-CE2 4.41Å; F91-F293 AromaticContact CG-CZ 3.73Å; F91-F293 HydrophobicContact CG-CZ 3.73Å; V100-F293 HydrophobicContact CB-CE1 4.46Å; V100-F293 HydrophobicContact CG1-CE1 4.06Å; Y291-F293 AromaticContact CE1-CD1 3.93Å; Y291-F293 HydrophobicContact CE1-CD1 3.93Å; Y291-F293 HydrophobicContact CE1-CE1 4.38Å; F293-Y295 AromaticContact CE2-CD1 3.9Å; F293-Y295 HydrophobicContact CE2-CD1 3.9Å; F293-V312 HydrophobicContact CD1-CB 4.17Å; F293-V312 HydrophobicContact CD1-CG1 4.32Å; F293-V312 HydrophobicContact CE1-CB 3.73Å; F293-V312 HydrophobicContact CE1-CG1 3.56Å; F293-V312 HydrophobicContact CE2-CB 4.3Å; F293-V312 HydrophobicContact CE2-CG2 4.35Å; F293-V312 HydrophobicContact CZ-CB 3.8Å; F293-V312 HydrophobicContact CZ-CG1 3.82Å; F293-V312 HydrophobicContact CZ-CG2 4.08Å; F293-V312 PolarHBondContact N-O 2.84Å; F293-V312 PolarHBondContact O-N 2.67Å
294	R	94.8	Very high	82.5	Confident	111 Å²	111	91.5 Å²	91.5	42%	0.419	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.8	178.2	-69.3	177.2	177.1	92.1	-6.3	110.6	E164 D166 L309 L310 K311	E164-R294 VanDerWaalsContact CD-NE 3.34Å; E164-R294 IonicContact OE1-CZ 2.99Å; E164-R294 IonicContact OE1-NE 3.03Å; E164-R294 PolarHBondContact OE1-NE 2.84Å; E164-R294 IonicContact OE1-NH2 3.5Å; E164-R294 PolarHBondContact OE1-NH2 2.98Å; E164-R294 WeakPolarHBondContact OE2-CD 3.42Å; E164-R294 IonicContact OE2-CZ 2.84Å; E164-R294 IonicContact OE2-NE 2.8Å; E164-R294 PolarHBondContact OE2-NE 2.91Å; E164-R294 IonicContact OE2-NH2 3.7Å; D166-R294 IonicContact OD2-NH2 3.93Å; D166-R294 PolarHBondContact OD2-NH2 2.93Å; R294-L309 HydrophobicContact CB-CD1 4.4Å; R294-L310 VanDerWaalsContact CA-O 3.27Å; R294-L310 WeakPolarHBondContact CA-O 3.16Å; R294-K311 HydrophobicContact CG-CB 3.94Å; R294-K311 HydrophobicContact CG-CG 4Å
295	Y	95.6	Very high	84.8	Confident	50 Å²	50	91.3 Å²	91.3	20%	0.196	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160.2	169.5	80.2	-83	0	0	0	110.1	F91 F293 K297 L310 V312	F91-Y295 HydrophobicContact CE1-CD1 4.37Å; F91-Y295 AromaticContact CE1-CE1 3.87Å; F91-Y295 HydrophobicContact CE1-CE1 3.87Å; F91-Y295 HydrophobicContact CE1-CE2 4.44Å; F91-Y295 AromaticContact CE1-CZ 3.9Å; F91-Y295 AromaticContact CZ-CE1 3.7Å; F91-Y295 HydrophobicContact CZ-CE1 3.7Å; F91-Y295 AromaticContact CZ-CZ 3.86Å; F293-Y295 AromaticContact CE2-CD1 3.9Å; F293-Y295 HydrophobicContact CE2-CD1 3.9Å; Y295-K297 HydrophobicContact CE2-CD 4.45Å; Y295-K297 HydrophobicContact CE2-CG 3.92Å; Y295-K297 WeakPolarHBondContact OH-CE 3.5Å; Y295-L310 HydrophobicContact CD1-CB 4.04Å; Y295-L310 HydrophobicContact CE1-CB 3.66Å; Y295-L310 HydrophobicContact CE1-CD1 4.37Å; Y295-L310 HydrophobicContact CE1-CD2 4.26Å; Y295-L310 HydrophobicContact CE1-CG 4.31Å; Y295-L310 HydrophobicContact CE2-CD1 4.06Å; Y295-L310 PolarHBondContact N-O 2.91Å; Y295-L310 PolarHBondContact O-N 2.96Å; Y295-V312 HydrophobicContact CD1-CG2 3.84Å; Y295-V312 HydrophobicContact CE1-CG2 3.48Å; Y295-V312 VanDerWaalsContact CE1-CG2 3.48Å
296	A	96.3	Very high	87	Confident	27 Å²	27	90.8 Å²	90.8	22%	0.223	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.3	-178.2	0	0	0	0	0	111.5	Y298 R307 T308 L309	A296-Y298 HydrophobicContact CB-CD2 4.44Å; A296-Y298 HydrophobicContact CB-CE2 3.86Å; A296-R307 HydrophobicContact CB-CB 4.4Å; A296-R307 HydrophobicContact CB-CG 4.44Å; A296-T308 CarbonylContact C-O 3.55Å; A296-T308 VanDerWaalsContact CA-O 3.32Å; A296-T308 WeakPolarHBondContact CA-O 3.44Å; A296-L309 HydrophobicContact CB-CD1 4.27Å
297	K	95.3	Very high	89.2	Confident	92 Å²	92	82.2 Å²	82.2	40%	0.4	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.5	169.8	-61.7	-176.8	-179.9	-175.7	0	107.9	D88 Y295 R307 T308 L310	D88-K297 IonicContact OD1-NZ 3.67Å; Y295-K297 HydrophobicContact CE2-CD 4.45Å; Y295-K297 HydrophobicContact CE2-CG 3.92Å; Y295-K297 WeakPolarHBondContact OH-CE 3.5Å; K297-R307 CarbonylContact O-C 3.49Å; K297-R307 VanDerWaalsContact O-CA 3.24Å; K297-R307 WeakPolarHBondContact O-CA 3.3Å; K297-T308 PolarHBondContact N-O 3.04Å; K297-T308 PolarHBondContact O-N 3.12Å; K297-L310 HydrophobicContact CD-CD1 4.35Å; K297-L310 HydrophobicContact CG-CD1 4.23Å
298	Y	96.4	Very high	91.1	Very high	149 Å²	149	78.3 Å²	78.3	58%	0.584	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	139.4	-178.6	-67.9	-87.9	0	0	0	111.2	W160 A296 R307	W160-Y298 HydrophobicContact CH2-CD1 4.38Å; W160-Y298 HydrophobicContact CH2-CE1 4.04Å; W160-Y298 AromaticContact CZ2-CE1 3.94Å; W160-Y298 HydrophobicContact CZ2-CE1 3.94Å; A296-Y298 HydrophobicContact CB-CD2 4.44Å; A296-Y298 HydrophobicContact CB-CE2 3.86Å; Y298-R307 HydrophobicContact CD1-CB 3.66Å; Y298-R307 HydrophobicContact CE1-CB 3.88Å; Y298-R307 HydrophobicContact CE1-CG 4.33Å; Y298-R307 HydrophobicContact CG-CB 4.22Å; Y298-R307 PolarHBondContact OH-NH1 3.34Å
299	Y	96.2	Very high	92.9	Very high	82 Å²	82	75.9 Å²	75.9	32%	0.322	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	170.4	177.4	60.5	-86	0	0	0	111.4	G110 E301 K306 T308	G110-Y299 WeakPolarHBondContact CA-OH 3.32Å; G110-Y299 PolarHBondContact N-OH 2.97Å; Y299-E301 HydrophobicContact CD2-CB 4.32Å; Y299-E301 HydrophobicContact CE2-CB 4.21Å; Y299-K306 HydrophobicContact CD2-CB 4.01Å; Y299-K306 HydrophobicContact CE1-CB 4.22Å; Y299-K306 HydrophobicContact CE2-CB 3.52Å; Y299-K306 HydrophobicContact CE2-CD 4.01Å; Y299-K306 HydrophobicContact CE2-CG 4.32Å; Y299-K306 PolarHBondContact N-O 3.43Å; Y299-K306 CarbonylContact O-C 3.55Å; Y299-K306 PolarHBondContact O-N 3.5Å; Y299-T308 WeakPolarHBondContact CE1-OG1 3.44Å
300	M	95.6	Very high	94.1	Very high	126 Å²	126	71.7 Å²	71.7	62%	0.621	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.9	175.7	-71.1	-73.9	-79.6	0	0	108.8	K303 P305	M300-K303 WeakPolarHBondContact CE-O 3.3Å; M300-P305 WeakPolarHBondContact SD-CA 3.33Å; M300-P305 HydrophobicContact SD-CB 3.72Å
301	E	94.4	Very high	94.9	Very high	86 Å²	86	72.3 Å²	72.3	40%	0.402	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126.1	174.8	-171.2	176.8	-152.7	0	0	107.9	Y299 K303 I304 K306	Y299-E301 HydrophobicContact CD2-CB 4.32Å; Y299-E301 HydrophobicContact CE2-CB 4.21Å; E301-K303 PolarHBondContact O-N 3.13Å; E301-I304 PolarHBondContact N-O 3.4Å; E301-I304 VanDerWaalsContact N-O 3.08Å; E301-I304 WeakPolarHBondContact O-CA 3.42Å; E301-I304 WeakPolarHBondContact O-CB 3.35Å; E301-I304 PolarHBondContact O-N 3.06Å; E301-K306 HydrophobicContact CB-CD 4.08Å; E301-K306 WeakPolarHBondContact OE2-CD 3.26Å; E301-K306 WeakPolarHBondContact OE2-CE 3.31Å; E301-K306 IonicContact OE2-NZ 2.63Å; E301-K306 PolarHBondContact OE2-NZ 3.02Å
302	D	93.8	Very high	95.3	Very high	142 Å²	142	69.2 Å²	69.2	76%	0.759	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	38.5	-176.3	-57.7	-39.9	0	0	0	114.6	I304	D302-I304 PolarHBondContact O-N 3.05Å; D302-I304 VanDerWaalsContact O-N 3.17Å
303	K	94.4	Very high	95.4	Very high	196 Å²	196	66.8 Å²	66.8	85%	0.852	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	9.7	-174.1	-52.3	175.8	-179.5	174.9	0	114.7	M300 E301	M300-K303 WeakPolarHBondContact CE-O 3.3Å; E301-K303 PolarHBondContact O-N 3.13Å
