A0A093H2K8_STRCA Loading...

UPF0669 protein C6orf120

AlphaFold DB , UniProt , Accession A0A093H2K8, Species STRCA (Struthio camelus australis), Gene n/a, Length 185 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.9	Low	63.1	Low	210 Å²	210	139.2 Å²	139.2	100%	1.034	67%	0.67	S	S	*	*				0	-39.8	0	-72.5	-165	-89	0	0	113.5	A3 R4	M1-A3 PolarHBondContact O-N 2.83Å; M1-R4 PolarHBondContact O-N 2.94Å
2	A	57.5	Low	63.5	Low	84 Å²	84	138.4 Å²	138.4	69%	0.694	66%	0.662	S	S	*	*	H	α-helix	trans	-57.1	-34.4	-178.4	0	0	0	0	0	116.6	R4 W5 R6	A2-R4 PolarHBondContact O-N 3.43Å; A2-W5 PolarHBondContact O-N 3.33Å; A2-R6 PolarHBondContact O-N 2.95Å
3	A	58.7	Low	64.1	Low	72 Å²	72	134.5 Å²	134.5	60%	0.595	65%	0.652	S	S	*	*	H	α-helix	trans	-68.3	-30.9	-176.1	0	0	0	0	0	114.3	M1 R7	M1-A3 PolarHBondContact O-N 2.83Å; A3-R7 PolarHBondContact O-N 3.46Å
4	R	59.4	Low	64.3	Low	194 Å²	194	128.2 Å²	128.2	73%	0.732	63%	0.633	S	S	*	*	H	α-helix	trans	-71.3	-37.4	179.3	-175.5	173.8	170.9	-176	-3.5	111.3	M1 A2 R7 I8	M1-R4 PolarHBondContact O-N 2.94Å; A2-R4 PolarHBondContact O-N 3.43Å; R4-R7 PolarHBondContact O-N 3.08Å; R4-I8 HydrophobicContact CG-CD1 4.22Å; R4-I8 WeakPolarHBondContact O-CD1 3.29Å; R4-I8 VanDerWaalsContact O-CG1 3.3Å; R4-I8 WeakPolarHBondContact O-CG1 3.3Å; R4-I8 PolarHBondContact O-N 3.42Å
5	W	59	Low	64.4	Low	184 Å²	184	122.3 Å²	122.3	70%	0.697	61%	0.613	S	S	*	*	H	α-helix	trans	-70.8	-38.4	178.9	-67.5	62.2	0	0	0	111.2	A2 R7 I8 L9	A2-W5 PolarHBondContact O-N 3.33Å; W5-R7 PolarHBondContact O-N 3.19Å; W5-I8 PolarHBondContact O-N 3.46Å; W5-L9 WeakPolarHBondContact O-CB 3.46Å; W5-L9 PolarHBondContact O-N 3.22Å
6	R	63.7	Low	64.4	Low	190 Å²	190	121.7 Å²	121.7	72%	0.717	61%	0.607	S	S	*	*	H	α-helix	trans	-63.1	-39	175.4	-161.6	176.5	176.8	-160.1	-1.3	112.6	A2 L9 I10	A2-R6 PolarHBondContact O-N 2.95Å; R6-L9 PolarHBondContact O-N 2.92Å; R6-I10 HydrophobicContact CG-CD1 4.23Å; R6-I10 WeakPolarHBondContact O-CD1 3.29Å; R6-I10 VanDerWaalsContact O-CG1 3.22Å; R6-I10 WeakPolarHBondContact O-CG1 3.46Å; R6-I10 PolarHBondContact O-N 3.24Å
7	R	64.7	Low	64.2	Low	192 Å²	192	117.7 Å²	117.7	73%	0.725	60%	0.598	S	S	*	*	H	α-helix	trans	-67.3	-42.3	175.7	-72.4	-177.3	179.6	-171.1	-0.7	112.2	A3 R4 W5 L9 I10 T11	A3-R7 PolarHBondContact O-N 3.46Å; R4-R7 PolarHBondContact O-N 3.08Å; W5-R7 PolarHBondContact O-N 3.19Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.35Å; R7-I10 PolarHBondContact O-N 3.45Å; R7-T11 WeakPolarHBondContact O-CG2 3.47Å; R7-T11 PolarHBondContact O-N 3.3Å; R7-T11 PolarHBondContact O-OG1 3.43Å; R7-T11 VanDerWaalsContact O-OG1 3.08Å
8	I	71.3	Confident	63.9	Low	99 Å²	99	117.6 Å²	117.6	51%	0.508	60%	0.598	S	S	.	*	H	α-helix	trans	-62.5	-42.2	176.4	-66.5	164.3	0	0	0	110.7	R4 W5 T11 F12	R4-I8 HydrophobicContact CG-CD1 4.22Å; R4-I8 WeakPolarHBondContact O-CD1 3.29Å; R4-I8 VanDerWaalsContact O-CG1 3.3Å; R4-I8 WeakPolarHBondContact O-CG1 3.3Å; R4-I8 PolarHBondContact O-N 3.42Å; W5-I8 PolarHBondContact O-N 3.46Å; I8-T11 WeakPolarHBondContact CA-OG1 3.48Å; I8-T11 PolarHBondContact O-N 3.25Å; I8-T11 PolarHBondContact O-OG1 3.41Å; I8-F12 VanDerWaalsContact O-CB 3.29Å; I8-F12 WeakPolarHBondContact O-CB 3.36Å; I8-F12 PolarHBondContact O-N 3.41Å
9	L	68.4	Low	63.5	Low	113 Å²	113	119.9 Å²	119.9	59%	0.592	60%	0.604	S	S	*	*	H	α-helix	trans	-62.9	-44.8	176.1	-118.6	128.2	0	0	0	111.9	W5 R6 R7 F12 V13	W5-L9 WeakPolarHBondContact O-CB 3.46Å; W5-L9 PolarHBondContact O-N 3.22Å; R6-L9 PolarHBondContact O-N 2.92Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.35Å; L9-F12 PolarHBondContact O-N 3.39Å; L9-V13 WeakPolarHBondContact O-CB 3.27Å; L9-V13 VanDerWaalsContact O-CG2 3.26Å; L9-V13 WeakPolarHBondContact O-CG2 3.26Å; L9-V13 PolarHBondContact O-N 2.9Å
10	I	69.6	Low	63.1	Low	103 Å²	103	117.2 Å²	117.2	53%	0.528	60%	0.6	S	S	.	*	H	α-helix	trans	-64.1	-43.3	178.1	-68.5	164.1	0	0	0	111	R6 R7 F12 V13 A14	R6-I10 HydrophobicContact CG-CD1 4.23Å; R6-I10 WeakPolarHBondContact O-CD1 3.29Å; R6-I10 VanDerWaalsContact O-CG1 3.22Å; R6-I10 WeakPolarHBondContact O-CG1 3.46Å; R6-I10 PolarHBondContact O-N 3.24Å; R7-I10 PolarHBondContact O-N 3.45Å; I10-F12 VanDerWaalsContact C-N 3.3Å; I10-F12 PolarHBondContact O-N 3.44Å; I10-V13 PolarHBondContact O-N 2.95Å; I10-A14 VanDerWaalsContact O-CB 3.26Å; I10-A14 WeakPolarHBondContact O-CB 3.26Å; I10-A14 PolarHBondContact O-N 2.9Å
11	T	69.5	Low	62.6	Low	90 Å²	90	116 Å²	116	55%	0.552	60%	0.598	S	S	*	*	H	α-helix	trans	-65.3	-36	177.1	49.3	0	0	0	0	112.2	R7 I8 A15	R7-T11 WeakPolarHBondContact O-CG2 3.47Å; R7-T11 PolarHBondContact O-N 3.3Å; R7-T11 PolarHBondContact O-OG1 3.43Å; R7-T11 VanDerWaalsContact O-OG1 3.08Å; I8-T11 WeakPolarHBondContact CA-OG1 3.48Å; I8-T11 PolarHBondContact O-N 3.25Å; I8-T11 PolarHBondContact O-OG1 3.41Å; T11-A15 VanDerWaalsContact O-CB 3.27Å; T11-A15 WeakPolarHBondContact O-CB 3.43Å; T11-A15 PolarHBondContact O-N 2.86Å
12	F	68.4	Low	62.5	Low	130 Å²	130	111.9 Å²	111.9	57%	0.57	58%	0.581	S	S	*	*	H	α-helix	trans	-70.7	-41.6	178.1	-172.3	-110.5	0	0	0	111.8	I8 L9 I10 A15 Q16	I8-F12 VanDerWaalsContact O-CB 3.29Å; I8-F12 WeakPolarHBondContact O-CB 3.36Å; I8-F12 PolarHBondContact O-N 3.41Å; L9-F12 PolarHBondContact O-N 3.39Å; I10-F12 VanDerWaalsContact C-N 3.3Å; I10-F12 PolarHBondContact O-N 3.44Å; F12-A15 PolarHBondContact O-N 3.02Å; F12-Q16 WeakPolarHBondContact O-CG 3.22Å; F12-Q16 PolarHBondContact O-N 3.49Å
13	V	71.3	Confident	61.9	Low	87 Å²	87	113.1 Å²	113.1	53%	0.527	58%	0.58	S	S	.	*	H	α-helix	trans	-66.4	-41.1	174.5	172.6	0	0	0	0	111.2	L9 I10 Q16 A17	L9-V13 WeakPolarHBondContact O-CB 3.27Å; L9-V13 VanDerWaalsContact O-CG2 3.26Å; L9-V13 WeakPolarHBondContact O-CG2 3.26Å; L9-V13 PolarHBondContact O-N 2.9Å; I10-V13 PolarHBondContact O-N 2.95Å; V13-Q16 PolarHBondContact O-N 3.27Å; V13-A17 WeakPolarHBondContact O-CB 3.45Å; V13-A17 PolarHBondContact O-N 3.12Å
14	A	67.1	Low	61.4	Low	47 Å²	47	118 Å²	118	39%	0.388	59%	0.588	S	S	.	*	H	α-helix	trans	-65.4	-38.4	175.4	0	0	0	0	0	112.1	I10 A17 L18	I10-A14 VanDerWaalsContact O-CB 3.26Å; I10-A14 WeakPolarHBondContact O-CB 3.26Å; I10-A14 PolarHBondContact O-N 2.9Å; A14-A17 PolarHBondContact O-N 3.42Å; A14-L18 WeakPolarHBondContact O-CB 3.47Å; A14-L18 PolarHBondContact O-N 3.09Å
15	A	66.1	Low	61.3	Low	40 Å²	40	117.2 Å²	117.2	33%	0.331	59%	0.593	S	S	.	*	H	α-helix	trans	-65.1	-44.2	173.8	0	0	0	0	0	111.4	T11 F12 A17 L18 F19	T11-A15 VanDerWaalsContact O-CB 3.27Å; T11-A15 WeakPolarHBondContact O-CB 3.43Å; T11-A15 PolarHBondContact O-N 2.86Å; F12-A15 PolarHBondContact O-N 3.02Å; A15-A17 VanDerWaalsContact C-N 3.33Å; A15-A17 PolarHBondContact O-N 3.32Å; A15-L18 PolarHBondContact O-N 3.49Å; A15-F19 VanDerWaalsContact O-CD2 3.29Å; A15-F19 WeakPolarHBondContact O-CD2 3.22Å; A15-F19 PolarHBondContact O-N 2.81Å
16	Q	63.8	Low	61.2	Low	112 Å²	112	117.5 Å²	117.5	52%	0.523	60%	0.602	S	S	.	*	H	α-helix	trans	-63.3	-37.7	174.5	-75.2	-159.6	56.5	0	0	112.7	F12 V13 F19 A20	F12-Q16 WeakPolarHBondContact O-CG 3.22Å; F12-Q16 PolarHBondContact O-N 3.49Å; V13-Q16 PolarHBondContact O-N 3.27Å; Q16-F19 PolarHBondContact O-N 2.97Å; Q16-A20 WeakPolarHBondContact O-CB 3.18Å; Q16-A20 PolarHBondContact O-N 3.01Å
17	A	60.4	Low	61.5	Low	54 Å²	54	111 Å²	111	45%	0.446	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-40.2	174.1	0	0	0	0	0	111.8	V13 A14 A15 A20 V21	V13-A17 WeakPolarHBondContact O-CB 3.45Å; V13-A17 PolarHBondContact O-N 3.12Å; A14-A17 PolarHBondContact O-N 3.42Å; A15-A17 VanDerWaalsContact C-N 3.33Å; A15-A17 PolarHBondContact O-N 3.32Å; A17-A20 PolarHBondContact O-N 3.42Å; A17-V21 WeakPolarHBondContact O-CB 3.27Å; A17-V21 VanDerWaalsContact O-CG2 3.22Å; A17-V21 WeakPolarHBondContact O-CG2 3.39Å; A17-V21 PolarHBondContact O-N 3.01Å
18	L	59.6	Low	62.3	Low	115 Å²	115	109.4 Å²	109.4	60%	0.602	59%	0.585	S	S	*	*	H	α-helix	trans	-65.4	-38.6	173.9	-84.5	155.9	0	0	0	112.5	A14 A15 V21 N22	A14-L18 WeakPolarHBondContact O-CB 3.47Å; A14-L18 PolarHBondContact O-N 3.09Å; A15-L18 PolarHBondContact O-N 3.49Å; L18-V21 PolarHBondContact O-N 2.88Å; L18-N22 PolarHBondContact O-N 3.35Å
