A0A096NRQ5_PAPAN Loading...

Complement component C8 gamma chain

Component of the membrane attack complex (MAC), a multiprotein complex activated by the complement cascade, which inserts into a target cell membrane and forms a pore, leading to target cell membrane rupture and cell lysis. The MAC is initiated by proteolytic cleavage of C5 into complement C5b in response to the classical, alternative, lectin and GZMK complement pathways. The complement pathways consist in a cascade of proteins that leads to phagocytosis and breakdown of pathogens and signaling that strengthens the adaptive immune system. C8G, together with C8A and C8B, inserts into the target membrane, but does not form pores by itself. During MAC assembly, associates with C5b, C6 and C7 to form the C5b8 intermediate complex that inserts into the target membrane and traverses the bilayer increasing membrane rigidity.

AlphaFold DB (F7GRA6), UniProt , Accession A0A096NRQ5, Species PAPAN (Papio anubis, Olive baboon), Gene C8G, Length 202 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	46.8	Very low	242 Å²	242	140.5 Å²	140.5	100%	1.192	82%	0.82	S	S	*	*				0	95.9	0	-72.5	-179.5	158.9	0	0	107.5
2	L	34.8	Very low	46.7	Very low	172 Å²	172	141.6 Å²	141.6	90%	0.901	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-97.7	131.6	174.6	-91.5	101.4	0	0	0	108.8
3	P	49.8	Very low	46.7	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-88.3	158.6	164.2	34.5	-27.9	0	0	0	111.3
4	P	47.8	Very low	46.8	Very low	134 Å²	134	142.2 Å²	142.2	87%	0.87	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-99.4	160.3	-177.6	38.1	-30.2	0	0	0	112.5
5	G	45.1	Very low	47	Very low	61 Å²	61	141.8 Å²	141.8	63%	0.629	81%	0.813	S	S	*	*			trans	164.8	101.8	165.2	0	0	0	0	0	110.9
6	T	45.8	Very low	47.3	Very low	149 Å²	149	138.8 Å²	138.8	91%	0.914	81%	0.81	S	S	*	*				55.9	128	104.2	49.1	0	0	0	0	113.2
7	A	48.4	Very low	47.2	Very low	92 Å²	92	135.4 Å²	135.4	76%	0.76	81%	0.811	S	S	*	*			cis	-156.5	148.3	26.2	0	0	0	0	0	110.3
8	I	52.5	Low	47.6	Very low	154 Å²	154	134.1 Å²	134.1	79%	0.79	81%	0.81	S	S	*	*			trans	-75.8	119.6	173.9	-65.1	168.1	0	0	0	108.3	L10	I8-L10 HydrophobicContact CG2-CD1 3.82Å
9	L	47.9	Very low	47.9	Very low	150 Å²	150	136.1 Å²	136.1	79%	0.785	81%	0.814	S	S	*	*			trans	-90.8	101.9	169.9	-133.2	99.2	0	0	0	108.6	I11	L9-I11 HydrophobicContact CD2-CD1 4.11Å; L9-I11 HydrophobicContact CD2-CG1 4.05Å
10	L	47.4	Very low	48.1	Very low	136 Å²	136	132.9 Å²	132.9	71%	0.712	81%	0.811	S	S	*	*			trans	-88.3	106.5	165.9	-102.9	116.7	0	0	0	108.6	I8 L12	I8-L10 HydrophobicContact CG2-CD1 3.82Å; L10-L12 HydrophobicContact CD2-CD1 3.93Å
11	I	55.2	Low	48.7	Very low	140 Å²	140	135.4 Å²	135.4	72%	0.718	81%	0.814	S	S	*	*			trans	-89.8	105.4	165.8	-60	174.7	0	0	0	106.8	L9	L9-I11 HydrophobicContact CD2-CD1 4.11Å; L9-I11 HydrophobicContact CD2-CG1 4.05Å
12	L	46.5	Very low	49.8	Very low	153 Å²	153	135 Å²	135	80%	0.801	80%	0.799	S	S	*	*			trans	-100.7	124.1	170.4	-97.9	151.2	0	0	0	109.8	L10	L10-L12 HydrophobicContact CD2-CD1 3.93Å
13	L	46.8	Very low	50.9	Low	139 Å²	139	132.6 Å²	132.6	73%	0.728	79%	0.794	S	S	*	*			trans	-81.1	157.1	178.9	-94.6	141.3	0	0	0	112.2
14	L	47.8	Very low	51.7	Low	153 Å²	153	136.2 Å²	136.2	80%	0.801	80%	0.8	S	S	*	*			trans	86.9	129.6	160.3	-55	143.6	0	0	0	115.4
15	T	49.5	Very low	52.5	Low	136 Å²	136	141 Å²	141	83%	0.834	80%	0.801	S	S	*	*				-160.2	147.4	65.8	40.8	0	0	0	0	112.6
16	A	51.7	Low	53.5	Low	94 Å²	94	143.1 Å²	143.1	78%	0.777	80%	0.804	S	S	*	*			trans	-56.7	133.4	177	0	0	0	0	0	112.5	S18	A16-S18 PolarHBondContact O-N 2.79Å
17	G	46.3	Very low	54.4	Low	80 Å²	80	142 Å²	142	83%	0.825	80%	0.799	S	S	*	*			trans	-65.8	101.8	167.9	0	0	0	0	0	110.3	L19	G17-L19 PolarHBondContact O-N 2.91Å
18	S	53.8	Low	55.3	Low	112 Å²	112	148.7 Å²	148.7	78%	0.783	81%	0.805	S	S	*	*			trans	-72.4	109.5	164.3	45.7	0	0	0	0	108.3	A16 G20	A16-S18 PolarHBondContact O-N 2.79Å; S18-G20 VanDerWaalsContact C-N 3.26Å; S18-G20 PolarHBondContact O-N 3.23Å
19	L	53.2	Low	56	Low	172 Å²	172	146.4 Å²	146.4	90%	0.901	80%	0.8	S	S	*	*			trans	-57.7	96.7	158.2	-95.3	124.2	0	0	0	107.2	G17 Q21	G17-L19 PolarHBondContact O-N 2.91Å; L19-Q21 PolarHBondContact O-N 2.78Å
20	G	52.4	Low	57.3	Low	72 Å²	72	144.8 Å²	144.8	74%	0.742	80%	0.799	S	S	*	*			trans	-60.4	101.9	172.1	0	0	0	0	0	108.9	S18 R22	S18-G20 VanDerWaalsContact C-N 3.26Å; S18-G20 PolarHBondContact O-N 3.23Å; G20-R22 PolarHBondContact O-N 3.12Å
21	Q	61.1	Low	59.2	Low	186 Å²	186	140.3 Å²	140.3	87%	0.869	78%	0.779	S	S	*	*			trans	-59.2	113.8	162.2	-74.1	-170.8	-1.6	0	0	106.8	L19 P23	L19-Q21 PolarHBondContact O-N 2.78Å; Q21-P23 WeakPolarHBondContact O-CD 3.3Å; Q21-P23 VanDerWaalsContact O-N 3.13Å
22	R	62	Low	60.9	Low	234 Å²	234	135.8 Å²	135.8	88%	0.883	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-52.2	121.1	170.2	-116.9	178.4	-178.3	177.2	1.5	106.7	G20 Q24	G20-R22 PolarHBondContact O-N 3.12Å; R22-Q24 PolarHBondContact O-N 3.32Å
23	P	58.6	Low	63.3	Low	122 Å²	122	128.7 Å²	128.7	79%	0.792	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-55.6	118.1	176.2	18.1	-28	0	0	0	108.1	Q21 R25	Q21-P23 WeakPolarHBondContact O-CD 3.3Å; Q21-P23 VanDerWaalsContact O-N 3.13Å; P23-R25 PolarHBondContact O-N 3.3Å; P23-R25 VanDerWaalsContact O-N 3.12Å
24	Q	65.6	Low	65.6	Low	191 Å²	191	124.9 Å²	124.9	89%	0.893	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-58.3	118.9	173.8	-83.6	176.6	-24.9	0	0	107.2	R22	R22-Q24 PolarHBondContact O-N 3.32Å
25	R	64.8	Low	67.8	Low	234 Å²	234	122.5 Å²	122.5	88%	0.883	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-60.3	128.4	178.1	-159.2	175.6	-156.9	167	5.9	107.3	P23	P23-R25 PolarHBondContact O-N 3.3Å; P23-R25 VanDerWaalsContact O-N 3.12Å
26	P	65.6	Low	70.1	Confident	106 Å²	106	117.4 Å²	117.4	69%	0.688	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-54.6	145.3	179.5	17.4	-28.5	0	0	0	110.4	R28	P26-R28 PolarHBondContact O-N 3.28Å
27	P	65.8	Low	72.3	Confident	125 Å²	125	119.9 Å²	119.9	81%	0.812	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-53.1	131.8	179.4	-20.2	29	0	0	0	109.8
28	R	66.1	Low	74.8	Confident	233 Å²	233	117.5 Å²	117.5	88%	0.879	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-64	133	176.4	-156.6	176.1	-151.7	161.1	3.9	107.7	P26	P26-R28 PolarHBondContact O-N 3.28Å
29	P	68.4	Low	76.9	Confident	107 Å²	107	115.1 Å²	115.1	70%	0.695	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-54.8	145.4	175.4	20.8	-31.2	0	0	0	110
30	P	75.8	Confident	79	Confident	116 Å²	116	110.6 Å²	110.6	75%	0.753	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-58.5	142.7	179.4	23.8	-31.5	0	0	0	110.2	A32	P30-A32 PolarHBondContact O-N 3.36Å
31	S	87.1	Confident	81.2	Confident	42 Å²	42	114 Å²	114	29%	0.294	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-60.9	131.3	178.4	161.2	0	0	0	0	109.9	I33 S34 E141	S31-I33 VanDerWaalsContact C-N 3.29Å; S31-I33 PolarHBondContact O-N 3.44Å; S31-I33 VanDerWaalsContact OG-CG2 3.31Å; S31-I33 WeakPolarHBondContact OG-CG2 3.3Å; S31-S34 VanDerWaalsContact O-CB 3.29Å; S31-S34 WeakPolarHBondContact O-CB 3.49Å; S31-S34 PolarHBondContact O-N 3.49Å; S31-S34 VanDerWaalsContact O-N 3.11Å; S31-S34 PolarHBondContact O-OG 3.35Å; S31-E141 WeakPolarHBondContact CB-OE1 3.49Å; S31-E141 PolarHBondContact OG-OE1 2.92Å; S31-E141 PolarHBondContact OG-OE2 3.06Å
32	A	91.2	Very high	83	Confident	44 Å²	44	105.7 Å²	105.7	36%	0.364	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-63.7	-35.6	-176.6	0	0	0	0	0	111.6	P30 S34 T35 E141 L146	P30-A32 PolarHBondContact O-N 3.36Å; A32-S34 PolarHBondContact O-N 2.81Å; A32-T35 PolarHBondContact O-N 3.01Å; A32-T35 PolarHBondContact O-OG1 3.41Å; A32-E141 WeakPolarHBondContact CA-OE2 3.49Å; A32-E141 PolarHBondContact N-OE2 2.87Å; A32-L146 HydrophobicContact CB-CB 4.44Å; A32-L146 HydrophobicContact CB-CD2 4.36Å
33	I	95.6	Very high	84.7	Confident	4 Å²	4	97.1 Å²	97.1	2%	0.021	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-70	-13.7	177.9	-160.2	164.5	0	0	0	113.7	S31 T35 I36 R111 H124 V126 Y139 E141 L146	S31-I33 VanDerWaalsContact C-N 3.29Å; S31-I33 PolarHBondContact O-N 3.44Å; S31-I33 VanDerWaalsContact OG-CG2 3.31Å; S31-I33 WeakPolarHBondContact OG-CG2 3.3Å; I33-T35 VanDerWaalsContact C-N 3.27Å; I33-T35 PolarHBondContact O-N 3.32Å; I33-I36 HydrophobicContact CG1-CG1 4.36Å; I33-I36 PolarHBondContact O-N 3.42Å; I33-R111 PolarHBondContact O-NH1 3.13Å; I33-H124 HydrophobicContact CD1-CB 4.17Å; I33-H124 HydrophobicContact CG2-CB 3.86Å; I33-V126 HydrophobicContact CD1-CB 4.34Å; I33-V126 HydrophobicContact CD1-CG2 3.76Å; I33-V126 HydrophobicContact CG1-CB 4.35Å; I33-V126 HydrophobicContact CG1-CG2 3.58Å; I33-Y139 WeakPolarHBondContact CD1-O 3.48Å; I33-E141 HydrophobicContact CB-CB 3.75Å; I33-E141 HydrophobicContact CD1-CB 4.04Å; I33-E141 HydrophobicContact CG2-CB 3.64Å; I33-E141 HydrophobicContact CG2-CG 4.33Å; I33-E141 PolarHBondContact N-OE2 2.82Å; I33-L146 HydrophobicContact CB-CD1 3.85Å; I33-L146 HydrophobicContact CD1-CD1 4.33Å; I33-L146 HydrophobicContact CG1-CD1 4.12Å
34	S	94.5	Very high	86.6	Confident	60 Å²	60	92.4 Å²	92.4	42%	0.42	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-65.5	-29.9	177.7	70.6	0	0	0	0	112.6	S31 A32 R111	S31-S34 VanDerWaalsContact O-CB 3.29Å; S31-S34 WeakPolarHBondContact O-CB 3.49Å; S31-S34 PolarHBondContact O-N 3.49Å; S31-S34 VanDerWaalsContact O-N 3.11Å; S31-S34 PolarHBondContact O-OG 3.35Å; A32-S34 PolarHBondContact O-N 2.81Å; S34-R111 PolarHBondContact O-NH2 3.01Å
35	T	95	Very high	88.1	Confident	103 Å²	103	89.8 Å²	89.8	63%	0.632	49%	0.49	S	S	*	.	S	Bend	trans	-82.8	-15.3	-179.8	62.4	0	0	0	0	113.2	A32 I33 Q37	A32-T35 PolarHBondContact O-N 3.01Å; A32-T35 PolarHBondContact O-OG1 3.41Å; I33-T35 VanDerWaalsContact C-N 3.27Å; I33-T35 PolarHBondContact O-N 3.32Å; T35-Q37 PolarHBondContact O-N 2.98Å
36	I	97.9	Very high	89.7	Confident	28 Å²	28	83.5 Å²	83.5	14%	0.144	47%	0.471	C	S	.	.	S	Bend	trans	-72.1	125	179.9	-55.6	-57.3	0	0	0	109.8	I33 R111 V126 A128 Y139	I33-I36 HydrophobicContact CG1-CG1 4.36Å; I33-I36 PolarHBondContact O-N 3.42Å; I36-R111 PolarHBondContact O-NH2 3.34Å; I36-V126 HydrophobicContact CG2-CB 4.42Å; I36-V126 HydrophobicContact CG2-CG1 4.05Å; I36-A128 HydrophobicContact CG2-CB 4.03Å; I36-Y139 HydrophobicContact CD1-CD1 3.87Å; I36-Y139 HydrophobicContact CD1-CE1 3.72Å; I36-Y139 HydrophobicContact CD1-CG 4.4Å; I36-Y139 HydrophobicContact CG1-CD1 3.92Å; I36-Y139 HydrophobicContact CG1-CE1 4.29Å; I36-Y139 HydrophobicContact CG1-CG 4.11Å; I36-Y139 HydrophobicContact CG2-CD1 4.34Å; I36-Y139 HydrophobicContact CG2-CD2 3.59Å; I36-Y139 HydrophobicContact CG2-CE2 3.97Å; I36-Y139 HydrophobicContact CG2-CG 3.79Å
37	Q	97.9	Very high	91.3	Very high	147 Å²	147	78.8 Å²	78.8	69%	0.687	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-78.6	128.2	178.3	-60.8	-58.9	-23.7	0	0	110.6	T35	T35-Q37 PolarHBondContact O-N 2.98Å
38	P	98.4	Very high	92.9	Very high	29 Å²	29	74 Å²	74	19%	0.188	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-70.6	158.5	171.3	30.5	-33.6	0	0	0	110.8	A40 V108 L109 R111 V126 V127	P38-A40 PolarHBondContact O-N 3.38Å; P38-A40 VanDerWaalsContact O-N 3.12Å; P38-V108 HydrophobicContact CG-CG1 4.28Å; P38-L109 WeakPolarHBondContact CB-O 3.41Å; P38-R111 HydrophobicContact CB-CG 4.24Å; P38-R111 HydrophobicContact CG-CG 4.34Å; P38-V126 HydrophobicContact CB-CG1 3.94Å; P38-V127 CarbonylContact C-O 3.54Å; P38-V127 WeakPolarHBondContact CA-O 3.49Å
39	K	98.4	Very high	94.4	Very high	63 Å²	63	64.4 Å²	64.4	27%	0.274	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-51.1	120	169.4	171.5	66.6	-179.8	-162.3	0	109.1	N41 F42 V127 A128 T130	K39-N41 PolarHBondContact O-N 3.02Å; K39-F42 HydrophobicContact CB-CB 4.29Å; K39-F42 HydrophobicContact CB-CD2 4.34Å; K39-F42 HydrophobicContact CG-CB 4.41Å; K39-F42 HydrophobicContact CG-CD2 4.47Å; K39-F42 PolarHBondContact O-N 2.8Å; K39-F42 VanDerWaalsContact O-N 3.12Å; K39-V127 PolarHBondContact N-O 3.38Å; K39-A128 WeakPolarHBondContact CA-O 3.28Å; K39-A128 PolarHBondContact N-O 2.98Å; K39-T130 HydrophobicContact CD-CG2 4.29Å; K39-T130 WeakPolarHBondContact CE-O 3.34Å; K39-T130 HydrophobicContact CG-CG2 4.08Å; K39-T130 PolarHBondContact NZ-O 3.31Å
40	A	97.8	Very high	95.8	Very high	76 Å²	76	61.4 Å²	61.4	63%	0.628	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	130.2	175.8	0	0	0	0	0	110.3	P38 F42	P38-A40 PolarHBondContact O-N 3.38Å; P38-A40 VanDerWaalsContact O-N 3.12Å; A40-F42 VanDerWaalsContact C-N 3.26Å; A40-F42 PolarHBondContact O-N 3.27Å
41	N	97.3	Very high	96.9	Very high	143 Å²	143	56 Å²	56	77%	0.765	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	46.6	-177	-54	-42.3	0	0	0	112.4	K39 D43	K39-N41 PolarHBondContact O-N 3.02Å; N41-D43 PolarHBondContact O-N 3.09Å
42	F	98.5	Very high	97.5	Very high	13 Å²	13	55 Å²	55	6%	0.057	32%	0.32	C	S	.	.			trans	-49.3	126.7	177.2	174.2	-95.4	0	0	0	111.3	K39 A40 A44 F47 M84 L109 F112 V127 Y132	K39-F42 HydrophobicContact CB-CB 4.29Å; K39-F42 HydrophobicContact CB-CD2 4.34Å; K39-F42 HydrophobicContact CG-CB 4.41Å; K39-F42 HydrophobicContact CG-CD2 4.47Å; K39-F42 PolarHBondContact O-N 2.8Å; K39-F42 VanDerWaalsContact O-N 3.12Å; A40-F42 VanDerWaalsContact C-N 3.26Å; A40-F42 PolarHBondContact O-N 3.27Å; F42-A44 HydrophobicContact CE1-CB 3.94Å; F42-F47 HydrophobicContact CE2-CB 3.72Å; F42-F47 HydrophobicContact CE2-CD1 4.15Å; F42-F47 AromaticContact CE2-CD2 3.81Å; F42-F47 HydrophobicContact CE2-CD2 3.81Å; F42-F47 HydrophobicContact CE2-CE2 4.49Å; F42-F47 AromaticContact CE2-CG 3.61Å; F42-F47 HydrophobicContact CE2-CG 3.61Å; F42-F47 HydrophobicContact CZ-CB 3.59Å; F42-F47 AromaticContact CZ-CD1 3.86Å; F42-F47 HydrophobicContact CZ-CD1 3.86Å; F42-F47 HydrophobicContact CZ-CD2 4.33Å; F42-F47 AromaticContact CZ-CG 3.66Å; F42-F47 HydrophobicContact CZ-CG 3.66Å; F42-M84 HydrophobicContact CE1-SD 4.03Å; F42-M84 HydrophobicContact CZ-CE 4.41Å; F42-M84 HydrophobicContact CZ-SD 3.8Å; F42-L109 HydrophobicContact CB-CB 4.31Å; F42-F112 HydrophobicContact CD1-CZ 4.09Å; F42-F112 HydrophobicContact CE1-CE2 4.08Å; F42-F112 AromaticContact CE1-CZ 3.58Å; F42-F112 HydrophobicContact CE1-CZ 3.58Å; F42-F112 HydrophobicContact CZ-CE2 4.37Å; F42-F112 HydrophobicContact CZ-CZ 4.22Å; F42-V127 HydrophobicContact CD2-CB 4.03Å; F42-V127 HydrophobicContact CD2-CG1 3.96Å; F42-V127 HydrophobicContact CD2-CG2 4.44Å; F42-V127 HydrophobicContact CE2-CB 3.93Å; F42-V127 HydrophobicContact CE2-CG1 3.78Å; F42-V127 HydrophobicContact CE2-CG2 3.9Å; F42-V127 HydrophobicContact CZ-CG2 4.28Å; F42-Y132 WeakPolarHBondContact CA-OH 3.23Å; F42-Y132 HydrophobicContact CD2-CE1 4.23Å; F42-Y132 HydrophobicContact CE2-CE1 4.27Å