304	I	94.6	Very high	95.4	Very high	79 Å²	79	64.4 Å²	64.4	41%	0.405	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126	175.3	-59.6	172.3	0	0	0	108.3	K112 E301 D302 K306	K112-I304 HydrophobicContact CB-CG2 4.44Å; E301-I304 PolarHBondContact N-O 3.4Å; E301-I304 VanDerWaalsContact N-O 3.08Å; E301-I304 WeakPolarHBondContact O-CA 3.42Å; E301-I304 WeakPolarHBondContact O-CB 3.35Å; E301-I304 PolarHBondContact O-N 3.06Å; D302-I304 PolarHBondContact O-N 3.05Å; D302-I304 VanDerWaalsContact O-N 3.17Å; I304-K306 HydrophobicContact CG2-CG 4.42Å; I304-K306 PolarHBondContact O-N 2.92Å
305	P	95.6	Very high	95.4	Very high	75 Å²	75	59.1 Å²	59.1	49%	0.487	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	124.4	173.9	27.4	-32.7	0	0	0	110.1	M300	M300-P305 WeakPolarHBondContact SD-CA 3.33Å; M300-P305 HydrophobicContact SD-CB 3.72Å
306	K	97	Very high	95.3	Very high	38 Å²	38	61 Å²	61	17%	0.165	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	165.5	177.4	-65.4	-168.5	-173.8	177.8	0	110.8	Q111 K112 Y299 E301 I304	Q111-K306 CarbonylContact O-C 3.57Å; Q111-K306 WeakPolarHBondContact O-CA 3.37Å; Q111-K306 WeakPolarHBondContact O-CB 3.43Å; K112-K306 HydrophobicContact CB-CG 4.24Å; Y299-K306 HydrophobicContact CD2-CB 4.01Å; Y299-K306 HydrophobicContact CE1-CB 4.22Å; Y299-K306 HydrophobicContact CE2-CB 3.52Å; Y299-K306 HydrophobicContact CE2-CD 4.01Å; Y299-K306 HydrophobicContact CE2-CG 4.32Å; Y299-K306 PolarHBondContact N-O 3.43Å; Y299-K306 CarbonylContact O-C 3.55Å; Y299-K306 PolarHBondContact O-N 3.5Å; E301-K306 HydrophobicContact CB-CD 4.08Å; E301-K306 WeakPolarHBondContact OE2-CD 3.26Å; E301-K306 WeakPolarHBondContact OE2-CE 3.31Å; E301-K306 IonicContact OE2-NZ 2.63Å; E301-K306 PolarHBondContact OE2-NZ 3.02Å; I304-K306 HydrophobicContact CG2-CG 4.42Å; I304-K306 PolarHBondContact O-N 2.92Å
307	R	96.9	Very high	95.3	Very high	39 Å²	39	59.7 Å²	59.7	15%	0.147	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	154.4	169.2	74.1	-175.3	-166.5	177.4	-0.2	111.1	Q111 W160 A296 K297 Y298	Q111-R307 HydrophobicContact CB-CG 3.85Å; Q111-R307 WeakPolarHBondContact CB-O 3.32Å; Q111-R307 PolarHBondContact N-O 2.97Å; Q111-R307 PolarHBondContact O-N 3.12Å; W160-R307 VanDerWaalsContact CD1-NH2 3.27Å; W160-R307 HydrophobicContact CD2-CG 4.09Å; W160-R307 HydrophobicContact CE3-CG 3.66Å; W160-R307 VanDerWaalsContact CG-NE 3.3Å; W160-R307 VanDerWaalsContact CG-NH2 3.3Å; W160-R307 HydrophobicContact CH2-CG 4.47Å; W160-R307 HydrophobicContact CZ3-CB 4.29Å; W160-R307 HydrophobicContact CZ3-CG 3.88Å; A296-R307 HydrophobicContact CB-CB 4.4Å; A296-R307 HydrophobicContact CB-CG 4.44Å; K297-R307 CarbonylContact O-C 3.49Å; K297-R307 VanDerWaalsContact O-CA 3.24Å; K297-R307 WeakPolarHBondContact O-CA 3.3Å; Y298-R307 HydrophobicContact CD1-CB 3.66Å; Y298-R307 HydrophobicContact CE1-CB 3.88Å; Y298-R307 HydrophobicContact CE1-CG 4.33Å; Y298-R307 HydrophobicContact CG-CB 4.22Å; Y298-R307 PolarHBondContact OH-NH1 3.34Å
308	T	95.7	Very high	95.3	Very high	20 Å²	20	56.8 Å²	56.8	12%	0.123	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.7	164.6	-65.4	0	0	0	0	107.2	I107 T108 E109 A296 K297 Y299 L310	I107-T308 HydrophobicContact CD1-CG2 3.8Å; I107-T308 HydrophobicContact CG1-CG2 3.6Å; T108-T308 WeakPolarHBondContact O-CA 3.46Å; E109-T308 HydrophobicContact CG-CG2 3.98Å; A296-T308 CarbonylContact C-O 3.55Å; A296-T308 VanDerWaalsContact CA-O 3.32Å; A296-T308 WeakPolarHBondContact CA-O 3.44Å; K297-T308 PolarHBondContact N-O 3.04Å; K297-T308 PolarHBondContact O-N 3.12Å; Y299-T308 WeakPolarHBondContact CE1-OG1 3.44Å; T308-L310 HydrophobicContact CG2-CD1 4Å
309	L	96.7	Very high	95.3	Very high	16 Å²	16	50.1 Å²	50.1	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.5	178.4	179.9	68.3	0	0	0	109.1	T108 E164 R294 A296	T108-L309 PolarHBondContact N-O 2.85Å; T108-L309 PolarHBondContact O-N 3.09Å; E164-L309 HydrophobicContact CB-CD2 4.03Å; E164-L309 HydrophobicContact CG-CD2 4.48Å; E164-L309 WeakPolarHBondContact OE2-CD2 3.44Å; R294-L309 HydrophobicContact CB-CD1 4.4Å; A296-L309 HydrophobicContact CB-CD1 4.27Å
310	L	94.8	Very high	95.3	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.9	175.1	-65.1	94.6	0	0	0	109	W84 I106 I107 R294 Y295 K297 T308 V312	W84-L310 HydrophobicContact CH2-CD2 4.47Å; I106-L310 WeakPolarHBondContact O-CA 3.37Å; I107-L310 HydrophobicContact CD1-CD2 4.36Å; I107-L310 HydrophobicContact CG1-CG 4.23Å; R294-L310 VanDerWaalsContact CA-O 3.27Å; R294-L310 WeakPolarHBondContact CA-O 3.16Å; Y295-L310 HydrophobicContact CD1-CB 4.04Å; Y295-L310 HydrophobicContact CE1-CB 3.66Å; Y295-L310 HydrophobicContact CE1-CD1 4.37Å; Y295-L310 HydrophobicContact CE1-CD2 4.26Å; Y295-L310 HydrophobicContact CE1-CG 4.31Å; Y295-L310 HydrophobicContact CE2-CD1 4.06Å; Y295-L310 PolarHBondContact N-O 2.91Å; Y295-L310 PolarHBondContact O-N 2.96Å; K297-L310 HydrophobicContact CD-CD1 4.35Å; K297-L310 HydrophobicContact CG-CD1 4.23Å; T308-L310 HydrophobicContact CG2-CD1 4Å; L310-V312 HydrophobicContact CB-CG2 4.43Å
311	K	95.4	Very high	95.3	Very high	18 Å²	18	45.2 Å²	45.2	8%	0.078	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112	162	-176.4	-177.7	-172.5	177.9	0	107.7	F105 I106 E164 D166 R294 F313	F105-K311 CarbonylContact C-O 3.51Å; F105-K311 VanDerWaalsContact CA-O 3.22Å; F105-K311 WeakPolarHBondContact CA-O 3.08Å; I106-K311 HydrophobicContact CB-CB 4.32Å; I106-K311 HydrophobicContact CD1-CD 4.5Å; I106-K311 PolarHBondContact N-O 3.37Å; I106-K311 PolarHBondContact O-N 3.1Å; E164-K311 WeakPolarHBondContact OE1-CD 3.47Å; D166-K311 HydrophobicContact CB-CD 4.33Å; D166-K311 IonicContact OD2-NZ 3.37Å; D166-K311 PolarHBondContact OD2-NZ 3Å; R294-K311 HydrophobicContact CG-CB 3.94Å; R294-K311 HydrophobicContact CG-CG 4Å; K311-F313 HydrophobicContact CD-CE2 4.07Å; K311-F313 HydrophobicContact CD-CZ 3.76Å; K311-F313 HydrophobicContact CG-CE2 4.07Å; K311-F313 HydrophobicContact CG-CZ 4.12Å
312	V	95.2	Very high	95.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.1	-176.9	174.8	0	0	0	0	109.5	F91 M102 N292 F293 Y295 L310	F91-V312 HydrophobicContact CE2-CG1 4.48Å; M102-V312 HydrophobicContact CB-CG1 3.69Å; M102-V312 HydrophobicContact CG-CG1 3.71Å; M102-V312 HydrophobicContact SD-CG1 4.06Å; M102-V312 HydrophobicContact SD-CG2 3.89Å; N292-V312 CarbonylContact C-O 3.57Å; N292-V312 WeakPolarHBondContact CA-O 3.38Å; N292-V312 VanDerWaalsContact CB-O 3.23Å; N292-V312 WeakPolarHBondContact CB-O 3.46Å; F293-V312 HydrophobicContact CD1-CB 4.17Å; F293-V312 HydrophobicContact CD1-CG1 4.32Å; F293-V312 HydrophobicContact CE1-CB 3.73Å; F293-V312 HydrophobicContact CE1-CG1 3.56Å; F293-V312 HydrophobicContact CE2-CB 4.3Å; F293-V312 HydrophobicContact CE2-CG2 4.35Å; F293-V312 HydrophobicContact CZ-CB 3.8Å; F293-V312 HydrophobicContact CZ-CG1 3.82Å; F293-V312 HydrophobicContact CZ-CG2 4.08Å; F293-V312 PolarHBondContact N-O 2.84Å; F293-V312 PolarHBondContact O-N 2.67Å; Y295-V312 HydrophobicContact CD1-CG2 3.84Å; Y295-V312 HydrophobicContact CE1-CG2 3.48Å; Y295-V312 VanDerWaalsContact CE1-CG2 3.48Å; L310-V312 HydrophobicContact CB-CG2 4.43Å