19	F	55.1	Low	63	Low	162 Å²	162	106.8 Å²	106.8	71%	0.711	57%	0.574	S	S	*	*	H	α-helix	trans	-67.6	-38.3	173.9	-89.9	-77.6	0	0	0	112.4	A15 Q16 N22 T23	A15-F19 VanDerWaalsContact O-CD2 3.29Å; A15-F19 WeakPolarHBondContact O-CD2 3.22Å; A15-F19 PolarHBondContact O-N 2.81Å; Q16-F19 PolarHBondContact O-N 2.97Å; F19-N22 PolarHBondContact O-N 3.34Å; F19-T23 PolarHBondContact O-N 3.5Å
20	A	56.4	Low	64.1	Low	65 Å²	65	103.7 Å²	103.7	54%	0.537	56%	0.56	S	S	.	*	H	α-helix	trans	-73.8	-24.3	177.1	0	0	0	0	0	113.7	Q16 A17 T23	Q16-A20 WeakPolarHBondContact O-CB 3.18Å; Q16-A20 PolarHBondContact O-N 3.01Å; A17-A20 PolarHBondContact O-N 3.42Å; A20-T23 PolarHBondContact O-OG1 2.95Å
21	V	53.6	Low	65	Low	92 Å²	92	107.9 Å²	107.9	56%	0.558	58%	0.578	S	S	*	*	H	α-helix	trans	-76	-26.8	172.6	168.6	0	0	0	0	111.4	A17 L18 F24	A17-V21 WeakPolarHBondContact O-CB 3.27Å; A17-V21 VanDerWaalsContact O-CG2 3.22Å; A17-V21 WeakPolarHBondContact O-CG2 3.39Å; A17-V21 PolarHBondContact O-N 3.01Å; L18-V21 PolarHBondContact O-N 2.88Å; V21-F24 WeakPolarHBondContact O-CD2 3.48Å; V21-F24 WeakPolarHBondContact O-CE2 3.34Å
22	N	48.6	Very low	66.1	Low	125 Å²	125	108.1 Å²	108.1	67%	0.668	57%	0.573	S	S	*	*	S	Bend	trans	-87.2	-4.4	177.7	-75.3	-12.7	0	0	0	114.2	L18 F19 F24	L18-N22 PolarHBondContact O-N 3.35Å; F19-N22 PolarHBondContact O-N 3.34Å; N22-F24 PolarHBondContact O-N 3.29Å
23	T	45	Very low	67.4	Low	109 Å²	109	103.9 Å²	103.9	67%	0.669	55%	0.553	S	S	*	*			trans	-78.4	45.5	165.6	37.7	0	0	0	0	111.3	F19 A20 E25	F19-T23 PolarHBondContact O-N 3.5Å; A20-T23 PolarHBondContact O-OG1 2.95Å; T23-E25 PolarHBondContact O-N 3.38Å
24	F	48.5	Very low	68.5	Low	174 Å²	174	101.9 Å²	101.9	76%	0.763	54%	0.539	S	S	*	.			trans	-65.5	117.9	149.8	-80.6	-86.4	0	0	0	104.7	V21 N22 E26	V21-F24 WeakPolarHBondContact O-CD2 3.48Å; V21-F24 WeakPolarHBondContact O-CE2 3.34Å; N22-F24 PolarHBondContact O-N 3.29Å; F24-E26 VanDerWaalsContact C-N 3.3Å; F24-E26 PolarHBondContact O-N 2.9Å
25	E	57	Low	69.8	Low	179 Å²	179	103.7 Å²	103.7	84%	0.836	54%	0.541	S	S	*	.			trans	-56	100.5	171.7	-67.6	177.4	155.6	0	0	106.9	T23 E27	T23-E25 PolarHBondContact O-N 3.38Å; E25-E27 VanDerWaalsContact C-N 3.28Å; E25-E27 PolarHBondContact O-N 2.87Å
26	E	57.8	Low	71.2	Confident	189 Å²	189	103.8 Å²	103.8	88%	0.883	54%	0.536	S	S	*	.			trans	-60.2	102.3	162.4	-105.8	176.4	169.8	0	0	104.9	F24 D28	F24-E26 VanDerWaalsContact C-N 3.3Å; F24-E26 PolarHBondContact O-N 2.9Å; E26-D28 PolarHBondContact O-N 2.93Å; E26-D28 VanDerWaalsContact O-N 3.09Å
27	E	69.9	Low	72.7	Confident	53 Å²	53	102.7 Å²	102.7	25%	0.248	53%	0.531	C	S	.	.			trans	-55.6	115.7	171	-109.6	175.9	162.3	0	0	107	E25 V29 Q95 K126	E25-E27 VanDerWaalsContact C-N 3.28Å; E25-E27 PolarHBondContact O-N 2.87Å; E27-V29 HydrophobicContact CB-CG2 4.2Å; E27-V29 PolarHBondContact O-N 2.76Å; E27-Q95 PolarHBondContact OE1-NE2 2.93Å; E27-K126 IonicContact OE2-NZ 3.64Å; E27-K126 PolarHBondContact OE2-NZ 3.4Å
28	D	80.3	Confident	74.4	Confident	159 Å²	159	103.7 Å²	103.7	85%	0.85	53%	0.532	S	S	*	.			trans	-71.5	81.8	-179.7	-168.4	16.3	0	0	0	108.9	E26	E26-D28 PolarHBondContact O-N 2.93Å; E26-D28 VanDerWaalsContact O-N 3.09Å
29	V	87.4	Confident	76.2	Confident	45 Å²	45	100.3 Å²	100.3	27%	0.273	52%	0.516	S	S	.	.			trans	-91.8	123.8	179.2	179.7	0	0	0	0	108.6	E27 W33 Y128	E27-V29 HydrophobicContact CB-CG2 4.2Å; E27-V29 PolarHBondContact O-N 2.76Å; V29-W33 HydrophobicContact CG1-CB 4.03Å; V29-W33 HydrophobicContact CG1-CE3 4.09Å; V29-Y128 HydrophobicContact CG1-CD1 4.22Å; V29-Y128 HydrophobicContact CG1-CE1 3.69Å; V29-Y128 HydrophobicContact CG2-CE1 4.47Å
30	P	90.8	Very high	78.2	Confident	47 Å²	47	98.9 Å²	98.9	31%	0.305	51%	0.511	S	S	.	.			trans	-56.5	142.2	176.5	-25	34.2	0	0	0	112.8	E32 W33	P30-E32 VanDerWaalsContact CB-OE2 3.27Å; P30-E32 WeakPolarHBondContact CB-OE2 3.36Å; P30-E32 PolarHBondContact O-N 2.81Å; P30-E32 VanDerWaalsContact O-N 3.12Å; P30-W33 HydrophobicContact CB-CD2 4.43Å; P30-W33 HydrophobicContact CB-CG 4.31Å; P30-W33 HydrophobicContact CG-CD2 4.07Å; P30-W33 HydrophobicContact CG-CE3 4.47Å; P30-W33 HydrophobicContact CG-CG 4.46Å; P30-W33 HydrophobicContact CG-CH2 4.3Å; P30-W33 HydrophobicContact CG-CZ2 3.89Å; P30-W33 PolarHBondContact O-N 3.39Å
31	E	89.3	Confident	80.2	Confident	191 Å²	191	96.9 Å²	96.9	89%	0.893	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.4	179.7	-66.4	-174.3	-178	0	0	112.8	W33	E31-W33 PolarHBondContact O-N 2.88Å
32	E	92.3	Very high	82.3	Confident	96 Å²	96	98 Å²	98	45%	0.449	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-13	178.7	-56.3	80.1	-173.8	0	0	113.2	P30 R131 T132	P30-E32 VanDerWaalsContact CB-OE2 3.27Å; P30-E32 WeakPolarHBondContact CB-OE2 3.36Å; P30-E32 PolarHBondContact O-N 2.81Å; P30-E32 VanDerWaalsContact O-N 3.12Å; E32-R131 VanDerWaalsContact O-CB 3.27Å; E32-R131 WeakPolarHBondContact O-CB 3.34Å; E32-R131 WeakPolarHBondContact O-CG 3.3Å; E32-R131 PolarHBondContact O-N 3.22Å; E32-T132 HydrophobicContact CB-CG2 4.15Å; E32-T132 HydrophobicContact CG-CG2 4.2Å
33	W	94.1	Very high	84.6	Confident	41 Å²	41	92.3 Å²	92.3	16%	0.155	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.2	-178.6	-69.4	10.5	0	0	0	111.1	V29 P30 E31 V60 H99 Y128 Y129 D130	V29-W33 HydrophobicContact CG1-CB 4.03Å; V29-W33 HydrophobicContact CG1-CE3 4.09Å; P30-W33 HydrophobicContact CB-CD2 4.43Å; P30-W33 HydrophobicContact CB-CG 4.31Å; P30-W33 HydrophobicContact CG-CD2 4.07Å; P30-W33 HydrophobicContact CG-CE3 4.47Å; P30-W33 HydrophobicContact CG-CG 4.46Å; P30-W33 HydrophobicContact CG-CH2 4.3Å; P30-W33 HydrophobicContact CG-CZ2 3.89Å; P30-W33 PolarHBondContact O-N 3.39Å; E31-W33 PolarHBondContact O-N 2.88Å; W33-V60 HydrophobicContact CD2-CB 4.49Å; W33-V60 HydrophobicContact CD2-CG2 4.19Å; W33-V60 HydrophobicContact CE3-CB 4.32Å; W33-V60 HydrophobicContact CE3-CG1 4.28Å; W33-V60 HydrophobicContact CE3-CG2 4.49Å; W33-V60 HydrophobicContact CH2-CB 4.4Å; W33-V60 HydrophobicContact CH2-CG1 3.7Å; W33-V60 HydrophobicContact CH2-CG2 4.35Å; W33-V60 HydrophobicContact CZ2-CG1 4.19Å; W33-V60 HydrophobicContact CZ2-CG2 4.01Å; W33-V60 HydrophobicContact CZ3-CB 4.27Å; W33-V60 HydrophobicContact CZ3-CG1 3.73Å; W33-H99 AromaticContact CH2-CE1 3.92Å; W33-H99 AromaticContact CZ2-CE1 3.56Å; W33-Y128 HydrophobicContact CB-CD1 3.89Å; W33-Y128 HydrophobicContact CB-CG 4.2Å; W33-Y128 HydrophobicContact CE3-CD1 4.42Å; W33-Y128 HydrophobicContact CE3-CD2 4.05Å; W33-Y128 AromaticContact CE3-CG 3.98Å; W33-Y128 HydrophobicContact CE3-CG 3.98Å; W33-Y129 WeakPolarHBondContact CA-O 3.29Å; W33-D130 PolarHBondContact NE1-OD2 3.49Å
34	I	94.7	Very high	87.1	Confident	44 Å²	44	88.6 Å²	88.6	23%	0.226	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.7	172.2	-38.6	166.4	0	0	0	108.1	L36 Y128 Y129 R131	I34-L36 PolarHBondContact O-N 3.27Å; I34-Y128 CarbonylContact O-C 3.56Å; I34-Y128 WeakPolarHBondContact O-CA 3.5Å; I34-Y129 HydrophobicContact CD1-CD1 3.78Å; I34-Y129 HydrophobicContact CD1-CG 4.36Å; I34-Y129 HydrophobicContact CG1-CD1 4.39Å; I34-Y129 PolarHBondContact N-O 2.75Å; I34-Y129 PolarHBondContact O-N 3.03Å; I34-R131 HydrophobicContact CD1-CG 3.95Å; I34-R131 HydrophobicContact CG1-CG 3.95Å; I34-R131 VanDerWaalsContact CG1-NE 3.34Å
35	L	95.8	Very high	89.5	Confident	85 Å²	85	82.5 Å²	82.5	45%	0.445	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	120.1	169	-176.3	64.4	0	0	0	109.5	H37 V38 K126 Y128	L35-H37 WeakPolarHBondContact CD1-O 3.12Å; L35-V38 HydrophobicContact CD1-CG2 4.12Å; L35-V38 HydrophobicContact CD2-CG2 3.89Å; L35-V38 HydrophobicContact CG-CG2 4.37Å; L35-K126 HydrophobicContact CD1-CB 3.81Å; L35-K126 HydrophobicContact CD1-CG 4.28Å; L35-Y128 HydrophobicContact CB-CD1 4.04Å; L35-Y128 HydrophobicContact CB-CE1 3.83Å; L35-Y128 HydrophobicContact CD1-CD1 4.11Å; L35-Y128 HydrophobicContact CD1-CE1 3.72Å; L35-Y128 HydrophobicContact CD1-CE2 4.33Å; L35-Y128 HydrophobicContact CG-CE1 4.36Å
36	L	94.6	Very high	91.4	Very high	43 Å²	43	75.8 Å²	75.8	23%	0.225	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-52.2	174.5	-59.7	-179.4	0	0	0	110.9	I34 H55 I59 V127	I34-L36 PolarHBondContact O-N 3.27Å; L36-H55 HydrophobicContact CD1-CB 4.37Å; L36-I59 HydrophobicContact CD1-CD1 3.96Å; L36-V127 WeakPolarHBondContact CB-O 3.22Å; L36-V127 PolarHBondContact N-O 2.93Å