43	D	98.4	Very high	97.8	Very high	53 Å²	53	53.2 Å²	53.2	28%	0.283	30%	0.304	S	S	.	.			trans	-112.8	108.9	-179.9	-175	-20	0	0	0	110.1	N41 Q45 Q46 F47 Y132	N41-D43 PolarHBondContact O-N 3.09Å; D43-Q45 VanDerWaalsContact C-N 3.25Å; D43-Q45 PolarHBondContact O-N 3.45Å; D43-Q45 WeakPolarHBondContact OD1-CA 3.18Å; D43-Q45 VanDerWaalsContact OD1-CB 3.27Å; D43-Q45 WeakPolarHBondContact OD1-CB 3.28Å; D43-Q45 PolarHBondContact OD1-N 3.04Å; D43-Q46 HydrophobicContact CB-CB 4.18Å; D43-Q46 HydrophobicContact CB-CG 4.23Å; D43-Q46 PolarHBondContact O-N 3.12Å; D43-Q46 PolarHBondContact OD1-N 2.99Å; D43-Q46 WeakPolarHBondContact OD2-CG 3.5Å; D43-Q46 PolarHBondContact OD2-NE2 3.02Å; D43-F47 WeakPolarHBondContact O-CB 3.35Å; D43-F47 PolarHBondContact O-N 2.72Å; D43-Y132 PolarHBondContact N-OH 2.79Å; D43-Y132 VanDerWaalsContact N-OH 3.09Å
44	A	97.9	Very high	98	Very high	24 Å²	24	53.7 Å²	53.7	20%	0.198	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-30.1	179.3	0	0	0	0	0	112.7	F42 F47 A48 P79 M84	F42-A44 HydrophobicContact CE1-CB 3.94Å; A44-F47 PolarHBondContact O-N 2.82Å; A44-A48 PolarHBondContact O-N 3.12Å; A44-P79 HydrophobicContact CB-CB 4.27Å; A44-P79 HydrophobicContact CB-CG 4.2Å; A44-P79 WeakPolarHBondContact O-CG 3.34Å; A44-M84 HydrophobicContact CB-CG 4.38Å; A44-M84 HydrophobicContact CB-SD 4.44Å
45	Q	98.3	Very high	98.2	Very high	135 Å²	135	50.8 Å²	50.8	63%	0.631	29%	0.287	S	S	*	.	H	α-helix	trans	-69	-44.6	179.1	-60.7	-62.7	-30.7	0	0	110.7	D43 F47 A48 P79	D43-Q45 VanDerWaalsContact C-N 3.25Å; D43-Q45 PolarHBondContact O-N 3.45Å; D43-Q45 WeakPolarHBondContact OD1-CA 3.18Å; D43-Q45 VanDerWaalsContact OD1-CB 3.27Å; D43-Q45 WeakPolarHBondContact OD1-CB 3.28Å; D43-Q45 PolarHBondContact OD1-N 3.04Å; Q45-F47 VanDerWaalsContact C-N 3.3Å; Q45-F47 PolarHBondContact O-N 3.07Å; Q45-A48 VanDerWaalsContact O-CB 3.27Å; Q45-A48 WeakPolarHBondContact O-CB 3.27Å; Q45-A48 PolarHBondContact O-N 2.86Å; Q45-P79 VanDerWaalsContact NE2-CB 3.34Å
46	Q	98.6	Very high	98.3	Very high	102 Å²	102	46.1 Å²	46.1	48%	0.477	26%	0.258	S	S	.	.	H	α-helix	trans	-67.8	-33.3	174.6	-68.3	-179.3	67.6	0	0	112	D43 A48 Y132 R153	D43-Q46 HydrophobicContact CB-CB 4.18Å; D43-Q46 HydrophobicContact CB-CG 4.23Å; D43-Q46 PolarHBondContact O-N 3.12Å; D43-Q46 PolarHBondContact OD1-N 2.99Å; D43-Q46 WeakPolarHBondContact OD2-CG 3.5Å; D43-Q46 PolarHBondContact OD2-NE2 3.02Å; Q46-A48 VanDerWaalsContact C-N 3.28Å; Q46-A48 PolarHBondContact O-N 2.81Å; Q46-Y132 HydrophobicContact CB-CD1 3.76Å; Q46-Y132 HydrophobicContact CB-CD2 4.04Å; Q46-Y132 HydrophobicContact CB-CE1 4.24Å; Q46-Y132 HydrophobicContact CB-CE2 4.47Å; Q46-Y132 HydrophobicContact CB-CG 3.64Å; Q46-R153 PolarHBondContact O-NH2 3.46Å; Q46-R153 VanDerWaalsContact O-NH2 3.08Å
47	F	98.7	Very high	98.4	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-75.4	-14.9	177.8	-163.9	-102.9	0	0	0	114	F42 D43 A44 Q45 W51 V77 M84 V127 T130 Y132 A136 L138 R153	F42-F47 HydrophobicContact CE2-CB 3.72Å; F42-F47 HydrophobicContact CE2-CD1 4.15Å; F42-F47 AromaticContact CE2-CD2 3.81Å; F42-F47 HydrophobicContact CE2-CD2 3.81Å; F42-F47 HydrophobicContact CE2-CE2 4.49Å; F42-F47 AromaticContact CE2-CG 3.61Å; F42-F47 HydrophobicContact CE2-CG 3.61Å; F42-F47 HydrophobicContact CZ-CB 3.59Å; F42-F47 AromaticContact CZ-CD1 3.86Å; F42-F47 HydrophobicContact CZ-CD1 3.86Å; F42-F47 HydrophobicContact CZ-CD2 4.33Å; F42-F47 AromaticContact CZ-CG 3.66Å; F42-F47 HydrophobicContact CZ-CG 3.66Å; D43-F47 WeakPolarHBondContact O-CB 3.35Å; D43-F47 PolarHBondContact O-N 2.72Å; A44-F47 PolarHBondContact O-N 2.82Å; Q45-F47 VanDerWaalsContact C-N 3.3Å; Q45-F47 PolarHBondContact O-N 3.07Å; F47-W51 AromaticContact CD2-CZ2 3.68Å; F47-W51 HydrophobicContact CD2-CZ2 3.68Å; F47-W51 AromaticContact CE1-NE1 3.88Å; F47-W51 AromaticContact CE2-CE2 3.8Å; F47-W51 HydrophobicContact CE2-CH2 4.34Å; F47-W51 AromaticContact CE2-CZ2 3.58Å; F47-W51 HydrophobicContact CE2-CZ2 3.58Å; F47-W51 AromaticContact CE2-NE1 3.99Å; F47-W51 HydrophobicContact CG-CZ2 4.43Å; F47-W51 AromaticContact CZ-CE2 3.99Å; F47-W51 HydrophobicContact CZ-CZ2 4.25Å; F47-W51 AromaticContact CZ-NE1 3.83Å; F47-W51 PolarHBondContact O-NE1 3.29Å; F47-V77 HydrophobicContact CD1-CG1 4.11Å; F47-V77 HydrophobicContact CE1-CG1 4.46Å; F47-V77 HydrophobicContact CE1-CG2 4.28Å; F47-M84 HydrophobicContact CD1-CE 4.48Å; F47-M84 HydrophobicContact CD1-SD 3.94Å; F47-V127 HydrophobicContact CD2-CG1 4.46Å; F47-V127 HydrophobicContact CE2-CG1 4.01Å; F47-V127 HydrophobicContact CZ-CG1 4.42Å; F47-V127 HydrophobicContact CZ-CG2 4.31Å; F47-T130 HydrophobicContact CD2-CG2 4.28Å; F47-T130 HydrophobicContact CE2-CG2 4.48Å; F47-Y132 HydrophobicContact CB-CD1 4.01Å; F47-Y132 HydrophobicContact CB-CE1 4.23Å; F47-Y132 HydrophobicContact CD2-CD1 4.12Å; F47-Y132 HydrophobicContact CD2-CE1 4.48Å; F47-A136 HydrophobicContact CE2-CB 3.61Å; F47-A136 HydrophobicContact CZ-CB 4.09Å; F47-L138 HydrophobicContact CZ-CD1 4.11Å; F47-R153 PolarHBondContact O-NH2 2.95Å
48	A	98.6	Very high	98.3	Very high	25 Å²	25	38.4 Å²	38.4	21%	0.207	22%	0.223	C	C	.	.			trans	-60.3	162.5	-178.8	0	0	0	0	0	113.1	A44 Q45 Q46 V77 P79 R153	A44-A48 PolarHBondContact O-N 3.12Å; Q45-A48 VanDerWaalsContact O-CB 3.27Å; Q45-A48 WeakPolarHBondContact O-CB 3.27Å; Q45-A48 PolarHBondContact O-N 2.86Å; Q46-A48 VanDerWaalsContact C-N 3.28Å; Q46-A48 PolarHBondContact O-N 2.81Å; A48-V77 WeakPolarHBondContact CA-O 3.24Å; A48-P79 HydrophobicContact CB-CG 4.02Å; A48-R153 VanDerWaalsContact O-CZ 3.25Å; A48-R153 PolarHBondContact O-NH1 2.87Å; A48-R153 PolarHBondContact O-NH2 2.81Å
49	G	98.3	Very high	98.2	Very high	31 Å²	31	38.6 Å²	38.6	32%	0.32	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	98	-158.1	178	0	0	0	0	0	113.5	V77	G49-V77 PolarHBondContact N-O 2.87Å; G49-V77 PolarHBondContact O-N 3.22Å
50	T	98.6	Very high	98	Very high	44 Å²	44	38.5 Å²	38.5	27%	0.27	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139.6	-170.9	-49.9	0	0	0	0	112.1	T74 L75 H76 R153	T50-T74 HydrophobicContact CG2-CG2 3.39Å; T50-L75 CarbonylContact C-O 3.58Å; T50-L75 VanDerWaalsContact CA-O 3.3Å; T50-L75 WeakPolarHBondContact CA-O 3.27Å; T50-H76 PolarHBondContact OG1-CE1 3.43Å; T50-H76 PolarHBondContact OG1-ND1 3.02Å; T50-R153 WeakPolarHBondContact O-CD 3.49Å; T50-R153 PolarHBondContact O-NH1 3.17Å
51	W	98.7	Very high	97.7	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	130.5	175.6	-71.8	101.1	0	0	0	110.3	F47 T74 L75 F135 A136 Y151 R153	F47-W51 AromaticContact CD2-CZ2 3.68Å; F47-W51 HydrophobicContact CD2-CZ2 3.68Å; F47-W51 AromaticContact CE1-NE1 3.88Å; F47-W51 AromaticContact CE2-CE2 3.8Å; F47-W51 HydrophobicContact CE2-CH2 4.34Å; F47-W51 AromaticContact CE2-CZ2 3.58Å; F47-W51 HydrophobicContact CE2-CZ2 3.58Å; F47-W51 AromaticContact CE2-NE1 3.99Å; F47-W51 HydrophobicContact CG-CZ2 4.43Å; F47-W51 AromaticContact CZ-CE2 3.99Å; F47-W51 HydrophobicContact CZ-CZ2 4.25Å; F47-W51 AromaticContact CZ-NE1 3.83Å; F47-W51 PolarHBondContact O-NE1 3.29Å; W51-T74 CarbonylContact O-C 3.58Å; W51-T74 WeakPolarHBondContact O-CA 3.43Å; W51-L75 HydrophobicContact CB-CB 4.15Å; W51-L75 PolarHBondContact N-O 3.4Å; W51-L75 PolarHBondContact O-N 3.35Å; W51-F135 VanDerWaalsContact CZ3-C 3.48Å; W51-A136 HydrophobicContact CE3-CB 4.33Å; W51-A136 HydrophobicContact CH2-CB 3.96Å; W51-A136 HydrophobicContact CZ2-CB 4.37Å; W51-A136 HydrophobicContact CZ3-CB 3.95Å; W51-Y151 HydrophobicContact CB-CD1 4.14Å; W51-Y151 HydrophobicContact CB-CG 4.45Å; W51-R153 HydrophobicContact CE3-CG 4.14Å; W51-R153 HydrophobicContact CH2-CG 3.99Å; W51-R153 HydrophobicContact CZ3-CG 3.73Å
52	L	98.5	Very high	97.4	Very high	21 Å²	21	43 Å²	43	11%	0.11	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.1	177.3	-52.8	178.5	0	0	0	109.3	V54 T74 Y151 A152 L155 F187	L52-V54 PolarHBondContact O-N 2.97Å; L52-T74 HydrophobicContact CD2-CG2 4.12Å; L52-Y151 CarbonylContact O-C 3.54Å; L52-Y151 WeakPolarHBondContact O-CA 3.44Å; L52-A152 PolarHBondContact N-O 2.93Å; L52-A152 PolarHBondContact O-N 2.86Å; L52-L155 HydrophobicContact CD1-CD1 4.43Å; L52-L155 HydrophobicContact CD1-CG 4.04Å; L52-F187 HydrophobicContact CB-CE1 4.04Å; L52-F187 HydrophobicContact CB-CZ 4.14Å; L52-F187 HydrophobicContact CD1-CE2 4.32Å; L52-F187 HydrophobicContact CD1-CZ 4.24Å; L52-F187 HydrophobicContact CD2-CD1 3.86Å; L52-F187 HydrophobicContact CD2-CE1 3.88Å; L52-F187 HydrophobicContact CD2-CG 4.23Å; L52-F187 HydrophobicContact CD2-CZ 4.27Å; L52-F187 HydrophobicContact CG-CE1 4.4Å; L52-F187 HydrophobicContact CG-CZ 4.45Å
53	L	98.5	Very high	97.1	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.1	174.5	-179.7	58.8	0	0	0	109.6	V56 T73 K149 Y151 F182	L53-V56 HydrophobicContact CD1-CG2 3.9Å; L53-V56 HydrophobicContact CD2-CG2 4.1Å; L53-V56 HydrophobicContact CG-CG2 4.39Å; L53-T73 HydrophobicContact CB-CG2 4.18Å; L53-T73 HydrophobicContact CD2-CG2 4.09Å; L53-T73 PolarHBondContact N-O 3.39Å; L53-K149 HydrophobicContact CD1-CB 4.28Å; L53-K149 HydrophobicContact CD1-CD 4.42Å; L53-Y151 HydrophobicContact CB-CD1 4.13Å; L53-Y151 HydrophobicContact CB-CE1 3.81Å; L53-Y151 HydrophobicContact CD1-CD1 4.17Å; L53-Y151 HydrophobicContact CD1-CE1 3.67Å; L53-Y151 HydrophobicContact CD1-CE2 4.35Å; L53-Y151 HydrophobicContact CG-CE1 4.27Å; L53-F182 HydrophobicContact CD2-CD1 3.56Å; L53-F182 HydrophobicContact CD2-CD2 4.1Å; L53-F182 HydrophobicContact CD2-CE1 3.4Å; L53-F182 HydrophobicContact CD2-CE2 3.97Å; L53-F182 HydrophobicContact CD2-CG 3.93Å; L53-F182 HydrophobicContact CD2-CZ 3.62Å; L53-F182 HydrophobicContact CG-CB 4.49Å; L53-F182 HydrophobicContact CG-CD1 4.01Å; L53-F182 HydrophobicContact CG-CD2 4.13Å; L53-F182 HydrophobicContact CG-CE1 4.31Å; L53-F182 HydrophobicContact CG-CE2 4.43Å; L53-F182 HydrophobicContact CG-CG 3.94Å; L53-F182 WeakPolarHBondContact O-CB 3.42Å
54	V	98.6	Very high	96.8	Very high	13 Å²	13	45.9 Å²	45.9	8%	0.079	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-50.3	-176.5	179.4	0	0	0	0	110.7	L52 L150 A152 L155 V157 L162 F182	L52-V54 PolarHBondContact O-N 2.97Å; V54-L150 HydrophobicContact CB-CB 4.31Å; V54-L150 HydrophobicContact CB-CD2 4.05Å; V54-L150 HydrophobicContact CB-CG 3.99Å; V54-L150 WeakPolarHBondContact CB-O 3.49Å; V54-L150 HydrophobicContact CG1-CD2 3.88Å; V54-L150 HydrophobicContact CG1-CG 4.38Å; V54-L150 HydrophobicContact CG2-CG 4.35Å; V54-L150 PolarHBondContact N-O 3.16Å; V54-A152 HydrophobicContact CG2-CB 3.67Å; V54-L155 HydrophobicContact CG2-CD2 4.24Å; V54-V157 HydrophobicContact CG1-CG2 4.02Å; V54-V157 HydrophobicContact CG2-CG2 3.7Å; V54-L162 HydrophobicContact CG1-CD2 4.22Å; V54-F182 PolarHBondContact O-N 3.04Å
55	A	98.5	Very high	96.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	155.8	-176	0	0	0	0	0	112	K149 L150 F165 I179 F180 Y181	A55-K149 WeakPolarHBondContact O-CA 3.43Å; A55-L150 PolarHBondContact N-O 2.9Å; A55-L150 PolarHBondContact O-N 2.96Å; A55-F165 HydrophobicContact CB-CD1 4.31Å; A55-F165 HydrophobicContact CB-CE1 3.51Å; A55-F165 HydrophobicContact CB-CZ 3.81Å; A55-I179 HydrophobicContact CB-CG2 4.35Å; A55-F180 CarbonylContact C-O 3.55Å; A55-F180 VanDerWaalsContact CA-O 3.25Å; A55-F180 WeakPolarHBondContact CA-O 3.49Å; A55-Y181 HydrophobicContact CB-CD1 3.76Å; A55-Y181 HydrophobicContact CB-CE1 3.89Å; A55-Y181 HydrophobicContact CB-CG 4.37Å
56	V	98.6	Very high	96.4	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.03	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.1	174.2	-179.4	0	0	0	0	109.4	L53 L63 V148 K149 F180 F182	L53-V56 HydrophobicContact CD1-CG2 3.9Å; L53-V56 HydrophobicContact CD2-CG2 4.1Å; L53-V56 HydrophobicContact CG-CG2 4.39Å; V56-L63 HydrophobicContact CB-CD1 4.42Å; V56-L63 HydrophobicContact CG1-CD1 3.8Å; V56-V148 CarbonylContact C-O 3.51Å; V56-V148 WeakPolarHBondContact CA-O 3.35Å; V56-K149 HydrophobicContact CG1-CG 4.27Å; V56-K149 HydrophobicContact CG2-CD 4.3Å; V56-K149 HydrophobicContact CG2-CG 4.03Å; V56-F180 PolarHBondContact N-O 2.83Å; V56-F180 WeakPolarHBondContact O-CD2 3.46Å; V56-F180 PolarHBondContact O-N 2.87Å; V56-F182 HydrophobicContact CB-CE2 4.07Å; V56-F182 HydrophobicContact CG2-CD2 4.23Å; V56-F182 HydrophobicContact CG2-CE2 3.48Å; V56-F182 VanDerWaalsContact CG2-CE2 3.48Å; V56-F182 HydrophobicContact CG2-CZ 4.01Å
57	G	98.4	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.1	163.4	0	0	0	0	0	109.7	S147 V148 L174 Q178	G57-S147 CarbonylContact O-C 3.55Å; G57-S147 VanDerWaalsContact O-CA 3.25Å; G57-S147 WeakPolarHBondContact O-CA 3.29Å; G57-S147 WeakPolarHBondContact O-CB 3.47Å; G57-V148 PolarHBondContact N-O 3.37Å; G57-V148 PolarHBondContact O-N 3.5Å; G57-L174 WeakPolarHBondContact O-CD1 3.38Å; G57-Q178 CarbonylContact C-O 3.52Å; G57-Q178 VanDerWaalsContact CA-O 3.3Å; G57-Q178 WeakPolarHBondContact CA-O 3.37Å
58	S	97.8	Very high	95.5	Very high	12 Å²	12	47.7 Å²	47.7	8%	0.084	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	141	179	-171.2	0	0	0	0	114.4	C60 Q178 F180	S58-C60 PolarHBondContact O-N 2.84Å; S58-C60 VanDerWaalsContact OG-CB 3.26Å; S58-C60 WeakPolarHBondContact OG-CB 3.33Å; S58-C60 PolarHBondContact OG-N 2.84Å; S58-C60 VanDerWaalsContact OG-N 3.07Å; S58-Q178 PolarHBondContact N-O 3.42Å; S58-F180 WeakPolarHBondContact O-CE2 3.43Å
59	A	95.7	Very high	95.1	Very high	34 Å²	34	54.6 Å²	54.6	28%	0.281	27%	0.268	S	S	.	.			trans	-79.7	11.6	166.6	0	0	0	0	0	113.6	R61 L174	A59-R61 PolarHBondContact O-N 3.3Å; A59-L174 HydrophobicContact CB-CD2 4.03Å
60	C	93.1	Very high	94.8	Very high	61 Å²	61	54.2 Å²	54.2	41%	0.412	26%	0.261	S	S	.	.			trans	-64.4	118.8	-179.9	-176.7	0	0	0	0	110.9	S58 F62 L63 Q64	S58-C60 PolarHBondContact O-N 2.84Å; S58-C60 VanDerWaalsContact OG-CB 3.26Å; S58-C60 WeakPolarHBondContact OG-CB 3.33Å; S58-C60 PolarHBondContact OG-N 2.84Å; S58-C60 VanDerWaalsContact OG-N 3.07Å; C60-F62 PolarHBondContact O-N 3.44Å; C60-F62 VanDerWaalsContact O-N 3.13Å; C60-L63 HydrophobicContact CB-CB 4.45Å; C60-L63 HydrophobicContact CB-CD1 4.28Å; C60-L63 HydrophobicContact CB-CG 4.44Å; C60-L63 PolarHBondContact O-N 2.85Å; C60-Q64 PolarHBondContact O-N 2.61Å
