A0A3Q0KLE4_SCHMA Loading...

Chymotrypsin

AlphaFold DB , UniProt , Accession A0A3Q0KLE4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 372 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	44.6	Very low	232 Å²	232	152.4 Å²	152.4	100%	1.143	75%	0.751	S	S	*	*				0	33.1	0	-151.6	163.5	160.3	0	0	112.1
2	C	41.7	Very low	46.2	Very low	70 Å²	70	145.6 Å²	145.6	47%	0.473	73%	0.729	S	S	.	*			trans	-127.3	51.8	-175	-42.8	0	0	0	0	110.7	C25	C2-C25 HydrophobicContact CB-CB 4.07Å; C2-C25 WeakPolarHBondContact CB-SG 3.31Å; C2-C25 WeakPolarHBondContact SG-CB 3.19Å; C2-C25 CovalentContact SG-SG 2.07Å; C2-C25 PolarHBondContact SG-SG 2.91Å
3	I	41.6	Very low	47.7	Very low	171 Å²	171	144.4 Å²	144.4	88%	0.877	73%	0.725	S	S	*	*			trans	-129.9	83.4	165.6	-55.5	176.3	0	0	0	107.2
4	N	40.3	Very low	48.8	Very low	112 Å²	112	149.7 Å²	149.7	60%	0.599	73%	0.732	S	S	*	*			trans	-158.6	109.2	145.5	-146.7	-21.5	0	0	0	108.4	Q6 K7	N4-Q6 PolarHBondContact O-N 3.08Å; N4-K7 PolarHBondContact O-N 3.21Å; N4-K7 VanDerWaalsContact O-N 3.1Å
5	K	41.4	Very low	50	Low	196 Å²	196	146 Å²	146	85%	0.852	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-53.2	-20.6	-175	-84.7	-177	174.6	179.1	0	113.4
6	Q	41.5	Very low	50.9	Low	177 Å²	177	140.8 Å²	140.8	83%	0.827	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-77.9	-13.5	-179.5	-73.6	-176.4	-19.2	0	0	115.6	N4	N4-Q6 PolarHBondContact O-N 3.08Å
7	K	43.2	Very low	51.6	Low	177 Å²	177	137.5 Å²	137.5	77%	0.77	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-101.1	1.7	179.9	-81.5	-171.5	175.5	-177.1	0	115.5	N4 Q9	N4-K7 PolarHBondContact O-N 3.21Å; N4-K7 VanDerWaalsContact O-N 3.1Å; K7-Q9 VanDerWaalsContact C-N 3.35Å; K7-Q9 PolarHBondContact O-N 3.43Å
8	L	44.3	Very low	52.5	Low	104 Å²	104	135 Å²	135	55%	0.545	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-78.1	-8	-174.2	-93.6	152.3	0	0	0	115.5	L10	L8-L10 PolarHBondContact O-N 3.11Å
9	Q	51.1	Low	53.2	Low	192 Å²	192	130.1 Å²	130.1	90%	0.897	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-73.9	-4.5	-177.8	-90.8	-178.2	-27.6	0	0	115.4	K7	K7-Q9 VanDerWaalsContact C-N 3.35Å; K7-Q9 PolarHBondContact O-N 3.43Å
10	L	53.2	Low	53.4	Low	168 Å²	168	126.8 Å²	126.8	88%	0.88	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-127.4	9.3	-173.2	-77.2	162.7	0	0	0	115.6	L8	L8-L10 PolarHBondContact O-N 3.11Å
11	I	55.1	Low	53.8	Low	77 Å²	77	128.4 Å²	128.4	40%	0.395	63%	0.634	S	S	.	*			trans	-100.6	120.7	177.1	-57	179.3	0	0	0	108.8	L15	I11-L15 HydrophobicContact CG2-CB 3.76Å; I11-L15 HydrophobicContact CG2-CD2 4.07Å
12	S	64.7	Low	55.6	Low	71 Å²	71	122.2 Å²	122.2	50%	0.497	60%	0.604	S	S	.	*			trans	-63.1	144.8	175.2	74.2	0	0	0	0	110.3	W14 L15 L16	S12-W14 PolarHBondContact O-N 3.49Å; S12-W14 VanDerWaalsContact O-N 3.08Å; S12-L15 PolarHBondContact O-N 2.92Å; S12-L16 PolarHBondContact O-N 3.49Å
13	I	64.6	Low	55.9	Low	130 Å²	130	121.9 Å²	121.9	67%	0.667	61%	0.612	S	S	*	*	H	α-helix	trans	-52	-35.6	-179	-67.8	167.2	0	0	0	111.7	L15 L16 N17	I13-L15 PolarHBondContact O-N 3.09Å; I13-L16 PolarHBondContact O-N 3.36Å; I13-N17 PolarHBondContact O-N 3.41Å; I13-N17 VanDerWaalsContact O-N 3.11Å
14	W	64	Low	56.8	Low	219 Å²	219	118.9 Å²	118.9	83%	0.83	60%	0.598	S	S	*	*	H	α-helix	trans	-60.2	-43.9	175.8	-74.9	93.9	0	0	0	113.4	S12 L16 N17 L18	S12-W14 PolarHBondContact O-N 3.49Å; S12-W14 VanDerWaalsContact O-N 3.08Å; W14-L16 VanDerWaalsContact C-N 3.35Å; W14-N17 PolarHBondContact O-N 3Å; W14-L18 PolarHBondContact O-N 3.25Å; W14-L18 VanDerWaalsContact O-N 3.09Å
15	L	67	Low	56.7	Low	94 Å²	94	114.2 Å²	114.2	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-70.5	-34.7	-179.3	-143.5	86.2	0	0	0	111.3	I11 S12 I13 L18 L19	I11-L15 HydrophobicContact CG2-CB 3.76Å; I11-L15 HydrophobicContact CG2-CD2 4.07Å; S12-L15 PolarHBondContact O-N 2.92Å; I13-L15 PolarHBondContact O-N 3.09Å; L15-L18 PolarHBondContact O-N 3.39Å; L15-L19 WeakPolarHBondContact O-CB 3.29Å; L15-L19 WeakPolarHBondContact O-CD1 3.48Å; L15-L19 WeakPolarHBondContact O-CG 3.32Å; L15-L19 PolarHBondContact O-N 3.33Å
16	L	63.5	Low	56.8	Low	62 Å²	62	110.3 Å²	110.3	33%	0.325	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-43.4	175.4	-171.4	69.5	0	0	0	111.4	S12 I13 W14 L19 I20	S12-L16 PolarHBondContact O-N 3.49Å; I13-L16 PolarHBondContact O-N 3.36Å; W14-L16 VanDerWaalsContact C-N 3.35Å; L16-L19 PolarHBondContact O-N 2.99Å; L16-I20 HydrophobicContact CG-CD1 4.31Å; L16-I20 VanDerWaalsContact O-CG1 3.32Å; L16-I20 WeakPolarHBondContact O-CG1 3.41Å; L16-I20 PolarHBondContact O-N 3.18Å
17	N	63.4	Low	56.9	Low	86 Å²	86	104.1 Å²	104.1	46%	0.46	55%	0.545	S	S	.	.	H	α-helix	trans	-63.8	-44.1	177	-74.1	-15.9	0	0	0	111.8	I13 W14 L19 I20 E21	I13-N17 PolarHBondContact O-N 3.41Å; I13-N17 VanDerWaalsContact O-N 3.11Å; W14-N17 PolarHBondContact O-N 3Å; N17-L19 VanDerWaalsContact C-N 3.31Å; N17-L19 PolarHBondContact O-N 3.43Å; N17-I20 PolarHBondContact O-N 3.05Å; N17-E21 PolarHBondContact O-N 3.29Å
18	L	68.1	Low	56.8	Low	92 Å²	92	102 Å²	102	48%	0.482	55%	0.55	S	S	.	.	H	α-helix	trans	-61	-41	176.1	-172.6	70.5	0	0	0	111.7	W14 L15 I20 E21 I22	W14-L18 PolarHBondContact O-N 3.25Å; W14-L18 VanDerWaalsContact O-N 3.09Å; L15-L18 PolarHBondContact O-N 3.39Å; L18-I20 VanDerWaalsContact C-N 3.3Å; L18-I20 PolarHBondContact O-N 3.1Å; L18-E21 PolarHBondContact O-N 2.07Å; L18-I22 VanDerWaalsContact O-CG1 3.29Å; L18-I22 WeakPolarHBondContact O-CG1 3.22Å; L18-I22 PolarHBondContact O-N 3.06Å
19	L	64.9	Low	56.6	Low	42 Å²	42	104.9 Å²	104.9	22%	0.22	56%	0.56	C	S	.	*	H	α-helix	trans	-67.1	-28.6	177.8	-73	168.7	0	0	0	113.2	L15 L16 N17 I22 L24 C25	L15-L19 WeakPolarHBondContact O-CB 3.29Å; L15-L19 WeakPolarHBondContact O-CD1 3.48Å; L15-L19 WeakPolarHBondContact O-CG 3.32Å; L15-L19 PolarHBondContact O-N 3.33Å; L16-L19 PolarHBondContact O-N 2.99Å; N17-L19 VanDerWaalsContact C-N 3.31Å; N17-L19 PolarHBondContact O-N 3.43Å; L19-I22 HydrophobicContact CD2-CD1 4.35Å; L19-L24 HydrophobicContact CD2-CB 3.99Å; L19-L24 HydrophobicContact CD2-CD1 4.08Å; L19-L24 PolarHBondContact O-N 3.03Å; L19-C25 HydrophobicContact CB-CB 4.41Å; L19-C25 PolarHBondContact O-N 2.94Å
20	I	57.1	Low	56.6	Low	63 Å²	63	100.1 Å²	100.1	32%	0.323	54%	0.538	S	S	.	.	H	α-helix	trans	-72.1	-46.5	171.8	-68.5	163	0	0	0	109.9	L16 N17 L18 I22 G23 C25 T27	L16-I20 HydrophobicContact CG-CD1 4.31Å; L16-I20 VanDerWaalsContact O-CG1 3.32Å; L16-I20 WeakPolarHBondContact O-CG1 3.41Å; L16-I20 PolarHBondContact O-N 3.18Å; N17-I20 PolarHBondContact O-N 3.05Å; L18-I20 VanDerWaalsContact C-N 3.3Å; L18-I20 PolarHBondContact O-N 3.1Å; I20-I22 VanDerWaalsContact C-N 3.34Å; I20-I22 PolarHBondContact O-N 3.45Å; I20-G23 PolarHBondContact O-N 3.16Å; I20-G23 VanDerWaalsContact O-N 3.16Å; I20-C25 HydrophobicContact CG1-CB 4.5Å; I20-T27 HydrophobicContact CD1-CG2 3.75Å; I20-T27 HydrophobicContact CG1-CG2 4.12Å; I20-T27 HydrophobicContact CG2-CG2 4.16Å
21	E	63.1	Low	56.4	Low	162 Å²	162	94.6 Å²	94.6	76%	0.757	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-38.7	-179.9	-78	-175.9	166.4	0	0	113.1	N17 L18 G23	N17-E21 PolarHBondContact O-N 3.29Å; L18-E21 PolarHBondContact O-N 2.07Å; E21-G23 VanDerWaalsContact C-N 3.29Å; E21-G23 PolarHBondContact O-N 3.39Å
22	I	73.6	Confident	56.2	Low	101 Å²	101	92.7 Å²	92.7	52%	0.518	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	9.6	179.3	70.5	-169.5	0	0	0	113.7	L18 L19 I20 L24	L18-I22 VanDerWaalsContact O-CG1 3.29Å; L18-I22 WeakPolarHBondContact O-CG1 3.22Å; L18-I22 PolarHBondContact O-N 3.06Å; L19-I22 HydrophobicContact CD2-CD1 4.35Å; I20-I22 VanDerWaalsContact C-N 3.34Å; I20-I22 PolarHBondContact O-N 3.45Å; I22-L24 VanDerWaalsContact C-N 3.32Å; I22-L24 HydrophobicContact CD1-CD1 3.71Å; I22-L24 HydrophobicContact CD1-CG 4.4Å; I22-L24 HydrophobicContact CG1-CB 4.27Å; I22-L24 HydrophobicContact CG1-CD1 3.89Å; I22-L24 HydrophobicContact CG1-CG 4.02Å; I22-L24 PolarHBondContact O-N 3.35Å
23	G	48.8	Very low	55.8	Low	63 Å²	63	93.5 Å²	93.5	65%	0.649	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	16.1	173.1	0	0	0	0	0	115.8	I20 E21	I20-G23 PolarHBondContact O-N 3.16Å; I20-G23 VanDerWaalsContact O-N 3.16Å; E21-G23 VanDerWaalsContact C-N 3.29Å; E21-G23 PolarHBondContact O-N 3.39Å
24	L	59.1	Low	55.6	Low	109 Å²	109	90 Å²	90	57%	0.571	50%	0.501	S	S	*	.	S	Bend	trans	-91	-22.1	-178.6	-73.6	175.7	0	0	0	114	L19 I22	L19-L24 HydrophobicContact CD2-CB 3.99Å; L19-L24 HydrophobicContact CD2-CD1 4.08Å; L19-L24 PolarHBondContact O-N 3.03Å; I22-L24 VanDerWaalsContact C-N 3.32Å; I22-L24 HydrophobicContact CD1-CD1 3.71Å; I22-L24 HydrophobicContact CD1-CG 4.4Å; I22-L24 HydrophobicContact CG1-CB 4.27Å; I22-L24 HydrophobicContact CG1-CD1 3.89Å; I22-L24 HydrophobicContact CG1-CG 4.02Å; I22-L24 PolarHBondContact O-N 3.35Å
25	C	39.7	Very low	55.7	Low	13 Å²	13	82.6 Å²	82.6	9%	0.088	48%	0.48	C	S	.	.	S	Bend	trans	-120.1	128.4	164.4	-68.9	0	0	0	0	109.9	C2 L19 I20	C2-C25 HydrophobicContact CB-CB 4.07Å; C2-C25 WeakPolarHBondContact CB-SG 3.31Å; C2-C25 WeakPolarHBondContact SG-CB 3.19Å; C2-C25 CovalentContact SG-SG 2.07Å; C2-C25 PolarHBondContact SG-SG 2.91Å; L19-C25 HydrophobicContact CB-CB 4.41Å; L19-C25 PolarHBondContact O-N 2.94Å; I20-C25 HydrophobicContact CG1-CB 4.5Å
26	S	43.4	Very low	55.7	Low	115 Å²	115	82.4 Å²	82.4	80%	0.804	48%	0.479	S	S	*	.			trans	-73.3	129.9	161.3	-20.5	0	0	0	0	107.7
27	T	43.1	Very low	56	Low	46 Å²	46	87.8 Å²	87.8	28%	0.282	50%	0.503	S	S	.	.			trans	-57	150.2	156.6	54.4	0	0	0	0	107.4	I20 H29	I20-T27 HydrophobicContact CD1-CG2 3.75Å; I20-T27 HydrophobicContact CG1-CG2 4.12Å; I20-T27 HydrophobicContact CG2-CG2 4.16Å; T27-H29 PolarHBondContact O-N 2.79Å; T27-H29 PolarHBondContact OG1-CD2 3.02Å; T27-H29 VanDerWaalsContact OG1-CG 3.29Å; T27-H29 PolarHBondContact OG1-NE2 3.22Å
28	P	41.9	Very low	56.6	Low	134 Å²	134	87.7 Å²	87.7	87%	0.87	50%	0.498	S	S	*	.			trans	-66.8	75.5	163.4	19.5	-15.9	0	0	0	108.3	E30	P28-E30 PolarHBondContact O-N 2.99Å
29	H	39.2	Very low	57.1	Low	163 Å²	163	84.2 Å²	84.2	76%	0.755	48%	0.48	S	S	*	.			trans	-70.3	79.3	166.9	-85	-63.7	0	0	0	108.1	T27	T27-H29 PolarHBondContact O-N 2.79Å; T27-H29 PolarHBondContact OG1-CD2 3.02Å; T27-H29 VanDerWaalsContact OG1-CG 3.29Å; T27-H29 PolarHBondContact OG1-NE2 3.22Å
30	E	50.2	Low	57.8	Low	93 Å²	93	85.2 Å²	85.2	44%	0.435	49%	0.489	S	S	.	.			trans	-135.5	11.6	160	-75.6	-166.7	155	0	0	113.1	P28 K58 R229	P28-E30 PolarHBondContact O-N 2.99Å; E30-K58 IonicContact OE1-NZ 3.49Å; E30-R229 IonicContact OE1-CZ 3.47Å; E30-R229 IonicContact OE1-NH1 3.57Å; E30-R229 IonicContact OE1-NH2 2.79Å; E30-R229 PolarHBondContact OE1-NH2 3.49Å
31	G	49.6	Very low	58.9	Low	51 Å²	51	87.2 Å²	87.2	53%	0.526	50%	0.497	S	S	.	.			trans	-110.4	115.9	172.2	0	0	0	0	0	111.5	A33	G31-A33 PolarHBondContact O-N 2.82Å
32	F	52.3	Low	59.7	Low	37 Å²	37	79.6 Å²	79.6	16%	0.162	46%	0.462	C	S	.	.			trans	-60.2	125	162.5	-177.6	-103.5	0	0	0	107.8	F34 K38 Y55	F32-F34 HydrophobicContact CD1-CB 4.04Å; F32-F34 HydrophobicContact CE1-CB 4.48Å; F32-F34 HydrophobicContact CE1-CD2 4.46Å; F32-F34 PolarHBondContact O-N 3.38Å; F32-K38 HydrophobicContact CZ-CD 4.4Å; F32-Y55 AromaticContact CD2-CD1 3.67Å; F32-Y55 HydrophobicContact CD2-CD1 3.67Å; F32-Y55 AromaticContact CD2-CE1 3.8Å; F32-Y55 HydrophobicContact CD2-CE1 3.8Å; F32-Y55 HydrophobicContact CD2-CG 4.1Å; F32-Y55 AromaticContact CE2-CD1 3.83Å; F32-Y55 HydrophobicContact CE2-CD1 3.83Å; F32-Y55 HydrophobicContact CE2-CD2 4.5Å; F32-Y55 AromaticContact CE2-CE1 3.45Å; F32-Y55 HydrophobicContact CE2-CE1 3.45Å; F32-Y55 VanDerWaalsContact CE2-CE1 3.45Å; F32-Y55 HydrophobicContact CE2-CE2 4.18Å; F32-Y55 HydrophobicContact CE2-CG 4.34Å; F32-Y55 AromaticContact CE2-CZ 3.64Å
33	A	55.6	Low	60.5	Low	89 Å²	89	75.2 Å²	75.2	74%	0.736	44%	0.44	S	S	*	.			trans	-71.1	82.5	172.4	0	0	0	0	0	108.3	G31 T35	G31-A33 PolarHBondContact O-N 2.82Å; A33-T35 PolarHBondContact O-N 2.95Å
34	F	60.9	Low	62.5	Low	56 Å²	56	72.3 Å²	72.3	25%	0.246	41%	0.409	C	S	.	.			trans	-67.8	126.3	-177.7	175.7	-96.1	0	0	0	110.5	F32 L36 I39 H42 P150 L227 I233	F32-F34 HydrophobicContact CD1-CB 4.04Å; F32-F34 HydrophobicContact CE1-CB 4.48Å; F32-F34 HydrophobicContact CE1-CD2 4.46Å; F32-F34 PolarHBondContact O-N 3.38Å; F34-L36 HydrophobicContact CE1-CD2 3.83Å; F34-L36 HydrophobicContact CE1-CG 4.47Å; F34-L36 HydrophobicContact CZ-CD2 4.08Å; F34-I39 HydrophobicContact CE2-CD1 4.36Å; F34-I39 HydrophobicContact CE2-CG1 3.62Å; F34-I39 HydrophobicContact CZ-CD1 3.8Å; F34-I39 HydrophobicContact CZ-CG1 3.56Å; F34-H42 AromaticContact CD2-CE1 3.62Å; F34-H42 AromaticContact CD2-NE2 3.49Å; F34-H42 WeakPolarHBondContact CD2-NE2 3.44Å; F34-H42 AromaticContact CE2-CE1 3.48Å; F34-H42 VanDerWaalsContact CE2-CE1 3.48Å; F34-H42 WeakPolarHBondContact CE2-CE1 3.43Å; F34-H42 AromaticContact CE2-NE2 3.42Å; F34-H42 WeakPolarHBondContact CE2-NE2 3.21Å; F34-P150 HydrophobicContact CD1-CG 4.21Å; F34-P150 HydrophobicContact CE1-CG 3.62Å; F34-P150 HydrophobicContact CE2-CG 4.33Å; F34-P150 HydrophobicContact CZ-CG 3.68Å; F34-L227 HydrophobicContact CB-CD1 4.39Å; F34-L227 HydrophobicContact CD2-CD1 3.37Å; F34-L227 HydrophobicContact CE2-CD1 3.71Å; F34-L227 HydrophobicContact CG-CD1 3.96Å; F34-I233 HydrophobicContact CE2-CD1 3.59Å; F34-I233 HydrophobicContact CZ-CD1 3.81Å
35	T	65.9	Low	63.9	Low	63 Å²	63	69.4 Å²	69.4	39%	0.387	39%	0.391	S	S	.	.			trans	-119.6	145.7	162.1	59.2	0	0	0	0	108.3	A33 E37 K38	A33-T35 PolarHBondContact O-N 2.95Å; T35-E37 PolarHBondContact O-N 2.97Å; T35-K38 PolarHBondContact O-N 2.7Å; T35-K38 WeakPolarHBondContact OG1-CG 3.27Å
36	L	66.2	Low	66	Low	90 Å²	90	69 Å²	69	47%	0.471	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-55.3	-37.8	-179.9	-68.5	173.6	0	0	0	112.1	F34 K38 I39 H149 V369	F34-L36 HydrophobicContact CE1-CD2 3.83Å; F34-L36 HydrophobicContact CE1-CG 4.47Å; F34-L36 HydrophobicContact CZ-CD2 4.08Å; L36-K38 PolarHBondContact O-N 3.39Å; L36-K38 VanDerWaalsContact O-N 3.12Å; L36-I39 HydrophobicContact CD2-CD1 3.9Å; L36-I39 WeakPolarHBondContact O-CB 3.19Å; L36-I39 VanDerWaalsContact O-CG1 3.27Å; L36-I39 WeakPolarHBondContact O-CG1 3.32Å; L36-I39 PolarHBondContact O-N 2.81Å; L36-H149 WeakPolarHBondContact CD2-NE2 3.15Å; L36-V369 HydrophobicContact CD1-CG1 4.29Å; L36-V369 HydrophobicContact CD2-CG1 3.69Å
37	E	69.7	Low	67.6	Low	176 Å²	176	64 Å²	64	82%	0.822	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-58.7	-24.7	177.9	-62.4	170.2	-168	0	0	113.4	T35	T35-E37 PolarHBondContact O-N 2.97Å
38	K	76.7	Confident	69.2	Low	83 Å²	83	66.4 Å²	66.4	36%	0.361	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-90.1	-4.9	179.7	-70.5	-173.9	175.4	-171.7	0	113.7	F32 T35 L36 P40 E41 H42	F32-K38 HydrophobicContact CZ-CD 4.4Å; T35-K38 PolarHBondContact O-N 2.7Å; T35-K38 WeakPolarHBondContact OG1-CG 3.27Å; L36-K38 PolarHBondContact O-N 3.39Å; L36-K38 VanDerWaalsContact O-N 3.12Å; K38-P40 VanDerWaalsContact C-CD 3.46Å; K38-P40 VanDerWaalsContact C-N 3.32Å; K38-E41 VanDerWaalsContact O-CB 3.32Å; K38-E41 WeakPolarHBondContact O-CB 2.9Å; K38-E41 PolarHBondContact O-N 3.15Å; K38-H42 PolarHBondContact O-CE1 3.38Å; K38-H42 PolarHBondContact O-ND1 2.91Å
39	I	79	Confident	70.9	Confident	19 Å²	19	61.4 Å²	61.4	10%	0.097	33%	0.326	C	S	.	.	H	α-helix	trans	-47.1	-50.6	178.9	-69.5	169.9	0	0	0	111.9	F34 L36 E41 H42 C43 I233	F34-I39 HydrophobicContact CE2-CD1 4.36Å; F34-I39 HydrophobicContact CE2-CG1 3.62Å; F34-I39 HydrophobicContact CZ-CD1 3.8Å; F34-I39 HydrophobicContact CZ-CG1 3.56Å; L36-I39 HydrophobicContact CD2-CD1 3.9Å; L36-I39 WeakPolarHBondContact O-CB 3.19Å; L36-I39 VanDerWaalsContact O-CG1 3.27Å; L36-I39 WeakPolarHBondContact O-CG1 3.32Å; L36-I39 PolarHBondContact O-N 2.81Å; I39-E41 PolarHBondContact O-N 2.75Å; I39-E41 VanDerWaalsContact O-N 3.11Å; I39-H42 WeakPolarHBondContact CA-CE1 3.38Å; I39-H42 PolarHBondContact O-N 3.48Å; I39-H42 VanDerWaalsContact O-N 3.14Å; I39-C43 HydrophobicContact CG2-CB 4.08Å; I39-C43 VanDerWaalsContact O-CB 3.27Å; I39-C43 WeakPolarHBondContact O-CB 3.23Å; I39-C43 PolarHBondContact O-N 3.45Å; I39-C43 PolarHBondContact O-SG 3.12Å; I39-I233 HydrophobicContact CG2-CG2 4.5Å
40	P	79	Confident	72.7	Confident	63 Å²	63	58 Å²	58	41%	0.409	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-25.2	-179.6	-23.9	35.6	0	0	0	114.1	K38	K38-P40 VanDerWaalsContact C-CD 3.46Å; K38-P40 VanDerWaalsContact C-N 3.32Å
41	E	79.1	Confident	73.8	Confident	105 Å²	105	58 Å²	58	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-73.8	-31.1	-179.8	-60.1	-178.5	173.3	0	0	112.6	K38 I39 R45	K38-E41 VanDerWaalsContact O-CB 3.32Å; K38-E41 WeakPolarHBondContact O-CB 2.9Å; K38-E41 PolarHBondContact O-N 3.15Å; I39-E41 PolarHBondContact O-N 2.75Å; I39-E41 VanDerWaalsContact O-N 3.11Å; E41-R45 VanDerWaalsContact O-CZ 3.26Å; E41-R45 PolarHBondContact O-NE 2.71Å; E41-R45 PolarHBondContact O-NH2 3.1Å
42	H	80.8	Confident	74.9	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.014	29%	0.289	C	S	.	.	H	α-helix	trans	-127.7	-11.1	-168.6	71.4	-77	0	0	0	115.6	F34 K38 I39 R45 W52 N232	F34-H42 AromaticContact CD2-CE1 3.62Å; F34-H42 AromaticContact CD2-NE2 3.49Å; F34-H42 WeakPolarHBondContact CD2-NE2 3.44Å; F34-H42 AromaticContact CE2-CE1 3.48Å; F34-H42 VanDerWaalsContact CE2-CE1 3.48Å; F34-H42 WeakPolarHBondContact CE2-CE1 3.43Å; F34-H42 AromaticContact CE2-NE2 3.42Å; F34-H42 WeakPolarHBondContact CE2-NE2 3.21Å; K38-H42 PolarHBondContact O-CE1 3.38Å; K38-H42 PolarHBondContact O-ND1 2.91Å; I39-H42 WeakPolarHBondContact CA-CE1 3.38Å; I39-H42 PolarHBondContact O-N 3.48Å; I39-H42 VanDerWaalsContact O-N 3.14Å; H42-R45 WeakPolarHBondContact O-CB 3.18Å; H42-R45 PolarHBondContact O-N 3.08Å; H42-W52 HydrophobicContact CB-CE3 4.08Å; H42-W52 HydrophobicContact CB-CZ3 3.82Å; H42-W52 AromaticContact CD2-CZ3 3.93Å; H42-N232 PolarHBondContact CD2-OD1 3.46Å; H42-N232 VanDerWaalsContact CD2-OD1 3.27Å; H42-N232 PolarHBondContact O-ND2 3.11Å
43	C	90.3	Very high	75.8	Confident	9 Å²	9	60 Å²	60	6%	0.061	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	153.1	173.2	69.3	0	0	0	0	110.4	I39 R45 I233 C235	I39-C43 HydrophobicContact CG2-CB 4.08Å; I39-C43 VanDerWaalsContact O-CB 3.27Å; I39-C43 WeakPolarHBondContact O-CB 3.23Å; I39-C43 PolarHBondContact O-N 3.45Å; I39-C43 PolarHBondContact O-SG 3.12Å; C43-R45 WeakPolarHBondContact O-CG 3.42Å; C43-R45 PolarHBondContact O-N 3.05Å; C43-I233 CarbonylContact C-O 3.59Å; C43-I233 VanDerWaalsContact CA-O 3.26Å; C43-I233 WeakPolarHBondContact CA-O 3.09Å; C43-I233 HydrophobicContact CB-CG2 4.46Å; C43-C235 HydrophobicContact CB-CB 3.95Å; C43-C235 WeakPolarHBondContact CB-SG 3.27Å; C43-C235 PolarHBondContact O-SG 2.83Å; C43-C235 WeakPolarHBondContact SG-CA 3.42Å; C43-C235 WeakPolarHBondContact SG-CB 3.48Å; C43-C235 CovalentContact SG-SG 2.04Å; C43-C235 PolarHBondContact SG-SG 2.92Å
44	G	90.7	Very high	76.7	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.01	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	12.4	173.3	0	0	0	0	0	114.2	W77 I233 C235 W332	G44-W77 VanDerWaalsContact C-CZ3 3.47Å; G44-I233 PolarHBondContact N-O 3.35Å; G44-C235 PolarHBondContact N-SG 3.13Å; G44-W332 VanDerWaalsContact CA-O 3.23Å; G44-W332 WeakPolarHBondContact CA-O 3.49Å; G44-W332 WeakPolarHBondContact O-CB 3.42Å; G44-W332 PolarHBondContact O-N 3.39Å
45	R	88	Confident	77.1	Confident	48 Å²	48	65.3 Å²	65.3	18%	0.181	31%	0.308	C	S	.	.			trans	-104	136.8	174.9	-57.6	-172.5	-170.6	-101.5	5.7	110.5	E41 H42 C43 D49 W52 N232	E41-R45 VanDerWaalsContact O-CZ 3.26Å; E41-R45 PolarHBondContact O-NE 2.71Å; E41-R45 PolarHBondContact O-NH2 3.1Å; H42-R45 WeakPolarHBondContact O-CB 3.18Å; H42-R45 PolarHBondContact O-N 3.08Å; C43-R45 WeakPolarHBondContact O-CG 3.42Å; C43-R45 PolarHBondContact O-N 3.05Å; R45-D49 HydrophobicContact CB-CB 4.01Å; R45-D49 HydrophobicContact CG-CB 4.39Å; R45-D49 IonicContact CZ-OD2 3.75Å; R45-D49 IonicContact NH1-OD1 2.81Å; R45-D49 PolarHBondContact NH1-OD1 2.81Å; R45-D49 IonicContact NH1-OD2 2.99Å; R45-D49 PolarHBondContact NH1-OD2 3.36Å; R45-W52 HydrophobicContact CB-CB 3.81Å; R45-W52 HydrophobicContact CB-CD2 4.46Å; R45-W52 HydrophobicContact CB-CG 4.1Å; R45-N232 PolarHBondContact O-ND2 3Å
46	N	84.8	Confident	77.3	Confident	5 Å²	5	63 Å²	63	3%	0.027	29%	0.293	C	S	.	.			trans	-127.3	-172.1	-175.7	70.2	13	0	0	0	111.2	F48 D49 W52 G73 E74 P76 W77 W332	N46-F48 PolarHBondContact O-N 3.17Å; N46-F48 PolarHBondContact OD1-N 3.01Å; N46-F48 VanDerWaalsContact OD1-N 3.07Å; N46-D49 PolarHBondContact O-N 3.44Å; N46-W52 VanDerWaalsContact O-CD1 3.3Å; N46-G73 WeakPolarHBondContact CB-O 3.47Å; N46-E74 WeakPolarHBondContact CB-O 3.35Å; N46-E74 VanDerWaalsContact CG-O 3.31Å; N46-E74 PolarHBondContact ND2-O 3.49Å; N46-P76 HydrophobicContact CB-CG 4.34Å; N46-W77 HydrophobicContact CB-CH2 4.28Å; N46-W77 HydrophobicContact CB-CZ3 4.3Å; N46-W332 PolarHBondContact ND2-NE1 3.23Å
47	A	76.4	Confident	77.1	Confident	10 Å²	10	63 Å²	63	8%	0.083	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-19.9	-176.8	0	0	0	0	0	115.8	I60 A71 G73	A47-I60 HydrophobicContact CB-CB 3.9Å; A47-I60 HydrophobicContact CB-CD1 3.46Å; A47-I60 VanDerWaalsContact CB-CD1 3.46Å; A47-I60 HydrophobicContact CB-CG1 4.25Å; A47-I60 HydrophobicContact CB-CG2 3.68Å; A47-A71 HydrophobicContact CB-CB 4.06Å; A47-G73 PolarHBondContact N-O 3.27Å
48	F	76.5	Confident	76.9	Confident	96 Å²	96	60.4 Å²	60.4	42%	0.421	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-9.5	-178.2	-56.6	-74.6	0	0	0	113.7	N46 A71 E74	N46-F48 PolarHBondContact O-N 3.17Å; N46-F48 PolarHBondContact OD1-N 3.01Å; N46-F48 VanDerWaalsContact OD1-N 3.07Å; F48-A71 HydrophobicContact CE1-CB 4.05Å; F48-A71 HydrophobicContact CE2-CB 3.68Å; F48-A71 HydrophobicContact CZ-CB 3.31Å; F48-E74 HydrophobicContact CD2-CG 4.22Å; F48-E74 HydrophobicContact CE2-CB 3.91Å; F48-E74 HydrophobicContact CE2-CG 3.62Å
49	D	77.8	Confident	76.3	Confident	29 Å²	29	61.2 Å²	61.2	16%	0.155	31%	0.314	C	S	.	.			trans	-81.6	123.2	175.3	-175.9	-64.3	0	0	0	110.2	R45 N46 E51 W52 R53	R45-D49 HydrophobicContact CB-CB 4.01Å; R45-D49 HydrophobicContact CG-CB 4.39Å; R45-D49 IonicContact CZ-OD2 3.75Å; R45-D49 IonicContact NH1-OD1 2.81Å; R45-D49 PolarHBondContact NH1-OD1 2.81Å; R45-D49 IonicContact NH1-OD2 2.99Å; R45-D49 PolarHBondContact NH1-OD2 3.36Å; N46-D49 PolarHBondContact O-N 3.44Å; D49-E51 VanDerWaalsContact C-N 3.34Å; D49-E51 PolarHBondContact O-N 2.88Å; D49-E51 VanDerWaalsContact OD1-CA 3.31Å; D49-E51 WeakPolarHBondContact OD1-CA 3.39Å; D49-E51 VanDerWaalsContact OD1-CB 3.28Å; D49-E51 WeakPolarHBondContact OD1-CB 3.32Å; D49-E51 PolarHBondContact OD1-N 2.94Å; D49-W52 HydrophobicContact CB-CB 3.98Å; D49-W52 PolarHBondContact O-N 2.8Å; D49-W52 PolarHBondContact OD1-N 3Å; D49-R53 WeakPolarHBondContact O-CB 3.44Å; D49-R53 PolarHBondContact O-N 3.47Å
50	N	77.6	Confident	75.5	Confident	93 Å²	93	61.3 Å²	61.3	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-33.2	-178.8	-80.8	-40.5	0	0	0	113.2	R53 K54	N50-R53 PolarHBondContact OD1-NH2 2.79Å; N50-K54 VanDerWaalsContact O-CG 3.22Å; N50-K54 WeakPolarHBondContact O-CG 3.17Å; N50-K54 PolarHBondContact O-N 3.02Å
51	E	73.2	Confident	74.7	Confident	93 Å²	93	63.2 Å²	63.2	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-69.1	-37.8	176.3	-60.4	-51.8	133.4	0	0	110.6	D49 K54 Y55	D49-E51 VanDerWaalsContact C-N 3.34Å; D49-E51 PolarHBondContact O-N 2.88Å; D49-E51 VanDerWaalsContact OD1-CA 3.31Å; D49-E51 WeakPolarHBondContact OD1-CA 3.39Å; D49-E51 VanDerWaalsContact OD1-CB 3.28Å; D49-E51 WeakPolarHBondContact OD1-CB 3.32Å; D49-E51 PolarHBondContact OD1-N 2.94Å; E51-K54 IonicContact OE1-NZ 3.82Å; E51-K54 PolarHBondContact OE1-NZ 3.13Å; E51-K54 IonicContact OE2-NZ 3.61Å; E51-K54 PolarHBondContact OE2-NZ 2.88Å; E51-Y55 WeakPolarHBondContact O-CD2 3.47Å; E51-Y55 WeakPolarHBondContact O-CE2 3.43Å
52	W	73.2	Confident	73.6	Confident	2 Å²	2	65 Å²	65	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-68.7	-46.1	174.1	-172.6	-118	0	0	0	112.6	H42 R45 N46 D49 K54 Y55 F56 N232	H42-W52 HydrophobicContact CB-CE3 4.08Å; H42-W52 HydrophobicContact CB-CZ3 3.82Å; H42-W52 AromaticContact CD2-CZ3 3.93Å; R45-W52 HydrophobicContact CB-CB 3.81Å; R45-W52 HydrophobicContact CB-CD2 4.46Å; R45-W52 HydrophobicContact CB-CG 4.1Å; N46-W52 VanDerWaalsContact O-CD1 3.3Å; D49-W52 HydrophobicContact CB-CB 3.98Å; D49-W52 PolarHBondContact O-N 2.8Å; D49-W52 PolarHBondContact OD1-N 3Å; W52-K54 PolarHBondContact O-N 3.44Å; W52-Y55 HydrophobicContact CE3-CD2 4.13Å; W52-Y55 WeakPolarHBondContact O-CB 3.46Å; W52-Y55 WeakPolarHBondContact O-CD2 3.4Å; W52-Y55 PolarHBondContact O-N 2.92Å; W52-Y55 VanDerWaalsContact O-N 3.1Å; W52-F56 AromaticContact CD1-CE2 3.96Å; W52-F56 AromaticContact CD2-CE2 3.82Å; W52-F56 HydrophobicContact CD2-CE2 3.82Å; W52-F56 HydrophobicContact CD2-CZ 4.47Å; W52-F56 AromaticContact CE2-CE2 3.37Å; W52-F56 AromaticContact CE2-CZ 3.79Å; W52-F56 HydrophobicContact CE3-CE2 4.42Å; W52-F56 HydrophobicContact CG-CE2 4.2Å; W52-F56 HydrophobicContact CH2-CE2 4.26Å; W52-F56 AromaticContact CH2-CZ 3.95Å; W52-F56 HydrophobicContact CH2-CZ 3.95Å; W52-F56 AromaticContact CZ2-CE2 3.63Å; W52-F56 HydrophobicContact CZ2-CE2 3.63Å; W52-F56 AromaticContact CZ2-CZ 3.49Å; W52-F56 HydrophobicContact CZ2-CZ 3.49Å; W52-F56 VanDerWaalsContact CZ2-CZ 3.49Å; W52-F56 AromaticContact NE1-CE2 3.48Å; W52-F56 WeakPolarHBondContact O-CD2 3.17Å; W52-N232 HydrophobicContact CH2-CB 4.18Å; W52-N232 VanDerWaalsContact CH2-CG 3.44Å; W52-N232 WeakPolarHBondContact CH2-OD1 3.44Å; W52-N232 HydrophobicContact CZ2-CB 3.69Å; W52-N232 WeakPolarHBondContact CZ2-ND2 3.36Å
53	R	71.5	Confident	72.3	Confident	126 Å²	126	70.7 Å²	70.7	48%	0.475	35%	0.349	S	S	.	.	H	α-helix	trans	-60.9	-32.5	-177.8	-171.7	175.1	62.8	151.7	-2.8	112.7	D49 N50 Y55 F56	D49-R53 WeakPolarHBondContact O-CB 3.44Å; D49-R53 PolarHBondContact O-N 3.47Å; N50-R53 PolarHBondContact OD1-NH2 2.79Å; R53-Y55 PolarHBondContact O-N 3.02Å; R53-Y55 VanDerWaalsContact O-N 3.17Å; R53-F56 CarbonylContact O-C 3.55Å; R53-F56 PolarHBondContact O-N 2.95Å; R53-F56 VanDerWaalsContact O-O 3.05Å
54	K	73.6	Confident	70.2	Confident	140 Å²	140	76.6 Å²	76.6	61%	0.609	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.7	177.3	-75.5	166.9	-164.1	173.2	0	113.3	N50 E51 W52 F56	N50-K54 VanDerWaalsContact O-CG 3.22Å; N50-K54 WeakPolarHBondContact O-CG 3.17Å; N50-K54 PolarHBondContact O-N 3.02Å; E51-K54 IonicContact OE1-NZ 3.82Å; E51-K54 PolarHBondContact OE1-NZ 3.13Å; E51-K54 IonicContact OE2-NZ 3.61Å; E51-K54 PolarHBondContact OE2-NZ 2.88Å; W52-K54 PolarHBondContact O-N 3.44Å; K54-F56 VanDerWaalsContact C-N 3.26Å; K54-F56 PolarHBondContact O-N 3.26Å
55	Y	69.6	Low	68.1	Low	117 Å²	117	77 Å²	77	46%	0.459	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-17.2	177.2	-66.5	-72.3	0	0	0	113.5	F32 E51 W52 R53	F32-Y55 AromaticContact CD2-CD1 3.67Å; F32-Y55 HydrophobicContact CD2-CD1 3.67Å; F32-Y55 AromaticContact CD2-CE1 3.8Å; F32-Y55 HydrophobicContact CD2-CE1 3.8Å; F32-Y55 HydrophobicContact CD2-CG 4.1Å; F32-Y55 AromaticContact CE2-CD1 3.83Å; F32-Y55 HydrophobicContact CE2-CD1 3.83Å; F32-Y55 HydrophobicContact CE2-CD2 4.5Å; F32-Y55 AromaticContact CE2-CE1 3.45Å; F32-Y55 HydrophobicContact CE2-CE1 3.45Å; F32-Y55 VanDerWaalsContact CE2-CE1 3.45Å; F32-Y55 HydrophobicContact CE2-CE2 4.18Å; F32-Y55 HydrophobicContact CE2-CG 4.34Å; F32-Y55 AromaticContact CE2-CZ 3.64Å; E51-Y55 WeakPolarHBondContact O-CD2 3.47Å; E51-Y55 WeakPolarHBondContact O-CE2 3.43Å; W52-Y55 HydrophobicContact CE3-CD2 4.13Å; W52-Y55 WeakPolarHBondContact O-CB 3.46Å; W52-Y55 WeakPolarHBondContact O-CD2 3.4Å; W52-Y55 PolarHBondContact O-N 2.92Å; W52-Y55 VanDerWaalsContact O-N 3.1Å; R53-Y55 PolarHBondContact O-N 3.02Å; R53-Y55 VanDerWaalsContact O-N 3.17Å
56	F	69.1	Low	66.2	Low	15 Å²	15	78 Å²	78	7%	0.066	41%	0.406	C	S	.	.			trans	-118.1	105.6	-178.4	-49.1	-75.5	0	0	0	109	W52 R53 K54 K58 R229	W52-F56 AromaticContact CD1-CE2 3.96Å; W52-F56 AromaticContact CD2-CE2 3.82Å; W52-F56 HydrophobicContact CD2-CE2 3.82Å; W52-F56 HydrophobicContact CD2-CZ 4.47Å; W52-F56 AromaticContact CE2-CE2 3.37Å; W52-F56 AromaticContact CE2-CZ 3.79Å; W52-F56 HydrophobicContact CE3-CE2 4.42Å; W52-F56 HydrophobicContact CG-CE2 4.2Å; W52-F56 HydrophobicContact CH2-CE2 4.26Å; W52-F56 AromaticContact CH2-CZ 3.95Å; W52-F56 HydrophobicContact CH2-CZ 3.95Å; W52-F56 AromaticContact CZ2-CE2 3.63Å; W52-F56 HydrophobicContact CZ2-CE2 3.63Å; W52-F56 AromaticContact CZ2-CZ 3.49Å; W52-F56 HydrophobicContact CZ2-CZ 3.49Å; W52-F56 VanDerWaalsContact CZ2-CZ 3.49Å; W52-F56 AromaticContact NE1-CE2 3.48Å; W52-F56 WeakPolarHBondContact O-CD2 3.17Å; R53-F56 CarbonylContact O-C 3.55Å; R53-F56 PolarHBondContact O-N 2.95Å; R53-F56 VanDerWaalsContact O-O 3.05Å; K54-F56 VanDerWaalsContact C-N 3.26Å; K54-F56 PolarHBondContact O-N 3.26Å; F56-K58 PolarHBondContact O-N 2.98Å; F56-R229 HydrophobicContact CD1-CB 3.87Å; F56-R229 HydrophobicContact CD1-CG 4.36Å; F56-R229 HydrophobicContact CE1-CB 4.07Å; F56-R229 HydrophobicContact CG-CB 4.23Å; F56-R229 HydrophobicContact CG-CG 4.21Å
57	G	63	Low	64.1	Low	89 Å²	89	81 Å²	81	92%	0.918	44%	0.439	S	S	*	.	S	Bend	trans	-63.1	7.1	178.4	0	0	0	0	0	115.7
58	K	65.8	Low	63	Low	122 Å²	122	84.1 Å²	84.1	53%	0.53	46%	0.459	S	S	.	.	S	Bend	trans	-124.4	136.7	176.8	-65.3	177.7	-175.3	161.4	0	109.6	E30 F56	E30-K58 IonicContact OE1-NZ 3.49Å; F56-K58 PolarHBondContact O-N 2.98Å