37	H	94.9	Very high	93.3	Very high	89 Å²	89	71.5 Å²	71.5	41%	0.412	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.1	-172	-66.6	-75.7	0	0	0	111.5	L35 H55 V127	L35-H37 WeakPolarHBondContact CD1-O 3.12Å; H37-H55 AromaticContact CD2-NE2 3.49Å; H37-H55 PolarHBondContact CD2-NE2 2.61Å; H37-H55 AromaticContact NE2-CE1 3.93Å; H37-H55 AromaticContact NE2-NE2 3.22Å; H37-H55 PolarHBondContact NE2-NE2 3.03Å; H37-V127 HydrophobicContact CB-CB 4.17Å; H37-V127 HydrophobicContact CB-CG2 4.34Å; H37-V127 PolarHBondContact N-O 3.48Å; H37-V127 PolarHBondContact O-N 3.14Å
38	V	97.2	Very high	94.6	Very high	75 Å²	75	70.7 Å²	70.7	46%	0.455	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.8	166.8	-174	0	0	0	0	107.6	L35 E124 M125 K126	L35-V38 HydrophobicContact CD1-CG2 4.12Å; L35-V38 HydrophobicContact CD2-CG2 3.89Å; L35-V38 HydrophobicContact CG-CG2 4.37Å; V38-E124 HydrophobicContact CG1-CG 3.82Å; V38-M125 CarbonylContact C-O 3.47Å; V38-M125 WeakPolarHBondContact CA-O 3.07Å; V38-K126 HydrophobicContact CG1-CG 4.36Å; V38-K126 HydrophobicContact CG2-CG 4.25Å
39	V	97.1	Very high	95.5	Very high	44 Å²	44	65 Å²	65	27%	0.267	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.6	-179.8	-175.9	0	0	0	0	108.1	L51 E124 M125	V39-L51 HydrophobicContact CG1-CD1 3.99Å; V39-E124 CarbonylContact O-C 3.56Å; V39-E124 WeakPolarHBondContact O-CA 3.4Å; V39-M125 HydrophobicContact CB-CE 4.49Å; V39-M125 PolarHBondContact N-O 2.83Å; V39-M125 PolarHBondContact O-N 3.36Å
40	Q	97.7	Very high	96	Very high	131 Å²	131	67.3 Å²	67.3	61%	0.612	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.6	173.9	-69.6	179	-20	0	0	109.2	F123 E124	Q40-F123 WeakPolarHBondContact CA-O 3.44Å; Q40-E124 HydrophobicContact CG-CB 4.08Å; Q40-E124 HydrophobicContact CG-CG 4Å; Q40-E124 PolarHBondContact NE2-OE2 3.41Å
41	G	96.8	Very high	96.3	Very high	24 Å²	24	67.7 Å²	67.7	25%	0.247	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	170.5	-178.6	0	0	0	0	0	113.7	E122 F123	G41-E122 WeakPolarHBondContact O-CA 3.45Å; G41-F123 PolarHBondContact N-O 2.77Å; G41-F123 VanDerWaalsContact N-O 3.09Å; G41-F123 WeakPolarHBondContact O-CD1 3.19Å; G41-F123 PolarHBondContact O-N 3.04Å
42	Q	97.8	Very high	96.7	Very high	116 Å²	116	66.4 Å²	66.4	54%	0.542	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140	175.1	-52.2	-169.4	-28	0	0	108.5	S121 E122	Q42-S121 CarbonylContact C-O 3.54Å; Q42-S121 WeakPolarHBondContact CA-O 3.28Å; Q42-E122 HydrophobicContact CB-CG 4.48Å; Q42-E122 HydrophobicContact CG-CB 4.45Å; Q42-E122 HydrophobicContact CG-CG 3.9Å; Q42-E122 PolarHBondContact NE2-OE2 2.86Å
43	I	97.8	Very high	97	Very high	5 Å²	5	62.2 Å²	62.2	3%	0.026	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	134.4	-177	-169.5	73.9	0	0	0	110.3	N47 S49 E120 S121	I43-N47 HydrophobicContact CD1-CB 4.14Å; I43-N47 HydrophobicContact CG1-CB 4.41Å; I43-N47 VanDerWaalsContact CG1-O 3.3Å; I43-N47 WeakPolarHBondContact CG1-O 3.27Å; I43-S49 VanDerWaalsContact CD1-N 3.34Å; I43-S49 WeakPolarHBondContact CD1-OG 3.4Å; I43-E120 CarbonylContact O-C 3.54Å; I43-E120 WeakPolarHBondContact O-CA 3.32Å; I43-S121 PolarHBondContact N-O 3.13Å; I43-S121 PolarHBondContact O-N 2.93Å
44	G	98.1	Very high	97.1	Very high	31 Å²	31	64.6 Å²	64.6	32%	0.32	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	157.5	175.6	0	0	0	0	0	112.5	G46 N47	G44-G46 PolarHBondContact O-N 3.42Å; G44-N47 WeakPolarHBondContact O-CB 3.43Å; G44-N47 PolarHBondContact O-N 2.85Å
45	A	97.9	Very high	97	Very high	46 Å²	46	63.4 Å²	63.4	38%	0.38	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	125.2	173.8	0	0	0	0	0	112.3	N47 H118 L119	A45-N47 PolarHBondContact O-N 3.35Å; A45-H118 WeakPolarHBondContact CB-O 3.31Å; A45-L119 PolarHBondContact N-O 2.66Å
46	G	96.8	Very high	96.8	Very high	38 Å²	38	63.9 Å²	63.9	39%	0.392	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	9.8	177.2	0	0	0	0	0	115.1	G44 Y113 G114	G44-G46 PolarHBondContact O-N 3.42Å; G46-Y113 VanDerWaalsContact C-CE2 3.47Å; G46-G114 PolarHBondContact N-O 3.33Å
47	N	98.3	Very high	96.6	Very high	98 Å²	98	62.6 Å²	62.6	52%	0.524	34%	0.338	S	S	.	.			trans	-107.8	166.1	-179.8	-156.9	5.6	0	0	0	112	I43 G44 A45 Y113 G114	I43-N47 HydrophobicContact CD1-CB 4.14Å; I43-N47 HydrophobicContact CG1-CB 4.41Å; I43-N47 VanDerWaalsContact CG1-O 3.3Å; I43-N47 WeakPolarHBondContact CG1-O 3.27Å; G44-N47 WeakPolarHBondContact O-CB 3.43Å; G44-N47 PolarHBondContact O-N 2.85Å; A45-N47 PolarHBondContact O-N 3.35Å; N47-Y113 WeakPolarHBondContact O-CA 3.36Å; N47-Y113 WeakPolarHBondContact O-CD2 3.41Å; N47-G114 PolarHBondContact O-N 2.93Å
48	Y	98	Very high	96.7	Very high	36 Å²	36	61 Å²	61	14%	0.141	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.5	179.4	-75.8	-91.3	0	0	0	113.5	Y50 Y73 F83 I112 Y113	Y48-Y50 VanDerWaalsContact CB-CE2 3.49Å; Y48-Y50 WeakPolarHBondContact CB-OH 3.17Å; Y48-Y50 AromaticContact CD1-CE1 4Å; Y48-Y50 HydrophobicContact CD1-CE1 4Å; Y48-Y50 AromaticContact CD1-CZ 3.99Å; Y48-Y50 HydrophobicContact CG-CE1 4.2Å; Y48-Y50 HydrophobicContact CG-CE2 4.32Å; Y48-Y50 AromaticContact CG-CZ 3.72Å; Y48-Y73 HydrophobicContact CE1-CD2 4.39Å; Y48-F83 WeakPolarHBondContact OH-CD1 3.47Å; Y48-F83 PolarHBondContact OH-N 2.79Å; Y48-I112 WeakPolarHBondContact CA-O 3.48Å; Y48-Y113 HydrophobicContact CD1-CD2 4.16Å; Y48-Y113 AromaticContact CD2-CD2 3.77Å; Y48-Y113 HydrophobicContact CD2-CD2 3.77Å; Y48-Y113 HydrophobicContact CD2-CE2 4.27Å; Y48-Y113 AromaticContact CE1-CD2 3.74Å; Y48-Y113 HydrophobicContact CE1-CD2 3.74Å; Y48-Y113 AromaticContact CE1-CG 3.95Å; Y48-Y113 HydrophobicContact CE1-CG 3.95Å; Y48-Y113 AromaticContact CE2-CD2 3.29Å; Y48-Y113 HydrophobicContact CE2-CD2 3.29Å; Y48-Y113 AromaticContact CE2-CE2 3.63Å; Y48-Y113 HydrophobicContact CE2-CE2 3.63Å; Y48-Y113 HydrophobicContact CE2-CG 4.25Å; Y48-Y113 HydrophobicContact CG-CD2 4.17Å; Y48-Y113 AromaticContact CZ-CD2 3.25Å; Y48-Y113 AromaticContact CZ-CE2 3.9Å; Y48-Y113 AromaticContact CZ-CG 3.76Å
49	S	97.8	Very high	96.7	Very high	41 Å²	41	57.4 Å²	57.4	29%	0.287	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.5	161.9	-80.1	0	0	0	0	108	I43 I112	I43-S49 VanDerWaalsContact CD1-N 3.34Å; I43-S49 WeakPolarHBondContact CD1-OG 3.4Å; S49-I112 PolarHBondContact N-O 2.77Å; S49-I112 PolarHBondContact O-N 2.79Å
50	Y	98.3	Very high	96.7	Very high	92 Å²	92	55.3 Å²	55.3	36%	0.361	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.9	-176.5	-62.5	-72.6	0	0	0	111.5	Y48 H80 P81 I110	Y48-Y50 VanDerWaalsContact CB-CE2 3.49Å; Y48-Y50 WeakPolarHBondContact CB-OH 3.17Å; Y48-Y50 AromaticContact CD1-CE1 4Å; Y48-Y50 HydrophobicContact CD1-CE1 4Å; Y48-Y50 AromaticContact CD1-CZ 3.99Å; Y48-Y50 HydrophobicContact CG-CE1 4.2Å; Y48-Y50 HydrophobicContact CG-CE2 4.32Å; Y48-Y50 AromaticContact CG-CZ 3.72Å; Y50-H80 HydrophobicContact CD1-CB 4.24Å; Y50-H80 AromaticContact CD2-CD2 3.7Å; Y50-H80 VanDerWaalsContact CE1-CA 3.49Å; Y50-H80 HydrophobicContact CE1-CB 3.86Å; Y50-H80 AromaticContact CE2-CD2 3.89Å; Y50-H80 AromaticContact CG-CD2 3.86Å; Y50-P81 WeakPolarHBondContact CE1-O 3.3Å; Y50-I110 CarbonylContact C-O 3.59Å; Y50-I110 VanDerWaalsContact CA-O 3.3Å; Y50-I110 WeakPolarHBondContact CA-O 3.5Å
51	L	98.1	Very high	96.7	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.288	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	156.5	176.3	-54.9	173.8	0	0	0	109.9	V39 I110 I112 M125	V39-L51 HydrophobicContact CG1-CD1 3.99Å; L51-I110 HydrophobicContact CB-CB 4.19Å; L51-I110 PolarHBondContact N-O 2.74Å; L51-I110 PolarHBondContact O-N 2.95Å; L51-I112 HydrophobicContact CD1-CD1 3.64Å; L51-I112 HydrophobicContact CG-CD1 4.17Å; L51-M125 HydrophobicContact CD1-CE 3.49Å; L51-M125 VanDerWaalsContact CD1-CE 3.49Å
52	R	97.9	Very high	96.7	Very high	164 Å²	164	48.4 Å²	48.4	62%	0.619	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	126.6	177.1	-60.7	-178.2	-175.1	174.7	1.5	109.8	L79 P107	R52-L79 HydrophobicContact CG-CD2 4.45Å; R52-P107 HydrophobicContact CB-CB 4.35Å