61	R	92.4	Very high	94.5	Very high	175 Å²	175	55.3 Å²	55.3	66%	0.66	26%	0.263	S	S	*	.	H	α-helix	trans	-49.9	-40.6	179.5	-175.3	176.3	176.4	165.2	4.8	113.9	A59 L63 Q64 E65	A59-R61 PolarHBondContact O-N 3.3Å; R61-L63 VanDerWaalsContact C-N 3.32Å; R61-L63 PolarHBondContact O-N 2.83Å; R61-Q64 PolarHBondContact O-N 3.37Å; R61-E65 HydrophobicContact CG-CG 4.35Å; R61-E65 IonicContact CZ-OE1 2.71Å; R61-E65 VanDerWaalsContact CZ-OE1 3.3Å; R61-E65 IonicContact NE-OE1 3.68Å; R61-E65 PolarHBondContact NE-OE1 3.46Å; R61-E65 IonicContact NE-OE2 2.72Å; R61-E65 IonicContact NH2-OE1 3.52Å; R61-E65 PolarHBondContact NH2-OE1 2.85Å; R61-E65 WeakPolarHBondContact O-CG 3.48Å; R61-E65 PolarHBondContact O-N 2.79Å
62	F	91.1	Very high	94.3	Very high	137 Å²	137	55.3 Å²	55.3	60%	0.601	26%	0.264	S	S	*	.	H	α-helix	trans	-61.5	-40.6	178	178.9	-94.7	0	0	0	112	C60 Q66	C60-F62 PolarHBondContact O-N 3.44Å; C60-F62 VanDerWaalsContact O-N 3.13Å; F62-Q66 HydrophobicContact CD2-CB 4.47Å; F62-Q66 HydrophobicContact CD2-CG 4.14Å; F62-Q66 HydrophobicContact CE1-CB 4.31Å; F62-Q66 HydrophobicContact CE2-CB 4.13Å; F62-Q66 HydrophobicContact CE2-CG 3.87Å; F62-Q66 HydrophobicContact CZ-CB 4.04Å; F62-Q66 HydrophobicContact CZ-CG 4.28Å; F62-Q66 WeakPolarHBondContact O-CA 3.44Å; F62-Q66 VanDerWaalsContact O-CB 3.27Å; F62-Q66 WeakPolarHBondContact O-CB 3.4Å; F62-Q66 PolarHBondContact O-N 2.88Å
63	L	92.1	Very high	94.2	Very high	31 Å²	31	54.9 Å²	54.9	16%	0.162	26%	0.262	C	S	.	.	H	α-helix	trans	-71.6	-37	176.3	-71.2	173.1	0	0	0	111.4	V56 C60 R61 E65 G67 F180	V56-L63 HydrophobicContact CB-CD1 4.42Å; V56-L63 HydrophobicContact CG1-CD1 3.8Å; C60-L63 HydrophobicContact CB-CB 4.45Å; C60-L63 HydrophobicContact CB-CD1 4.28Å; C60-L63 HydrophobicContact CB-CG 4.44Å; C60-L63 PolarHBondContact O-N 2.85Å; R61-L63 VanDerWaalsContact C-N 3.32Å; R61-L63 PolarHBondContact O-N 2.83Å; L63-E65 VanDerWaalsContact C-N 3.32Å; L63-E65 PolarHBondContact O-N 3.22Å; L63-G67 WeakPolarHBondContact O-CA 3.4Å; L63-G67 PolarHBondContact O-N 3.11Å; L63-F180 HydrophobicContact CB-CD2 3.77Å; L63-F180 HydrophobicContact CB-CE1 4.47Å; L63-F180 HydrophobicContact CB-CE2 3.69Å; L63-F180 HydrophobicContact CB-CG 4.21Å; L63-F180 HydrophobicContact CB-CZ 4.07Å; L63-F180 HydrophobicContact CD1-CD2 4.29Å; L63-F180 WeakPolarHBondContact O-CD1 3.47Å; L63-F180 WeakPolarHBondContact O-CE1 3.36Å
64	Q	92.3	Very high	94.2	Very high	97 Å²	97	54.5 Å²	54.5	45%	0.453	26%	0.26	S	S	.	.	H	α-helix	trans	-60.9	-41.2	174.6	-67.6	175.3	-29.1	0	0	112.3	C60 R61 F180	C60-Q64 PolarHBondContact O-N 2.61Å; R61-Q64 PolarHBondContact O-N 3.37Å; Q64-F180 HydrophobicContact CB-CZ 4.44Å; Q64-F180 HydrophobicContact CG-CZ 3.99Å
65	E	94.1	Very high	94.2	Very high	92 Å²	92	54.3 Å²	54.3	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-83.6	-38.8	-178.3	-68	174.8	173	0	0	112.7	R61 L63 H68	R61-E65 HydrophobicContact CG-CG 4.35Å; R61-E65 IonicContact CZ-OE1 2.71Å; R61-E65 VanDerWaalsContact CZ-OE1 3.3Å; R61-E65 IonicContact NE-OE1 3.68Å; R61-E65 PolarHBondContact NE-OE1 3.46Å; R61-E65 IonicContact NE-OE2 2.72Å; R61-E65 IonicContact NH2-OE1 3.52Å; R61-E65 PolarHBondContact NH2-OE1 2.85Å; R61-E65 WeakPolarHBondContact O-CG 3.48Å; R61-E65 PolarHBondContact O-N 2.79Å; L63-E65 VanDerWaalsContact C-N 3.32Å; L63-E65 PolarHBondContact O-N 3.22Å; E65-H68 PolarHBondContact O-CE1 2.81Å; E65-H68 PolarHBondContact O-ND1 2.91Å
66	Q	92.3	Very high	94.2	Very high	64 Å²	64	56.7 Å²	56.7	30%	0.299	27%	0.269	S	S	.	.	H	α-helix	trans	-116.5	5.4	-169.6	-55.3	-60.7	-39.3	0	0	113.9	F62 H68 R69	F62-Q66 HydrophobicContact CD2-CB 4.47Å; F62-Q66 HydrophobicContact CD2-CG 4.14Å; F62-Q66 HydrophobicContact CE1-CB 4.31Å; F62-Q66 HydrophobicContact CE2-CB 4.13Å; F62-Q66 HydrophobicContact CE2-CG 3.87Å; F62-Q66 HydrophobicContact CZ-CB 4.04Å; F62-Q66 HydrophobicContact CZ-CG 4.28Å; F62-Q66 WeakPolarHBondContact O-CA 3.44Å; F62-Q66 VanDerWaalsContact O-CB 3.27Å; F62-Q66 WeakPolarHBondContact O-CB 3.4Å; F62-Q66 PolarHBondContact O-N 2.88Å; Q66-H68 PolarHBondContact O-N 3.49Å; Q66-H68 VanDerWaalsContact O-N 3.17Å; Q66-R69 WeakPolarHBondContact O-CA 3.36Å; Q66-R69 WeakPolarHBondContact O-CB 3.31Å; Q66-R69 PolarHBondContact O-N 3.03Å
67	G	89.3	Confident	94.2	Very high	8 Å²	8	56.9 Å²	56.9	8%	0.082	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-60.5	-28.3	-177.2	0	0	0	0	0	113.6	L63 R69 A70	L63-G67 WeakPolarHBondContact O-CA 3.4Å; L63-G67 PolarHBondContact O-N 3.11Å; G67-R69 PolarHBondContact O-N 2.59Å; G67-R69 VanDerWaalsContact O-N 3.15Å; G67-A70 VanDerWaalsContact O-CB 3.26Å; G67-A70 WeakPolarHBondContact O-CB 3.36Å; G67-A70 PolarHBondContact O-N 3.08Å
68	H	90.1	Very high	94.2	Very high	142 Å²	142	59.3 Å²	59.3	66%	0.657	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-64.1	-13.8	172.5	68.5	-82.6	0	0	0	113.8	E65 Q66	E65-H68 PolarHBondContact O-CE1 2.81Å; E65-H68 PolarHBondContact O-ND1 2.91Å; Q66-H68 PolarHBondContact O-N 3.49Å; Q66-H68 VanDerWaalsContact O-N 3.17Å
69	R	91	Very high	94.2	Very high	170 Å²	170	60.5 Å²	60.5	64%	0.642	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-110.1	23.8	174.6	-53	-178.6	-177.3	-172.1	-5.9	111.6	Q66 G67 E71	Q66-R69 WeakPolarHBondContact O-CA 3.36Å; Q66-R69 WeakPolarHBondContact O-CB 3.31Å; Q66-R69 PolarHBondContact O-N 3.03Å; G67-R69 PolarHBondContact O-N 2.59Å; G67-R69 VanDerWaalsContact O-N 3.15Å; R69-E71 PolarHBondContact O-N 3.06Å
70	A	91.9	Very high	94.2	Very high	22 Å²	22	64 Å²	64	18%	0.182	31%	0.309	C	S	.	.			trans	-56.4	138.1	173.8	0	0	0	0	0	109.7	G67 F182 P183	G67-A70 VanDerWaalsContact O-CB 3.26Å; G67-A70 WeakPolarHBondContact O-CB 3.36Å; G67-A70 PolarHBondContact O-N 3.08Å; A70-F182 HydrophobicContact CB-CD1 3.98Å; A70-F182 HydrophobicContact CB-CD2 4.27Å; A70-F182 HydrophobicContact CB-CE1 4Å; A70-F182 HydrophobicContact CB-CE2 4.28Å; A70-F182 HydrophobicContact CB-CG 4.11Å; A70-F182 HydrophobicContact CB-CZ 4.15Å; A70-P183 VanDerWaalsContact O-CD 3.23Å; A70-P183 WeakPolarHBondContact O-CD 3.49Å; A70-P183 WeakPolarHBondContact O-CG 3.28Å
71	E	92.4	Very high	94.3	Very high	68 Å²	68	64.7 Å²	64.7	32%	0.318	33%	0.327	S	S	.	.			trans	-106.7	144.1	-176.7	-71	-78.4	-169.7	0	0	109.8	R69 T73 K91 F182	R69-E71 PolarHBondContact O-N 3.06Å; E71-T73 PolarHBondContact O-N 3.01Å; E71-T73 VanDerWaalsContact O-N 3.14Å; E71-T73 PolarHBondContact O-OG1 2.86Å; E71-K91 WeakPolarHBondContact CB-O 3.35Å; E71-K91 VanDerWaalsContact CD-O 3.24Å; E71-K91 WeakPolarHBondContact CG-O 3.47Å; E71-F182 VanDerWaalsContact O-CD1 3.3Å; E71-F182 WeakPolarHBondContact O-CD1 3Å
72	A	93.8	Very high	94.4	Very high	2 Å²	2	61.2 Å²	61.2	2%	0.017	33%	0.325	C	S	.	.			trans	-54.4	123.2	177.6	0	0	0	0	0	109.8	P183 Y185 F187	A72-P183 HydrophobicContact CB-CB 4.17Å; A72-Y185 VanDerWaalsContact CB-O 3.29Å; A72-Y185 WeakPolarHBondContact CB-O 3.36Å; A72-F187 HydrophobicContact CB-CB 4.48Å; A72-F187 HydrophobicContact CB-CD1 3.77Å; A72-F187 HydrophobicContact CB-CE1 4.06Å; A72-F187 HydrophobicContact CB-CG 4.02Å
73	T	96.7	Very high	94.6	Very high	12 Å²	12	55.2 Å²	55.2	7%	0.074	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125	-170	-62.2	0	0	0	0	110.5	L53 E71 L75 T88 F89	L53-T73 HydrophobicContact CB-CG2 4.18Å; L53-T73 HydrophobicContact CD2-CG2 4.09Å; L53-T73 PolarHBondContact N-O 3.39Å; E71-T73 PolarHBondContact O-N 3.01Å; E71-T73 VanDerWaalsContact O-N 3.14Å; E71-T73 PolarHBondContact O-OG1 2.86Å; T73-L75 HydrophobicContact CG2-CD1 4Å; T73-T88 HydrophobicContact CG2-CG2 3.61Å; T73-F89 CarbonylContact C-O 3.55Å; T73-F89 VanDerWaalsContact CA-O 3.32Å; T73-F89 WeakPolarHBondContact CA-O 3.43Å
74	T	98.2	Very high	94.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.8	177.6	-57.6	0	0	0	0	109.7	T50 W51 L52 T88 F89 F187 E189	T50-T74 HydrophobicContact CG2-CG2 3.39Å; W51-T74 CarbonylContact O-C 3.58Å; W51-T74 WeakPolarHBondContact O-CA 3.43Å; L52-T74 HydrophobicContact CD2-CG2 4.12Å; T74-T88 CarbonylContact O-C 3.55Å; T74-T88 WeakPolarHBondContact O-CA 3.23Å; T74-F89 PolarHBondContact N-O 2.83Å; T74-F89 PolarHBondContact O-N 3.38Å; T74-F187 WeakPolarHBondContact OG1-CD1 3.44Å; T74-E189 HydrophobicContact CG2-CG 4.49Å
75	L	98.1	Very high	95.2	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.3	171.1	-85.6	63.6	0	0	0	108.8	T50 W51 T73 V86 S87 T88 Y151	T50-L75 CarbonylContact C-O 3.58Å; T50-L75 VanDerWaalsContact CA-O 3.3Å; T50-L75 WeakPolarHBondContact CA-O 3.27Å; W51-L75 HydrophobicContact CB-CB 4.15Å; W51-L75 PolarHBondContact N-O 3.4Å; W51-L75 PolarHBondContact O-N 3.35Å; T73-L75 HydrophobicContact CG2-CD1 4Å; L75-V86 HydrophobicContact CD2-CG1 4.09Å; L75-V86 HydrophobicContact CG-CG1 4.17Å; L75-S87 CarbonylContact C-O 3.51Å; L75-S87 WeakPolarHBondContact CA-O 3.3Å; L75-T88 HydrophobicContact CD1-CG2 4.05Å; L75-Y151 HydrophobicContact CD1-CD1 4.43Å; L75-Y151 HydrophobicContact CD1-CE1 3.56Å; L75-Y151 HydrophobicContact CD2-CD1 4.34Å; L75-Y151 HydrophobicContact CD2-CE1 3.58Å; L75-Y151 HydrophobicContact CG-CE1 4.12Å
76	H	98.4	Very high	95.3	Very high	50 Å²	50	46.3 Å²	46.3	23%	0.231	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.7	162.7	-69.6	-96	0	0	0	108.7	T50 V86 S87 F89	T50-H76 PolarHBondContact OG1-CE1 3.43Å; T50-H76 PolarHBondContact OG1-ND1 3.02Å; H76-V86 WeakPolarHBondContact O-CA 3.36Å; H76-S87 PolarHBondContact N-O 2.6Å; H76-S87 PolarHBondContact O-N 2.92Å; H76-F89 HydrophobicContact CB-CE2 4.27Å; H76-F89 AromaticContact CD2-CD2 3.44Å; H76-F89 VanDerWaalsContact CD2-CD2 3.44Å; H76-F89 WeakPolarHBondContact CD2-CD2 3.31Å; H76-F89 AromaticContact CD2-CE2 3.23Å; H76-F89 WeakPolarHBondContact CD2-CE2 3.31Å; H76-F89 AromaticContact CG-CE2 3.99Å
77	V	98.5	Very high	95.6	Very high	9 Å²	9	44.4 Å²	44.4	6%	0.055	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.7	-178	-175.8	0	0	0	0	109.3	F47 A48 G49 M84 V86	F47-V77 HydrophobicContact CD1-CG1 4.11Å; F47-V77 HydrophobicContact CE1-CG1 4.46Å; F47-V77 HydrophobicContact CE1-CG2 4.28Å; A48-V77 WeakPolarHBondContact CA-O 3.24Å; G49-V77 PolarHBondContact N-O 2.87Å; G49-V77 PolarHBondContact O-N 3.22Å; V77-M84 HydrophobicContact CG1-CB 4.11Å; V77-M84 HydrophobicContact CG1-CG 4.35Å; V77-M84 HydrophobicContact CG1-SD 3.83Å; V77-V86 HydrophobicContact CG2-CG2 4.43Å
78	A	98.4	Very high	96	Very high	51 Å²	51	45.2 Å²	45.2	42%	0.421	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.9	174.5	0	0	0	0	0	109.7	A85	A78-A85 HydrophobicContact CB-CB 4.48Å; A78-A85 PolarHBondContact N-O 2.77Å; A78-A85 PolarHBondContact O-N 2.93Å
79	P	97.9	Very high	96.3	Very high	37 Å²	37	39 Å²	39	24%	0.24	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	138.5	173.4	-25.3	36.6	0	0	0	111.4	A44 Q45 A48	A44-P79 HydrophobicContact CB-CB 4.27Å; A44-P79 HydrophobicContact CB-CG 4.2Å; A44-P79 WeakPolarHBondContact O-CG 3.34Å; Q45-P79 VanDerWaalsContact NE2-CB 3.34Å; A48-P79 HydrophobicContact CB-CG 4.02Å
80	Q	96.8	Very high	96.4	Very high	107 Å²	107	36.5 Å²	36.5	50%	0.5	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	86.4	176.5	-169.7	-179.8	-74.7	0	0	109.6	T82 A83	Q80-T82 PolarHBondContact O-N 2.81Å; Q80-A83 CarbonylContact C-O 3.54Å; Q80-A83 PolarHBondContact N-O 3Å; Q80-A83 WeakPolarHBondContact O-CB 3.48Å; Q80-A83 PolarHBondContact O-N 2.69Å
81	G	94.6	Very high	96.3	Very high	77 Å²	77	39 Å²	39	79%	0.794	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	-125.1	-169.8	0	0	0	0	0	110.3
82	T	93.6	Very high	95.9	Very high	101 Å²	101	38.9 Å²	38.9	62%	0.62	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-7.1	173.6	61.8	0	0	0	0	113.5	Q80 D105	Q80-T82 PolarHBondContact O-N 2.81Å; T82-D105 VanDerWaalsContact CB-OD2 3.3Å; T82-D105 WeakPolarHBondContact CB-OD2 3.35Å; T82-D105 VanDerWaalsContact OG1-CB 3.3Å; T82-D105 WeakPolarHBondContact OG1-CB 3.39Å; T82-D105 PolarHBondContact OG1-OD2 2.89Å
83	A	96.9	Very high	95.5	Very high	12 Å²	12	45.7 Å²	45.7	10%	0.099	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	173.8	176.2	0	0	0	0	0	111.6	Q80 L102 Y103	Q80-A83 CarbonylContact C-O 3.54Å; Q80-A83 PolarHBondContact N-O 3Å; Q80-A83 WeakPolarHBondContact O-CB 3.48Å; Q80-A83 PolarHBondContact O-N 2.69Å; A83-L102 HydrophobicContact CB-CD1 4.04Å; A83-L102 HydrophobicContact CB-CG 4.43Å; A83-Y103 WeakPolarHBondContact CA-O 3.12Å; A83-Y103 VanDerWaalsContact CB-O 3.28Å; A83-Y103 WeakPolarHBondContact CB-O 3.37Å
84	M	97.6	Very high	94.9	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.5	170.4	-59.8	-174.6	-57.4	0	0	110.9	F42 A44 F47 V77 V86 Y103 F112	F42-M84 HydrophobicContact CE1-SD 4.03Å; F42-M84 HydrophobicContact CZ-CE 4.41Å; F42-M84 HydrophobicContact CZ-SD 3.8Å; A44-M84 HydrophobicContact CB-CG 4.38Å; A44-M84 HydrophobicContact CB-SD 4.44Å; F47-M84 HydrophobicContact CD1-CE 4.48Å; F47-M84 HydrophobicContact CD1-SD 3.94Å; V77-M84 HydrophobicContact CG1-CB 4.11Å; V77-M84 HydrophobicContact CG1-CG 4.35Å; V77-M84 HydrophobicContact CG1-SD 3.83Å; M84-V86 HydrophobicContact CB-CG2 4.28Å; M84-Y103 HydrophobicContact CE-CD2 4.02Å; M84-Y103 PolarHBondContact N-O 2.76Å; M84-Y103 PolarHBondContact O-N 2.91Å; M84-F112 HydrophobicContact CE-CD1 4.19Å; M84-F112 HydrophobicContact CE-CD2 3.74Å; M84-F112 HydrophobicContact CE-CE1 3.82Å; M84-F112 HydrophobicContact CE-CE2 3.34Å; M84-F112 HydrophobicContact CE-CG 4.16Å; M84-F112 HydrophobicContact CE-CZ 3.39Å; M84-F112 HydrophobicContact CG-CE1 3.98Å; M84-F112 HydrophobicContact CG-CZ 4.15Å; M84-F112 HydrophobicContact SD-CE1 4.29Å; M84-F112 HydrophobicContact SD-CE2 4.31Å; M84-F112 HydrophobicContact SD-CZ 3.85Å
85	A	97.8	Very high	94.6	Very high	27 Å²	27	51.1 Å²	51.1	22%	0.223	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	125.2	164.8	0	0	0	0	0	108.6	A78	A78-A85 HydrophobicContact CB-CB 4.48Å; A78-A85 PolarHBondContact N-O 2.77Å; A78-A85 PolarHBondContact O-N 2.93Å
86	V	97.8	Very high	94.5	Very high	3 Å²	3	52 Å²	52	2%	0.018	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	119.8	-176.4	-178	0	0	0	0	108.9	L75 H76 V77 M84 Q101 Y103	L75-V86 HydrophobicContact CD2-CG1 4.09Å; L75-V86 HydrophobicContact CG-CG1 4.17Å; H76-V86 WeakPolarHBondContact O-CA 3.36Å; V77-V86 HydrophobicContact CG2-CG2 4.43Å; M84-V86 HydrophobicContact CB-CG2 4.28Å; V86-Q101 PolarHBondContact N-O 2.86Å; V86-Q101 PolarHBondContact O-N 3.16Å; V86-Y103 HydrophobicContact CB-CD1 4.2Å; V86-Y103 HydrophobicContact CB-CE1 4.12Å; V86-Y103 HydrophobicContact CG1-CE1 4.41Å; V86-Y103 HydrophobicContact CG2-CD1 3.78Å; V86-Y103 HydrophobicContact CG2-CD2 3.99Å; V86-Y103 HydrophobicContact CG2-CE1 4Å; V86-Y103 HydrophobicContact CG2-CE2 4.17Å; V86-Y103 HydrophobicContact CG2-CG 3.78Å