313	F	94.4	Very high	95.5	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.4	164.2	-54.7	-94.5	0	0	0	107.7	T103 N104 I106 I169 N292 K311	T103-F313 PolarHBondContact N-O 2.81Å; T103-F313 PolarHBondContact OG1-O 3.46Å; N104-F313 HydrophobicContact CB-CB 4.09Å; N104-F313 PolarHBondContact N-O 3.37Å; N104-F313 VanDerWaalsContact N-O 3.1Å; N104-F313 CarbonylContact O-C 3.54Å; N104-F313 PolarHBondContact O-N 3.06Å; I106-F313 HydrophobicContact CD1-CE2 4.03Å; I106-F313 HydrophobicContact CD1-CZ 4.37Å; I106-F313 HydrophobicContact CG1-CE2 4.13Å; I169-F313 HydrophobicContact CD1-CE1 3.82Å; I169-F313 HydrophobicContact CD1-CZ 3.86Å; I169-F313 HydrophobicContact CG1-CE1 4.38Å; I169-F313 HydrophobicContact CG1-CE2 4.49Å; I169-F313 HydrophobicContact CG1-CZ 3.91Å; I169-F313 HydrophobicContact CG2-CE2 4.35Å; I169-F313 HydrophobicContact CG2-CZ 4.41Å; N292-F313 HydrophobicContact CB-CD1 3.56Å; N292-F313 HydrophobicContact CB-CE1 3.76Å; N292-F313 HydrophobicContact CB-CG 4.22Å; K311-F313 HydrophobicContact CD-CE2 4.07Å; K311-F313 HydrophobicContact CD-CZ 3.76Å; K311-F313 HydrophobicContact CG-CE2 4.07Å; K311-F313 HydrophobicContact CG-CZ 4.12Å
314	G	93.5	Very high	95.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	170.8	-172.3	0	0	0	0	0	113.7	V101 G246 G247 Y291	V101-G314 CarbonylContact O-C 3.56Å; V101-G314 WeakPolarHBondContact O-CA 3.41Å; G246-G314 WeakPolarHBondContact CA-O 3.42Å; G247-G314 PolarHBondContact N-O 2.83Å; G247-G314 VanDerWaalsContact N-O 3.1Å; Y291-G314 PolarHBondContact O-N 3.49Å
315	I	94.8	Very high	95.6	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117.4	177.5	-50.9	173.4	0	0	0	107.4	V100 V101 T103 V232 F239 L242 G247 I249 F317	V100-I315 CarbonylContact C-O 3.56Å; V100-I315 WeakPolarHBondContact CA-O 3.27Å; V101-I315 PolarHBondContact N-O 2.91Å; V101-I315 PolarHBondContact O-N 2.85Å; T103-I315 HydrophobicContact CG2-CD1 4.02Å; T103-I315 HydrophobicContact CG2-CG1 4.02Å; V232-I315 HydrophobicContact CG2-CD1 3.97Å; F239-I315 HydrophobicContact CE2-CD1 4.04Å; L242-I315 HydrophobicContact CD2-CD1 3.79Å; L242-I315 HydrophobicContact CD2-CG1 3.94Å; L242-I315 HydrophobicContact CD2-CG2 4.03Å; L242-I315 HydrophobicContact CG-CD1 4.2Å; L242-I315 HydrophobicContact CG-CG1 4.01Å; G247-I315 WeakPolarHBondContact O-CA 3.43Å; I249-I315 HydrophobicContact CD1-CG2 3.98Å; I249-I315 HydrophobicContact CG1-CG2 4.21Å; I315-F317 HydrophobicContact CB-CE2 3.84Å; I315-F317 HydrophobicContact CB-CZ 4.03Å; I315-F317 HydrophobicContact CG2-CD1 4.48Å; I315-F317 HydrophobicContact CG2-CD2 4.26Å; I315-F317 HydrophobicContact CG2-CE1 3.93Å; I315-F317 HydrophobicContact CG2-CE2 3.67Å; I315-F317 HydrophobicContact CG2-CZ 3.49Å; I315-F317 VanDerWaalsContact CG2-CZ 3.49Å
316	R	94.8	Very high	95.6	Very high	89 Å²	89	29.6 Å²	29.6	34%	0.336	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	125.2	169.7	-178.1	-179.5	173.2	166.3	6.4	109.2	S98 F99 V100 G247 A248 I249 Y291 D318	S98-R316 PolarHBondContact OG-NE 3.48Å; S98-R316 PolarHBondContact OG-NH2 3.01Å; F99-R316 CarbonylContact O-C 3.58Å; F99-R316 WeakPolarHBondContact O-CA 3.39Å; V100-R316 HydrophobicContact CG2-CB 4.15Å; V100-R316 HydrophobicContact CG2-CG 4.25Å; G247-R316 PolarHBondContact O-N 3.22Å; A248-R316 CarbonylContact C-O 3.59Å; A248-R316 VanDerWaalsContact CA-O 3.29Å; A248-R316 WeakPolarHBondContact CA-O 3.44Å; A248-R316 HydrophobicContact CB-CB 4.18Å; I249-R316 PolarHBondContact N-O 2.91Å; Y291-R316 HydrophobicContact CD1-CB 4.41Å; Y291-R316 HydrophobicContact CE1-CB 4.4Å; R316-D318 IonicContact CZ-OD1 3.27Å; R316-D318 IonicContact CZ-OD2 3.35Å; R316-D318 IonicContact NE-OD1 3Å; R316-D318 PolarHBondContact NE-OD1 3.3Å; R316-D318 IonicContact NE-OD2 2.95Å; R316-D318 PolarHBondContact NE-OD2 2.99Å; R316-D318 IonicContact NH2-OD1 3.32Å; R316-D318 PolarHBondContact NH2-OD1 3.19Å
317	F	95.6	Very high	95.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.8	172	-65.2	-80.5	0	0	0	109.4	S98 F99 V101 L228 I231 I249 I251 I315	S98-F317 WeakPolarHBondContact CA-O 3.44Å; F99-F317 HydrophobicContact CD1-CB 4.42Å; F99-F317 HydrophobicContact CD2-CB 4.49Å; F99-F317 HydrophobicContact CD2-CD2 4.37Å; F99-F317 HydrophobicContact CE1-CB 3.82Å; F99-F317 HydrophobicContact CE2-CB 3.93Å; F99-F317 AromaticContact CE2-CD2 3.68Å; F99-F317 HydrophobicContact CE2-CD2 3.68Å; F99-F317 HydrophobicContact CE2-CG 4.12Å; F99-F317 HydrophobicContact CZ-CB 3.55Å; F99-F317 HydrophobicContact CZ-CD2 4.04Å; F99-F317 HydrophobicContact CZ-CG 4.01Å; F99-F317 PolarHBondContact N-O 3.38Å; F99-F317 PolarHBondContact O-N 3.35Å; V101-F317 HydrophobicContact CB-CE2 4.2Å; V101-F317 HydrophobicContact CG2-CD2 3.94Å; V101-F317 HydrophobicContact CG2-CE2 3.75Å; L228-F317 HydrophobicContact CD1-CE2 4.47Å; L228-F317 HydrophobicContact CD2-CE1 4.46Å; L228-F317 HydrophobicContact CD2-CE2 3.99Å; L228-F317 HydrophobicContact CD2-CZ 3.77Å; I231-F317 HydrophobicContact CB-CE1 4.47Å; I231-F317 HydrophobicContact CD1-CE1 4.41Å; I231-F317 HydrophobicContact CG2-CD1 4.3Å; I231-F317 HydrophobicContact CG2-CE1 3.71Å; I249-F317 HydrophobicContact CB-CD1 4Å; I249-F317 HydrophobicContact CB-CE1 4.09Å; I249-F317 HydrophobicContact CD1-CE1 4.05Å; I249-F317 HydrophobicContact CG2-CD1 4.2Å; I249-F317 HydrophobicContact CG2-CE1 4.29Å; I249-F317 WeakPolarHBondContact O-CA 3.15Å; I251-F317 HydrophobicContact CD1-CB 4.4Å; I251-F317 HydrophobicContact CD1-CD1 3.94Å; I251-F317 HydrophobicContact CD1-CG 4.49Å; I251-F317 HydrophobicContact CG1-CD1 4.34Å; I315-F317 HydrophobicContact CB-CE2 3.84Å; I315-F317 HydrophobicContact CB-CZ 4.03Å; I315-F317 HydrophobicContact CG2-CD1 4.48Å; I315-F317 HydrophobicContact CG2-CD2 4.26Å; I315-F317 HydrophobicContact CG2-CE1 3.93Å; I315-F317 HydrophobicContact CG2-CE2 3.67Å; I315-F317 HydrophobicContact CG2-CZ 3.49Å; I315-F317 VanDerWaalsContact CG2-CZ 3.49Å
318	D	95.6	Very high	95.4	Very high	30 Å²	30	35.4 Å²	35.4	16%	0.16	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.5	173	-64.4	-36	0	0	0	108.7	S98 I249 G250 I251 L275 R316 I320	S98-D318 VanDerWaalsContact CB-OD1 3.29Å; S98-D318 WeakPolarHBondContact CB-OD1 3.41Å; S98-D318 PolarHBondContact OG-OD1 3.13Å; I249-D318 PolarHBondContact O-N 2.91Å; G250-D318 CarbonylContact C-O 3.56Å; G250-D318 WeakPolarHBondContact CA-O 3.34Å; I251-D318 PolarHBondContact N-O 3.46Å; L275-D318 HydrophobicContact CD1-CB 4.31Å; R316-D318 IonicContact CZ-OD1 3.27Å; R316-D318 IonicContact CZ-OD2 3.35Å; R316-D318 IonicContact NE-OD1 3Å; R316-D318 PolarHBondContact NE-OD1 3.3Å; R316-D318 IonicContact NE-OD2 2.95Å; R316-D318 PolarHBondContact NE-OD2 2.99Å; R316-D318 IonicContact NH2-OD1 3.32Å; R316-D318 PolarHBondContact NH2-OD1 3.19Å; D318-I320 PolarHBondContact O-N 3.18Å
319	V	96.5	Very high	95.4	Very high	9 Å²	9	36.7 Å²	36.7	6%	0.055	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	106.8	176.4	-174.1	0	0	0	0	108.8	V65 T67 S97 F99 I185 I251 V253	V65-V319 HydrophobicContact CG1-CB 4Å; V65-V319 HydrophobicContact CG1-CG1 3.79Å; V65-V319 HydrophobicContact CG1-CG2 4.32Å; V65-V319 HydrophobicContact CG2-CG1 4.11Å; T67-V319 HydrophobicContact CG2-CG2 4.08Å; S97-V319 PolarHBondContact O-N 2.99Å; F99-V319 HydrophobicContact CE1-CG2 4.34Å; I185-V319 HydrophobicContact CD1-CG2 4.23Å; I185-V319 HydrophobicContact CG2-CG1 4.28Å; I251-V319 HydrophobicContact CB-CG2 4.44Å; I251-V319 HydrophobicContact CD1-CG2 4.45Å; I251-V319 CarbonylContact O-C 3.58Å; I251-V319 WeakPolarHBondContact O-CA 3.24Å; V253-V319 HydrophobicContact CG2-CG1 3.96Å