59	P	64	Low	61.6	Low	100 Å²	100	82.8 Å²	82.8	65%	0.649	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-60.9	143.6	173.7	25.4	-31.8	0	0	0	110.5
60	I	62.7	Low	60.7	Low	21 Å²	21	81.8 Å²	81.8	11%	0.108	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-82.5	121.6	172.8	-67.7	166.3	0	0	0	107.8	A47 Y72 R229 Y230	A47-I60 HydrophobicContact CB-CB 3.9Å; A47-I60 HydrophobicContact CB-CD1 3.46Å; A47-I60 VanDerWaalsContact CB-CD1 3.46Å; A47-I60 HydrophobicContact CB-CG1 4.25Å; A47-I60 HydrophobicContact CB-CG2 3.68Å; I60-Y72 WeakPolarHBondContact CG2-O 3.5Å; I60-R229 HydrophobicContact CD1-CG 3.75Å; I60-R229 HydrophobicContact CG1-CG 3.44Å; I60-R229 VanDerWaalsContact CG1-CG 3.44Å; I60-Y230 HydrophobicContact CG2-CE1 4.15Å
61	N	62.2	Low	59.7	Low	104 Å²	104	77.6 Å²	77.6	56%	0.556	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-64.2	138.6	-176	-69.1	-28.7	0	0	0	110.9	Y72	N61-Y72 HydrophobicContact CB-CD2 4.25Å; N61-Y72 WeakPolarHBondContact O-CD2 3.47Å; N61-Y72 PolarHBondContact O-N 2.85Å; N61-Y72 VanDerWaalsContact O-N 3.12Å
62	K	54.6	Low	59	Low	142 Å²	142	73.8 Å²	73.8	62%	0.617	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	148.1	166.4	-62	-172.9	-178.9	-169.7	0	110	T70 A71	K62-T70 CarbonylContact C-O 3.58Å; K62-T70 WeakPolarHBondContact CA-O 3.49Å; K62-A71 HydrophobicContact CG-CB 4.39Å
63	R	54.1	Low	58.8	Low	123 Å²	123	74.2 Å²	74.2	46%	0.464	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154	163.4	-107.7	-166.3	-165.7	-168.3	-3.9	110.1	T70 Y72 D184	R63-T70 PolarHBondContact N-O 2.04Å; R63-T70 PolarHBondContact O-N 2.83Å; R63-Y72 HydrophobicContact CB-CE2 3.95Å; R63-Y72 WeakPolarHBondContact CD-OH 3.46Å; R63-Y72 HydrophobicContact CG-CE2 3.81Å; R63-Y72 PolarHBondContact NE-OH 3.14Å; R63-Y72 VanDerWaalsContact NE-OH 3.16Å; R63-D184 IonicContact NH1-OD2 2.78Å
64	I	46.3	Very low	59.4	Low	132 Å²	132	69.3 Å²	69.3	68%	0.677	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	118.4	171.2	-59.4	179.3	0	0	0	106.7
65	V	47.2	Very low	60.2	Low	10 Å²	10	63.4 Å²	63.4	6%	0.061	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.2	174.2	179.2	0	0	0	0	107.8	G67 S68 T70 I267 K269	V65-G67 PolarHBondContact O-N 2.62Å; V65-S68 PolarHBondContact N-O 2.84Å; V65-S68 PolarHBondContact O-N 2.9Å; V65-S68 VanDerWaalsContact O-O 3.09Å; V65-T70 HydrophobicContact CB-CG2 3.99Å; V65-T70 HydrophobicContact CG2-CG2 4.37Å; V65-T70 WeakPolarHBondContact CG2-OG1 3.48Å; V65-I267 HydrophobicContact CB-CG2 4.13Å; V65-I267 HydrophobicContact CG1-CB 4.16Å; V65-I267 HydrophobicContact CG1-CG2 3.5Å; V65-I267 VanDerWaalsContact CG1-CG2 3.5Å; V65-I267 HydrophobicContact CG2-CG2 3.49Å; V65-I267 VanDerWaalsContact CG2-CG2 3.49Å; V65-K269 HydrophobicContact CG1-CG 4.21Å
66	G	46.6	Very low	61.2	Low	69 Å²	69	58 Å²	58	71%	0.711	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	22.6	176	0	0	0	0	0	115.4
67	G	42.5	Very low	62.4	Low	69 Å²	69	57.3 Å²	57.3	71%	0.711	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	-8.8	-177.1	0	0	0	0	0	115.3	V65	V65-G67 PolarHBondContact O-N 2.62Å
68	S	51.5	Low	64	Low	74 Å²	74	53.2 Å²	53.2	52%	0.517	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.1	175.9	-71.3	0	0	0	0	111	V65 T70	V65-S68 PolarHBondContact N-O 2.84Å; V65-S68 PolarHBondContact O-N 2.9Å; V65-S68 VanDerWaalsContact O-O 3.09Å; S68-T70 PolarHBondContact O-N 3.44Å; S68-T70 VanDerWaalsContact O-N 3.14Å
69	A	48.4	Very low	65.5	Low	69 Å²	69	47.4 Å²	47.4	57%	0.57	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	105.4	175.4	0	0	0	0	0	109.7
70	T	59.2	Low	67.1	Low	8 Å²	8	42.7 Å²	42.7	5%	0.049	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	155.2	172.8	69.4	0	0	0	0	109.4	K62 R63 V65 S68	K62-T70 CarbonylContact C-O 3.58Å; K62-T70 WeakPolarHBondContact CA-O 3.49Å; R63-T70 PolarHBondContact N-O 2.04Å; R63-T70 PolarHBondContact O-N 2.83Å; V65-T70 HydrophobicContact CB-CG2 3.99Å; V65-T70 HydrophobicContact CG2-CG2 4.37Å; V65-T70 WeakPolarHBondContact CG2-OG1 3.48Å; S68-T70 PolarHBondContact O-N 3.44Å; S68-T70 VanDerWaalsContact O-N 3.14Å
71	A	56.7	Low	68.7	Low	5 Å²	5	41.8 Å²	41.8	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.6	172	0	0	0	0	0	110.5	A47 F48 K62 G73 E74	A47-A71 HydrophobicContact CB-CB 4.06Å; F48-A71 HydrophobicContact CE1-CB 4.05Å; F48-A71 HydrophobicContact CE2-CB 3.68Å; F48-A71 HydrophobicContact CZ-CB 3.31Å; K62-A71 HydrophobicContact CG-CB 4.39Å; A71-G73 PolarHBondContact O-N 3.11Å; A71-E74 HydrophobicContact CB-CB 4.4Å; A71-E74 PolarHBondContact N-OE2 2.69Å; A71-E74 VanDerWaalsContact O-CB 3.3Å; A71-E74 WeakPolarHBondContact O-CB 3.29Å; A71-E74 PolarHBondContact O-N 2.98Å; A71-E74 VanDerWaalsContact O-N 3.11Å
72	Y	58.4	Low	70.3	Confident	13 Å²	13	37 Å²	37	5%	0.051	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	136.1	157.6	-75.2	-82	0	0	0	107.6	I60 N61 R63 E74 H183 M190	I60-Y72 WeakPolarHBondContact CG2-O 3.5Å; N61-Y72 HydrophobicContact CB-CD2 4.25Å; N61-Y72 WeakPolarHBondContact O-CD2 3.47Å; N61-Y72 PolarHBondContact O-N 2.85Å; N61-Y72 VanDerWaalsContact O-N 3.12Å; R63-Y72 HydrophobicContact CB-CE2 3.95Å; R63-Y72 WeakPolarHBondContact CD-OH 3.46Å; R63-Y72 HydrophobicContact CG-CE2 3.81Å; R63-Y72 PolarHBondContact NE-OH 3.14Å; R63-Y72 VanDerWaalsContact NE-OH 3.16Å; Y72-E74 VanDerWaalsContact C-N 3.28Å; Y72-E74 PolarHBondContact O-N 2.93Å; Y72-H183 HydrophobicContact CD1-CB 3.78Å; Y72-H183 AromaticContact CD1-CD2 3.6Å; Y72-H183 AromaticContact CD1-CG 3.6Å; Y72-H183 HydrophobicContact CE1-CB 3.82Å; Y72-H183 AromaticContact CE1-CD2 3.13Å; Y72-H183 WeakPolarHBondContact CE1-CD2 3.22Å; Y72-H183 AromaticContact CE1-CG 3.58Å; Y72-H183 AromaticContact CE1-NE2 3.94Å; Y72-H183 AromaticContact CZ-CD2 3.71Å; Y72-M190 HydrophobicContact CD1-CE 3.85Å; Y72-M190 HydrophobicContact CE1-CE 3.93Å; Y72-M190 HydrophobicContact CE1-CG 4.28Å; Y72-M190 HydrophobicContact CE1-SD 4.46Å; Y72-M190 HydrophobicContact CG-CE 4.33Å
73	G	68	Low	72.3	Confident	11 Å²	11	30.2 Å²	30.2	11%	0.113	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	24.3	-177.4	0	0	0	0	0	115.1	N46 A47 A71 W75 P76	N46-G73 WeakPolarHBondContact CB-O 3.47Å; A47-G73 PolarHBondContact N-O 3.27Å; A71-G73 PolarHBondContact O-N 3.11Å; G73-W75 VanDerWaalsContact C-N 3.34Å; G73-P76 WeakPolarHBondContact O-CD 3.28Å
74	E	83.3	Confident	74.2	Confident	23 Å²	23	27.6 Å²	27.6	11%	0.107	19%	0.191	C	C	.	.	S	Bend	trans	-67.1	-37.3	161.8	-177	165.8	-177.8	0	0	111.6	N46 F48 A71 Y72 P76 H270	N46-E74 WeakPolarHBondContact CB-O 3.35Å; N46-E74 VanDerWaalsContact CG-O 3.31Å; N46-E74 PolarHBondContact ND2-O 3.49Å; F48-E74 HydrophobicContact CD2-CG 4.22Å; F48-E74 HydrophobicContact CE2-CB 3.91Å; F48-E74 HydrophobicContact CE2-CG 3.62Å; A71-E74 HydrophobicContact CB-CB 4.4Å; A71-E74 PolarHBondContact N-OE2 2.69Å; A71-E74 VanDerWaalsContact O-CB 3.3Å; A71-E74 WeakPolarHBondContact O-CB 3.29Å; A71-E74 PolarHBondContact O-N 2.98Å; A71-E74 VanDerWaalsContact O-N 3.11Å; Y72-E74 VanDerWaalsContact C-N 3.28Å; Y72-E74 PolarHBondContact O-N 2.93Å; E74-P76 WeakPolarHBondContact O-CD 3.43Å; E74-H270 IonicContact OE1-CE1 2.92Å; E74-H270 PolarHBondContact OE1-CE1 2.98Å; E74-H270 IonicContact OE1-ND1 2.86Å; E74-H270 PolarHBondContact OE1-ND1 2.75Å; E74-H270 IonicContact OE2-CE1 3.78Å
75	W	90.6	Very high	76.5	Confident	15 Å²	15	21.3 Å²	21.3	6%	0.057	16%	0.159	C	C	.	.	S	Bend	trans	-123.4	62.4	176.8	-48.8	121.4	0	0	0	110.9	G73 W77 L78 I250 V252 L268 H270 M325 W332	G73-W75 VanDerWaalsContact C-N 3.34Å; W75-W77 HydrophobicContact CE3-CH2 4.11Å; W75-W77 AromaticContact CE3-CZ2 3.49Å; W75-W77 HydrophobicContact CE3-CZ2 3.49Å; W75-W77 VanDerWaalsContact CE3-CZ2 3.49Å; W75-W77 HydrophobicContact CZ3-CH2 4.35Å; W75-W77 AromaticContact CZ3-CZ2 3.86Å; W75-W77 HydrophobicContact CZ3-CZ2 3.86Å; W75-W77 PolarHBondContact O-N 2.87Å; W75-L78 HydrophobicContact CB-CB 4.25Å; W75-L78 WeakPolarHBondContact O-CB 3.32Å; W75-L78 PolarHBondContact O-N 3.23Å; W75-I250 HydrophobicContact CH2-CB 4.16Å; W75-I250 HydrophobicContact CH2-CG1 4.24Å; W75-I250 HydrophobicContact CH2-CG2 4.08Å; W75-I250 HydrophobicContact CZ2-CB 4.18Å; W75-I250 HydrophobicContact CZ2-CG1 4.41Å; W75-I250 HydrophobicContact CZ2-CG2 3.59Å; W75-V252 HydrophobicContact CB-CG1 4.16Å; W75-V252 HydrophobicContact CD2-CG2 3.95Å; W75-V252 HydrophobicContact CG-CB 4.49Å; W75-V252 HydrophobicContact CG-CG1 3.78Å; W75-V252 HydrophobicContact CG-CG2 4Å; W75-V252 HydrophobicContact CZ2-CG2 4.27Å; W75-L268 HydrophobicContact CB-CD2 4.33Å; W75-H270 AromaticContact CE2-ND1 3.65Å; W75-H270 AromaticContact CZ2-ND1 3.47Å; W75-H270 WeakPolarHBondContact CZ2-ND1 3.35Å; W75-H270 AromaticContact NE1-CG 3.78Å; W75-H270 AromaticContact NE1-ND1 3.25Å; W75-H270 PolarHBondContact NE1-ND1 2.92Å; W75-M325 HydrophobicContact CD2-CE 3.48Å; W75-M325 VanDerWaalsContact CD2-CE 3.48Å; W75-M325 HydrophobicContact CE3-CE 3.14Å; W75-M325 HydrophobicContact CG-CE 4.27Å; W75-M325 HydrophobicContact CH2-CE 3.73Å; W75-M325 HydrophobicContact CZ2-CE 4.05Å; W75-M325 HydrophobicContact CZ3-CE 3.28Å; W75-W332 HydrophobicContact CH2-CD2 4.06Å; W75-W332 AromaticContact CH2-CE2 3.75Å; W75-W332 HydrophobicContact CH2-CE3 4.25Å; W75-W332 AromaticContact CH2-CH2 3.87Å; W75-W332 HydrophobicContact CH2-CH2 3.87Å; W75-W332 AromaticContact CH2-CZ2 3.64Å; W75-W332 HydrophobicContact CH2-CZ2 3.64Å; W75-W332 HydrophobicContact CH2-CZ3 4.16Å; W75-W332 AromaticContact CZ3-CD2 3.78Å; W75-W332 HydrophobicContact CZ3-CD2 3.78Å; W75-W332 AromaticContact CZ3-CE2 3.74Å; W75-W332 HydrophobicContact CZ3-CE3 4.22Å; W75-W332 HydrophobicContact CZ3-CG 4.05Å; W75-W332 HydrophobicContact CZ3-CZ2 4.14Å
76	P	90.7	Very high	78.7	Confident	4 Å²	4	23.4 Å²	23.4	3%	0.026	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-4.6	-170	32.2	-37.9	0	0	0	114	N46 G73 E74 Y230 V231 N232	N46-P76 HydrophobicContact CB-CG 4.34Å; G73-P76 WeakPolarHBondContact O-CD 3.28Å; E74-P76 WeakPolarHBondContact O-CD 3.43Å; P76-Y230 WeakPolarHBondContact CA-O 3.23Å; P76-Y230 WeakPolarHBondContact CB-O 3.43Å; P76-V231 CarbonylContact O-C 3.28Å; P76-V231 VanDerWaalsContact O-CA 3.32Å; P76-V231 WeakPolarHBondContact O-CA 3.07Å; P76-N232 CarbonylContact C-O 3.6Å; P76-N232 HydrophobicContact CB-CB 3.87Å; P76-N232 HydrophobicContact CG-CB 3.66Å; P76-N232 PolarHBondContact O-N 3.21Å
77	W	95	Very high	81	Confident	0 Å²	0	22 Å²	22	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-6.5	173.6	49.9	79.2	0	0	0	113.4	G44 N46 W75 T146 L147 N232 A234 M325 W332	G44-W77 VanDerWaalsContact C-CZ3 3.47Å; N46-W77 HydrophobicContact CB-CH2 4.28Å; N46-W77 HydrophobicContact CB-CZ3 4.3Å; W75-W77 HydrophobicContact CE3-CH2 4.11Å; W75-W77 AromaticContact CE3-CZ2 3.49Å; W75-W77 HydrophobicContact CE3-CZ2 3.49Å; W75-W77 VanDerWaalsContact CE3-CZ2 3.49Å; W75-W77 HydrophobicContact CZ3-CH2 4.35Å; W75-W77 AromaticContact CZ3-CZ2 3.86Å; W75-W77 HydrophobicContact CZ3-CZ2 3.86Å; W75-W77 PolarHBondContact O-N 2.87Å; W77-T146 CarbonylContact O-C 3.39Å; W77-T146 WeakPolarHBondContact O-CA 3.04Å; W77-L147 HydrophobicContact CB-CB 4.32Å; W77-L147 WeakPolarHBondContact O-CB 3.45Å; W77-L147 PolarHBondContact O-N 3.07Å; W77-N232 WeakPolarHBondContact CA-O 3.49Å; W77-N232 VanDerWaalsContact CB-O 3.29Å; W77-N232 WeakPolarHBondContact CB-O 3.48Å; W77-A234 HydrophobicContact CB-CB 3.86Å; W77-A234 HydrophobicContact CD2-CB 4.04Å; W77-A234 HydrophobicContact CG-CB 3.64Å; W77-M325 HydrophobicContact CZ2-CE 4.41Å; W77-M325 HydrophobicContact CZ2-CG 4.26Å; W77-W332 HydrophobicContact CH2-CB 3.73Å; W77-W332 AromaticContact CH2-CD1 3.98Å; W77-W332 HydrophobicContact CH2-CG 4.05Å; W77-W332 HydrophobicContact CZ2-CB 3.83Å; W77-W332 HydrophobicContact CZ2-CG 4.27Å
78	L	95.9	Very high	83.4	Confident	3 Å²	3	24.6 Å²	24.6	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	138.7	178.9	-172.5	73.3	0	0	0	110.5	W75 V252 W254 L268 P323	W75-L78 HydrophobicContact CB-CB 4.25Å; W75-L78 WeakPolarHBondContact O-CB 3.32Å; W75-L78 PolarHBondContact O-N 3.23Å; L78-V252 HydrophobicContact CD1-CG1 4.4Å; L78-V252 HydrophobicContact CD2-CG1 3.65Å; L78-W254 HydrophobicContact CB-CH2 4.47Å; L78-W254 HydrophobicContact CD1-CZ3 4.43Å; L78-W254 HydrophobicContact CD2-CE3 4.04Å; L78-W254 HydrophobicContact CD2-CH2 3.33Å; L78-W254 HydrophobicContact CD2-CZ2 3.99Å; L78-W254 HydrophobicContact CD2-CZ3 3.36Å; L78-W254 HydrophobicContact CG-CH2 3.69Å; L78-W254 HydrophobicContact CG-CZ3 3.6Å; L78-L268 HydrophobicContact CD2-CD1 3.1Å; L78-L268 HydrophobicContact CD2-CD2 3.68Å; L78-L268 HydrophobicContact CD2-CG 4.01Å; L78-P323 HydrophobicContact CD1-CG 3.98Å
79	T	97.6	Very high	85.3	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.6	179.3	70.4	0	0	0	0	110.7	G144 G145 L147 I153 V178 R179 I180	T79-G144 CarbonylContact O-C 3.46Å; T79-G144 WeakPolarHBondContact O-CA 3.11Å; T79-G145 PolarHBondContact N-O 3.04Å; T79-G145 PolarHBondContact O-N 3.09Å; T79-G145 VanDerWaalsContact OG1-CA 3.23Å; T79-G145 WeakPolarHBondContact OG1-CA 3.25Å; T79-G145 PolarHBondContact OG1-O 3.3Å; T79-L147 HydrophobicContact CG2-CB 4.09Å; T79-I153 HydrophobicContact CG2-CD1 4.47Å; T79-I153 HydrophobicContact CG2-CG1 4.21Å; T79-V178 HydrophobicContact CG2-CG1 4.18Å; T79-R179 WeakPolarHBondContact CA-O 3.21Å; T79-I180 HydrophobicContact CG2-CD1 4.32Å; T79-I180 HydrophobicContact CG2-CG1 3.83Å; T79-I180 HydrophobicContact CG2-CG2 4.34Å
80	S	96.8	Very high	87.3	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.007	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	117.5	172.1	164.7	0	0	0	0	109.1	M82 H141 V178 R179	S80-M82 PolarHBondContact O-N 2.76Å; S80-H141 PolarHBondContact OG-ND1 2.94Å; S80-V178 CarbonylContact O-C 3.48Å; S80-V178 WeakPolarHBondContact O-CA 3.39Å; S80-R179 PolarHBondContact N-O 3.36Å; S80-R179 PolarHBondContact O-N 3.05Å
81	L	97.8	Very high	88.7	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	104.9	170	-83.1	64.8	0	0	0	107.8	L142 C143 I153 T155 F160 W176 V178 V219	L81-L142 PolarHBondContact O-N 3.47Å; L81-C143 HydrophobicContact CB-CB 4.19Å; L81-C143 WeakPolarHBondContact CB-O 3.44Å; L81-C143 PolarHBondContact N-O 2.81Å; L81-C143 PolarHBondContact O-N 2.86Å; L81-I153 HydrophobicContact CD1-CG2 4.3Å; L81-T155 HydrophobicContact CD2-CG2 3.81Å; L81-F160 HydrophobicContact CD2-CE1 4.24Å; L81-F160 HydrophobicContact CD2-CZ 3.65Å; L81-W176 HydrophobicContact CB-CE3 4.17Å; L81-W176 HydrophobicContact CB-CZ3 4.17Å; L81-V178 HydrophobicContact CD1-CG1 4.42Å; L81-V219 HydrophobicContact CD2-CG2 4.34Å
82	M	96.1	Very high	90.1	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.02	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.6	178.8	-53.8	-176.2	83.9	0	0	109.8	S80 Y131 R139 F140 W176 I177 R179	S80-M82 PolarHBondContact O-N 2.76Å; M82-Y131 HydrophobicContact CE-CD2 3.57Å; M82-Y131 HydrophobicContact CE-CE2 3.29Å; M82-R139 HydrophobicContact CB-CG 3.8Å; M82-R139 HydrophobicContact CE-CG 4.02Å; M82-R139 HydrophobicContact SD-CG 4.43Å; M82-F140 CarbonylContact C-O 3.12Å; M82-F140 WeakPolarHBondContact CA-O 3.27Å; M82-W176 WeakPolarHBondContact O-CA 3.32Å; M82-I177 HydrophobicContact CB-CB 4.42Å; M82-I177 WeakPolarHBondContact CB-O 3.25Å; M82-I177 PolarHBondContact N-O 3.11Å; M82-I177 PolarHBondContact O-N 3.34Å; M82-R179 HydrophobicContact CG-CB 4.4Å; M82-R179 HydrophobicContact SD-CB 3.97Å
83	F	95.6	Very high	91.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.6	176.5	-176.2	-126.6	0	0	0	110.2	Q85 R139 F140 L142 L169 S175 W176	F83-Q85 HydrophobicContact CD1-CG 3.67Å; F83-Q85 HydrophobicContact CE1-CG 3.27Å; F83-Q85 HydrophobicContact CZ-CG 4.04Å; F83-R139 VanDerWaalsContact O-CA 3.29Å; F83-R139 WeakPolarHBondContact O-CA 3.09Å; F83-F140 HydrophobicContact CB-CZ 4.47Å; F83-F140 HydrophobicContact CD1-CE1 4.23Å; F83-F140 HydrophobicContact CD1-CE2 4.46Å; F83-F140 AromaticContact CD1-CZ 3.77Å; F83-F140 HydrophobicContact CD1-CZ 3.77Å; F83-F140 PolarHBondContact N-O 3.45Å; F83-F140 PolarHBondContact O-N 3.26Å; F83-F140 VanDerWaalsContact O-N 3.12Å; F83-L142 HydrophobicContact CB-CB 4.06Å; F83-L142 HydrophobicContact CB-CD2 4.34Å; F83-L169 HydrophobicContact CD1-CD2 3.84Å; F83-L169 HydrophobicContact CD2-CD2 3.77Å; F83-L169 HydrophobicContact CE1-CD2 3.77Å; F83-L169 HydrophobicContact CE2-CD2 3.71Å; F83-L169 HydrophobicContact CG-CD2 3.85Å; F83-L169 HydrophobicContact CZ-CD2 3.73Å; F83-L169 HydrophobicContact CZ-CG 4.48Å; F83-S175 WeakPolarHBondContact CD2-O 3.33Å; F83-W176 HydrophobicContact CB-CE3 4.31Å; F83-W176 HydrophobicContact CB-CH2 4.24Å; F83-W176 HydrophobicContact CB-CZ3 3.89Å; F83-W176 HydrophobicContact CD2-CD2 4.35Å; F83-W176 HydrophobicContact CD2-CE3 4.4Å; F83-W176 AromaticContact CD2-CH2 3.96Å; F83-W176 HydrophobicContact CD2-CH2 3.96Å; F83-W176 AromaticContact CD2-CZ2 3.86Å; F83-W176 HydrophobicContact CD2-CZ2 3.86Å; F83-W176 HydrophobicContact CD2-CZ3 4.22Å; F83-W176 HydrophobicContact CE2-CZ2 4.37Å; F83-W176 HydrophobicContact CG-CH2 4.39Å; F83-W176 HydrophobicContact CG-CZ3 4.47Å
84	Y	94.9	Very high	92	Very high	68 Å²	68	34.9 Å²	34.9	27%	0.267	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.4	175.1	174.8	-97.5	0	0	0	110.2	T86 Y133 S137 S175	Y84-T86 HydrophobicContact CE1-CG2 3.94Å; Y84-Y133 HydrophobicContact CD2-CE2 4.39Å; Y84-Y133 HydrophobicContact CE2-CD2 4.37Å; Y84-Y133 HydrophobicContact CE2-CE2 4.24Å; Y84-S137 WeakPolarHBondContact OH-CB 3.49Å; Y84-S137 PolarHBondContact OH-OG 2.68Å; Y84-S175 PolarHBondContact N-O 3.47Å
85	Q	92.7	Very high	92	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.2	172.9	-66.4	-173.3	-62.7	0	0	110.4	F83 Q89 V90 S137 R138 F140	F83-Q85 HydrophobicContact CD1-CG 3.67Å; F83-Q85 HydrophobicContact CE1-CG 3.27Å; F83-Q85 HydrophobicContact CZ-CG 4.04Å; Q85-Q89 HydrophobicContact CB-CB 4.28Å; Q85-V90 HydrophobicContact CB-CG2 3.82Å; Q85-S137 CarbonylContact O-C 3.51Å; Q85-S137 VanDerWaalsContact O-CA 3.28Å; Q85-S137 WeakPolarHBondContact O-CA 3.41Å; Q85-S137 WeakPolarHBondContact O-CB 3.38Å; Q85-R138 HydrophobicContact CB-CG 4.18Å; Q85-R138 PolarHBondContact N-O 3.34Å; Q85-R138 PolarHBondContact O-N 3.15Å; Q85-R138 VanDerWaalsContact OE1-CZ 3.24Å; Q85-F140 HydrophobicContact CG-CE1 4.21Å
86	T	94.8	Very high	91.3	Very high	54 Å²	54	42 Å²	42	33%	0.331	20%	0.203	S	C	.	.			trans	-63.5	158.4	170.1	62	0	0	0	0	111.1	Y84 E88 Q89 V90	Y84-T86 HydrophobicContact CE1-CG2 3.94Å; T86-E88 PolarHBondContact O-N 3.17Å; T86-Q89 PolarHBondContact O-N 2.96Å; T86-Q89 VanDerWaalsContact O-N 3.08Å; T86-Q89 VanDerWaalsContact OG1-CD 3.3Å; T86-Q89 VanDerWaalsContact OG1-CG 3.26Å; T86-Q89 WeakPolarHBondContact OG1-CG 3.49Å; T86-Q89 PolarHBondContact OG1-N 3.09Å; T86-Q89 PolarHBondContact OG1-OE1 2.78Å; T86-V90 WeakPolarHBondContact O-CG2 3.46Å; T86-V90 PolarHBondContact O-N 2.81Å
87	A	94.1	Very high	90.4	Very high	40 Å²	40	43.9 Å²	43.9	33%	0.331	21%	0.212	S	C	.	.	H	α-helix	trans	-55.6	-35.8	176.6	0	0	0	0	0	113	V90 K91 D135	A87-V90 PolarHBondContact O-N 2.93Å; A87-K91 WeakPolarHBondContact O-CB 3.41Å; A87-K91 PolarHBondContact O-N 3.23Å; A87-D135 WeakPolarHBondContact CB-O 3.47Å
88	E	93.7	Very high	89.4	Confident	122 Å²	122	48.3 Å²	48.3	57%	0.57	23%	0.234	S	C	*	.	H	α-helix	trans	-65.1	-45.2	176.2	-170.2	-172.4	156.2	0	0	111.9	T86 V90 K91 K92	T86-E88 PolarHBondContact O-N 3.17Å; E88-V90 VanDerWaalsContact C-N 3.35Å; E88-K91 PolarHBondContact O-N 3.08Å; E88-K92 HydrophobicContact CG-CD 4.37Å; E88-K92 WeakPolarHBondContact O-CG 3.31Å; E88-K92 PolarHBondContact O-N 3.25Å; E88-K92 WeakPolarHBondContact OE1-CE 3.22Å; E88-K92 IonicContact OE1-NZ 3.47Å; E88-K92 PolarHBondContact OE1-NZ 3.47Å
89	Q	91.7	Very high	88.3	Confident	39 Å²	39	54.1 Å²	54.1	18%	0.182	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-40.9	176.9	-71.7	166.2	-35.3	0	0	111.4	Q85 T86 K91 K92 Q93 H168	Q85-Q89 HydrophobicContact CB-CB 4.28Å; T86-Q89 PolarHBondContact O-N 2.96Å; T86-Q89 VanDerWaalsContact O-N 3.08Å; T86-Q89 VanDerWaalsContact OG1-CD 3.3Å; T86-Q89 VanDerWaalsContact OG1-CG 3.26Å; T86-Q89 WeakPolarHBondContact OG1-CG 3.49Å; T86-Q89 PolarHBondContact OG1-N 3.09Å; T86-Q89 PolarHBondContact OG1-OE1 2.78Å; Q89-K91 VanDerWaalsContact C-N 3.33Å; Q89-K91 PolarHBondContact O-N 3.23Å; Q89-K92 PolarHBondContact O-N 2.86Å; Q89-Q93 WeakPolarHBondContact O-CB 3.36Å; Q89-Q93 PolarHBondContact O-N 3.44Å; Q89-H168 HydrophobicContact CG-CB 4.21Å
90	V	89.3	Confident	86.9	Confident	11 Å²	11	56.7 Å²	56.7	7%	0.067	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-43.4	175.5	175.4	0	0	0	0	110.9	Q85 T86 A87 E88 K94 R138	Q85-V90 HydrophobicContact CB-CG2 3.82Å; T86-V90 WeakPolarHBondContact O-CG2 3.46Å; T86-V90 PolarHBondContact O-N 2.81Å; A87-V90 PolarHBondContact O-N 2.93Å; E88-V90 VanDerWaalsContact C-N 3.35Å; V90-K94 HydrophobicContact CG1-CD 4.37Å; V90-K94 WeakPolarHBondContact O-CG 3.47Å; V90-K94 PolarHBondContact O-N 3.46Å; V90-K94 VanDerWaalsContact O-N 3.11Å; V90-R138 HydrophobicContact CG2-CG 3.67Å
91	K	89.2	Confident	85.7	Confident	135 Å²	135	60.3 Å²	60.3	59%	0.587	30%	0.297	S	S	*	.	H	α-helix	trans	-64	-49.6	178.1	-174.6	-179.8	174.7	-172.9	0	111.8	A87 E88 Q89 Q93 K94 E95	A87-K91 WeakPolarHBondContact O-CB 3.41Å; A87-K91 PolarHBondContact O-N 3.23Å; E88-K91 PolarHBondContact O-N 3.08Å; Q89-K91 VanDerWaalsContact C-N 3.33Å; Q89-K91 PolarHBondContact O-N 3.23Å; K91-Q93 VanDerWaalsContact C-N 3.31Å; K91-Q93 PolarHBondContact O-N 2.83Å; K91-K94 PolarHBondContact O-N 2.98Å; K91-E95 WeakPolarHBondContact CE-OE1 3.43Å; K91-E95 WeakPolarHBondContact O-CG 3.18Å; K91-E95 PolarHBondContact O-N 3.01Å
92	K	86.4	Confident	84.3	Confident	90 Å²	90	65.6 Å²	65.6	39%	0.391	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-41.4	178.2	-77.7	174.3	170.4	169.5	0	112.3	E88 Q89 E95 L96	E88-K92 HydrophobicContact CG-CD 4.37Å; E88-K92 WeakPolarHBondContact O-CG 3.31Å; E88-K92 PolarHBondContact O-N 3.25Å; E88-K92 WeakPolarHBondContact OE1-CE 3.22Å; E88-K92 IonicContact OE1-NZ 3.47Å; E88-K92 PolarHBondContact OE1-NZ 3.47Å; Q89-K92 PolarHBondContact O-N 2.86Å; K92-E95 PolarHBondContact O-N 2.78Å; K92-L96 WeakPolarHBondContact O-CG 3.28Å; K92-L96 PolarHBondContact O-N 2.83Å
93	Q	83.5	Confident	82.9	Confident	5 Å²	5	71.9 Å²	71.9	2%	0.023	35%	0.351	C	S	.	.	H	α-helix	trans	-64.7	-43.2	177.8	-170.6	174.3	12.5	0	0	111.7	Q89 K91 E95 L96 Q97 F165	Q89-Q93 WeakPolarHBondContact O-CB 3.36Å; Q89-Q93 PolarHBondContact O-N 3.44Å; K91-Q93 VanDerWaalsContact C-N 3.31Å; K91-Q93 PolarHBondContact O-N 2.83Å; Q93-E95 VanDerWaalsContact C-N 3.31Å; Q93-E95 PolarHBondContact O-N 3.38Å; Q93-L96 PolarHBondContact O-N 2.87Å; Q93-Q97 WeakPolarHBondContact O-CG 3.29Å; Q93-Q97 PolarHBondContact O-N 2.83Å; Q93-F165 PolarHBondContact NE2-O 2.84Å
94	K	82.1	Confident	81.4	Confident	117 Å²	117	74.7 Å²	74.7	51%	0.509	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-38.1	174.2	-72.3	176.4	178.7	-176.9	0	112.4	V90 K91 Q97 I98	V90-K94 HydrophobicContact CG1-CD 4.37Å; V90-K94 WeakPolarHBondContact O-CG 3.47Å; V90-K94 PolarHBondContact O-N 3.46Å; V90-K94 VanDerWaalsContact O-N 3.11Å; K91-K94 PolarHBondContact O-N 2.98Å; K94-Q97 PolarHBondContact O-N 2.79Å; K94-I98 VanDerWaalsContact O-CG1 3.28Å; K94-I98 WeakPolarHBondContact O-CG1 3.34Å; K94-I98 PolarHBondContact O-N 2.94Å
95	E	82.8	Confident	79.9	Confident	91 Å²	91	76.6 Å²	76.6	43%	0.425	38%	0.378	S	S	.	.	H	α-helix	trans	-66.5	-39.3	176.1	-71.3	169.4	-179.8	0	0	112.3	K91 K92 Q93 Q97 I98 K99	K91-E95 WeakPolarHBondContact CE-OE1 3.43Å; K91-E95 WeakPolarHBondContact O-CG 3.18Å; K91-E95 PolarHBondContact O-N 3.01Å; K92-E95 PolarHBondContact O-N 2.78Å; Q93-E95 VanDerWaalsContact C-N 3.31Å; Q93-E95 PolarHBondContact O-N 3.38Å; E95-Q97 VanDerWaalsContact C-N 3.34Å; E95-I98 PolarHBondContact O-N 2.81Å; E95-K99 WeakPolarHBondContact O-CG 3.47Å; E95-K99 PolarHBondContact O-N 2.91Å
96	L	76.2	Confident	78.7	Confident	95 Å²	95	83.2 Å²	83.2	50%	0.497	41%	0.409	S	S	.	.	H	α-helix	trans	-64.3	-39.6	173.8	-72.5	168.9	0	0	0	111.7	K92 Q93 K99 S100 P167	K92-L96 WeakPolarHBondContact O-CG 3.28Å; K92-L96 PolarHBondContact O-N 2.83Å; Q93-L96 PolarHBondContact O-N 2.87Å; L96-K99 PolarHBondContact O-N 3.18Å; L96-S100 PolarHBondContact O-N 3.38Å; L96-S100 PolarHBondContact O-OG 2.89Å; L96-P167 HydrophobicContact CD1-CG 4.18Å
97	Q	71.9	Confident	77.1	Confident	45 Å²	45	85.9 Å²	85.9	21%	0.21	42%	0.416	C	S	.	.	H	α-helix	trans	-65.3	-45.1	175.4	-72.8	-174.3	-93	0	0	112.7	Q93 K94 E95 K99 S100 D101 F124	Q93-Q97 WeakPolarHBondContact O-CG 3.29Å; Q93-Q97 PolarHBondContact O-N 2.83Å; K94-Q97 PolarHBondContact O-N 2.79Å; E95-Q97 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.05Å; Q97-S100 WeakPolarHBondContact CA-OG 3.3Å; Q97-S100 PolarHBondContact O-N 3.17Å; Q97-S100 VanDerWaalsContact O-N 3.13Å; Q97-S100 PolarHBondContact O-OG 2.77Å; Q97-D101 WeakPolarHBondContact O-CB 3.49Å; Q97-D101 PolarHBondContact O-N 3.49Å; Q97-F124 HydrophobicContact CG-CD1 4.24Å
98	I	75.3	Confident	75.3	Confident	92 Å²	92	86.7 Å²	86.7	47%	0.472	41%	0.414	S	S	.	.	H	α-helix	trans	-58.6	-40.4	177.9	-69.9	162.9	0	0	0	110.2	K94 E95 D101 E102	K94-I98 VanDerWaalsContact O-CG1 3.28Å; K94-I98 WeakPolarHBondContact O-CG1 3.34Å; K94-I98 PolarHBondContact O-N 2.94Å; E95-I98 PolarHBondContact O-N 2.81Å; I98-D101 PolarHBondContact O-N 2.84Å; I98-E102 HydrophobicContact CG2-CG 4.41Å; I98-E102 WeakPolarHBondContact O-CB 3.34Å; I98-E102 VanDerWaalsContact O-CG 3.25Å; I98-E102 WeakPolarHBondContact O-CG 3.41Å; I98-E102 PolarHBondContact O-N 3.4Å
99	K	71.5	Confident	73.7	Confident	125 Å²	125	86.6 Å²	86.6	54%	0.543	42%	0.418	S	S	.	.	H	α-helix	trans	-65.6	-42.9	175.5	-71.2	178.9	179.2	-173.2	0	112.9	E95 L96 Q97 D101 E102 E103	E95-K99 WeakPolarHBondContact O-CG 3.47Å; E95-K99 PolarHBondContact O-N 2.91Å; L96-K99 PolarHBondContact O-N 3.18Å; Q97-K99 PolarHBondContact O-N 3.05Å; K99-D101 VanDerWaalsContact C-N 3.33Å; K99-E102 PolarHBondContact O-N 3.41Å; K99-E103 WeakPolarHBondContact O-CB 3.34Å; K99-E103 WeakPolarHBondContact O-CG 3.41Å; K99-E103 PolarHBondContact O-N 3.33Å
100	S	69.3	Low	72.1	Confident	55 Å²	55	91.7 Å²	91.7	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-40.3	177.2	60.6	0	0	0	0	111.7	L96 Q97 E103 E104	L96-S100 PolarHBondContact O-N 3.38Å; L96-S100 PolarHBondContact O-OG 2.89Å; Q97-S100 WeakPolarHBondContact CA-OG 3.3Å; Q97-S100 PolarHBondContact O-N 3.17Å; Q97-S100 VanDerWaalsContact O-N 3.13Å; Q97-S100 PolarHBondContact O-OG 2.77Å; S100-E103 PolarHBondContact O-N 3.22Å; S100-E104 VanDerWaalsContact O-CB 3.24Å; S100-E104 WeakPolarHBondContact O-CB 3.49Å; S100-E104 PolarHBondContact O-N 3.06Å
101	D	70	Confident	70.3	Confident	77 Å²	77	93.2 Å²	93.2	41%	0.412	45%	0.449	S	S	.	.	H	α-helix	trans	-67.7	-37.1	178.2	-62.4	-3.7	0	0	0	110.8	Q97 I98 K99 L105	Q97-D101 WeakPolarHBondContact O-CB 3.49Å; Q97-D101 PolarHBondContact O-N 3.49Å; I98-D101 PolarHBondContact O-N 2.84Å; K99-D101 VanDerWaalsContact C-N 3.33Å; D101-L105 WeakPolarHBondContact O-CB 3.2Å; D101-L105 WeakPolarHBondContact O-CD1 3.27Å; D101-L105 VanDerWaalsContact O-CG 3.24Å; D101-L105 WeakPolarHBondContact O-CG 3.41Å; D101-L105 PolarHBondContact O-N 3.05Å
102	E	69.5	Low	68.4	Low	113 Å²	113	93.6 Å²	93.6	53%	0.528	46%	0.458	S	S	.	.	H	α-helix	trans	-66.4	-46.1	173.3	-78	174.1	179.9	0	0	112	I98 K99 E104 L105 E106	I98-E102 HydrophobicContact CG2-CG 4.41Å; I98-E102 WeakPolarHBondContact O-CB 3.34Å; I98-E102 VanDerWaalsContact O-CG 3.25Å; I98-E102 WeakPolarHBondContact O-CG 3.41Å; I98-E102 PolarHBondContact O-N 3.4Å; K99-E102 PolarHBondContact O-N 3.41Å; E102-E104 VanDerWaalsContact C-N 3.33Å; E102-L105 PolarHBondContact O-N 3.2Å; E102-E106 PolarHBondContact O-N 3.42Å
103	E	67.2	Low	66.7	Low	136 Å²	136	97.7 Å²	97.7	64%	0.636	48%	0.476	S	S	*	.	H	α-helix	trans	-63.8	-38.4	175.5	-74.1	174	-177.3	0	0	111.4	K99 S100 E106 F107	K99-E103 WeakPolarHBondContact O-CB 3.34Å; K99-E103 WeakPolarHBondContact O-CG 3.41Å; K99-E103 PolarHBondContact O-N 3.33Å; S100-E103 PolarHBondContact O-N 3.22Å; E103-E106 PolarHBondContact O-N 3.03Å; E103-F107 VanDerWaalsContact O-CB 3.25Å; E103-F107 WeakPolarHBondContact O-CB 3.35Å; E103-F107 PolarHBondContact O-N 3.34Å
104	E	62.4	Low	64.7	Low	58 Å²	58	103.6 Å²	103.6	27%	0.271	51%	0.507	S	S	.	.	H	α-helix	trans	-65.6	-43	174	-172.4	179.2	174.7	0	0	111.1	S100 E102 F107 L108 I121	S100-E104 VanDerWaalsContact O-CB 3.24Å; S100-E104 WeakPolarHBondContact O-CB 3.49Å; S100-E104 PolarHBondContact O-N 3.06Å; E102-E104 VanDerWaalsContact C-N 3.33Å; E104-F107 PolarHBondContact O-N 3.22Å; E104-L108 HydrophobicContact CG-CD1 4.04Å; E104-L108 HydrophobicContact CG-CG 4.33Å; E104-L108 VanDerWaalsContact O-CB 3.32Å; E104-L108 WeakPolarHBondContact O-CB 3.47Å; E104-L108 WeakPolarHBondContact O-CG 3.48Å; E104-L108 PolarHBondContact O-N 3.38Å; E104-I121 HydrophobicContact CG-CD1 4.37Å
105	L	64.3	Low	62.6	Low	108 Å²	108	107 Å²	107	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-43.5	175.1	-79.7	162	0	0	0	112.2	D101 E102 F107 L108 D109	D101-L105 WeakPolarHBondContact O-CB 3.2Å; D101-L105 WeakPolarHBondContact O-CD1 3.27Å; D101-L105 VanDerWaalsContact O-CG 3.24Å; D101-L105 WeakPolarHBondContact O-CG 3.41Å; D101-L105 PolarHBondContact O-N 3.05Å; E102-L105 PolarHBondContact O-N 3.2Å; L105-F107 VanDerWaalsContact C-N 3.35Å; L105-L108 PolarHBondContact O-N 2.93Å; L105-D109 WeakPolarHBondContact O-CB 3.4Å; L105-D109 PolarHBondContact O-N 2.88Å