53	L	97.3	Very high	96.7	Very high	9 Å²	9	42.9 Å²	42.9	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	107.6	174.5	174.3	67	0	0	0	109.8	H55 I59 V100 P107 V108 I110 V127	L53-H55 HydrophobicContact CD1-CB 4.01Å; L53-I59 HydrophobicContact CD1-CG1 4.31Å; L53-I59 HydrophobicContact CD1-CG2 4.04Å; L53-I59 HydrophobicContact CD2-CB 3.91Å; L53-I59 HydrophobicContact CD2-CG1 4.08Å; L53-I59 HydrophobicContact CD2-CG2 3.77Å; L53-V100 HydrophobicContact CD2-CB 4.33Å; L53-V100 HydrophobicContact CD2-CG1 4.18Å; L53-V100 HydrophobicContact CD2-CG2 4.19Å; L53-P107 WeakPolarHBondContact O-CA 3.22Å; L53-V108 HydrophobicContact CB-CB 4.1Å; L53-V108 HydrophobicContact CD2-CB 4.37Å; L53-V108 HydrophobicContact CD2-CG1 4.47Å; L53-V108 PolarHBondContact N-O 2.73Å; L53-V108 PolarHBondContact O-N 3.36Å; L53-I110 HydrophobicContact CB-CD1 3.83Å; L53-V127 HydrophobicContact CD1-CG1 4.34Å
54	N	95.9	Very high	96.6	Very high	91 Å²	91	47.5 Å²	47.5	49%	0.487	25%	0.248	S	C	.	.			trans	-93.5	-14.4	177.4	-66.5	-49.9	0	0	0	113.4	E56 P107	N54-E56 PolarHBondContact O-N 2.93Å; N54-P107 WeakPolarHBondContact OD1-CB 3.47Å
55	H	92.1	Very high	96.5	Very high	18 Å²	18	47.1 Å²	47.1	8%	0.083	24%	0.241	C	C	.	.			trans	-67.2	126.1	-176	-73.1	-80	0	0	0	111.3	L36 H37 L53 I59 R106 Q152	L36-H55 HydrophobicContact CD1-CB 4.37Å; H37-H55 AromaticContact CD2-NE2 3.49Å; H37-H55 PolarHBondContact CD2-NE2 2.61Å; H37-H55 AromaticContact NE2-CE1 3.93Å; H37-H55 AromaticContact NE2-NE2 3.22Å; H37-H55 PolarHBondContact NE2-NE2 3.03Å; L53-H55 HydrophobicContact CD1-CB 4.01Å; H55-I59 HydrophobicContact CB-CD1 3.82Å; H55-I59 HydrophobicContact CB-CG1 4.25Å; H55-R106 PolarHBondContact O-NE 2.83Å; H55-R106 PolarHBondContact O-NH2 3.45Å; H55-Q152 PolarHBondContact CE1-NE2 2.83Å; H55-Q152 PolarHBondContact ND1-NE2 3.04Å
56	E	91.6	Very high	96.3	Very high	95 Å²	95	48.7 Å²	48.7	44%	0.444	24%	0.242	S	C	.	.			trans	-72.1	161	174.7	-67.9	-62.2	160.1	0	0	111.7	N54 R106	N54-E56 PolarHBondContact O-N 2.93Å; E56-R106 VanDerWaalsContact OE1-CG 3.29Å; E56-R106 WeakPolarHBondContact OE1-CG 3.4Å
57	G	91.9	Very high	96.3	Very high	16 Å²	16	51.5 Å²	51.5	17%	0.165	24%	0.244	C	C	.	.	S	Bend	trans	85.6	-166.5	178.2	0	0	0	0	0	114.1	I59 A102 R106	G57-I59 PolarHBondContact O-N 3.3Å; G57-A102 WeakPolarHBondContact O-CA 3.36Å; G57-R106 PolarHBondContact O-NH2 3.27Å
58	K	95.6	Very high	96.1	Very high	56 Å²	56	48.3 Å²	48.3	24%	0.243	23%	0.234	C	C	.	.			trans	-83	116.5	-176.9	-170	-178.3	177.9	-159.3	0	109.4	V100 D130 T132 V134	K58-V100 WeakPolarHBondContact CA-O 3.33Å; K58-D130 HydrophobicContact CB-CB 4.22Å; K58-D130 HydrophobicContact CD-CB 3.9Å; K58-D130 WeakPolarHBondContact CD-OD2 3.38Å; K58-D130 WeakPolarHBondContact CE-OD2 3.48Å; K58-D130 HydrophobicContact CG-CB 3.99Å; K58-D130 IonicContact NZ-OD2 2.66Å; K58-D130 PolarHBondContact NZ-OD2 2.83Å; K58-D130 PolarHBondContact O-N 2.94Å; K58-T132 PolarHBondContact NZ-OG1 2.86Å; K58-V134 HydrophobicContact CD-CG2 4.5Å
59	I	97.5	Very high	96.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	141.4	-178.4	-58	-60.8	0	0	0	108.9	L36 L53 H55 G57 L61 H99 V100 V127 Y128 Y129	L36-I59 HydrophobicContact CD1-CD1 3.96Å; L53-I59 HydrophobicContact CD1-CG1 4.31Å; L53-I59 HydrophobicContact CD1-CG2 4.04Å; L53-I59 HydrophobicContact CD2-CB 3.91Å; L53-I59 HydrophobicContact CD2-CG1 4.08Å; L53-I59 HydrophobicContact CD2-CG2 3.77Å; H55-I59 HydrophobicContact CB-CD1 3.82Å; H55-I59 HydrophobicContact CB-CG1 4.25Å; G57-I59 PolarHBondContact O-N 3.3Å; I59-L61 HydrophobicContact CG2-CD2 4.08Å; I59-H99 CarbonylContact O-C 3.48Å; I59-V100 HydrophobicContact CB-CB 4.26Å; I59-V100 PolarHBondContact N-O 3.32Å; I59-V100 PolarHBondContact O-N 3.36Å; I59-V127 HydrophobicContact CG2-CG1 3.6Å; I59-Y128 CarbonylContact C-O 3.59Å; I59-Y128 VanDerWaalsContact CA-O 3.3Å; I59-Y128 WeakPolarHBondContact CA-O 3.2Å; I59-Y128 WeakPolarHBondContact CG2-O 3.39Å; I59-Y129 HydrophobicContact CD1-CD2 3.88Å
60	V	97.8	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.1	172.3	-168.9	0	0	0	0	108.6	W33 V97 V98 H99 Y128 D130	W33-V60 HydrophobicContact CD2-CB 4.49Å; W33-V60 HydrophobicContact CD2-CG2 4.19Å; W33-V60 HydrophobicContact CE3-CB 4.32Å; W33-V60 HydrophobicContact CE3-CG1 4.28Å; W33-V60 HydrophobicContact CE3-CG2 4.49Å; W33-V60 HydrophobicContact CH2-CB 4.4Å; W33-V60 HydrophobicContact CH2-CG1 3.7Å; W33-V60 HydrophobicContact CH2-CG2 4.35Å; W33-V60 HydrophobicContact CZ2-CG1 4.19Å; W33-V60 HydrophobicContact CZ2-CG2 4.01Å; W33-V60 HydrophobicContact CZ3-CB 4.27Å; W33-V60 HydrophobicContact CZ3-CG1 3.73Å; V60-V97 HydrophobicContact CG1-CG1 3.6Å; V60-V98 WeakPolarHBondContact CA-O 3.22Å; V60-H99 WeakPolarHBondContact CG2-ND1 2.97Å; V60-Y128 PolarHBondContact N-O 3.36Å; V60-Y128 PolarHBondContact O-N 2.82Å; V60-D130 HydrophobicContact CG2-CB 4Å
61	L	98	Very high	96	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.4	171.7	-54.3	177.5	0	0	0	106.9	I59 L72 V74 V97 V98 V100 I110 M125 V127	I59-L61 HydrophobicContact CG2-CD2 4.08Å; L61-L72 HydrophobicContact CB-CD2 3.9Å; L61-L72 HydrophobicContact CD1-CD2 4.31Å; L61-V74 HydrophobicContact CD1-CG2 3.75Å; L61-V97 CarbonylContact O-C 3.59Å; L61-V97 VanDerWaalsContact O-CA 3.3Å; L61-V97 WeakPolarHBondContact O-CA 3.47Å; L61-V98 HydrophobicContact CB-CB 4.47Å; L61-V98 PolarHBondContact N-O 3.33Å; L61-V98 PolarHBondContact O-N 2.91Å; L61-V100 HydrophobicContact CD1-CG2 3.99Å; L61-V100 HydrophobicContact CG-CG2 4.15Å; L61-I110 HydrophobicContact CD1-CD1 3.59Å; L61-I110 HydrophobicContact CD1-CG1 3.88Å; L61-I110 HydrophobicContact CD1-CG2 4.4Å; L61-I110 HydrophobicContact CD2-CD1 3.99Å; L61-I110 HydrophobicContact CG-CD1 4.46Å; L61-M125 HydrophobicContact CB-SD 4.12Å; L61-M125 HydrophobicContact CD2-SD 4.25Å; L61-V127 HydrophobicContact CD2-CB 4.42Å; L61-V127 HydrophobicContact CD2-CG1 4.01Å; L61-V127 HydrophobicContact CD2-CG2 3.93Å
62	Q	97.2	Very high	96	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.047	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.9	175.9	177.9	176.8	72.8	0	0	107.9	Q95 D96 V97 M125 K126 Y128	Q62-Q95 HydrophobicContact CG-CG 4.08Å; Q62-Q95 VanDerWaalsContact CG-NE2 3.33Å; Q62-D96 CarbonylContact C-O 3.57Å; Q62-D96 WeakPolarHBondContact CA-O 3.35Å; Q62-V97 HydrophobicContact CB-CG2 4.48Å; Q62-V97 HydrophobicContact CG-CG2 4.17Å; Q62-M125 CarbonylContact O-C 3.53Å; Q62-M125 WeakPolarHBondContact O-CA 3.34Å; Q62-K126 PolarHBondContact N-O 3.37Å; Q62-K126 PolarHBondContact O-N 2.75Å; Q62-Y128 HydrophobicContact CB-CD2 4.31Å; Q62-Y128 HydrophobicContact CB-CE2 3.95Å; Q62-Y128 PolarHBondContact OE1-OH 2.99Å
63	M	96.4	Very high	96	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	141.8	-178.5	-173.2	-177.3	73	0	0	110.3	A70 L72 D96 I112 F123 E124 M125	M63-A70 HydrophobicContact CE-CB 4.08Å; M63-A70 WeakPolarHBondContact CE-O 3.37Å; M63-A70 HydrophobicContact SD-CB 4.41Å; M63-L72 HydrophobicContact CE-CB 3.88Å; M63-L72 HydrophobicContact SD-CB 4.47Å; M63-D96 HydrophobicContact CB-CB 4.28Å; M63-D96 HydrophobicContact CE-CB 4.16Å; M63-D96 PolarHBondContact N-O 2.82Å; M63-D96 PolarHBondContact O-N 2.82Å; M63-I112 HydrophobicContact SD-CG1 4.26Å; M63-I112 HydrophobicContact SD-CG2 4.02Å; M63-F123 HydrophobicContact CG-CB 4.18Å; M63-F123 HydrophobicContact CG-CD2 4.19Å; M63-F123 HydrophobicContact SD-CB 4.26Å; M63-F123 HydrophobicContact SD-CD2 4.09Å; M63-F123 HydrophobicContact SD-CG 4.24Å; M63-E124 CarbonylContact C-O 3.49Å; M63-E124 WeakPolarHBondContact CA-O 3.41Å; M63-M125 HydrophobicContact CB-CB 4.15Å; M63-M125 HydrophobicContact CB-CG 4.12Å; M63-M125 HydrophobicContact CG-CB 4.14Å
64	R	95.4	Very high	96.1	Very high	101 Å²	101	31.2 Å²	31.2	38%	0.381	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.2	171.9	-177.2	176.6	65.6	119.9	-0.4	109.3	L66 F123 E124	R64-L66 PolarHBondContact O-N 3.32Å; R64-F123 WeakPolarHBondContact O-CA 3.48Å; R64-E124 PolarHBondContact N-O 3.48Å; R64-E124 PolarHBondContact O-N 3.1Å
65	S	95.9	Very high	96.2	Very high	24 Å²	24	26.9 Å²	26.9	17%	0.168	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	116.5	168.1	-65.9	0	0	0	0	109.5	A70 E122	S65-A70 PolarHBondContact OG-N 3.34Å; S65-E122 CarbonylContact C-O 3.5Å
66	L	95	Very high	96.5	Very high	78 Å²	78	27.3 Å²	27.3	41%	0.408	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-31.3	173.4	-56.8	179.4	0	0	0	111.2	R64 E122 E124	R64-L66 PolarHBondContact O-N 3.32Å; L66-E122 HydrophobicContact CB-CB 4.26Å; L66-E122 PolarHBondContact N-O 2.69Å; L66-E124 HydrophobicContact CD1-CB 4.27Å; L66-E124 HydrophobicContact CD2-CB 4.29Å; L66-E124 HydrophobicContact CG-CB 4.37Å