87	S	97.7	Very high	94.4	Very high	24 Å²	24	53.8 Å²	53.8	17%	0.168	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118	169.6	-69.3	0	0	0	0	109.6	L75 H76 Q98 V99	L75-S87 CarbonylContact C-O 3.51Å; L75-S87 WeakPolarHBondContact CA-O 3.3Å; H76-S87 PolarHBondContact N-O 2.6Å; H76-S87 PolarHBondContact O-N 2.92Å; S87-Q98 PolarHBondContact OG-NE2 2.97Å; S87-V99 CarbonylContact C-O 3.55Å; S87-V99 WeakPolarHBondContact CA-O 3.35Å
88	T	97.4	Very high	94.3	Very high	25 Å²	25	54.3 Å²	54.3	15%	0.153	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.3	173.6	-60.1	0	0	0	0	109.3	T73 T74 L75 Q98 V99	T73-T88 HydrophobicContact CG2-CG2 3.61Å; T74-T88 CarbonylContact O-C 3.55Å; T74-T88 WeakPolarHBondContact O-CA 3.23Å; L75-T88 HydrophobicContact CD1-CG2 4.05Å; T88-Q98 CarbonylContact O-C 3.53Å; T88-Q98 WeakPolarHBondContact O-CA 3.07Å; T88-V99 PolarHBondContact N-O 2.95Å; T88-V99 PolarHBondContact O-N 3.06Å
89	F	97.2	Very high	94.1	Very high	12 Å²	12	52.8 Å²	52.8	5%	0.053	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.5	174.1	-62.1	-97.9	0	0	0	108.9	T73 T74 H76 W97 Q98 C188 E189	T73-F89 CarbonylContact C-O 3.55Å; T73-F89 VanDerWaalsContact CA-O 3.32Å; T73-F89 WeakPolarHBondContact CA-O 3.43Å; T74-F89 PolarHBondContact N-O 2.83Å; T74-F89 PolarHBondContact O-N 3.38Å; H76-F89 HydrophobicContact CB-CE2 4.27Å; H76-F89 AromaticContact CD2-CD2 3.44Å; H76-F89 VanDerWaalsContact CD2-CD2 3.44Å; H76-F89 WeakPolarHBondContact CD2-CD2 3.31Å; H76-F89 AromaticContact CD2-CE2 3.23Å; H76-F89 WeakPolarHBondContact CD2-CE2 3.31Å; H76-F89 AromaticContact CG-CE2 3.99Å; F89-W97 VanDerWaalsContact CA-O 3.28Å; F89-W97 WeakPolarHBondContact CA-O 3.43Å; F89-Q98 HydrophobicContact CD1-CB 3.92Å; F89-Q98 HydrophobicContact CD1-CG 4.13Å; F89-Q98 HydrophobicContact CE1-CB 3.66Å; F89-Q98 HydrophobicContact CE1-CG 3.58Å; F89-Q98 HydrophobicContact CE2-CG 4.22Å; F89-Q98 HydrophobicContact CZ-CB 4.27Å; F89-Q98 HydrophobicContact CZ-CG 3.65Å; F89-C188 WeakPolarHBondContact CB-O 2.73Å; F89-E189 WeakPolarHBondContact CE1-O 2.98Å; F89-E189 WeakPolarHBondContact CZ-O 3.07Å
90	R	93.7	Very high	94	Very high	116 Å²	116	55.4 Å²	55.4	44%	0.438	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	146.7	172.7	66.6	-178.9	-176.3	172.7	4.4	109.8	W97	R90-W97 HydrophobicContact CG-CB 4.5Å; R90-W97 PolarHBondContact N-O 2.91Å; R90-W97 PolarHBondContact O-N 2.84Å
91	K	88	Confident	94	Very high	75 Å²	75	51.7 Å²	51.7	33%	0.326	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	138	169.1	-159.2	166	177.9	173.6	0	108.8	E71 G94 I95	E71-K91 WeakPolarHBondContact CB-O 3.35Å; E71-K91 VanDerWaalsContact CD-O 3.24Å; E71-K91 WeakPolarHBondContact CG-O 3.47Å; K91-G94 VanDerWaalsContact CE-CA 3.4Å; K91-G94 VanDerWaalsContact CE-O 3.29Å; K91-G94 WeakPolarHBondContact CE-O 3.46Å; K91-I95 CarbonylContact C-O 3.53Å; K91-I95 WeakPolarHBondContact CA-O 3.14Å
92	L	85.9	Confident	94	Very high	65 Å²	65	50.7 Å²	50.7	34%	0.34	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	118.5	171.2	-177.2	68.7	0	0	0	106.6	G94 I95	L92-G94 PolarHBondContact O-N 2.98Å; L92-I95 PolarHBondContact N-O 2.98Å; L92-I95 PolarHBondContact O-N 2.85Å
93	D	84.4	Confident	94.2	Very high	145 Å²	145	46.4 Å²	46.4	78%	0.775	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	40.2	-179.4	-59	-42.7	0	0	0	113.6	I95	D93-I95 VanDerWaalsContact C-N 3.31Å; D93-I95 PolarHBondContact O-N 2.8Å
94	G	84.1	Confident	94.2	Very high	52 Å²	52	46.9 Å²	46.9	54%	0.536	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	-16.6	-179.9	0	0	0	0	0	115	K91 L92	K91-G94 VanDerWaalsContact CE-CA 3.4Å; K91-G94 VanDerWaalsContact CE-O 3.29Å; K91-G94 WeakPolarHBondContact CE-O 3.46Å; L92-G94 PolarHBondContact O-N 2.98Å
95	I	92.1	Very high	94.1	Very high	74 Å²	74	50 Å²	50	38%	0.379	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.9	-172.2	-57.8	173.9	0	0	0	110.5	K91 L92 D93 H195	K91-I95 CarbonylContact C-O 3.53Å; K91-I95 WeakPolarHBondContact CA-O 3.14Å; L92-I95 PolarHBondContact N-O 2.98Å; L92-I95 PolarHBondContact O-N 2.85Å; D93-I95 VanDerWaalsContact C-N 3.31Å; D93-I95 PolarHBondContact O-N 2.8Å; I95-H195 HydrophobicContact CG2-CB 4.47Å
96	C	95.4	Very high	94.1	Very high	27 Å²	27	51.6 Å²	51.6	18%	0.182	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	123.4	178.3	-74.8	0	0	0	0	112.1	C188 A190 A191 H195	C96-C188 HydrophobicContact CB-CB 3.84Å; C96-C188 WeakPolarHBondContact CB-SG 3.37Å; C96-C188 WeakPolarHBondContact SG-CB 3.37Å; C96-C188 CovalentContact SG-SG 2.02Å; C96-C188 PolarHBondContact SG-SG 3.45Å; C96-A190 VanDerWaalsContact CB-O 3.24Å; C96-A190 WeakPolarHBondContact CB-O 3.16Å; C96-A191 WeakPolarHBondContact O-CB 3.29Å; C96-H195 WeakPolarHBondContact O-CB 3.48Å
97	W	96.3	Very high	94	Very high	88 Å²	88	54.5 Å²	54.5	33%	0.333	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.8	177.7	-73.4	80.1	0	0	0	110.1	F89 R90 H195	F89-W97 VanDerWaalsContact CA-O 3.28Å; F89-W97 WeakPolarHBondContact CA-O 3.43Å; R90-W97 HydrophobicContact CG-CB 4.5Å; R90-W97 PolarHBondContact N-O 2.91Å; R90-W97 PolarHBondContact O-N 2.84Å; W97-H195 WeakPolarHBondContact CA-O 3.27Å; W97-H195 HydrophobicContact CD2-CB 4.06Å; W97-H195 AromaticContact CE2-CD2 3.59Å; W97-H195 HydrophobicContact CE3-CB 4.1Å; W97-H195 HydrophobicContact CG-CB 4.41Å; W97-H195 AromaticContact CH2-CD2 3.86Å; W97-H195 AromaticContact CZ2-CD2 3.5Å; W97-H195 AromaticContact NE1-CD2 3.99Å
98	Q	96.8	Very high	93.9	Very high	20 Å²	20	56.7 Å²	56.7	9%	0.093	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126	171.6	-177.1	-175.8	11	0	0	109.7	S87 T88 F89 R100 A191 H195 V196 L197	S87-Q98 PolarHBondContact OG-NE2 2.97Å; T88-Q98 CarbonylContact O-C 3.53Å; T88-Q98 WeakPolarHBondContact O-CA 3.07Å; F89-Q98 HydrophobicContact CD1-CB 3.92Å; F89-Q98 HydrophobicContact CD1-CG 4.13Å; F89-Q98 HydrophobicContact CE1-CB 3.66Å; F89-Q98 HydrophobicContact CE1-CG 3.58Å; F89-Q98 HydrophobicContact CE2-CG 4.22Å; F89-Q98 HydrophobicContact CZ-CB 4.27Å; F89-Q98 HydrophobicContact CZ-CG 3.65Å; Q98-R100 HydrophobicContact CG-CG 4.14Å; Q98-A191 HydrophobicContact CB-CB 3.71Å; Q98-H195 PolarHBondContact N-O 2.97Å; Q98-V196 HydrophobicContact CB-CG2 4.25Å; Q98-V196 CarbonylContact O-C 3.58Å; Q98-V196 WeakPolarHBondContact O-CA 3.44Å; Q98-L197 PolarHBondContact O-N 3.2Å
99	V	94.7	Very high	94	Very high	19 Å²	19	60.8 Å²	60.8	12%	0.115	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.4	169.7	-172.9	0	0	0	0	108.6	S87 T88 Q101 L197 E199	S87-V99 CarbonylContact C-O 3.55Å; S87-V99 WeakPolarHBondContact CA-O 3.35Å; T88-V99 PolarHBondContact N-O 2.95Å; T88-V99 PolarHBondContact O-N 3.06Å; V99-Q101 HydrophobicContact CG1-CG 4.14Å; V99-L197 CarbonylContact C-O 3.59Å; V99-L197 WeakPolarHBondContact CA-O 3.45Å; V99-L197 HydrophobicContact CG1-CD2 4.25Å; V99-L197 HydrophobicContact CG1-CG 4.48Å; V99-L197 HydrophobicContact CG2-CB 4.38Å; V99-L197 HydrophobicContact CG2-CD2 4.46Å; V99-E199 HydrophobicContact CG1-CG 4.09Å
100	R	95.6	Very high	94	Very high	92 Å²	92	60.2 Å²	60.2	35%	0.347	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.8	178.7	-57.3	179.2	176.6	170.3	2.4	110.2	Q98 V196 L197 E199	Q98-R100 HydrophobicContact CG-CG 4.14Å; R100-V196 HydrophobicContact CG-CG1 4.31Å; R100-L197 PolarHBondContact N-O 2.97Å; R100-E199 WeakPolarHBondContact O-CA 3.31Å; R100-E199 VanDerWaalsContact O-CB 3.28Å; R100-E199 WeakPolarHBondContact O-CB 3.29Å; R100-E199 PolarHBondContact O-N 2.72Å
101	Q	95.5	Very high	94.2	Very high	29 Å²	29	56.9 Å²	56.9	14%	0.136	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	155.2	-176.2	-72.6	179.7	-33.1	0	0	110.2	V86 V99 Y103 L114 E199	V86-Q101 PolarHBondContact N-O 2.86Å; V86-Q101 PolarHBondContact O-N 3.16Å; V99-Q101 HydrophobicContact CG1-CG 4.14Å; Q101-Y103 HydrophobicContact CB-CD1 4.48Å; Q101-Y103 HydrophobicContact CB-CE1 4.3Å; Q101-L114 HydrophobicContact CB-CD1 3.67Å; Q101-L114 HydrophobicContact CG-CD1 3.89Å; Q101-E199 HydrophobicContact CG-CB 4.28Å; Q101-E199 PolarHBondContact NE2-OE2 3.15Å
102	L	96.3	Very high	94.7	Very high	56 Å²	56	53.7 Å²	53.7	29%	0.293	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.7	172	-174.2	69.7	0	0	0	108.8	A83 G104 V200	A83-L102 HydrophobicContact CB-CD1 4.04Å; A83-L102 HydrophobicContact CB-CG 4.43Å; L102-G104 PolarHBondContact O-N 2.8Å; L102-V200 HydrophobicContact CB-CG1 4.36Å; L102-V200 HydrophobicContact CB-CG2 3.97Å
103	Y	97.1	Very high	95.2	Very high	11 Å²	11	52.4 Å²	52.4	4%	0.043	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	93.8	173.8	-79.6	28.8	0	0	0	106.8	A83 M84 V86 Q101 F112 L114 V125	A83-Y103 WeakPolarHBondContact CA-O 3.12Å; A83-Y103 VanDerWaalsContact CB-O 3.28Å; A83-Y103 WeakPolarHBondContact CB-O 3.37Å; M84-Y103 HydrophobicContact CE-CD2 4.02Å; M84-Y103 PolarHBondContact N-O 2.76Å; M84-Y103 PolarHBondContact O-N 2.91Å; V86-Y103 HydrophobicContact CB-CD1 4.2Å; V86-Y103 HydrophobicContact CB-CE1 4.12Å; V86-Y103 HydrophobicContact CG1-CE1 4.41Å; V86-Y103 HydrophobicContact CG2-CD1 3.78Å; V86-Y103 HydrophobicContact CG2-CD2 3.99Å; V86-Y103 HydrophobicContact CG2-CE1 4Å; V86-Y103 HydrophobicContact CG2-CE2 4.17Å; V86-Y103 HydrophobicContact CG2-CG 3.78Å; Q101-Y103 HydrophobicContact CB-CD1 4.48Å; Q101-Y103 HydrophobicContact CB-CE1 4.3Å; Y103-F112 HydrophobicContact CD2-CB 4.26Å; Y103-F112 HydrophobicContact CD2-CG 4.44Å; Y103-F112 HydrophobicContact CG-CB 4.37Å; Y103-F112 WeakPolarHBondContact O-CD1 3.43Å; Y103-L114 HydrophobicContact CD1-CD1 4.09Å; Y103-L114 HydrophobicContact CE1-CD1 4.14Å; Y103-V125 HydrophobicContact CD2-CB 4.44Å; Y103-V125 HydrophobicContact CD2-CG1 4.22Å; Y103-V125 HydrophobicContact CD2-CG2 4.35Å; Y103-V125 HydrophobicContact CE2-CB 4.31Å; Y103-V125 HydrophobicContact CE2-CG1 3.82Å; Y103-V125 HydrophobicContact CE2-CG2 4.02Å
104	G	97.2	Very high	95.7	Very high	21 Å²	21	46.3 Å²	46.3	22%	0.216	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	144.3	-175.6	0	0	0	0	0	112	L102 F112 L113	L102-G104 PolarHBondContact O-N 2.8Å; G104-F112 CarbonylContact O-C 3.52Å; G104-F112 WeakPolarHBondContact O-CA 3.19Å; G104-L113 PolarHBondContact N-O 3.11Å; G104-L113 PolarHBondContact O-N 2.88Å
105	D	95.4	Very high	95.8	Very high	69 Å²	69	50.1 Å²	50.1	37%	0.369	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	139.5	175.8	-178.9	19.8	0	0	0	111.6	T82 G107	T82-D105 VanDerWaalsContact CB-OD2 3.3Å; T82-D105 WeakPolarHBondContact CB-OD2 3.35Å; T82-D105 VanDerWaalsContact OG1-CB 3.3Å; T82-D105 WeakPolarHBondContact OG1-CB 3.39Å; T82-D105 PolarHBondContact OG1-OD2 2.89Å; D105-G107 WeakPolarHBondContact OD1-CA 3.25Å; D105-G107 PolarHBondContact OD1-N 2.92Å
106	T	96.5	Very high	94.9	Very high	60 Å²	60	48 Å²	48	37%	0.368	26%	0.264	S	S	.	.			trans	-108.8	7.2	173.7	68.7	0	0	0	0	113	R111 L113	T106-R111 VanDerWaalsContact OG1-CB 3.28Å; T106-R111 WeakPolarHBondContact OG1-CB 3.41Å; T106-R111 PolarHBondContact OG1-O 2.71Å; T106-L113 HydrophobicContact CG2-CB 3.77Å
107	G	95.8	Very high	93.8	Very high	64 Å²	64	51.4 Å²	51.4	66%	0.66	27%	0.272	S	S	*	.	S	Bend	trans	85.9	1.3	-176.6	0	0	0	0	0	114.6	D105	D105-G107 WeakPolarHBondContact OD1-CA 3.25Å; D105-G107 PolarHBondContact OD1-N 2.92Å
108	V	97.4	Very high	92.3	Very high	70 Å²	70	51 Å²	51	42%	0.424	30%	0.295	S	S	.	.	S	Bend	trans	-126.1	121.7	177.8	-178.8	0	0	0	0	108.3	P38 G110 R111	P38-V108 HydrophobicContact CG-CG1 4.28Å; V108-G110 PolarHBondContact O-N 3.36Å; V108-R111 HydrophobicContact CB-CB 4.22Å; V108-R111 HydrophobicContact CB-CG 4.08Å; V108-R111 HydrophobicContact CG1-CG 3.99Å; V108-R111 WeakPolarHBondContact O-CB 3.25Å; V108-R111 PolarHBondContact O-N 2.9Å
109	L	97.9	Very high	90.7	Very high	111 Å²	111	55.5 Å²	55.5	58%	0.581	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	134	-179.6	-63.9	178.5	0	0	0	111.3	P38 F42 R111	P38-L109 WeakPolarHBondContact CB-O 3.41Å; F42-L109 HydrophobicContact CB-CB 4.31Å; L109-R111 VanDerWaalsContact C-N 3.25Å; L109-R111 PolarHBondContact O-N 2.9Å
110	G	97.6	Very high	89.5	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.01	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-1.3	-177.5	0	0	0	0	0	114.7	V108 V126 V127	V108-G110 PolarHBondContact O-N 3.36Å; G110-V126 CarbonylContact O-C 3.48Å; G110-V126 WeakPolarHBondContact O-CA 3.48Å; G110-V127 PolarHBondContact O-N 2.78Å
111	R	98.5	Very high	88.9	Confident	46 Å²	46	59.2 Å²	59.2	17%	0.174	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.8	171.6	-59	-165.2	170.9	-103.1	9	110.7	I33 S34 I36 P38 T106 V108 L109 V125 V126	I33-R111 PolarHBondContact O-NH1 3.13Å; S34-R111 PolarHBondContact O-NH2 3.01Å; I36-R111 PolarHBondContact O-NH2 3.34Å; P38-R111 HydrophobicContact CB-CG 4.24Å; P38-R111 HydrophobicContact CG-CG 4.34Å; T106-R111 VanDerWaalsContact OG1-CB 3.28Å; T106-R111 WeakPolarHBondContact OG1-CB 3.41Å; T106-R111 PolarHBondContact OG1-O 2.71Å; V108-R111 HydrophobicContact CB-CB 4.22Å; V108-R111 HydrophobicContact CB-CG 4.08Å; V108-R111 HydrophobicContact CG1-CG 3.99Å; V108-R111 WeakPolarHBondContact O-CB 3.25Å; V108-R111 PolarHBondContact O-N 2.9Å; L109-R111 VanDerWaalsContact C-N 3.25Å; L109-R111 PolarHBondContact O-N 2.9Å; R111-V125 WeakPolarHBondContact CA-O 3.28Å; R111-V126 HydrophobicContact CG-CG2 4.1Å; R111-V126 VanDerWaalsContact NH1-CG2 3.33Å
112	F	98.3	Very high	88.7	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.035	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	159.1	-178.1	-52.7	-85.2	0	0	0	112	F42 M84 Y103 G104 V125 V127	F42-F112 HydrophobicContact CD1-CZ 4.09Å; F42-F112 HydrophobicContact CE1-CE2 4.08Å; F42-F112 AromaticContact CE1-CZ 3.58Å; F42-F112 HydrophobicContact CE1-CZ 3.58Å; F42-F112 HydrophobicContact CZ-CE2 4.37Å; F42-F112 HydrophobicContact CZ-CZ 4.22Å; M84-F112 HydrophobicContact CE-CD1 4.19Å; M84-F112 HydrophobicContact CE-CD2 3.74Å; M84-F112 HydrophobicContact CE-CE1 3.82Å; M84-F112 HydrophobicContact CE-CE2 3.34Å; M84-F112 HydrophobicContact CE-CG 4.16Å; M84-F112 HydrophobicContact CE-CZ 3.39Å; M84-F112 HydrophobicContact CG-CE1 3.98Å; M84-F112 HydrophobicContact CG-CZ 4.15Å; M84-F112 HydrophobicContact SD-CE1 4.29Å; M84-F112 HydrophobicContact SD-CE2 4.31Å; M84-F112 HydrophobicContact SD-CZ 3.85Å; Y103-F112 HydrophobicContact CD2-CB 4.26Å; Y103-F112 HydrophobicContact CD2-CG 4.44Å; Y103-F112 HydrophobicContact CG-CB 4.37Å; Y103-F112 WeakPolarHBondContact O-CD1 3.43Å; G104-F112 CarbonylContact O-C 3.52Å; G104-F112 WeakPolarHBondContact O-CA 3.19Å; F112-V125 HydrophobicContact CB-CB 4.27Å; F112-V125 PolarHBondContact N-O 2.83Å; F112-V125 PolarHBondContact O-N 3.35Å; F112-V127 HydrophobicContact CE2-CG2 4.09Å