106	E	66.5	Low	60.6	Low	140 Å²	140	111.3 Å²	111.3	65%	0.654	55%	0.545	S	S	*	.	H	α-helix	trans	-62.5	-42.2	174.6	-75.6	-174	175.7	0	0	111.4	E102 E103 D109 E110	E102-E106 PolarHBondContact O-N 3.42Å; E103-E106 PolarHBondContact O-N 3.03Å; E106-D109 PolarHBondContact O-N 3.49Å; E106-E110 PolarHBondContact O-N 3.02Å
107	F	61.6	Low	58.8	Low	110 Å²	110	113.2 Å²	113.2	48%	0.482	55%	0.554	S	S	.	*	H	α-helix	trans	-66.1	-41.1	176.3	-177.1	-110.9	0	0	0	112.6	E103 E104 L105 D109 E110 I111	E103-F107 VanDerWaalsContact O-CB 3.25Å; E103-F107 WeakPolarHBondContact O-CB 3.35Å; E103-F107 PolarHBondContact O-N 3.34Å; E104-F107 PolarHBondContact O-N 3.22Å; L105-F107 VanDerWaalsContact C-N 3.35Å; F107-D109 VanDerWaalsContact C-N 3.34Å; F107-E110 WeakPolarHBondContact O-CB 3.25Å; F107-E110 PolarHBondContact O-N 2.93Å; F107-I111 HydrophobicContact CD1-CD1 3.78Å; F107-I111 HydrophobicContact CD1-CG1 4.42Å; F107-I111 HydrophobicContact CE1-CD1 3.15Å; F107-I111 HydrophobicContact CE1-CG1 4.13Å; F107-I111 HydrophobicContact CE2-CD1 4.11Å; F107-I111 HydrophobicContact CE2-CG1 4.42Å; F107-I111 HydrophobicContact CG-CD1 4.49Å; F107-I111 HydrophobicContact CZ-CD1 3.36Å; F107-I111 HydrophobicContact CZ-CG1 4.14Å; F107-I111 WeakPolarHBondContact O-CG1 3.41Å; F107-I111 PolarHBondContact O-N 2.77Å
108	L	57.1	Low	57	Low	56 Å²	56	118 Å²	118	29%	0.293	58%	0.581	S	S	.	*	H	α-helix	trans	-66.3	-35.5	175	-72.4	173.4	0	0	0	111.8	E104 L105 E110 I111 N112 L118	E104-L108 HydrophobicContact CG-CD1 4.04Å; E104-L108 HydrophobicContact CG-CG 4.33Å; E104-L108 VanDerWaalsContact O-CB 3.32Å; E104-L108 WeakPolarHBondContact O-CB 3.47Å; E104-L108 WeakPolarHBondContact O-CG 3.48Å; E104-L108 PolarHBondContact O-N 3.38Å; L105-L108 PolarHBondContact O-N 2.93Å; L108-E110 VanDerWaalsContact C-N 3.31Å; L108-I111 CarbonylContact O-C 3.42Å; L108-I111 PolarHBondContact O-N 3.01Å; L108-N112 WeakPolarHBondContact O-CB 3.29Å; L108-N112 PolarHBondContact O-N 3.11Å; L108-L118 HydrophobicContact CD2-CD2 3.83Å
109	D	60.7	Low	55.2	Low	120 Å²	120	119.9 Å²	119.9	64%	0.642	59%	0.587	S	S	*	*	H	α-helix	trans	-66.3	-31.8	172.5	-89.1	-9.7	0	0	0	112.1	L105 E106 F107	L105-D109 WeakPolarHBondContact O-CB 3.4Å; L105-D109 PolarHBondContact O-N 2.88Å; E106-D109 PolarHBondContact O-N 3.49Å; F107-D109 VanDerWaalsContact C-N 3.34Å
110	E	56.4	Low	53.7	Low	147 Å²	147	122.5 Å²	122.5	69%	0.687	60%	0.601	S	S	*	*	H	α-helix	trans	-72.3	-41.2	170	-73.2	-167.1	162	0	0	112.5	E106 F107 L108 K113	E106-E110 PolarHBondContact O-N 3.02Å; F107-E110 WeakPolarHBondContact O-CB 3.25Å; F107-E110 PolarHBondContact O-N 2.93Å; L108-E110 VanDerWaalsContact C-N 3.31Å; E110-K113 PolarHBondContact O-N 3.21Å
111	I	52.3	Low	52.2	Low	42 Å²	42	125.1 Å²	125.1	22%	0.215	61%	0.61	C	S	.	*	H	α-helix	trans	-73	-23.9	178.1	-73.1	-172.8	0	0	0	112.8	F107 L108 K113 N114	F107-I111 HydrophobicContact CD1-CD1 3.78Å; F107-I111 HydrophobicContact CD1-CG1 4.42Å; F107-I111 HydrophobicContact CE1-CD1 3.15Å; F107-I111 HydrophobicContact CE1-CG1 4.13Å; F107-I111 HydrophobicContact CE2-CD1 4.11Å; F107-I111 HydrophobicContact CE2-CG1 4.42Å; F107-I111 HydrophobicContact CG-CD1 4.49Å; F107-I111 HydrophobicContact CZ-CD1 3.36Å; F107-I111 HydrophobicContact CZ-CG1 4.14Å; F107-I111 WeakPolarHBondContact O-CG1 3.41Å; F107-I111 PolarHBondContact O-N 2.77Å; L108-I111 CarbonylContact O-C 3.42Å; L108-I111 PolarHBondContact O-N 3.01Å; I111-K113 PolarHBondContact O-N 2.95Å; I111-N114 CarbonylContact O-C 3.33Å; I111-N114 PolarHBondContact O-N 2.89Å
112	N	50.2	Low	50.9	Low	144 Å²	144	125.1 Å²	125.1	77%	0.77	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	2.9	174.3	-126.5	-11.3	0	0	0	113.2	L108	L108-N112 WeakPolarHBondContact O-CB 3.29Å; L108-N112 PolarHBondContact O-N 3.11Å
113	K	50.6	Low	49.5	Very low	176 Å²	176	123 Å²	123	77%	0.765	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-8.8	165.5	-69.9	178.4	-178.5	163.9	0	115.7	E110 I111	E110-K113 PolarHBondContact O-N 3.21Å; I111-K113 PolarHBondContact O-N 2.95Å
114	N	40.4	Very low	48.6	Very low	128 Å²	128	118.3 Å²	118.3	68%	0.684	59%	0.585	S	S	*	*	S	Bend	trans	-149.5	104.4	175.8	-69.1	-50.4	0	0	0	110.3	I111	I111-N114 CarbonylContact O-C 3.33Å; I111-N114 PolarHBondContact O-N 2.89Å
115	E	38.8	Very low	47.9	Very low	190 Å²	190	118.4 Å²	118.4	89%	0.888	59%	0.587	S	S	*	*			trans	-60.1	145.5	172.3	-72.5	176.2	145.1	0	0	111.2
116	E	40.1	Very low	47.4	Very low	181 Å²	181	114.9 Å²	114.9	85%	0.846	57%	0.571	S	S	*	*			trans	87.4	83.9	-178.8	-57.8	-175.8	155.6	0	0	115.6
117	I	38	Very low	47.1	Very low	134 Å²	134	108.2 Å²	108.2	69%	0.687	54%	0.539	S	S	*	.				-173.6	103.4	126.1	-80.7	141.2	0	0	0	105.8
118	L	34.3	Very low	47.1	Very low	146 Å²	146	105.5 Å²	105.5	76%	0.764	53%	0.534	S	S	*	.			trans	-128.8	75.8	167.3	-81.2	167.3	0	0	0	106.4	L108	L108-L118 HydrophobicContact CD2-CD2 3.83Å
119	E	39.1	Very low	48	Very low	131 Å²	131	104 Å²	104	61%	0.612	53%	0.526	S	S	*	.			trans	-84.2	121	161.1	-79.8	-169.1	179.7	0	0	108.1	I121 N293	E119-I121 PolarHBondContact O-N 3Å; E119-I121 VanDerWaalsContact O-N 3.08Å; E119-N293 PolarHBondContact OE2-ND2 3.38Å
120	E	39.8	Very low	49.3	Very low	180 Å²	180	99.8 Å²	99.8	84%	0.841	51%	0.505	S	S	*	.			trans	-20.5	93.7	177.2	-68.1	169.7	156.1	0	0	115.5	D122	E120-D122 PolarHBondContact O-N 3.32Å
121	I	37.7	Very low	50.9	Low	111 Å²	111	95.3 Å²	95.3	57%	0.569	48%	0.482	S	S	*	.			trans	-77.1	98.5	152.5	-57.9	176.5	0	0	0	105.1	E104 E119 S123	E104-I121 HydrophobicContact CG-CD1 4.37Å; E119-I121 PolarHBondContact O-N 3Å; E119-I121 VanDerWaalsContact O-N 3.08Å; I121-S123 PolarHBondContact O-N 3.01Å
122	D	41.5	Very low	52.7	Low	77 Å²	77	99 Å²	99	41%	0.412	50%	0.502	S	S	.	.			trans	-59	95.9	-179	-170.9	17.8	0	0	0	110	E120 F124	E120-D122 PolarHBondContact O-N 3.32Å; D122-F124 PolarHBondContact O-N 3.43Å
123	S	40.1	Very low	54.8	Low	67 Å²	67	96.3 Å²	96.3	47%	0.469	48%	0.482	S	S	.	.			trans	-58.2	111.9	-176.8	61.5	0	0	0	0	110.1	I121 I125	I121-S123 PolarHBondContact O-N 3.01Å; S123-I125 PolarHBondContact O-N 3.3Å
124	F	48.7	Very low	57	Low	39 Å²	39	94.7 Å²	94.7	17%	0.171	49%	0.489	C	S	.	.			trans	-58.2	121.8	-172	174.2	-85.6	0	0	0	112.6	Q97 D122 F165 Y166	Q97-F124 HydrophobicContact CG-CD1 4.24Å; D122-F124 PolarHBondContact O-N 3.43Å; F124-F165 HydrophobicContact CB-CD1 4.28Å; F124-F165 HydrophobicContact CD2-CB 3.79Å; F124-F165 AromaticContact CD2-CD1 3.6Å; F124-F165 HydrophobicContact CD2-CD1 3.6Å; F124-F165 HydrophobicContact CD2-CG 4.06Å; F124-F165 HydrophobicContact CE2-CB 3.83Å; F124-F165 HydrophobicContact CE2-CD1 4.48Å; F124-F165 HydrophobicContact CG-CD1 4.38Å; F124-Y166 AromaticContact CE2-CE1 4Å; F124-Y166 HydrophobicContact CE2-CE1 4Å; F124-Y166 HydrophobicContact CE2-CE2 4.38Å; F124-Y166 AromaticContact CE2-CZ 3.89Å; F124-Y166 HydrophobicContact CZ-CE1 4.1Å
125	I	48.8	Very low	59.6	Low	60 Å²	60	93.3 Å²	93.3	31%	0.308	48%	0.482	S	S	.	.			trans	-128.3	119.8	167.9	-67.4	171.9	0	0	0	107.7	S123 K262	S123-I125 PolarHBondContact O-N 3.3Å; I125-K262 HydrophobicContact CD1-CB 3.58Å; I125-K262 HydrophobicContact CD1-CD 3.26Å; I125-K262 HydrophobicContact CD1-CG 3.47Å; I125-K262 VanDerWaalsContact CD1-CG 3.47Å; I125-K262 WeakPolarHBondContact CG2-O 3.47Å
126	P	53.9	Low	62.3	Low	34 Å²	34	86.2 Å²	86.2	22%	0.221	46%	0.459	C	S	.	.			trans	-57	143.5	171.2	27.1	-33.3	0	0	0	107.8	S128 V130	P126-S128 PolarHBondContact O-N 3.44Å; P126-V130 HydrophobicContact CB-CG2 4.06Å; P126-V130 HydrophobicContact CG-CG2 4.42Å
127	P	60.1	Low	64.9	Low	0 Å²	0	77.7 Å²	77.7	0%	0	42%	0.42	C	S	.	.			trans	-51.5	135.6	-173.8	17.5	-28.3	0	0	0	109.5	L129 V130 F140 H141 I264 F318	P127-L129 CarbonylContact O-C 3.49Å; P127-L129 PolarHBondContact O-N 3.15Å; P127-V130 WeakPolarHBondContact O-CG2 3.29Å; P127-F140 HydrophobicContact CG-CB 4.09Å; P127-F140 HydrophobicContact CG-CD2 3.41Å; P127-F140 VanDerWaalsContact CG-CD2 3.41Å; P127-F140 HydrophobicContact CG-CE2 4.17Å; P127-F140 HydrophobicContact CG-CG 4.07Å; P127-H141 VanDerWaalsContact CG-O 3.27Å; P127-H141 WeakPolarHBondContact CG-O 3.17Å; P127-I264 HydrophobicContact CB-CB 4.37Å; P127-I264 HydrophobicContact CB-CD1 3.76Å; P127-I264 HydrophobicContact CB-CG1 3.82Å; P127-I264 HydrophobicContact CB-CG2 3.69Å; P127-F318 HydrophobicContact CB-CD1 4.42Å; P127-F318 HydrophobicContact CB-CE1 4.13Å; P127-F318 HydrophobicContact CB-CE2 4.47Å; P127-F318 HydrophobicContact CB-CZ 4.15Å; P127-F318 HydrophobicContact CG-CD1 4.25Å; P127-F318 HydrophobicContact CG-CE1 3.77Å; P127-F318 HydrophobicContact CG-CZ 4.12Å
128	S	60.6	Low	67.5	Low	53 Å²	53	72.1 Å²	72.1	37%	0.371	39%	0.39	S	S	.	.	S	Bend	trans	-44.8	-24.9	-170.8	56.4	0	0	0	0	115.3	P126 N263 I264	P126-S128 PolarHBondContact O-N 3.44Å; S128-N263 VanDerWaalsContact CB-OD1 3.29Å; S128-N263 WeakPolarHBondContact CB-OD1 3.26Å; S128-I264 PolarHBondContact OG-O 3.48Å
129	L	76.6	Confident	70.3	Confident	23 Å²	23	66.2 Å²	66.2	12%	0.12	36%	0.358	C	S	.	.			trans	-102.5	90.8	175	-165.9	65.5	0	0	0	113.1	P127 Y131 F140 M185 L186	P127-L129 CarbonylContact O-C 3.49Å; P127-L129 PolarHBondContact O-N 3.15Å; L129-Y131 HydrophobicContact CD2-CE2 4.27Å; L129-Y131 HydrophobicContact CG-CE2 4.17Å; L129-F140 WeakPolarHBondContact O-CB 3.36Å; L129-M185 HydrophobicContact CD2-CB 3.1Å; L129-M185 HydrophobicContact CD2-CG 4.1Å; L129-M185 HydrophobicContact CD2-SD 3.92Å; L129-L186 HydrophobicContact CD1-CD2 3.52Å
130	V	86.5	Confident	72.9	Confident	32 Å²	32	60 Å²	60	19%	0.194	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.2	173.3	-175.3	0	0	0	0	110.5	P126 P127 N132 R138 F140	P126-V130 HydrophobicContact CB-CG2 4.06Å; P126-V130 HydrophobicContact CG-CG2 4.42Å; P127-V130 WeakPolarHBondContact O-CG2 3.29Å; V130-N132 WeakPolarHBondContact CG1-OD1 3.47Å; V130-N132 PolarHBondContact O-N 2.88Å; V130-R138 HydrophobicContact CG1-CB 3.7Å; V130-R138 HydrophobicContact CG1-CG 4.11Å; V130-F140 HydrophobicContact CG2-CB 4.19Å
131	Y	90	Very high	75.5	Confident	54 Å²	54	51.5 Å²	51.5	21%	0.212	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	104.6	167.9	-58.6	-91.8	0	0	0	108.8	M82 L129 R138 R139 R179 M185 E188	M82-Y131 HydrophobicContact CE-CD2 3.57Å; M82-Y131 HydrophobicContact CE-CE2 3.29Å; L129-Y131 HydrophobicContact CD2-CE2 4.27Å; L129-Y131 HydrophobicContact CG-CE2 4.17Å; Y131-R138 CarbonylContact O-C 3.52Å; Y131-R138 VanDerWaalsContact O-CA 3.22Å; Y131-R138 WeakPolarHBondContact O-CA 3.19Å; Y131-R139 WeakPolarHBondContact CB-O 3.14Å; Y131-R139 WeakPolarHBondContact CD2-O 3.22Å; Y131-R139 PolarHBondContact N-O 2.86Å; Y131-R139 PolarHBondContact O-N 3.12Å; Y131-R179 PolarHBondContact OH-NH1 3.12Å; Y131-R179 VanDerWaalsContact OH-NH1 3.11Å; Y131-M185 PolarHBondContact OH-O 3.44Å; Y131-E188 PolarHBondContact OH-OE1 2.97Å
132	N	91.6	Very high	78.2	Confident	119 Å²	119	46.8 Å²	46.8	64%	0.636	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	134.8	176.7	-63	-67.1	0	0	0	110.5	V130	V130-N132 WeakPolarHBondContact CG1-OD1 3.47Å; V130-N132 PolarHBondContact O-N 2.88Å
133	Y	94.5	Very high	80.9	Confident	87 Å²	87	43.3 Å²	43.3	34%	0.341	25%	0.246	S	C	.	.			trans	-101.7	155.6	178.3	-62.3	-84.7	0	0	0	111.2	Y84 D135 G136 S137 R139	Y84-Y133 HydrophobicContact CD2-CE2 4.39Å; Y84-Y133 HydrophobicContact CE2-CD2 4.37Å; Y84-Y133 HydrophobicContact CE2-CE2 4.24Å; Y133-D135 WeakPolarHBondContact CB-OD1 3.23Å; Y133-D135 PolarHBondContact O-N 2.95Å; Y133-D135 VanDerWaalsContact O-N 3.15Å; Y133-G136 PolarHBondContact O-N 2.62Å; Y133-S137 WeakPolarHBondContact CB-OG 2.78Å; Y133-S137 WeakPolarHBondContact CD2-O 3.4Å; Y133-S137 WeakPolarHBondContact CD2-OG 3.26Å; Y133-S137 PolarHBondContact N-O 2.78Å; Y133-R139 HydrophobicContact CE2-CB 3.82Å
134	P	95.8	Very high	83.6	Confident	142 Å²	142	40.1 Å²	40.1	92%	0.922	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.8	-178.3	-26.5	35.6	0	0	0	115.5	G136	P134-G136 PolarHBondContact O-N 2.87Å
135	D	95.9	Very high	86	Confident	100 Å²	100	38.3 Å²	38.3	54%	0.535	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-2.2	177.5	67.5	-11.1	0	0	0	113.3	A87 Y133 S137	A87-D135 WeakPolarHBondContact CB-O 3.47Å; Y133-D135 WeakPolarHBondContact CB-OD1 3.23Å; Y133-D135 PolarHBondContact O-N 2.95Å; Y133-D135 VanDerWaalsContact O-N 3.15Å; D135-S137 VanDerWaalsContact OD1-CB 3.25Å; D135-S137 WeakPolarHBondContact OD1-CB 3.34Å; D135-S137 PolarHBondContact OD1-N 2.88Å; D135-S137 PolarHBondContact OD1-OG 2.82Å; D135-S137 PolarHBondContact OD2-OG 3.14Å
136	G	94.2	Very high	88.3	Confident	40 Å²	40	35.5 Å²	35.5	41%	0.412	20%	0.202	S	C	.	.	S	Bend	trans	87.3	-0.7	-175.9	0	0	0	0	0	114.5	Y133 P134	Y133-G136 PolarHBondContact O-N 2.62Å; P134-G136 PolarHBondContact O-N 2.87Å
137	S	94.8	Very high	90.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	19%	0.191	C	C	.	.			trans	-73.8	163.3	169.1	70.2	0	0	0	0	110.7	Y84 Q85 Y133 D135	Y84-S137 WeakPolarHBondContact OH-CB 3.49Å; Y84-S137 PolarHBondContact OH-OG 2.68Å; Q85-S137 CarbonylContact O-C 3.51Å; Q85-S137 VanDerWaalsContact O-CA 3.28Å; Q85-S137 WeakPolarHBondContact O-CA 3.41Å; Q85-S137 WeakPolarHBondContact O-CB 3.38Å; Y133-S137 WeakPolarHBondContact CB-OG 2.78Å; Y133-S137 WeakPolarHBondContact CD2-O 3.4Å; Y133-S137 WeakPolarHBondContact CD2-OG 3.26Å; Y133-S137 PolarHBondContact N-O 2.78Å; D135-S137 VanDerWaalsContact OD1-CB 3.25Å; D135-S137 WeakPolarHBondContact OD1-CB 3.34Å; D135-S137 PolarHBondContact OD1-N 2.88Å; D135-S137 PolarHBondContact OD1-OG 2.82Å; D135-S137 PolarHBondContact OD2-OG 3.14Å
138	R	93.8	Very high	92.1	Very high	17 Å²	17	33.9 Å²	33.9	6%	0.064	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	156.6	179.1	71.4	-177	-179.9	176.3	-0.9	112.9	Q85 V90 V130 Y131 F140	Q85-R138 HydrophobicContact CB-CG 4.18Å; Q85-R138 PolarHBondContact N-O 3.34Å; Q85-R138 PolarHBondContact O-N 3.15Å; Q85-R138 VanDerWaalsContact OE1-CZ 3.24Å; V90-R138 HydrophobicContact CG2-CG 3.67Å; V130-R138 HydrophobicContact CG1-CB 3.7Å; V130-R138 HydrophobicContact CG1-CG 4.11Å; Y131-R138 CarbonylContact O-C 3.52Å; Y131-R138 VanDerWaalsContact O-CA 3.22Å; Y131-R138 WeakPolarHBondContact O-CA 3.19Å; R138-F140 HydrophobicContact CG-CD1 4.21Å; R138-F140 HydrophobicContact CG-CE1 4.25Å
139	R	93.1	Very high	93.6	Very high	23 Å²	23	32.3 Å²	32.3	9%	0.087	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	140.5	173.3	-177.6	-177.6	73.7	170.3	9.7	110.3	M82 F83 Y131 Y133 D194	M82-R139 HydrophobicContact CB-CG 3.8Å; M82-R139 HydrophobicContact CE-CG 4.02Å; M82-R139 HydrophobicContact SD-CG 4.43Å; F83-R139 VanDerWaalsContact O-CA 3.29Å; F83-R139 WeakPolarHBondContact O-CA 3.09Å; Y131-R139 WeakPolarHBondContact CB-O 3.14Å; Y131-R139 WeakPolarHBondContact CD2-O 3.22Å; Y131-R139 PolarHBondContact N-O 2.86Å; Y131-R139 PolarHBondContact O-N 3.12Å; Y133-R139 HydrophobicContact CE2-CB 3.82Å; R139-D194 IonicContact CZ-OD2 3.05Å; R139-D194 VanDerWaalsContact CZ-OD2 3.24Å; R139-D194 IonicContact NH1-OD2 3.4Å; R139-D194 PolarHBondContact NH1-OD2 3.49Å; R139-D194 IonicContact NH2-OD2 3.88Å; R139-D194 PolarHBondContact NH2-OD2 2.04Å
140	F	93.5	Very high	94.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	159.3	178.9	55	-86.5	0	0	0	111.4	M82 F83 Q85 P127 L129 V130 R138 L142 Y166	M82-F140 CarbonylContact C-O 3.12Å; M82-F140 WeakPolarHBondContact CA-O 3.27Å; F83-F140 HydrophobicContact CB-CZ 4.47Å; F83-F140 HydrophobicContact CD1-CE1 4.23Å; F83-F140 HydrophobicContact CD1-CE2 4.46Å; F83-F140 AromaticContact CD1-CZ 3.77Å; F83-F140 HydrophobicContact CD1-CZ 3.77Å; F83-F140 PolarHBondContact N-O 3.45Å; F83-F140 PolarHBondContact O-N 3.26Å; F83-F140 VanDerWaalsContact O-N 3.12Å; Q85-F140 HydrophobicContact CG-CE1 4.21Å; P127-F140 HydrophobicContact CG-CB 4.09Å; P127-F140 HydrophobicContact CG-CD2 3.41Å; P127-F140 VanDerWaalsContact CG-CD2 3.41Å; P127-F140 HydrophobicContact CG-CE2 4.17Å; P127-F140 HydrophobicContact CG-CG 4.07Å; L129-F140 WeakPolarHBondContact O-CB 3.36Å; V130-F140 HydrophobicContact CG2-CB 4.19Å; R138-F140 HydrophobicContact CG-CD1 4.21Å; R138-F140 HydrophobicContact CG-CE1 4.25Å; F140-L142 HydrophobicContact CE2-CD1 3.8Å; F140-Y166 HydrophobicContact CE2-CD1 4.44Å; F140-Y166 AromaticContact CE2-CE1 3.68Å; F140-Y166 HydrophobicContact CE2-CE1 3.68Å; F140-Y166 HydrophobicContact CZ-CD1 4.08Å; F140-Y166 AromaticContact CZ-CE1 3.57Å; F140-Y166 HydrophobicContact CZ-CE1 3.57Å
141	H	94.2	Very high	94.8	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.009	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	129.5	173.2	173.2	67.8	0	0	0	110.3	S80 P127 C143 M185 W254 I264 F318	S80-H141 PolarHBondContact OG-ND1 2.94Å; P127-H141 VanDerWaalsContact CG-O 3.27Å; P127-H141 WeakPolarHBondContact CG-O 3.17Å; H141-C143 PolarHBondContact CE1-O 3.26Å; H141-C143 PolarHBondContact ND1-O 3.39Å; H141-M185 HydrophobicContact CB-CE 3.88Å; H141-M185 HydrophobicContact CB-SD 4.23Å; H141-W254 AromaticContact CE1-CE3 3.92Å; H141-I264 HydrophobicContact CB-CD1 4.27Å; H141-F318 PolarHBondContact NE2-O 3.45Å; H141-F318 VanDerWaalsContact NE2-O 3.1Å
142	L	94.8	Very high	95.1	Very high	11 Å²	11	30.2 Å²	30.2	6%	0.058	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-42.8	176.3	-170.2	84.2	0	0	0	112.4	L81 F83 F140 Y166 L169 W176 F318	L81-L142 PolarHBondContact O-N 3.47Å; F83-L142 HydrophobicContact CB-CB 4.06Å; F83-L142 HydrophobicContact CB-CD2 4.34Å; F140-L142 HydrophobicContact CE2-CD1 3.8Å; L142-Y166 HydrophobicContact CD1-CD1 4.43Å; L142-Y166 HydrophobicContact CD1-CD2 4.08Å; L142-Y166 HydrophobicContact CD1-CE1 4.19Å; L142-Y166 HydrophobicContact CD1-CE2 3.82Å; L142-Y166 HydrophobicContact CD1-CG 4.37Å; L142-L169 HydrophobicContact CD2-CD1 3.98Å; L142-L169 HydrophobicContact CD2-CD2 3.37Å; L142-L169 HydrophobicContact CD2-CG 4.34Å; L142-W176 HydrophobicContact CB-CZ3 4.38Å; L142-W176 HydrophobicContact CD2-CH2 3.56Å; L142-W176 HydrophobicContact CD2-CZ3 4.01Å; L142-F318 HydrophobicContact CD1-CE1 4.31Å
143	C	96.4	Very high	95.5	Very high	4 Å²	4	24.6 Å²	24.6	3%	0.027	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	155.6	-176.4	-81.2	0	0	0	0	111.2	L81 H141 C159 S320	L81-C143 HydrophobicContact CB-CB 4.19Å; L81-C143 WeakPolarHBondContact CB-O 3.44Å; L81-C143 PolarHBondContact N-O 2.81Å; L81-C143 PolarHBondContact O-N 2.86Å; H141-C143 PolarHBondContact CE1-O 3.26Å; H141-C143 PolarHBondContact ND1-O 3.39Å; C143-C159 HydrophobicContact CB-CB 3.85Å; C143-C159 WeakPolarHBondContact CB-SG 3.46Å; C143-C159 WeakPolarHBondContact SG-CB 3.43Å; C143-C159 CovalentContact SG-SG 2.04Å; C143-C159 PolarHBondContact SG-SG 2.99Å; C143-S320 CarbonylContact C-O 3.59Å; C143-S320 VanDerWaalsContact CA-O 3.32Å; C143-S320 WeakPolarHBondContact CA-O 2.99Å; C143-S320 WeakPolarHBondContact CB-O 3.21Å
144	G	97.9	Very high	95.7	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	172.3	162.9	0	0	0	0	0	112.8	T79 T155 S320 G321	T79-G144 CarbonylContact O-C 3.46Å; T79-G144 WeakPolarHBondContact O-CA 3.11Å; G144-T155 PolarHBondContact O-OG1 2.9Å; G144-S320 PolarHBondContact N-O 2.99Å; G144-G321 VanDerWaalsContact C-C 3.46Å; G144-G321 CarbonylContact C-O 3.48Å; G144-G321 CarbonylContact O-C 3.48Å; G144-G321 VanDerWaalsContact O-C 3.28Å
145	G	98.6	Very high	95.8	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	170.4	173	0	0	0	0	0	110.5	T79 M154 G321	T79-G145 PolarHBondContact N-O 3.04Å; T79-G145 PolarHBondContact O-N 3.09Å; T79-G145 VanDerWaalsContact OG1-CA 3.23Å; T79-G145 WeakPolarHBondContact OG1-CA 3.25Å; T79-G145 PolarHBondContact OG1-O 3.3Å; G145-M154 CarbonylContact C-O 3.53Å; G145-M154 WeakPolarHBondContact CA-O 3.37Å; G145-G321 WeakPolarHBondContact CA-O 3.28Å
146	T	98.5	Very high	95.9	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.006	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119.8	-174.8	-56.9	0	0	0	0	110.2	W77 I148 I153 M154 A234 P323 V334	W77-T146 CarbonylContact O-C 3.39Å; W77-T146 WeakPolarHBondContact O-CA 3.04Å; T146-I148 HydrophobicContact CG2-CG2 3.98Å; T146-I148 PolarHBondContact O-N 2.85Å; T146-I148 VanDerWaalsContact O-N 3.17Å; T146-I153 CarbonylContact O-C 3.54Å; T146-I153 WeakPolarHBondContact O-CA 3.45Å; T146-M154 PolarHBondContact N-O 2.76Å; T146-M154 PolarHBondContact O-N 2.77Å; T146-A234 HydrophobicContact CG2-CB 3.41Å; T146-A234 VanDerWaalsContact CG2-CB 3.41Å; T146-P323 VanDerWaalsContact OG1-CB 3.31Å; T146-P323 WeakPolarHBondContact OG1-CB 3.46Å; T146-V334 HydrophobicContact CG2-CG1 4.36Å; T146-V334 HydrophobicContact CG2-CG2 3.82Å
147	L	97.1	Very high	96.1	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	107.6	171.7	-169.2	68.5	0	0	0	109.9	W77 T79 H149 I153 I180 V225 L227 V231 I233 A234	W77-L147 HydrophobicContact CB-CB 4.32Å; W77-L147 WeakPolarHBondContact O-CB 3.45Å; W77-L147 PolarHBondContact O-N 3.07Å; T79-L147 HydrophobicContact CG2-CB 4.09Å; L147-H149 WeakPolarHBondContact CD1-O 3.35Å; L147-I153 HydrophobicContact CD1-CG1 3.93Å; L147-I180 HydrophobicContact CD1-CD1 4.21Å; L147-I180 HydrophobicContact CD2-CG2 4.35Å; L147-V225 HydrophobicContact CD1-CG1 4.09Å; L147-V225 HydrophobicContact CD2-CG1 3.66Å; L147-L227 HydrophobicContact CD2-CD2 4.2Å; L147-V231 HydrophobicContact CD2-CG1 3.88Å; L147-I233 HydrophobicContact CD2-CG1 4.42Å; L147-I233 HydrophobicContact CG-CG1 4.41Å; L147-I233 WeakPolarHBondContact O-CA 3.49Å; L147-A234 PolarHBondContact O-N 2.8Å
148	I	95.3	Very high	96.1	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.005	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-8.8	-179.2	60.3	164.6	0	0	0	112.5	T146 W152 M154 L218 I233 L236 I363 F370	T146-I148 HydrophobicContact CG2-CG2 3.98Å; T146-I148 PolarHBondContact O-N 2.85Å; T146-I148 VanDerWaalsContact O-N 3.17Å; I148-W152 HydrophobicContact CD1-CB 4.31Å; I148-W152 HydrophobicContact CG1-CB 3.98Å; I148-W152 WeakPolarHBondContact CG1-O 3.48Å; I148-W152 PolarHBondContact N-O 2.84Å; I148-M154 HydrophobicContact CD1-CB 4.18Å; I148-M154 HydrophobicContact CG1-CB 4.48Å; I148-M154 HydrophobicContact CG2-CB 3.87Å; I148-M154 HydrophobicContact CG2-CE 4.35Å; I148-L218 HydrophobicContact CD1-CD2 3.79Å; I148-I233 VanDerWaalsContact C-CG2 3.41Å; I148-I233 VanDerWaalsContact O-CG2 3.28Å; I148-I233 WeakPolarHBondContact O-CG2 3.32Å; I148-L236 HydrophobicContact CB-CD1 4.44Å; I148-L236 HydrophobicContact CB-CD2 4.48Å; I148-L236 HydrophobicContact CB-CG 4.5Å; I148-L236 HydrophobicContact CD1-CD1 4.41Å; I148-L236 HydrophobicContact CG2-CD2 3.79Å; I148-L236 HydrophobicContact CG2-CG 4.29Å; I148-I363 HydrophobicContact CD1-CG2 3.97Å; I148-F370 HydrophobicContact CB-CZ 4.24Å; I148-F370 HydrophobicContact CD1-CE2 4.01Å; I148-F370 HydrophobicContact CD1-CZ 3.84Å; I148-F370 HydrophobicContact CG1-CZ 4.15Å
149	H	93	Very high	96.2	Very high	20 Å²	20	7.9 Å²	7.9	9%	0.093	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	156	176.2	174.8	-100	0	0	0	107.4	L36 L147 Q151 W152 V369	L36-H149 WeakPolarHBondContact CD2-NE2 3.15Å; L147-H149 WeakPolarHBondContact CD1-O 3.35Å; H149-Q151 PolarHBondContact ND1-N 3.39Å; H149-Q151 PolarHBondContact O-N 2.99Å; H149-W152 HydrophobicContact CB-CB 3.95Å; H149-W152 HydrophobicContact CB-CG 4.37Å; H149-W152 AromaticContact CG-CD1 3.84Å; H149-W152 PolarHBondContact N-O 2.96Å; H149-W152 AromaticContact ND1-CD1 3.39Å; H149-W152 PolarHBondContact O-N 3.37Å; H149-W152 VanDerWaalsContact O-O 3.08Å; H149-V369 WeakPolarHBondContact CD2-CG1 3.44Å; H149-V369 VanDerWaalsContact NE2-CG1 3.32Å; H149-V369 WeakPolarHBondContact NE2-CG1 3.49Å
150	P	92.3	Very high	96.4	Very high	8 Å²	8	7.1 Å²	7.1	5%	0.052	4%	0.035	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-17.8	179.4	-28.5	38.8	0	0	0	114.7	F34 P224 V225 L227 I233	F34-P150 HydrophobicContact CD1-CG 4.21Å; F34-P150 HydrophobicContact CE1-CG 3.62Å; F34-P150 HydrophobicContact CE2-CG 4.33Å; F34-P150 HydrophobicContact CZ-CG 3.68Å; P150-P224 HydrophobicContact CB-CB 3.88Å; P150-P224 CarbonylContact O-C 3.51Å; P150-P224 VanDerWaalsContact O-CA 3.27Å; P150-P224 WeakPolarHBondContact O-CA 3.37Å; P150-V225 WeakPolarHBondContact O-CG1 3.4Å; P150-V225 PolarHBondContact O-N 3.38Å; P150-L227 HydrophobicContact CG-CD1 4.33Å; P150-L227 HydrophobicContact CG-CD2 4.36Å; P150-L227 HydrophobicContact CG-CG 4.36Å; P150-I233 VanDerWaalsContact CD-CD1 3.49Å; P150-I233 HydrophobicContact CG-CD1 3.87Å
151	Q	95.4	Very high	96.3	Very high	47 Å²	47	10.6 Å²	10.6	22%	0.22	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-0.1	178.5	-158.5	174.8	-16	0	0	114.3	H149 K220 L221 P224	H149-Q151 PolarHBondContact ND1-N 3.39Å; H149-Q151 PolarHBondContact O-N 2.99Å; Q151-K220 HydrophobicContact CG-CG 4.41Å; Q151-K220 WeakPolarHBondContact O-CA 3.32Å; Q151-L221 HydrophobicContact CG-CB 4Å; Q151-L221 WeakPolarHBondContact CG-O 3.43Å; Q151-L221 PolarHBondContact NE2-O 2.84Å; Q151-L221 PolarHBondContact O-N 3.12Å; Q151-P224 HydrophobicContact CB-CB 4.5Å
152	W	97.1	Very high	96.1	Very high	10 Å²	10	14.4 Å²	14.4	4%	0.038	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.9	-177.6	-62.4	100.1	0	0	0	112.2	I148 H149 Y201 L218 V219 K220 I366 A367 V369	I148-W152 HydrophobicContact CD1-CB 4.31Å; I148-W152 HydrophobicContact CG1-CB 3.98Å; I148-W152 WeakPolarHBondContact CG1-O 3.48Å; I148-W152 PolarHBondContact N-O 2.84Å; H149-W152 HydrophobicContact CB-CB 3.95Å; H149-W152 HydrophobicContact CB-CG 4.37Å; H149-W152 AromaticContact CG-CD1 3.84Å; H149-W152 PolarHBondContact N-O 2.96Å; H149-W152 AromaticContact ND1-CD1 3.39Å; H149-W152 PolarHBondContact O-N 3.37Å; H149-W152 VanDerWaalsContact O-O 3.08Å; W152-Y201 HydrophobicContact CH2-CD2 4.16Å; W152-Y201 AromaticContact CH2-CE2 3.67Å; W152-Y201 HydrophobicContact CH2-CE2 3.67Å; W152-Y201 AromaticContact CZ3-CD2 3.7Å; W152-Y201 HydrophobicContact CZ3-CD2 3.7Å; W152-Y201 AromaticContact CZ3-CE2 3.64Å; W152-Y201 HydrophobicContact CZ3-CE2 3.64Å; W152-L218 HydrophobicContact CE3-CB 4.12Å; W152-L218 HydrophobicContact CZ3-CB 4.19Å; W152-V219 WeakPolarHBondContact CA-O 3.29Å; W152-K220 HydrophobicContact CD2-CB 4.32Å; W152-K220 HydrophobicContact CD2-CG 4.25Å; W152-K220 HydrophobicContact CE3-CB 3.84Å; W152-K220 HydrophobicContact CE3-CG 4.25Å; W152-K220 HydrophobicContact CH2-CB 3.97Å; W152-K220 HydrophobicContact CH2-CD 3.77Å; W152-K220 HydrophobicContact CH2-CG 4.04Å; W152-K220 HydrophobicContact CZ2-CB 4.39Å; W152-K220 HydrophobicContact CZ2-CD 3.68Å; W152-K220 HydrophobicContact CZ2-CG 3.98Å; W152-K220 HydrophobicContact CZ3-CB 3.67Å; W152-K220 HydrophobicContact CZ3-CD 4.36Å; W152-K220 HydrophobicContact CZ3-CG 4.18Å; W152-I366 HydrophobicContact CH2-CG2 3.98Å; W152-I366 WeakPolarHBondContact CH2-O 3.23Å; W152-I366 HydrophobicContact CZ3-CG2 3.92Å; W152-A367 HydrophobicContact CD2-CB 4.07Å; W152-A367 HydrophobicContact CG-CB 4.25Å; W152-A367 HydrophobicContact CZ2-CB 4.32Å; W152-A367 PolarHBondContact NE1-O 2.81Å; W152-V369 VanDerWaalsContact CD1-CG2 3.45Å; W152-V369 VanDerWaalsContact NE1-CG2 3.34Å
153	I	98.5	Very high	95.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.7	176.9	-65.1	146.8	0	0	0	108.6	T79 L81 T146 L147 V178 I180 L218 V219 L221	T79-I153 HydrophobicContact CG2-CD1 4.47Å; T79-I153 HydrophobicContact CG2-CG1 4.21Å; L81-I153 HydrophobicContact CD1-CG2 4.3Å; T146-I153 CarbonylContact O-C 3.54Å; T146-I153 WeakPolarHBondContact O-CA 3.45Å; L147-I153 HydrophobicContact CD1-CG1 3.93Å; I153-V178 HydrophobicContact CD1-CB 3.84Å; I153-V178 HydrophobicContact CD1-CG1 3.32Å; I153-V178 HydrophobicContact CD1-CG2 3.72Å; I153-V178 HydrophobicContact CG1-CG1 4.46Å; I153-I180 HydrophobicContact CD1-CD1 4.37Å; I153-L218 CarbonylContact O-C 3.46Å; I153-L218 VanDerWaalsContact O-CA 3.3Å; I153-L218 WeakPolarHBondContact O-CA 3.36Å; I153-V219 HydrophobicContact CB-CB 4.21Å; I153-V219 PolarHBondContact N-O 3.43Å; I153-V219 PolarHBondContact O-N 3.25Å; I153-L221 HydrophobicContact CD1-CD1 4.05Å; I153-L221 HydrophobicContact CD1-CD2 3.6Å; I153-L221 HydrophobicContact CD1-CG 3.91Å
154	M	98.6	Very high	94.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	137.6	171.2	-177.9	174.7	71	0	0	109.7	G145 T146 I148 I216 L218 L236 V334 I337 V356 I363	G145-M154 CarbonylContact C-O 3.53Å; G145-M154 WeakPolarHBondContact CA-O 3.37Å; T146-M154 PolarHBondContact N-O 2.76Å; T146-M154 PolarHBondContact O-N 2.77Å; I148-M154 HydrophobicContact CD1-CB 4.18Å; I148-M154 HydrophobicContact CG1-CB 4.48Å; I148-M154 HydrophobicContact CG2-CB 3.87Å; I148-M154 HydrophobicContact CG2-CE 4.35Å; M154-I216 HydrophobicContact CG-CD1 4.13Å; M154-I216 HydrophobicContact CG-CG1 4.25Å; M154-I216 HydrophobicContact SD-CD1 4.07Å; M154-L218 HydrophobicContact CB-CD2 3.95Å; M154-L218 HydrophobicContact CG-CD2 4.24Å; M154-L236 HydrophobicContact CE-CD2 3.95Å; M154-L236 HydrophobicContact SD-CD2 4.12Å; M154-V334 HydrophobicContact CE-CB 4.26Å; M154-V334 HydrophobicContact CE-CG1 3.47Å; M154-V334 VanDerWaalsContact CE-CG1 3.47Å; M154-I337 HydrophobicContact CE-CD1 4.18Å; M154-I337 HydrophobicContact CE-CG1 4.02Å; M154-I337 HydrophobicContact CG-CD1 3.54Å; M154-I337 HydrophobicContact CG-CG1 4.26Å; M154-I337 HydrophobicContact SD-CD1 3.77Å; M154-I337 HydrophobicContact SD-CG1 4.28Å; M154-V356 HydrophobicContact CE-CG1 4Å; M154-V356 HydrophobicContact CE-CG2 3.79Å; M154-V356 HydrophobicContact SD-CG1 3.92Å; M154-V356 HydrophobicContact SD-CG2 4.17Å; M154-I363 HydrophobicContact SD-CD1 3.79Å