320	I	96.1	Very high	95.3	Very high	77 Å²	77	40.2 Å²	40.2	40%	0.395	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.2	-174.3	-58.8	165	0	0	0	108.3	I251 V252 V253 D318	I251-I320 PolarHBondContact O-N 3.03Å; V252-I320 CarbonylContact C-O 3.52Å; V252-I320 VanDerWaalsContact CA-O 3.27Å; V252-I320 WeakPolarHBondContact CA-O 3.36Å; V252-I320 HydrophobicContact CG2-CB 4.28Å; V253-I320 PolarHBondContact N-O 3.17Å; D318-I320 PolarHBondContact O-N 3.18Å
321	V	96.6	Very high	95.2	Very high	28 Å²	28	45.6 Å²	45.6	17%	0.17	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.2	177.6	-174.3	0	0	0	0	109.1	V65 N187 V189	V65-V321 HydrophobicContact CG2-CG2 3.52Å; N187-V321 WeakPolarHBondContact ND2-CG2 3.19Å; V189-V321 HydrophobicContact CG1-CG1 3.81Å
322	K	96.3	Very high	95.2	Very high	112 Å²	112	46.4 Å²	46.4	49%	0.487	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.1	170.4	179.8	177.9	164.8	-142.3	0	108	V252 V253 D254 W255	V252-K322 HydrophobicContact CG1-CB 4.21Å; V253-K322 PolarHBondContact O-N 3.03Å; D254-K322 CarbonylContact C-O 3.6Å; D254-K322 WeakPolarHBondContact CA-O 3.42Å; D254-K322 WeakPolarHBondContact OD2-CD 3.27Å; D254-K322 WeakPolarHBondContact OD2-CE 3.37Å; D254-K322 IonicContact OD2-NZ 2.7Å; D254-K322 PolarHBondContact OD2-NZ 3.43Å; W255-K322 PolarHBondContact N-O 3.37Å
323	S	95.4	Very high	95.1	Very high	23 Å²	23	47.1 Å²	47.1	16%	0.161	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	136.2	-178.8	62.2	0	0	0	0	111.6	A61	A61-S323 WeakPolarHBondContact CB-OG 3.49Å; A61-S323 PolarHBondContact N-OG 2.96Å
324	L	95.6	Very high	95.1	Very high	55 Å²	55	51.9 Å²	51.9	29%	0.288	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	107.8	173.3	-179.7	68.4	0	0	0	108	W255 T256 C257	W255-L324 PolarHBondContact O-N 3.24Å; T256-L324 CarbonylContact C-O 3.43Å; T256-L324 WeakPolarHBondContact CA-O 3.43Å; C257-L324 PolarHBondContact N-O 3.08Å
325	A	95.9	Very high	95.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	144.3	171	0	0	0	0	0	110.4	T58 D59 F191 F194 C257 F259	T58-A325 CarbonylContact C-O 3.6Å; T58-A325 VanDerWaalsContact CA-O 3.29Å; T58-A325 WeakPolarHBondContact CA-O 3.37Å; D59-A325 PolarHBondContact N-O 3.48Å; D59-A325 PolarHBondContact O-N 2.87Å; F191-A325 HydrophobicContact CD1-CB 3.32Å; F191-A325 HydrophobicContact CD2-CB 4.23Å; F191-A325 HydrophobicContact CE1-CB 3.28Å; F191-A325 HydrophobicContact CE2-CB 4.21Å; F191-A325 HydrophobicContact CG-CB 3.8Å; F191-A325 HydrophobicContact CZ-CB 3.75Å; F194-A325 HydrophobicContact CD2-CB 3.92Å; F194-A325 HydrophobicContact CE2-CB 3.7Å; C257-A325 CarbonylContact O-C 3.48Å; C257-A325 WeakPolarHBondContact O-CA 3.39Å; F259-A325 HydrophobicContact CD2-CB 3.76Å; F259-A325 HydrophobicContact CE2-CB 3.32Å; F259-A325 HydrophobicContact CZ-CB 4.1Å
326	R	95	Very high	95	Very high	60 Å²	60	56.8 Å²	56.8	23%	0.226	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.9	169.4	-51.6	-165	179.5	-171.1	-2.8	110.7	E52 Q56 S57 T58 C257 F259	E52-R326 PolarHBondContact O-NH1 3.27Å; Q56-R326 HydrophobicContact CB-CB 3.99Å; Q56-R326 HydrophobicContact CG-CB 4.42Å; S57-R326 VanDerWaalsContact O-CA 3.28Å; S57-R326 WeakPolarHBondContact O-CA 3.47Å; T58-R326 HydrophobicContact CG2-CG 4.03Å; C257-R326 PolarHBondContact O-N 3.16Å; F259-R326 PolarHBondContact N-O 3.22Å
327	K	95.3	Very high	94.9	Very high	84 Å²	84	56.4 Å²	56.4	37%	0.365	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	143	176.4	-168.6	178.4	178.8	-179.3	0	110.2	Q56 S57 F194 F259 D260 D329	Q56-K327 CarbonylContact C-O 3.6Å; Q56-K327 VanDerWaalsContact CA-O 3.26Å; Q56-K327 WeakPolarHBondContact CA-O 3.33Å; S57-K327 PolarHBondContact N-O 2.89Å; S57-K327 PolarHBondContact O-N 2.82Å; F194-K327 HydrophobicContact CB-CD 4.37Å; F194-K327 HydrophobicContact CD1-CB 3.89Å; F194-K327 HydrophobicContact CD1-CD 3.84Å; F194-K327 HydrophobicContact CD2-CB 4.41Å; F194-K327 HydrophobicContact CE1-CB 3.65Å; F194-K327 HydrophobicContact CE1-CD 4.4Å; F194-K327 HydrophobicContact CE2-CB 4.17Å; F194-K327 HydrophobicContact CG-CB 4.27Å; F194-K327 HydrophobicContact CG-CD 4.13Å; F194-K327 HydrophobicContact CZ-CB 3.8Å; F259-K327 HydrophobicContact CB-CB 4.09Å; F259-K327 HydrophobicContact CB-CD 4.27Å; F259-K327 HydrophobicContact CB-CG 4.06Å; D260-K327 WeakPolarHBondContact OD1-CA 3.07Å; K327-D329 PolarHBondContact O-N 2.63Å
328	F	95.1	Very high	94.8	Very high	115 Å²	115	58.6 Å²	58.6	50%	0.504	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	130.4	175.4	174	-93.3	0	0	0	110.6	Y55 D260 I330 T333	Y55-F328 HydrophobicContact CD2-CD2 4.01Å; D260-F328 WeakPolarHBondContact OD1-CB 3.37Å; D260-F328 PolarHBondContact OD1-N 3.43Å; F328-I330 HydrophobicContact CZ-CD1 4.49Å; F328-T333 HydrophobicContact CE2-CG2 4.49Å
329	D	94.7	Very high	94.6	Very high	48 Å²	48	60.3 Å²	60.3	26%	0.257	33%	0.325	S	S	.	.			trans	-140.4	133.3	175.3	-175.6	-11.6	0	0	0	109.3	Y55 K327 I331 P332 T333	Y55-D329 PolarHBondContact O-N 3.42Å; Y55-D329 VanDerWaalsContact O-N 3.13Å; K327-D329 PolarHBondContact O-N 2.63Å; D329-I331 VanDerWaalsContact C-N 3.29Å; D329-I331 PolarHBondContact O-N 3.14Å; D329-I331 PolarHBondContact OD1-N 3.05Å; D329-P332 HydrophobicContact CB-CG 3.68Å; D329-P332 WeakPolarHBondContact O-CD 3.46Å; D329-P332 WeakPolarHBondContact O-CG 3.17Å; D329-T333 WeakPolarHBondContact O-CB 3.3Å; D329-T333 PolarHBondContact O-N 3.27Å; D329-T333 PolarHBondContact O-OG1 2.97Å
330	I	94.3	Very high	94.3	Very high	90 Å²	90	60 Å²	60	46%	0.462	32%	0.324	S	S	.	.	H	α-helix	trans	-67.4	-30.9	-178.7	-168.4	59.4	0	0	0	111.9	F328 T333 L334	F328-I330 HydrophobicContact CZ-CD1 4.49Å; I330-T333 PolarHBondContact O-N 3.07Å; I330-L334 HydrophobicContact CD1-CD1 4.29Å; I330-L334 HydrophobicContact CD1-CD2 4.44Å; I330-L334 HydrophobicContact CD1-CG 4.01Å; I330-L334 HydrophobicContact CG1-CD1 3.87Å; I330-L334 HydrophobicContact CG1-CG 4.05Å; I330-L334 WeakPolarHBondContact O-CB 3.39Å; I330-L334 WeakPolarHBondContact O-CG 3.47Å; I330-L334 PolarHBondContact O-N 3.35Å
331	I	94	Very high	94.1	Very high	115 Å²	115	61 Å²	61	59%	0.59	33%	0.333	S	S	*	.	H	α-helix	trans	-64.6	-56.9	-177.9	-61.6	175.2	0	0	0	111.8	D329 T333 L334 T335	D329-I331 VanDerWaalsContact C-N 3.29Å; D329-I331 PolarHBondContact O-N 3.14Å; D329-I331 PolarHBondContact OD1-N 3.05Å; I331-T333 VanDerWaalsContact C-N 3.27Å; I331-T333 PolarHBondContact O-N 2.98Å; I331-L334 PolarHBondContact O-N 3.1Å; I331-T335 WeakPolarHBondContact O-CB 3.48Å; I331-T335 PolarHBondContact O-N 2.93Å; I331-T335 PolarHBondContact O-OG1 3.46Å
332	P	93.8	Very high	93.9	Very high	35 Å²	35	61.7 Å²	61.7	23%	0.227	35%	0.347	C	S	.	.	H	α-helix	trans	-65.1	-33.1	176.5	26.9	-34.8	0	0	0	111.5	G54 D329 T335 A336	G54-P332 CarbonylContact O-C 3.52Å; D329-P332 HydrophobicContact CB-CG 3.68Å; D329-P332 WeakPolarHBondContact O-CD 3.46Å; D329-P332 WeakPolarHBondContact O-CG 3.17Å; P332-T335 PolarHBondContact O-N 3.23Å; P332-A336 VanDerWaalsContact O-CB 3.3Å; P332-A336 WeakPolarHBondContact O-CB 3.49Å; P332-A336 PolarHBondContact O-N 2.94Å