67	K	95.8	Very high	96.8	Very high	98 Å²	98	28 Å²	28	43%	0.426	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	148	177.4	178.4	-168.4	174.1	-164.7	0	108.5	E120 S121 E122	K67-E120 IonicContact NZ-OE2 2.72Å; K67-E120 PolarHBondContact NZ-OE2 2.84Å; K67-S121 CarbonylContact O-C 3.58Å; K67-S121 WeakPolarHBondContact O-CA 3.28Å; K67-E122 HydrophobicContact CB-CB 4.03Å; K67-E122 HydrophobicContact CB-CG 4.08Å; K67-E122 HydrophobicContact CD-CG 3.95Å; K67-E122 WeakPolarHBondContact CD-OE1 3.45Å; K67-E122 PolarHBondContact N-O 2.64Å; K67-E122 IonicContact NZ-OE1 2.91Å; K67-E122 PolarHBondContact NZ-OE1 2.85Å; K67-E122 PolarHBondContact O-N 3.37Å
68	G	95.6	Very high	97.1	Very high	31 Å²	31	28.7 Å²	28.7	32%	0.32	15%	0.145	S	C	.	.	S	Bend	trans	67.7	-144.9	-177.9	0	0	0	0	0	111.1
69	D	96.4	Very high	97.3	Very high	15 Å²	15	28.4 Å²	28.4	8%	0.08	15%	0.146	C	C	.	.			trans	-146.4	110	-178.6	-165.7	19.6	0	0	0	108.2	H115 H118 S121	D69-H115 HydrophobicContact CB-CB 3.92Å; D69-H115 WeakPolarHBondContact O-CB 3.29Å; D69-H115 PolarHBondContact O-N 3.24Å; D69-H118 VanDerWaalsContact CB-ND1 3.28Å; D69-H118 WeakPolarHBondContact CB-ND1 3.37Å; D69-H118 PolarHBondContact N-ND1 2.8Å; D69-S121 VanDerWaalsContact C-OG 3.23Å; D69-S121 PolarHBondContact N-OG 3.32Å; D69-S121 PolarHBondContact O-OG 3.25Å
70	A	97.2	Very high	97.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.7	176.8	0	0	0	0	0	108.3	M63 S65 I112 Y113 F123	M63-A70 HydrophobicContact CE-CB 4.08Å; M63-A70 WeakPolarHBondContact CE-O 3.37Å; M63-A70 HydrophobicContact SD-CB 4.41Å; S65-A70 PolarHBondContact OG-N 3.34Å; A70-I112 HydrophobicContact CB-CG2 4.14Å; A70-Y113 CarbonylContact C-O 3.53Å; A70-Y113 VanDerWaalsContact CA-O 3.31Å; A70-Y113 WeakPolarHBondContact CA-O 3.46Å; A70-F123 HydrophobicContact CB-CB 4.05Å; A70-F123 HydrophobicContact CB-CD1 4.38Å; A70-F123 HydrophobicContact CB-CG 4.49Å
71	D	97.4	Very high	97.3	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.2	-175.3	-74.9	-41.1	0	0	0	110.4	Y73 V91 I112 Y113 H115	D71-Y73 HydrophobicContact CB-CE2 3.67Å; D71-V91 HydrophobicContact CB-CB 4.4Å; D71-V91 HydrophobicContact CB-CG1 3.87Å; D71-V91 VanDerWaalsContact OD1-CA 3.23Å; D71-V91 WeakPolarHBondContact OD1-CA 3.44Å; D71-V91 WeakPolarHBondContact OD1-CB 2.97Å; D71-I112 CarbonylContact O-C 3.55Å; D71-I112 WeakPolarHBondContact O-CA 3.45Å; D71-Y113 HydrophobicContact CB-CD1 4.36Å; D71-Y113 PolarHBondContact N-O 3.25Å; D71-Y113 PolarHBondContact O-N 2.83Å; D71-H115 IonicContact OD2-CD2 3.97Å
72	L	98.2	Very high	97.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.5	-175.3	-174.3	64.6	0	0	0	112.3	L61 M63 V74 Q89 S90 V98 I110 I112 M125	L61-L72 HydrophobicContact CB-CD2 3.9Å; L61-L72 HydrophobicContact CD1-CD2 4.31Å; M63-L72 HydrophobicContact CE-CB 3.88Å; M63-L72 HydrophobicContact SD-CB 4.47Å; L72-V74 HydrophobicContact CG-CG2 4.35Å; L72-Q89 CarbonylContact O-C 3.59Å; L72-Q89 WeakPolarHBondContact O-CA 3.41Å; L72-Q89 WeakPolarHBondContact O-CB 3.18Å; L72-S90 PolarHBondContact N-O 3.33Å; L72-S90 PolarHBondContact O-N 2.79Å; L72-V98 HydrophobicContact CD2-CB 4.05Å; L72-V98 HydrophobicContact CD2-CG2 3.72Å; L72-V98 HydrophobicContact CG-CG2 4.26Å; L72-I110 HydrophobicContact CD1-CG2 3.53Å; L72-I112 HydrophobicContact CD1-CG1 4.05Å; L72-M125 HydrophobicContact CD1-SD 4.21Å
73	Y	98.6	Very high	97.2	Very high	16 Å²	16	39 Å²	39	6%	0.063	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.8	176	-58.2	-89.5	0	0	0	110.5	Y48 D71 S82 F83 Y86 Q89 V91 I110 G111 Y113	Y48-Y73 HydrophobicContact CE1-CD2 4.39Å; D71-Y73 HydrophobicContact CB-CE2 3.67Å; Y73-S82 WeakPolarHBondContact CD1-O 3.47Å; Y73-F83 VanDerWaalsContact CE1-CA 3.48Å; Y73-F83 HydrophobicContact CE1-CB 4Å; Y73-F83 HydrophobicContact CE2-CB 4.41Å; Y73-F83 WeakPolarHBondContact OH-CB 3.38Å; Y73-Y86 AromaticContact CD1-CD1 3.73Å; Y73-Y86 HydrophobicContact CD1-CD1 3.73Å; Y73-Y86 HydrophobicContact CD1-CE1 4.3Å; Y73-Y86 AromaticContact CD1-CG 3.92Å; Y73-Y86 HydrophobicContact CD1-CG 3.92Å; Y73-Y86 HydrophobicContact CE1-CD1 4.15Å; Y73-Y86 HydrophobicContact CE1-CE1 4.3Å; Y73-Q89 HydrophobicContact CD1-CB 3.85Å; Y73-Q89 HydrophobicContact CE1-CB 4.18Å; Y73-V91 HydrophobicContact CE1-CG1 4.02Å; Y73-V91 HydrophobicContact CE2-CG1 4.29Å; Y73-V91 WeakPolarHBondContact OH-CG1 3.34Å; Y73-I110 CarbonylContact O-C 3.54Å; Y73-I110 WeakPolarHBondContact O-CA 3.5Å; Y73-G111 PolarHBondContact N-O 3.48Å; Y73-G111 PolarHBondContact O-N 2.87Å; Y73-Y113 HydrophobicContact CE2-CD1 4.5Å; Y73-Y113 HydrophobicContact CE2-CG 4.45Å
74	V	98.8	Very high	97.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	138.9	-174	-176.2	0	0	0	0	110.8	L61 L72 E87 L88 V98 V100 V108 G109 I110	L61-V74 HydrophobicContact CD1-CG2 3.75Å; L72-V74 HydrophobicContact CG-CG2 4.35Å; V74-E87 PolarHBondContact O-N 3.23Å; V74-L88 HydrophobicContact CB-CB 4.22Å; V74-L88 PolarHBondContact N-O 3.11Å; V74-L88 PolarHBondContact O-N 3.41Å; V74-V98 HydrophobicContact CB-CG1 4.43Å; V74-V98 HydrophobicContact CG2-CG1 3.93Å; V74-V100 HydrophobicContact CG1-CG2 4.06Å; V74-V108 HydrophobicContact CG1-CG1 3.28Å; V74-G109 WeakPolarHBondContact CA-O 3.23Å; V74-I110 HydrophobicContact CG2-CG1 4.42Å
75	S	98.6	Very high	97.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	143	179.4	-178.8	0	0	0	0	112.4	M77 T78 E87 V108 G109	S75-M77 PolarHBondContact OG-N 2.95Å; S75-T78 WeakPolarHBondContact CB-O 3.35Å; S75-T78 WeakPolarHBondContact OG-CG2 3.32Å; S75-T78 PolarHBondContact OG-N 2.9Å; S75-E87 WeakPolarHBondContact CA-OE2 3.45Å; S75-E87 WeakPolarHBondContact CB-OE2 3.47Å; S75-E87 PolarHBondContact OG-OE1 2.64Å; S75-E87 PolarHBondContact OG-OE2 3.49Å; S75-V108 CarbonylContact O-C 3.52Å; S75-V108 WeakPolarHBondContact O-CA 3.35Å; S75-V108 WeakPolarHBondContact O-CG1 3.44Å; S75-G109 PolarHBondContact N-O 2.88Å; S75-G109 PolarHBondContact O-N 2.81Å
76	D	98.3	Very high	97.5	Very high	27 Å²	27	49 Å²	49	14%	0.144	25%	0.246	C	C	.	.	S	Bend	trans	-102.1	1.1	165.1	75.9	-33.5	0	0	0	113.5	F104 R105 V108	D76-F104 HydrophobicContact CB-CB 3.77Å; D76-F104 HydrophobicContact CB-CD1 4.47Å; D76-F104 HydrophobicContact CB-CD2 3.69Å; D76-F104 HydrophobicContact CB-CE2 4.41Å; D76-F104 HydrophobicContact CB-CG 3.72Å; D76-F104 WeakPolarHBondContact OD2-CA 3.43Å; D76-R105 HydrophobicContact CB-CB 4.33Å; D76-R105 PolarHBondContact OD2-N 2.81Å; D76-V108 HydrophobicContact CB-CG2 4Å
77	M	98.1	Very high	97.6	Very high	109 Å²	109	48.8 Å²	48.8	54%	0.537	24%	0.243	S	C	.	.	S	Bend	trans	-99.5	-26.3	176.7	-60.9	-64.2	112.6	0	0	112.5	S75 E87	S75-M77 PolarHBondContact OG-N 2.95Å; M77-E87 VanDerWaalsContact CB-OE1 3.22Å; M77-E87 WeakPolarHBondContact CB-OE1 3.25Å; M77-E87 WeakPolarHBondContact CG-OE1 3.48Å
78	T	98.2	Very high	97.8	Very high	31 Å²	31	46.6 Å²	46.6	19%	0.19	24%	0.235	C	C	.	.			trans	-136.4	148.7	176.9	-179.3	0	0	0	0	111.9	S75 H80 P81 E85	S75-T78 WeakPolarHBondContact CB-O 3.35Å; S75-T78 WeakPolarHBondContact OG-CG2 3.32Å; S75-T78 PolarHBondContact OG-N 2.9Å; T78-H80 VanDerWaalsContact C-N 3.29Å; T78-H80 PolarHBondContact OG1-N 2.82Å; T78-H80 VanDerWaalsContact OG1-N 3.14Å; T78-P81 HydrophobicContact CG2-CB 4.39Å; T78-E85 HydrophobicContact CG2-CG 4.34Å
79	L	98.5	Very high	97.9	Very high	50 Å²	50	48.7 Å²	48.7	26%	0.262	24%	0.237	S	C	.	.	S	Bend	trans	-85.2	-3.8	172.2	-63.5	-178.7	0	0	0	113.4	R52 P81 P107	R52-L79 HydrophobicContact CG-CD2 4.45Å; L79-P81 VanDerWaalsContact C-CD 3.42Å; L79-P107 HydrophobicContact CD2-CB 4.03Å; L79-P107 HydrophobicContact CD2-CG 3.99Å; L79-P107 WeakPolarHBondContact CD2-O 3.46Å
80	H	98.4	Very high	97.9	Very high	107 Å²	107	48.9 Å²	48.9	50%	0.495	24%	0.239	S	C	.	.	S	Bend	trans	-128	60.4	-179.2	-54.2	89.4	0	0	0	110.9	Y50 T78	Y50-H80 HydrophobicContact CD1-CB 4.24Å; Y50-H80 AromaticContact CD2-CD2 3.7Å; Y50-H80 VanDerWaalsContact CE1-CA 3.49Å; Y50-H80 HydrophobicContact CE1-CB 3.86Å; Y50-H80 AromaticContact CE2-CD2 3.89Å; Y50-H80 AromaticContact CG-CD2 3.86Å; T78-H80 VanDerWaalsContact C-N 3.29Å; T78-H80 PolarHBondContact OG1-N 2.82Å; T78-H80 VanDerWaalsContact OG1-N 3.14Å