155	T	98.7	Very high	93.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	-173.9	-178.5	-174.3	0	0	0	0	109.6	L81 G144 F160 I216 A217 V219 G321	L81-T155 HydrophobicContact CD2-CG2 3.81Å; G144-T155 PolarHBondContact O-OG1 2.9Å; T155-F160 HydrophobicContact CG2-CE2 3.59Å; T155-F160 HydrophobicContact CG2-CZ 3.86Å; T155-I216 CarbonylContact O-C 3.55Å; T155-I216 WeakPolarHBondContact O-CA 3.24Å; T155-A217 HydrophobicContact CG2-CB 3.99Å; T155-A217 PolarHBondContact N-O 2.03Å; T155-A217 PolarHBondContact O-N 2.83Å; T155-V219 HydrophobicContact CG2-CG2 4.08Å; T155-G321 WeakPolarHBondContact OG1-CA 3.46Å
156	A	98	Very high	93	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.			trans	-83.5	147.1	176.3	0	0	0	0	0	111.1	F160 G321 I337	A156-F160 WeakPolarHBondContact O-CE2 3.37Å; A156-G321 VanDerWaalsContact N-CA 3.33Å; A156-I337 HydrophobicContact CB-CG2 4.22Å
157	A	97.7	Very high	92.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-67.1	-41.6	175.8	0	0	0	0	0	111.2	C159 F160 F161 V202 Y206 D215	A157-C159 PolarHBondContact O-N 3.17Å; A157-C159 VanDerWaalsContact O-N 3.08Å; A157-F160 WeakPolarHBondContact O-CD2 3.14Å; A157-F160 PolarHBondContact O-N 3.42Å; A157-F161 HydrophobicContact CB-CE2 4.49Å; A157-F161 VanDerWaalsContact O-CD2 3.3Å; A157-F161 WeakPolarHBondContact O-CD2 3.23Å; A157-V202 HydrophobicContact CB-CG1 3.99Å; A157-Y206 HydrophobicContact CB-CD1 3.72Å; A157-Y206 HydrophobicContact CB-CD2 3.65Å; A157-Y206 HydrophobicContact CB-CE1 4.13Å; A157-Y206 HydrophobicContact CB-CE2 4.06Å; A157-Y206 HydrophobicContact CB-CG 3.44Å; A157-Y206 VanDerWaalsContact CB-CG 3.44Å; A157-D215 WeakPolarHBondContact CA-OD1 3.17Å; A157-D215 WeakPolarHBondContact CB-OD1 3.27Å; A157-D215 PolarHBondContact N-OD1 3.13Å
158	H	95.4	Very high	92.1	Very high	36 Å²	36	32 Å²	32	17%	0.167	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-60.2	-24.2	-173.9	81.9	-109.4	0	0	0	113.5	F160 F161 Y206 A209 D215 S320 S339	H158-F160 PolarHBondContact O-N 3.11Å; H158-F161 PolarHBondContact O-N 3.21Å; H158-Y206 WeakPolarHBondContact CA-OH 3.36Å; H158-Y206 HydrophobicContact CB-CE1 4.39Å; H158-Y206 HydrophobicContact CB-CE2 4.36Å; H158-Y206 WeakPolarHBondContact CB-OH 3.48Å; H158-A209 HydrophobicContact CB-CB 4.37Å; H158-D215 IonicContact CE1-OD2 2.68Å; H158-D215 IonicContact CG-OD1 3.71Å; H158-D215 IonicContact CG-OD2 3.24Å; H158-D215 PolarHBondContact N-OD1 2.83Å; H158-D215 IonicContact ND1-OD1 3.12Å; H158-D215 PolarHBondContact ND1-OD1 2.86Å; H158-D215 IonicContact ND1-OD2 2.78Å; H158-D215 PolarHBondContact ND1-OD2 3.15Å; H158-S320 WeakPolarHBondContact CE1-CB 3.48Å; H158-S320 PolarHBondContact CE1-OG 2.78Å; H158-S320 VanDerWaalsContact CE1-OG 3.26Å; H158-S320 WeakPolarHBondContact NE2-CB 3.48Å; H158-S320 PolarHBondContact NE2-OG 2.84Å; H158-S320 VanDerWaalsContact NE2-OG 3.15Å; H158-S339 PolarHBondContact CE1-O 2.8Å
159	C	95.9	Very high	92	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.014	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-55.8	-23.4	173.3	-66.4	0	0	0	0	112.8	C143 A157 W176	C143-C159 HydrophobicContact CB-CB 3.85Å; C143-C159 WeakPolarHBondContact CB-SG 3.46Å; C143-C159 WeakPolarHBondContact SG-CB 3.43Å; C143-C159 CovalentContact SG-SG 2.04Å; C143-C159 PolarHBondContact SG-SG 2.99Å; A157-C159 PolarHBondContact O-N 3.17Å; A157-C159 VanDerWaalsContact O-N 3.08Å; C159-W176 WeakPolarHBondContact O-CH2 3.24Å; C159-W176 WeakPolarHBondContact O-CZ2 3.26Å
160	F	96.7	Very high	92.1	Very high	7 Å²	7	33.1 Å²	33.1	3%	0.031	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-104.4	4.7	-178.2	-53.7	-72.9	0	0	0	114	L81 T155 A156 A157 H158 S170 A171 W176 V200 V202 A217 V219	L81-F160 HydrophobicContact CD2-CE1 4.24Å; L81-F160 HydrophobicContact CD2-CZ 3.65Å; T155-F160 HydrophobicContact CG2-CE2 3.59Å; T155-F160 HydrophobicContact CG2-CZ 3.86Å; A156-F160 WeakPolarHBondContact O-CE2 3.37Å; A157-F160 WeakPolarHBondContact O-CD2 3.14Å; A157-F160 PolarHBondContact O-N 3.42Å; H158-F160 PolarHBondContact O-N 3.11Å; F160-S170 CarbonylContact O-C 3.58Å; F160-S170 WeakPolarHBondContact O-CA 3.31Å; F160-S170 PolarHBondContact O-N 3.25Å; F160-A171 HydrophobicContact CB-CB 4.29Å; F160-W176 HydrophobicContact CD1-CD2 4.28Å; F160-W176 AromaticContact CD1-CE2 3.47Å; F160-W176 VanDerWaalsContact CD1-CE2 3.47Å; F160-W176 HydrophobicContact CD1-CH2 4.21Å; F160-W176 AromaticContact CD1-CZ2 3.44Å; F160-W176 HydrophobicContact CD1-CZ2 3.44Å; F160-W176 VanDerWaalsContact CD1-CZ2 3.44Å; F160-W176 AromaticContact CD1-NE1 3.55Å; F160-W176 AromaticContact CE1-CD2 3.89Å; F160-W176 HydrophobicContact CE1-CD2 3.89Å; F160-W176 AromaticContact CE1-CE2 3.56Å; F160-W176 HydrophobicContact CE1-CE3 4.4Å; F160-W176 HydrophobicContact CE1-CG 4.3Å; F160-W176 HydrophobicContact CE1-CH2 4.27Å; F160-W176 AromaticContact CE1-CZ2 3.79Å; F160-W176 HydrophobicContact CE1-CZ2 3.79Å; F160-W176 AromaticContact CE1-NE1 3.78Å; F160-W176 HydrophobicContact CG-CZ2 4.44Å; F160-V200 HydrophobicContact CD1-CG1 3.69Å; F160-V200 HydrophobicContact CD1-CG2 4.34Å; F160-V200 HydrophobicContact CD2-CG1 3.7Å; F160-V200 HydrophobicContact CE1-CB 4.41Å; F160-V200 HydrophobicContact CE1-CG1 3.61Å; F160-V200 HydrophobicContact CE1-CG2 3.92Å; F160-V200 HydrophobicContact CE2-CG1 3.63Å; F160-V200 HydrophobicContact CG-CG1 3.72Å; F160-V200 HydrophobicContact CZ-CG1 3.58Å; F160-V200 HydrophobicContact CZ-CG2 4.37Å; F160-V202 HydrophobicContact CB-CG2 4.12Å; F160-V202 HydrophobicContact CD2-CG2 4.14Å; F160-V202 HydrophobicContact CG-CG2 4.39Å; F160-A217 HydrophobicContact CD2-CB 3.79Å; F160-A217 HydrophobicContact CE2-CB 3.47Å; F160-A217 VanDerWaalsContact CE2-CB 3.47Å; F160-V219 HydrophobicContact CE1-CG2 4.42Å; F160-V219 HydrophobicContact CE2-CG2 4.37Å; F160-V219 HydrophobicContact CZ-CG2 3.62Å
161	F	92.2	Very high	92.3	Very high	73 Å²	73	34.6 Å²	34.6	32%	0.32	19%	0.193	S	C	.	.	S	Bend	trans	-103.7	136.9	-179.4	-78.9	-101.1	0	0	0	111.7	A157 H158 N163 L169 V202 Y206	A157-F161 HydrophobicContact CB-CE2 4.49Å; A157-F161 VanDerWaalsContact O-CD2 3.3Å; A157-F161 WeakPolarHBondContact O-CD2 3.23Å; H158-F161 PolarHBondContact O-N 3.21Å; F161-N163 PolarHBondContact O-N 3Å; F161-L169 WeakPolarHBondContact O-CB 3.38Å; F161-L169 VanDerWaalsContact O-CD1 3.29Å; F161-L169 WeakPolarHBondContact O-CD1 3.35Å; F161-V202 HydrophobicContact CE2-CG1 3.54Å; F161-V202 HydrophobicContact CE2-CG2 4.35Å; F161-V202 HydrophobicContact CZ-CG1 3.88Å; F161-Y206 HydrophobicContact CD1-CE1 4.28Å; F161-Y206 AromaticContact CD2-CD1 3.78Å; F161-Y206 HydrophobicContact CD2-CD1 3.78Å; F161-Y206 AromaticContact CD2-CE1 3.45Å; F161-Y206 HydrophobicContact CD2-CE1 3.45Å; F161-Y206 VanDerWaalsContact CD2-CE1 3.45Å; F161-Y206 HydrophobicContact CE1-CD1 4.18Å; F161-Y206 HydrophobicContact CE1-CE1 4.3Å; F161-Y206 AromaticContact CE2-CD1 3.25Å; F161-Y206 HydrophobicContact CE2-CD1 3.25Å; F161-Y206 AromaticContact CE2-CE1 3.47Å; F161-Y206 HydrophobicContact CE2-CE1 3.47Å; F161-Y206 VanDerWaalsContact CE2-CE1 3.47Å; F161-Y206 HydrophobicContact CE2-CG 4.41Å; F161-Y206 HydrophobicContact CG-CD1 4.43Å; F161-Y206 AromaticContact CG-CE1 3.88Å; F161-Y206 HydrophobicContact CG-CE1 3.88Å; F161-Y206 AromaticContact CZ-CD1 3.49Å; F161-Y206 HydrophobicContact CZ-CD1 3.49Å; F161-Y206 VanDerWaalsContact CZ-CD1 3.49Å; F161-Y206 AromaticContact CZ-CE1 3.92Å; F161-Y206 HydrophobicContact CZ-CE1 3.92Å
162	P	90.1	Very high	92.4	Very high	81 Å²	81	36 Å²	36	53%	0.526	20%	0.202	S	C	.	.			trans	-52.6	138.8	170	-24.1	32.1	0	0	0	111.6	L169	P162-L169 VanDerWaalsContact CD-O 3.32Å; P162-L169 WeakPolarHBondContact CD-O 3.49Å; P162-L169 VanDerWaalsContact CG-O 3.31Å; P162-L169 WeakPolarHBondContact CG-O 3.1Å
163	N	84.2	Confident	92.4	Very high	54 Å²	54	37.1 Å²	37.1	29%	0.289	21%	0.211	S	C	.	.			trans	-134.8	169.5	168.3	64.3	55.1	0	0	0	109.1	F161 F165 Y166 P167 L169	F161-N163 PolarHBondContact O-N 3Å; N163-F165 PolarHBondContact O-N 3.09Å; N163-F165 VanDerWaalsContact O-N 3.13Å; N163-F165 WeakPolarHBondContact OD1-CA 3.42Å; N163-F165 WeakPolarHBondContact OD1-CB 3.39Å; N163-F165 PolarHBondContact OD1-N 2.84Å; N163-F165 VanDerWaalsContact OD1-N 3.08Å; N163-Y166 PolarHBondContact N-O 3.17Å; N163-Y166 CarbonylContact O-C 3.53Å; N163-Y166 PolarHBondContact O-N 3.45Å; N163-Y166 VanDerWaalsContact O-N 3.07Å; N163-Y166 PolarHBondContact OD1-N 2.97Å; N163-P167 WeakPolarHBondContact O-CA 3.48Å; N163-P167 VanDerWaalsContact O-N 3.14Å; N163-L169 WeakPolarHBondContact ND2-CD1 3.37Å
164	P	78.1	Confident	92.3	Very high	125 Å²	125	41.3 Å²	41.3	81%	0.812	24%	0.24	S	C	*	.	S	Bend	trans	-53.3	-35.9	-177	-29.3	37.1	0	0	0	113.6
165	F	76.2	Confident	92.3	Very high	96 Å²	96	41.8 Å²	41.8	42%	0.421	24%	0.243	S	C	.	.	S	Bend	trans	-78.5	-33.5	-179.8	-57.8	-64.7	0	0	0	113.1	Q93 F124 N163	Q93-F165 PolarHBondContact NE2-O 2.84Å; F124-F165 HydrophobicContact CB-CD1 4.28Å; F124-F165 HydrophobicContact CD2-CB 3.79Å; F124-F165 AromaticContact CD2-CD1 3.6Å; F124-F165 HydrophobicContact CD2-CD1 3.6Å; F124-F165 HydrophobicContact CD2-CG 4.06Å; F124-F165 HydrophobicContact CE2-CB 3.83Å; F124-F165 HydrophobicContact CE2-CD1 4.48Å; F124-F165 HydrophobicContact CG-CD1 4.38Å; N163-F165 PolarHBondContact O-N 3.09Å; N163-F165 VanDerWaalsContact O-N 3.13Å; N163-F165 WeakPolarHBondContact OD1-CA 3.42Å; N163-F165 WeakPolarHBondContact OD1-CB 3.39Å; N163-F165 PolarHBondContact OD1-N 2.84Å; N163-F165 VanDerWaalsContact OD1-N 3.08Å
166	Y	84.9	Confident	92.2	Very high	16 Å²	16	42 Å²	42	6%	0.063	24%	0.244	C	C	.	.			trans	-131.1	73.8	-178.6	-54.7	-80.6	0	0	0	110.9	F124 F140 L142 N163 H168 L169	F124-Y166 AromaticContact CE2-CE1 4Å; F124-Y166 HydrophobicContact CE2-CE1 4Å; F124-Y166 HydrophobicContact CE2-CE2 4.38Å; F124-Y166 AromaticContact CE2-CZ 3.89Å; F124-Y166 HydrophobicContact CZ-CE1 4.1Å; F140-Y166 HydrophobicContact CE2-CD1 4.44Å; F140-Y166 AromaticContact CE2-CE1 3.68Å; F140-Y166 HydrophobicContact CE2-CE1 3.68Å; F140-Y166 HydrophobicContact CZ-CD1 4.08Å; F140-Y166 AromaticContact CZ-CE1 3.57Å; F140-Y166 HydrophobicContact CZ-CE1 3.57Å; L142-Y166 HydrophobicContact CD1-CD1 4.43Å; L142-Y166 HydrophobicContact CD1-CD2 4.08Å; L142-Y166 HydrophobicContact CD1-CE1 4.19Å; L142-Y166 HydrophobicContact CD1-CE2 3.82Å; L142-Y166 HydrophobicContact CD1-CG 4.37Å; N163-Y166 PolarHBondContact N-O 3.17Å; N163-Y166 CarbonylContact O-C 3.53Å; N163-Y166 PolarHBondContact O-N 3.45Å; N163-Y166 VanDerWaalsContact O-N 3.07Å; N163-Y166 PolarHBondContact OD1-N 2.97Å; Y166-H168 PolarHBondContact O-N 2.57Å; Y166-L169 HydrophobicContact CD2-CD1 4.47Å; Y166-L169 HydrophobicContact CG-CD1 4.3Å; Y166-L169 HydrophobicContact CG-CG 4.49Å; Y166-L169 WeakPolarHBondContact O-CG 3.11Å; Y166-L169 PolarHBondContact O-N 3.11Å
167	P	86.7	Confident	92.2	Very high	47 Å²	47	43.8 Å²	43.8	31%	0.305	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-8.1	-174.4	27.9	-36.9	0	0	0	113.7	L96 N163	L96-P167 HydrophobicContact CD1-CG 4.18Å; N163-P167 WeakPolarHBondContact O-CA 3.48Å; N163-P167 VanDerWaalsContact O-N 3.14Å
168	H	89.1	Confident	92.2	Very high	50 Å²	50	43.8 Å²	43.8	23%	0.231	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	5	-178.1	-58.5	-48.5	0	0	0	113.6	Q89 Y166 S170	Q89-H168 HydrophobicContact CG-CB 4.21Å; Y166-H168 PolarHBondContact O-N 2.57Å; H168-S170 PolarHBondContact O-N 2.82Å
169	L	92.3	Very high	92.3	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	25%	0.246	C	C	.	.			trans	-59.1	136.9	171.5	-69.3	174.1	0	0	0	109.8	F83 L142 F161 P162 N163 Y166 W176	F83-L169 HydrophobicContact CD1-CD2 3.84Å; F83-L169 HydrophobicContact CD2-CD2 3.77Å; F83-L169 HydrophobicContact CE1-CD2 3.77Å; F83-L169 HydrophobicContact CE2-CD2 3.71Å; F83-L169 HydrophobicContact CG-CD2 3.85Å; F83-L169 HydrophobicContact CZ-CD2 3.73Å; F83-L169 HydrophobicContact CZ-CG 4.48Å; L142-L169 HydrophobicContact CD2-CD1 3.98Å; L142-L169 HydrophobicContact CD2-CD2 3.37Å; L142-L169 HydrophobicContact CD2-CG 4.34Å; F161-L169 WeakPolarHBondContact O-CB 3.38Å; F161-L169 VanDerWaalsContact O-CD1 3.29Å; F161-L169 WeakPolarHBondContact O-CD1 3.35Å; P162-L169 VanDerWaalsContact CD-O 3.32Å; P162-L169 WeakPolarHBondContact CD-O 3.49Å; P162-L169 VanDerWaalsContact CG-O 3.31Å; P162-L169 WeakPolarHBondContact CG-O 3.1Å; N163-L169 WeakPolarHBondContact ND2-CD1 3.37Å; Y166-L169 HydrophobicContact CD2-CD1 4.47Å; Y166-L169 HydrophobicContact CG-CD1 4.3Å; Y166-L169 HydrophobicContact CG-CG 4.49Å; Y166-L169 WeakPolarHBondContact O-CG 3.11Å; Y166-L169 PolarHBondContact O-N 3.11Å; L169-W176 HydrophobicContact CD2-CH2 3.93Å; L169-W176 HydrophobicContact CD2-CZ2 4.05Å
170	S	95.2	Very high	92.3	Very high	40 Å²	40	42.2 Å²	42.2	28%	0.28	25%	0.245	S	C	.	.			trans	-157.6	162.5	177.4	67.2	0	0	0	0	109.8	F160 H168 N172 W176	F160-S170 CarbonylContact O-C 3.58Å; F160-S170 WeakPolarHBondContact O-CA 3.31Å; F160-S170 PolarHBondContact O-N 3.25Å; H168-S170 PolarHBondContact O-N 2.82Å; S170-N172 PolarHBondContact O-N 2.99Å; S170-N172 VanDerWaalsContact O-N 3.15Å; S170-N172 WeakPolarHBondContact OG-CB 3.38Å; S170-N172 PolarHBondContact OG-N 2.96Å; S170-W176 PolarHBondContact O-NE1 2.8Å
171	A	96.8	Very high	92.1	Very high	38 Å²	38	42.5 Å²	42.5	31%	0.314	25%	0.25	S	S	.	.	S	Bend	trans	-74.3	10.9	170.6	0	0	0	0	0	113.5	F160 P173 V200 V202	F160-A171 HydrophobicContact CB-CB 4.29Å; A171-P173 VanDerWaalsContact O-CD 3.29Å; A171-P173 WeakPolarHBondContact O-CD 3.49Å; A171-V200 HydrophobicContact CB-CB 4.01Å; A171-V200 HydrophobicContact CB-CG1 4.04Å; A171-V202 HydrophobicContact CB-CG2 4.25Å
172	N	97.8	Very high	92	Very high	78 Å²	78	39.5 Å²	39.5	42%	0.417	24%	0.237	S	C	.	.			trans	-66	118.6	179.6	-177.8	-7.2	0	0	0	110.6	S170 S174 S175	S170-N172 PolarHBondContact O-N 2.99Å; S170-N172 VanDerWaalsContact O-N 3.15Å; S170-N172 WeakPolarHBondContact OG-CB 3.38Å; S170-N172 PolarHBondContact OG-N 2.96Å; N172-S174 PolarHBondContact ND2-OG 3.31Å; N172-S174 PolarHBondContact O-N 3.01Å; N172-S174 VanDerWaalsContact O-N 3.08Å; N172-S174 PolarHBondContact OD1-N 3.16Å; N172-S174 VanDerWaalsContact OD1-N 3.17Å; N172-S174 PolarHBondContact OD1-OG 2.9Å; N172-S174 VanDerWaalsContact OD1-OG 3.09Å; N172-S175 WeakPolarHBondContact O-CB 3.47Å; N172-S175 PolarHBondContact O-N 2.93Å
173	P	97.9	Very high	91.9	Very high	33 Å²	33	36.2 Å²	36.2	21%	0.214	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-53.8	-33.1	-177.8	-29.9	38.5	0	0	0	115	A171 S175 W176 V197 A198	A171-P173 VanDerWaalsContact O-CD 3.29Å; A171-P173 WeakPolarHBondContact O-CD 3.49Å; P173-S175 PolarHBondContact O-N 3.5Å; P173-W176 PolarHBondContact O-N 3.11Å; P173-V197 HydrophobicContact CB-CB 4.27Å; P173-V197 HydrophobicContact CB-CG1 3.98Å; P173-V197 WeakPolarHBondContact CB-O 3.37Å; P173-A198 WeakPolarHBondContact CG-O 3.4Å
174	S	96.9	Very high	92	Very high	87 Å²	87	34.5 Å²	34.5	61%	0.608	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-70.1	-15	-179.6	65	0	0	0	0	113.8	N172 W176	N172-S174 PolarHBondContact ND2-OG 3.31Å; N172-S174 PolarHBondContact O-N 3.01Å; N172-S174 VanDerWaalsContact O-N 3.08Å; N172-S174 PolarHBondContact OD1-N 3.16Å; N172-S174 VanDerWaalsContact OD1-N 3.17Å; N172-S174 PolarHBondContact OD1-OG 2.9Å; N172-S174 VanDerWaalsContact OD1-OG 3.09Å; S174-W176 VanDerWaalsContact C-N 3.27Å
175	S	97	Very high	92.5	Very high	10 Å²	10	28.8 Å²	28.8	7%	0.07	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-83	-2.1	176.5	-65.9	0	0	0	0	113.3	F83 Y84 N172 P173	F83-S175 WeakPolarHBondContact CD2-O 3.33Å; Y84-S175 PolarHBondContact N-O 3.47Å; N172-S175 WeakPolarHBondContact O-CB 3.47Å; N172-S175 PolarHBondContact O-N 2.93Å; P173-S175 PolarHBondContact O-N 3.5Å
176	W	98.1	Very high	92.9	Very high	6 Å²	6	29.7 Å²	29.7	2%	0.023	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.8	-169.8	-59.8	98.5	0	0	0	113.2	L81 M82 F83 L142 C159 F160 L169 S170 P173 S174 V197	L81-W176 HydrophobicContact CB-CE3 4.17Å; L81-W176 HydrophobicContact CB-CZ3 4.17Å; M82-W176 WeakPolarHBondContact O-CA 3.32Å; F83-W176 HydrophobicContact CB-CE3 4.31Å; F83-W176 HydrophobicContact CB-CH2 4.24Å; F83-W176 HydrophobicContact CB-CZ3 3.89Å; F83-W176 HydrophobicContact CD2-CD2 4.35Å; F83-W176 HydrophobicContact CD2-CE3 4.4Å; F83-W176 AromaticContact CD2-CH2 3.96Å; F83-W176 HydrophobicContact CD2-CH2 3.96Å; F83-W176 AromaticContact CD2-CZ2 3.86Å; F83-W176 HydrophobicContact CD2-CZ2 3.86Å; F83-W176 HydrophobicContact CD2-CZ3 4.22Å; F83-W176 HydrophobicContact CE2-CZ2 4.37Å; F83-W176 HydrophobicContact CG-CH2 4.39Å; F83-W176 HydrophobicContact CG-CZ3 4.47Å; L142-W176 HydrophobicContact CB-CZ3 4.38Å; L142-W176 HydrophobicContact CD2-CH2 3.56Å; L142-W176 HydrophobicContact CD2-CZ3 4.01Å; C159-W176 WeakPolarHBondContact O-CH2 3.24Å; C159-W176 WeakPolarHBondContact O-CZ2 3.26Å; F160-W176 HydrophobicContact CD1-CD2 4.28Å; F160-W176 AromaticContact CD1-CE2 3.47Å; F160-W176 VanDerWaalsContact CD1-CE2 3.47Å; F160-W176 HydrophobicContact CD1-CH2 4.21Å; F160-W176 AromaticContact CD1-CZ2 3.44Å; F160-W176 HydrophobicContact CD1-CZ2 3.44Å; F160-W176 VanDerWaalsContact CD1-CZ2 3.44Å; F160-W176 AromaticContact CD1-NE1 3.55Å; F160-W176 AromaticContact CE1-CD2 3.89Å; F160-W176 HydrophobicContact CE1-CD2 3.89Å; F160-W176 AromaticContact CE1-CE2 3.56Å; F160-W176 HydrophobicContact CE1-CE3 4.4Å; F160-W176 HydrophobicContact CE1-CG 4.3Å; F160-W176 HydrophobicContact CE1-CH2 4.27Å; F160-W176 AromaticContact CE1-CZ2 3.79Å; F160-W176 HydrophobicContact CE1-CZ2 3.79Å; F160-W176 AromaticContact CE1-NE1 3.78Å; F160-W176 HydrophobicContact CG-CZ2 4.44Å; L169-W176 HydrophobicContact CD2-CH2 3.93Å; L169-W176 HydrophobicContact CD2-CZ2 4.05Å; S170-W176 PolarHBondContact O-NE1 2.8Å; P173-W176 PolarHBondContact O-N 3.11Å; S174-W176 VanDerWaalsContact C-N 3.27Å; W176-V197 HydrophobicContact CB-CB 4.36Å; W176-V197 HydrophobicContact CB-CG2 3.74Å
177	I	97.5	Very high	92.8	Very high	37 Å²	37	30.5 Å²	30.5	19%	0.19	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136	161.7	-66.5	-65	0	0	0	107.2	M82 D194	M82-I177 HydrophobicContact CB-CB 4.42Å; M82-I177 WeakPolarHBondContact CB-O 3.25Å; M82-I177 PolarHBondContact N-O 3.11Å; M82-I177 PolarHBondContact O-N 3.34Å; I177-D194 HydrophobicContact CG2-CB 3.83Å
178	V	98.2	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.8	171	-173.7	0	0	0	0	108.6	T79 S80 L81 I153 I180 M195 V197 V219 L221	T79-V178 HydrophobicContact CG2-CG1 4.18Å; S80-V178 CarbonylContact O-C 3.48Å; S80-V178 WeakPolarHBondContact O-CA 3.39Å; L81-V178 HydrophobicContact CD1-CG1 4.42Å; I153-V178 HydrophobicContact CD1-CB 3.84Å; I153-V178 HydrophobicContact CD1-CG1 3.32Å; I153-V178 HydrophobicContact CD1-CG2 3.72Å; I153-V178 HydrophobicContact CG1-CG1 4.46Å; V178-I180 HydrophobicContact CG1-CD1 4.24Å; V178-I180 HydrophobicContact CG1-CG1 3.82Å; V178-M195 PolarHBondContact N-O 2.89Å; V178-M195 WeakPolarHBondContact O-CB 3.34Å; V178-M195 PolarHBondContact O-N 2.94Å; V178-V197 HydrophobicContact CG2-CG2 3.82Å; V178-V219 HydrophobicContact CG2-CG1 4.08Å; V178-L221 HydrophobicContact CB-CD2 4.03Å; V178-L221 HydrophobicContact CG2-CD2 3.9Å
179	R	96.8	Very high	92.1	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.6	170.8	-178.3	174.1	-76.4	-160.2	-10	110.5	T79 S80 M82 Y131 E182 E188 H192 Y193 D194	T79-R179 WeakPolarHBondContact CA-O 3.21Å; S80-R179 PolarHBondContact N-O 3.36Å; S80-R179 PolarHBondContact O-N 3.05Å; M82-R179 HydrophobicContact CG-CB 4.4Å; M82-R179 HydrophobicContact SD-CB 3.97Å; Y131-R179 PolarHBondContact OH-NH1 3.12Å; Y131-R179 VanDerWaalsContact OH-NH1 3.11Å; R179-E182 WeakPolarHBondContact CD-OE2 3.13Å; R179-E182 HydrophobicContact CG-CB 3.94Å; R179-E182 IonicContact CZ-OE2 3.49Å; R179-E182 IonicContact NE-OE2 2.66Å; R179-E182 IonicContact NH1-OE2 3.92Å; R179-E182 PolarHBondContact NH1-OE2 3.38Å; R179-E188 IonicContact CZ-OE1 3.71Å; R179-E188 IonicContact NH1-OE1 3.92Å; R179-E188 PolarHBondContact NH1-OE1 2.97Å; R179-E188 IonicContact NH2-OE1 3.43Å; R179-E188 PolarHBondContact NH2-OE1 3.29Å; R179-E188 IonicContact NH2-OE2 3.17Å; R179-H192 HydrophobicContact CG-CB 4.35Å; R179-H192 PolarHBondContact NE-CD2 3.06Å; R179-H192 PolarHBondContact NH2-NE2 2.78Å; R179-H192 VanDerWaalsContact NH2-NE2 3.18Å; R179-Y193 CarbonylContact C-O 3.44Å; R179-Y193 WeakPolarHBondContact CA-O 3.35Å; R179-D194 WeakPolarHBondContact CG-OD1 3.39Å; R179-D194 IonicContact CZ-OD1 3.7Å; R179-D194 IonicContact NE-OD1 3.83Å; R179-D194 PolarHBondContact NE-OD1 2.84Å; R179-D194 IonicContact NH2-OD1 2.84Å; R179-D194 PolarHBondContact NH2-OD1 2.75Å; R179-D194 IonicContact NH2-OD2 2.77Å; R179-D194 PolarHBondContact NH2-OD2 3.08Å
180	I	95.8	Very high	91.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.9	-174.3	-51.9	-179.5	0	0	0	110	T79 L147 I153 V178 E182 H192 Y193 M195 L221 V225 V231	T79-I180 HydrophobicContact CG2-CD1 4.32Å; T79-I180 HydrophobicContact CG2-CG1 3.83Å; T79-I180 HydrophobicContact CG2-CG2 4.34Å; L147-I180 HydrophobicContact CD1-CD1 4.21Å; L147-I180 HydrophobicContact CD2-CG2 4.35Å; I153-I180 HydrophobicContact CD1-CD1 4.37Å; V178-I180 HydrophobicContact CG1-CD1 4.24Å; V178-I180 HydrophobicContact CG1-CG1 3.82Å; I180-E182 VanDerWaalsContact C-N 3.32Å; I180-H192 CarbonylContact O-C 3.58Å; I180-H192 VanDerWaalsContact O-CA 3.27Å; I180-H192 WeakPolarHBondContact O-CA 3.3Å; I180-H192 WeakPolarHBondContact O-CB 3.45Å; I180-Y193 PolarHBondContact N-O 3.05Å; I180-Y193 PolarHBondContact O-N 2.8Å; I180-M195 HydrophobicContact CD1-CG 3.94Å; I180-M195 HydrophobicContact CG1-CG 4.42Å; I180-L221 HydrophobicContact CD1-CD1 3.83Å; I180-V225 HydrophobicContact CB-CG2 4.42Å; I180-V225 HydrophobicContact CD1-CB 4.07Å; I180-V225 HydrophobicContact CD1-CG1 4.15Å; I180-V225 HydrophobicContact CD1-CG2 4.05Å; I180-V225 HydrophobicContact CG2-CG2 4.32Å; I180-V231 HydrophobicContact CG2-CB 4.44Å; I180-V231 HydrophobicContact CG2-CG1 3.61Å; I180-V231 HydrophobicContact CG2-CG2 4.01Å
181	G	91.4	Very high	90.6	Very high	13 Å²	13	40.9 Å²	40.9	13%	0.134	23%	0.234	C	C	.	.	S	Bend	trans	85	5.4	-176.2	0	0	0	0	0	114.2
182	E	90.9	Very high	90.3	Very high	11 Å²	11	40.7 Å²	40.7	5%	0.051	23%	0.226	C	C	.	.			trans	-67.1	146.2	175.5	-176.5	57.5	-83.6	0	0	111.6	R179 I180 D184 M185 W254	R179-E182 WeakPolarHBondContact CD-OE2 3.13Å; R179-E182 HydrophobicContact CG-CB 3.94Å; R179-E182 IonicContact CZ-OE2 3.49Å; R179-E182 IonicContact NE-OE2 2.66Å; R179-E182 IonicContact NH1-OE2 3.92Å; R179-E182 PolarHBondContact NH1-OE2 3.38Å; I180-E182 VanDerWaalsContact C-N 3.32Å; E182-D184 PolarHBondContact OE1-N 2.97Å; E182-D184 VanDerWaalsContact OE1-O 3.11Å; E182-M185 HydrophobicContact CG-CG 3.7Å; E182-M185 PolarHBondContact OE1-N 2.95Å; E182-M185 WeakPolarHBondContact OE2-CA 3.49Å; E182-W254 HydrophobicContact CB-CH2 4.34Å; E182-W254 HydrophobicContact CB-CZ2 3.98Å; E182-W254 HydrophobicContact CG-CZ2 3.87Å
183	H	87.1	Confident	90.2	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.056	22%	0.217	C	C	.	.	S	Bend	trans	-140.5	-40.7	172.2	176.4	79.6	0	0	0	111.5	Y72 I267 L268	Y72-H183 HydrophobicContact CD1-CB 3.78Å; Y72-H183 AromaticContact CD1-CD2 3.6Å; Y72-H183 AromaticContact CD1-CG 3.6Å; Y72-H183 HydrophobicContact CE1-CB 3.82Å; Y72-H183 AromaticContact CE1-CD2 3.13Å; Y72-H183 WeakPolarHBondContact CE1-CD2 3.22Å; Y72-H183 AromaticContact CE1-CG 3.58Å; Y72-H183 AromaticContact CE1-NE2 3.94Å; Y72-H183 AromaticContact CZ-CD2 3.71Å; H183-I267 CarbonylContact O-C 3.6Å; H183-I267 WeakPolarHBondContact O-CA 3.41Å; H183-L268 PolarHBondContact O-N 3.07Å
184	D	87.6	Confident	90	Very high	18 Å²	18	40.9 Å²	40.9	10%	0.096	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-133.4	99	-178.3	175.7	-5.9	0	0	0	106.8	R63 E182 L186 N187 T266 I267	R63-D184 IonicContact NH1-OD2 2.78Å; E182-D184 PolarHBondContact OE1-N 2.97Å; E182-D184 VanDerWaalsContact OE1-O 3.11Å; D184-L186 PolarHBondContact O-N 3.08Å; D184-L186 PolarHBondContact OD1-N 3.46Å; D184-N187 HydrophobicContact CB-CB 3.95Å; D184-N187 WeakPolarHBondContact O-CA 3.22Å; D184-N187 PolarHBondContact O-N 2.66Å; D184-T266 CarbonylContact C-O 3.52Å; D184-T266 WeakPolarHBondContact CA-O 3.49Å; D184-I267 HydrophobicContact CB-CG1 4.43Å
185	M	87.3	Confident	90.1	Very high	5 Å²	5	37 Å²	37	3%	0.025	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-11	-171.2	-57.2	-178.7	172.2	0	0	113.4	L129 Y131 H141 E182 W254 I264 T266	L129-M185 HydrophobicContact CD2-CB 3.1Å; L129-M185 HydrophobicContact CD2-CG 4.1Å; L129-M185 HydrophobicContact CD2-SD 3.92Å; Y131-M185 PolarHBondContact OH-O 3.44Å; H141-M185 HydrophobicContact CB-CE 3.88Å; H141-M185 HydrophobicContact CB-SD 4.23Å; E182-M185 HydrophobicContact CG-CG 3.7Å; E182-M185 PolarHBondContact OE1-N 2.95Å; E182-M185 WeakPolarHBondContact OE2-CA 3.49Å; M185-W254 HydrophobicContact CE-CB 3.74Å; M185-W254 HydrophobicContact CE-CD2 3.39Å; M185-W254 HydrophobicContact CE-CE3 3.86Å; M185-W254 HydrophobicContact CE-CG 3.32Å; M185-W254 HydrophobicContact SD-CG 4.38Å; M185-I264 HydrophobicContact SD-CD1 4.47Å; M185-T266 PolarHBondContact N-O 3.27Å
186	L	85.3	Confident	90.2	Very high	115 Å²	115	39.5 Å²	39.5	60%	0.602	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-9.2	171.7	-67.1	177	0	0	0	112.9	L129 D184 T266	L129-L186 HydrophobicContact CD1-CD2 3.52Å; D184-L186 PolarHBondContact O-N 3.08Å; D184-L186 PolarHBondContact OD1-N 3.46Å; L186-T266 HydrophobicContact CD1-CG2 3.83Å; L186-T266 HydrophobicContact CD2-CG2 4.47Å; L186-T266 HydrophobicContact CG-CG2 3.85Å
187	N	83.4	Confident	90.2	Very high	33 Å²	33	39.8 Å²	39.8	18%	0.176	21%	0.214	C	C	.	.			trans	-112.5	81.4	-174.1	-175.1	11.8	0	0	0	112.7	D184 S189 M190	D184-N187 HydrophobicContact CB-CB 3.95Å; D184-N187 WeakPolarHBondContact O-CA 3.22Å; D184-N187 PolarHBondContact O-N 2.66Å; N187-S189 PolarHBondContact O-N 3.2Å; N187-S189 WeakPolarHBondContact OD1-CB 2.97Å; N187-S189 PolarHBondContact OD1-N 3Å; N187-S189 PolarHBondContact OD1-OG 3.2Å; N187-M190 PolarHBondContact O-N 3.02Å
188	E	81.4	Confident	90.2	Very high	100 Å²	100	40.1 Å²	40.1	47%	0.467	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-3.7	176.4	-64.4	-76.9	152.1	0	0	113.9	Y131 R179 M190 H192	Y131-E188 PolarHBondContact OH-OE1 2.97Å; R179-E188 IonicContact CZ-OE1 3.71Å; R179-E188 IonicContact NH1-OE1 3.92Å; R179-E188 PolarHBondContact NH1-OE1 2.97Å; R179-E188 IonicContact NH2-OE1 3.43Å; R179-E188 PolarHBondContact NH2-OE1 3.29Å; R179-E188 IonicContact NH2-OE2 3.17Å; E188-M190 PolarHBondContact O-N 3.16Å; E188-H192 IonicContact OE2-CE1 3.75Å; E188-H192 PolarHBondContact OE2-CE1 2.96Å; E188-H192 IonicContact OE2-NE2 3.6Å; E188-H192 PolarHBondContact OE2-NE2 3.44Å
189	S	78.4	Confident	90.2	Very high	99 Å²	99	44.2 Å²	44.2	69%	0.692	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-16.2	175	75.4	0	0	0	0	113.4	N187	N187-S189 PolarHBondContact O-N 3.2Å; N187-S189 WeakPolarHBondContact OD1-CB 2.97Å; N187-S189 PolarHBondContact OD1-N 3Å; N187-S189 PolarHBondContact OD1-OG 3.2Å
190	M	76	Confident	90.3	Very high	48 Å²	48	44.4 Å²	44.4	24%	0.236	24%	0.243	C	C	.	.	S	Bend	trans	-88	135.7	176.5	-65.7	-61.8	-63.7	0	0	110.7	Y72 N187 E188 H192 Y230	Y72-M190 HydrophobicContact CD1-CE 3.85Å; Y72-M190 HydrophobicContact CE1-CE 3.93Å; Y72-M190 HydrophobicContact CE1-CG 4.28Å; Y72-M190 HydrophobicContact CE1-SD 4.46Å; Y72-M190 HydrophobicContact CG-CE 4.33Å; N187-M190 PolarHBondContact O-N 3.02Å; E188-M190 PolarHBondContact O-N 3.16Å; M190-H192 PolarHBondContact O-N 3.4Å; M190-H192 PolarHBondContact O-ND1 3.06Å; M190-Y230 HydrophobicContact CE-CE2 4.37Å
191	E	81.7	Confident	90.4	Very high	111 Å²	111	48 Å²	48	52%	0.519	26%	0.257	S	S	.	.			trans	-64.7	118.9	178.6	-172.5	178.8	-171.6	0	0	110.4	Y193	E191-Y193 PolarHBondContact OE1-OH 3.03Å
192	H	90.4	Very high	90.7	Very high	35 Å²	35	49.2 Å²	49.2	16%	0.162	26%	0.262	C	S	.	.			trans	-135.8	166	169.5	61.5	-85	0	0	0	108.8	R179 I180 E188 M190 D194	R179-H192 HydrophobicContact CG-CB 4.35Å; R179-H192 PolarHBondContact NE-CD2 3.06Å; R179-H192 PolarHBondContact NH2-NE2 2.78Å; R179-H192 VanDerWaalsContact NH2-NE2 3.18Å; I180-H192 CarbonylContact O-C 3.58Å; I180-H192 VanDerWaalsContact O-CA 3.27Å; I180-H192 WeakPolarHBondContact O-CA 3.3Å; I180-H192 WeakPolarHBondContact O-CB 3.45Å; E188-H192 IonicContact OE2-CE1 3.75Å; E188-H192 PolarHBondContact OE2-CE1 2.96Å; E188-H192 IonicContact OE2-NE2 3.6Å; E188-H192 PolarHBondContact OE2-NE2 3.44Å; M190-H192 PolarHBondContact O-N 3.4Å; M190-H192 PolarHBondContact O-ND1 3.06Å; H192-D194 IonicContact CD2-OD1 3.55Å
193	Y	94.3	Very high	91	Very high	54 Å²	54	49.3 Å²	49.3	21%	0.212	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.7	179.5	-55	-76.5	0	0	0	110.3	R179 I180 E191 V225 V231	R179-Y193 CarbonylContact C-O 3.44Å; R179-Y193 WeakPolarHBondContact CA-O 3.35Å; I180-Y193 PolarHBondContact N-O 3.05Å; I180-Y193 PolarHBondContact O-N 2.8Å; E191-Y193 PolarHBondContact OE1-OH 3.03Å; Y193-V225 HydrophobicContact CD2-CG2 3.59Å; Y193-V225 HydrophobicContact CE2-CG2 4.24Å; Y193-V225 HydrophobicContact CG-CG2 3.93Å; Y193-V231 HydrophobicContact CD2-CG2 4.09Å; Y193-V231 HydrophobicContact CE2-CG2 3.95Å