333	T	94	Very high	93.7	Very high	15 Å²	15	59.5 Å²	59.5	9%	0.092	34%	0.339	C	S	.	.	H	α-helix	trans	-58.8	-53.4	174.2	-59.6	0	0	0	0	111.9	F49 Y55 F328 D329 I330 I331 T335 A336 I337	F49-T333 HydrophobicContact CE1-CG2 4.42Å; Y55-T333 VanDerWaalsContact CA-OG1 3.3Å; Y55-T333 WeakPolarHBondContact CA-OG1 3.37Å; Y55-T333 WeakPolarHBondContact CB-OG1 3.33Å; Y55-T333 PolarHBondContact O-OG1 3.49Å; F328-T333 HydrophobicContact CE2-CG2 4.49Å; D329-T333 WeakPolarHBondContact O-CB 3.3Å; D329-T333 PolarHBondContact O-N 3.27Å; D329-T333 PolarHBondContact O-OG1 2.97Å; I330-T333 PolarHBondContact O-N 3.07Å; I331-T333 VanDerWaalsContact C-N 3.27Å; I331-T333 PolarHBondContact O-N 2.98Å; T333-T335 VanDerWaalsContact C-N 3.29Å; T333-T335 PolarHBondContact O-N 2.91Å; T333-A336 PolarHBondContact O-N 3.25Å; T333-I337 HydrophobicContact CG2-CD1 4.09Å; T333-I337 VanDerWaalsContact O-CG1 3.31Å; T333-I337 WeakPolarHBondContact O-CG1 3.45Å; T333-I337 PolarHBondContact O-N 3.34Å
334	L	94.7	Very high	93.5	Very high	104 Å²	104	61.4 Å²	61.4	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-65.3	-34.9	179	-71.6	177.1	0	0	0	111.9	I330 I331 I337 G338	I330-L334 HydrophobicContact CD1-CD1 4.29Å; I330-L334 HydrophobicContact CD1-CD2 4.44Å; I330-L334 HydrophobicContact CD1-CG 4.01Å; I330-L334 HydrophobicContact CG1-CD1 3.87Å; I330-L334 HydrophobicContact CG1-CG 4.05Å; I330-L334 WeakPolarHBondContact O-CB 3.39Å; I330-L334 WeakPolarHBondContact O-CG 3.47Å; I330-L334 PolarHBondContact O-N 3.35Å; I331-L334 PolarHBondContact O-N 3.1Å; L334-I337 PolarHBondContact O-N 2.79Å; L334-G338 PolarHBondContact O-N 3.28Å
335	T	92.9	Very high	93.2	Very high	93 Å²	93	60.4 Å²	60.4	57%	0.571	35%	0.348	S	S	*	.	H	α-helix	trans	-65.3	-41.9	175.6	-54.8	0	0	0	0	111.4	I331 P332 T333 G338 S339	I331-T335 WeakPolarHBondContact O-CB 3.48Å; I331-T335 PolarHBondContact O-N 2.93Å; I331-T335 PolarHBondContact O-OG1 3.46Å; P332-T335 PolarHBondContact O-N 3.23Å; T333-T335 VanDerWaalsContact C-N 3.29Å; T333-T335 PolarHBondContact O-N 2.91Å; T335-G338 PolarHBondContact O-N 2.84Å; T335-S339 WeakPolarHBondContact O-CB 3.33Å; T335-S339 PolarHBondContact O-N 3.23Å; T335-S339 PolarHBondContact O-OG 3.41Å; T335-S339 VanDerWaalsContact O-OG 3.13Å
336	A	92.1	Very high	92.9	Very high	10 Å²	10	64.8 Å²	64.8	8%	0.083	37%	0.374	C	S	.	.	H	α-helix	trans	-68.2	-37.4	175.4	0	0	0	0	0	112.4	V48 F49 P332 T333 S339 G340	V48-A336 HydrophobicContact CG1-CB 4.33Å; F49-A336 HydrophobicContact CE1-CB 4.11Å; F49-A336 HydrophobicContact CE2-CB 4.35Å; F49-A336 HydrophobicContact CZ-CB 3.71Å; P332-A336 VanDerWaalsContact O-CB 3.3Å; P332-A336 WeakPolarHBondContact O-CB 3.49Å; P332-A336 PolarHBondContact O-N 2.94Å; T333-A336 PolarHBondContact O-N 3.25Å; A336-S339 WeakPolarHBondContact CA-OG 3.5Å; A336-S339 PolarHBondContact O-OG 3.24Å; A336-S339 VanDerWaalsContact O-OG 3.06Å; A336-G340 PolarHBondContact O-N 3.02Å
337	I	92.6	Very high	92.7	Very high	82 Å²	82	62.2 Å²	62.2	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-64.8	-48	172.5	-66.8	171.6	0	0	0	110	F49 T333 L334 S339 G340 V341	F49-I337 HydrophobicContact CZ-CG1 3.75Å; T333-I337 HydrophobicContact CG2-CD1 4.09Å; T333-I337 VanDerWaalsContact O-CG1 3.31Å; T333-I337 WeakPolarHBondContact O-CG1 3.45Å; T333-I337 PolarHBondContact O-N 3.34Å; L334-I337 PolarHBondContact O-N 2.79Å; I337-S339 PolarHBondContact O-N 3.26Å; I337-G340 PolarHBondContact O-N 2.68Å; I337-V341 HydrophobicContact CG2-CG2 4.4Å; I337-V341 WeakPolarHBondContact O-CG2 3.47Å; I337-V341 PolarHBondContact O-N 2.88Å
338	G	93.5	Very high	92.3	Very high	45 Å²	45	61.3 Å²	61.3	46%	0.464	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-46.1	-179.8	0	0	0	0	0	112.6	L334 T335 V341 G342	L334-G338 PolarHBondContact O-N 3.28Å; T335-G338 PolarHBondContact O-N 2.84Å; G338-V341 PolarHBondContact O-N 2.95Å; G338-G342 PolarHBondContact O-N 3.38Å
339	S	92.2	Very high	92	Very high	66 Å²	66	59.8 Å²	59.8	46%	0.462	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-40.5	174.5	65.4	0	0	0	0	111.9	T335 A336 I337 V341 G342 I343	T335-S339 WeakPolarHBondContact O-CB 3.33Å; T335-S339 PolarHBondContact O-N 3.23Å; T335-S339 PolarHBondContact O-OG 3.41Å; T335-S339 VanDerWaalsContact O-OG 3.13Å; A336-S339 WeakPolarHBondContact CA-OG 3.5Å; A336-S339 PolarHBondContact O-OG 3.24Å; A336-S339 VanDerWaalsContact O-OG 3.06Å; I337-S339 PolarHBondContact O-N 3.26Å; S339-V341 PolarHBondContact O-N 3.23Å; S339-G342 WeakPolarHBondContact O-CA 3.5Å; S339-G342 PolarHBondContact O-N 3.08Å; S339-G342 VanDerWaalsContact O-N 3.12Å; S339-I343 WeakPolarHBondContact O-CG1 3.38Å; S339-I343 PolarHBondContact O-N 2.92Å
340	G	90.9	Very high	91.7	Very high	4 Å²	4	60.4 Å²	60.4	4%	0.041	37%	0.373	C	S	.	.	H	α-helix	trans	-58.5	-45.8	174	0	0	0	0	0	113.2	I44 A336 I337 G342 I343 F344	I44-G340 WeakPolarHBondContact CD1-O 3.4Å; A336-G340 PolarHBondContact O-N 3.02Å; I337-G340 PolarHBondContact O-N 2.68Å; G340-G342 VanDerWaalsContact C-N 3.28Å; G340-G342 PolarHBondContact O-N 2.87Å; G340-I343 PolarHBondContact O-N 2.9Å; G340-I343 VanDerWaalsContact O-N 3.16Å; G340-F344 WeakPolarHBondContact O-CD2 3.4Å; G340-F344 PolarHBondContact O-N 2.91Å; G340-F344 VanDerWaalsContact O-N 3.08Å
341	V	91.2	Very high	91.4	Very high	96 Å²	96	56.6 Å²	56.6	58%	0.582	35%	0.354	S	S	*	.	H	α-helix	trans	-61.3	-37.9	174	172.5	0	0	0	0	111.1	I337 G338 S339 I343 F344 G345	I337-V341 HydrophobicContact CG2-CG2 4.4Å; I337-V341 WeakPolarHBondContact O-CG2 3.47Å; I337-V341 PolarHBondContact O-N 2.88Å; G338-V341 PolarHBondContact O-N 2.95Å; S339-V341 PolarHBondContact O-N 3.23Å; V341-I343 PolarHBondContact O-N 3.24Å; V341-F344 WeakPolarHBondContact O-CB 3.29Å; V341-F344 PolarHBondContact O-N 3.21Å; V341-G345 PolarHBondContact O-N 3.4Å
342	G	92.5	Very high	91.1	Very high	44 Å²	44	54.2 Å²	54.2	45%	0.454	34%	0.343	S	S	.	.	H	α-helix	trans	-58.4	-44.5	172.2	0	0	0	0	0	113.1	G338 S339 G340 F344 G345 V346	G338-G342 PolarHBondContact O-N 3.38Å; S339-G342 WeakPolarHBondContact O-CA 3.5Å; S339-G342 PolarHBondContact O-N 3.08Å; S339-G342 VanDerWaalsContact O-N 3.12Å; G340-G342 VanDerWaalsContact C-N 3.28Å; G340-G342 PolarHBondContact O-N 2.87Å; G342-F344 VanDerWaalsContact C-N 3.31Å; G342-F344 PolarHBondContact O-N 2.9Å; G342-G345 WeakPolarHBondContact O-CA 3.42Å; G342-G345 PolarHBondContact O-N 3.47Å; G342-V346 PolarHBondContact O-N 3.38Å
343	I	91.8	Very high	90.8	Very high	65 Å²	65	56.8 Å²	56.8	33%	0.333	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-35.8	177.5	-61.4	167.5	0	0	0	111.1	V40 S339 G340 V341 G345 V346 A347	V40-I343 HydrophobicContact CG1-CB 4.43Å; V40-I343 HydrophobicContact CG1-CG2 3.67Å; S339-I343 WeakPolarHBondContact O-CG1 3.38Å; S339-I343 PolarHBondContact O-N 2.92Å; G340-I343 PolarHBondContact O-N 2.9Å; G340-I343 VanDerWaalsContact O-N 3.16Å; V341-I343 PolarHBondContact O-N 3.24Å; I343-G345 VanDerWaalsContact C-N 3.25Å; I343-G345 PolarHBondContact O-N 2.94Å; I343-V346 WeakPolarHBondContact O-CB 3.38Å; I343-V346 PolarHBondContact O-N 2.88Å; I343-V346 VanDerWaalsContact O-N 3.14Å; I343-A347 PolarHBondContact O-N 3.49Å