81	P	98.4	Very high	97.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.			trans	-64.1	145.5	177.2	29.5	-35.8	0	0	0	111	Y50 T78 L79 E85	Y50-P81 WeakPolarHBondContact CE1-O 3.3Å; T78-P81 HydrophobicContact CG2-CB 4.39Å; L79-P81 VanDerWaalsContact C-CD 3.42Å; P81-E85 CarbonylContact C-O 3.54Å; P81-E85 VanDerWaalsContact CA-O 3.22Å; P81-E85 WeakPolarHBondContact CA-O 3.37Å; P81-E85 WeakPolarHBondContact CB-O 3.18Å
82	S	97.8	Very high	97.6	Very high	25 Å²	25	54.3 Å²	54.3	18%	0.175	27%	0.273	C	S	.	.			trans	-131.6	-177.9	-177.2	70.6	0	0	0	0	110.9	Y73 D84 E85 Y86	Y73-S82 WeakPolarHBondContact CD1-O 3.47Å; S82-D84 PolarHBondContact O-N 3.19Å; S82-D84 PolarHBondContact OG-N 2.76Å; S82-E85 PolarHBondContact N-O 3.34Å; S82-E85 CarbonylContact O-C 3.51Å; S82-E85 PolarHBondContact O-N 2.84Å; S82-E85 PolarHBondContact OG-N 2.8Å; S82-Y86 WeakPolarHBondContact O-CD1 3.13Å
83	F	95.4	Very high	96.6	Very high	99 Å²	99	60 Å²	60	43%	0.434	31%	0.311	S	S	.	.	S	Bend	trans	-66.5	-17.8	176.3	70	-104.1	0	0	0	113.3	Y48 Y73 Y86	Y48-F83 WeakPolarHBondContact OH-CD1 3.47Å; Y48-F83 PolarHBondContact OH-N 2.79Å; Y73-F83 VanDerWaalsContact CE1-CA 3.48Å; Y73-F83 HydrophobicContact CE1-CB 4Å; Y73-F83 HydrophobicContact CE2-CB 4.41Å; Y73-F83 WeakPolarHBondContact OH-CB 3.38Å; F83-Y86 WeakPolarHBondContact O-CE1 3.3Å
84	D	96.4	Very high	95.8	Very high	131 Å²	131	61 Å²	61	70%	0.701	33%	0.326	S	S	*	.	S	Bend	trans	-100.2	-22.3	177.3	-73.8	-36.8	0	0	0	113	S82	S82-D84 PolarHBondContact O-N 3.19Å; S82-D84 PolarHBondContact OG-N 2.76Å
85	E	97.8	Very high	95.4	Very high	113 Å²	113	65.1 Å²	65.1	53%	0.528	35%	0.345	S	S	.	.	S	Bend	trans	-134.6	99.6	-173	-173.3	177.6	-169.5	0	0	110.7	T78 P81 S82	T78-E85 HydrophobicContact CG2-CG 4.34Å; P81-E85 CarbonylContact C-O 3.54Å; P81-E85 VanDerWaalsContact CA-O 3.22Å; P81-E85 WeakPolarHBondContact CA-O 3.37Å; P81-E85 WeakPolarHBondContact CB-O 3.18Å; S82-E85 PolarHBondContact N-O 3.34Å; S82-E85 CarbonylContact O-C 3.51Å; S82-E85 PolarHBondContact O-N 2.84Å; S82-E85 PolarHBondContact OG-N 2.8Å
86	Y	98.4	Very high	95.2	Very high	92 Å²	92	65.1 Å²	65.1	36%	0.361	35%	0.345	S	S	.	.			trans	-159.5	166.1	179.8	64	-90.1	0	0	0	111.3	Y73 S82 F83 Q89	Y73-Y86 AromaticContact CD1-CD1 3.73Å; Y73-Y86 HydrophobicContact CD1-CD1 3.73Å; Y73-Y86 HydrophobicContact CD1-CE1 4.3Å; Y73-Y86 AromaticContact CD1-CG 3.92Å; Y73-Y86 HydrophobicContact CD1-CG 3.92Å; Y73-Y86 HydrophobicContact CE1-CD1 4.15Å; Y73-Y86 HydrophobicContact CE1-CE1 4.3Å; S82-Y86 WeakPolarHBondContact O-CD1 3.13Å; F83-Y86 WeakPolarHBondContact O-CE1 3.3Å; Y86-Q89 HydrophobicContact CD2-CB 3.9Å; Y86-Q89 HydrophobicContact CD2-CG 4.03Å; Y86-Q89 VanDerWaalsContact CE1-OE1 3.23Å; Y86-Q89 HydrophobicContact CE2-CB 3.96Å; Y86-Q89 VanDerWaalsContact CE2-CD 3.46Å; Y86-Q89 HydrophobicContact CE2-CG 3.55Å; Y86-Q89 HydrophobicContact CG-CB 4.45Å; Y86-Q89 VanDerWaalsContact OH-CD 3.31Å; Y86-Q89 PolarHBondContact OH-NE2 3.04Å; Y86-Q89 PolarHBondContact OH-OE1 2.89Å; Y86-Q89 VanDerWaalsContact OH-OE1 3.11Å
87	E	98.3	Very high	95.1	Very high	74 Å²	74	66 Å²	66	35%	0.346	35%	0.352	S	S	.	.	S	Bend	trans	-113.4	-33.8	177.6	-77.9	77	171.1	0	0	110.6	V74 S75 M77 F104	V74-E87 PolarHBondContact O-N 3.23Å; S75-E87 WeakPolarHBondContact CA-OE2 3.45Å; S75-E87 WeakPolarHBondContact CB-OE2 3.47Å; S75-E87 PolarHBondContact OG-OE1 2.64Å; S75-E87 PolarHBondContact OG-OE2 3.49Å; M77-E87 VanDerWaalsContact CB-OE1 3.22Å; M77-E87 WeakPolarHBondContact CB-OE1 3.25Å; M77-E87 WeakPolarHBondContact CG-OE1 3.48Å; E87-F104 HydrophobicContact CB-CE2 4.26Å; E87-F104 HydrophobicContact CB-CZ 3.92Å
88	L	98.4	Very high	95.1	Very high	52 Å²	52	61.1 Å²	61.1	27%	0.272	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.2	172.8	-52	168.8	0	0	0	109.7	V74 V98 H99 F104	V74-L88 HydrophobicContact CB-CB 4.22Å; V74-L88 PolarHBondContact N-O 3.11Å; V74-L88 PolarHBondContact O-N 3.41Å; L88-V98 HydrophobicContact CB-CG1 3.67Å; L88-V98 HydrophobicContact CD1-CG1 3.86Å; L88-V98 HydrophobicContact CG-CG1 4.41Å; L88-H99 WeakPolarHBondContact CD1-O 3.35Å; L88-F104 HydrophobicContact CD1-CE2 3.59Å; L88-F104 HydrophobicContact CD1-CZ 3.63Å; L88-F104 HydrophobicContact CD2-CZ 4.39Å; L88-F104 HydrophobicContact CG-CE2 3.98Å; L88-F104 HydrophobicContact CG-CZ 3.76Å
89	Q	98.1	Very high	95.1	Very high	75 Å²	75	63.9 Å²	63.9	35%	0.35	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	159.9	176.1	66.9	170.6	22.1	0	0	111.9	L72 Y73 Y86	L72-Q89 CarbonylContact O-C 3.59Å; L72-Q89 WeakPolarHBondContact O-CA 3.41Å; L72-Q89 WeakPolarHBondContact O-CB 3.18Å; Y73-Q89 HydrophobicContact CD1-CB 3.85Å; Y73-Q89 HydrophobicContact CE1-CB 4.18Å; Y86-Q89 HydrophobicContact CD2-CB 3.9Å; Y86-Q89 HydrophobicContact CD2-CG 4.03Å; Y86-Q89 VanDerWaalsContact CE1-OE1 3.23Å; Y86-Q89 HydrophobicContact CE2-CB 3.96Å; Y86-Q89 VanDerWaalsContact CE2-CD 3.46Å; Y86-Q89 HydrophobicContact CE2-CG 3.55Å; Y86-Q89 HydrophobicContact CG-CB 4.45Å; Y86-Q89 VanDerWaalsContact OH-CD 3.31Å; Y86-Q89 PolarHBondContact OH-NE2 3.04Å; Y86-Q89 PolarHBondContact OH-OE1 2.89Å; Y86-Q89 VanDerWaalsContact OH-OE1 3.11Å
90	S	97.8	Very high	95	Very high	18 Å²	18	61.5 Å²	61.5	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	124.9	160.9	-173.1	0	0	0	0	108	L72 D96 V97	L72-S90 PolarHBondContact N-O 3.33Å; L72-S90 PolarHBondContact O-N 2.79Å; S90-D96 VanDerWaalsContact C-OD1 3.26Å; S90-D96 WeakPolarHBondContact CB-OD1 3.43Å; S90-D96 WeakPolarHBondContact OG-CA 3.43Å; S90-D96 WeakPolarHBondContact OG-CB 3.23Å; S90-D96 PolarHBondContact OG-OD1 3.39Å; S90-V97 PolarHBondContact OG-N 3.38Å
91	V	95.9	Very high	94.9	Very high	60 Å²	60	57.7 Å²	57.7	36%	0.364	31%	0.311	S	S	.	.			trans	-133.8	53.8	-168.5	-63.7	0	0	0	0	110.4	D71 Y73 D96	D71-V91 HydrophobicContact CB-CB 4.4Å; D71-V91 HydrophobicContact CB-CG1 3.87Å; D71-V91 VanDerWaalsContact OD1-CA 3.23Å; D71-V91 WeakPolarHBondContact OD1-CA 3.44Å; D71-V91 WeakPolarHBondContact OD1-CB 2.97Å; Y73-V91 HydrophobicContact CE1-CG1 4.02Å; Y73-V91 HydrophobicContact CE2-CG1 4.29Å; Y73-V91 WeakPolarHBondContact OH-CG1 3.34Å; V91-D96 PolarHBondContact N-OD1 2.78Å
92	T	91	Very high	94.7	Very high	62 Å²	62	59.7 Å²	59.7	38%	0.38	33%	0.327	S	S	.	.			trans	-106.9	148.7	-174.3	73	0	0	0	0	110.7	G94 Q95 D96	T92-G94 PolarHBondContact O-N 3.42Å; T92-Q95 PolarHBondContact OG1-O 3.35Å; T92-D96 WeakPolarHBondContact CB-OD1 3.34Å; T92-D96 PolarHBondContact N-OD1 3.34Å; T92-D96 PolarHBondContact OG1-OD1 3.27Å
93	C	77.3	Confident	94.5	Very high	120 Å²	120	64.3 Å²	64.3	81%	0.811	35%	0.346	S	S	*	.	S	Bend	trans	-74.2	23.7	177.6	-41.4	0	0	0	0	113.3
94	G	81.6	Confident	94.6	Very high	36 Å²	36	60.6 Å²	60.6	37%	0.371	33%	0.33	S	S	.	.	S	Bend	trans	-144.3	-126.7	-168.4	0	0	0	0	0	111.6	T92	T92-G94 PolarHBondContact O-N 3.42Å
95	Q	90.6	Very high	94.6	Very high	86 Å²	86	62.9 Å²	62.9	40%	0.402	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.5	175.7	-169.9	-178.4	30.1	0	0	109.5	E27 Q62 T92 V97	E27-Q95 PolarHBondContact OE1-NE2 2.93Å; Q62-Q95 HydrophobicContact CG-CG 4.08Å; Q62-Q95 VanDerWaalsContact CG-NE2 3.33Å; T92-Q95 PolarHBondContact OG1-O 3.35Å; Q95-V97 HydrophobicContact CG-CG2 4.21Å
96	D	95.3	Very high	94.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.6	178.1	-75.2	-46	0	0	0	110.7	Q62 M63 S90 V91 T92	Q62-D96 CarbonylContact C-O 3.57Å; Q62-D96 WeakPolarHBondContact CA-O 3.35Å; M63-D96 HydrophobicContact CB-CB 4.28Å; M63-D96 HydrophobicContact CE-CB 4.16Å; M63-D96 PolarHBondContact N-O 2.82Å; M63-D96 PolarHBondContact O-N 2.82Å; S90-D96 VanDerWaalsContact C-OD1 3.26Å; S90-D96 WeakPolarHBondContact CB-OD1 3.43Å; S90-D96 WeakPolarHBondContact OG-CA 3.43Å; S90-D96 WeakPolarHBondContact OG-CB 3.23Å; S90-D96 PolarHBondContact OG-OD1 3.39Å; V91-D96 PolarHBondContact N-OD1 2.78Å; T92-D96 WeakPolarHBondContact CB-OD1 3.34Å; T92-D96 PolarHBondContact N-OD1 3.34Å; T92-D96 PolarHBondContact OG1-OD1 3.27Å
97	V	96.2	Very high	94.5	Very high	47 Å²	47	57.6 Å²	57.6	29%	0.285	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	123	-178.5	-174.4	0	0	0	0	110.2	V60 L61 Q62 S90 Q95	V60-V97 HydrophobicContact CG1-CG1 3.6Å; L61-V97 CarbonylContact O-C 3.59Å; L61-V97 VanDerWaalsContact O-CA 3.3Å; L61-V97 WeakPolarHBondContact O-CA 3.47Å; Q62-V97 HydrophobicContact CB-CG2 4.48Å; Q62-V97 HydrophobicContact CG-CG2 4.17Å; S90-V97 PolarHBondContact OG-N 3.38Å; Q95-V97 HydrophobicContact CG-CG2 4.21Å