194	D	95.5	Very high	91.4	Very high	60 Å²	60	54 Å²	54	32%	0.321	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	106.3	166.9	-78.7	5.6	0	0	0	108.9	R139 I177 R179 H192	R139-D194 IonicContact CZ-OD2 3.05Å; R139-D194 VanDerWaalsContact CZ-OD2 3.24Å; R139-D194 IonicContact NH1-OD2 3.4Å; R139-D194 PolarHBondContact NH1-OD2 3.49Å; R139-D194 IonicContact NH2-OD2 3.88Å; R139-D194 PolarHBondContact NH2-OD2 2.04Å; I177-D194 HydrophobicContact CG2-CB 3.83Å; R179-D194 WeakPolarHBondContact CG-OD1 3.39Å; R179-D194 IonicContact CZ-OD1 3.7Å; R179-D194 IonicContact NE-OD1 3.83Å; R179-D194 PolarHBondContact NE-OD1 2.84Å; R179-D194 IonicContact NH2-OD1 2.84Å; R179-D194 PolarHBondContact NH2-OD1 2.75Å; R179-D194 IonicContact NH2-OD2 2.77Å; R179-D194 PolarHBondContact NH2-OD2 3.08Å; H192-D194 IonicContact CD2-OD1 3.55Å
195	M	97.8	Very high	91.7	Very high	7 Å²	7	58 Å²	58	3%	0.034	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.6	-172.3	-58.2	-66.6	-73.6	0	0	111.2	V178 I180 L221 K223 V225	V178-M195 PolarHBondContact N-O 2.89Å; V178-M195 WeakPolarHBondContact O-CB 3.34Å; V178-M195 PolarHBondContact O-N 2.94Å; I180-M195 HydrophobicContact CD1-CG 3.94Å; I180-M195 HydrophobicContact CG1-CG 4.42Å; M195-L221 HydrophobicContact CB-CD1 4.17Å; M195-L221 HydrophobicContact CB-CD2 3.79Å; M195-L221 HydrophobicContact CB-CG 4.49Å; M195-L221 HydrophobicContact CE-CD1 4.12Å; M195-L221 HydrophobicContact CG-CD1 4.28Å; M195-K223 HydrophobicContact CE-CD 4.48Å; M195-K223 HydrophobicContact CE-CG 3.65Å; M195-K223 WeakPolarHBondContact CE-O 3.46Å; M195-V225 HydrophobicContact CE-CB 3.97Å; M195-V225 HydrophobicContact CE-CG2 4.41Å; M195-V225 HydrophobicContact CG-CG2 4.48Å; M195-V225 HydrophobicContact SD-CB 4.49Å; M195-V225 HydrophobicContact SD-CG2 4.31Å
196	S	98.3	Very high	92	Very high	62 Å²	62	58.8 Å²	58.8	43%	0.434	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	141.2	173.4	-52.2	0	0	0	0	111.6	T222	S196-T222 WeakPolarHBondContact O-CG2 3.35Å; S196-T222 PolarHBondContact O-N 2.84Å; S196-T222 PolarHBondContact O-OG1 3.02Å
197	V	98.7	Very high	92.1	Very high	11 Å²	11	60.2 Å²	60.2	7%	0.067	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135	177.4	178.1	0	0	0	0	110.5	P173 W176 V178 V200 V219	P173-V197 HydrophobicContact CB-CB 4.27Å; P173-V197 HydrophobicContact CB-CG1 3.98Å; P173-V197 WeakPolarHBondContact CB-O 3.37Å; W176-V197 HydrophobicContact CB-CB 4.36Å; W176-V197 HydrophobicContact CB-CG2 3.74Å; V178-V197 HydrophobicContact CG2-CG2 3.82Å; V197-V200 HydrophobicContact CG1-CG2 3.8Å; V197-V219 HydrophobicContact CB-CG1 4.23Å; V197-V219 HydrophobicContact CG1-CG1 3.6Å; V197-V219 HydrophobicContact CG2-CG1 3.62Å
198	A	98.3	Very high	91.9	Very high	44 Å²	44	60.3 Å²	60.3	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-40.6	172.7	0	0	0	0	0	111.8	P173 K220 T222	P173-A198 WeakPolarHBondContact CG-O 3.4Å; A198-K220 WeakPolarHBondContact CB-O 3.34Å; A198-K220 PolarHBondContact N-O 2.73Å; A198-T222 HydrophobicContact CB-CG2 3.99Å
199	H	98.2	Very high	91.2	Very high	87 Å²	87	56.6 Å²	56.6	40%	0.403	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	151.6	-179.7	-151.7	79.4	0	0	0	111.1	Y201 K220	H199-Y201 HydrophobicContact CB-CD2 4.38Å; H199-Y201 HydrophobicContact CB-CE2 3.72Å; H199-Y201 AromaticContact CD2-CD1 3.82Å; H199-Y201 AromaticContact CD2-CD2 3.73Å; H199-Y201 AromaticContact CD2-CE1 3.55Å; H199-Y201 AromaticContact CD2-CE2 3.47Å; H199-Y201 VanDerWaalsContact CD2-CE2 3.47Å; H199-Y201 WeakPolarHBondContact CD2-CE2 3.32Å; H199-Y201 AromaticContact CD2-CG 3.91Å; H199-Y201 AromaticContact CD2-CZ 3.36Å; H199-Y201 AromaticContact CG-CE2 3.89Å; H199-Y201 AromaticContact CG-CZ 3.89Å; H199-K220 HydrophobicContact CB-CB 4.46Å; H199-K220 PolarHBondContact N-O 2.87Å; H199-K220 PolarHBondContact O-N 3.32Å
200	V	98.5	Very high	90.7	Very high	8 Å²	8	54.5 Å²	54.5	5%	0.048	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.7	171.9	180	0	0	0	0	108	F160 A171 V197 V202 V219	F160-V200 HydrophobicContact CD1-CG1 3.69Å; F160-V200 HydrophobicContact CD1-CG2 4.34Å; F160-V200 HydrophobicContact CD2-CG1 3.7Å; F160-V200 HydrophobicContact CE1-CB 4.41Å; F160-V200 HydrophobicContact CE1-CG1 3.61Å; F160-V200 HydrophobicContact CE1-CG2 3.92Å; F160-V200 HydrophobicContact CE2-CG1 3.63Å; F160-V200 HydrophobicContact CG-CG1 3.72Å; F160-V200 HydrophobicContact CZ-CG1 3.58Å; F160-V200 HydrophobicContact CZ-CG2 4.37Å; A171-V200 HydrophobicContact CB-CB 4.01Å; A171-V200 HydrophobicContact CB-CG1 4.04Å; V197-V200 HydrophobicContact CG1-CG2 3.8Å; V200-V202 HydrophobicContact CG1-CG2 4.24Å; V200-V219 HydrophobicContact CG1-CG2 4.45Å; V200-V219 HydrophobicContact CG2-CG2 4.34Å
201	Y	98	Very high	90	Very high	75 Å²	75	54.9 Å²	54.9	29%	0.294	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	100	177	-62	-92.5	0	0	0	108.8	W152 H199 A217 L218 K220 I366	W152-Y201 HydrophobicContact CH2-CD2 4.16Å; W152-Y201 AromaticContact CH2-CE2 3.67Å; W152-Y201 HydrophobicContact CH2-CE2 3.67Å; W152-Y201 AromaticContact CZ3-CD2 3.7Å; W152-Y201 HydrophobicContact CZ3-CD2 3.7Å; W152-Y201 AromaticContact CZ3-CE2 3.64Å; W152-Y201 HydrophobicContact CZ3-CE2 3.64Å; H199-Y201 HydrophobicContact CB-CD2 4.38Å; H199-Y201 HydrophobicContact CB-CE2 3.72Å; H199-Y201 AromaticContact CD2-CD1 3.82Å; H199-Y201 AromaticContact CD2-CD2 3.73Å; H199-Y201 AromaticContact CD2-CE1 3.55Å; H199-Y201 AromaticContact CD2-CE2 3.47Å; H199-Y201 VanDerWaalsContact CD2-CE2 3.47Å; H199-Y201 WeakPolarHBondContact CD2-CE2 3.32Å; H199-Y201 AromaticContact CD2-CG 3.91Å; H199-Y201 AromaticContact CD2-CZ 3.36Å; H199-Y201 AromaticContact CG-CE2 3.89Å; H199-Y201 AromaticContact CG-CZ 3.89Å; Y201-A217 CarbonylContact O-C 3.47Å; Y201-A217 WeakPolarHBondContact O-CA 3.31Å; Y201-A217 WeakPolarHBondContact O-CB 3.22Å; Y201-L218 PolarHBondContact N-O 3.5Å; Y201-L218 PolarHBondContact O-N 2.79Å; Y201-K220 HydrophobicContact CE2-CB 4.31Å; Y201-I366 HydrophobicContact CD1-CD1 4.29Å; Y201-I366 HydrophobicContact CD1-CG2 3.85Å; Y201-I366 HydrophobicContact CD2-CG2 3.84Å; Y201-I366 HydrophobicContact CE1-CG2 4.29Å; Y201-I366 HydrophobicContact CE2-CG2 4.28Å; Y201-I366 HydrophobicContact CG-CG2 3.61Å
202	V	97.4	Very high	89	Confident	39 Å²	39	50.1 Å²	50.1	24%	0.236	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	139.8	171.2	172.5	0	0	0	0	109.1	A157 F160 F161 A171 V200 A217	A157-V202 HydrophobicContact CB-CG1 3.99Å; F160-V202 HydrophobicContact CB-CG2 4.12Å; F160-V202 HydrophobicContact CD2-CG2 4.14Å; F160-V202 HydrophobicContact CG-CG2 4.39Å; F161-V202 HydrophobicContact CE2-CG1 3.54Å; F161-V202 HydrophobicContact CE2-CG2 4.35Å; F161-V202 HydrophobicContact CZ-CG1 3.88Å; A171-V202 HydrophobicContact CB-CG2 4.25Å; V200-V202 HydrophobicContact CG1-CG2 4.24Å; V202-A217 HydrophobicContact CG2-CB 4.46Å
203	H	96.9	Very high	88.8	Confident	13 Å²	13	48.8 Å²	48.8	6%	0.06	28%	0.275	C	S	.	.			trans	-59.5	127.2	174.6	-164	-79.6	0	0	0	110.8	Q205 Y206 Y214 I216 Y359 W362	H203-Q205 PolarHBondContact CE1-OE1 3.38Å; H203-Q205 PolarHBondContact ND1-N 2.9Å; H203-Q205 PolarHBondContact O-N 3.27Å; H203-Q205 VanDerWaalsContact O-N 3.09Å; H203-Y206 WeakPolarHBondContact O-CB 3.39Å; H203-Y206 PolarHBondContact O-N 2.75Å; H203-Y214 WeakPolarHBondContact CB-O 3.3Å; H203-Y214 AromaticContact CE1-CD1 3.23Å; H203-Y214 WeakPolarHBondContact CE1-CD1 3.45Å; H203-Y214 AromaticContact CE1-CE1 3.88Å; H203-Y214 AromaticContact ND1-CD1 3.45Å; H203-Y214 WeakPolarHBondContact ND1-CD1 3.5Å; H203-Y214 AromaticContact ND1-CG 3.81Å; H203-Y214 AromaticContact NE2-CD1 3.9Å; H203-I216 HydrophobicContact CB-CG2 3.77Å; H203-I216 WeakPolarHBondContact CB-O 3.29Å; H203-I216 PolarHBondContact N-O 3.14Å; H203-Y359 AromaticContact CD2-CD1 3.96Å; H203-W362 HydrophobicContact CB-CZ2 4.17Å; H203-W362 AromaticContact CD2-CD1 3.69Å; H203-W362 AromaticContact CD2-CD2 3.52Å; H203-W362 AromaticContact CD2-CE2 3.52Å; H203-W362 AromaticContact CD2-CG 3.65Å; H203-W362 AromaticContact CD2-NE1 3.61Å; H203-W362 AromaticContact NE2-CD1 3.68Å; H203-W362 AromaticContact NE2-CG 3.79Å; H203-W362 AromaticContact NE2-NE1 4Å
204	P	95.3	Very high	88.8	Confident	109 Å²	109	49.5 Å²	49.5	71%	0.708	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.3	-170.8	26.2	-36.3	0	0	0	114.4
205	Q	94.5	Very high	88.9	Confident	102 Å²	102	46.7 Å²	46.7	48%	0.477	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-1.7	177.6	-63.5	178	-97.6	0	0	113.8	H203 Q207 Y214	H203-Q205 PolarHBondContact CE1-OE1 3.38Å; H203-Q205 PolarHBondContact ND1-N 2.9Å; H203-Q205 PolarHBondContact O-N 3.27Å; H203-Q205 VanDerWaalsContact O-N 3.09Å; Q205-Q207 PolarHBondContact O-N 3.1Å; Q205-Y214 HydrophobicContact CB-CD1 3.82Å; Q205-Y214 HydrophobicContact CB-CD2 3.77Å; Q205-Y214 HydrophobicContact CB-CE1 4.07Å; Q205-Y214 HydrophobicContact CB-CE2 4.07Å; Q205-Y214 HydrophobicContact CB-CG 3.68Å; Q205-Y214 HydrophobicContact CG-CE1 4.5Å; Q205-Y214 PolarHBondContact NE2-OH 3.05Å
206	Y	94	Very high	88.9	Confident	22 Å²	22	46.3 Å²	46.3	9%	0.086	26%	0.261	C	S	.	.			trans	-67.2	127.9	176.2	178.7	-99.1	0	0	0	110.5	A157 H158 F161 H203 S208 A209 Y214 D215	A157-Y206 HydrophobicContact CB-CD1 3.72Å; A157-Y206 HydrophobicContact CB-CD2 3.65Å; A157-Y206 HydrophobicContact CB-CE1 4.13Å; A157-Y206 HydrophobicContact CB-CE2 4.06Å; A157-Y206 HydrophobicContact CB-CG 3.44Å; A157-Y206 VanDerWaalsContact CB-CG 3.44Å; H158-Y206 WeakPolarHBondContact CA-OH 3.36Å; H158-Y206 HydrophobicContact CB-CE1 4.39Å; H158-Y206 HydrophobicContact CB-CE2 4.36Å; H158-Y206 WeakPolarHBondContact CB-OH 3.48Å; F161-Y206 HydrophobicContact CD1-CE1 4.28Å; F161-Y206 AromaticContact CD2-CD1 3.78Å; F161-Y206 HydrophobicContact CD2-CD1 3.78Å; F161-Y206 AromaticContact CD2-CE1 3.45Å; F161-Y206 HydrophobicContact CD2-CE1 3.45Å; F161-Y206 VanDerWaalsContact CD2-CE1 3.45Å; F161-Y206 HydrophobicContact CE1-CD1 4.18Å; F161-Y206 HydrophobicContact CE1-CE1 4.3Å; F161-Y206 AromaticContact CE2-CD1 3.25Å; F161-Y206 HydrophobicContact CE2-CD1 3.25Å; F161-Y206 AromaticContact CE2-CE1 3.47Å; F161-Y206 HydrophobicContact CE2-CE1 3.47Å; F161-Y206 VanDerWaalsContact CE2-CE1 3.47Å; F161-Y206 HydrophobicContact CE2-CG 4.41Å; F161-Y206 HydrophobicContact CG-CD1 4.43Å; F161-Y206 AromaticContact CG-CE1 3.88Å; F161-Y206 HydrophobicContact CG-CE1 3.88Å; F161-Y206 AromaticContact CZ-CD1 3.49Å; F161-Y206 HydrophobicContact CZ-CD1 3.49Å; F161-Y206 VanDerWaalsContact CZ-CD1 3.49Å; F161-Y206 AromaticContact CZ-CE1 3.92Å; F161-Y206 HydrophobicContact CZ-CE1 3.92Å; H203-Y206 WeakPolarHBondContact O-CB 3.39Å; H203-Y206 PolarHBondContact O-N 2.75Å; Y206-S208 VanDerWaalsContact OH-C 3.27Å; Y206-S208 WeakPolarHBondContact OH-CA 2.95Å; Y206-A209 PolarHBondContact OH-N 3.16Å; Y206-Y214 WeakPolarHBondContact CB-O 3.37Å; Y206-D215 HydrophobicContact CD2-CB 3.96Å; Y206-D215 HydrophobicContact CE2-CB 3.72Å; Y206-D215 WeakPolarHBondContact CE2-OD1 3.49Å
207	Q	86.6	Confident	88.9	Confident	146 Å²	146	43.4 Å²	43.4	68%	0.682	24%	0.24	S	C	*	.			trans	-114.7	-55.2	178	-58.4	178.5	8	0	0	111.2	Q205 S212	Q205-Q207 PolarHBondContact O-N 3.1Å; Q207-S212 WeakPolarHBondContact CB-OG 3.27Å; Q207-S212 PolarHBondContact N-OG 3.17Å; Q207-S212 VanDerWaalsContact N-OG 3.16Å
208	S	80.5	Confident	88.9	Confident	34 Å²	34	42.9 Å²	42.9	24%	0.238	24%	0.237	C	C	.	.			trans	-154.1	162.7	172.4	83.1	0	0	0	0	110.2	Y206 S210 S211 S212	Y206-S208 VanDerWaalsContact OH-C 3.27Å; Y206-S208 WeakPolarHBondContact OH-CA 2.95Å; S208-S210 VanDerWaalsContact C-N 3.31Å; S208-S210 PolarHBondContact O-N 3Å; S208-S210 PolarHBondContact OG-N 3.1Å; S208-S210 PolarHBondContact OG-OG 3.13Å; S208-S211 WeakPolarHBondContact OG-CB 3.48Å; S208-S211 PolarHBondContact OG-N 2.96Å; S208-S211 PolarHBondContact OG-OG 3.37Å; S208-S212 PolarHBondContact N-OG 3.05Å; S208-S212 PolarHBondContact O-OG 2.83Å; S208-S212 VanDerWaalsContact O-OG 3.1Å
209	A	66.5	Low	88.9	Confident	23 Å²	23	40.9 Å²	40.9	19%	0.19	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-39.1	178.4	0	0	0	0	0	111.5	H158 Y206 F340	H158-A209 HydrophobicContact CB-CB 4.37Å; Y206-A209 PolarHBondContact OH-N 3.16Å; A209-F340 HydrophobicContact CB-CB 4.32Å; A209-F340 WeakPolarHBondContact O-CD1 3.45Å; A209-F340 WeakPolarHBondContact O-CE1 3.38Å
210	S	66.3	Low	88.9	Confident	55 Å²	55	40 Å²	40	39%	0.385	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-14.1	-174.5	52.8	0	0	0	0	115.7	S208	S208-S210 VanDerWaalsContact C-N 3.31Å; S208-S210 PolarHBondContact O-N 3Å; S208-S210 PolarHBondContact OG-N 3.1Å; S208-S210 PolarHBondContact OG-OG 3.13Å
211	S	62.8	Low	88.9	Confident	56 Å²	56	39.6 Å²	39.6	39%	0.392	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	1.2	-162.8	70.7	0	0	0	0	117.8	S208	S208-S211 WeakPolarHBondContact OG-CB 3.48Å; S208-S211 PolarHBondContact OG-N 2.96Å; S208-S211 PolarHBondContact OG-OG 3.37Å
212	S	60.9	Low	88.9	Confident	10 Å²	10	39.6 Å²	39.6	7%	0.07	22%	0.221	C	C	.	.			trans	-146.7	-6.1	-171.2	54	0	0	0	0	118.7	Q207 S208 Y214	Q207-S212 WeakPolarHBondContact CB-OG 3.27Å; Q207-S212 PolarHBondContact N-OG 3.17Å; Q207-S212 VanDerWaalsContact N-OG 3.16Å; S208-S212 PolarHBondContact N-OG 3.05Å; S208-S212 PolarHBondContact O-OG 2.83Å; S208-S212 VanDerWaalsContact O-OG 3.1Å; S212-Y214 WeakPolarHBondContact O-CD2 2.97Å; S212-Y214 VanDerWaalsContact O-CE2 3.27Å; S212-Y214 WeakPolarHBondContact O-CE2 3.02Å
213	G	85.2	Confident	88.9	Confident	7 Å²	7	43.8 Å²	43.8	7%	0.072	24%	0.236	C	C	.	.			trans	56.4	-151.8	-161	0	0	0	0	0	109.8	D215	G213-D215 PolarHBondContact O-N 2.86Å
214	Y	95.4	Very high	88.7	Confident	69 Å²	69	46.9 Å²	46.9	27%	0.271	26%	0.257	S	S	.	.			trans	55.8	18.4	-175.8	-50.1	-81.1	0	0	0	114.8	H203 Q205 Y206 S212 I216 Y359	H203-Y214 WeakPolarHBondContact CB-O 3.3Å; H203-Y214 AromaticContact CE1-CD1 3.23Å; H203-Y214 WeakPolarHBondContact CE1-CD1 3.45Å; H203-Y214 AromaticContact CE1-CE1 3.88Å; H203-Y214 AromaticContact ND1-CD1 3.45Å; H203-Y214 WeakPolarHBondContact ND1-CD1 3.5Å; H203-Y214 AromaticContact ND1-CG 3.81Å; H203-Y214 AromaticContact NE2-CD1 3.9Å; Q205-Y214 HydrophobicContact CB-CD1 3.82Å; Q205-Y214 HydrophobicContact CB-CD2 3.77Å; Q205-Y214 HydrophobicContact CB-CE1 4.07Å; Q205-Y214 HydrophobicContact CB-CE2 4.07Å; Q205-Y214 HydrophobicContact CB-CG 3.68Å; Q205-Y214 HydrophobicContact CG-CE1 4.5Å; Q205-Y214 PolarHBondContact NE2-OH 3.05Å; Y206-Y214 WeakPolarHBondContact CB-O 3.37Å; S212-Y214 WeakPolarHBondContact O-CD2 2.97Å; S212-Y214 VanDerWaalsContact O-CE2 3.27Å; S212-Y214 WeakPolarHBondContact O-CE2 3.02Å; Y214-I216 PolarHBondContact O-N 2.87Å; Y214-Y359 VanDerWaalsContact CA-OH 3.24Å; Y214-Y359 WeakPolarHBondContact CA-OH 3.25Å; Y214-Y359 AromaticContact CD1-CE1 3.72Å; Y214-Y359 HydrophobicContact CD1-CE1 3.72Å; Y214-Y359 HydrophobicContact CE1-CE1 4.46Å; Y214-Y359 HydrophobicContact CG-CE1 4.39Å; Y214-Y359 PolarHBondContact N-OH 3.33Å
215	D	96.7	Very high	88.6	Confident	1 Å²	1	42 Å²	42	1%	0.005	23%	0.226	C	C	.	.			trans	-77.4	69.8	179.6	-168.6	17.8	0	0	0	110.7	A157 H158 Y206 G213 S339 T354	A157-D215 WeakPolarHBondContact CA-OD1 3.17Å; A157-D215 WeakPolarHBondContact CB-OD1 3.27Å; A157-D215 PolarHBondContact N-OD1 3.13Å; H158-D215 IonicContact CE1-OD2 2.68Å; H158-D215 IonicContact CG-OD1 3.71Å; H158-D215 IonicContact CG-OD2 3.24Å; H158-D215 PolarHBondContact N-OD1 2.83Å; H158-D215 IonicContact ND1-OD1 3.12Å; H158-D215 PolarHBondContact ND1-OD1 2.86Å; H158-D215 IonicContact ND1-OD2 2.78Å; H158-D215 PolarHBondContact ND1-OD2 3.15Å; Y206-D215 HydrophobicContact CD2-CB 3.96Å; Y206-D215 HydrophobicContact CE2-CB 3.72Å; Y206-D215 WeakPolarHBondContact CE2-OD1 3.49Å; G213-D215 PolarHBondContact O-N 2.86Å; D215-S339 WeakPolarHBondContact CB-OG 3.47Å; D215-S339 WeakPolarHBondContact OD2-CA 3.27Å; D215-S339 WeakPolarHBondContact OD2-CB 3.24Å; D215-S339 PolarHBondContact OD2-OG 2.9Å; D215-T354 PolarHBondContact O-OG1 3.16Å
216	I	98	Very high	88.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.			trans	-142.6	139.3	-179	-173.4	172.6	0	0	0	110.6	M154 T155 H203 Y214 I337 T354 Y359 W362 I363	M154-I216 HydrophobicContact CG-CD1 4.13Å; M154-I216 HydrophobicContact CG-CG1 4.25Å; M154-I216 HydrophobicContact SD-CD1 4.07Å; T155-I216 CarbonylContact O-C 3.55Å; T155-I216 WeakPolarHBondContact O-CA 3.24Å; H203-I216 HydrophobicContact CB-CG2 3.77Å; H203-I216 WeakPolarHBondContact CB-O 3.29Å; H203-I216 PolarHBondContact N-O 3.14Å; Y214-I216 PolarHBondContact O-N 2.87Å; I216-I337 HydrophobicContact CB-CD1 4.03Å; I216-I337 HydrophobicContact CD1-CD1 3.68Å; I216-I337 HydrophobicContact CG1-CD1 3.53Å; I216-T354 HydrophobicContact CB-CG2 4.26Å; I216-Y359 HydrophobicContact CD1-CG 4.13Å; I216-Y359 HydrophobicContact CG2-CD1 3.61Å; I216-Y359 HydrophobicContact CG2-CE1 3.85Å; I216-Y359 HydrophobicContact CG2-CG 4.09Å; I216-W362 HydrophobicContact CB-CZ3 4.47Å; I216-W362 HydrophobicContact CD1-CE3 4.16Å; I216-W362 HydrophobicContact CD1-CZ3 3.86Å; I216-W362 HydrophobicContact CG1-CZ3 3.79Å; I216-W362 HydrophobicContact CG2-CE3 4.24Å; I216-W362 HydrophobicContact CG2-CH2 4.43Å; I216-W362 HydrophobicContact CG2-CZ3 3.96Å; I216-I363 HydrophobicContact CD1-CD1 3.97Å; I216-I363 HydrophobicContact CD1-CG1 4.1Å
217	A	98.4	Very high	88	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.5	170.6	0	0	0	0	0	110.7	T155 F160 Y201 V202	T155-A217 HydrophobicContact CG2-CB 3.99Å; T155-A217 PolarHBondContact N-O 2.03Å; T155-A217 PolarHBondContact O-N 2.83Å; F160-A217 HydrophobicContact CD2-CB 3.79Å; F160-A217 HydrophobicContact CE2-CB 3.47Å; F160-A217 VanDerWaalsContact CE2-CB 3.47Å; Y201-A217 CarbonylContact O-C 3.47Å; Y201-A217 WeakPolarHBondContact O-CA 3.31Å; Y201-A217 WeakPolarHBondContact O-CB 3.22Å; V202-A217 HydrophobicContact CG2-CB 4.46Å
218	L	98.7	Very high	87.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.1	168.7	-65.3	-177.7	0	0	0	110.5	I148 W152 I153 M154 Y201 W362 I363 I366 A367	I148-L218 HydrophobicContact CD1-CD2 3.79Å; W152-L218 HydrophobicContact CE3-CB 4.12Å; W152-L218 HydrophobicContact CZ3-CB 4.19Å; I153-L218 CarbonylContact O-C 3.46Å; I153-L218 VanDerWaalsContact O-CA 3.3Å; I153-L218 WeakPolarHBondContact O-CA 3.36Å; M154-L218 HydrophobicContact CB-CD2 3.95Å; M154-L218 HydrophobicContact CG-CD2 4.24Å; Y201-L218 PolarHBondContact N-O 3.5Å; Y201-L218 PolarHBondContact O-N 2.79Å; L218-W362 HydrophobicContact CB-CH2 4.4Å; L218-W362 HydrophobicContact CD1-CH2 4.37Å; L218-W362 HydrophobicContact CD1-CZ3 4.06Å; L218-W362 HydrophobicContact CD2-CZ3 4.42Å; L218-W362 HydrophobicContact CG-CH2 3.87Å; L218-W362 HydrophobicContact CG-CZ3 3.67Å; L218-I363 HydrophobicContact CD1-CG2 4.29Å; L218-I366 HydrophobicContact CB-CG2 4.49Å; L218-I366 HydrophobicContact CD1-CB 3.9Å; L218-I366 HydrophobicContact CD1-CG2 3.81Å; L218-A367 HydrophobicContact CD1-CB 4.41Å
219	V	98.7	Very high	87.7	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120	175.1	-179.4	0	0	0	0	108.5	L81 W152 I153 T155 F160 V178 V197 V200	L81-V219 HydrophobicContact CD2-CG2 4.34Å; W152-V219 WeakPolarHBondContact CA-O 3.29Å; I153-V219 HydrophobicContact CB-CB 4.21Å; I153-V219 PolarHBondContact N-O 3.43Å; I153-V219 PolarHBondContact O-N 3.25Å; T155-V219 HydrophobicContact CG2-CG2 4.08Å; F160-V219 HydrophobicContact CE1-CG2 4.42Å; F160-V219 HydrophobicContact CE2-CG2 4.37Å; F160-V219 HydrophobicContact CZ-CG2 3.62Å; V178-V219 HydrophobicContact CG2-CG1 4.08Å; V197-V219 HydrophobicContact CB-CG1 4.23Å; V197-V219 HydrophobicContact CG1-CG1 3.6Å; V197-V219 HydrophobicContact CG2-CG1 3.62Å; V200-V219 HydrophobicContact CG1-CG2 4.45Å; V200-V219 HydrophobicContact CG2-CG2 4.34Å
220	K	98.2	Very high	88.5	Confident	69 Å²	69	37.4 Å²	37.4	30%	0.3	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.4	172.9	-168.4	176.7	-173	170.2	0	109.3	Q151 W152 A198 H199 Y201	Q151-K220 HydrophobicContact CG-CG 4.41Å; Q151-K220 WeakPolarHBondContact O-CA 3.32Å; W152-K220 HydrophobicContact CD2-CB 4.32Å; W152-K220 HydrophobicContact CD2-CG 4.25Å; W152-K220 HydrophobicContact CE3-CB 3.84Å; W152-K220 HydrophobicContact CE3-CG 4.25Å; W152-K220 HydrophobicContact CH2-CB 3.97Å; W152-K220 HydrophobicContact CH2-CD 3.77Å; W152-K220 HydrophobicContact CH2-CG 4.04Å; W152-K220 HydrophobicContact CZ2-CB 4.39Å; W152-K220 HydrophobicContact CZ2-CD 3.68Å; W152-K220 HydrophobicContact CZ2-CG 3.98Å; W152-K220 HydrophobicContact CZ3-CB 3.67Å; W152-K220 HydrophobicContact CZ3-CD 4.36Å; W152-K220 HydrophobicContact CZ3-CG 4.18Å; A198-K220 WeakPolarHBondContact CB-O 3.34Å; A198-K220 PolarHBondContact N-O 2.73Å; H199-K220 HydrophobicContact CB-CB 4.46Å; H199-K220 PolarHBondContact N-O 2.87Å; H199-K220 PolarHBondContact O-N 3.32Å; Y201-K220 HydrophobicContact CE2-CB 4.31Å
221	L	98.4	Very high	89.6	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	152.6	173.4	-58.8	178.7	0	0	0	110.9	Q151 I153 V178 I180 M195 K223	Q151-L221 HydrophobicContact CG-CB 4Å; Q151-L221 WeakPolarHBondContact CG-O 3.43Å; Q151-L221 PolarHBondContact NE2-O 2.84Å; Q151-L221 PolarHBondContact O-N 3.12Å; I153-L221 HydrophobicContact CD1-CD1 4.05Å; I153-L221 HydrophobicContact CD1-CD2 3.6Å; I153-L221 HydrophobicContact CD1-CG 3.91Å; V178-L221 HydrophobicContact CB-CD2 4.03Å; V178-L221 HydrophobicContact CG2-CD2 3.9Å; I180-L221 HydrophobicContact CD1-CD1 3.83Å; M195-L221 HydrophobicContact CB-CD1 4.17Å; M195-L221 HydrophobicContact CB-CD2 3.79Å; M195-L221 HydrophobicContact CB-CG 4.49Å; M195-L221 HydrophobicContact CE-CD1 4.12Å; M195-L221 HydrophobicContact CG-CD1 4.28Å; L221-K223 VanDerWaalsContact C-N 3.26Å; L221-K223 WeakPolarHBondContact CB-O 3.32Å; L221-K223 PolarHBondContact O-N 2.96Å
222	T	97.9	Very high	90.9	Very high	75 Å²	75	32.3 Å²	32.3	46%	0.46	16%	0.161	S	C	.	.	S	Bend	trans	-63.5	-30.4	174.6	48.4	0	0	0	0	113.6	S196 A198	S196-T222 WeakPolarHBondContact O-CG2 3.35Å; S196-T222 PolarHBondContact O-N 2.84Å; S196-T222 PolarHBondContact O-OG1 3.02Å; A198-T222 HydrophobicContact CB-CG2 3.99Å
223	K	96	Very high	92.4	Very high	127 Å²	127	31.9 Å²	31.9	55%	0.552	16%	0.157	S	C	*	.	S	Bend	trans	-145.3	153.7	177.6	65.5	-173.8	179.6	-177.1	0	109.3	M195 L221	M195-K223 HydrophobicContact CE-CD 4.48Å; M195-K223 HydrophobicContact CE-CG 3.65Å; M195-K223 WeakPolarHBondContact CE-O 3.46Å; L221-K223 VanDerWaalsContact C-N 3.26Å; L221-K223 WeakPolarHBondContact CB-O 3.32Å; L221-K223 PolarHBondContact O-N 2.96Å
224	P	93.9	Very high	92.8	Very high	78 Å²	78	31.6 Å²	31.6	51%	0.506	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-62.3	138.2	173.8	26.1	-34.1	0	0	0	111	P150 Q151	P150-P224 HydrophobicContact CB-CB 3.88Å; P150-P224 CarbonylContact O-C 3.51Å; P150-P224 VanDerWaalsContact O-CA 3.27Å; P150-P224 WeakPolarHBondContact O-CA 3.37Å; Q151-P224 HydrophobicContact CB-CB 4.5Å
225	V	93.4	Very high	92.7	Very high	7 Å²	7	28.5 Å²	28.5	4%	0.042	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-73.5	146	168.7	74.1	0	0	0	0	109.7	L147 P150 I180 Y193 M195 L227 V231	L147-V225 HydrophobicContact CD1-CG1 4.09Å; L147-V225 HydrophobicContact CD2-CG1 3.66Å; P150-V225 WeakPolarHBondContact O-CG1 3.4Å; P150-V225 PolarHBondContact O-N 3.38Å; I180-V225 HydrophobicContact CB-CG2 4.42Å; I180-V225 HydrophobicContact CD1-CB 4.07Å; I180-V225 HydrophobicContact CD1-CG1 4.15Å; I180-V225 HydrophobicContact CD1-CG2 4.05Å; I180-V225 HydrophobicContact CG2-CG2 4.32Å; Y193-V225 HydrophobicContact CD2-CG2 3.59Å; Y193-V225 HydrophobicContact CE2-CG2 4.24Å; Y193-V225 HydrophobicContact CG-CG2 3.93Å; M195-V225 HydrophobicContact CE-CB 3.97Å; M195-V225 HydrophobicContact CE-CG2 4.41Å; M195-V225 HydrophobicContact CG-CG2 4.48Å; M195-V225 HydrophobicContact SD-CB 4.49Å; M195-V225 HydrophobicContact SD-CG2 4.31Å; V225-L227 HydrophobicContact CG1-CD2 4.47Å; V225-L227 PolarHBondContact O-N 2.98Å; V225-V231 HydrophobicContact CG1-CG1 4.07Å; V225-V231 HydrophobicContact CG2-CG1 4.24Å
226	K	89.3	Confident	92.7	Very high	125 Å²	125	29.4 Å²	29.4	54%	0.543	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-77.3	121.3	174.8	-173.9	-175.6	173.3	-164.7	0	109.1
227	L	86.9	Confident	92.6	Very high	14 Å²	14	29.5 Å²	29.5	7%	0.073	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-71.3	152.6	171	-54.9	-175.4	0	0	0	110.7	F34 L147 P150 V225 V231 I233	F34-L227 HydrophobicContact CB-CD1 4.39Å; F34-L227 HydrophobicContact CD2-CD1 3.37Å; F34-L227 HydrophobicContact CE2-CD1 3.71Å; F34-L227 HydrophobicContact CG-CD1 3.96Å; L147-L227 HydrophobicContact CD2-CD2 4.2Å; P150-L227 HydrophobicContact CG-CD1 4.33Å; P150-L227 HydrophobicContact CG-CD2 4.36Å; P150-L227 HydrophobicContact CG-CG 4.36Å; V225-L227 HydrophobicContact CG1-CD2 4.47Å; V225-L227 PolarHBondContact O-N 2.98Å; L227-V231 WeakPolarHBondContact CA-O 3.24Å; L227-V231 HydrophobicContact CD2-CG1 4.22Å; L227-I233 HydrophobicContact CD1-CD1 3.81Å; L227-I233 HydrophobicContact CD1-CG1 4.38Å; L227-I233 HydrophobicContact CD2-CD1 4.22Å; L227-I233 HydrophobicContact CD2-CG1 4.04Å
228	G	81.3	Confident	92.4	Very high	14 Å²	14	33.2 Å²	33.2	14%	0.144	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-175.4	-161.7	-178	0	0	0	0	0	112.6	Y230 V231	G228-Y230 PolarHBondContact O-N 3.3Å; G228-V231 PolarHBondContact N-O 3.47Å; G228-V231 PolarHBondContact O-N 3.45Å
229	R	78.5	Confident	92.3	Very high	35 Å²	35	36.3 Å²	36.3	13%	0.132	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-34.6	-174.4	-173.1	-177.8	-66.4	125.3	12.6	113.4	E30 F56 I60	E30-R229 IonicContact OE1-CZ 3.47Å; E30-R229 IonicContact OE1-NH1 3.57Å; E30-R229 IonicContact OE1-NH2 2.79Å; E30-R229 PolarHBondContact OE1-NH2 3.49Å; F56-R229 HydrophobicContact CD1-CB 3.87Å; F56-R229 HydrophobicContact CD1-CG 4.36Å; F56-R229 HydrophobicContact CE1-CB 4.07Å; F56-R229 HydrophobicContact CG-CB 4.23Å; F56-R229 HydrophobicContact CG-CG 4.21Å; I60-R229 HydrophobicContact CD1-CG 3.75Å; I60-R229 HydrophobicContact CG1-CG 3.44Å; I60-R229 VanDerWaalsContact CG1-CG 3.44Å
230	Y	84	Confident	92.1	Very high	41 Å²	41	38.6 Å²	38.6	16%	0.161	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-0.6	-175.7	-48.4	-62	0	0	0	113.1	I60 P76 M190 G228	I60-Y230 HydrophobicContact CG2-CE1 4.15Å; P76-Y230 WeakPolarHBondContact CA-O 3.23Å; P76-Y230 WeakPolarHBondContact CB-O 3.43Å; M190-Y230 HydrophobicContact CE-CE2 4.37Å; G228-Y230 PolarHBondContact O-N 3.3Å
231	V	88.6	Confident	92	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.03	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-131.7	111.3	-178.5	-179.7	0	0	0	0	108.8	P76 L147 I180 Y193 V225 L227 G228	P76-V231 CarbonylContact O-C 3.28Å; P76-V231 VanDerWaalsContact O-CA 3.32Å; P76-V231 WeakPolarHBondContact O-CA 3.07Å; L147-V231 HydrophobicContact CD2-CG1 3.88Å; I180-V231 HydrophobicContact CG2-CB 4.44Å; I180-V231 HydrophobicContact CG2-CG1 3.61Å; I180-V231 HydrophobicContact CG2-CG2 4.01Å; Y193-V231 HydrophobicContact CD2-CG2 4.09Å; Y193-V231 HydrophobicContact CE2-CG2 3.95Å; V225-V231 HydrophobicContact CG1-CG1 4.07Å; V225-V231 HydrophobicContact CG2-CG1 4.24Å; L227-V231 WeakPolarHBondContact CA-O 3.24Å; L227-V231 HydrophobicContact CD2-CG1 4.22Å; G228-V231 PolarHBondContact N-O 3.47Å; G228-V231 PolarHBondContact O-N 3.45Å
232	N	89.7	Confident	91.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.253	C	S	.	.			trans	-140.9	172.8	178.6	-163.5	16.2	0	0	0	109.9	H42 R45 W52 P76 W77	H42-N232 PolarHBondContact CD2-OD1 3.46Å; H42-N232 VanDerWaalsContact CD2-OD1 3.27Å; H42-N232 PolarHBondContact O-ND2 3.11Å; R45-N232 PolarHBondContact O-ND2 3Å; W52-N232 HydrophobicContact CH2-CB 4.18Å; W52-N232 VanDerWaalsContact CH2-CG 3.44Å; W52-N232 WeakPolarHBondContact CH2-OD1 3.44Å; W52-N232 HydrophobicContact CZ2-CB 3.69Å; W52-N232 WeakPolarHBondContact CZ2-ND2 3.36Å; P76-N232 CarbonylContact C-O 3.6Å; P76-N232 HydrophobicContact CB-CB 3.87Å; P76-N232 HydrophobicContact CG-CB 3.66Å; P76-N232 PolarHBondContact O-N 3.21Å; W77-N232 WeakPolarHBondContact CA-O 3.49Å; W77-N232 VanDerWaalsContact CB-O 3.29Å; W77-N232 WeakPolarHBondContact CB-O 3.48Å
233	I	92.4	Very high	91.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-98.8	142.6	-178.2	-66.8	159.3	0	0	0	110.3	F34 I39 C43 G44 L147 I148 P150 L227	F34-I233 HydrophobicContact CE2-CD1 3.59Å; F34-I233 HydrophobicContact CZ-CD1 3.81Å; I39-I233 HydrophobicContact CG2-CG2 4.5Å; C43-I233 CarbonylContact C-O 3.59Å; C43-I233 VanDerWaalsContact CA-O 3.26Å; C43-I233 WeakPolarHBondContact CA-O 3.09Å; C43-I233 HydrophobicContact CB-CG2 4.46Å; G44-I233 PolarHBondContact N-O 3.35Å; L147-I233 HydrophobicContact CD2-CG1 4.42Å; L147-I233 HydrophobicContact CG-CG1 4.41Å; L147-I233 WeakPolarHBondContact O-CA 3.49Å; I148-I233 VanDerWaalsContact C-CG2 3.41Å; I148-I233 VanDerWaalsContact O-CG2 3.28Å; I148-I233 WeakPolarHBondContact O-CG2 3.32Å; P150-I233 VanDerWaalsContact CD-CD1 3.49Å; P150-I233 HydrophobicContact CG-CD1 3.87Å; L227-I233 HydrophobicContact CD1-CD1 3.81Å; L227-I233 HydrophobicContact CD1-CG1 4.38Å; L227-I233 HydrophobicContact CD2-CD1 4.22Å; L227-I233 HydrophobicContact CD2-CG1 4.04Å