344	F	90.8	Very high	90.4	Very high	64 Å²	64	57.6 Å²	57.6	28%	0.281	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-36.6	170.9	-86.4	-73.7	0	0	0	112.6	Q37 V40 L41 I44 G340 V341 G342 A347 T348	Q37-F344 HydrophobicContact CB-CE1 4.46Å; Q37-F344 WeakPolarHBondContact O-CE1 3.25Å; V40-F344 HydrophobicContact CB-CE1 4.42Å; V40-F344 HydrophobicContact CG1-CD1 4.16Å; V40-F344 HydrophobicContact CG1-CD2 4.38Å; V40-F344 HydrophobicContact CG1-CE1 4.13Å; V40-F344 HydrophobicContact CG1-CE2 4.36Å; V40-F344 HydrophobicContact CG1-CG 4.28Å; V40-F344 HydrophobicContact CG1-CZ 4.22Å; L41-F344 HydrophobicContact CB-CE1 4.35Å; L41-F344 HydrophobicContact CB-CZ 3.74Å; L41-F344 HydrophobicContact CD1-CE2 4.19Å; L41-F344 HydrophobicContact CD1-CZ 3.69Å; L41-F344 HydrophobicContact CG-CZ 4.3Å; I44-F344 HydrophobicContact CD1-CD2 3.79Å; I44-F344 HydrophobicContact CD1-CE2 3.48Å; I44-F344 VanDerWaalsContact CD1-CE2 3.48Å; I44-F344 HydrophobicContact CD1-CZ 4.3Å; G340-F344 WeakPolarHBondContact O-CD2 3.4Å; G340-F344 PolarHBondContact O-N 2.91Å; G340-F344 VanDerWaalsContact O-N 3.08Å; V341-F344 WeakPolarHBondContact O-CB 3.29Å; V341-F344 PolarHBondContact O-N 3.21Å; G342-F344 VanDerWaalsContact C-N 3.31Å; G342-F344 PolarHBondContact O-N 2.9Å; F344-A347 WeakPolarHBondContact O-CB 3.4Å; F344-A347 PolarHBondContact O-N 3.32Å; F344-T348 PolarHBondContact O-N 3.23Å
345	G	89.5	Confident	89.9	Confident	34 Å²	34	53.3 Å²	53.3	35%	0.351	34%	0.336	S	S	.	.	H	α-helix	trans	-57.8	-47	172.1	0	0	0	0	0	112.1	V341 G342 I343 A347 T348 V349	V341-G345 PolarHBondContact O-N 3.4Å; G342-G345 WeakPolarHBondContact O-CA 3.42Å; G342-G345 PolarHBondContact O-N 3.47Å; I343-G345 VanDerWaalsContact C-N 3.25Å; I343-G345 PolarHBondContact O-N 2.94Å; G345-A347 VanDerWaalsContact C-N 3.29Å; G345-A347 PolarHBondContact O-N 2.92Å; G345-T348 PolarHBondContact O-N 3.26Å; G345-T348 PolarHBondContact O-OG1 3.49Å; G345-V349 PolarHBondContact O-N 3.46Å
346	V	90.8	Very high	89.4	Confident	91 Å²	91	49.3 Å²	49.3	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-60.5	-39.8	176.4	-178.8	0	0	0	0	111.4	G342 I343 T348 V349 V350	G342-V346 PolarHBondContact O-N 3.38Å; I343-V346 WeakPolarHBondContact O-CB 3.38Å; I343-V346 PolarHBondContact O-N 2.88Å; I343-V346 VanDerWaalsContact O-N 3.14Å; V346-T348 PolarHBondContact O-N 2.86Å; V346-V349 PolarHBondContact O-N 2.84Å; V346-V349 VanDerWaalsContact O-N 3.1Å; V346-V350 HydrophobicContact CG1-CG2 4.49Å; V346-V350 WeakPolarHBondContact O-CG2 3.45Å; V346-V350 PolarHBondContact O-N 3.43Å
347	A	89.4	Confident	89.1	Confident	6 Å²	6	55.6 Å²	55.6	5%	0.05	33%	0.334	C	S	.	.	H	α-helix	trans	-57.4	-37.8	175.9	0	0	0	0	0	112.1	I36 V40 I343 F344 G345 V350 C351	I36-A347 HydrophobicContact CG2-CB 4.24Å; V40-A347 HydrophobicContact CG2-CB 4.06Å; I343-A347 PolarHBondContact O-N 3.49Å; F344-A347 WeakPolarHBondContact O-CB 3.4Å; F344-A347 PolarHBondContact O-N 3.32Å; G345-A347 VanDerWaalsContact C-N 3.29Å; G345-A347 PolarHBondContact O-N 2.92Å; A347-V350 PolarHBondContact O-N 3.39Å; A347-C351 WeakPolarHBondContact O-CB 3.48Å; A347-C351 PolarHBondContact O-N 2.99Å; A347-C351 PolarHBondContact O-SG 3.4Å
348	T	87.4	Confident	88.5	Confident	66 Å²	66	58 Å²	58	41%	0.405	35%	0.347	S	S	.	.	H	α-helix	trans	-67.9	-38.6	176.5	67.9	0	0	0	0	112.7	F344 G345 V346 V350 C351 D352	F344-T348 PolarHBondContact O-N 3.23Å; G345-T348 PolarHBondContact O-N 3.26Å; G345-T348 PolarHBondContact O-OG1 3.49Å; V346-T348 PolarHBondContact O-N 2.86Å; T348-V350 VanDerWaalsContact C-N 3.34Å; T348-V350 PolarHBondContact O-N 3.49Å; T348-C351 WeakPolarHBondContact O-CB 3.27Å; T348-C351 PolarHBondContact O-N 3.05Å; T348-D352 WeakPolarHBondContact O-CB 3.32Å; T348-D352 PolarHBondContact O-N 3.32Å
349	V	89.6	Confident	87.9	Confident	82 Å²	82	57.6 Å²	57.6	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-42.3	174.3	178.2	0	0	0	0	110.7	G345 V346 D352 L353	G345-V349 PolarHBondContact O-N 3.46Å; V346-V349 PolarHBondContact O-N 2.84Å; V346-V349 VanDerWaalsContact O-N 3.1Å; V349-D352 WeakPolarHBondContact O-CB 3.4Å; V349-D352 PolarHBondContact O-N 3.4Å; V349-L353 WeakPolarHBondContact O-CG 3.44Å; V349-L353 PolarHBondContact O-N 2.87Å
350	V	88.6	Confident	87.1	Confident	62 Å²	62	60.5 Å²	60.5	38%	0.376	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-44.2	174.6	174.9	0	0	0	0	110.8	V346 A347 T348 D352 L353 V354	V346-V350 HydrophobicContact CG1-CG2 4.49Å; V346-V350 WeakPolarHBondContact O-CG2 3.45Å; V346-V350 PolarHBondContact O-N 3.43Å; A347-V350 PolarHBondContact O-N 3.39Å; T348-V350 VanDerWaalsContact C-N 3.34Å; T348-V350 PolarHBondContact O-N 3.49Å; V350-D352 VanDerWaalsContact C-N 3.28Å; V350-D352 PolarHBondContact O-N 3.26Å; V350-L353 PolarHBondContact O-N 3.39Å; V350-V354 HydrophobicContact CG1-CG2 4.47Å; V350-V354 VanDerWaalsContact O-CG2 3.29Å; V350-V354 WeakPolarHBondContact O-CG2 3.48Å; V350-V354 PolarHBondContact O-N 3.16Å
351	C	87.6	Confident	86.6	Confident	10 Å²	10	67.3 Å²	67.3	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-58.9	-40.4	175	-69.3	0	0	0	0	111.9	C33 A347 T348 V354 L355	C33-C351 VanDerWaalsContact CA-SG 3.57Å; C33-C351 HydrophobicContact CB-CB 4.09Å; C33-C351 VanDerWaalsContact CB-SG 3.53Å; C33-C351 VanDerWaalsContact SG-CB 3.55Å; A347-C351 WeakPolarHBondContact O-CB 3.48Å; A347-C351 PolarHBondContact O-N 2.99Å; A347-C351 PolarHBondContact O-SG 3.4Å; T348-C351 WeakPolarHBondContact O-CB 3.27Å; T348-C351 PolarHBondContact O-N 3.05Å; C351-V354 PolarHBondContact O-N 3.18Å; C351-L355 WeakPolarHBondContact O-CB 3.3Å; C351-L355 PolarHBondContact O-N 3.05Å
352	D	87.3	Confident	86	Confident	64 Å²	64	68.5 Å²	68.5	34%	0.342	37%	0.374	S	S	.	.	H	α-helix	trans	-64.7	-42.8	175.1	-89.4	-30	0	0	0	112.5	T348 V349 V350 V354 L355 L356 K369	T348-D352 WeakPolarHBondContact O-CB 3.32Å; T348-D352 PolarHBondContact O-N 3.32Å; V349-D352 WeakPolarHBondContact O-CB 3.4Å; V349-D352 PolarHBondContact O-N 3.4Å; V350-D352 VanDerWaalsContact C-N 3.28Å; V350-D352 PolarHBondContact O-N 3.26Å; D352-V354 VanDerWaalsContact C-N 3.34Å; D352-L355 WeakPolarHBondContact O-CB 3.38Å; D352-L355 PolarHBondContact O-N 3.48Å; D352-L356 WeakPolarHBondContact O-CB 3.35Å; D352-L356 VanDerWaalsContact O-CG 3.25Å; D352-L356 WeakPolarHBondContact O-CG 3.26Å; D352-L356 PolarHBondContact O-N 2.9Å; D352-K369 IonicContact OD1-NZ 3.45Å; D352-K369 PolarHBondContact OD1-NZ 3.42Å; D352-K369 IonicContact OD2-NZ 3.71Å; D352-K369 PolarHBondContact OD2-NZ 3.06Å
353	L	87.1	Confident	85.3	Confident	90 Å²	90	71.2 Å²	71.2	47%	0.471	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-43.2	174.4	-70.9	173.6	0	0	0	111.1	V349 V350 L355 L356 Y357	V349-L353 WeakPolarHBondContact O-CG 3.44Å; V349-L353 PolarHBondContact O-N 2.87Å; V350-L353 PolarHBondContact O-N 3.39Å; L353-L355 VanDerWaalsContact C-N 3.33Å; L353-L355 PolarHBondContact O-N 3.49Å; L353-L356 PolarHBondContact O-N 3.36Å; L353-Y357 HydrophobicContact CD2-CD2 4Å; L353-Y357 HydrophobicContact CD2-CE2 3.85Å; L353-Y357 WeakPolarHBondContact O-CB 3.39Å; L353-Y357 WeakPolarHBondContact O-CD2 3.44Å; L353-Y357 PolarHBondContact O-N 3.1Å
354	V	85.4	Confident	84.8	Confident	32 Å²	32	73.6 Å²	73.6	19%	0.194	38%	0.383	C	S	.	.	I	π-helix	trans	-60.8	-44.5	174.7	174.1	0	0	0	0	110.9	V32 V350 C351 D352 L356 L358 L359	V32-V354 HydrophobicContact CG1-CG1 4.34Å; V350-V354 HydrophobicContact CG1-CG2 4.47Å; V350-V354 VanDerWaalsContact O-CG2 3.29Å; V350-V354 WeakPolarHBondContact O-CG2 3.48Å; V350-V354 PolarHBondContact O-N 3.16Å; C351-V354 PolarHBondContact O-N 3.18Å; D352-V354 VanDerWaalsContact C-N 3.34Å; V354-L356 PolarHBondContact O-N 3.31Å; V354-L358 HydrophobicContact CB-CD1 4.24Å; V354-L358 HydrophobicContact CG1-CB 4.32Å; V354-L358 HydrophobicContact CG1-CD1 4.35Å; V354-L358 HydrophobicContact CG2-CD1 3.84Å; V354-L358 WeakPolarHBondContact O-CB 3.28Å; V354-L358 PolarHBondContact O-N 3.44Å; V354-L358 VanDerWaalsContact O-N 3.1Å; V354-L359 PolarHBondContact O-N 3.09Å