113	L	96.6	Very high	88.7	Confident	38 Å²	38	57.8 Å²	57.8	20%	0.199	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.6	174.5	-175.9	64	0	0	0	109.9	G104 T106 Q115 A122	G104-L113 PolarHBondContact N-O 3.11Å; G104-L113 PolarHBondContact O-N 2.88Å; T106-L113 HydrophobicContact CG2-CB 3.77Å; L113-Q115 VanDerWaalsContact CD2-NE2 3.3Å; L113-A122 HydrophobicContact CD1-CB 3.95Å
114	L	94.1	Very high	88.7	Confident	17 Å²	17	61 Å²	61	9%	0.089	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.6	168.1	179.6	71.4	0	0	0	108.6	Q101 Y103 A116 V123	Q101-L114 HydrophobicContact CB-CD1 3.67Å; Q101-L114 HydrophobicContact CG-CD1 3.89Å; Y103-L114 HydrophobicContact CD1-CD1 4.09Å; Y103-L114 HydrophobicContact CE1-CD1 4.14Å; L114-A116 PolarHBondContact O-N 3.38Å; L114-V123 HydrophobicContact CB-CB 4.19Å; L114-V123 HydrophobicContact CD2-CB 4.4Å; L114-V123 HydrophobicContact CD2-CG2 4.5Å; L114-V123 PolarHBondContact N-O 2.74Å; L114-V123 PolarHBondContact O-N 3.31Å
115	Q	87.3	Confident	88.7	Confident	131 Å²	131	60 Å²	60	61%	0.612	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-73.8	123	171.9	-65	-66.6	-7.4	0	0	108.8	L113	L113-Q115 VanDerWaalsContact CD2-NE2 3.3Å
116	A	73.7	Confident	88.9	Confident	31 Å²	31	56.9 Å²	56.9	26%	0.256	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-91.7	149.6	-179.9	0	0	0	0	0	111	L114 R120 G121	L114-A116 PolarHBondContact O-N 3.38Å; A116-R120 HydrophobicContact CB-CB 3.75Å; A116-R120 WeakPolarHBondContact CB-O 3.41Å; A116-G121 WeakPolarHBondContact CB-O 3.48Å
117	R	71.8	Confident	89	Confident	97 Å²	97	54 Å²	54	37%	0.366	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-84.8	141.6	176.8	-71.5	-172.4	172.2	167.2	1.4	112.4	R120 D198 E199 R201	R117-R120 WeakPolarHBondContact O-CB 3.46Å; R117-R120 PolarHBondContact O-N 3.04Å; R117-D198 PolarHBondContact NH1-O 2.89Å; R117-D198 PolarHBondContact NH2-O 3.38Å; R117-E199 PolarHBondContact NE-O 3.34Å; R117-E199 PolarHBondContact NH2-O 3.17Å; R117-E199 VanDerWaalsContact NH2-O 3.17Å; R117-R201 PolarHBondContact NH2-O 3.26Å
118	G	65.4	Low	89.1	Confident	79 Å²	79	51.6 Å²	51.6	81%	0.814	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	-139.2	173.5	0	0	0	0	0	112.6	R120	G118-R120 PolarHBondContact O-N 2.73Å; G118-R120 VanDerWaalsContact O-N 3.17Å
119	A	61.8	Low	89.2	Confident	116 Å²	116	51.1 Å²	51.1	96%	0.959	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-2.7	-179.5	0	0	0	0	0	114	G121	A119-G121 PolarHBondContact O-N 2.64Å
120	R	70.4	Confident	89.2	Confident	148 Å²	148	46.1 Å²	46.1	56%	0.558	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-74.3	120.2	176.3	-62.5	-175.4	178.1	-179.7	1.5	107.3	A116 R117 G118 R142	A116-R120 HydrophobicContact CB-CB 3.75Å; A116-R120 WeakPolarHBondContact CB-O 3.41Å; R117-R120 WeakPolarHBondContact O-CB 3.46Å; R117-R120 PolarHBondContact O-N 3.04Å; G118-R120 PolarHBondContact O-N 2.73Å; G118-R120 VanDerWaalsContact O-N 3.17Å; R120-R142 VanDerWaalsContact CB-NH2 3.33Å
121	G	82.6	Confident	89.3	Confident	41 Å²	41	48.6 Å²	48.6	42%	0.423	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-68.8	157.1	175.8	0	0	0	0	0	112.5	A116 A119	A116-G121 WeakPolarHBondContact CB-O 3.48Å; A119-G121 PolarHBondContact O-N 2.64Å
122	A	91.5	Very high	89.3	Confident	39 Å²	39	47.4 Å²	47.4	32%	0.322	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-57	153.3	178.5	0	0	0	0	0	112.4	L113	L113-A122 HydrophobicContact CD1-CB 3.95Å
123	V	95.2	Very high	89.3	Confident	15 Å²	15	54 Å²	54	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.8	178.4	-173.3	0	0	0	0	109	L114 V125 L140 E141 R142	L114-V123 HydrophobicContact CB-CB 4.19Å; L114-V123 HydrophobicContact CD2-CB 4.4Å; L114-V123 HydrophobicContact CD2-CG2 4.5Å; L114-V123 PolarHBondContact N-O 2.74Å; L114-V123 PolarHBondContact O-N 3.31Å; V123-V125 HydrophobicContact CG1-CG2 4.45Å; V123-L140 HydrophobicContact CG1-CB 4.15Å; V123-L140 HydrophobicContact CG1-CD2 4.15Å; V123-E141 WeakPolarHBondContact CA-O 3.38Å; V123-R142 HydrophobicContact CG1-CB 4.46Å; V123-R142 HydrophobicContact CG2-CB 4.06Å; V123-R142 HydrophobicContact CG2-CG 3.96Å
124	H	97.1	Very high	89.4	Confident	78 Å²	78	56.4 Å²	56.4	36%	0.361	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	140	171.2	-65.8	-82.9	0	0	0	109.1	I33 L140 E141	I33-H124 HydrophobicContact CD1-CB 4.17Å; I33-H124 HydrophobicContact CG2-CB 3.86Å; H124-L140 CarbonylContact O-C 3.56Å; H124-L140 VanDerWaalsContact O-CA 3.23Å; H124-L140 WeakPolarHBondContact O-CA 3.33Å; H124-E141 HydrophobicContact CB-CB 4.45Å; H124-E141 PolarHBondContact N-O 3.3Å; H124-E141 PolarHBondContact O-N 3.41Å
125	V	98.4	Very high	89.6	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.5	-179.5	-173.6	0	0	0	0	108.9	Y103 R111 F112 V123 L138 Y139 L140	Y103-V125 HydrophobicContact CD2-CB 4.44Å; Y103-V125 HydrophobicContact CD2-CG1 4.22Å; Y103-V125 HydrophobicContact CD2-CG2 4.35Å; Y103-V125 HydrophobicContact CE2-CB 4.31Å; Y103-V125 HydrophobicContact CE2-CG1 3.82Å; Y103-V125 HydrophobicContact CE2-CG2 4.02Å; R111-V125 WeakPolarHBondContact CA-O 3.28Å; F112-V125 HydrophobicContact CB-CB 4.27Å; F112-V125 PolarHBondContact N-O 2.83Å; F112-V125 PolarHBondContact O-N 3.35Å; V123-V125 HydrophobicContact CG1-CG2 4.45Å; V125-L138 HydrophobicContact CG1-CD2 4.15Å; V125-Y139 CarbonylContact C-O 3.53Å; V125-Y139 WeakPolarHBondContact CA-O 3.33Å; V125-L140 HydrophobicContact CG1-CG 4.27Å; V125-L140 HydrophobicContact CG2-CD2 4.23Å; V125-L140 HydrophobicContact CG2-CG 4.15Å
126	V	98.8	Very high	90.1	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.8	172.3	-179.2	0	0	0	0	108.9	I33 I36 P38 G110 R111 A128 L138 Y139	I33-V126 HydrophobicContact CD1-CB 4.34Å; I33-V126 HydrophobicContact CD1-CG2 3.76Å; I33-V126 HydrophobicContact CG1-CB 4.35Å; I33-V126 HydrophobicContact CG1-CG2 3.58Å; I36-V126 HydrophobicContact CG2-CB 4.42Å; I36-V126 HydrophobicContact CG2-CG1 4.05Å; P38-V126 HydrophobicContact CB-CG1 3.94Å; G110-V126 CarbonylContact O-C 3.48Å; G110-V126 WeakPolarHBondContact O-CA 3.48Å; R111-V126 HydrophobicContact CG-CG2 4.1Å; R111-V126 VanDerWaalsContact NH1-CG2 3.33Å; V126-A128 PolarHBondContact O-N 3.17Å; V126-L138 CarbonylContact O-C 3.59Å; V126-L138 VanDerWaalsContact O-CA 3.28Å; V126-L138 WeakPolarHBondContact O-CA 3.28Å; V126-Y139 PolarHBondContact N-O 2.86Å; V126-Y139 PolarHBondContact O-N 3.38Å
127	V	98.8	Very high	91.3	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	102.4	165.4	-176.3	0	0	0	0	106.7	P38 K39 F42 F47 G110 F112 T130 L138	P38-V127 CarbonylContact C-O 3.54Å; P38-V127 WeakPolarHBondContact CA-O 3.49Å; K39-V127 PolarHBondContact N-O 3.38Å; F42-V127 HydrophobicContact CD2-CB 4.03Å; F42-V127 HydrophobicContact CD2-CG1 3.96Å; F42-V127 HydrophobicContact CD2-CG2 4.44Å; F42-V127 HydrophobicContact CE2-CB 3.93Å; F42-V127 HydrophobicContact CE2-CG1 3.78Å; F42-V127 HydrophobicContact CE2-CG2 3.9Å; F42-V127 HydrophobicContact CZ-CG2 4.28Å; F47-V127 HydrophobicContact CD2-CG1 4.46Å; F47-V127 HydrophobicContact CE2-CG1 4.01Å; F47-V127 HydrophobicContact CZ-CG1 4.42Å; F47-V127 HydrophobicContact CZ-CG2 4.31Å; G110-V127 PolarHBondContact O-N 2.78Å; F112-V127 HydrophobicContact CE2-CG2 4.09Å; V127-T130 HydrophobicContact CG1-CG2 3.94Å; V127-L138 HydrophobicContact CB-CD1 4.41Å; V127-L138 HydrophobicContact CB-CG 4.48Å; V127-L138 HydrophobicContact CG1-CD1 4.08Å; V127-L138 HydrophobicContact CG2-CD1 4.13Å; V127-L138 HydrophobicContact CG2-CD2 4.29Å; V127-L138 HydrophobicContact CG2-CG 3.99Å
128	A	98.6	Very high	92.6	Very high	13 Å²	13	45.7 Å²	45.7	11%	0.107	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-51	-172	0	0	0	0	0	111.8	I36 K39 V126 V137 Y139	I36-A128 HydrophobicContact CG2-CB 4.03Å; K39-A128 WeakPolarHBondContact CA-O 3.28Å; K39-A128 PolarHBondContact N-O 2.98Å; V126-A128 PolarHBondContact O-N 3.17Å; A128-V137 PolarHBondContact N-O 3.35Å; A128-Y139 HydrophobicContact CB-CD2 3.64Å; A128-Y139 HydrophobicContact CB-CE2 3.74Å
129	E	98.7	Very high	94.2	Very high	60 Å²	60	42.4 Å²	42.4	28%	0.28	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.8	-177.7	-67.1	167.4	-89.1	0	0	109.6	F135 A136 V137 R168	E129-F135 HydrophobicContact CB-CE2 4.13Å; E129-A136 CarbonylContact O-C 3.59Å; E129-A136 VanDerWaalsContact O-CA 3.31Å; E129-A136 WeakPolarHBondContact O-CA 3.36Å; E129-V137 HydrophobicContact CB-CB 4.17Å; E129-V137 HydrophobicContact CB-CG2 4.39Å; E129-V137 PolarHBondContact N-O 3.46Å; E129-V137 PolarHBondContact O-N 2.83Å; E129-R168 WeakPolarHBondContact OE1-CG 3.39Å; E129-R168 IonicContact OE1-CZ 3.44Å; E129-R168 IonicContact OE1-NE 3.49Å; E129-R168 PolarHBondContact OE1-NE 2.78Å; E129-R168 IonicContact OE1-NH2 2.76Å; E129-R168 IonicContact OE2-CZ 2.74Å; E129-R168 IonicContact OE2-NE 3.38Å; E129-R168 IonicContact OE2-NH2 3.83Å; E129-R168 PolarHBondContact OE2-NH2 2.8Å
130	T	98.7	Very high	95.9	Very high	6 Å²	6	37.5 Å²	37.5	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	146.1	172.1	-176.1	0	0	0	0	109.4	K39 F47 V127 Y132 F135	K39-T130 HydrophobicContact CD-CG2 4.29Å; K39-T130 WeakPolarHBondContact CE-O 3.34Å; K39-T130 HydrophobicContact CG-CG2 4.08Å; K39-T130 PolarHBondContact NZ-O 3.31Å; F47-T130 HydrophobicContact CD2-CG2 4.28Å; F47-T130 HydrophobicContact CE2-CG2 4.48Å; V127-T130 HydrophobicContact CG1-CG2 3.94Å; T130-Y132 HydrophobicContact CG2-CD1 3.82Å; T130-Y132 HydrophobicContact CG2-CE1 3.66Å; T130-Y132 HydrophobicContact CG2-CG 4.41Å; T130-Y132 WeakPolarHBondContact OG1-CA 3.44Å; T130-Y132 PolarHBondContact OG1-N 3.17Å; T130-F135 WeakPolarHBondContact CA-O 3.02Å; T130-F135 WeakPolarHBondContact CB-O 3.36Å; T130-F135 PolarHBondContact OG1-O 3.3Å
131	D	98.4	Very high	97.1	Very high	53 Å²	53	31.1 Å²	31.1	28%	0.283	17%	0.17	S	C	.	.			trans	-100	5.7	165.5	66.5	-5	0	0	0	112.2	Q133 N134 F135	D131-Q133 PolarHBondContact O-N 2.74Å; D131-Q133 PolarHBondContact OD1-N 2.78Å; D131-N134 PolarHBondContact OD1-N 2.79Å; D131-N134 VanDerWaalsContact OD2-CB 3.31Å; D131-N134 WeakPolarHBondContact OD2-CB 3.33Å; D131-N134 PolarHBondContact OD2-ND2 2.94Å; D131-F135 HydrophobicContact CB-CD1 4.48Å; D131-F135 HydrophobicContact CB-CE1 4.17Å; D131-F135 PolarHBondContact OD1-N 3.41Å
132	Y	98.7	Very high	97.6	Very high	21 Å²	21	34.6 Å²	34.6	8%	0.082	17%	0.171	C	C	.	.	S	Bend	trans	64.1	-23.4	-175.3	-50.8	-72.9	0	0	0	115.7	F42 D43 Q46 F47 T130 R153	F42-Y132 WeakPolarHBondContact CA-OH 3.23Å; F42-Y132 HydrophobicContact CD2-CE1 4.23Å; F42-Y132 HydrophobicContact CE2-CE1 4.27Å; D43-Y132 PolarHBondContact N-OH 2.79Å; D43-Y132 VanDerWaalsContact N-OH 3.09Å; Q46-Y132 HydrophobicContact CB-CD1 3.76Å; Q46-Y132 HydrophobicContact CB-CD2 4.04Å; Q46-Y132 HydrophobicContact CB-CE1 4.24Å; Q46-Y132 HydrophobicContact CB-CE2 4.47Å; Q46-Y132 HydrophobicContact CB-CG 3.64Å; F47-Y132 HydrophobicContact CB-CD1 4.01Å; F47-Y132 HydrophobicContact CB-CE1 4.23Å; F47-Y132 HydrophobicContact CD2-CD1 4.12Å; F47-Y132 HydrophobicContact CD2-CE1 4.48Å; T130-Y132 HydrophobicContact CG2-CD1 3.82Å; T130-Y132 HydrophobicContact CG2-CE1 3.66Å; T130-Y132 HydrophobicContact CG2-CG 4.41Å; T130-Y132 WeakPolarHBondContact OG1-CA 3.44Å; T130-Y132 PolarHBondContact OG1-N 3.17Å; Y132-R153 PolarHBondContact O-NE 3.2Å; Y132-R153 PolarHBondContact O-NH2 3.04Å
133	Q	98.4	Very high	97.5	Very high	146 Å²	146	37.3 Å²	37.3	68%	0.682	19%	0.193	S	C	*	.	S	Bend	trans	-103.1	-28.4	-169	-63.6	178.4	25.7	0	0	113.9	D131 R153	D131-Q133 PolarHBondContact O-N 2.74Å; D131-Q133 PolarHBondContact OD1-N 2.78Å; Q133-R153 VanDerWaalsContact C-CG 3.49Å; Q133-R153 WeakPolarHBondContact O-CB 3.37Å; Q133-R153 WeakPolarHBondContact O-CG 3.5Å
134	N	98.3	Very high	97.2	Very high	89 Å²	89	38.8 Å²	38.8	48%	0.476	21%	0.211	S	C	.	.	S	Bend	trans	-125.8	-46.7	-174.9	-56.6	-71.7	0	0	0	111.8	D131 A152 R153	D131-N134 PolarHBondContact OD1-N 2.79Å; D131-N134 VanDerWaalsContact OD2-CB 3.31Å; D131-N134 WeakPolarHBondContact OD2-CB 3.33Å; D131-N134 PolarHBondContact OD2-ND2 2.94Å; N134-A152 CarbonylContact O-C 3.48Å; N134-A152 WeakPolarHBondContact O-CA 3.44Å; N134-R153 PolarHBondContact O-N 2.83Å
135	F	98.8	Very high	97	Very high	42 Å²	42	40.9 Å²	40.9	18%	0.184	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	162	-172.4	82.3	-79.8	0	0	0	114.1	W51 E129 T130 D131 V137 L150 Y151 V161	W51-F135 VanDerWaalsContact CZ3-C 3.48Å; E129-F135 HydrophobicContact CB-CE2 4.13Å; T130-F135 WeakPolarHBondContact CA-O 3.02Å; T130-F135 WeakPolarHBondContact CB-O 3.36Å; T130-F135 PolarHBondContact OG1-O 3.3Å; D131-F135 HydrophobicContact CB-CD1 4.48Å; D131-F135 HydrophobicContact CB-CE1 4.17Å; D131-F135 PolarHBondContact OD1-N 3.41Å; F135-V137 HydrophobicContact CD2-CG2 4.13Å; F135-V137 HydrophobicContact CE2-CG2 4.1Å; F135-L150 HydrophobicContact CB-CD1 4.38Å; F135-L150 HydrophobicContact CD2-CD1 4.35Å; F135-Y151 CarbonylContact C-O 3.55Å; F135-Y151 VanDerWaalsContact CA-O 3.25Å; F135-Y151 WeakPolarHBondContact CA-O 3.35Å; F135-V161 HydrophobicContact CB-CG1 3.7Å; F135-V161 HydrophobicContact CB-CG2 4.35Å; F135-V161 HydrophobicContact CD1-CG1 4.43Å; F135-V161 HydrophobicContact CD1-CG2 3.79Å; F135-V161 HydrophobicContact CD2-CG1 3.91Å; F135-V161 HydrophobicContact CE1-CG2 4.2Å; F135-V161 HydrophobicContact CG-CG1 3.76Å; F135-V161 HydrophobicContact CG-CG2 3.97Å
136	A	98.9	Very high	96.8	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	134.4	167.7	0	0	0	0	0	111.7	F47 W51 E129 L138 Y151	F47-A136 HydrophobicContact CE2-CB 3.61Å; F47-A136 HydrophobicContact CZ-CB 4.09Å; W51-A136 HydrophobicContact CE3-CB 4.33Å; W51-A136 HydrophobicContact CH2-CB 3.96Å; W51-A136 HydrophobicContact CZ2-CB 4.37Å; W51-A136 HydrophobicContact CZ3-CB 3.95Å; E129-A136 CarbonylContact O-C 3.59Å; E129-A136 VanDerWaalsContact O-CA 3.31Å; E129-A136 WeakPolarHBondContact O-CA 3.36Å; A136-L138 HydrophobicContact CB-CD1 3.76Å; A136-Y151 PolarHBondContact N-O 2.87Å; A136-Y151 PolarHBondContact O-N 3.39Å