234	A	94.4	Very high	91.6	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.017	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-76.5	147.3	171	0	0	0	0	0	112	W77 T146 L147 V334	W77-A234 HydrophobicContact CB-CB 3.86Å; W77-A234 HydrophobicContact CD2-CB 4.04Å; W77-A234 HydrophobicContact CG-CB 3.64Å; T146-A234 HydrophobicContact CG2-CB 3.41Å; T146-A234 VanDerWaalsContact CG2-CB 3.41Å; L147-A234 PolarHBondContact O-N 2.8Å; A234-V334 HydrophobicContact CB-CG2 3.5Å; A234-V334 VanDerWaalsContact CB-CG2 3.5Å
235	C	94.4	Very high	91.7	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.027	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-77.7	137.7	166	-66	0	0	0	0	110.3	C43 G44 I333 V334	C43-C235 HydrophobicContact CB-CB 3.95Å; C43-C235 WeakPolarHBondContact CB-SG 3.27Å; C43-C235 PolarHBondContact O-SG 2.83Å; C43-C235 WeakPolarHBondContact SG-CA 3.42Å; C43-C235 WeakPolarHBondContact SG-CB 3.48Å; C43-C235 CovalentContact SG-SG 2.04Å; C43-C235 PolarHBondContact SG-SG 2.92Å; G44-C235 PolarHBondContact N-SG 3.13Å; C235-I333 HydrophobicContact CB-CD1 3.33Å; C235-V334 PolarHBondContact O-N 3.07Å
236	L	95.4	Very high	91.9	Very high	19 Å²	19	43.7 Å²	43.7	10%	0.099	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-88.9	148.6	167.4	-68.2	178.6	0	0	0	110.3	I148 M154 V356 I360 I363 F370	I148-L236 HydrophobicContact CB-CD1 4.44Å; I148-L236 HydrophobicContact CB-CD2 4.48Å; I148-L236 HydrophobicContact CB-CG 4.5Å; I148-L236 HydrophobicContact CD1-CD1 4.41Å; I148-L236 HydrophobicContact CG2-CD2 3.79Å; I148-L236 HydrophobicContact CG2-CG 4.29Å; M154-L236 HydrophobicContact CE-CD2 3.95Å; M154-L236 HydrophobicContact SD-CD2 4.12Å; L236-V356 HydrophobicContact CD2-CG1 3.99Å; L236-I360 HydrophobicContact CB-CD1 3.95Å; L236-I360 HydrophobicContact CD1-CD1 4.35Å; L236-I363 HydrophobicContact CD1-CG2 4.01Å; L236-F370 HydrophobicContact CD1-CD1 4.5Å; L236-F370 HydrophobicContact CD1-CE1 3.97Å; L236-F370 HydrophobicContact CD1-CE2 4.07Å; L236-F370 HydrophobicContact CD1-CZ 3.73Å
237	P	95.7	Very high	92.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.013	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-68.5	164.2	175	28.3	-34.5	0	0	0	111.5	E241 I333 V334 V356 I360	P237-E241 VanDerWaalsContact CA-OE2 3.25Å; P237-E241 WeakPolarHBondContact CA-OE2 3.41Å; P237-E241 HydrophobicContact CB-CB 4.09Å; P237-E241 VanDerWaalsContact CB-OE2 3.26Å; P237-E241 WeakPolarHBondContact CB-OE2 3.39Å; P237-I333 VanDerWaalsContact CA-CG2 3.49Å; P237-I333 HydrophobicContact CB-CG2 3.7Å; P237-I333 HydrophobicContact CG-CG2 4.35Å; P237-V334 VanDerWaalsContact CD-O 3.25Å; P237-V334 WeakPolarHBondContact CD-O 2.91Å; P237-V356 HydrophobicContact CG-CB 3.97Å; P237-V356 HydrophobicContact CG-CG1 3.74Å; P237-I360 HydrophobicContact CG-CD1 4.19Å; P237-I360 VanDerWaalsContact O-CD1 3.29Å; P237-I360 WeakPolarHBondContact O-CD1 3.25Å
238	S	94.6	Very high	92.8	Very high	78 Å²	78	45.1 Å²	45.1	55%	0.545	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-67.9	153.2	165	-61	0	0	0	0	110.3	G240 E241 S357	S238-G240 PolarHBondContact O-N 3.28Å; S238-E241 PolarHBondContact N-OE2 2.71Å; S238-E241 VanDerWaalsContact N-OE2 3.11Å; S238-E241 VanDerWaalsContact O-CB 3.24Å; S238-E241 WeakPolarHBondContact O-CB 3.19Å; S238-E241 PolarHBondContact O-N 2.68Å; S238-S357 WeakPolarHBondContact O-CB 3.5Å
239	A	95.7	Very high	93.6	Very high	65 Å²	65	44.4 Å²	44.4	54%	0.537	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	127	175.2	0	0	0	0	0	110	E241 S357 I360	A239-E241 VanDerWaalsContact C-N 3.25Å; A239-E241 PolarHBondContact O-N 3.34Å; A239-S357 WeakPolarHBondContact CA-O 3.48Å; A239-I360 HydrophobicContact CB-CB 4.07Å; A239-I360 HydrophobicContact CB-CG2 4.15Å
240	G	95.3	Very high	94.4	Very high	51 Å²	51	44 Å²	44	53%	0.526	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	14	-174.6	0	0	0	0	0	115.5	S238 E242 S357	S238-G240 PolarHBondContact O-N 3.28Å; G240-E242 PolarHBondContact O-N 3.46Å; G240-S357 PolarHBondContact N-O 3.03Å; G240-S357 VanDerWaalsContact N-O 3.11Å
241	E	95.6	Very high	95	Very high	46 Å²	46	42.2 Å²	42.2	22%	0.215	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-63.9	124.1	172.5	-171.6	163.2	-123	0	0	110.4	P237 S238 A239 I328 S357	P237-E241 VanDerWaalsContact CA-OE2 3.25Å; P237-E241 WeakPolarHBondContact CA-OE2 3.41Å; P237-E241 HydrophobicContact CB-CB 4.09Å; P237-E241 VanDerWaalsContact CB-OE2 3.26Å; P237-E241 WeakPolarHBondContact CB-OE2 3.39Å; S238-E241 PolarHBondContact N-OE2 2.71Å; S238-E241 VanDerWaalsContact N-OE2 3.11Å; S238-E241 VanDerWaalsContact O-CB 3.24Å; S238-E241 WeakPolarHBondContact O-CB 3.19Å; S238-E241 PolarHBondContact O-N 2.68Å; A239-E241 VanDerWaalsContact C-N 3.25Å; A239-E241 PolarHBondContact O-N 3.34Å; E241-I328 HydrophobicContact CG-CD1 4.07Å; E241-I328 WeakPolarHBondContact OE2-CD1 3.45Å; E241-S357 VanDerWaalsContact O-CB 3.32Å; E241-S357 WeakPolarHBondContact O-CB 3.21Å; E241-S357 PolarHBondContact O-OG 2.78Å
242	E	93.6	Very high	95.3	Very high	149 Å²	149	42 Å²	42	70%	0.696	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-98.3	143.5	178.9	-67.2	-175.7	175.9	0	0	111.1	G240	G240-E242 PolarHBondContact O-N 3.46Å
243	I	95.7	Very high	95.5	Very high	14 Å²	14	42.3 Å²	42.3	7%	0.072	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-102.1	133.4	171.4	-46.3	-58	0	0	0	108.2	Q247 I275 C326 I328 S335	I243-Q247 HydrophobicContact CG2-CB 4Å; I243-Q247 HydrophobicContact CG2-CG 4.09Å; I243-I275 HydrophobicContact CB-CD1 4.5Å; I243-I275 HydrophobicContact CB-CG1 4.13Å; I243-I275 HydrophobicContact CG2-CD1 4.28Å; I243-I275 HydrophobicContact CG2-CG1 3.63Å; I243-C326 HydrophobicContact CD1-CB 4.12Å; I243-C326 HydrophobicContact CG1-CB 4.45Å; I243-C326 HydrophobicContact CG2-CB 4.17Å; I243-I328 HydrophobicContact CD1-CD1 3.57Å; I243-I328 HydrophobicContact CD1-CG1 4.3Å; I243-S335 VanDerWaalsContact CD1-OG 3.26Å; I243-S335 WeakPolarHBondContact CD1-OG 3.26Å
244	Q	95.1	Very high	95.5	Very high	122 Å²	122	42.3 Å²	42.3	57%	0.57	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-67.8	137.2	-176	-65.2	-61.7	-41.1	0	0	110.9	Q247	Q244-Q247 WeakPolarHBondContact O-CB 3.49Å; Q244-Q247 PolarHBondContact O-N 3.34Å; Q244-Q247 VanDerWaalsContact O-N 3.07Å
245	P	96.8	Very high	95.4	Very high	78 Å²	78	42.4 Å²	42.4	51%	0.506	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	140.8	169.1	-30.3	37.7	0	0	0	112.9	Q247 P277	P245-Q247 PolarHBondContact O-N 3.1Å; P245-P277 HydrophobicContact CB-CG 3.81Å; P245-P277 HydrophobicContact CG-CG 4.03Å
246	G	97.5	Very high	95.2	Very high	54 Å²	54	42.9 Å²	42.9	56%	0.557	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	-8.5	-176.7	0	0	0	0	0	114.7	E248 I275	G246-E248 PolarHBondContact O-N 2.89Å; G246-I275 PolarHBondContact N-O 2.8Å
247	Q	97.4	Very high	94.8	Very high	55 Å²	55	47.3 Å²	47.3	26%	0.257	28%	0.28	S	S	.	.			trans	-63.7	127.4	172.7	-178.7	170.7	-26.8	0	0	109.8	I243 Q244 P245 P274 I275 Q327	I243-Q247 HydrophobicContact CG2-CB 4Å; I243-Q247 HydrophobicContact CG2-CG 4.09Å; Q244-Q247 WeakPolarHBondContact O-CB 3.49Å; Q244-Q247 PolarHBondContact O-N 3.34Å; Q244-Q247 VanDerWaalsContact O-N 3.07Å; P245-Q247 PolarHBondContact O-N 3.1Å; Q247-P274 CarbonylContact O-C 3.51Å; Q247-P274 WeakPolarHBondContact O-CA 3.07Å; Q247-I275 WeakPolarHBondContact O-CG1 3.08Å; Q247-I275 PolarHBondContact O-N 3.45Å; Q247-Q327 PolarHBondContact NE2-O 3.3Å
248	E	97.2	Very high	94.3	Very high	113 Å²	113	53.2 Å²	53.2	53%	0.528	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	126.3	176.4	-166.1	168.5	174.4	0	0	110.5	G246 G272	G246-E248 PolarHBondContact O-N 2.89Å; E248-G272 WeakPolarHBondContact OE1-CA 3.12Å
249	C	97.9	Very high	93.8	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	160.6	175.4	-58.7	0	0	0	0	109.4	G272 V273 L324 M325 C326	C249-G272 WeakPolarHBondContact O-CA 3.07Å; C249-V273 PolarHBondContact N-O 3.32Å; C249-V273 PolarHBondContact O-N 3.15Å; C249-L324 HydrophobicContact CB-CD1 3.78Å; C249-L324 HydrophobicContact CB-CD2 4.48Å; C249-L324 HydrophobicContact CB-CG 3.99Å; C249-M325 CarbonylContact C-O 3.51Å; C249-M325 WeakPolarHBondContact CA-O 3.02Å; C249-M325 WeakPolarHBondContact CB-O 3.35Å; C249-C326 HydrophobicContact CB-CB 4.11Å; C249-C326 WeakPolarHBondContact CB-SG 3.49Å; C249-C326 WeakPolarHBondContact SG-CB 3.27Å; C249-C326 CovalentContact SG-SG 2.03Å; C249-C326 PolarHBondContact SG-SG 3.44Å
250	I	96.2	Very high	93	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.138	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120	-175.1	-52.1	-57.9	0	0	0	109.7	W75 V252 H270 V271 M325 W332	W75-I250 HydrophobicContact CH2-CB 4.16Å; W75-I250 HydrophobicContact CH2-CG1 4.24Å; W75-I250 HydrophobicContact CH2-CG2 4.08Å; W75-I250 HydrophobicContact CZ2-CB 4.18Å; W75-I250 HydrophobicContact CZ2-CG1 4.41Å; W75-I250 HydrophobicContact CZ2-CG2 3.59Å; I250-V252 HydrophobicContact CG2-CG2 3.73Å; I250-H270 HydrophobicContact CG2-CB 3.68Å; I250-V271 WeakPolarHBondContact CA-O 3.18Å; I250-M325 HydrophobicContact CB-CE 4.45Å; I250-M325 PolarHBondContact N-O 3.26Å; I250-M325 PolarHBondContact O-N 2.94Å; I250-W332 HydrophobicContact CB-CZ3 4.3Å; I250-W332 HydrophobicContact CG1-CH2 3.55Å; I250-W332 HydrophobicContact CG1-CZ3 3.61Å
251	S	96.1	Very high	92.3	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	143	168.3	-171.4	0	0	0	0	109.8	H270 V271 I338	S251-H270 CarbonylContact O-C 3.43Å; S251-H270 WeakPolarHBondContact O-CA 3.36Å; S251-V271 PolarHBondContact N-O 3.14Å; S251-V271 PolarHBondContact O-N 3.46Å; S251-I338 WeakPolarHBondContact OG-CD1 3.42Å
252	V	94	Very high	91.5	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	133.6	-167.5	-178.1	0	0	0	0	111.8	W75 L78 I250 L268 K269 H270 M325	W75-V252 HydrophobicContact CB-CG1 4.16Å; W75-V252 HydrophobicContact CD2-CG2 3.95Å; W75-V252 HydrophobicContact CG-CB 4.49Å; W75-V252 HydrophobicContact CG-CG1 3.78Å; W75-V252 HydrophobicContact CG-CG2 4Å; W75-V252 HydrophobicContact CZ2-CG2 4.27Å; L78-V252 HydrophobicContact CD1-CG1 4.4Å; L78-V252 HydrophobicContact CD2-CG1 3.65Å; I250-V252 HydrophobicContact CG2-CG2 3.73Å; V252-L268 HydrophobicContact CG1-CD1 3.7Å; V252-L268 HydrophobicContact CG1-CD2 4.27Å; V252-L268 HydrophobicContact CG1-CG 4.18Å; V252-K269 WeakPolarHBondContact CA-O 3.32Å; V252-K269 WeakPolarHBondContact CG1-O 3.47Å; V252-H270 HydrophobicContact CB-CB 4.5Å; V252-H270 HydrophobicContact CG2-CB 3.72Å; V252-M325 HydrophobicContact CB-CE 4.21Å; V252-M325 HydrophobicContact CG2-CE 3.28Å; V252-M325 HydrophobicContact CG2-SD 4.23Å
253	G	94.7	Very high	91	Very high	5 Å²	5	50.7 Å²	50.7	5%	0.052	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-169.9	173.5	0	0	0	0	0	114.7	L268 K269 D319	G253-L268 WeakPolarHBondContact O-CD1 3.35Å; G253-K269 PolarHBondContact N-O 3.26Å; G253-K269 VanDerWaalsContact N-O 3.13Å; G253-K269 PolarHBondContact O-N 2.78Å; G253-D319 WeakPolarHBondContact CA-OD1 3.11Å
254	W	92.5	Very high	90.6	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	28%	0.281	C	S	.	.	S	Bend	trans	-110.5	8.1	-177.6	-69.1	-86.9	0	0	0	112.5	L78 H141 E182 M185 I264 S265 L268 D319	L78-W254 HydrophobicContact CB-CH2 4.47Å; L78-W254 HydrophobicContact CD1-CZ3 4.43Å; L78-W254 HydrophobicContact CD2-CE3 4.04Å; L78-W254 HydrophobicContact CD2-CH2 3.33Å; L78-W254 HydrophobicContact CD2-CZ2 3.99Å; L78-W254 HydrophobicContact CD2-CZ3 3.36Å; L78-W254 HydrophobicContact CG-CH2 3.69Å; L78-W254 HydrophobicContact CG-CZ3 3.6Å; H141-W254 AromaticContact CE1-CE3 3.92Å; E182-W254 HydrophobicContact CB-CH2 4.34Å; E182-W254 HydrophobicContact CB-CZ2 3.98Å; E182-W254 HydrophobicContact CG-CZ2 3.87Å; M185-W254 HydrophobicContact CE-CB 3.74Å; M185-W254 HydrophobicContact CE-CD2 3.39Å; M185-W254 HydrophobicContact CE-CE3 3.86Å; M185-W254 HydrophobicContact CE-CG 3.32Å; M185-W254 HydrophobicContact SD-CG 4.38Å; W254-I264 VanDerWaalsContact O-CB 3.28Å; W254-I264 WeakPolarHBondContact O-CB 3.12Å; W254-S265 WeakPolarHBondContact CB-O 3.49Å; W254-S265 PolarHBondContact O-N 3.26Å; W254-L268 HydrophobicContact CD2-CD1 3.93Å; W254-L268 HydrophobicContact CE3-CD1 4.3Å; W254-L268 HydrophobicContact CG-CD1 4.45Å; W254-L268 HydrophobicContact CH2-CD1 4.29Å; W254-L268 HydrophobicContact CZ2-CB 4.23Å; W254-L268 HydrophobicContact CZ2-CD1 3.9Å; W254-L268 HydrophobicContact CZ2-CD2 4.43Å; W254-L268 HydrophobicContact CZ2-CG 4.42Å; W254-L268 HydrophobicContact CZ3-CD1 4.48Å; W254-D319 PolarHBondContact N-OD1 2.84Å; W254-D319 VanDerWaalsContact N-OD1 3.07Å
255	G	92.3	Very high	90.2	Very high	4 Å²	4	45 Å²	45	4%	0.041	26%	0.257	C	S	.	.	S	Bend	trans	-63.7	-170.7	-173.5	0	0	0	0	0	114.7	E257 S265 Q317 D319	G255-E257 PolarHBondContact O-N 3.17Å; G255-S265 PolarHBondContact O-N 3.36Å; G255-Q317 CarbonylContact C-O 3.6Å; G255-Q317 WeakPolarHBondContact CA-O 3.35Å; G255-D319 WeakPolarHBondContact CA-OD1 3.49Å; G255-D319 PolarHBondContact N-OD1 3.37Å
256	H	90.3	Very high	89.7	Confident	14 Å²	14	43 Å²	43	7%	0.065	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-59.3	131.2	177	-72.1	170.5	0	0	0	111.4	I258 A261 N263 C316 Q317 F318	H256-I258 VanDerWaalsContact C-N 3.28Å; H256-I258 WeakPolarHBondContact CB-O 3.33Å; H256-A261 HydrophobicContact CB-CB 4.13Å; H256-A261 PolarHBondContact CE1-O 2.92Å; H256-A261 PolarHBondContact ND1-O 3.44Å; H256-A261 PolarHBondContact NE2-O 2.89Å; H256-A261 VanDerWaalsContact NE2-O 3.14Å; H256-N263 PolarHBondContact CD2-O 2.78Å; H256-C316 HydrophobicContact CB-CB 4.05Å; H256-C316 WeakPolarHBondContact O-CB 3.39Å; H256-Q317 PolarHBondContact N-O 3.48Å; H256-Q317 PolarHBondContact ND1-OE1 3.05Å; H256-Q317 VanDerWaalsContact ND1-OE1 3.16Å; H256-F318 AromaticContact CD2-CD2 3.91Å; H256-F318 AromaticContact CE1-CE2 3.69Å; H256-F318 AromaticContact NE2-CD2 3.59Å; H256-F318 AromaticContact NE2-CE2 3.35Å; H256-F318 WeakPolarHBondContact NE2-CE2 3.35Å
257	E	86.5	Confident	89.2	Confident	112 Å²	112	42.7 Å²	42.7	52%	0.523	23%	0.228	S	C	.	.	S	Bend	trans	-78.7	-18.5	175.3	-57.5	-171.9	-164	0	0	112.6	G255 S265 K269	G255-E257 PolarHBondContact O-N 3.17Å; E257-S265 WeakPolarHBondContact OE1-CB 3.49Å; E257-S265 PolarHBondContact OE1-OG 2.98Å; E257-K269 HydrophobicContact CG-CD 4.15Å; E257-K269 WeakPolarHBondContact OE1-CE 3.42Å; E257-K269 IonicContact OE1-NZ 2.58Å; E257-K269 PolarHBondContact OE1-NZ 2.57Å; E257-K269 IonicContact OE2-NZ 2.83Å; E257-K269 PolarHBondContact OE2-NZ 2.85Å
258	I	85.6	Confident	88.8	Confident	126 Å²	126	40.7 Å²	40.7	65%	0.646	22%	0.219	S	C	*	.	S	Bend	trans	-139.4	137.8	-177.8	-54.3	173.9	0	0	0	106.7	H256 G260 A261	H256-I258 VanDerWaalsContact C-N 3.28Å; H256-I258 WeakPolarHBondContact CB-O 3.33Å; I258-G260 PolarHBondContact O-N 3.2Å; I258-A261 HydrophobicContact CB-CB 4.38Å; I258-A261 WeakPolarHBondContact O-CB 3.37Å; I258-A261 PolarHBondContact O-N 3.06Å
259	D	83.3	Confident	88.5	Confident	53 Å²	53	38.3 Å²	38.3	28%	0.283	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	136	174.9	-158.6	7.2	0	0	0	111.3	A261 G343 C344 K346	D259-A261 PolarHBondContact O-N 3.35Å; D259-G343 VanDerWaalsContact OD2-CA 3.27Å; D259-G343 WeakPolarHBondContact OD2-CA 3.43Å; D259-C344 HydrophobicContact CB-CB 3.88Å; D259-C344 VanDerWaalsContact CG-N 3.29Å; D259-C344 PolarHBondContact OD2-N 3.09Å; D259-K346 VanDerWaalsContact OD2-CE 3.3Å; D259-K346 WeakPolarHBondContact OD2-CE 3.47Å; D259-K346 IonicContact OD2-NZ 3.94Å
260	G	79.5	Confident	88.3	Confident	39 Å²	39	41.5 Å²	41.5	40%	0.402	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	15.2	-176.4	0	0	0	0	0	115.1	I258	I258-G260 PolarHBondContact O-N 3.2Å
261	A	81.5	Confident	88.2	Confident	26 Å²	26	41.7 Å²	41.7	22%	0.215	22%	0.224	C	C	.	.			trans	-61.5	151.7	174.1	0	0	0	0	0	111.3	H256 I258 D259	H256-A261 HydrophobicContact CB-CB 4.13Å; H256-A261 PolarHBondContact CE1-O 2.92Å; H256-A261 PolarHBondContact ND1-O 3.44Å; H256-A261 PolarHBondContact NE2-O 2.89Å; H256-A261 VanDerWaalsContact NE2-O 3.14Å; I258-A261 HydrophobicContact CB-CB 4.38Å; I258-A261 WeakPolarHBondContact O-CB 3.37Å; I258-A261 PolarHBondContact O-N 3.06Å; D259-A261 PolarHBondContact O-N 3.35Å
262	K	77.3	Confident	88.1	Confident	121 Å²	121	42 Å²	42	53%	0.526	23%	0.228	S	C	.	.	S	Bend	trans	-82.1	-22.7	176.3	-62.3	-169.1	154.2	-168.1	0	113.2	I125	I125-K262 HydrophobicContact CD1-CB 3.58Å; I125-K262 HydrophobicContact CD1-CD 3.26Å; I125-K262 HydrophobicContact CD1-CG 3.47Å; I125-K262 VanDerWaalsContact CD1-CG 3.47Å; I125-K262 WeakPolarHBondContact CG2-O 3.47Å
263	N	82.9	Confident	88.3	Confident	97 Å²	97	42 Å²	42	52%	0.519	23%	0.228	S	C	.	.	S	Bend	trans	-126.1	138	-168.6	-63.5	-34.9	0	0	0	109.9	S128 H256	S128-N263 VanDerWaalsContact CB-OD1 3.29Å; S128-N263 WeakPolarHBondContact CB-OD1 3.26Å; H256-N263 PolarHBondContact CD2-O 2.78Å
264	I	87.8	Confident	88.5	Confident	9 Å²	9	43 Å²	43	5%	0.046	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-76.6	161.7	167.4	63.7	160.1	0	0	0	110.8	P127 S128 H141 M185 W254 F318	P127-I264 HydrophobicContact CB-CB 4.37Å; P127-I264 HydrophobicContact CB-CD1 3.76Å; P127-I264 HydrophobicContact CB-CG1 3.82Å; P127-I264 HydrophobicContact CB-CG2 3.69Å; S128-I264 PolarHBondContact OG-O 3.48Å; H141-I264 HydrophobicContact CB-CD1 4.27Å; M185-I264 HydrophobicContact SD-CD1 4.47Å; W254-I264 VanDerWaalsContact O-CB 3.28Å; W254-I264 WeakPolarHBondContact O-CB 3.12Å; I264-F318 HydrophobicContact CG2-CB 3.88Å; I264-F318 HydrophobicContact CG2-CD2 3.29Å; I264-F318 HydrophobicContact CG2-CE2 3.9Å; I264-F318 HydrophobicContact CG2-CG 3.66Å
265	S	87.9	Confident	88.8	Confident	8 Å²	8	43.6 Å²	43.6	6%	0.056	24%	0.236	C	C	.	.			trans	-75	127.2	170.5	-152.3	0	0	0	0	110.3	W254 G255 E257 I267 K269	W254-S265 WeakPolarHBondContact CB-O 3.49Å; W254-S265 PolarHBondContact O-N 3.26Å; G255-S265 PolarHBondContact O-N 3.36Å; E257-S265 WeakPolarHBondContact OE1-CB 3.49Å; E257-S265 PolarHBondContact OE1-OG 2.98Å; S265-I267 VanDerWaalsContact C-N 3.25Å; S265-I267 PolarHBondContact OG-O 3.11Å; S265-I267 VanDerWaalsContact OG-O 3.1Å; S265-K269 WeakPolarHBondContact OG-CE 3.48Å
266	T	86.2	Confident	89.1	Confident	34 Å²	34	44.3 Å²	44.3	21%	0.209	24%	0.24	C	C	.	.	S	Bend	trans	-77.5	-18.1	174.6	54.1	0	0	0	0	112.3	D184 M185 L186	D184-T266 CarbonylContact C-O 3.52Å; D184-T266 WeakPolarHBondContact CA-O 3.49Å; M185-T266 PolarHBondContact N-O 3.27Å; L186-T266 HydrophobicContact CD1-CG2 3.83Å; L186-T266 HydrophobicContact CD2-CG2 4.47Å; L186-T266 HydrophobicContact CG-CG2 3.85Å
267	I	87	Confident	89.4	Confident	49 Å²	49	46 Å²	46	25%	0.251	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-110.6	135.7	179.9	-53.6	175.2	0	0	0	108.6	V65 H183 D184 S265 K269	V65-I267 HydrophobicContact CB-CG2 4.13Å; V65-I267 HydrophobicContact CG1-CB 4.16Å; V65-I267 HydrophobicContact CG1-CG2 3.5Å; V65-I267 VanDerWaalsContact CG1-CG2 3.5Å; V65-I267 HydrophobicContact CG2-CG2 3.49Å; V65-I267 VanDerWaalsContact CG2-CG2 3.49Å; H183-I267 CarbonylContact O-C 3.6Å; H183-I267 WeakPolarHBondContact O-CA 3.41Å; D184-I267 HydrophobicContact CB-CG1 4.43Å; S265-I267 VanDerWaalsContact C-N 3.25Å; S265-I267 PolarHBondContact OG-O 3.11Å; S265-I267 VanDerWaalsContact OG-O 3.1Å; I267-K269 PolarHBondContact O-N 3.47Å
268	L	89.3	Confident	89.8	Confident	13 Å²	13	42.5 Å²	42.5	7%	0.068	24%	0.237	C	C	.	.			trans	-58.7	128.7	-178.1	-179.3	58.7	0	0	0	112.3	W75 L78 H183 V252 G253 W254	W75-L268 HydrophobicContact CB-CD2 4.33Å; L78-L268 HydrophobicContact CD2-CD1 3.1Å; L78-L268 HydrophobicContact CD2-CD2 3.68Å; L78-L268 HydrophobicContact CD2-CG 4.01Å; H183-L268 PolarHBondContact O-N 3.07Å; V252-L268 HydrophobicContact CG1-CD1 3.7Å; V252-L268 HydrophobicContact CG1-CD2 4.27Å; V252-L268 HydrophobicContact CG1-CG 4.18Å; G253-L268 WeakPolarHBondContact O-CD1 3.35Å; W254-L268 HydrophobicContact CD2-CD1 3.93Å; W254-L268 HydrophobicContact CE3-CD1 4.3Å; W254-L268 HydrophobicContact CG-CD1 4.45Å; W254-L268 HydrophobicContact CH2-CD1 4.29Å; W254-L268 HydrophobicContact CZ2-CB 4.23Å; W254-L268 HydrophobicContact CZ2-CD1 3.9Å; W254-L268 HydrophobicContact CZ2-CD2 4.43Å; W254-L268 HydrophobicContact CZ2-CG 4.42Å; W254-L268 HydrophobicContact CZ3-CD1 4.48Å
269	K	90.9	Very high	90.4	Very high	62 Å²	62	41.7 Å²	41.7	27%	0.27	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	165.1	176.1	-62.5	-158.6	175	-165	0	112.5	V65 V252 G253 E257 S265 I267	V65-K269 HydrophobicContact CG1-CG 4.21Å; V252-K269 WeakPolarHBondContact CA-O 3.32Å; V252-K269 WeakPolarHBondContact CG1-O 3.47Å; G253-K269 PolarHBondContact N-O 3.26Å; G253-K269 VanDerWaalsContact N-O 3.13Å; G253-K269 PolarHBondContact O-N 2.78Å; E257-K269 HydrophobicContact CG-CD 4.15Å; E257-K269 WeakPolarHBondContact OE1-CE 3.42Å; E257-K269 IonicContact OE1-NZ 2.58Å; E257-K269 PolarHBondContact OE1-NZ 2.57Å; E257-K269 IonicContact OE2-NZ 2.83Å; E257-K269 PolarHBondContact OE2-NZ 2.85Å; S265-K269 WeakPolarHBondContact OG-CE 3.48Å; I267-K269 PolarHBondContact O-N 3.47Å
270	H	93.1	Very high	91.1	Very high	67 Å²	67	43 Å²	43	31%	0.31	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	158.9	174.6	67.2	178.9	0	0	0	111.2	E74 W75 I250 S251 V252	E74-H270 IonicContact OE1-CE1 2.92Å; E74-H270 PolarHBondContact OE1-CE1 2.98Å; E74-H270 IonicContact OE1-ND1 2.86Å; E74-H270 PolarHBondContact OE1-ND1 2.75Å; E74-H270 IonicContact OE2-CE1 3.78Å; W75-H270 AromaticContact CE2-ND1 3.65Å; W75-H270 AromaticContact CZ2-ND1 3.47Å; W75-H270 WeakPolarHBondContact CZ2-ND1 3.35Å; W75-H270 AromaticContact NE1-CG 3.78Å; W75-H270 AromaticContact NE1-ND1 3.25Å; W75-H270 PolarHBondContact NE1-ND1 2.92Å; I250-H270 HydrophobicContact CG2-CB 3.68Å; S251-H270 CarbonylContact O-C 3.43Å; S251-H270 WeakPolarHBondContact O-CA 3.36Å; V252-H270 HydrophobicContact CB-CB 4.5Å; V252-H270 HydrophobicContact CG2-CB 3.72Å
271	V	93.3	Very high	91.9	Very high	32 Å²	32	41.1 Å²	41.1	19%	0.194	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	139.3	176	66.8	0	0	0	0	111	I250 S251 V273 R313	I250-V271 WeakPolarHBondContact CA-O 3.18Å; S251-V271 PolarHBondContact N-O 3.14Å; S251-V271 PolarHBondContact O-N 3.46Å; V271-V273 HydrophobicContact CG1-CG1 4.25Å; V271-R313 HydrophobicContact CG2-CB 3.56Å; V271-R313 HydrophobicContact CG2-CG 3.74Å
272	G	95.4	Very high	92.5	Very high	10 Å²	10	42.8 Å²	42.8	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	121.8	172.8	0	0	0	0	0	111.5	E248 C249 H308	E248-G272 WeakPolarHBondContact OE1-CA 3.12Å; C249-G272 WeakPolarHBondContact O-CA 3.07Å; G272-H308 PolarHBondContact O-NE2 3.5Å
273	V	97.4	Very high	93.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.5	179.8	-70.7	0	0	0	0	110.2	C249 V271 A306 R313 L324	C249-V273 PolarHBondContact N-O 3.32Å; C249-V273 PolarHBondContact O-N 3.15Å; V271-V273 HydrophobicContact CG1-CG1 4.25Å; V273-A306 HydrophobicContact CB-CB 4.15Å; V273-A306 HydrophobicContact CG2-CB 3.76Å; V273-R313 HydrophobicContact CG1-CB 4.45Å; V273-L324 HydrophobicContact CG2-CD1 3.72Å
274	P	98.3	Very high	94	Very high	25 Å²	25	39 Å²	39	16%	0.162	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	145.8	178.2	31.4	-34.6	0	0	0	111.1	Q247 V276 A306 G307 H308	Q247-P274 CarbonylContact O-C 3.51Å; Q247-P274 WeakPolarHBondContact O-CA 3.07Å; P274-V276 PolarHBondContact O-N 2.86Å; P274-A306 CarbonylContact O-C 3.57Å; P274-A306 WeakPolarHBondContact O-CA 3.1Å; P274-G307 PolarHBondContact O-N 2.83Å; P274-H308 WeakPolarHBondContact CD-NE2 3.43Å
275	I	98.6	Very high	94.2	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.072	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	128.9	172.2	-61.3	-60.4	0	0	0	110.3	I243 G246 Q247 I304 A306 L324	I243-I275 HydrophobicContact CB-CD1 4.5Å; I243-I275 HydrophobicContact CB-CG1 4.13Å; I243-I275 HydrophobicContact CG2-CD1 4.28Å; I243-I275 HydrophobicContact CG2-CG1 3.63Å; G246-I275 PolarHBondContact N-O 2.8Å; Q247-I275 WeakPolarHBondContact O-CG1 3.08Å; Q247-I275 PolarHBondContact O-N 3.45Å; I275-I304 HydrophobicContact CD1-CG2 3.6Å; I275-A306 HydrophobicContact CD1-CB 4.26Å; I275-L324 HydrophobicContact CD1-CD2 4.22Å
276	V	98.2	Very high	94.5	Very high	20 Å²	20	39.9 Å²	39.9	12%	0.121	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130.9	174.9	-179	0	0	0	0	108.9	P274 N278 Q280 C281 C305 G307 P350	P274-V276 PolarHBondContact O-N 2.86Å; V276-N278 PolarHBondContact O-N 3.03Å; V276-Q280 HydrophobicContact CG1-CB 4.08Å; V276-Q280 HydrophobicContact CG1-CG 4.13Å; V276-C281 HydrophobicContact CG1-CB 4.44Å; V276-C305 HydrophobicContact CB-CB 4.06Å; V276-C305 PolarHBondContact N-O 2.58Å; V276-G307 VanDerWaalsContact CG2-O 3.31Å; V276-G307 WeakPolarHBondContact CG2-O 2.94Å; V276-P350 HydrophobicContact CB-CB 4.46Å; V276-P350 HydrophobicContact CB-CG 4.28Å; V276-P350 HydrophobicContact CG1-CG 4.29Å; V276-P350 HydrophobicContact CG2-CB 3.92Å; V276-P350 HydrophobicContact CG2-CG 4.15Å
277	P	97.6	Very high	94.8	Very high	50 Å²	50	42 Å²	42	33%	0.325	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-51	136.1	171.7	-28.3	35.8	0	0	0	112.8	P245 D279 Q280 C281	P245-P277 HydrophobicContact CB-CG 3.81Å; P245-P277 HydrophobicContact CG-CG 4.03Å; P277-D279 WeakPolarHBondContact CB-OD1 3.33Å; P277-D279 PolarHBondContact O-N 2.69Å; P277-Q280 HydrophobicContact CB-CB 4.22Å; P277-Q280 PolarHBondContact O-N 2.72Å; P277-Q280 VanDerWaalsContact O-N 3.15Å; P277-C281 PolarHBondContact O-N 3.07Å
278	N	95.9	Very high	94.9	Very high	37 Å²	37	40.2 Å²	40.2	20%	0.198	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-31	-178.1	-80.3	49.1	0	0	0	112.7	V276 C281 T282 I299 E300 V303 R355	V276-N278 PolarHBondContact O-N 3.03Å; N278-C281 PolarHBondContact O-N 3.1Å; N278-T282 WeakPolarHBondContact O-CB 3.05Å; N278-T282 PolarHBondContact O-N 2.88Å; N278-T282 PolarHBondContact O-OG1 2.85Å; N278-I299 HydrophobicContact CB-CG2 4.5Å; N278-E300 PolarHBondContact ND2-O 3.44Å; N278-E300 VanDerWaalsContact ND2-O 3.11Å; N278-V303 PolarHBondContact ND2-O 3.35Å; N278-V303 PolarHBondContact OD1-O 2.9Å; N278-R355 PolarHBondContact OD1-NH2 2.9Å; N278-R355 VanDerWaalsContact OD1-NH2 3.1Å
279	D	96.9	Very high	94.9	Very high	109 Å²	109	44.8 Å²	44.8	58%	0.583	24%	0.239	S	C	*	.	H	α-helix	trans	-65.5	-45.4	174.2	60.8	-23	0	0	0	111.6	P277 C281 T282 M283	P277-D279 WeakPolarHBondContact CB-OD1 3.33Å; P277-D279 PolarHBondContact O-N 2.69Å; D279-C281 VanDerWaalsContact C-N 3.35Å; D279-T282 WeakPolarHBondContact O-CB 3.47Å; D279-T282 PolarHBondContact O-N 2.93Å; D279-M283 WeakPolarHBondContact O-CG 3.18Å; D279-M283 PolarHBondContact O-N 3.14Å
280	Q	97.3	Very high	94.6	Very high	81 Å²	81	48.9 Å²	48.9	38%	0.379	26%	0.264	S	S	.	.	H	α-helix	trans	-62.4	-43.5	172.9	-174.6	62.5	59.6	0	0	111.4	V276 P277 T282 M283 N284	V276-Q280 HydrophobicContact CG1-CB 4.08Å; V276-Q280 HydrophobicContact CG1-CG 4.13Å; P277-Q280 HydrophobicContact CB-CB 4.22Å; P277-Q280 PolarHBondContact O-N 2.72Å; P277-Q280 VanDerWaalsContact O-N 3.15Å; Q280-T282 VanDerWaalsContact C-N 3.33Å; Q280-T282 PolarHBondContact O-N 2.93Å; Q280-M283 HydrophobicContact CB-CE 4.43Å; Q280-M283 PolarHBondContact O-N 2.87Å; Q280-N284 PolarHBondContact NE2-OD1 3.32Å; Q280-N284 PolarHBondContact O-N 3.04Å; Q280-N284 PolarHBondContact O-OD1 3.2Å
281	C	96.2	Very high	93.9	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-43.8	176	-167.7	0	0	0	0	111.5	V276 P277 N278 D279 M283 N284 Y285 I299 C305	V276-C281 HydrophobicContact CG1-CB 4.44Å; P277-C281 PolarHBondContact O-N 3.07Å; N278-C281 PolarHBondContact O-N 3.1Å; D279-C281 VanDerWaalsContact C-N 3.35Å; C281-M283 PolarHBondContact O-N 2.99Å; C281-N284 PolarHBondContact O-N 3.1Å; C281-Y285 WeakPolarHBondContact O-CD2 3.02Å; C281-Y285 PolarHBondContact O-N 3.25Å; C281-I299 HydrophobicContact CB-CG2 4.23Å; C281-C305 HydrophobicContact CB-CB 3.55Å; C281-C305 WeakPolarHBondContact CB-SG 3.39Å; C281-C305 WeakPolarHBondContact SG-CB 3.29Å; C281-C305 CovalentContact SG-SG 2.03Å; C281-C305 PolarHBondContact SG-SG 3.41Å
282	T	95.3	Very high	93.3	Very high	61 Å²	61	51.2 Å²	51.2	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-58.6	-47	175	-58.5	0	0	0	0	111.2	N278 D279 Q280 N284 A286	N278-T282 WeakPolarHBondContact O-CB 3.05Å; N278-T282 PolarHBondContact O-N 2.88Å; N278-T282 PolarHBondContact O-OG1 2.85Å; D279-T282 WeakPolarHBondContact O-CB 3.47Å; D279-T282 PolarHBondContact O-N 2.93Å; Q280-T282 VanDerWaalsContact C-N 3.33Å; Q280-T282 PolarHBondContact O-N 2.93Å; T282-N284 VanDerWaalsContact C-N 3.32Å; T282-N284 PolarHBondContact O-N 2.89Å; T282-A286 WeakPolarHBondContact O-CB 3.32Å; T282-A286 PolarHBondContact O-N 3.18Å
283	M	95.7	Very high	92.5	Very high	106 Å²	106	55.5 Å²	55.5	52%	0.522	31%	0.311	S	S	.	.	H	α-helix	trans	-61.2	-41.3	177.7	-72.7	-172.6	-68.7	0	0	111.9	D279 Q280 C281	D279-M283 WeakPolarHBondContact O-CG 3.18Å; D279-M283 PolarHBondContact O-N 3.14Å; Q280-M283 HydrophobicContact CB-CE 4.43Å; Q280-M283 PolarHBondContact O-N 2.87Å; C281-M283 PolarHBondContact O-N 2.99Å