355	L	84.8	Confident	84.2	Confident	13 Å²	13	71.6 Å²	71.6	7%	0.068	37%	0.374	C	S	.	.	I	π-helix	trans	-60.6	-47.2	178.6	-175.5	95.1	0	0	0	112.1	V24 V29 C351 D352 L353 L359 Y365	V24-L355 HydrophobicContact CG1-CD1 4.13Å; V24-L355 HydrophobicContact CG2-CD1 4.35Å; V24-L355 HydrophobicContact CG2-CD2 4.32Å; V29-L355 HydrophobicContact CB-CD1 4.49Å; V29-L355 HydrophobicContact CG1-CD1 3.44Å; V29-L355 VanDerWaalsContact CG1-CD1 3.44Å; V29-L355 HydrophobicContact CG2-CD1 4.37Å; C351-L355 WeakPolarHBondContact O-CB 3.3Å; C351-L355 PolarHBondContact O-N 3.05Å; D352-L355 WeakPolarHBondContact O-CB 3.38Å; D352-L355 PolarHBondContact O-N 3.48Å; L353-L355 VanDerWaalsContact C-N 3.33Å; L353-L355 PolarHBondContact O-N 3.49Å; L355-L359 HydrophobicContact CB-CD1 4.38Å; L355-L359 HydrophobicContact CD1-CD1 3.81Å; L355-L359 HydrophobicContact CG-CD1 4.24Å; L355-Y365 HydrophobicContact CD1-CD1 4.44Å; L355-Y365 HydrophobicContact CD1-CD2 4.32Å; L355-Y365 HydrophobicContact CD1-CE2 4.49Å; L355-Y365 HydrophobicContact CD1-CG 4.29Å; L355-Y365 HydrophobicContact CD2-CG 4.3Å; L355-Y365 HydrophobicContact CG-CD2 4.32Å; L355-Y365 HydrophobicContact CG-CG 4.17Å
356	L	83.3	Confident	83.8	Confident	9 Å²	9	72 Å²	72	5%	0.047	37%	0.366	C	S	.	.	I	π-helix	trans	-85.1	-24.6	-169.7	-66	171.3	0	0	0	114	D352 L353 V354 R362 K366 K369 F370	D352-L356 WeakPolarHBondContact O-CB 3.35Å; D352-L356 VanDerWaalsContact O-CG 3.25Å; D352-L356 WeakPolarHBondContact O-CG 3.26Å; D352-L356 PolarHBondContact O-N 2.9Å; L353-L356 PolarHBondContact O-N 3.36Å; V354-L356 PolarHBondContact O-N 3.31Å; L356-R362 VanDerWaalsContact O-CB 3.28Å; L356-R362 WeakPolarHBondContact O-CB 3.16Å; L356-K366 HydrophobicContact CD2-CG 3.84Å; L356-K366 VanDerWaalsContact O-CE 3.27Å; L356-K366 WeakPolarHBondContact O-CE 3.23Å; L356-K369 HydrophobicContact CD1-CD 3.99Å; L356-K369 HydrophobicContact CD2-CD 4.14Å; L356-F370 HydrophobicContact CD1-CE2 4.06Å; L356-F370 HydrophobicContact CD1-CZ 4.2Å; L356-F370 HydrophobicContact CD2-CE2 4.3Å
357	Y	83.9	Confident	83.4	Confident	142 Å²	142	72.9 Å²	72.9	56%	0.557	37%	0.367	S	S	*	.	I	π-helix	trans	-117.2	-33.6	-173.4	-65.8	-83.7	0	0	0	114	L353	L353-Y357 HydrophobicContact CD2-CD2 4Å; L353-Y357 HydrophobicContact CD2-CE2 3.85Å; L353-Y357 WeakPolarHBondContact O-CB 3.39Å; L353-Y357 WeakPolarHBondContact O-CD2 3.44Å; L353-Y357 PolarHBondContact O-N 3.1Å
358	L	81.4	Confident	82.9	Confident	134 Å²	134	77.8 Å²	77.8	70%	0.702	39%	0.391	S	S	*	.	I	π-helix	trans	-98.1	-22.3	-171.6	-75.9	154.7	0	0	0	114.2	V354	V354-L358 HydrophobicContact CB-CD1 4.24Å; V354-L358 HydrophobicContact CG1-CB 4.32Å; V354-L358 HydrophobicContact CG1-CD1 4.35Å; V354-L358 HydrophobicContact CG2-CD1 3.84Å; V354-L358 WeakPolarHBondContact O-CB 3.28Å; V354-L358 PolarHBondContact O-N 3.44Å; V354-L358 VanDerWaalsContact O-N 3.1Å
359	L	80.8	Confident	82.6	Confident	36 Å²	36	78.2 Å²	78.2	19%	0.188	39%	0.387	C	S	.	.	S	Bend	trans	-81.7	145.3	-177.9	-69.1	174.4	0	0	0	113.6	V29 V354 L355 K361 R362 Y365	V29-L359 HydrophobicContact CB-CD1 4.34Å; V29-L359 HydrophobicContact CG1-CD1 4.21Å; V29-L359 HydrophobicContact CG2-CD1 3.26Å; V29-L359 HydrophobicContact CG2-CD2 4.09Å; V29-L359 HydrophobicContact CG2-CG 4.34Å; V354-L359 PolarHBondContact O-N 3.09Å; L355-L359 HydrophobicContact CB-CD1 4.38Å; L355-L359 HydrophobicContact CD1-CD1 3.81Å; L355-L359 HydrophobicContact CG-CD1 4.24Å; L359-K361 PolarHBondContact O-N 3.37Å; L359-K361 VanDerWaalsContact O-N 3.16Å; L359-R362 WeakPolarHBondContact O-CB 3.29Å; L359-R362 PolarHBondContact O-N 3.33Å; L359-R362 VanDerWaalsContact O-N 3.13Å; L359-Y365 HydrophobicContact CD1-CD2 4.43Å; L359-Y365 HydrophobicContact CD1-CE2 4.13Å
360	P	75.5	Confident	82.3	Confident	127 Å²	127	78.7 Å²	78.7	83%	0.825	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.4	-177.9	22.6	-31.9	0	0	0	114.3
361	K	79.3	Confident	81.8	Confident	147 Å²	147	83.7 Å²	83.7	64%	0.639	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	30.6	175.8	-66.1	-169.5	177	-173.3	0	113.2	L359 E363 F364 Y365	L359-K361 PolarHBondContact O-N 3.37Å; L359-K361 VanDerWaalsContact O-N 3.16Å; K361-E363 PolarHBondContact O-N 2.93Å; K361-F364 WeakPolarHBondContact O-CB 3.3Å; K361-F364 PolarHBondContact O-N 3.46Å; K361-Y365 HydrophobicContact CB-CD2 4.44Å; K361-Y365 HydrophobicContact CB-CE2 4Å; K361-Y365 VanDerWaalsContact O-CD2 3.23Å; K361-Y365 WeakPolarHBondContact O-CD2 3.47Å; K361-Y365 PolarHBondContact O-N 3.45Å
362	R	79.3	Confident	81.2	Confident	121 Å²	121	91.5 Å²	91.5	46%	0.457	43%	0.429	S	S	.	.	H	α-helix	trans	-55.5	-40.7	-174.6	59.9	-177.9	-170.9	-154.9	-3	115.4	L356 L359 F364 Y365 K366	L356-R362 VanDerWaalsContact O-CB 3.28Å; L356-R362 WeakPolarHBondContact O-CB 3.16Å; L359-R362 WeakPolarHBondContact O-CB 3.29Å; L359-R362 PolarHBondContact O-N 3.33Å; L359-R362 VanDerWaalsContact O-N 3.13Å; R362-F364 VanDerWaalsContact C-N 3.29Å; R362-F364 PolarHBondContact O-N 3.32Å; R362-Y365 PolarHBondContact O-N 2.89Å; R362-Y365 VanDerWaalsContact O-N 3.15Å; R362-K366 WeakPolarHBondContact O-CG 3.37Å; R362-K366 PolarHBondContact O-N 2.9Å
363	E	78.3	Confident	80.5	Confident	100 Å²	100	94.3 Å²	94.3	47%	0.467	45%	0.448	S	S	.	.	H	α-helix	trans	-64.3	-36.1	-177.2	-63.4	-52.5	138.5	0	0	112	K361 K366 N367	K361-E363 PolarHBondContact O-N 2.93Å; E363-K366 PolarHBondContact O-N 2.94Å; E363-K366 IonicContact OE1-NZ 3.38Å; E363-K366 PolarHBondContact OE1-NZ 3.27Å; E363-N367 VanDerWaalsContact O-CG 3.28Å; E363-N367 PolarHBondContact O-N 3.08Å; E363-N367 VanDerWaalsContact O-N 3.09Å; E363-N367 PolarHBondContact O-ND2 3.42Å
364	F	81.3	Confident	79.8	Confident	115 Å²	115	96.7 Å²	96.7	50%	0.504	46%	0.461	S	S	.	.	H	α-helix	trans	-64	-44.1	173.8	177.2	-97.5	0	0	0	111.9	K361 R362 M368	K361-F364 WeakPolarHBondContact O-CB 3.3Å; K361-F364 PolarHBondContact O-N 3.46Å; R362-F364 VanDerWaalsContact C-N 3.29Å; R362-F364 PolarHBondContact O-N 3.32Å; F364-M368 HydrophobicContact CD1-SD 4.4Å; F364-M368 HydrophobicContact CE1-CE 3.97Å; F364-M368 HydrophobicContact CE1-SD 3.62Å; F364-M368 HydrophobicContact CE2-CE 3.72Å; F364-M368 HydrophobicContact CE2-SD 4.32Å; F364-M368 HydrophobicContact CZ-CE 3.26Å; F364-M368 HydrophobicContact CZ-SD 3.59Å; F364-M368 VanDerWaalsContact CZ-SD 3.59Å; F364-M368 PolarHBondContact O-N 3.15Å
365	Y	78.8	Confident	78.6	Confident	22 Å²	22	101.7 Å²	101.7	9%	0.086	49%	0.492	C	S	.	.	H	α-helix	trans	-70	-35.6	178.9	-65.1	-56.7	0	0	0	112.7	V24 N26 L355 L359 K361 R362 M368 K369	V24-Y365 HydrophobicContact CB-CE1 4.41Å; V24-Y365 HydrophobicContact CG1-CD1 4.04Å; V24-Y365 HydrophobicContact CG1-CE1 3.36Å; V24-Y365 HydrophobicContact CG2-CD1 4.04Å; V24-Y365 HydrophobicContact CG2-CE1 4.18Å; N26-Y365 PolarHBondContact ND2-OH 3.28Å; L355-Y365 HydrophobicContact CD1-CD1 4.44Å; L355-Y365 HydrophobicContact CD1-CD2 4.32Å; L355-Y365 HydrophobicContact CD1-CE2 4.49Å; L355-Y365 HydrophobicContact CD1-CG 4.29Å; L355-Y365 HydrophobicContact CD2-CG 4.3Å; L355-Y365 HydrophobicContact CG-CD2 4.32Å; L355-Y365 HydrophobicContact CG-CG 4.17Å; L359-Y365 HydrophobicContact CD1-CD2 4.43Å; L359-Y365 HydrophobicContact CD1-CE2 4.13Å; K361-Y365 HydrophobicContact CB-CD2 4.44Å; K361-Y365 HydrophobicContact CB-CE2 4Å; K361-Y365 VanDerWaalsContact O-CD2 3.23Å; K361-Y365 WeakPolarHBondContact O-CD2 3.47Å; K361-Y365 PolarHBondContact O-N 3.45Å; R362-Y365 PolarHBondContact O-N 2.89Å; R362-Y365 VanDerWaalsContact O-N 3.15Å; Y365-M368 PolarHBondContact O-N 3.05Å; Y365-K369 WeakPolarHBondContact O-CB 3.49Å; Y365-K369 PolarHBondContact O-N 3.13Å