98	V	97.6	Very high	94.5	Very high	6 Å²	6	54 Å²	54	4%	0.036	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	124.7	176.1	174.6	0	0	0	0	110	V60 L61 L72 V74 L88 V100	V60-V98 WeakPolarHBondContact CA-O 3.22Å; L61-V98 HydrophobicContact CB-CB 4.47Å; L61-V98 PolarHBondContact N-O 3.33Å; L61-V98 PolarHBondContact O-N 2.91Å; L72-V98 HydrophobicContact CD2-CB 4.05Å; L72-V98 HydrophobicContact CD2-CG2 3.72Å; L72-V98 HydrophobicContact CG-CG2 4.26Å; V74-V98 HydrophobicContact CB-CG1 4.43Å; V74-V98 HydrophobicContact CG2-CG1 3.93Å; L88-V98 HydrophobicContact CB-CG1 3.67Å; L88-V98 HydrophobicContact CD1-CG1 3.86Å; L88-V98 HydrophobicContact CG-CG1 4.41Å; V98-V100 HydrophobicContact CG1-CG2 4.32Å
99	H	97.2	Very high	94.6	Very high	88 Å²	88	51.6 Å²	51.6	41%	0.407	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	103.1	173.9	-66	-88.4	0	0	0	110.3	W33 I59 V60 L88 P101	W33-H99 AromaticContact CH2-CE1 3.92Å; W33-H99 AromaticContact CZ2-CE1 3.56Å; I59-H99 CarbonylContact O-C 3.48Å; V60-H99 WeakPolarHBondContact CG2-ND1 2.97Å; L88-H99 WeakPolarHBondContact CD1-O 3.35Å; H99-P101 WeakPolarHBondContact O-CD 3.4Å
100	V	97.6	Very high	94.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.8	175.4	-172.6	0	0	0	0	109	L53 K58 I59 L61 V74 V98 F104 V108	L53-V100 HydrophobicContact CD2-CB 4.33Å; L53-V100 HydrophobicContact CD2-CG1 4.18Å; L53-V100 HydrophobicContact CD2-CG2 4.19Å; K58-V100 WeakPolarHBondContact CA-O 3.33Å; I59-V100 HydrophobicContact CB-CB 4.26Å; I59-V100 PolarHBondContact N-O 3.32Å; I59-V100 PolarHBondContact O-N 3.36Å; L61-V100 HydrophobicContact CD1-CG2 3.99Å; L61-V100 HydrophobicContact CG-CG2 4.15Å; V74-V100 HydrophobicContact CG1-CG2 4.06Å; V98-V100 HydrophobicContact CG1-CG2 4.32Å; V100-F104 HydrophobicContact CG1-CB 4.22Å; V100-F104 HydrophobicContact CG1-CD2 3.76Å; V100-F104 HydrophobicContact CG1-CE2 4.49Å; V100-F104 HydrophobicContact CG1-CG 4.25Å; V100-V108 HydrophobicContact CG1-CG1 4.23Å; V100-V108 HydrophobicContact CG1-CG2 4.12Å
101	P	96.2	Very high	94.6	Very high	28 Å²	28	47.3 Å²	47.3	18%	0.182	26%	0.258	C	S	.	.			trans	-73.4	159.3	-177	32.5	-36.8	0	0	0	111.7	H99 H103 F104 R106	H99-P101 WeakPolarHBondContact O-CD 3.4Å; P101-H103 VanDerWaalsContact CB-CE1 3.41Å; P101-H103 WeakPolarHBondContact CB-CE1 3.4Å; P101-H103 VanDerWaalsContact CG-CE1 3.48Å; P101-H103 WeakPolarHBondContact CG-CE1 2.86Å; P101-H103 PolarHBondContact O-N 3.25Å; P101-F104 HydrophobicContact CG-CB 4.42Å; P101-F104 HydrophobicContact CG-CD1 3.25Å; P101-F104 HydrophobicContact CG-CD2 4.5Å; P101-F104 HydrophobicContact CG-CE1 3.44Å; P101-F104 VanDerWaalsContact CG-CE1 3.44Å; P101-F104 HydrophobicContact CG-CG 3.83Å; P101-F104 HydrophobicContact CG-CZ 4.17Å; P101-F104 PolarHBondContact O-N 2.81Å; P101-R106 PolarHBondContact O-NH1 3.28Å; P101-R106 PolarHBondContact O-NH2 3.49Å
102	A	94.3	Very high	94.7	Very high	41 Å²	41	44.5 Å²	44.5	34%	0.339	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.3	179.4	0	0	0	0	0	114.1	G57	G57-A102 WeakPolarHBondContact O-CA 3.36Å
103	H	93.9	Very high	95.1	Very high	123 Å²	123	42.8 Å²	42.8	57%	0.569	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-7.6	-178.1	63.7	-104.3	0	0	0	114	P101 R105	P101-H103 VanDerWaalsContact CB-CE1 3.41Å; P101-H103 WeakPolarHBondContact CB-CE1 3.4Å; P101-H103 VanDerWaalsContact CG-CE1 3.48Å; P101-H103 WeakPolarHBondContact CG-CE1 2.86Å; P101-H103 PolarHBondContact O-N 3.25Å; H103-R105 PolarHBondContact O-N 2.94Å
104	F	96.8	Very high	96	Very high	21 Å²	21	37.1 Å²	37.1	9%	0.092	19%	0.189	C	C	.	.	S	Bend	trans	-64	133.5	175.5	-95.4	30.4	0	0	0	109.8	D76 E87 L88 V100 P101 R106 V108	D76-F104 HydrophobicContact CB-CB 3.77Å; D76-F104 HydrophobicContact CB-CD1 4.47Å; D76-F104 HydrophobicContact CB-CD2 3.69Å; D76-F104 HydrophobicContact CB-CE2 4.41Å; D76-F104 HydrophobicContact CB-CG 3.72Å; D76-F104 WeakPolarHBondContact OD2-CA 3.43Å; E87-F104 HydrophobicContact CB-CE2 4.26Å; E87-F104 HydrophobicContact CB-CZ 3.92Å; L88-F104 HydrophobicContact CD1-CE2 3.59Å; L88-F104 HydrophobicContact CD1-CZ 3.63Å; L88-F104 HydrophobicContact CD2-CZ 4.39Å; L88-F104 HydrophobicContact CG-CE2 3.98Å; L88-F104 HydrophobicContact CG-CZ 3.76Å; V100-F104 HydrophobicContact CG1-CB 4.22Å; V100-F104 HydrophobicContact CG1-CD2 3.76Å; V100-F104 HydrophobicContact CG1-CE2 4.49Å; V100-F104 HydrophobicContact CG1-CG 4.25Å; P101-F104 HydrophobicContact CG-CB 4.42Å; P101-F104 HydrophobicContact CG-CD1 3.25Å; P101-F104 HydrophobicContact CG-CD2 4.5Å; P101-F104 HydrophobicContact CG-CE1 3.44Å; P101-F104 VanDerWaalsContact CG-CE1 3.44Å; P101-F104 HydrophobicContact CG-CG 3.83Å; P101-F104 HydrophobicContact CG-CZ 4.17Å; P101-F104 PolarHBondContact O-N 2.81Å; F104-R106 PolarHBondContact O-N 2.77Å; F104-R106 PolarHBondContact O-NH1 2.8Å; F104-V108 HydrophobicContact CB-CG2 3.79Å; F104-V108 HydrophobicContact CD2-CG1 4.49Å; F104-V108 HydrophobicContact CD2-CG2 3.95Å; F104-V108 HydrophobicContact CG-CG2 4.38Å
105	R	96.6	Very high	96.7	Very high	178 Å²	178	38.3 Å²	38.3	67%	0.672	19%	0.185	S	C	*	.	P	Polyproline II helix	trans	-65.8	128.1	-179.8	-64	179.6	-179.3	169.1	1.7	110.7	D76 H103 P107 V108	D76-R105 HydrophobicContact CB-CB 4.33Å; D76-R105 PolarHBondContact OD2-N 2.81Å; H103-R105 PolarHBondContact O-N 2.94Å; R105-P107 CarbonylContact O-C 3.53Å; R105-V108 WeakPolarHBondContact O-CG2 3.12Å
106	R	96.7	Very high	97	Very high	43 Å²	43	37.8 Å²	37.8	16%	0.162	19%	0.189	C	C	.	.	S	Bend	trans	-89.3	145.1	176.2	-58.4	-49.8	-168.9	-114.8	5.9	111	H55 E56 G57 P101 F104	H55-R106 PolarHBondContact O-NE 2.83Å; H55-R106 PolarHBondContact O-NH2 3.45Å; E56-R106 VanDerWaalsContact OE1-CG 3.29Å; E56-R106 WeakPolarHBondContact OE1-CG 3.4Å; G57-R106 PolarHBondContact O-NH2 3.27Å; P101-R106 PolarHBondContact O-NH1 3.28Å; P101-R106 PolarHBondContact O-NH2 3.49Å; F104-R106 PolarHBondContact O-N 2.77Å; F104-R106 PolarHBondContact O-NH1 2.8Å
107	P	97.9	Very high	97	Very high	51 Å²	51	42.2 Å²	42.2	33%	0.331	22%	0.22	S	C	.	.	S	Bend	cis	-68.7	139.4	-6.2	19.1	-24	0	0	0	113.4	R52 L53 N54 L79 R105	R52-P107 HydrophobicContact CB-CB 4.35Å; L53-P107 WeakPolarHBondContact O-CA 3.22Å; N54-P107 WeakPolarHBondContact OD1-CB 3.47Å; L79-P107 HydrophobicContact CD2-CB 4.03Å; L79-P107 HydrophobicContact CD2-CG 3.99Å; L79-P107 WeakPolarHBondContact CD2-O 3.46Å; R105-P107 CarbonylContact O-C 3.53Å
108	V	98.5	Very high	97	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.5	168.7	164.2	0	0	0	0	108.9	L53 V74 S75 D76 V100 F104 R105	L53-V108 HydrophobicContact CB-CB 4.1Å; L53-V108 HydrophobicContact CD2-CB 4.37Å; L53-V108 HydrophobicContact CD2-CG1 4.47Å; L53-V108 PolarHBondContact N-O 2.73Å; L53-V108 PolarHBondContact O-N 3.36Å; V74-V108 HydrophobicContact CG1-CG1 3.28Å; S75-V108 CarbonylContact O-C 3.52Å; S75-V108 WeakPolarHBondContact O-CA 3.35Å; S75-V108 WeakPolarHBondContact O-CG1 3.44Å; D76-V108 HydrophobicContact CB-CG2 4Å; V100-V108 HydrophobicContact CG1-CG1 4.23Å; V100-V108 HydrophobicContact CG1-CG2 4.12Å; F104-V108 HydrophobicContact CB-CG2 3.79Å; F104-V108 HydrophobicContact CD2-CG1 4.49Å; F104-V108 HydrophobicContact CD2-CG2 3.95Å; F104-V108 HydrophobicContact CG-CG2 4.38Å; R105-V108 WeakPolarHBondContact O-CG2 3.12Å
109	G	98.6	Very high	97	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	134.7	171.6	0	0	0	0	0	111.4	V74 S75	V74-G109 WeakPolarHBondContact CA-O 3.23Å; S75-G109 PolarHBondContact N-O 2.88Å; S75-G109 PolarHBondContact O-N 2.81Å
110	I	98.8	Very high	97	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.6	173.8	-59.9	167.1	0	0	0	107.5	Y50 L51 L53 L61 L72 Y73 V74 I112	Y50-I110 CarbonylContact C-O 3.59Å; Y50-I110 VanDerWaalsContact CA-O 3.3Å; Y50-I110 WeakPolarHBondContact CA-O 3.5Å; L51-I110 HydrophobicContact CB-CB 4.19Å; L51-I110 PolarHBondContact N-O 2.74Å; L51-I110 PolarHBondContact O-N 2.95Å; L53-I110 HydrophobicContact CB-CD1 3.83Å; L61-I110 HydrophobicContact CD1-CD1 3.59Å; L61-I110 HydrophobicContact CD1-CG1 3.88Å; L61-I110 HydrophobicContact CD1-CG2 4.4Å; L61-I110 HydrophobicContact CD2-CD1 3.99Å; L61-I110 HydrophobicContact CG-CD1 4.46Å; L72-I110 HydrophobicContact CD1-CG2 3.53Å; Y73-I110 CarbonylContact O-C 3.54Å; Y73-I110 WeakPolarHBondContact O-CA 3.5Å; V74-I110 HydrophobicContact CG2-CG1 4.42Å; I110-I112 HydrophobicContact CG2-CG1 4.39Å