137	V	98.9	Very high	96.8	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.1	171.2	-177.4	0	0	0	0	108.7	A128 E129 F135 Y139 V148 K149 L150	A128-V137 PolarHBondContact N-O 3.35Å; E129-V137 HydrophobicContact CB-CB 4.17Å; E129-V137 HydrophobicContact CB-CG2 4.39Å; E129-V137 PolarHBondContact N-O 3.46Å; E129-V137 PolarHBondContact O-N 2.83Å; F135-V137 HydrophobicContact CD2-CG2 4.13Å; F135-V137 HydrophobicContact CE2-CG2 4.1Å; V137-Y139 HydrophobicContact CG1-CE2 4.1Å; V137-V148 HydrophobicContact CG1-CG1 3.59Å; V137-K149 WeakPolarHBondContact CA-O 3.25Å; V137-L150 HydrophobicContact CG2-CD1 4.13Å
138	L	98.8	Very high	96.8	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	137.1	179.3	-84.6	65.3	0	0	0	110.1	F47 V125 V126 V127 A136 L140 V148 K149 Y151	F47-L138 HydrophobicContact CZ-CD1 4.11Å; V125-L138 HydrophobicContact CG1-CD2 4.15Å; V126-L138 CarbonylContact O-C 3.59Å; V126-L138 VanDerWaalsContact O-CA 3.28Å; V126-L138 WeakPolarHBondContact O-CA 3.28Å; V127-L138 HydrophobicContact CB-CD1 4.41Å; V127-L138 HydrophobicContact CB-CG 4.48Å; V127-L138 HydrophobicContact CG1-CD1 4.08Å; V127-L138 HydrophobicContact CG2-CD1 4.13Å; V127-L138 HydrophobicContact CG2-CD2 4.29Å; V127-L138 HydrophobicContact CG2-CG 3.99Å; A136-L138 HydrophobicContact CB-CD1 3.76Å; L138-L140 HydrophobicContact CB-CD1 4.12Å; L138-V148 CarbonylContact O-C 3.5Å; L138-V148 WeakPolarHBondContact O-CA 3.41Å; L138-K149 PolarHBondContact N-O 3.42Å; L138-K149 PolarHBondContact O-N 2.92Å; L138-Y151 HydrophobicContact CB-CE2 4.35Å; L138-Y151 HydrophobicContact CD1-CD2 4.15Å; L138-Y151 HydrophobicContact CD2-CD2 4.45Å; L138-Y151 HydrophobicContact CD2-CE2 4.06Å
139	Y	98.7	Very high	96.8	Very high	11 Å²	11	44.3 Å²	44.3	4%	0.043	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.5	168	-72.9	-103.7	0	0	0	109.3	I33 I36 V125 V126 A128 V137 L146 S147 V148 R168 A172	I33-Y139 WeakPolarHBondContact CD1-O 3.48Å; I36-Y139 HydrophobicContact CD1-CD1 3.87Å; I36-Y139 HydrophobicContact CD1-CE1 3.72Å; I36-Y139 HydrophobicContact CD1-CG 4.4Å; I36-Y139 HydrophobicContact CG1-CD1 3.92Å; I36-Y139 HydrophobicContact CG1-CE1 4.29Å; I36-Y139 HydrophobicContact CG1-CG 4.11Å; I36-Y139 HydrophobicContact CG2-CD1 4.34Å; I36-Y139 HydrophobicContact CG2-CD2 3.59Å; I36-Y139 HydrophobicContact CG2-CE2 3.97Å; I36-Y139 HydrophobicContact CG2-CG 3.79Å; V125-Y139 CarbonylContact C-O 3.53Å; V125-Y139 WeakPolarHBondContact CA-O 3.33Å; V126-Y139 PolarHBondContact N-O 2.86Å; V126-Y139 PolarHBondContact O-N 3.38Å; A128-Y139 HydrophobicContact CB-CD2 3.64Å; A128-Y139 HydrophobicContact CB-CE2 3.74Å; V137-Y139 HydrophobicContact CG1-CE2 4.1Å; Y139-L146 HydrophobicContact CD1-CD1 4.07Å; Y139-L146 HydrophobicContact CD1-CD2 4.01Å; Y139-L146 HydrophobicContact CD1-CG 4.12Å; Y139-L146 HydrophobicContact CE1-CD2 4.33Å; Y139-S147 CarbonylContact C-O 3.57Å; Y139-S147 WeakPolarHBondContact CA-O 3.44Å; Y139-V148 HydrophobicContact CD1-CG2 3.83Å; Y139-V148 HydrophobicContact CE1-CG1 4.32Å; Y139-V148 HydrophobicContact CE1-CG2 3.53Å; Y139-V148 HydrophobicContact CE2-CG1 4.28Å; Y139-R168 WeakPolarHBondContact OH-CB 3.2Å; Y139-A172 HydrophobicContact CE1-CB 4.23Å
140	L	98.1	Very high	96.8	Very high	13 Å²	13	41.5 Å²	41.5	7%	0.068	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	136	174	-63.9	82.7	0	0	0	109.8	V123 H124 V125 L138 L146 S147 K149	V123-L140 HydrophobicContact CG1-CB 4.15Å; V123-L140 HydrophobicContact CG1-CD2 4.15Å; H124-L140 CarbonylContact O-C 3.56Å; H124-L140 VanDerWaalsContact O-CA 3.23Å; H124-L140 WeakPolarHBondContact O-CA 3.33Å; V125-L140 HydrophobicContact CG1-CG 4.27Å; V125-L140 HydrophobicContact CG2-CD2 4.23Å; V125-L140 HydrophobicContact CG2-CG 4.15Å; L138-L140 HydrophobicContact CB-CD1 4.12Å; L140-L146 CarbonylContact O-C 3.55Å; L140-L146 WeakPolarHBondContact O-CA 3.37Å; L140-S147 PolarHBondContact N-O 2.93Å; L140-S147 PolarHBondContact O-N 2.79Å; L140-S147 PolarHBondContact O-OG 2.93Å; L140-S147 VanDerWaalsContact O-OG 3.11Å; L140-K149 HydrophobicContact CD1-CB 4.41Å; L140-K149 HydrophobicContact CD1-CD 3.69Å; L140-K149 HydrophobicContact CD1-CG 3.77Å
141	E	95.7	Very high	96.8	Very high	13 Å²	13	41.5 Å²	41.5	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.1	173.2	-176.5	-177	103.8	0	0	111	S31 A32 I33 V123 H124 Q145 L146	S31-E141 WeakPolarHBondContact CB-OE1 3.49Å; S31-E141 PolarHBondContact OG-OE1 2.92Å; S31-E141 PolarHBondContact OG-OE2 3.06Å; A32-E141 WeakPolarHBondContact CA-OE2 3.49Å; A32-E141 PolarHBondContact N-OE2 2.87Å; I33-E141 HydrophobicContact CB-CB 3.75Å; I33-E141 HydrophobicContact CD1-CB 4.04Å; I33-E141 HydrophobicContact CG2-CB 3.64Å; I33-E141 HydrophobicContact CG2-CG 4.33Å; I33-E141 PolarHBondContact N-OE2 2.82Å; V123-E141 WeakPolarHBondContact CA-O 3.38Å; H124-E141 HydrophobicContact CB-CB 4.45Å; H124-E141 PolarHBondContact N-O 3.3Å; H124-E141 PolarHBondContact O-N 3.41Å; E141-Q145 WeakPolarHBondContact CA-O 3.22Å; E141-L146 HydrophobicContact CB-CD1 4.29Å
142	R	92.4	Very high	96.8	Very high	115 Å²	115	39 Å²	39	43%	0.434	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127	173.6	-175.7	176.9	178.8	-175.4	-9.5	109.6	R120 V123 G144 Q145	R120-R142 VanDerWaalsContact CB-NH2 3.33Å; V123-R142 HydrophobicContact CG1-CB 4.46Å; V123-R142 HydrophobicContact CG2-CB 4.06Å; V123-R142 HydrophobicContact CG2-CG 3.96Å; R142-G144 PolarHBondContact O-N 3.11Å; R142-G144 VanDerWaalsContact O-N 3.16Å; R142-Q145 PolarHBondContact N-O 2.94Å; R142-Q145 WeakPolarHBondContact O-CB 3.38Å; R142-Q145 PolarHBondContact O-N 3.44Å
143	A	88.9	Confident	96.8	Very high	96 Å²	96	40.9 Å²	40.9	79%	0.793	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	36.2	-179	0	0	0	0	0	113.5	Q145	A143-Q145 VanDerWaalsContact C-N 3.27Å; A143-Q145 PolarHBondContact O-N 3.49Å
144	G	88.9	Confident	96.8	Very high	45 Å²	45	37.4 Å²	37.4	46%	0.464	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	5.5	-178.5	0	0	0	0	0	115.1	R142	R142-G144 PolarHBondContact O-N 3.11Å; R142-G144 VanDerWaalsContact O-N 3.16Å
145	Q	92.3	Very high	96.7	Very high	123 Å²	123	35.9 Å²	35.9	58%	0.575	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.8	174.8	-61.3	-64.3	-61	0	0	109.6	E141 R142 A143	E141-Q145 WeakPolarHBondContact CA-O 3.22Å; R142-Q145 PolarHBondContact N-O 2.94Å; R142-Q145 WeakPolarHBondContact O-CB 3.38Å; R142-Q145 PolarHBondContact O-N 3.44Å; A143-Q145 VanDerWaalsContact C-N 3.27Å; A143-Q145 PolarHBondContact O-N 3.49Å
146	L	96.1	Very high	96.7	Very high	26 Å²	26	39.8 Å²	39.8	14%	0.136	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	146.4	178.1	-166.2	66.1	0	0	0	110.5	A32 I33 Y139 L140 E141 A172	A32-L146 HydrophobicContact CB-CB 4.44Å; A32-L146 HydrophobicContact CB-CD2 4.36Å; I33-L146 HydrophobicContact CB-CD1 3.85Å; I33-L146 HydrophobicContact CD1-CD1 4.33Å; I33-L146 HydrophobicContact CG1-CD1 4.12Å; Y139-L146 HydrophobicContact CD1-CD1 4.07Å; Y139-L146 HydrophobicContact CD1-CD2 4.01Å; Y139-L146 HydrophobicContact CD1-CG 4.12Å; Y139-L146 HydrophobicContact CE1-CD2 4.33Å; L140-L146 CarbonylContact O-C 3.55Å; L140-L146 WeakPolarHBondContact O-CA 3.37Å; E141-L146 HydrophobicContact CB-CD1 4.29Å; L146-A172 HydrophobicContact CD2-CB 4.07Å
147	S	97.9	Very high	96.6	Very high	17 Å²	17	40.9 Å²	40.9	12%	0.119	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.4	171.7	56.2	0	0	0	0	109.8	G57 Y139 L140	G57-S147 CarbonylContact O-C 3.55Å; G57-S147 VanDerWaalsContact O-CA 3.25Å; G57-S147 WeakPolarHBondContact O-CA 3.29Å; G57-S147 WeakPolarHBondContact O-CB 3.47Å; Y139-S147 CarbonylContact C-O 3.57Å; Y139-S147 WeakPolarHBondContact CA-O 3.44Å; L140-S147 PolarHBondContact N-O 2.93Å; L140-S147 PolarHBondContact O-N 2.79Å; L140-S147 PolarHBondContact O-OG 2.93Å; L140-S147 VanDerWaalsContact O-OG 3.11Å
148	V	98.7	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.3	179.8	-165.4	0	0	0	0	108.1	V56 G57 V137 L138 Y139 F165 R168 V169 A172	V56-V148 CarbonylContact C-O 3.51Å; V56-V148 WeakPolarHBondContact CA-O 3.35Å; G57-V148 PolarHBondContact N-O 3.37Å; G57-V148 PolarHBondContact O-N 3.5Å; V137-V148 HydrophobicContact CG1-CG1 3.59Å; L138-V148 CarbonylContact O-C 3.5Å; L138-V148 WeakPolarHBondContact O-CA 3.41Å; Y139-V148 HydrophobicContact CD1-CG2 3.83Å; Y139-V148 HydrophobicContact CE1-CG1 4.32Å; Y139-V148 HydrophobicContact CE1-CG2 3.53Å; Y139-V148 HydrophobicContact CE2-CG1 4.28Å; V148-F165 HydrophobicContact CB-CE2 4.13Å; V148-F165 HydrophobicContact CG1-CD2 4.1Å; V148-F165 HydrophobicContact CG1-CE2 3.83Å; V148-R168 HydrophobicContact CG1-CB 4.41Å; V148-V169 HydrophobicContact CB-CG2 4.22Å; V148-A172 HydrophobicContact CG2-CB 3.77Å
149	K	98.8	Very high	96.5	Very high	46 Å²	46	49.5 Å²	49.5	20%	0.2	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	133.4	178.8	-59.3	-167.2	179.5	-177.7	0	110.4	L53 A55 V56 V137 L138 L140 Y151	L53-K149 HydrophobicContact CD1-CB 4.28Å; L53-K149 HydrophobicContact CD1-CD 4.42Å; A55-K149 WeakPolarHBondContact O-CA 3.43Å; V56-K149 HydrophobicContact CG1-CG 4.27Å; V56-K149 HydrophobicContact CG2-CD 4.3Å; V56-K149 HydrophobicContact CG2-CG 4.03Å; V137-K149 WeakPolarHBondContact CA-O 3.25Å; L138-K149 PolarHBondContact N-O 3.42Å; L138-K149 PolarHBondContact O-N 2.92Å; L140-K149 HydrophobicContact CD1-CB 4.41Å; L140-K149 HydrophobicContact CD1-CD 3.69Å; L140-K149 HydrophobicContact CD1-CG 3.77Å; K149-Y151 HydrophobicContact CB-CD2 4.24Å; K149-Y151 HydrophobicContact CB-CE2 3.58Å; K149-Y151 HydrophobicContact CD-CE2 4.09Å; K149-Y151 WeakPolarHBondContact CD-OH 3.42Å
150	L	98.9	Very high	96.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.2	170.3	178.4	62.5	0	0	0	109.9	V54 A55 F135 V137 V161 L162 F165	V54-L150 HydrophobicContact CB-CB 4.31Å; V54-L150 HydrophobicContact CB-CD2 4.05Å; V54-L150 HydrophobicContact CB-CG 3.99Å; V54-L150 WeakPolarHBondContact CB-O 3.49Å; V54-L150 HydrophobicContact CG1-CD2 3.88Å; V54-L150 HydrophobicContact CG1-CG 4.38Å; V54-L150 HydrophobicContact CG2-CG 4.35Å; V54-L150 PolarHBondContact N-O 3.16Å; A55-L150 PolarHBondContact N-O 2.9Å; A55-L150 PolarHBondContact O-N 2.96Å; F135-L150 HydrophobicContact CB-CD1 4.38Å; F135-L150 HydrophobicContact CD2-CD1 4.35Å; V137-L150 HydrophobicContact CG2-CD1 4.13Å; L150-V161 HydrophobicContact CD1-CG1 3.74Å; L150-V161 HydrophobicContact CD2-CG1 4.29Å; L150-L162 HydrophobicContact CD2-CD2 3.86Å; L150-F165 HydrophobicContact CB-CB 4.38Å; L150-F165 HydrophobicContact CB-CD1 4.3Å; L150-F165 HydrophobicContact CB-CD2 3.62Å; L150-F165 HydrophobicContact CB-CE2 3.87Å; L150-F165 HydrophobicContact CB-CG 3.83Å; L150-F165 HydrophobicContact CB-CZ 4.32Å; L150-F165 HydrophobicContact CD1-CB 4.44Å; L150-F165 HydrophobicContact CD2-CB 3.95Å; L150-F165 HydrophobicContact CD2-CD1 4.25Å; L150-F165 HydrophobicContact CD2-CG 4.03Å; L150-F165 HydrophobicContact CG-CB 4.49Å; L150-F165 HydrophobicContact CG-CG 4.42Å
151	Y	98.9	Very high	96.5	Very high	7 Å²	7	53.7 Å²	53.7	3%	0.027	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.4	170.9	-65.2	-86.5	0	0	0	110.6	W51 L52 L53 L75 F135 A136 L138 K149	W51-Y151 HydrophobicContact CB-CD1 4.14Å; W51-Y151 HydrophobicContact CB-CG 4.45Å; L52-Y151 CarbonylContact O-C 3.54Å; L52-Y151 WeakPolarHBondContact O-CA 3.44Å; L53-Y151 HydrophobicContact CB-CD1 4.13Å; L53-Y151 HydrophobicContact CB-CE1 3.81Å; L53-Y151 HydrophobicContact CD1-CD1 4.17Å; L53-Y151 HydrophobicContact CD1-CE1 3.67Å; L53-Y151 HydrophobicContact CD1-CE2 4.35Å; L53-Y151 HydrophobicContact CG-CE1 4.27Å; L75-Y151 HydrophobicContact CD1-CD1 4.43Å; L75-Y151 HydrophobicContact CD1-CE1 3.56Å; L75-Y151 HydrophobicContact CD2-CD1 4.34Å; L75-Y151 HydrophobicContact CD2-CE1 3.58Å; L75-Y151 HydrophobicContact CG-CE1 4.12Å; F135-Y151 CarbonylContact C-O 3.55Å; F135-Y151 VanDerWaalsContact CA-O 3.25Å; F135-Y151 WeakPolarHBondContact CA-O 3.35Å; A136-Y151 PolarHBondContact N-O 2.87Å; A136-Y151 PolarHBondContact O-N 3.39Å; L138-Y151 HydrophobicContact CB-CE2 4.35Å; L138-Y151 HydrophobicContact CD1-CD2 4.15Å; L138-Y151 HydrophobicContact CD2-CD2 4.45Å; L138-Y151 HydrophobicContact CD2-CE2 4.06Å; K149-Y151 HydrophobicContact CB-CD2 4.24Å; K149-Y151 HydrophobicContact CB-CE2 3.58Å; K149-Y151 HydrophobicContact CD-CE2 4.09Å; K149-Y151 WeakPolarHBondContact CD-OH 3.42Å
152	A	98.8	Very high	96.6	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.1	173.5	0	0	0	0	0	111.7	L52 V54 N134 S154 V157	L52-A152 PolarHBondContact N-O 2.93Å; L52-A152 PolarHBondContact O-N 2.86Å; V54-A152 HydrophobicContact CG2-CB 3.67Å; N134-A152 CarbonylContact O-C 3.48Å; N134-A152 WeakPolarHBondContact O-CA 3.44Å; A152-S154 WeakPolarHBondContact CB-O 3.46Å; A152-V157 HydrophobicContact CB-CG2 3.64Å
153	R	98.3	Very high	96.9	Very high	60 Å²	60	52.5 Å²	52.5	23%	0.226	33%	0.326	C	S	.	.	S	Bend	trans	-73.5	-32.5	172.1	-69.1	-57.5	-163.9	165.2	4.6	112.3	Q46 F47 A48 T50 W51 Y132 Q133 N134	Q46-R153 PolarHBondContact O-NH2 3.46Å; Q46-R153 VanDerWaalsContact O-NH2 3.08Å; F47-R153 PolarHBondContact O-NH2 2.95Å; A48-R153 VanDerWaalsContact O-CZ 3.25Å; A48-R153 PolarHBondContact O-NH1 2.87Å; A48-R153 PolarHBondContact O-NH2 2.81Å; T50-R153 WeakPolarHBondContact O-CD 3.49Å; T50-R153 PolarHBondContact O-NH1 3.17Å; W51-R153 HydrophobicContact CE3-CG 4.14Å; W51-R153 HydrophobicContact CH2-CG 3.99Å; W51-R153 HydrophobicContact CZ3-CG 3.73Å; Y132-R153 PolarHBondContact O-NE 3.2Å; Y132-R153 PolarHBondContact O-NH2 3.04Å; Q133-R153 VanDerWaalsContact C-CG 3.49Å; Q133-R153 WeakPolarHBondContact O-CB 3.37Å; Q133-R153 WeakPolarHBondContact O-CG 3.5Å; N134-R153 PolarHBondContact O-N 2.83Å
154	S	97.8	Very high	97.4	Very high	72 Å²	72	49.6 Å²	49.6	50%	0.503	31%	0.305	S	S	.	.	S	Bend	trans	-151	164.4	-179.6	56	0	0	0	0	110.9	A152	A152-S154 WeakPolarHBondContact CB-O 3.46Å
155	L	97	Very high	97.8	Very high	58 Å²	58	47.5 Å²	47.5	30%	0.304	28%	0.283	S	S	.	.	S	Bend	trans	-112	150.2	174.7	-59.4	178.2	0	0	0	110	L52 V54 V157 K184 F187	L52-L155 HydrophobicContact CD1-CD1 4.43Å; L52-L155 HydrophobicContact CD1-CG 4.04Å; V54-L155 HydrophobicContact CG2-CD2 4.24Å; L155-V157 HydrophobicContact CD2-CG2 3.88Å; L155-K184 HydrophobicContact CD1-CB 3.83Å; L155-K184 HydrophobicContact CD1-CG 4.18Å; L155-F187 HydrophobicContact CD1-CE2 3.91Å; L155-F187 HydrophobicContact CD1-CZ 4.04Å