284	N	95.2	Very high	91.8	Very high	33 Å²	33	59.7 Å²	59.7	18%	0.176	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-52.9	179.4	-66.1	-3.6	0	0	0	111.2	Q280 C281 T282 A286 T287 G348 Y349	Q280-N284 PolarHBondContact NE2-OD1 3.32Å; Q280-N284 PolarHBondContact O-N 3.04Å; Q280-N284 PolarHBondContact O-OD1 3.2Å; C281-N284 PolarHBondContact O-N 3.1Å; T282-N284 VanDerWaalsContact C-N 3.32Å; T282-N284 PolarHBondContact O-N 2.89Å; N284-A286 VanDerWaalsContact C-N 3.3Å; N284-A286 PolarHBondContact O-N 3.49Å; N284-T287 WeakPolarHBondContact O-CB 3.38Å; N284-T287 PolarHBondContact O-N 3.27Å; N284-T287 VanDerWaalsContact O-N 3.16Å; N284-T287 PolarHBondContact O-OG1 2.95Å; N284-G348 WeakPolarHBondContact CB-O 3.34Å; N284-G348 PolarHBondContact ND2-O 3.07Å; N284-Y349 WeakPolarHBondContact O-CE1 3.5Å
285	Y	93.5	Very high	91.2	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-67.6	-27.8	-179.3	-83.7	-90.6	0	0	0	113.1	C281 T287 L288 V297 I299 F340 Y342 Y349 P350 V352	C281-Y285 WeakPolarHBondContact O-CD2 3.02Å; C281-Y285 PolarHBondContact O-N 3.25Å; Y285-T287 PolarHBondContact O-N 3.43Å; Y285-T287 VanDerWaalsContact O-N 3.16Å; Y285-L288 HydrophobicContact CD1-CD1 3.82Å; Y285-L288 HydrophobicContact CE1-CD1 4.33Å; Y285-L288 WeakPolarHBondContact O-CB 3.28Å; Y285-L288 PolarHBondContact O-N 3.33Å; Y285-L288 VanDerWaalsContact O-N 3.1Å; Y285-V297 HydrophobicContact CD1-CB 3.85Å; Y285-V297 HydrophobicContact CD1-CG1 3.62Å; Y285-V297 HydrophobicContact CD1-CG2 4.02Å; Y285-V297 HydrophobicContact CE1-CG1 4.21Å; Y285-V297 HydrophobicContact CG-CB 4.46Å; Y285-V297 HydrophobicContact CG-CG1 4.14Å; Y285-I299 HydrophobicContact CD2-CD1 3.84Å; Y285-I299 HydrophobicContact CD2-CG1 4.19Å; Y285-I299 HydrophobicContact CE2-CD1 4.29Å; Y285-I299 HydrophobicContact CG-CD1 4.01Å; Y285-I299 HydrophobicContact CG-CG1 4.32Å; Y285-F340 HydrophobicContact CE1-CE2 4.3Å; Y285-Y342 PolarHBondContact OH-N 2.9Å; Y285-Y349 HydrophobicContact CD1-CD1 4.49Å; Y285-P350 HydrophobicContact CE2-CG 4.46Å; Y285-P350 WeakPolarHBondContact CE2-O 3.25Å; Y285-P350 PolarHBondContact OH-O 3.31Å; Y285-V352 HydrophobicContact CE2-CG2 3.92Å
286	A	92.7	Very high	90.5	Very high	33 Å²	33	65.9 Å²	65.9	27%	0.273	37%	0.37	S	S	.	.	H	α-helix	trans	-61.2	-23.1	174.3	0	0	0	0	0	113.2	T282 N284 L288 R289	T282-A286 WeakPolarHBondContact O-CB 3.32Å; T282-A286 PolarHBondContact O-N 3.18Å; N284-A286 VanDerWaalsContact C-N 3.3Å; N284-A286 PolarHBondContact O-N 3.49Å; A286-L288 VanDerWaalsContact C-N 3.25Å; A286-L288 PolarHBondContact O-N 2.98Å; A286-R289 PolarHBondContact O-N 3.38Å
287	T	92.1	Very high	90	Very high	77 Å²	77	65.5 Å²	65.5	47%	0.472	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-68	-24.4	176.9	68.3	0	0	0	0	113	N284 Y285 R289 N290 Y349	N284-T287 WeakPolarHBondContact O-CB 3.38Å; N284-T287 PolarHBondContact O-N 3.27Å; N284-T287 VanDerWaalsContact O-N 3.16Å; N284-T287 PolarHBondContact O-OG1 2.95Å; Y285-T287 PolarHBondContact O-N 3.43Å; Y285-T287 VanDerWaalsContact O-N 3.16Å; T287-R289 VanDerWaalsContact C-N 3.26Å; T287-R289 PolarHBondContact O-N 2.8Å; T287-N290 PolarHBondContact O-N 3.16Å; T287-Y349 PolarHBondContact OG1-OH 3.08Å
288	L	90	Very high	89.6	Confident	12 Å²	12	65.8 Å²	65.8	6%	0.063	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-69.1	-22.3	178.2	-61.7	176.1	0	0	0	113.2	Y285 A286 N290 G291 P294 I295 Y342 Y349	Y285-L288 HydrophobicContact CD1-CD1 3.82Å; Y285-L288 HydrophobicContact CE1-CD1 4.33Å; Y285-L288 WeakPolarHBondContact O-CB 3.28Å; Y285-L288 PolarHBondContact O-N 3.33Å; Y285-L288 VanDerWaalsContact O-N 3.1Å; A286-L288 VanDerWaalsContact C-N 3.25Å; A286-L288 PolarHBondContact O-N 2.98Å; L288-N290 PolarHBondContact O-N 3.48Å; L288-G291 PolarHBondContact O-N 3.41Å; L288-P294 WeakPolarHBondContact O-CA 3.32Å; L288-I295 CarbonylContact C-O 3.57Å; L288-I295 HydrophobicContact CB-CB 4.2Å; L288-I295 PolarHBondContact O-N 2.7Å; L288-I295 VanDerWaalsContact O-N 3.11Å; L288-Y342 HydrophobicContact CD1-CD1 4.42Å; L288-Y342 HydrophobicContact CD1-CD2 3.79Å; L288-Y342 HydrophobicContact CD1-CE2 4.37Å; L288-Y342 HydrophobicContact CD1-CG 3.81Å; L288-Y342 HydrophobicContact CD2-CD1 3.99Å; L288-Y342 HydrophobicContact CD2-CD2 4.08Å; L288-Y342 HydrophobicContact CD2-CE1 3.81Å; L288-Y342 HydrophobicContact CD2-CE2 3.92Å; L288-Y342 HydrophobicContact CD2-CG 4.11Å; L288-Y349 HydrophobicContact CD1-CD1 4.24Å; L288-Y349 HydrophobicContact CD1-CE1 3.94Å; L288-Y349 HydrophobicContact CD2-CE1 3.63Å; L288-Y349 HydrophobicContact CD2-CE2 4.47Å; L288-Y349 WeakPolarHBondContact CD2-OH 3.16Å; L288-Y349 HydrophobicContact CG-CD1 4.4Å; L288-Y349 HydrophobicContact CG-CE1 3.61Å
289	R	88.3	Confident	89.5	Confident	109 Å²	109	64.9 Å²	64.9	41%	0.411	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-67.6	-22.1	177.9	-69.3	-179.8	173.1	150.1	-0.2	113.5	A286 T287 P294 D296 T298	A286-R289 PolarHBondContact O-N 3.38Å; T287-R289 VanDerWaalsContact C-N 3.26Å; T287-R289 PolarHBondContact O-N 2.8Å; R289-P294 WeakPolarHBondContact O-CB 3.22Å; R289-D296 IonicContact CZ-OD1 3.13Å; R289-D296 IonicContact NE-OD1 2.73Å; R289-D296 PolarHBondContact NE-OD1 2.96Å; R289-D296 IonicContact NH2-OD1 2.7Å; R289-D296 PolarHBondContact NH2-OD1 3.08Å; R289-T298 PolarHBondContact NH2-OG1 2.71Å
290	N	85.3	Confident	89.3	Confident	148 Å²	148	63.4 Å²	63.4	79%	0.791	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-106.1	9.1	-176.4	-58.8	-46.8	0	0	0	112.6	T287 L288	T287-N290 PolarHBondContact O-N 3.16Å; L288-N290 PolarHBondContact O-N 3.48Å
291	G	78	Confident	89.2	Confident	28 Å²	28	63.9 Å²	63.9	29%	0.289	37%	0.365	S	S	.	.	S	Bend	trans	-75.9	172	178.4	0	0	0	0	0	113.6	L288 N293 P294	L288-G291 PolarHBondContact O-N 3.41Å; G291-N293 PolarHBondContact O-N 2.03Å; G291-P294 WeakPolarHBondContact O-CD 3.33Å; G291-P294 WeakPolarHBondContact O-CG 3.38Å
292	P	81.1	Confident	89.1	Confident	121 Å²	121	64.6 Å²	64.6	79%	0.786	37%	0.369	S	S	*	.	S	Bend	trans	-62.4	-29.9	175.7	25.9	-33.6	0	0	0	112.6	P294	P292-P294 WeakPolarHBondContact O-CD 3.43Å
293	N	79.1	Confident	89.1	Confident	100 Å²	100	61.9 Å²	61.9	54%	0.535	35%	0.352	S	S	.	.	S	Bend	trans	-117.3	85.1	169.4	-72.3	-45.8	0	0	0	108.7	E119 G291 I295	E119-N293 PolarHBondContact OE2-ND2 3.38Å; G291-N293 PolarHBondContact O-N 2.03Å; N293-I295 WeakPolarHBondContact O-CG1 3.37Å; N293-I295 PolarHBondContact O-N 2.03Å
294	P	83.5	Confident	89.2	Confident	88 Å²	88	56.9 Å²	56.9	57%	0.571	33%	0.328	S	S	*	.			trans	-56.9	123.6	-176.2	-28.1	36.3	0	0	0	112.5	L288 R289 G291 P292	L288-P294 WeakPolarHBondContact O-CA 3.32Å; R289-P294 WeakPolarHBondContact O-CB 3.22Å; G291-P294 WeakPolarHBondContact O-CD 3.33Å; G291-P294 WeakPolarHBondContact O-CG 3.38Å; P292-P294 WeakPolarHBondContact O-CD 3.43Å
295	I	84.3	Confident	89.3	Confident	66 Å²	66	55.3 Å²	55.3	34%	0.338	32%	0.319	S	S	.	.			trans	-112.1	121.8	172.4	-50.9	178.7	0	0	0	108.2	L288 N293 V297 Y342	L288-I295 CarbonylContact C-O 3.57Å; L288-I295 HydrophobicContact CB-CB 4.2Å; L288-I295 PolarHBondContact O-N 2.7Å; L288-I295 VanDerWaalsContact O-N 3.11Å; N293-I295 WeakPolarHBondContact O-CG1 3.37Å; N293-I295 PolarHBondContact O-N 2.03Å; I295-V297 HydrophobicContact CG2-CG2 3.77Å; I295-Y342 HydrophobicContact CD1-CD2 3.93Å; I295-Y342 HydrophobicContact CD1-CE2 3.6Å
296	D	84.9	Confident	89.5	Confident	103 Å²	103	55.2 Å²	55.2	55%	0.551	32%	0.319	S	S	*	.			trans	-90.4	105.3	174.6	-167.9	11.9	0	0	0	110.2	R289	R289-D296 IonicContact CZ-OD1 3.13Å; R289-D296 IonicContact NE-OD1 2.73Å; R289-D296 PolarHBondContact NE-OD1 2.96Å; R289-D296 IonicContact NH2-OD1 2.7Å; R289-D296 PolarHBondContact NH2-OD1 3.08Å
297	V	87.8	Confident	89.8	Confident	12 Å²	12	54 Å²	54	7%	0.073	31%	0.309	C	S	.	.			trans	-117.9	128.5	174.6	-179.5	0	0	0	0	108.6	Y285 I295 I299 F340	Y285-V297 HydrophobicContact CD1-CB 3.85Å; Y285-V297 HydrophobicContact CD1-CG1 3.62Å; Y285-V297 HydrophobicContact CD1-CG2 4.02Å; Y285-V297 HydrophobicContact CE1-CG1 4.21Å; Y285-V297 HydrophobicContact CG-CB 4.46Å; Y285-V297 HydrophobicContact CG-CG1 4.14Å; I295-V297 HydrophobicContact CG2-CG2 3.77Å; V297-I299 HydrophobicContact CG1-CD1 3.98Å; V297-F340 HydrophobicContact CG1-CE2 3.63Å; V297-F340 HydrophobicContact CG1-CZ 3.91Å
298	T	89.5	Confident	90	Very high	56 Å²	56	52.2 Å²	52.2	34%	0.344	30%	0.295	S	S	.	.			trans	-108.5	121.6	173.7	-62.2	0	0	0	0	109.6	R289 E300	R289-T298 PolarHBondContact NH2-OG1 2.71Å; T298-E300 HydrophobicContact CG2-CG 4.32Å; T298-E300 WeakPolarHBondContact CG2-OE1 3.17Å; T298-E300 PolarHBondContact O-N 3.22Å
299	I	93.4	Very high	90.3	Very high	18 Å²	18	55.5 Å²	55.5	9%	0.092	33%	0.325	C	S	.	.			trans	-89.4	98.7	174.7	-56.1	-57.2	0	0	0	108.3	N278 C281 Y285 V297 V303 F340 V352	N278-I299 HydrophobicContact CB-CG2 4.5Å; C281-I299 HydrophobicContact CB-CG2 4.23Å; Y285-I299 HydrophobicContact CD2-CD1 3.84Å; Y285-I299 HydrophobicContact CD2-CG1 4.19Å; Y285-I299 HydrophobicContact CE2-CD1 4.29Å; Y285-I299 HydrophobicContact CG-CD1 4.01Å; Y285-I299 HydrophobicContact CG-CG1 4.32Å; V297-I299 HydrophobicContact CG1-CD1 3.98Å; I299-V303 HydrophobicContact CG2-CG2 3.89Å; I299-F340 HydrophobicContact CD1-CZ 4.3Å; I299-V352 HydrophobicContact CD1-CG2 4.05Å
300	E	92.5	Very high	90.7	Very high	77 Å²	77	57.1 Å²	57.1	36%	0.36	34%	0.337	S	S	.	.			trans	-75	164	178.3	-66.6	-67.3	172.1	0	0	112.1	N278 T298 N302 V303	N278-E300 PolarHBondContact ND2-O 3.44Å; N278-E300 VanDerWaalsContact ND2-O 3.11Å; T298-E300 HydrophobicContact CG2-CG 4.32Å; T298-E300 WeakPolarHBondContact CG2-OE1 3.17Å; T298-E300 PolarHBondContact O-N 3.22Å; E300-N302 WeakPolarHBondContact CB-OD1 3.5Å; E300-N302 PolarHBondContact O-N 3.44Å; E300-V303 WeakPolarHBondContact O-CG2 3.41Å; E300-V303 PolarHBondContact O-N 3.38Å
301	S	94	Very high	91.2	Very high	91 Å²	91	50.5 Å²	50.5	64%	0.636	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.4	176.7	62.3	0	0	0	0	112.9	V303 R355	S301-V303 PolarHBondContact O-N 2.92Å; S301-R355 PolarHBondContact O-NE 3.27Å
302	N	95.3	Very high	92	Very high	16 Å²	16	52.7 Å²	52.7	9%	0.086	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	14.5	-178.5	68.5	-4.7	0	0	0	113.9	E300 R355 D358 Y359	E300-N302 WeakPolarHBondContact CB-OD1 3.5Å; E300-N302 PolarHBondContact O-N 3.44Å; N302-R355 VanDerWaalsContact C-CB 3.49Å; N302-R355 VanDerWaalsContact O-CB 3.24Å; N302-R355 WeakPolarHBondContact O-CB 3.35Å; N302-R355 PolarHBondContact O-N 3.37Å; N302-D358 WeakPolarHBondContact CA-OD2 3.43Å; N302-Y359 HydrophobicContact CB-CE2 4.33Å; N302-Y359 VanDerWaalsContact CG-OH 3.28Å; N302-Y359 PolarHBondContact ND2-OH 3.46Å
303	V	95.8	Very high	92.6	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.018	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	161.4	169.1	-59.3	0	0	0	0	111.4	N278 I299 E300 S301 V352 Y353 R355	N278-V303 PolarHBondContact ND2-O 3.35Å; N278-V303 PolarHBondContact OD1-O 2.9Å; I299-V303 HydrophobicContact CG2-CG2 3.89Å; E300-V303 WeakPolarHBondContact O-CG2 3.41Å; E300-V303 PolarHBondContact O-N 3.38Å; S301-V303 PolarHBondContact O-N 2.92Å; V303-V352 HydrophobicContact CB-CG1 3.77Å; V303-V352 HydrophobicContact CG1-CG1 4.15Å; V303-V352 HydrophobicContact CG2-CG1 3.82Å; V303-Y353 CarbonylContact C-O 3.46Å; V303-Y353 VanDerWaalsContact CA-O 3.22Å; V303-Y353 WeakPolarHBondContact CA-O 3.36Å; V303-Y353 VanDerWaalsContact CB-O 3.32Å; V303-Y353 WeakPolarHBondContact CB-O 3.39Å; V303-R355 PolarHBondContact O-NE 3.15Å; V303-R355 PolarHBondContact O-NH2 2.94Å
304	I	96.7	Very high	93.4	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.7	173.5	-65.6	170.5	0	0	0	106.9	I275 L324 S335 Y353 R355	I275-I304 HydrophobicContact CD1-CG2 3.6Å; I304-L324 HydrophobicContact CG2-CD2 4.31Å; I304-S335 WeakPolarHBondContact CD1-O 3.47Å; I304-Y353 PolarHBondContact N-O 2.83Å; I304-Y353 PolarHBondContact O-N 3.35Å; I304-R355 HydrophobicContact CD1-CB 4.18Å; I304-R355 HydrophobicContact CD1-CG 4.03Å; I304-R355 HydrophobicContact CG1-CB 3.85Å; I304-R355 HydrophobicContact CG1-CG 3.93Å
305	C	97.5	Very high	93.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140	168.3	-59.2	0	0	0	0	110	V276 C281 P350 G351	V276-C305 HydrophobicContact CB-CB 4.06Å; V276-C305 PolarHBondContact N-O 2.58Å; C281-C305 HydrophobicContact CB-CB 3.55Å; C281-C305 WeakPolarHBondContact CB-SG 3.39Å; C281-C305 WeakPolarHBondContact SG-CB 3.29Å; C281-C305 CovalentContact SG-SG 2.03Å; C281-C305 PolarHBondContact SG-SG 3.41Å; C305-P350 HydrophobicContact CB-CB 4.25Å; C305-P350 HydrophobicContact CB-CG 3.86Å; C305-G351 WeakPolarHBondContact CA-O 3.41Å
306	A	98.4	Very high	94.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	133.2	175.6	0	0	0	0	0	111.1	V273 P274 I275 L324 P350 G351 Y353	V273-A306 HydrophobicContact CB-CB 4.15Å; V273-A306 HydrophobicContact CG2-CB 3.76Å; P274-A306 CarbonylContact O-C 3.57Å; P274-A306 WeakPolarHBondContact O-CA 3.1Å; I275-A306 HydrophobicContact CD1-CB 4.26Å; A306-L324 HydrophobicContact CB-CD2 4.13Å; A306-P350 WeakPolarHBondContact O-CB 3.41Å; A306-G351 PolarHBondContact N-O 3.39Å; A306-G351 PolarHBondContact O-N 3.38Å; A306-G351 VanDerWaalsContact O-N 3.08Å; A306-Y353 HydrophobicContact CB-CD2 4.21Å; A306-Y353 HydrophobicContact CB-CE2 3.76Å
307	G	98.1	Very high	94.7	Very high	6 Å²	6	41.7 Å²	41.7	6%	0.062	25%	0.246	C	C	.	.			trans	163.4	153.5	-177	0	0	0	0	0	112.1	P274 V276	P274-G307 PolarHBondContact O-N 2.83Å; V276-G307 VanDerWaalsContact CG2-O 3.31Å; V276-G307 WeakPolarHBondContact CG2-O 2.94Å
308	H	97.3	Very high	94.9	Very high	40 Å²	40	42.3 Å²	42.3	19%	0.185	25%	0.248	C	C	.	.			trans	-76	145.1	174.4	-63.6	-91.1	0	0	0	109.6	G272 P274 E310 G311	G272-H308 PolarHBondContact O-NE2 3.5Å; P274-H308 WeakPolarHBondContact CD-NE2 3.43Å; H308-E310 HydrophobicContact CB-CG 4.17Å; H308-E310 PolarHBondContact O-N 2.97Å; H308-G311 PolarHBondContact O-N 2.84Å
309	A	96.2	Very high	95.2	Very high	82 Å²	82	40.2 Å²	40.2	68%	0.678	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-36.1	-177.5	0	0	0	0	0	111.7	G311 G348	A309-G311 PolarHBondContact O-N 3.13Å; A309-G348 PolarHBondContact O-N 3.08Å
310	E	96.8	Very high	95.4	Very high	143 Å²	143	40.3 Å²	40.3	67%	0.668	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-9.3	173.3	64.3	-91.9	-142.4	0	0	114.1	H308 A347	H308-E310 HydrophobicContact CB-CG 4.17Å; H308-E310 PolarHBondContact O-N 2.97Å; E310-A347 WeakPolarHBondContact O-CB 3.18Å
311	G	95.5	Very high	95.6	Very high	9 Å²	9	36.6 Å²	36.6	9%	0.093	22%	0.22	C	C	.	.			trans	73.2	-147.7	-175.1	0	0	0	0	0	113.5	H308 A309 R313 G345	H308-G311 PolarHBondContact O-N 2.84Å; A309-G311 PolarHBondContact O-N 3.13Å; G311-R313 VanDerWaalsContact C-N 3.26Å; G311-R313 PolarHBondContact O-N 3.28Å; G311-G345 CarbonylContact C-O 3.59Å; G311-G345 VanDerWaalsContact CA-O 3.25Å; G311-G345 WeakPolarHBondContact CA-O 3.41Å
312	G	93.8	Very high	95.8	Very high	73 Å²	73	32.3 Å²	32.3	75%	0.753	19%	0.189	S	C	*	.			trans	78.1	-6	176.5	0	0	0	0	0	116.1	G345	G312-G345 PolarHBondContact N-O 2.99Å
313	R	94	Very high	96	Very high	130 Å²	130	31.5 Å²	31.5	49%	0.491	19%	0.185	S	C	.	.			trans	-144.9	118.4	-178.3	-72.8	-174.2	-167	-177.7	7.7	110.6	V271 V273 G311	V271-R313 HydrophobicContact CG2-CB 3.56Å; V271-R313 HydrophobicContact CG2-CG 3.74Å; V273-R313 HydrophobicContact CG1-CB 4.45Å; G311-R313 VanDerWaalsContact C-N 3.26Å; G311-R313 PolarHBondContact O-N 3.28Å
314	D	95.2	Very high	96.1	Very high	28 Å²	28	31.4 Å²	31.4	15%	0.15	18%	0.184	C	C	.	.			trans	-163.9	169.1	-179.1	-156.1	1.2	0	0	0	111.7	G345 Y353	D314-G345 VanDerWaalsContact CB-N 3.25Å; D314-G345 PolarHBondContact OD2-N 2.84Å; D314-Y353 PolarHBondContact OD1-OH 3.41Å
315	A	95	Very high	96.1	Very high	9 Å²	9	31.3 Å²	31.3	7%	0.074	18%	0.184	C	C	.	.			trans	-71.2	158.3	155	0	0	0	0	0	110.1	D319 I338	A315-D319 HydrophobicContact CB-CB 4.02Å; A315-I338 HydrophobicContact CB-CD1 3.86Å; A315-I338 HydrophobicContact CB-CG1 4.05Å; A315-I338 HydrophobicContact CB-CG2 3.72Å
316	C	93.7	Very high	96.1	Very high	12 Å²	12	31.3 Å²	31.3	8%	0.081	18%	0.184	C	C	.	.			trans	-139.9	-169.1	-178.6	-157.7	0	0	0	0	112.2	H256 F318 D319 C344	H256-C316 HydrophobicContact CB-CB 4.05Å; H256-C316 WeakPolarHBondContact O-CB 3.39Å; C316-F318 PolarHBondContact O-N 2.83Å; C316-D319 PolarHBondContact N-OD2 3.38Å; C316-D319 WeakPolarHBondContact O-CB 3.28Å; C316-D319 PolarHBondContact O-N 2.7Å; C316-C344 WeakPolarHBondContact CA-SG 3.35Å; C316-C344 HydrophobicContact CB-CB 3.75Å; C316-C344 WeakPolarHBondContact CB-SG 3.39Å; C316-C344 WeakPolarHBondContact SG-CB 3.5Å; C316-C344 CovalentContact SG-SG 2.03Å; C316-C344 PolarHBondContact SG-SG 2.91Å
317	Q	91.4	Very high	95.9	Very high	68 Å²	68	36.1 Å²	36.1	32%	0.318	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	142.3	-179.6	-63.3	79.1	24.2	0	0	110.6	G255 H256 D319	G255-Q317 CarbonylContact C-O 3.6Å; G255-Q317 WeakPolarHBondContact CA-O 3.35Å; H256-Q317 PolarHBondContact N-O 3.48Å; H256-Q317 PolarHBondContact ND1-OE1 3.05Å; H256-Q317 VanDerWaalsContact ND1-OE1 3.16Å; Q317-D319 PolarHBondContact O-N 2.73Å
318	F	93.6	Very high	95.5	Very high	25 Å²	25	37.3 Å²	37.3	11%	0.11	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-7	-172.6	-49.1	-83.6	0	0	0	116.6	P127 H141 L142 H256 I264 C316 S320	P127-F318 HydrophobicContact CB-CD1 4.42Å; P127-F318 HydrophobicContact CB-CE1 4.13Å; P127-F318 HydrophobicContact CB-CE2 4.47Å; P127-F318 HydrophobicContact CB-CZ 4.15Å; P127-F318 HydrophobicContact CG-CD1 4.25Å; P127-F318 HydrophobicContact CG-CE1 3.77Å; P127-F318 HydrophobicContact CG-CZ 4.12Å; H141-F318 PolarHBondContact NE2-O 3.45Å; H141-F318 VanDerWaalsContact NE2-O 3.1Å; L142-F318 HydrophobicContact CD1-CE1 4.31Å; H256-F318 AromaticContact CD2-CD2 3.91Å; H256-F318 AromaticContact CE1-CE2 3.69Å; H256-F318 AromaticContact NE2-CD2 3.59Å; H256-F318 AromaticContact NE2-CE2 3.35Å; H256-F318 WeakPolarHBondContact NE2-CE2 3.35Å; I264-F318 HydrophobicContact CG2-CB 3.88Å; I264-F318 HydrophobicContact CG2-CD2 3.29Å; I264-F318 HydrophobicContact CG2-CE2 3.9Å; I264-F318 HydrophobicContact CG2-CG 3.66Å; C316-F318 PolarHBondContact O-N 2.83Å; F318-S320 VanDerWaalsContact C-N 3.29Å
319	D	95.9	Very high	94.9	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.07	24%	0.243	C	C	.	.			trans	-79	-14.9	168.6	-68.3	-47	0	0	0	113.4	G253 W254 G255 A315 C316 Q317 G321 G322 I338	G253-D319 WeakPolarHBondContact CA-OD1 3.11Å; W254-D319 PolarHBondContact N-OD1 2.84Å; W254-D319 VanDerWaalsContact N-OD1 3.07Å; G255-D319 WeakPolarHBondContact CA-OD1 3.49Å; G255-D319 PolarHBondContact N-OD1 3.37Å; A315-D319 HydrophobicContact CB-CB 4.02Å; C316-D319 PolarHBondContact N-OD2 3.38Å; C316-D319 WeakPolarHBondContact O-CB 3.28Å; C316-D319 PolarHBondContact O-N 2.7Å; Q317-D319 PolarHBondContact O-N 2.73Å; D319-G321 PolarHBondContact O-N 3.05Å; D319-G322 WeakPolarHBondContact O-CA 3.44Å; D319-G322 PolarHBondContact O-N 3.14Å; D319-I338 HydrophobicContact CB-CD1 3.91Å; D319-I338 HydrophobicContact CB-CG2 4.36Å; D319-I338 WeakPolarHBondContact O-CD1 3.44Å
320	S	95.8	Very high	94.3	Very high	19 Å²	19	49.8 Å²	49.8	13%	0.133	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	136.8	-178	-74	0	0	0	0	113.6	C143 G144 H158 F318 G322	C143-S320 CarbonylContact C-O 3.59Å; C143-S320 VanDerWaalsContact CA-O 3.32Å; C143-S320 WeakPolarHBondContact CA-O 2.99Å; C143-S320 WeakPolarHBondContact CB-O 3.21Å; G144-S320 PolarHBondContact N-O 2.99Å; H158-S320 WeakPolarHBondContact CE1-CB 3.48Å; H158-S320 PolarHBondContact CE1-OG 2.78Å; H158-S320 VanDerWaalsContact CE1-OG 3.26Å; H158-S320 WeakPolarHBondContact NE2-CB 3.48Å; H158-S320 PolarHBondContact NE2-OG 2.84Å; H158-S320 VanDerWaalsContact NE2-OG 3.15Å; F318-S320 VanDerWaalsContact C-N 3.29Å; S320-G322 PolarHBondContact O-N 3.2Å
321	G	98.1	Very high	93.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-12.7	-173.8	0	0	0	0	0	115.2	G144 G145 T155 A156 D319 I338	G144-G321 VanDerWaalsContact C-C 3.46Å; G144-G321 CarbonylContact C-O 3.48Å; G144-G321 CarbonylContact O-C 3.48Å; G144-G321 VanDerWaalsContact O-C 3.28Å; G145-G321 WeakPolarHBondContact CA-O 3.28Å; T155-G321 WeakPolarHBondContact OG1-CA 3.46Å; A156-G321 VanDerWaalsContact N-CA 3.33Å; D319-G321 PolarHBondContact O-N 3.05Å; G321-I338 PolarHBondContact N-O 3.48Å
322	G	98.3	Very high	93.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.			trans	-65	161.1	169.7	0	0	0	0	0	112.6	D319 S320 I337 I338	D319-G322 WeakPolarHBondContact O-CA 3.44Å; D319-G322 PolarHBondContact O-N 3.14Å; S320-G322 PolarHBondContact O-N 3.2Å; G322-I337 WeakPolarHBondContact O-CA 3.31Å; G322-I338 WeakPolarHBondContact O-CG1 3.36Å; G322-I338 PolarHBondContact O-N 2.83Å
323	P	98.3	Very high	93.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	148.4	-176.9	30.8	-32.4	0	0	0	113.7	L78 T146 M325 V334	L78-P323 HydrophobicContact CD1-CG 3.98Å; T146-P323 VanDerWaalsContact OG1-CB 3.31Å; T146-P323 WeakPolarHBondContact OG1-CB 3.46Å; P323-M325 HydrophobicContact CB-CG 4.24Å; P323-M325 HydrophobicContact CB-SD 3.39Å; P323-M325 WeakPolarHBondContact CB-SD 3.47Å; P323-M325 HydrophobicContact CG-SD 3.35Å; P323-M325 WeakPolarHBondContact CG-SD 2.98Å; P323-V334 HydrophobicContact CB-CG1 3.68Å; P323-V334 HydrophobicContact CB-CG2 4Å
324	L	98.4	Very high	94.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.7	155.7	179.5	72.2	0	0	0	108.4	C249 V273 I275 I304 A306 S335 G336 Y353	C249-L324 HydrophobicContact CB-CD1 3.78Å; C249-L324 HydrophobicContact CB-CD2 4.48Å; C249-L324 HydrophobicContact CB-CG 3.99Å; V273-L324 HydrophobicContact CG2-CD1 3.72Å; I275-L324 HydrophobicContact CD1-CD2 4.22Å; I304-L324 HydrophobicContact CG2-CD2 4.31Å; A306-L324 HydrophobicContact CB-CD2 4.13Å; L324-S335 PolarHBondContact O-N 2.94Å; L324-G336 PolarHBondContact N-O 2.75Å; L324-G336 PolarHBondContact O-N 3.26Å; L324-G336 VanDerWaalsContact O-N 3.14Å; L324-Y353 HydrophobicContact CB-CD1 3.56Å; L324-Y353 HydrophobicContact CB-CE1 3.78Å; L324-Y353 HydrophobicContact CB-CG 4.3Å; L324-Y353 HydrophobicContact CD1-CD1 4.45Å; L324-Y353 HydrophobicContact CD1-CE1 3.95Å; L324-Y353 HydrophobicContact CD2-CD1 3.94Å; L324-Y353 HydrophobicContact CD2-CD2 4.09Å; L324-Y353 HydrophobicContact CD2-CE1 4.19Å; L324-Y353 HydrophobicContact CD2-CE2 4.41Å; L324-Y353 HydrophobicContact CD2-CG 3.89Å; L324-Y353 HydrophobicContact CG-CD1 4.19Å; L324-Y353 HydrophobicContact CG-CE1 4.19Å
325	M	97.4	Very high	94.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.5	-178.4	-59	86.7	64.3	0	0	112.6	W75 W77 C249 I250 V252 P323 W332 I333 V334	W75-M325 HydrophobicContact CD2-CE 3.48Å; W75-M325 VanDerWaalsContact CD2-CE 3.48Å; W75-M325 HydrophobicContact CE3-CE 3.14Å; W75-M325 HydrophobicContact CG-CE 4.27Å; W75-M325 HydrophobicContact CH2-CE 3.73Å; W75-M325 HydrophobicContact CZ2-CE 4.05Å; W75-M325 HydrophobicContact CZ3-CE 3.28Å; W77-M325 HydrophobicContact CZ2-CE 4.41Å; W77-M325 HydrophobicContact CZ2-CG 4.26Å; C249-M325 CarbonylContact C-O 3.51Å; C249-M325 WeakPolarHBondContact CA-O 3.02Å; C249-M325 WeakPolarHBondContact CB-O 3.35Å; I250-M325 HydrophobicContact CB-CE 4.45Å; I250-M325 PolarHBondContact N-O 3.26Å; I250-M325 PolarHBondContact O-N 2.94Å; V252-M325 HydrophobicContact CB-CE 4.21Å; V252-M325 HydrophobicContact CG2-CE 3.28Å; V252-M325 HydrophobicContact CG2-SD 4.23Å; P323-M325 HydrophobicContact CB-CG 4.24Å; P323-M325 HydrophobicContact CB-SD 3.39Å; P323-M325 WeakPolarHBondContact CB-SD 3.47Å; P323-M325 HydrophobicContact CG-SD 3.35Å; P323-M325 WeakPolarHBondContact CG-SD 2.98Å; M325-W332 HydrophobicContact CB-CB 4.45Å; M325-W332 HydrophobicContact CB-CE3 3.78Å; M325-W332 HydrophobicContact CB-CZ3 4.44Å; M325-I333 CarbonylContact C-O 3.58Å; M325-I333 VanDerWaalsContact CA-O 3.22Å; M325-I333 WeakPolarHBondContact CA-O 3.03Å; M325-V334 HydrophobicContact CG-CG2 3.91Å
326	C	96.9	Very high	94.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142	173	-55.9	0	0	0	0	109.2	I243 C249 I328 I333 S335	I243-C326 HydrophobicContact CD1-CB 4.12Å; I243-C326 HydrophobicContact CG1-CB 4.45Å; I243-C326 HydrophobicContact CG2-CB 4.17Å; C249-C326 HydrophobicContact CB-CB 4.11Å; C249-C326 WeakPolarHBondContact CB-SG 3.49Å; C249-C326 WeakPolarHBondContact SG-CB 3.27Å; C249-C326 CovalentContact SG-SG 2.03Å; C249-C326 PolarHBondContact SG-SG 3.44Å; C326-I328 PolarHBondContact O-N 3.46Å; C326-I333 PolarHBondContact N-O 3.17Å; C326-I333 PolarHBondContact O-N 3.37Å; C326-S335 WeakPolarHBondContact CB-OG 3.47Å
327	Q	93.3	Very high	94.6	Very high	101 Å²	101	35.2 Å²	35.2	47%	0.472	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	122.4	172.5	-70.2	-167	-8.7	0	0	110.7	Q247 Q331 W332	Q247-Q327 PolarHBondContact NE2-O 3.3Å; Q327-Q331 WeakPolarHBondContact CA-O 3.19Å; Q327-W332 HydrophobicContact CG-CD2 3.78Å; Q327-W332 HydrophobicContact CG-CE3 3.49Å; Q327-W332 VanDerWaalsContact CG-CE3 3.49Å; Q327-W332 HydrophobicContact CG-CH2 3.64Å; Q327-W332 HydrophobicContact CG-CZ2 3.91Å; Q327-W332 HydrophobicContact CG-CZ3 3.42Å; Q327-W332 VanDerWaalsContact CG-CZ3 3.42Å; Q327-W332 VanDerWaalsContact NE2-CE2 3.33Å
328	I	90.1	Very high	94.9	Very high	31 Å²	31	32.4 Å²	32.4	16%	0.159	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.4	172.7	-50.8	-178.3	0	0	0	107.4	E241 I243 C326 K330 Q331 I333	E241-I328 HydrophobicContact CG-CD1 4.07Å; E241-I328 WeakPolarHBondContact OE2-CD1 3.45Å; I243-I328 HydrophobicContact CD1-CD1 3.57Å; I243-I328 HydrophobicContact CD1-CG1 4.3Å; C326-I328 PolarHBondContact O-N 3.46Å; I328-K330 PolarHBondContact O-N 3.46Å; I328-Q331 PolarHBondContact N-O 2.81Å; I328-Q331 PolarHBondContact O-N 2.96Å; I328-I333 HydrophobicContact CB-CG1 3.75Å; I328-I333 HydrophobicContact CD1-CB 4.04Å; I328-I333 HydrophobicContact CD1-CG1 3.87Å; I328-I333 HydrophobicContact CD1-CG2 4.25Å; I328-I333 HydrophobicContact CG1-CB 4.26Å; I328-I333 HydrophobicContact CG1-CG1 3.83Å
329	K	85	Confident	95	Very high	197 Å²	197	31.5 Å²	31.5	86%	0.857	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	37.5	-179	-61.5	170.9	-176.7	167.1	0	113.6	Q331	K329-Q331 VanDerWaalsContact C-N 3.34Å
330	K	83.2	Confident	94.9	Very high	187 Å²	187	33 Å²	33	81%	0.813	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	14.2	-179.2	-49.7	176.8	178.7	177.8	0	116.1	I328	I328-K330 PolarHBondContact O-N 3.46Å
331	Q	88.6	Confident	94.8	Very high	46 Å²	46	33.8 Å²	33.8	22%	0.215	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	149	169.2	-70.1	-178.2	-9.8	0	0	110.2	Q327 I328 K329 I333	Q327-Q331 WeakPolarHBondContact CA-O 3.19Å; I328-Q331 PolarHBondContact N-O 2.81Å; I328-Q331 PolarHBondContact O-N 2.96Å; K329-Q331 VanDerWaalsContact C-N 3.34Å; Q331-I333 HydrophobicContact CB-CD1 4.13Å; Q331-I333 PolarHBondContact O-N 2.7Å
332	W	94.5	Very high	94.4	Very high	38 Å²	38	38.3 Å²	38.3	14%	0.144	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.8	171.4	-66.2	106	0	0	0	109.9	G44 N46 W75 W77 I250 M325 Q327	G44-W332 VanDerWaalsContact CA-O 3.23Å; G44-W332 WeakPolarHBondContact CA-O 3.49Å; G44-W332 WeakPolarHBondContact O-CB 3.42Å; G44-W332 PolarHBondContact O-N 3.39Å; N46-W332 PolarHBondContact ND2-NE1 3.23Å; W75-W332 HydrophobicContact CH2-CD2 4.06Å; W75-W332 AromaticContact CH2-CE2 3.75Å; W75-W332 HydrophobicContact CH2-CE3 4.25Å; W75-W332 AromaticContact CH2-CH2 3.87Å; W75-W332 HydrophobicContact CH2-CH2 3.87Å; W75-W332 AromaticContact CH2-CZ2 3.64Å; W75-W332 HydrophobicContact CH2-CZ2 3.64Å; W75-W332 HydrophobicContact CH2-CZ3 4.16Å; W75-W332 AromaticContact CZ3-CD2 3.78Å; W75-W332 HydrophobicContact CZ3-CD2 3.78Å; W75-W332 AromaticContact CZ3-CE2 3.74Å; W75-W332 HydrophobicContact CZ3-CE3 4.22Å; W75-W332 HydrophobicContact CZ3-CG 4.05Å; W75-W332 HydrophobicContact CZ3-CZ2 4.14Å; W77-W332 HydrophobicContact CH2-CB 3.73Å; W77-W332 AromaticContact CH2-CD1 3.98Å; W77-W332 HydrophobicContact CH2-CG 4.05Å; W77-W332 HydrophobicContact CZ2-CB 3.83Å; W77-W332 HydrophobicContact CZ2-CG 4.27Å; I250-W332 HydrophobicContact CB-CZ3 4.3Å; I250-W332 HydrophobicContact CG1-CH2 3.55Å; I250-W332 HydrophobicContact CG1-CZ3 3.61Å; M325-W332 HydrophobicContact CB-CB 4.45Å; M325-W332 HydrophobicContact CB-CE3 3.78Å; M325-W332 HydrophobicContact CB-CZ3 4.44Å; Q327-W332 HydrophobicContact CG-CD2 3.78Å; Q327-W332 HydrophobicContact CG-CE3 3.49Å; Q327-W332 VanDerWaalsContact CG-CE3 3.49Å; Q327-W332 HydrophobicContact CG-CH2 3.64Å; Q327-W332 HydrophobicContact CG-CZ2 3.91Å; Q327-W332 HydrophobicContact CG-CZ3 3.42Å; Q327-W332 VanDerWaalsContact CG-CZ3 3.42Å; Q327-W332 VanDerWaalsContact NE2-CE2 3.33Å
333	I	96	Very high	94	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.062	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.9	177.9	-51.5	-53.7	0	0	0	108.3	C235 P237 M325 C326 I328 Q331 S335	C235-I333 HydrophobicContact CB-CD1 3.33Å; P237-I333 VanDerWaalsContact CA-CG2 3.49Å; P237-I333 HydrophobicContact CB-CG2 3.7Å; P237-I333 HydrophobicContact CG-CG2 4.35Å; M325-I333 CarbonylContact C-O 3.58Å; M325-I333 VanDerWaalsContact CA-O 3.22Å; M325-I333 WeakPolarHBondContact CA-O 3.03Å; C326-I333 PolarHBondContact N-O 3.17Å; C326-I333 PolarHBondContact O-N 3.37Å; I328-I333 HydrophobicContact CB-CG1 3.75Å; I328-I333 HydrophobicContact CD1-CB 4.04Å; I328-I333 HydrophobicContact CD1-CG1 3.87Å; I328-I333 HydrophobicContact CD1-CG2 4.25Å; I328-I333 HydrophobicContact CG1-CB 4.26Å; I328-I333 HydrophobicContact CG1-CG1 3.83Å; Q331-I333 HydrophobicContact CB-CD1 4.13Å; Q331-I333 PolarHBondContact O-N 2.7Å; I333-S335 PolarHBondContact O-N 3.34Å; I333-S335 VanDerWaalsContact O-N 3.11Å