366	K	80.4	Confident	76.8	Confident	42 Å²	42	108 Å²	108	18%	0.183	52%	0.521	C	S	.	.	H	α-helix	trans	-61.6	-47.2	173.7	-76.1	177.2	-178.3	176.2	0	111.9	L356 R362 E363 M368 K369 F370	L356-K366 HydrophobicContact CD2-CG 3.84Å; L356-K366 VanDerWaalsContact O-CE 3.27Å; L356-K366 WeakPolarHBondContact O-CE 3.23Å; R362-K366 WeakPolarHBondContact O-CG 3.37Å; R362-K366 PolarHBondContact O-N 2.9Å; E363-K366 PolarHBondContact O-N 2.94Å; E363-K366 IonicContact OE1-NZ 3.38Å; E363-K366 PolarHBondContact OE1-NZ 3.27Å; K366-M368 VanDerWaalsContact C-N 3.25Å; K366-M368 PolarHBondContact O-N 3.27Å; K366-K369 PolarHBondContact O-N 3.16Å; K366-F370 HydrophobicContact CB-CD2 4.46Å; K366-F370 WeakPolarHBondContact O-CD2 3.23Å; K366-F370 PolarHBondContact O-N 3.42Å
367	N	81.3	Confident	75	Confident	110 Å²	110	113.4 Å²	113.4	59%	0.588	56%	0.555	S	S	*	*	H	α-helix	trans	-65.8	-27.3	-179.9	-69.8	-12.7	0	0	0	113.3	E363	E363-N367 VanDerWaalsContact O-CG 3.28Å; E363-N367 PolarHBondContact O-N 3.08Å; E363-N367 VanDerWaalsContact O-N 3.09Å; E363-N367 PolarHBondContact O-ND2 3.42Å
368	M	79.7	Confident	73.2	Confident	110 Å²	110	114.1 Å²	114.1	54%	0.542	56%	0.563	S	S	.	*	H	α-helix	trans	-81.1	-30.2	174.3	-73.4	-166.3	159.1	0	0	113.4	F364 Y365 K366	F364-M368 HydrophobicContact CD1-SD 4.4Å; F364-M368 HydrophobicContact CE1-CE 3.97Å; F364-M368 HydrophobicContact CE1-SD 3.62Å; F364-M368 HydrophobicContact CE2-CE 3.72Å; F364-M368 HydrophobicContact CE2-SD 4.32Å; F364-M368 HydrophobicContact CZ-CE 3.26Å; F364-M368 HydrophobicContact CZ-SD 3.59Å; F364-M368 VanDerWaalsContact CZ-SD 3.59Å; F364-M368 PolarHBondContact O-N 3.15Å; Y365-M368 PolarHBondContact O-N 3.05Å; K366-M368 VanDerWaalsContact C-N 3.25Å; K366-M368 PolarHBondContact O-N 3.27Å
369	K	80.5	Confident	71.3	Confident	74 Å²	74	112.7 Å²	112.7	32%	0.322	56%	0.56	S	S	.	*	H	α-helix	trans	-84.9	-41.3	-178.2	-170.7	174	-175.3	168.4	0	112.7	D352 L356 Y365 K366	D352-K369 IonicContact OD1-NZ 3.45Å; D352-K369 PolarHBondContact OD1-NZ 3.42Å; D352-K369 IonicContact OD2-NZ 3.71Å; D352-K369 PolarHBondContact OD2-NZ 3.06Å; L356-K369 HydrophobicContact CD1-CD 3.99Å; L356-K369 HydrophobicContact CD2-CD 4.14Å; Y365-K369 WeakPolarHBondContact O-CB 3.49Å; Y365-K369 PolarHBondContact O-N 3.13Å; K366-K369 PolarHBondContact O-N 3.16Å
370	F	83.4	Confident	69.5	Low	92 Å²	92	117.2 Å²	117.2	40%	0.404	58%	0.583	S	S	.	*			trans	-103.3	128.3	-176.6	-59.9	-70.9	0	0	0	110.9	L356 K366 Y372	L356-F370 HydrophobicContact CD1-CE2 4.06Å; L356-F370 HydrophobicContact CD1-CZ 4.2Å; L356-F370 HydrophobicContact CD2-CE2 4.3Å; K366-F370 HydrophobicContact CB-CD2 4.46Å; K366-F370 WeakPolarHBondContact O-CD2 3.23Å; K366-F370 PolarHBondContact O-N 3.42Å; F370-Y372 HydrophobicContact CB-CE2 4.17Å
371	K	78.2	Confident	67.9	Low	168 Å²	168	118.7 Å²	118.7	73%	0.73	58%	0.583	S	S	*	*			trans	-101	115.8	163	-68.4	-173.8	178.2	-173.8	0	107.2
372	Y	75.9	Confident	65.9	Low	174 Å²	174	115.4 Å²	115.4	68%	0.682	58%	0.579	S	S	*	*			trans	-80	127.4	173	-59.8	-83.4	0	0	0	108.1	F370	F370-Y372 HydrophobicContact CB-CE2 4.17Å
373	T	72.2	Confident	64	Low	123 Å²	123	113.2 Å²	113.2	76%	0.755	58%	0.582	S	S	*	*			trans	-109.9	119.8	169.8	53.1	0	0	0	0	107.2	T375	T373-T375 PolarHBondContact O-N 3.46Å
374	D	72.7	Confident	62.2	Low	139 Å²	139	112.2 Å²	112.2	74%	0.743	59%	0.591	S	S	*	*			trans	-71.1	122	175.2	-62.6	-39.2	0	0	0	109	Q376	D374-Q376 PolarHBondContact O-N 3.08Å
375	T	58.8	Low	60.1	Low	138 Å²	138	117 Å²	117	85%	0.847	61%	0.606	S	S	*	*	S	Bend	trans	-70.6	98.4	171.1	-33.1	0	0	0	0	107.6	T373	T373-T375 PolarHBondContact O-N 3.46Å
376	Q	47.8	Very low	58.1	Low	145 Å²	145	124 Å²	124	68%	0.678	64%	0.636	S	S	*	*			trans	70.2	91.1	175.7	-62.9	-179.5	-17.8	0	0	117.6	D374 Q378	D374-Q376 PolarHBondContact O-N 3.08Å; Q376-Q378 VanDerWaalsContact C-N 3.33Å; Q376-Q378 HydrophobicContact CG-CB 4.42Å
377	T	45.8	Very low	56.2	Low	122 Å²	122	128 Å²	128	75%	0.748	66%	0.664	S	S	*	*			trans	-99.7	63.5	130.7	-42.7	0	0	0	0	107.9
378	Q	46.8	Very low	53.9	Low	158 Å²	158	130.5 Å²	130.5	74%	0.738	67%	0.674	S	S	*	*			trans	-114.4	23.7	179.6	-128	-178.9	6.7	0	0	113	Q376	Q376-Q378 VanDerWaalsContact C-N 3.33Å; Q376-Q378 HydrophobicContact CG-CB 4.42Å
379	T	41.4	Very low	51.8	Low	103 Å²	103	134.8 Å²	134.8	63%	0.632	69%	0.69	S	S	*	*	S	Bend	trans	-118.2	10.2	-176.1	-27.6	0	0	0	0	115
380	I	42.3	Very low	49.6	Very low	132 Å²	132	139.3 Å²	139.3	68%	0.677	71%	0.713	S	S	*	*	S	Bend	trans	-122.5	-7.3	179.8	-57.9	-178.5	0	0	0	114.4
381	L	41.3	Very low	47.1	Very low	157 Å²	157	141.2 Å²	141.2	82%	0.822	73%	0.732	S	S	*	*	S	Bend	trans	-110.1	-2.7	176.5	-93.5	122.7	0	0	0	115.7
382	S	37.9	Very low	44.8	Very low	78 Å²	78	140.4 Å²	140.4	55%	0.545	73%	0.73	S	S	.	*	S	Bend	trans	-93.3	-18.4	171.3	57	0	0	0	0	113.8
383	S	38.8	Very low	42.8	Very low	76 Å²	76	141.5 Å²	141.5	53%	0.531	74%	0.742	S	S	.	*	S	Bend	trans	-84.8	-18.6	175.5	64.5	0	0	0	0	113.9
384	A	40.4	Very low	40.8	Very low	78 Å²	78	143.3 Å²	143.3	65%	0.645	74%	0.742	S	S	*	*	S	Bend	trans	-88.2	-5.4	175.4	0	0	0	0	0	114
385	R	37.4	Very low	38.7	Very low	217 Å²	217	141.8 Å²	141.8	82%	0.819	74%	0.742	S	S	*	*	S	Bend	trans	-108.1	-2.6	175.2	-100.1	-177.8	-179	-175.8	0.3	114.5
386	F	37.8	Very low	37.5	Very low	167 Å²	167	141.8 Å²	141.8	73%	0.732	74%	0.741	S	S	*	*	S	Bend	trans	-106.4	-4.1	-179.3	-119	-89.3	0	0	0	114.6
387	V	39	Very low	36.8	Very low	126 Å²	126	143.9 Å²	143.9	76%	0.764	77%	0.772	S	S	*	*	S	Bend	trans	-108.4	4.7	-179.5	-173.5	0	0	0	0	113.3
388	M	33.9	Very low	36.3	Very low	164 Å²	164	145 Å²	145	81%	0.808	77%	0.773	S	S	*	*	S	Bend	trans	-120.2	10.8	178	-78.2	-64.9	-63.8	0	0	114.7
389	F	34.7	Very low	35.7	Very low	200 Å²	200	144.3 Å²	144.3	88%	0.877	78%	0.775	S	S	*	*	S	Bend	trans	-122	19.5	179	-101.1	-78.9	0	0	0	114.1
390	E	34.3	Very low	35.4	Very low	169 Å²	169	146.6 Å²	146.6	79%	0.79	78%	0.783	S	S	*	*			trans	-131.6	51.4	177.8	-145.6	161.1	-158.2	0	0	111.3
391	V	31.9	Very low	35	Very low	132 Å²	132	147.4 Å²	147.4	80%	0.8	79%	0.789	S	S	*	*	S	Bend	trans	-134.3	90.8	154.3	-177.3	0	0	0	0	108.3
392	Q	30.5	Very low	34.6	Very low	151 Å²	151	146.8 Å²	146.8	71%	0.706	79%	0.787	S	S	*	*			trans	37.1	109.8	142.2	-83	154.4	-76.1	0	0	120.3	E394	Q392-E394 PolarHBondContact O-N 3.41Å
393	E	33.2	Very low	34.4	Very low	197 Å²	197	151.4 Å²	151.4	92%	0.921	80%	0.803	S	S	*	*				-40	116.3	125.6	-113.4	172.1	165.6	0	0	111.3
394	E	30.7	Very low	34.1	Very low	161 Å²	161	156.8 Å²	156.8	75%	0.752	82%	0.822	S	S	*	*			trans	-159.2	123	151.9	-124.7	172.9	-170.8	0	0	112.3	Q392	Q392-E394 PolarHBondContact O-N 3.41Å
395	S	27.9	Very low	33.6	Very low	106 Å²	106	162.8 Å²	162.8	74%	0.741	84%	0.836	S	S	*	*			trans	78.2	109.4	154.4	74.3	0	0	0	0	119.3
396	V	33.8	Very low	33.3	Very low	139 Å²	139	158.3 Å²	158.3	84%	0.842	84%	0.837	S	S	*	*				95.7	130.5	82.9	166	0	0	0	0	112.8
397	S	31.9	Very low	32.9	Very low	188 Å²	188	157.5 Å²	157.5	100%	1.315	85%	0.847	S	S	*	*			trans	75.7	0	175.7	79.2	0	0	0	0	118.7

Retrieved 397 of 397 residues in 170.7 ms (Link to these results)

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