156	P	97.3	Very high	98.1	Very high	123 Å²	123	44.2 Å²	44.2	80%	0.799	27%	0.267	S	S	*	.	S	Bend	cis	-74.6	158.5	-1.7	32.7	-35.8	0	0	0	113
157	V	97.6	Very high	98.3	Very high	23 Å²	23	46.5 Å²	46.5	14%	0.139	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-84.2	140.7	171	-173.8	0	0	0	0	108.7	V54 A152 L155 V161 L162	V54-V157 HydrophobicContact CG1-CG2 4.02Å; V54-V157 HydrophobicContact CG2-CG2 3.7Å; A152-V157 HydrophobicContact CB-CG2 3.64Å; L155-V157 HydrophobicContact CD2-CG2 3.88Å; V157-V161 HydrophobicContact CG1-CB 3.74Å; V157-V161 HydrophobicContact CG1-CG1 3.52Å; V157-L162 HydrophobicContact CB-CD2 4.21Å; V157-L162 HydrophobicContact CB-CG 4.23Å; V157-L162 HydrophobicContact CG1-CD2 4.18Å; V157-L162 HydrophobicContact CG1-CG 4.1Å
158	S	97.9	Very high	98.3	Very high	63 Å²	63	49.2 Å²	49.2	44%	0.441	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-66	145.6	176.8	57.7	0	0	0	0	112.4	S160 V161 L162	S158-S160 VanDerWaalsContact C-N 3.25Å; S158-S160 PolarHBondContact O-N 3.34Å; S158-S160 PolarHBondContact OG-OG 2.99Å; S158-V161 PolarHBondContact O-N 3.07Å; S158-V161 VanDerWaalsContact OG-CG2 3.28Å; S158-V161 WeakPolarHBondContact OG-CG2 3.47Å; S158-L162 PolarHBondContact O-N 3.23Å; S158-L162 VanDerWaalsContact O-N 3.17Å
159	D	97.9	Very high	98.3	Very high	128 Å²	128	49.2 Å²	49.2	68%	0.684	29%	0.285	S	S	*	.	H	α-helix	trans	-55.7	-37.9	179.9	-61.9	-19.7	0	0	0	113	V161 L162 S163	D159-V161 VanDerWaalsContact C-N 3.3Å; D159-V161 PolarHBondContact O-N 3.44Å; D159-L162 PolarHBondContact O-N 3.02Å; D159-S163 PolarHBondContact O-N 2.98Å; D159-S163 PolarHBondContact O-OG 3.22Å
160	S	98.1	Very high	98.2	Very high	91 Å²	91	51.7 Å²	51.7	64%	0.636	29%	0.293	S	S	*	.	H	α-helix	trans	-59.5	-38.7	177.2	57.5	0	0	0	0	113.1	S158 G164	S158-S160 VanDerWaalsContact C-N 3.25Å; S158-S160 PolarHBondContact O-N 3.34Å; S158-S160 PolarHBondContact OG-OG 2.99Å; S160-G164 PolarHBondContact O-N 2.86Å
161	V	98.5	Very high	98.1	Very high	20 Å²	20	55.8 Å²	55.8	12%	0.121	31%	0.312	C	S	.	.	H	α-helix	trans	-73.1	-39.5	177.6	169.8	0	0	0	0	110.5	F135 L150 V157 S158 D159 G164 F165	F135-V161 HydrophobicContact CB-CG1 3.7Å; F135-V161 HydrophobicContact CB-CG2 4.35Å; F135-V161 HydrophobicContact CD1-CG1 4.43Å; F135-V161 HydrophobicContact CD1-CG2 3.79Å; F135-V161 HydrophobicContact CD2-CG1 3.91Å; F135-V161 HydrophobicContact CE1-CG2 4.2Å; F135-V161 HydrophobicContact CG-CG1 3.76Å; F135-V161 HydrophobicContact CG-CG2 3.97Å; L150-V161 HydrophobicContact CD1-CG1 3.74Å; L150-V161 HydrophobicContact CD2-CG1 4.29Å; V157-V161 HydrophobicContact CG1-CB 3.74Å; V157-V161 HydrophobicContact CG1-CG1 3.52Å; S158-V161 PolarHBondContact O-N 3.07Å; S158-V161 VanDerWaalsContact OG-CG2 3.28Å; S158-V161 WeakPolarHBondContact OG-CG2 3.47Å; D159-V161 VanDerWaalsContact C-N 3.3Å; D159-V161 PolarHBondContact O-N 3.44Å; V161-G164 PolarHBondContact O-N 2.95Å; V161-F165 WeakPolarHBondContact O-CB 3.45Å; V161-F165 PolarHBondContact O-N 3.03Å
162	L	98.6	Very high	98	Very high	38 Å²	38	56.1 Å²	56.1	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-51	176.4	-68.7	174	0	0	0	111.2	V54 L150 V157 S158 D159 G164 F165 E166 Y181	V54-L162 HydrophobicContact CG1-CD2 4.22Å; L150-L162 HydrophobicContact CD2-CD2 3.86Å; V157-L162 HydrophobicContact CB-CD2 4.21Å; V157-L162 HydrophobicContact CB-CG 4.23Å; V157-L162 HydrophobicContact CG1-CD2 4.18Å; V157-L162 HydrophobicContact CG1-CG 4.1Å; S158-L162 PolarHBondContact O-N 3.23Å; S158-L162 VanDerWaalsContact O-N 3.17Å; D159-L162 PolarHBondContact O-N 3.02Å; L162-G164 VanDerWaalsContact C-N 3.3Å; L162-G164 PolarHBondContact O-N 3.33Å; L162-F165 WeakPolarHBondContact O-CB 3.44Å; L162-F165 PolarHBondContact O-N 2.9Å; L162-F165 VanDerWaalsContact O-N 3.16Å; L162-E166 WeakPolarHBondContact O-CG 3.41Å; L162-E166 PolarHBondContact O-N 3.2Å; L162-Y181 HydrophobicContact CD2-CE1 4.21Å
163	S	98.3	Very high	97.9	Very high	66 Å²	66	64.6 Å²	64.6	46%	0.462	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-37	176.9	-59.4	0	0	0	0	112.4	D159 E166 Q167	D159-S163 PolarHBondContact O-N 2.98Å; D159-S163 PolarHBondContact O-OG 3.22Å; S163-E166 PolarHBondContact O-N 3.37Å; S163-Q167 WeakPolarHBondContact O-CB 3.39Å; S163-Q167 PolarHBondContact O-N 3.04Å
164	G	98.5	Very high	97.8	Very high	34 Å²	34	62.4 Å²	62.4	35%	0.351	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-45	173	0	0	0	0	0	112.1	S160 V161 L162 Q167 R168	S160-G164 PolarHBondContact O-N 2.86Å; V161-G164 PolarHBondContact O-N 2.95Å; L162-G164 VanDerWaalsContact C-N 3.3Å; L162-G164 PolarHBondContact O-N 3.33Å; G164-Q167 WeakPolarHBondContact O-CB 3.43Å; G164-Q167 PolarHBondContact O-N 3.08Å; G164-R168 WeakPolarHBondContact O-CG 3.43Å; G164-R168 PolarHBondContact O-N 2.85Å
165	F	98.7	Very high	97.7	Very high	1 Å²	1	62.2 Å²	62.2	0%	0.004	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-46	174.7	165.6	-103.8	0	0	0	112.5	A55 V148 L150 V161 L162 Q167 R168 V169 I179	A55-F165 HydrophobicContact CB-CD1 4.31Å; A55-F165 HydrophobicContact CB-CE1 3.51Å; A55-F165 HydrophobicContact CB-CZ 3.81Å; V148-F165 HydrophobicContact CB-CE2 4.13Å; V148-F165 HydrophobicContact CG1-CD2 4.1Å; V148-F165 HydrophobicContact CG1-CE2 3.83Å; L150-F165 HydrophobicContact CB-CB 4.38Å; L150-F165 HydrophobicContact CB-CD1 4.3Å; L150-F165 HydrophobicContact CB-CD2 3.62Å; L150-F165 HydrophobicContact CB-CE2 3.87Å; L150-F165 HydrophobicContact CB-CG 3.83Å; L150-F165 HydrophobicContact CB-CZ 4.32Å; L150-F165 HydrophobicContact CD1-CB 4.44Å; L150-F165 HydrophobicContact CD2-CB 3.95Å; L150-F165 HydrophobicContact CD2-CD1 4.25Å; L150-F165 HydrophobicContact CD2-CG 4.03Å; L150-F165 HydrophobicContact CG-CB 4.49Å; L150-F165 HydrophobicContact CG-CG 4.42Å; V161-F165 WeakPolarHBondContact O-CB 3.45Å; V161-F165 PolarHBondContact O-N 3.03Å; L162-F165 WeakPolarHBondContact O-CB 3.44Å; L162-F165 PolarHBondContact O-N 2.9Å; L162-F165 VanDerWaalsContact O-N 3.16Å; F165-Q167 VanDerWaalsContact C-N 3.26Å; F165-Q167 PolarHBondContact O-N 2.88Å; F165-R168 WeakPolarHBondContact O-CA 3.36Å; F165-R168 WeakPolarHBondContact O-CB 3.24Å; F165-R168 PolarHBondContact O-N 2.74Å; F165-V169 HydrophobicContact CD1-CG2 4.45Å; F165-V169 HydrophobicContact CD2-CG2 4.26Å; F165-V169 HydrophobicContact CE1-CG2 3.96Å; F165-V169 HydrophobicContact CE2-CG2 3.78Å; F165-V169 HydrophobicContact CZ-CG2 3.61Å; F165-V169 WeakPolarHBondContact O-CG2 3.32Å; F165-V169 PolarHBondContact O-N 3.14Å; F165-I179 HydrophobicContact CE1-CG2 3.91Å
166	E	98.6	Very high	97.6	Very high	54 Å²	54	65.5 Å²	65.5	25%	0.252	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-38.6	177.1	-70.6	172	171.8	0	0	111.7	L162 S163 V169 R170 I179 Y181	L162-E166 WeakPolarHBondContact O-CG 3.41Å; L162-E166 PolarHBondContact O-N 3.2Å; S163-E166 PolarHBondContact O-N 3.37Å; E166-V169 PolarHBondContact O-N 3.07Å; E166-R170 PolarHBondContact O-N 2.78Å; E166-R170 VanDerWaalsContact O-N 3.07Å; E166-I179 HydrophobicContact CB-CD1 4.43Å; E166-I179 HydrophobicContact CG-CD1 3.94Å; E166-Y181 PolarHBondContact OE1-OH 3.24Å
167	Q	98.4	Very high	97.5	Very high	75 Å²	75	65.5 Å²	65.5	35%	0.35	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-43.3	172.3	-179.7	60.5	25.5	0	0	112	S163 G164 F165 V169 R170 E171	S163-Q167 WeakPolarHBondContact O-CB 3.39Å; S163-Q167 PolarHBondContact O-N 3.04Å; G164-Q167 WeakPolarHBondContact O-CB 3.43Å; G164-Q167 PolarHBondContact O-N 3.08Å; F165-Q167 VanDerWaalsContact C-N 3.26Å; F165-Q167 PolarHBondContact O-N 2.88Å; Q167-V169 VanDerWaalsContact C-N 3.32Å; Q167-V169 PolarHBondContact O-N 3.29Å; Q167-R170 PolarHBondContact O-N 2.83Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.3Å; Q167-E171 PolarHBondContact NE2-OE1 3.43Å; Q167-E171 WeakPolarHBondContact O-CG 3.33Å; Q167-E171 PolarHBondContact O-N 3.01Å
168	R	98.4	Very high	97.5	Very high	73 Å²	73	65.9 Å²	65.9	28%	0.275	35%	0.351	S	S	.	.	H	α-helix	trans	-63.7	-34.4	175.3	-68.8	-44.7	-179.1	-142	-8.7	113.6	E129 Y139 V148 G164 F165 E171 A172	E129-R168 WeakPolarHBondContact OE1-CG 3.39Å; E129-R168 IonicContact OE1-CZ 3.44Å; E129-R168 IonicContact OE1-NE 3.49Å; E129-R168 PolarHBondContact OE1-NE 2.78Å; E129-R168 IonicContact OE1-NH2 2.76Å; E129-R168 IonicContact OE2-CZ 2.74Å; E129-R168 IonicContact OE2-NE 3.38Å; E129-R168 IonicContact OE2-NH2 3.83Å; E129-R168 PolarHBondContact OE2-NH2 2.8Å; Y139-R168 WeakPolarHBondContact OH-CB 3.2Å; V148-R168 HydrophobicContact CG1-CB 4.41Å; G164-R168 WeakPolarHBondContact O-CG 3.43Å; G164-R168 PolarHBondContact O-N 2.85Å; F165-R168 WeakPolarHBondContact O-CA 3.36Å; F165-R168 WeakPolarHBondContact O-CB 3.24Å; F165-R168 PolarHBondContact O-N 2.74Å; R168-E171 VanDerWaalsContact CD-OE2 3.25Å; R168-E171 WeakPolarHBondContact CD-OE2 3.28Å; R168-E171 IonicContact CZ-OE2 3.55Å; R168-E171 IonicContact NE-OE2 3.56Å; R168-E171 IonicContact NH1-OE1 3.51Å; R168-E171 PolarHBondContact NH1-OE1 2.83Å; R168-E171 IonicContact NH1-OE2 2.92Å; R168-E171 PolarHBondContact NH1-OE2 2.91Å; R168-A172 WeakPolarHBondContact O-CB 3.39Å; R168-A172 PolarHBondContact O-N 2.88Å
169	V	98.4	Very high	97.5	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-46	173.2	173.8	0	0	0	0	110.4	V148 F165 E166 Q167 E171 A172 H173 L174 I179	V148-V169 HydrophobicContact CB-CG2 4.22Å; F165-V169 HydrophobicContact CD1-CG2 4.45Å; F165-V169 HydrophobicContact CD2-CG2 4.26Å; F165-V169 HydrophobicContact CE1-CG2 3.96Å; F165-V169 HydrophobicContact CE2-CG2 3.78Å; F165-V169 HydrophobicContact CZ-CG2 3.61Å; F165-V169 WeakPolarHBondContact O-CG2 3.32Å; F165-V169 PolarHBondContact O-N 3.14Å; E166-V169 PolarHBondContact O-N 3.07Å; Q167-V169 VanDerWaalsContact C-N 3.32Å; Q167-V169 PolarHBondContact O-N 3.29Å; V169-E171 PolarHBondContact O-N 3.19Å; V169-A172 CarbonylContact O-C 3.54Å; V169-A172 WeakPolarHBondContact O-CA 3.26Å; V169-A172 WeakPolarHBondContact O-CB 3.48Å; V169-A172 PolarHBondContact O-N 3.44Å; V169-A172 VanDerWaalsContact O-N 3.13Å; V169-H173 PolarHBondContact O-N 2.9Å; V169-L174 HydrophobicContact CG1-CB 3.51Å; V169-L174 HydrophobicContact CG1-CD1 4.33Å; V169-L174 WeakPolarHBondContact O-CB 3.12Å; V169-L174 PolarHBondContact O-N 2.95Å; V169-L174 VanDerWaalsContact O-N 3.11Å; V169-I179 HydrophobicContact CB-CD1 4.15Å; V169-I179 HydrophobicContact CB-CG1 4.34Å; V169-I179 HydrophobicContact CG1-CD1 3.97Å; V169-I179 HydrophobicContact CG1-CG1 3.75Å; V169-I179 HydrophobicContact CG2-CD1 4.22Å; V169-I179 HydrophobicContact CG2-CG1 4.23Å
170	R	97.9	Very high	97.6	Very high	98 Å²	98	59 Å²	59	37%	0.37	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-43	176.1	-69.8	-172.2	-66.7	-94.2	-2.8	112.6	E166 Q167 A172 H173 E176	E166-R170 PolarHBondContact O-N 2.78Å; E166-R170 VanDerWaalsContact O-N 3.07Å; Q167-R170 PolarHBondContact O-N 2.83Å; R170-A172 PolarHBondContact O-N 3.49Å; R170-H173 WeakPolarHBondContact O-CA 3.45Å; R170-H173 PolarHBondContact O-N 2.76Å; R170-E176 IonicContact NH1-OE1 3.86Å; R170-E176 PolarHBondContact NH1-OE1 3.43Å
171	E	96.9	Very high	97.5	Very high	87 Å²	87	59.5 Å²	59.5	41%	0.407	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-26.5	175.5	-72.6	169.2	-172.4	0	0	112.8	Q167 R168 V169 H173	Q167-E171 WeakPolarHBondContact CG-OE1 3.3Å; Q167-E171 PolarHBondContact NE2-OE1 3.43Å; Q167-E171 WeakPolarHBondContact O-CG 3.33Å; Q167-E171 PolarHBondContact O-N 3.01Å; R168-E171 VanDerWaalsContact CD-OE2 3.25Å; R168-E171 WeakPolarHBondContact CD-OE2 3.28Å; R168-E171 IonicContact CZ-OE2 3.55Å; R168-E171 IonicContact NE-OE2 3.56Å; R168-E171 IonicContact NH1-OE1 3.51Å; R168-E171 PolarHBondContact NH1-OE1 2.83Å; R168-E171 IonicContact NH1-OE2 2.92Å; R168-E171 PolarHBondContact NH1-OE2 2.91Å; V169-E171 PolarHBondContact O-N 3.19Å; E171-H173 PolarHBondContact O-N 3.4Å
172	A	96.1	Very high	97.4	Very high	14 Å²	14	59.9 Å²	59.9	12%	0.116	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	9.2	171.5	0	0	0	0	0	113.6	Y139 L146 V148 R168 V169 R170 L174	Y139-A172 HydrophobicContact CE1-CB 4.23Å; L146-A172 HydrophobicContact CD2-CB 4.07Å; V148-A172 HydrophobicContact CG2-CB 3.77Å; R168-A172 WeakPolarHBondContact O-CB 3.39Å; R168-A172 PolarHBondContact O-N 2.88Å; V169-A172 CarbonylContact O-C 3.54Å; V169-A172 WeakPolarHBondContact O-CA 3.26Å; V169-A172 WeakPolarHBondContact O-CB 3.48Å; V169-A172 PolarHBondContact O-N 3.44Å; V169-A172 VanDerWaalsContact O-N 3.13Å; R170-A172 PolarHBondContact O-N 3.49Å; A172-L174 HydrophobicContact CB-CD1 4.32Å; A172-L174 PolarHBondContact O-N 2.89Å
173	H	96.2	Very high	97.3	Very high	178 Å²	178	59.7 Å²	59.7	82%	0.824	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	31.6	-177.1	-51.7	-62.5	0	0	0	114	V169 R170 E171	V169-H173 PolarHBondContact O-N 2.9Å; R170-H173 WeakPolarHBondContact O-CA 3.45Å; R170-H173 PolarHBondContact O-N 2.76Å; E171-H173 PolarHBondContact O-N 3.4Å
174	L	97.3	Very high	97.2	Very high	15 Å²	15	63.9 Å²	63.9	8%	0.079	31%	0.308	C	S	.	.			trans	-106.2	150.8	172.3	-63.1	168.3	0	0	0	109.5	G57 A59 V169 A172	G57-L174 WeakPolarHBondContact O-CD1 3.38Å; A59-L174 HydrophobicContact CB-CD2 4.03Å; V169-L174 HydrophobicContact CG1-CB 3.51Å; V169-L174 HydrophobicContact CG1-CD1 4.33Å; V169-L174 WeakPolarHBondContact O-CB 3.12Å; V169-L174 PolarHBondContact O-N 2.95Å; V169-L174 VanDerWaalsContact O-N 3.11Å; A172-L174 HydrophobicContact CB-CD1 4.32Å; A172-L174 PolarHBondContact O-N 2.89Å
175	T	96.3	Very high	96.9	Very high	67 Å²	67	71.2 Å²	71.2	41%	0.411	33%	0.327	S	S	.	.			trans	-96	166.3	-177.9	53.9	0	0	0	0	111.8	D177 Q178	T175-D177 VanDerWaalsContact C-N 3.3Å; T175-D177 WeakPolarHBondContact CB-OD1 3.25Å; T175-D177 PolarHBondContact O-N 2.9Å; T175-D177 PolarHBondContact OG1-OD1 2.75Å; T175-Q178 VanDerWaalsContact N-OE1 3.11Å; T175-Q178 WeakPolarHBondContact O-CA 3.3Å; T175-Q178 WeakPolarHBondContact O-CB 3.21Å; T175-Q178 PolarHBondContact O-N 2.82Å; T175-Q178 VanDerWaalsContact OG1-CD 3.26Å; T175-Q178 VanDerWaalsContact OG1-CG 3.31Å; T175-Q178 WeakPolarHBondContact OG1-CG 3.37Å; T175-Q178 PolarHBondContact OG1-OE1 3.41Å