334	V	97.6	Very high	93.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	90.7	177	179.6	0	0	0	0	108.7	T146 M154 A234 C235 P237 P323 M325 G336 V356	T146-V334 HydrophobicContact CG2-CG1 4.36Å; T146-V334 HydrophobicContact CG2-CG2 3.82Å; M154-V334 HydrophobicContact CE-CB 4.26Å; M154-V334 HydrophobicContact CE-CG1 3.47Å; M154-V334 VanDerWaalsContact CE-CG1 3.47Å; A234-V334 HydrophobicContact CB-CG2 3.5Å; A234-V334 VanDerWaalsContact CB-CG2 3.5Å; C235-V334 PolarHBondContact O-N 3.07Å; P237-V334 VanDerWaalsContact CD-O 3.25Å; P237-V334 WeakPolarHBondContact CD-O 2.91Å; P323-V334 HydrophobicContact CB-CG1 3.68Å; P323-V334 HydrophobicContact CB-CG2 4Å; M325-V334 HydrophobicContact CG-CG2 3.91Å; V334-G336 WeakPolarHBondContact CG1-O 3.2Å; V334-V356 HydrophobicContact CG1-CG2 4.39Å; V334-V356 WeakPolarHBondContact O-CB 3.45Å; V334-V356 WeakPolarHBondContact O-CG2 3.43Å
335	S	98.1	Very high	93.5	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-27.4	-176.7	-55.8	0	0	0	0	112.5	I243 I304 L324 C326 I333 V356	I243-S335 VanDerWaalsContact CD1-OG 3.26Å; I243-S335 WeakPolarHBondContact CD1-OG 3.26Å; I304-S335 WeakPolarHBondContact CD1-O 3.47Å; L324-S335 PolarHBondContact O-N 2.94Å; C326-S335 WeakPolarHBondContact CB-OG 3.47Å; I333-S335 PolarHBondContact O-N 3.34Å; I333-S335 VanDerWaalsContact O-N 3.11Å; S335-V356 PolarHBondContact O-N 2.94Å
336	G	98.3	Very high	93.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	160.3	-178.4	0	0	0	0	0	114.1	L324 V334 T354	L324-G336 PolarHBondContact N-O 2.75Å; L324-G336 PolarHBondContact O-N 3.26Å; L324-G336 VanDerWaalsContact O-N 3.14Å; V334-G336 WeakPolarHBondContact CG1-O 3.2Å; G336-T354 VanDerWaalsContact CA-O 3.23Å; G336-T354 WeakPolarHBondContact CA-O 3.24Å
337	I	98.6	Very high	93.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.7	168.5	-52.6	170.1	0	0	0	107.4	M154 A156 I216 G322 S339 Y353 T354 V356	M154-I337 HydrophobicContact CE-CD1 4.18Å; M154-I337 HydrophobicContact CE-CG1 4.02Å; M154-I337 HydrophobicContact CG-CD1 3.54Å; M154-I337 HydrophobicContact CG-CG1 4.26Å; M154-I337 HydrophobicContact SD-CD1 3.77Å; M154-I337 HydrophobicContact SD-CG1 4.28Å; A156-I337 HydrophobicContact CB-CG2 4.22Å; I216-I337 HydrophobicContact CB-CD1 4.03Å; I216-I337 HydrophobicContact CD1-CD1 3.68Å; I216-I337 HydrophobicContact CG1-CD1 3.53Å; G322-I337 WeakPolarHBondContact O-CA 3.31Å; I337-S339 PolarHBondContact O-N 3.44Å; I337-Y353 CarbonylContact O-C 3.57Å; I337-Y353 WeakPolarHBondContact O-CA 3.39Å; I337-Y353 WeakPolarHBondContact O-CB 3.38Å; I337-T354 PolarHBondContact N-O 3.16Å; I337-T354 VanDerWaalsContact N-O 3.16Å; I337-T354 PolarHBondContact O-N 3.1Å; I337-V356 HydrophobicContact CD1-CG2 4.17Å; I337-V356 HydrophobicContact CG1-CG2 3.7Å
338	I	97.8	Very high	93.4	Very high	9 Å²	9	45.2 Å²	45.2	5%	0.046	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	121.2	179.6	-62.2	162.5	0	0	0	109.1	S251 A315 D319 G321 G322 Y353	S251-I338 WeakPolarHBondContact OG-CD1 3.42Å; A315-I338 HydrophobicContact CB-CD1 3.86Å; A315-I338 HydrophobicContact CB-CG1 4.05Å; A315-I338 HydrophobicContact CB-CG2 3.72Å; D319-I338 HydrophobicContact CB-CD1 3.91Å; D319-I338 HydrophobicContact CB-CG2 4.36Å; D319-I338 WeakPolarHBondContact O-CD1 3.44Å; G321-I338 PolarHBondContact N-O 3.48Å; G322-I338 WeakPolarHBondContact O-CG1 3.36Å; G322-I338 PolarHBondContact O-N 2.83Å; I338-Y353 HydrophobicContact CB-CD1 4.35Å; I338-Y353 HydrophobicContact CB-CE1 4.37Å; I338-Y353 HydrophobicContact CG1-CD1 3.81Å; I338-Y353 HydrophobicContact CG1-CE1 3.52Å
339	S	95.7	Very high	93.7	Very high	5 Å²	5	46 Å²	46	4%	0.035	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	-68.2	-172.3	-178.9	0	0	0	0	111.9	H158 D215 I337 V352	H158-S339 PolarHBondContact CE1-O 2.8Å; D215-S339 WeakPolarHBondContact CB-OG 3.47Å; D215-S339 WeakPolarHBondContact OD2-CA 3.27Å; D215-S339 WeakPolarHBondContact OD2-CB 3.24Å; D215-S339 PolarHBondContact OD2-OG 2.9Å; I337-S339 PolarHBondContact O-N 3.44Å; S339-V352 WeakPolarHBondContact CB-O 3.05Å; S339-V352 PolarHBondContact N-O 2.89Å; S339-V352 VanDerWaalsContact N-O 3.09Å
340	F	94	Very high	94.3	Very high	44 Å²	44	36.9 Å²	36.9	19%	0.193	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	172.7	-179.3	70	-89.4	0	0	0	112.2	A209 Y285 V297 I299 V352	A209-F340 HydrophobicContact CB-CB 4.32Å; A209-F340 WeakPolarHBondContact O-CD1 3.45Å; A209-F340 WeakPolarHBondContact O-CE1 3.38Å; Y285-F340 HydrophobicContact CE1-CE2 4.3Å; V297-F340 HydrophobicContact CG1-CE2 3.63Å; V297-F340 HydrophobicContact CG1-CZ 3.91Å; I299-F340 HydrophobicContact CD1-CZ 4.3Å; F340-V352 HydrophobicContact CD1-CB 4.02Å; F340-V352 HydrophobicContact CD1-CG1 4.16Å; F340-V352 HydrophobicContact CD2-CB 4.14Å; F340-V352 HydrophobicContact CD2-CG2 4.14Å; F340-V352 HydrophobicContact CE1-CB 3.75Å; F340-V352 HydrophobicContact CE1-CG1 3.48Å; F340-V352 VanDerWaalsContact CE1-CG1 3.48Å; F340-V352 HydrophobicContact CE1-CG2 4.33Å; F340-V352 HydrophobicContact CE2-CB 3.86Å; F340-V352 HydrophobicContact CE2-CG1 4.27Å; F340-V352 HydrophobicContact CE2-CG2 3.6Å; F340-V352 HydrophobicContact CG-CB 4.22Å; F340-V352 HydrophobicContact CZ-CB 3.67Å; F340-V352 HydrophobicContact CZ-CG1 3.56Å; F340-V352 HydrophobicContact CZ-CG2 3.73Å; F340-V352 PolarHBondContact N-O 3.29Å; F340-V352 WeakPolarHBondContact O-CA 3.34Å; F340-V352 WeakPolarHBondContact O-CB 3.3Å; F340-V352 PolarHBondContact O-N 3.39Å
341	G	92.3	Very high	94.9	Very high	36 Å²	36	28.1 Å²	28.1	37%	0.371	17%	0.166	S	C	.	.			trans	-162	169.8	173.7	0	0	0	0	0	111.2
342	Y	90.6	Very high	95.3	Very high	96 Å²	96	26 Å²	26	38%	0.376	16%	0.156	S	C	.	.	S	Bend	trans	-99	101.5	168.4	-179.6	-104.1	0	0	0	109.6	Y285 L288 I295 K346 Y349	Y285-Y342 PolarHBondContact OH-N 2.9Å; L288-Y342 HydrophobicContact CD1-CD1 4.42Å; L288-Y342 HydrophobicContact CD1-CD2 3.79Å; L288-Y342 HydrophobicContact CD1-CE2 4.37Å; L288-Y342 HydrophobicContact CD1-CG 3.81Å; L288-Y342 HydrophobicContact CD2-CD1 3.99Å; L288-Y342 HydrophobicContact CD2-CD2 4.08Å; L288-Y342 HydrophobicContact CD2-CE1 3.81Å; L288-Y342 HydrophobicContact CD2-CE2 3.92Å; L288-Y342 HydrophobicContact CD2-CG 4.11Å; I295-Y342 HydrophobicContact CD1-CD2 3.93Å; I295-Y342 HydrophobicContact CD1-CE2 3.6Å; Y342-K346 VanDerWaalsContact O-CG 3.24Å; Y342-K346 WeakPolarHBondContact O-CG 3.11Å; Y342-Y349 HydrophobicContact CD1-CD1 4.22Å; Y342-Y349 AromaticContact CD1-CD2 3.72Å; Y342-Y349 HydrophobicContact CD1-CD2 3.72Å; Y342-Y349 HydrophobicContact CD1-CE1 4.46Å; Y342-Y349 AromaticContact CD1-CE2 3.97Å; Y342-Y349 HydrophobicContact CD1-CE2 3.97Å; Y342-Y349 AromaticContact CD1-CG 3.84Å; Y342-Y349 HydrophobicContact CD1-CG 3.84Å; Y342-Y349 HydrophobicContact CE1-CD2 4.33Å; Y342-Y349 HydrophobicContact CE1-CE2 4.19Å; Y342-Y349 HydrophobicContact CG-CG 4.42Å
343	G	90	Very high	95.4	Very high	26 Å²	26	24.2 Å²	24.2	27%	0.268	15%	0.149	S	C	.	.	S	Bend	trans	60.6	-166.6	-162.7	0	0	0	0	0	111.8	D259	D259-G343 VanDerWaalsContact OD2-CA 3.27Å; D259-G343 WeakPolarHBondContact OD2-CA 3.43Å
344	C	92.9	Very high	95.5	Very high	24 Å²	24	23.7 Å²	23.7	16%	0.162	15%	0.146	C	C	.	.	S	Bend	trans	-114.7	115.7	174.6	-56	0	0	0	0	110.8	D259 C316 K346	D259-C344 HydrophobicContact CB-CB 3.88Å; D259-C344 VanDerWaalsContact CG-N 3.29Å; D259-C344 PolarHBondContact OD2-N 3.09Å; C316-C344 WeakPolarHBondContact CA-SG 3.35Å; C316-C344 HydrophobicContact CB-CB 3.75Å; C316-C344 WeakPolarHBondContact CB-SG 3.39Å; C316-C344 WeakPolarHBondContact SG-CB 3.5Å; C316-C344 CovalentContact SG-SG 2.03Å; C316-C344 PolarHBondContact SG-SG 2.91Å; C344-K346 VanDerWaalsContact C-N 3.29Å; C344-K346 PolarHBondContact O-N 3.21Å
345	G	93	Very high	95.5	Very high	14 Å²	14	25.4 Å²	25.4	14%	0.144	15%	0.153	C	C	.	.	S	Bend	trans	63.4	33.5	178.6	0	0	0	0	0	113.4	G311 G312 D314	G311-G345 CarbonylContact C-O 3.59Å; G311-G345 VanDerWaalsContact CA-O 3.25Å; G311-G345 WeakPolarHBondContact CA-O 3.41Å; G312-G345 PolarHBondContact N-O 2.99Å; D314-G345 VanDerWaalsContact CB-N 3.25Å; D314-G345 PolarHBondContact OD2-N 2.84Å
346	K	94.5	Very high	95.5	Very high	93 Å²	93	25.2 Å²	25.2	40%	0.404	15%	0.152	S	C	.	.			trans	-71.2	137.1	173.4	-65.5	-73.8	-176.7	172.1	0	109.8	D259 Y342 C344 G348 Y349	D259-K346 VanDerWaalsContact OD2-CE 3.3Å; D259-K346 WeakPolarHBondContact OD2-CE 3.47Å; D259-K346 IonicContact OD2-NZ 3.94Å; Y342-K346 VanDerWaalsContact O-CG 3.24Å; Y342-K346 WeakPolarHBondContact O-CG 3.11Å; C344-K346 VanDerWaalsContact C-N 3.29Å; C344-K346 PolarHBondContact O-N 3.21Å; K346-G348 PolarHBondContact O-N 3.11Å; K346-Y349 HydrophobicContact CB-CD2 4.1Å; K346-Y349 PolarHBondContact O-N 3.25Å
347	A	96	Very high	95.5	Very high	63 Å²	63	25.4 Å²	25.4	52%	0.521	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	133.7	177.6	0	0	0	0	0	110.8	E310 Y349	E310-A347 WeakPolarHBondContact O-CB 3.18Å; A347-Y349 VanDerWaalsContact O-CD2 3.29Å; A347-Y349 WeakPolarHBondContact O-CD2 3.33Å; A347-Y349 PolarHBondContact O-N 3.41Å
348	G	95	Very high	95.4	Very high	25 Å²	25	28.8 Å²	28.8	26%	0.258	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	-14.2	-175.8	0	0	0	0	0	115.4	N284 A309 K346 P350	N284-G348 WeakPolarHBondContact CB-O 3.34Å; N284-G348 PolarHBondContact ND2-O 3.07Å; A309-G348 PolarHBondContact O-N 3.08Å; K346-G348 PolarHBondContact O-N 3.11Å; G348-P350 WeakPolarHBondContact O-CD 3.34Å
349	Y	95.5	Very high	95.4	Very high	47 Å²	47	28.7 Å²	28.7	18%	0.184	17%	0.17	C	C	.	.			trans	-114.1	86.4	-177.8	-59.1	-78.3	0	0	0	110.5	N284 Y285 T287 L288 Y342 K346 A347	N284-Y349 WeakPolarHBondContact O-CE1 3.5Å; Y285-Y349 HydrophobicContact CD1-CD1 4.49Å; T287-Y349 PolarHBondContact OG1-OH 3.08Å; L288-Y349 HydrophobicContact CD1-CD1 4.24Å; L288-Y349 HydrophobicContact CD1-CE1 3.94Å; L288-Y349 HydrophobicContact CD2-CE1 3.63Å; L288-Y349 HydrophobicContact CD2-CE2 4.47Å; L288-Y349 WeakPolarHBondContact CD2-OH 3.16Å; L288-Y349 HydrophobicContact CG-CD1 4.4Å; L288-Y349 HydrophobicContact CG-CE1 3.61Å; Y342-Y349 HydrophobicContact CD1-CD1 4.22Å; Y342-Y349 AromaticContact CD1-CD2 3.72Å; Y342-Y349 HydrophobicContact CD1-CD2 3.72Å; Y342-Y349 HydrophobicContact CD1-CE1 4.46Å; Y342-Y349 AromaticContact CD1-CE2 3.97Å; Y342-Y349 HydrophobicContact CD1-CE2 3.97Å; Y342-Y349 AromaticContact CD1-CG 3.84Å; Y342-Y349 HydrophobicContact CD1-CG 3.84Å; Y342-Y349 HydrophobicContact CE1-CD2 4.33Å; Y342-Y349 HydrophobicContact CE1-CE2 4.19Å; Y342-Y349 HydrophobicContact CG-CG 4.42Å; K346-Y349 HydrophobicContact CB-CD2 4.1Å; K346-Y349 PolarHBondContact O-N 3.25Å; A347-Y349 VanDerWaalsContact O-CD2 3.29Å; A347-Y349 WeakPolarHBondContact O-CD2 3.33Å; A347-Y349 PolarHBondContact O-N 3.41Å
350	P	97.1	Very high	95.4	Very high	7 Å²	7	28.7 Å²	28.7	5%	0.045	17%	0.169	C	C	.	.			trans	-64.4	151.3	176.3	29.5	-36.1	0	0	0	110.8	V276 Y285 C305 A306 G348	V276-P350 HydrophobicContact CB-CB 4.46Å; V276-P350 HydrophobicContact CB-CG 4.28Å; V276-P350 HydrophobicContact CG1-CG 4.29Å; V276-P350 HydrophobicContact CG2-CB 3.92Å; V276-P350 HydrophobicContact CG2-CG 4.15Å; Y285-P350 HydrophobicContact CE2-CG 4.46Å; Y285-P350 WeakPolarHBondContact CE2-O 3.25Å; Y285-P350 PolarHBondContact OH-O 3.31Å; C305-P350 HydrophobicContact CB-CB 4.25Å; C305-P350 HydrophobicContact CB-CG 3.86Å; A306-P350 WeakPolarHBondContact O-CB 3.41Å; G348-P350 WeakPolarHBondContact O-CD 3.34Å
351	G	96.8	Very high	95.5	Very high	3 Å²	3	30.7 Å²	30.7	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	147.6	168.6	0	0	0	0	0	111	C305 A306 Y353	C305-G351 WeakPolarHBondContact CA-O 3.41Å; A306-G351 PolarHBondContact N-O 3.39Å; A306-G351 PolarHBondContact O-N 3.38Å; A306-G351 VanDerWaalsContact O-N 3.08Å; G351-Y353 VanDerWaalsContact C-CE2 3.46Å; G351-Y353 WeakPolarHBondContact O-CD2 3.39Å; G351-Y353 VanDerWaalsContact O-CE2 3.27Å; G351-Y353 WeakPolarHBondContact O-CE2 3.24Å
352	V	96.8	Very high	95.7	Very high	1 Å²	1	31 Å²	31	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.1	-179.1	-172.1	0	0	0	0	109.8	Y285 I299 V303 S339 F340	Y285-V352 HydrophobicContact CE2-CG2 3.92Å; I299-V352 HydrophobicContact CD1-CG2 4.05Å; V303-V352 HydrophobicContact CB-CG1 3.77Å; V303-V352 HydrophobicContact CG1-CG1 4.15Å; V303-V352 HydrophobicContact CG2-CG1 3.82Å; S339-V352 WeakPolarHBondContact CB-O 3.05Å; S339-V352 PolarHBondContact N-O 2.89Å; S339-V352 VanDerWaalsContact N-O 3.09Å; F340-V352 HydrophobicContact CD1-CB 4.02Å; F340-V352 HydrophobicContact CD1-CG1 4.16Å; F340-V352 HydrophobicContact CD2-CB 4.14Å; F340-V352 HydrophobicContact CD2-CG2 4.14Å; F340-V352 HydrophobicContact CE1-CB 3.75Å; F340-V352 HydrophobicContact CE1-CG1 3.48Å; F340-V352 VanDerWaalsContact CE1-CG1 3.48Å; F340-V352 HydrophobicContact CE1-CG2 4.33Å; F340-V352 HydrophobicContact CE2-CB 3.86Å; F340-V352 HydrophobicContact CE2-CG1 4.27Å; F340-V352 HydrophobicContact CE2-CG2 3.6Å; F340-V352 HydrophobicContact CG-CB 4.22Å; F340-V352 HydrophobicContact CZ-CB 3.67Å; F340-V352 HydrophobicContact CZ-CG1 3.56Å; F340-V352 HydrophobicContact CZ-CG2 3.73Å; F340-V352 PolarHBondContact N-O 3.29Å; F340-V352 WeakPolarHBondContact O-CA 3.34Å; F340-V352 WeakPolarHBondContact O-CB 3.3Å; F340-V352 PolarHBondContact O-N 3.39Å
353	Y	97.7	Very high	96	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.1	-172.1	-55.9	-105.8	0	0	0	109.8	V303 I304 A306 D314 L324 I337 I338 G351 R355	V303-Y353 CarbonylContact C-O 3.46Å; V303-Y353 VanDerWaalsContact CA-O 3.22Å; V303-Y353 WeakPolarHBondContact CA-O 3.36Å; V303-Y353 VanDerWaalsContact CB-O 3.32Å; V303-Y353 WeakPolarHBondContact CB-O 3.39Å; I304-Y353 PolarHBondContact N-O 2.83Å; I304-Y353 PolarHBondContact O-N 3.35Å; A306-Y353 HydrophobicContact CB-CD2 4.21Å; A306-Y353 HydrophobicContact CB-CE2 3.76Å; D314-Y353 PolarHBondContact OD1-OH 3.41Å; L324-Y353 HydrophobicContact CB-CD1 3.56Å; L324-Y353 HydrophobicContact CB-CE1 3.78Å; L324-Y353 HydrophobicContact CB-CG 4.3Å; L324-Y353 HydrophobicContact CD1-CD1 4.45Å; L324-Y353 HydrophobicContact CD1-CE1 3.95Å; L324-Y353 HydrophobicContact CD2-CD1 3.94Å; L324-Y353 HydrophobicContact CD2-CD2 4.09Å; L324-Y353 HydrophobicContact CD2-CE1 4.19Å; L324-Y353 HydrophobicContact CD2-CE2 4.41Å; L324-Y353 HydrophobicContact CD2-CG 3.89Å; L324-Y353 HydrophobicContact CG-CD1 4.19Å; L324-Y353 HydrophobicContact CG-CE1 4.19Å; I337-Y353 CarbonylContact O-C 3.57Å; I337-Y353 WeakPolarHBondContact O-CA 3.39Å; I337-Y353 WeakPolarHBondContact O-CB 3.38Å; I338-Y353 HydrophobicContact CB-CD1 4.35Å; I338-Y353 HydrophobicContact CB-CE1 4.37Å; I338-Y353 HydrophobicContact CG1-CD1 3.81Å; I338-Y353 HydrophobicContact CG1-CE1 3.52Å; G351-Y353 VanDerWaalsContact C-CE2 3.46Å; G351-Y353 WeakPolarHBondContact O-CD2 3.39Å; G351-Y353 VanDerWaalsContact O-CE2 3.27Å; G351-Y353 WeakPolarHBondContact O-CE2 3.24Å; Y353-R355 PolarHBondContact O-N 2.91Å
354	T	97.5	Very high	96.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	128.6	172.2	-60	0	0	0	0	110.1	D215 I216 G336 I337 V356 Y359	D215-T354 PolarHBondContact O-OG1 3.16Å; I216-T354 HydrophobicContact CB-CG2 4.26Å; G336-T354 VanDerWaalsContact CA-O 3.23Å; G336-T354 WeakPolarHBondContact CA-O 3.24Å; I337-T354 PolarHBondContact N-O 3.16Å; I337-T354 VanDerWaalsContact N-O 3.16Å; I337-T354 PolarHBondContact O-N 3.1Å; T354-V356 PolarHBondContact O-N 3.28Å; T354-V356 VanDerWaalsContact O-N 3.1Å; T354-Y359 HydrophobicContact CG2-CD2 3.68Å; T354-Y359 HydrophobicContact CG2-CE2 3.19Å
355	R	97.6	Very high	96.2	Very high	36 Å²	36	30.6 Å²	30.6	14%	0.136	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	95.8	-180	-177.8	178.2	-64.4	-83.9	-5.1	110.9	N278 S301 N302 V303 I304 Y353 S357 D358 Y359	N278-R355 PolarHBondContact OD1-NH2 2.9Å; N278-R355 VanDerWaalsContact OD1-NH2 3.1Å; S301-R355 PolarHBondContact O-NE 3.27Å; N302-R355 VanDerWaalsContact C-CB 3.49Å; N302-R355 VanDerWaalsContact O-CB 3.24Å; N302-R355 WeakPolarHBondContact O-CB 3.35Å; N302-R355 PolarHBondContact O-N 3.37Å; V303-R355 PolarHBondContact O-NE 3.15Å; V303-R355 PolarHBondContact O-NH2 2.94Å; I304-R355 HydrophobicContact CD1-CB 4.18Å; I304-R355 HydrophobicContact CD1-CG 4.03Å; I304-R355 HydrophobicContact CG1-CB 3.85Å; I304-R355 HydrophobicContact CG1-CG 3.93Å; Y353-R355 PolarHBondContact O-N 2.91Å; R355-S357 WeakPolarHBondContact CG-OG 3.41Å; R355-S357 PolarHBondContact O-N 2.66Å; R355-S357 VanDerWaalsContact O-N 3.13Å; R355-D358 WeakPolarHBondContact CD-OD1 3.36Å; R355-D358 WeakPolarHBondContact CD-OD2 3.41Å; R355-D358 PolarHBondContact O-N 2.87Å; R355-D358 VanDerWaalsContact O-N 3.09Å; R355-Y359 WeakPolarHBondContact O-CD2 3.29Å; R355-Y359 WeakPolarHBondContact O-CE2 3.46Å
356	V	98.1	Very high	96.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.7	-35.3	-171.3	176.9	0	0	0	0	113.1	M154 L236 P237 V334 S335 I337 T354 D358 Y359 I360 I363	M154-V356 HydrophobicContact CE-CG1 4Å; M154-V356 HydrophobicContact CE-CG2 3.79Å; M154-V356 HydrophobicContact SD-CG1 3.92Å; M154-V356 HydrophobicContact SD-CG2 4.17Å; L236-V356 HydrophobicContact CD2-CG1 3.99Å; P237-V356 HydrophobicContact CG-CB 3.97Å; P237-V356 HydrophobicContact CG-CG1 3.74Å; V334-V356 HydrophobicContact CG1-CG2 4.39Å; V334-V356 WeakPolarHBondContact O-CB 3.45Å; V334-V356 WeakPolarHBondContact O-CG2 3.43Å; S335-V356 PolarHBondContact O-N 2.94Å; I337-V356 HydrophobicContact CD1-CG2 4.17Å; I337-V356 HydrophobicContact CG1-CG2 3.7Å; T354-V356 PolarHBondContact O-N 3.28Å; T354-V356 VanDerWaalsContact O-N 3.1Å; V356-D358 PolarHBondContact O-N 3.37Å; V356-D358 VanDerWaalsContact O-N 3.17Å; V356-Y359 PolarHBondContact O-N 3.41Å; V356-I360 HydrophobicContact CG1-CD1 4.26Å; V356-I360 PolarHBondContact O-N 2.91Å; V356-I363 HydrophobicContact CG1-CD1 4.24Å
357	S	97.6	Very high	95.9	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-25	-179.5	47.2	0	0	0	0	114	S238 A239 G240 E241 R355	S238-S357 WeakPolarHBondContact O-CB 3.5Å; A239-S357 WeakPolarHBondContact CA-O 3.48Å; G240-S357 PolarHBondContact N-O 3.03Å; G240-S357 VanDerWaalsContact N-O 3.11Å; E241-S357 VanDerWaalsContact O-CB 3.32Å; E241-S357 WeakPolarHBondContact O-CB 3.21Å; E241-S357 PolarHBondContact O-OG 2.78Å; R355-S357 WeakPolarHBondContact CG-OG 3.41Å; R355-S357 PolarHBondContact O-N 2.66Å; R355-S357 VanDerWaalsContact O-N 3.13Å
358	D	97.4	Very high	94.6	Very high	70 Å²	70	33.7 Å²	33.7	37%	0.374	19%	0.187	S	C	.	.	H	α-helix	trans	-79.9	-21.2	177.3	-72.4	10.7	0	0	0	112.4	N302 R355 V356	N302-D358 WeakPolarHBondContact CA-OD2 3.43Å; R355-D358 WeakPolarHBondContact CD-OD1 3.36Å; R355-D358 WeakPolarHBondContact CD-OD2 3.41Å; R355-D358 PolarHBondContact O-N 2.87Å; R355-D358 VanDerWaalsContact O-N 3.09Å; V356-D358 PolarHBondContact O-N 3.37Å; V356-D358 VanDerWaalsContact O-N 3.17Å
359	Y	97.3	Very high	93	Very high	8 Å²	8	33.7 Å²	33.7	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-100.8	0.1	-176.7	-59	-90.2	0	0	0	113.2	H203 Y214 I216 N302 T354 R355 V356 P361 W362 I363	H203-Y359 AromaticContact CD2-CD1 3.96Å; Y214-Y359 VanDerWaalsContact CA-OH 3.24Å; Y214-Y359 WeakPolarHBondContact CA-OH 3.25Å; Y214-Y359 AromaticContact CD1-CE1 3.72Å; Y214-Y359 HydrophobicContact CD1-CE1 3.72Å; Y214-Y359 HydrophobicContact CE1-CE1 4.46Å; Y214-Y359 HydrophobicContact CG-CE1 4.39Å; Y214-Y359 PolarHBondContact N-OH 3.33Å; I216-Y359 HydrophobicContact CD1-CG 4.13Å; I216-Y359 HydrophobicContact CG2-CD1 3.61Å; I216-Y359 HydrophobicContact CG2-CE1 3.85Å; I216-Y359 HydrophobicContact CG2-CG 4.09Å; N302-Y359 HydrophobicContact CB-CE2 4.33Å; N302-Y359 VanDerWaalsContact CG-OH 3.28Å; N302-Y359 PolarHBondContact ND2-OH 3.46Å; T354-Y359 HydrophobicContact CG2-CD2 3.68Å; T354-Y359 HydrophobicContact CG2-CE2 3.19Å; R355-Y359 WeakPolarHBondContact O-CD2 3.29Å; R355-Y359 WeakPolarHBondContact O-CE2 3.46Å; V356-Y359 PolarHBondContact O-N 3.41Å; Y359-P361 VanDerWaalsContact C-CD 3.46Å; Y359-P361 VanDerWaalsContact C-N 3.31Å; Y359-W362 WeakPolarHBondContact O-CA 3.44Å; Y359-W362 WeakPolarHBondContact O-CB 3.32Å; Y359-W362 PolarHBondContact O-N 2.91Å; Y359-I363 WeakPolarHBondContact O-CG1 3.14Å; Y359-I363 PolarHBondContact O-N 2.7Å
360	I	96.6	Very high	91.1	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-52	-43	177.9	-63	-62.4	0	0	0	112.7	L236 P237 A239 V356 W362 I363 K364	L236-I360 HydrophobicContact CB-CD1 3.95Å; L236-I360 HydrophobicContact CD1-CD1 4.35Å; P237-I360 HydrophobicContact CG-CD1 4.19Å; P237-I360 VanDerWaalsContact O-CD1 3.29Å; P237-I360 WeakPolarHBondContact O-CD1 3.25Å; A239-I360 HydrophobicContact CB-CB 4.07Å; A239-I360 HydrophobicContact CB-CG2 4.15Å; V356-I360 HydrophobicContact CG1-CD1 4.26Å; V356-I360 PolarHBondContact O-N 2.91Å; I360-W362 PolarHBondContact O-N 3.41Å; I360-I363 HydrophobicContact CD1-CD1 4.35Å; I360-I363 PolarHBondContact O-N 3.34Å; I360-K364 HydrophobicContact CG2-CD 4Å; I360-K364 HydrophobicContact CG2-CG 4.43Å; I360-K364 WeakPolarHBondContact O-CB 3.37Å; I360-K364 VanDerWaalsContact O-CG 3.29Å; I360-K364 WeakPolarHBondContact O-CG 3.47Å; I360-K364 PolarHBondContact O-N 3.31Å
361	P	95.4	Very high	88.7	Confident	86 Å²	86	39.2 Å²	39.2	56%	0.558	22%	0.218	S	C	*	.	H	α-helix	trans	-60.4	-41.4	174.7	-24.5	35.8	0	0	0	113.3	Y359 G365	Y359-P361 VanDerWaalsContact C-CD 3.46Å; Y359-P361 VanDerWaalsContact C-N 3.31Å; P361-G365 PolarHBondContact O-N 3.5Å
362	W	96.3	Very high	86.3	Confident	42 Å²	42	47 Å²	47	16%	0.159	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-44.9	178.1	177.4	83.2	0	0	0	111.7	H203 I216 L218 Y359 I360 K364 G365 I366	H203-W362 HydrophobicContact CB-CZ2 4.17Å; H203-W362 AromaticContact CD2-CD1 3.69Å; H203-W362 AromaticContact CD2-CD2 3.52Å; H203-W362 AromaticContact CD2-CE2 3.52Å; H203-W362 AromaticContact CD2-CG 3.65Å; H203-W362 AromaticContact CD2-NE1 3.61Å; H203-W362 AromaticContact NE2-CD1 3.68Å; H203-W362 AromaticContact NE2-CG 3.79Å; H203-W362 AromaticContact NE2-NE1 4Å; I216-W362 HydrophobicContact CB-CZ3 4.47Å; I216-W362 HydrophobicContact CD1-CE3 4.16Å; I216-W362 HydrophobicContact CD1-CZ3 3.86Å; I216-W362 HydrophobicContact CG1-CZ3 3.79Å; I216-W362 HydrophobicContact CG2-CE3 4.24Å; I216-W362 HydrophobicContact CG2-CH2 4.43Å; I216-W362 HydrophobicContact CG2-CZ3 3.96Å; L218-W362 HydrophobicContact CB-CH2 4.4Å; L218-W362 HydrophobicContact CD1-CH2 4.37Å; L218-W362 HydrophobicContact CD1-CZ3 4.06Å; L218-W362 HydrophobicContact CD2-CZ3 4.42Å; L218-W362 HydrophobicContact CG-CH2 3.87Å; L218-W362 HydrophobicContact CG-CZ3 3.67Å; Y359-W362 WeakPolarHBondContact O-CA 3.44Å; Y359-W362 WeakPolarHBondContact O-CB 3.32Å; Y359-W362 PolarHBondContact O-N 2.91Å; I360-W362 PolarHBondContact O-N 3.41Å; W362-K364 VanDerWaalsContact C-N 3.31Å; W362-K364 PolarHBondContact O-N 2.78Å; W362-G365 PolarHBondContact O-N 2.85Å; W362-G365 VanDerWaalsContact O-N 3.13Å; W362-I366 HydrophobicContact CD2-CG1 4.31Å; W362-I366 HydrophobicContact CZ2-CG1 4.14Å; W362-I366 WeakPolarHBondContact O-CG1 3.42Å; W362-I366 PolarHBondContact O-N 3.2Å
363	I	96.5	Very high	85.8	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-57.7	-46.1	176.6	-66.2	166.7	0	0	0	110.3	I148 M154 I216 L218 L236 V356 Y359 I360 I366 A367 F370	I148-I363 HydrophobicContact CD1-CG2 3.97Å; M154-I363 HydrophobicContact SD-CD1 3.79Å; I216-I363 HydrophobicContact CD1-CD1 3.97Å; I216-I363 HydrophobicContact CD1-CG1 4.1Å; L218-I363 HydrophobicContact CD1-CG2 4.29Å; L236-I363 HydrophobicContact CD1-CG2 4.01Å; V356-I363 HydrophobicContact CG1-CD1 4.24Å; Y359-I363 WeakPolarHBondContact O-CG1 3.14Å; Y359-I363 PolarHBondContact O-N 2.7Å; I360-I363 HydrophobicContact CD1-CD1 4.35Å; I360-I363 PolarHBondContact O-N 3.34Å; I363-I366 PolarHBondContact O-N 3.07Å; I363-A367 WeakPolarHBondContact O-CB 3.19Å; I363-A367 PolarHBondContact O-N 3.35Å; I363-F370 HydrophobicContact CG2-CD2 3.95Å; I363-F370 HydrophobicContact CG2-CE2 3.54Å; I363-F370 HydrophobicContact CG2-CZ 4.46Å
364	K	93	Very high	85.1	Confident	81 Å²	81	51.8 Å²	51.8	35%	0.352	28%	0.277	S	S	.	.	H	α-helix	trans	-58.1	-47.4	174.6	-80.6	174.5	175.6	-170.8	0	112.2	I360 W362 I366 E368 F370 F372	I360-K364 HydrophobicContact CG2-CD 4Å; I360-K364 HydrophobicContact CG2-CG 4.43Å; I360-K364 WeakPolarHBondContact O-CB 3.37Å; I360-K364 VanDerWaalsContact O-CG 3.29Å; I360-K364 WeakPolarHBondContact O-CG 3.47Å; I360-K364 PolarHBondContact O-N 3.31Å; W362-K364 VanDerWaalsContact C-N 3.31Å; W362-K364 PolarHBondContact O-N 2.78Å; K364-I366 VanDerWaalsContact C-N 3.33Å; K364-I366 PolarHBondContact O-N 3.37Å; K364-E368 PolarHBondContact O-N 2.75Å; K364-E368 VanDerWaalsContact O-N 3.15Å; K364-F370 HydrophobicContact CG-CB 3.83Å; K364-F372 HydrophobicContact CD-CE2 4.46Å
365	G	94.6	Very high	84.5	Confident	57 Å²	57	54.7 Å²	54.7	59%	0.588	29%	0.292	S	S	*	.	H	α-helix	trans	-63.9	-34.7	-177.5	0	0	0	0	0	113.8	P361 W362	P361-G365 PolarHBondContact O-N 3.5Å; W362-G365 PolarHBondContact O-N 2.85Å; W362-G365 VanDerWaalsContact O-N 3.13Å
366	I	94.8	Very high	83.7	Confident	51 Å²	51	55.8 Å²	55.8	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-86.2	-44.7	179.6	-63.3	-61	0	0	0	112.2	W152 Y201 L218 W362 I363 K364 E368	W152-I366 HydrophobicContact CH2-CG2 3.98Å; W152-I366 WeakPolarHBondContact CH2-O 3.23Å; W152-I366 HydrophobicContact CZ3-CG2 3.92Å; Y201-I366 HydrophobicContact CD1-CD1 4.29Å; Y201-I366 HydrophobicContact CD1-CG2 3.85Å; Y201-I366 HydrophobicContact CD2-CG2 3.84Å; Y201-I366 HydrophobicContact CE1-CG2 4.29Å; Y201-I366 HydrophobicContact CE2-CG2 4.28Å; Y201-I366 HydrophobicContact CG-CG2 3.61Å; L218-I366 HydrophobicContact CB-CG2 4.49Å; L218-I366 HydrophobicContact CD1-CB 3.9Å; L218-I366 HydrophobicContact CD1-CG2 3.81Å; W362-I366 HydrophobicContact CD2-CG1 4.31Å; W362-I366 HydrophobicContact CZ2-CG1 4.14Å; W362-I366 WeakPolarHBondContact O-CG1 3.42Å; W362-I366 PolarHBondContact O-N 3.2Å; I363-I366 PolarHBondContact O-N 3.07Å; K364-I366 VanDerWaalsContact C-N 3.33Å; K364-I366 PolarHBondContact O-N 3.37Å; I366-E368 VanDerWaalsContact C-N 3.35Å
367	A	86.2	Confident	82.8	Confident	5 Å²	5	59.3 Å²	59.3	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-77.8	-22.9	-171.4	0	0	0	0	0	112.4	W152 L218 I363 V369 F370	W152-A367 HydrophobicContact CD2-CB 4.07Å; W152-A367 HydrophobicContact CG-CB 4.25Å; W152-A367 HydrophobicContact CZ2-CB 4.32Å; W152-A367 PolarHBondContact NE1-O 2.81Å; L218-A367 HydrophobicContact CD1-CB 4.41Å; I363-A367 WeakPolarHBondContact O-CB 3.19Å; I363-A367 PolarHBondContact O-N 3.35Å; A367-V369 HydrophobicContact CB-CG2 4.03Å; A367-V369 WeakPolarHBondContact O-CG2 3.49Å; A367-V369 PolarHBondContact O-N 3.45Å; A367-F370 HydrophobicContact CB-CD2 4.12Å; A367-F370 HydrophobicContact CB-CE2 3.79Å
368	E	69.8	Low	81.8	Confident	179 Å²	179	62.9 Å²	62.9	84%	0.836	34%	0.34	S	S	*	.			trans	55.6	1.5	-171.6	-61.7	-178.3	-175.7	0	0	114.6	K364 I366	K364-E368 PolarHBondContact O-N 2.75Å; K364-E368 VanDerWaalsContact O-N 3.15Å; I366-E368 VanDerWaalsContact C-N 3.35Å
369	V	60.3	Low	80.7	Confident	25 Å²	25	62.4 Å²	62.4	15%	0.152	34%	0.337	C	S	.	.			trans	-94.3	-11.4	-168.3	-156.5	0	0	0	0	114.8	L36 H149 W152 A367 T371	L36-V369 HydrophobicContact CD1-CG1 4.29Å; L36-V369 HydrophobicContact CD2-CG1 3.69Å; H149-V369 WeakPolarHBondContact CD2-CG1 3.44Å; H149-V369 VanDerWaalsContact NE2-CG1 3.32Å; H149-V369 WeakPolarHBondContact NE2-CG1 3.49Å; W152-V369 VanDerWaalsContact CD1-CG2 3.45Å; W152-V369 VanDerWaalsContact NE1-CG2 3.34Å; A367-V369 HydrophobicContact CB-CG2 4.03Å; A367-V369 WeakPolarHBondContact O-CG2 3.49Å; A367-V369 PolarHBondContact O-N 3.45Å; V369-T371 PolarHBondContact O-N 2.74Å
370	F	56.9	Low	79.4	Confident	26 Å²	26	66.6 Å²	66.6	11%	0.114	36%	0.361	C	S	.	.			trans	-108.9	71.2	-165.6	-59.3	-70.3	0	0	0	112.6	I148 L236 I363 K364 A367 F372	I148-F370 HydrophobicContact CB-CZ 4.24Å; I148-F370 HydrophobicContact CD1-CE2 4.01Å; I148-F370 HydrophobicContact CD1-CZ 3.84Å; I148-F370 HydrophobicContact CG1-CZ 4.15Å; L236-F370 HydrophobicContact CD1-CD1 4.5Å; L236-F370 HydrophobicContact CD1-CE1 3.97Å; L236-F370 HydrophobicContact CD1-CE2 4.07Å; L236-F370 HydrophobicContact CD1-CZ 3.73Å; I363-F370 HydrophobicContact CG2-CD2 3.95Å; I363-F370 HydrophobicContact CG2-CE2 3.54Å; I363-F370 HydrophobicContact CG2-CZ 4.46Å; K364-F370 HydrophobicContact CG-CB 3.83Å; A367-F370 HydrophobicContact CB-CD2 4.12Å; A367-F370 HydrophobicContact CB-CE2 3.79Å; F370-F372 HydrophobicContact CB-CD2 4.08Å; F370-F372 HydrophobicContact CB-CE2 3.63Å; F370-F372 HydrophobicContact CB-CZ 4.4Å; F370-F372 HydrophobicContact CD1-CE2 4.44Å; F370-F372 HydrophobicContact CD1-CZ 4.41Å; F370-F372 HydrophobicContact CG-CE2 4.28Å
371	T	46.2	Very low	78	Confident	143 Å²	143	71.8 Å²	71.8	88%	0.877	39%	0.389	S	S	*	.			trans	-80.6	107.6	153.1	48.7	0	0	0	0	107.4	V369	V369-T371 PolarHBondContact O-N 2.74Å
372	F	45.8	Very low	76.4	Confident	166 Å²	166	70.5 Å²	70.5	73%	0.728	37%	0.374	S	S	*	.			trans	-83.8	0	178.6	-76	-94.4	0	0	0	111.5	K364 F370	K364-F372 HydrophobicContact CD-CE2 4.46Å; F370-F372 HydrophobicContact CB-CD2 4.08Å; F370-F372 HydrophobicContact CB-CE2 3.63Å; F370-F372 HydrophobicContact CB-CZ 4.4Å; F370-F372 HydrophobicContact CD1-CE2 4.44Å; F370-F372 HydrophobicContact CD1-CZ 4.41Å; F370-F372 HydrophobicContact CG-CE2 4.28Å

Retrieved 372 of 372 residues in 315.5 ms (Link to these results)

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