176	E	94.6	Very high	96.6	Very high	127 Å²	127	73 Å²	73	59%	0.593	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-64.6	-33.1	-179.4	-68.1	179.2	179.9	0	0	112.5	R170 Q178 I179	R170-E176 IonicContact NH1-OE1 3.86Å; R170-E176 PolarHBondContact NH1-OE1 3.43Å; E176-Q178 PolarHBondContact O-N 2.02Å; E176-I179 WeakPolarHBondContact O-CB 3.37Å; E176-I179 PolarHBondContact O-N 2.92Å
177	D	95.3	Very high	96.4	Very high	124 Å²	124	73 Å²	73	66%	0.663	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-68.6	-10.2	172.8	63	-62.2	0	0	0	113.5	T175	T175-D177 VanDerWaalsContact C-N 3.3Å; T175-D177 WeakPolarHBondContact CB-OD1 3.25Å; T175-D177 PolarHBondContact O-N 2.9Å; T175-D177 PolarHBondContact OG1-OD1 2.75Å
178	Q	97.5	Very high	96.2	Very high	30 Å²	30	70.3 Å²	70.3	14%	0.14	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-97.4	9.7	173.3	-63.7	173.6	-17.9	0	0	112.4	G57 S58 T175 E176 F180	G57-Q178 CarbonylContact C-O 3.52Å; G57-Q178 VanDerWaalsContact CA-O 3.3Å; G57-Q178 WeakPolarHBondContact CA-O 3.37Å; S58-Q178 PolarHBondContact N-O 3.42Å; T175-Q178 VanDerWaalsContact N-OE1 3.11Å; T175-Q178 WeakPolarHBondContact O-CA 3.3Å; T175-Q178 WeakPolarHBondContact O-CB 3.21Å; T175-Q178 PolarHBondContact O-N 2.82Å; T175-Q178 VanDerWaalsContact OG1-CD 3.26Å; T175-Q178 VanDerWaalsContact OG1-CG 3.31Å; T175-Q178 WeakPolarHBondContact OG1-CG 3.37Å; T175-Q178 PolarHBondContact OG1-OE1 3.41Å; E176-Q178 PolarHBondContact O-N 2.02Å; Q178-F180 WeakPolarHBondContact O-CD2 3.48Å; Q178-F180 WeakPolarHBondContact O-CE2 3.45Å
179	I	98.3	Very high	95.7	Very high	22 Å²	22	72.4 Å²	72.4	11%	0.113	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	118.9	171	-58.2	178.5	0	0	0	109.5	A55 F165 E166 V169 E176 Y181	A55-I179 HydrophobicContact CB-CG2 4.35Å; F165-I179 HydrophobicContact CE1-CG2 3.91Å; E166-I179 HydrophobicContact CB-CD1 4.43Å; E166-I179 HydrophobicContact CG-CD1 3.94Å; V169-I179 HydrophobicContact CB-CD1 4.15Å; V169-I179 HydrophobicContact CB-CG1 4.34Å; V169-I179 HydrophobicContact CG1-CD1 3.97Å; V169-I179 HydrophobicContact CG1-CG1 3.75Å; V169-I179 HydrophobicContact CG2-CD1 4.22Å; V169-I179 HydrophobicContact CG2-CG1 4.23Å; E176-I179 WeakPolarHBondContact O-CB 3.37Å; E176-I179 PolarHBondContact O-N 2.92Å; I179-Y181 HydrophobicContact CG2-CD2 4.07Å; I179-Y181 HydrophobicContact CG2-CE2 3.69Å
180	F	98.3	Very high	95.5	Very high	25 Å²	25	76 Å²	76	11%	0.11	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	110.1	178.2	-53.7	-81	0	0	0	109.2	A55 V56 S58 L63 Q64 Q178 F182	A55-F180 CarbonylContact C-O 3.55Å; A55-F180 VanDerWaalsContact CA-O 3.25Å; A55-F180 WeakPolarHBondContact CA-O 3.49Å; V56-F180 PolarHBondContact N-O 2.83Å; V56-F180 WeakPolarHBondContact O-CD2 3.46Å; V56-F180 PolarHBondContact O-N 2.87Å; S58-F180 WeakPolarHBondContact O-CE2 3.43Å; L63-F180 HydrophobicContact CB-CD2 3.77Å; L63-F180 HydrophobicContact CB-CE1 4.47Å; L63-F180 HydrophobicContact CB-CE2 3.69Å; L63-F180 HydrophobicContact CB-CG 4.21Å; L63-F180 HydrophobicContact CB-CZ 4.07Å; L63-F180 HydrophobicContact CD1-CD2 4.29Å; L63-F180 WeakPolarHBondContact O-CD1 3.47Å; L63-F180 WeakPolarHBondContact O-CE1 3.36Å; Q64-F180 HydrophobicContact CB-CZ 4.44Å; Q64-F180 HydrophobicContact CG-CZ 3.99Å; Q178-F180 WeakPolarHBondContact O-CD2 3.48Å; Q178-F180 WeakPolarHBondContact O-CE2 3.45Å; F180-F182 WeakPolarHBondContact O-CD2 3.34Å
181	Y	97.5	Very high	95.3	Very high	102 Å²	102	72.5 Å²	72.5	40%	0.4	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	135.4	173.2	-75.3	-81.1	0	0	0	110.7	A55 L162 E166 I179	A55-Y181 HydrophobicContact CB-CD1 3.76Å; A55-Y181 HydrophobicContact CB-CE1 3.89Å; A55-Y181 HydrophobicContact CB-CG 4.37Å; L162-Y181 HydrophobicContact CD2-CE1 4.21Å; E166-Y181 PolarHBondContact OE1-OH 3.24Å; I179-Y181 HydrophobicContact CG2-CD2 4.07Å; I179-Y181 HydrophobicContact CG2-CE2 3.69Å
182	F	96.4	Very high	95.1	Very high	27 Å²	27	72 Å²	72	12%	0.118	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-92.9	156.9	-179.2	-82	-115.9	0	0	0	110.7	L53 V54 V56 A70 E71 F180	L53-F182 HydrophobicContact CD2-CD1 3.56Å; L53-F182 HydrophobicContact CD2-CD2 4.1Å; L53-F182 HydrophobicContact CD2-CE1 3.4Å; L53-F182 HydrophobicContact CD2-CE2 3.97Å; L53-F182 HydrophobicContact CD2-CG 3.93Å; L53-F182 HydrophobicContact CD2-CZ 3.62Å; L53-F182 HydrophobicContact CG-CB 4.49Å; L53-F182 HydrophobicContact CG-CD1 4.01Å; L53-F182 HydrophobicContact CG-CD2 4.13Å; L53-F182 HydrophobicContact CG-CE1 4.31Å; L53-F182 HydrophobicContact CG-CE2 4.43Å; L53-F182 HydrophobicContact CG-CG 3.94Å; L53-F182 WeakPolarHBondContact O-CB 3.42Å; V54-F182 PolarHBondContact O-N 3.04Å; V56-F182 HydrophobicContact CB-CE2 4.07Å; V56-F182 HydrophobicContact CG2-CD2 4.23Å; V56-F182 HydrophobicContact CG2-CE2 3.48Å; V56-F182 VanDerWaalsContact CG2-CE2 3.48Å; V56-F182 HydrophobicContact CG2-CZ 4.01Å; A70-F182 HydrophobicContact CB-CD1 3.98Å; A70-F182 HydrophobicContact CB-CD2 4.27Å; A70-F182 HydrophobicContact CB-CE1 4Å; A70-F182 HydrophobicContact CB-CE2 4.28Å; A70-F182 HydrophobicContact CB-CG 4.11Å; A70-F182 HydrophobicContact CB-CZ 4.15Å; E71-F182 VanDerWaalsContact O-CD1 3.3Å; E71-F182 WeakPolarHBondContact O-CD1 3Å; F180-F182 WeakPolarHBondContact O-CD2 3.34Å
183	P	95.4	Very high	95	Very high	35 Å²	35	78.6 Å²	78.6	23%	0.227	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-56.5	141.4	178.9	-26	34.3	0	0	0	112.9	A70 A72 Y185 F187	A70-P183 VanDerWaalsContact O-CD 3.23Å; A70-P183 WeakPolarHBondContact O-CD 3.49Å; A70-P183 WeakPolarHBondContact O-CG 3.28Å; A72-P183 HydrophobicContact CB-CB 4.17Å; P183-Y185 VanDerWaalsContact C-N 3.32Å; P183-F187 WeakPolarHBondContact O-CZ 3.33Å
184	K	95.9	Very high	94.9	Very high	153 Å²	153	77.6 Å²	77.6	67%	0.665	39%	0.39	S	S	*	.	S	Bend	trans	-90.6	4.5	178.3	-60.6	-178.4	-176.7	179.6	0	113.2	L155	L155-K184 HydrophobicContact CD1-CB 3.83Å; L155-K184 HydrophobicContact CD1-CG 4.18Å
185	Y	93	Very high	94.8	Very high	189 Å²	189	78.7 Å²	78.7	74%	0.741	40%	0.395	S	S	*	.	S	Bend	trans	-149.5	164.6	-176.4	57.9	-94.4	0	0	0	109.9	A72 P183	A72-Y185 VanDerWaalsContact CB-O 3.29Å; A72-Y185 WeakPolarHBondContact CB-O 3.36Å; P183-Y185 VanDerWaalsContact C-N 3.32Å
186	G	92.4	Very high	94.7	Very high	37 Å²	37	77.4 Å²	77.4	38%	0.381	39%	0.386	S	S	.	.			trans	80.9	17.9	178.5	0	0	0	0	0	114.6
187	F	94.5	Very high	94.6	Very high	56 Å²	56	74.8 Å²	74.8	25%	0.246	38%	0.376	C	S	.	.			trans	-58.7	158.8	171.9	-64.3	-78.8	0	0	0	112	L52 A72 T74 L155 P183	L52-F187 HydrophobicContact CB-CE1 4.04Å; L52-F187 HydrophobicContact CB-CZ 4.14Å; L52-F187 HydrophobicContact CD1-CE2 4.32Å; L52-F187 HydrophobicContact CD1-CZ 4.24Å; L52-F187 HydrophobicContact CD2-CD1 3.86Å; L52-F187 HydrophobicContact CD2-CE1 3.88Å; L52-F187 HydrophobicContact CD2-CG 4.23Å; L52-F187 HydrophobicContact CD2-CZ 4.27Å; L52-F187 HydrophobicContact CG-CE1 4.4Å; L52-F187 HydrophobicContact CG-CZ 4.45Å; A72-F187 HydrophobicContact CB-CB 4.48Å; A72-F187 HydrophobicContact CB-CD1 3.77Å; A72-F187 HydrophobicContact CB-CE1 4.06Å; A72-F187 HydrophobicContact CB-CG 4.02Å; T74-F187 WeakPolarHBondContact OG1-CD1 3.44Å; L155-F187 HydrophobicContact CD1-CE2 3.91Å; L155-F187 HydrophobicContact CD1-CZ 4.04Å; P183-F187 WeakPolarHBondContact O-CZ 3.33Å
188	C	93.4	Very high	94.4	Very high	18 Å²	18	70.5 Å²	70.5	12%	0.122	35%	0.353	C	S	.	.			trans	-144.5	158.3	163.8	51.3	0	0	0	0	112.6	F89 C96	F89-C188 WeakPolarHBondContact CB-O 2.73Å; C96-C188 HydrophobicContact CB-CB 3.84Å; C96-C188 WeakPolarHBondContact CB-SG 3.37Å; C96-C188 WeakPolarHBondContact SG-CB 3.37Å; C96-C188 CovalentContact SG-SG 2.02Å; C96-C188 PolarHBondContact SG-SG 3.45Å
189	E	89.2	Confident	93.9	Very high	117 Å²	117	70.9 Å²	70.9	55%	0.547	36%	0.355	S	S	.	.	S	Bend	trans	-128.8	-0.6	-169.8	-56.9	-172	161.2	0	0	112.3	T74 F89	T74-E189 HydrophobicContact CG2-CG 4.49Å; F89-E189 WeakPolarHBondContact CE1-O 2.98Å; F89-E189 WeakPolarHBondContact CZ-O 3.07Å
190	A	92.4	Very high	93.2	Very high	75 Å²	75	73.2 Å²	73.2	62%	0.62	37%	0.37	S	S	*	.			trans	-141.1	145.2	178.1	0	0	0	0	0	110.2	C96	C96-A190 VanDerWaalsContact CB-O 3.24Å; C96-A190 WeakPolarHBondContact CB-O 3.16Å
191	A	94.6	Very high	91.8	Very high	25 Å²	25	81 Å²	81	21%	0.207	40%	0.399	C	S	.	.			trans	-130.9	145.1	171.4	0	0	0	0	0	108	C96 Q98 H195	C96-A191 WeakPolarHBondContact O-CB 3.29Å; Q98-A191 HydrophobicContact CB-CB 3.71Å; A191-H195 HydrophobicContact CB-CB 4.4Å
192	D	93.4	Very high	89.9	Confident	75 Å²	75	91 Å²	91	40%	0.401	44%	0.436	S	S	.	.			trans	-71.9	167.7	171.3	67.5	68.3	0	0	0	111.1	F194 H195 V196	D192-F194 PolarHBondContact O-N 3.2Å; D192-F194 VanDerWaalsContact O-N 3.08Å; D192-F194 WeakPolarHBondContact OD1-CA 3.09Å; D192-F194 WeakPolarHBondContact OD1-CB 3.04Å; D192-F194 PolarHBondContact OD1-N 2.52Å; D192-H195 PolarHBondContact O-N 3.13Å; D192-H195 IonicContact OD1-CE1 3.94Å; D192-H195 IonicContact OD1-CG 2.97Å; D192-H195 PolarHBondContact OD1-N 3.43Å; D192-H195 IonicContact OD1-ND1 3.3Å; D192-H195 PolarHBondContact OD1-ND1 2.94Å; D192-H195 IonicContact OD2-CE1 3.73Å; D192-H195 PolarHBondContact OD2-CE1 3.05Å; D192-H195 IonicContact OD2-CG 3.78Å; D192-H195 IonicContact OD2-ND1 2.89Å; D192-H195 PolarHBondContact OD2-ND1 2.88Å; D192-V196 WeakPolarHBondContact O-CG2 3.26Å
193	Q	92.8	Very high	89.6	Confident	154 Å²	154	94.3 Å²	94.3	72%	0.72	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-59.2	-22.1	-174.8	67.4	-177.1	21.8	0	0	115.1
194	F	93.6	Very high	89.3	Confident	156 Å²	156	97.4 Å²	97.4	68%	0.684	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-86	-16.1	-179.6	-55.1	-73.8	0	0	0	112.3	D192	D192-F194 PolarHBondContact O-N 3.2Å; D192-F194 VanDerWaalsContact O-N 3.08Å; D192-F194 WeakPolarHBondContact OD1-CA 3.09Å; D192-F194 WeakPolarHBondContact OD1-CB 3.04Å; D192-F194 PolarHBondContact OD1-N 2.52Å
195	H	95.1	Very high	88.9	Confident	39 Å²	39	94.3 Å²	94.3	18%	0.181	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-110.6	27.4	-178	-58.1	100.5	0	0	0	112.5	I95 C96 W97 Q98 A191 D192	I95-H195 HydrophobicContact CG2-CB 4.47Å; C96-H195 WeakPolarHBondContact O-CB 3.48Å; W97-H195 WeakPolarHBondContact CA-O 3.27Å; W97-H195 HydrophobicContact CD2-CB 4.06Å; W97-H195 AromaticContact CE2-CD2 3.59Å; W97-H195 HydrophobicContact CE3-CB 4.1Å; W97-H195 HydrophobicContact CG-CB 4.41Å; W97-H195 AromaticContact CH2-CD2 3.86Å; W97-H195 AromaticContact CZ2-CD2 3.5Å; W97-H195 AromaticContact NE1-CD2 3.99Å; Q98-H195 PolarHBondContact N-O 2.97Å; A191-H195 HydrophobicContact CB-CB 4.4Å; D192-H195 PolarHBondContact O-N 3.13Å; D192-H195 IonicContact OD1-CE1 3.94Å; D192-H195 IonicContact OD1-CG 2.97Å; D192-H195 PolarHBondContact OD1-N 3.43Å; D192-H195 IonicContact OD1-ND1 3.3Å; D192-H195 PolarHBondContact OD1-ND1 2.94Å; D192-H195 IonicContact OD2-CE1 3.73Å; D192-H195 PolarHBondContact OD2-CE1 3.05Å; D192-H195 IonicContact OD2-CG 3.78Å; D192-H195 IonicContact OD2-ND1 2.89Å; D192-H195 PolarHBondContact OD2-ND1 2.88Å
196	V	95.1	Very high	88.7	Confident	39 Å²	39	88.7 Å²	88.7	24%	0.236	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114.5	173.8	-178.2	0	0	0	0	110.1	Q98 R100 D192	Q98-V196 HydrophobicContact CB-CG2 4.25Å; Q98-V196 CarbonylContact O-C 3.58Å; Q98-V196 WeakPolarHBondContact O-CA 3.44Å; R100-V196 HydrophobicContact CG-CG1 4.31Å; D192-V196 WeakPolarHBondContact O-CG2 3.26Å
197	L	92.2	Very high	88.4	Confident	73 Å²	73	91.9 Å²	91.9	38%	0.382	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	97.9	164.7	-179.6	62.6	0	0	0	109	Q98 V99 R100 E199	Q98-L197 PolarHBondContact O-N 3.2Å; V99-L197 CarbonylContact C-O 3.59Å; V99-L197 WeakPolarHBondContact CA-O 3.45Å; V99-L197 HydrophobicContact CG1-CD2 4.25Å; V99-L197 HydrophobicContact CG1-CG 4.48Å; V99-L197 HydrophobicContact CG2-CB 4.38Å; V99-L197 HydrophobicContact CG2-CD2 4.46Å; R100-L197 PolarHBondContact N-O 2.97Å; L197-E199 HydrophobicContact CD2-CG 4.23Å; L197-E199 HydrophobicContact CG-CG 4.04Å; L197-E199 PolarHBondContact O-N 3.02Å
198	D	90.8	Very high	88	Confident	33 Å²	33	94.3 Å²	94.3	18%	0.176	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	109.6	171.9	-171	-30.9	0	0	0	108.8	R117 V200 R201	R117-D198 PolarHBondContact NH1-O 2.89Å; R117-D198 PolarHBondContact NH2-O 3.38Å; D198-V200 WeakPolarHBondContact OD1-CA 3.23Å; D198-V200 WeakPolarHBondContact OD1-CB 2.98Å; D198-V200 PolarHBondContact OD1-N 2.87Å; D198-R201 PolarHBondContact OD1-N 3.2Å; D198-R201 VanDerWaalsContact OD2-CD 3.24Å; D198-R201 WeakPolarHBondContact OD2-CD 3.46Å; D198-R201 WeakPolarHBondContact OD2-CG 3.49Å; D198-R201 IonicContact OD2-NE 3.7Å
199	E	87.8	Confident	87.7	Confident	38 Å²	38	99.8 Å²	99.8	18%	0.178	48%	0.475	C	S	.	.	S	Bend	trans	-89	-5.9	175.1	-62.7	-166.2	153	0	0	113.6	V99 R100 Q101 R117 L197	V99-E199 HydrophobicContact CG1-CG 4.09Å; R100-E199 WeakPolarHBondContact O-CA 3.31Å; R100-E199 VanDerWaalsContact O-CB 3.28Å; R100-E199 WeakPolarHBondContact O-CB 3.29Å; R100-E199 PolarHBondContact O-N 2.72Å; Q101-E199 HydrophobicContact CG-CB 4.28Å; Q101-E199 PolarHBondContact NE2-OE2 3.15Å; R117-E199 PolarHBondContact NE-O 3.34Å; R117-E199 PolarHBondContact NH2-O 3.17Å; R117-E199 VanDerWaalsContact NH2-O 3.17Å; L197-E199 HydrophobicContact CD2-CG 4.23Å; L197-E199 HydrophobicContact CG-CG 4.04Å; L197-E199 PolarHBondContact O-N 3.02Å
200	V	83.4	Confident	87.5	Confident	71 Å²	71	98.5 Å²	98.5	43%	0.43	47%	0.47	S	S	.	.	S	Bend	trans	-86.5	-42.1	-178.6	-174.5	0	0	0	0	111.6	L102 D198 R202	L102-V200 HydrophobicContact CB-CG1 4.36Å; L102-V200 HydrophobicContact CB-CG2 3.97Å; D198-V200 WeakPolarHBondContact OD1-CA 3.23Å; D198-V200 WeakPolarHBondContact OD1-CB 2.98Å; D198-V200 PolarHBondContact OD1-N 2.87Å; V200-R202 PolarHBondContact O-N 3.17Å
201	R	67.8	Low	87.1	Confident	188 Å²	188	100.4 Å²	100.4	71%	0.709	46%	0.457	S	S	*	.			trans	-75.1	114.1	-177.4	-72	-178.2	178	-171.4	-1	112.3	R117 D198	R117-R201 PolarHBondContact NH2-O 3.26Å; D198-R201 PolarHBondContact OD1-N 3.2Å; D198-R201 VanDerWaalsContact OD2-CD 3.24Å; D198-R201 WeakPolarHBondContact OD2-CD 3.46Å; D198-R201 WeakPolarHBondContact OD2-CG 3.49Å; D198-R201 IonicContact OD2-NE 3.7Å
202	R	58.9	Low	86.5	Confident	314 Å²	314	107.3 Å²	107.3	100%	1.185	48%	0.48	S	S	*	.			trans	-65.2	0	175	-70.4	-175.6	-177.5	-177.4	1.5	112.3	V200	V200-R202 PolarHBondContact O-N 3.17Å

Retrieved 202 of 202 residues in 152 ms (Link to these results)

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