111	G	98.4	Very high	97	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.1	175.6	0	0	0	0	0	109.7	Y73	Y73-G111 PolarHBondContact N-O 3.48Å; Y73-G111 PolarHBondContact O-N 2.87Å
112	I	98.4	Very high	97.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	116.9	174.4	-61.2	141.4	0	0	0	107.4	Y48 S49 L51 M63 A70 D71 L72 I110 F123	Y48-I112 WeakPolarHBondContact CA-O 3.48Å; S49-I112 PolarHBondContact N-O 2.77Å; S49-I112 PolarHBondContact O-N 2.79Å; L51-I112 HydrophobicContact CD1-CD1 3.64Å; L51-I112 HydrophobicContact CG-CD1 4.17Å; M63-I112 HydrophobicContact SD-CG1 4.26Å; M63-I112 HydrophobicContact SD-CG2 4.02Å; A70-I112 HydrophobicContact CB-CG2 4.14Å; D71-I112 CarbonylContact O-C 3.55Å; D71-I112 WeakPolarHBondContact O-CA 3.45Å; L72-I112 HydrophobicContact CD1-CG1 4.05Å; I110-I112 HydrophobicContact CG2-CG1 4.39Å; I112-F123 HydrophobicContact CD1-CE1 4.46Å; I112-F123 HydrophobicContact CD1-CE2 3.74Å; I112-F123 HydrophobicContact CD1-CZ 3.65Å; I112-F123 HydrophobicContact CG1-CZ 4.47Å; I112-F123 HydrophobicContact CG2-CD1 3.88Å; I112-F123 HydrophobicContact CG2-CE1 3.74Å; I112-F123 HydrophobicContact CG2-CE2 4.48Å; I112-F123 HydrophobicContact CG2-CG 4.32Å; I112-F123 HydrophobicContact CG2-CZ 4.08Å
113	Y	98	Very high	97.2	Very high	27 Å²	27	49.8 Å²	49.8	11%	0.106	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.2	-173.8	179.3	-118.2	0	0	0	111.1	G46 N47 Y48 A70 D71 Y73 P116	G46-Y113 VanDerWaalsContact C-CE2 3.47Å; N47-Y113 WeakPolarHBondContact O-CA 3.36Å; N47-Y113 WeakPolarHBondContact O-CD2 3.41Å; Y48-Y113 HydrophobicContact CD1-CD2 4.16Å; Y48-Y113 AromaticContact CD2-CD2 3.77Å; Y48-Y113 HydrophobicContact CD2-CD2 3.77Å; Y48-Y113 HydrophobicContact CD2-CE2 4.27Å; Y48-Y113 AromaticContact CE1-CD2 3.74Å; Y48-Y113 HydrophobicContact CE1-CD2 3.74Å; Y48-Y113 AromaticContact CE1-CG 3.95Å; Y48-Y113 HydrophobicContact CE1-CG 3.95Å; Y48-Y113 AromaticContact CE2-CD2 3.29Å; Y48-Y113 HydrophobicContact CE2-CD2 3.29Å; Y48-Y113 AromaticContact CE2-CE2 3.63Å; Y48-Y113 HydrophobicContact CE2-CE2 3.63Å; Y48-Y113 HydrophobicContact CE2-CG 4.25Å; Y48-Y113 HydrophobicContact CG-CD2 4.17Å; Y48-Y113 AromaticContact CZ-CD2 3.25Å; Y48-Y113 AromaticContact CZ-CE2 3.9Å; Y48-Y113 AromaticContact CZ-CG 3.76Å; A70-Y113 CarbonylContact C-O 3.53Å; A70-Y113 VanDerWaalsContact CA-O 3.31Å; A70-Y113 WeakPolarHBondContact CA-O 3.46Å; D71-Y113 HydrophobicContact CB-CD1 4.36Å; D71-Y113 PolarHBondContact N-O 3.25Å; D71-Y113 PolarHBondContact O-N 2.83Å; Y73-Y113 HydrophobicContact CE2-CD1 4.5Å; Y73-Y113 HydrophobicContact CE2-CG 4.45Å; Y113-P116 HydrophobicContact CE1-CG 4.44Å; Y113-P116 VanDerWaalsContact OH-CG 3.29Å; Y113-P116 WeakPolarHBondContact OH-CG 3.41Å
114	G	97.8	Very high	97.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.4	170.9	0	0	0	0	0	111.1	G46 N47	G46-G114 PolarHBondContact N-O 3.33Å; N47-G114 PolarHBondContact O-N 2.93Å
115	H	95.9	Very high	97.4	Very high	61 Å²	61	44.7 Å²	44.7	28%	0.282	22%	0.224	S	C	.	.			trans	-61.3	131.6	-178.6	-169.9	-91.9	0	0	0	111.5	D69 D71 S117 H118	D69-H115 HydrophobicContact CB-CB 3.92Å; D69-H115 WeakPolarHBondContact O-CB 3.29Å; D69-H115 PolarHBondContact O-N 3.24Å; D71-H115 IonicContact OD2-CD2 3.97Å; H115-S117 PolarHBondContact CE1-OG 3.03Å; H115-S117 WeakPolarHBondContact ND1-CB 3.43Å; H115-S117 PolarHBondContact ND1-N 2.55Å; H115-S117 PolarHBondContact ND1-OG 2.94Å; H115-S117 PolarHBondContact O-N 3.01Å; H115-H118 PolarHBondContact O-N 2.94Å
116	P	96.5	Very high	97.4	Very high	76 Å²	76	38.2 Å²	38.2	49%	0.494	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.7	-172.4	-27.2	35.1	0	0	0	116.2	Y113 H118	Y113-P116 HydrophobicContact CE1-CG 4.44Å; Y113-P116 VanDerWaalsContact OH-CG 3.29Å; Y113-P116 WeakPolarHBondContact OH-CG 3.41Å; P116-H118 PolarHBondContact O-N 2.77Å
117	S	95.3	Very high	97.5	Very high	92 Å²	92	36.6 Å²	36.6	64%	0.643	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-14.7	175.9	-57.1	0	0	0	0	113.7	H115	H115-S117 PolarHBondContact CE1-OG 3.03Å; H115-S117 WeakPolarHBondContact ND1-CB 3.43Å; H115-S117 PolarHBondContact ND1-N 2.55Å; H115-S117 PolarHBondContact ND1-OG 2.94Å; H115-S117 PolarHBondContact O-N 3.01Å
118	H	95.9	Very high	97.4	Very high	74 Å²	74	34.7 Å²	34.7	34%	0.343	18%	0.182	S	C	.	.	S	Bend	trans	-118.4	130.1	177	-60.4	101	0	0	0	109	A45 D69 H115 P116 E120	A45-H118 WeakPolarHBondContact CB-O 3.31Å; D69-H118 VanDerWaalsContact CB-ND1 3.28Å; D69-H118 WeakPolarHBondContact CB-ND1 3.37Å; D69-H118 PolarHBondContact N-ND1 2.8Å; H115-H118 PolarHBondContact O-N 2.94Å; P116-H118 PolarHBondContact O-N 2.77Å; H118-E120 PolarHBondContact O-N 2.85Å
119	L	97.6	Very high	97.3	Very high	164 Å²	164	36 Å²	36	86%	0.859	19%	0.187	S	C	*	.	S	Bend	trans	-60.1	-33.9	-179.5	-69.9	174.4	0	0	0	112.3	A45	A45-L119 PolarHBondContact N-O 2.66Å
120	E	97.6	Very high	97.1	Very high	75 Å²	75	36.3 Å²	36.3	35%	0.35	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	139.4	-179.7	-177.7	-174.9	-92.7	0	0	108.2	I43 K67 H118	I43-E120 CarbonylContact O-C 3.54Å; I43-E120 WeakPolarHBondContact O-CA 3.32Å; K67-E120 IonicContact NZ-OE2 2.72Å; K67-E120 PolarHBondContact NZ-OE2 2.84Å; H118-E120 PolarHBondContact O-N 2.85Å
121	S	97.3	Very high	96.8	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.4	172.8	-54	0	0	0	0	109.5	Q42 I43 K67 D69	Q42-S121 CarbonylContact C-O 3.54Å; Q42-S121 WeakPolarHBondContact CA-O 3.28Å; I43-S121 PolarHBondContact N-O 3.13Å; I43-S121 PolarHBondContact O-N 2.93Å; K67-S121 CarbonylContact O-C 3.58Å; K67-S121 WeakPolarHBondContact O-CA 3.28Å; D69-S121 VanDerWaalsContact C-OG 3.23Å; D69-S121 PolarHBondContact N-OG 3.32Å; D69-S121 PolarHBondContact O-OG 3.25Å
122	E	97.7	Very high	96.2	Very high	51 Å²	51	45.8 Å²	45.8	24%	0.238	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.4	174.3	-54.8	179	-149.3	0	0	107.3	G41 Q42 S65 L66 K67	G41-E122 WeakPolarHBondContact O-CA 3.45Å; Q42-E122 HydrophobicContact CB-CG 4.48Å; Q42-E122 HydrophobicContact CG-CB 4.45Å; Q42-E122 HydrophobicContact CG-CG 3.9Å; Q42-E122 PolarHBondContact NE2-OE2 2.86Å; S65-E122 CarbonylContact C-O 3.5Å; L66-E122 HydrophobicContact CB-CB 4.26Å; L66-E122 PolarHBondContact N-O 2.69Å; K67-E122 HydrophobicContact CB-CB 4.03Å; K67-E122 HydrophobicContact CB-CG 4.08Å; K67-E122 HydrophobicContact CD-CG 3.95Å; K67-E122 WeakPolarHBondContact CD-OE1 3.45Å; K67-E122 PolarHBondContact N-O 2.64Å; K67-E122 IonicContact NZ-OE1 2.91Å; K67-E122 PolarHBondContact NZ-OE1 2.85Å; K67-E122 PolarHBondContact O-N 3.37Å
123	F	96.5	Very high	94.4	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.026	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156.4	-175.1	69.5	-89.1	0	0	0	112.2	Q40 G41 M63 R64 A70 I112 M125	Q40-F123 WeakPolarHBondContact CA-O 3.44Å; G41-F123 PolarHBondContact N-O 2.77Å; G41-F123 VanDerWaalsContact N-O 3.09Å; G41-F123 WeakPolarHBondContact O-CD1 3.19Å; G41-F123 PolarHBondContact O-N 3.04Å; M63-F123 HydrophobicContact CG-CB 4.18Å; M63-F123 HydrophobicContact CG-CD2 4.19Å; M63-F123 HydrophobicContact SD-CB 4.26Å; M63-F123 HydrophobicContact SD-CD2 4.09Å; M63-F123 HydrophobicContact SD-CG 4.24Å; R64-F123 WeakPolarHBondContact O-CA 3.48Å; A70-F123 HydrophobicContact CB-CB 4.05Å; A70-F123 HydrophobicContact CB-CD1 4.38Å; A70-F123 HydrophobicContact CB-CG 4.49Å; I112-F123 HydrophobicContact CD1-CE1 4.46Å; I112-F123 HydrophobicContact CD1-CE2 3.74Å; I112-F123 HydrophobicContact CD1-CZ 3.65Å; I112-F123 HydrophobicContact CG1-CZ 4.47Å; I112-F123 HydrophobicContact CG2-CD1 3.88Å; I112-F123 HydrophobicContact CG2-CE1 3.74Å; I112-F123 HydrophobicContact CG2-CE2 4.48Å; I112-F123 HydrophobicContact CG2-CG 4.32Å; I112-F123 HydrophobicContact CG2-CZ 4.08Å; F123-M125 HydrophobicContact CD2-CB 4.39Å
124	E	97.4	Very high	92.4	Very high	34 Å²	34	54.2 Å²	54.2	16%	0.159	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.5	164.1	178.8	176.7	92.3	0	0	108.2	V38 V39 Q40 M63 R64 L66 K126	V38-E124 HydrophobicContact CG1-CG 3.82Å; V39-E124 CarbonylContact O-C 3.56Å; V39-E124 WeakPolarHBondContact O-CA 3.4Å; Q40-E124 HydrophobicContact CG-CB 4.08Å; Q40-E124 HydrophobicContact CG-CG 4Å; Q40-E124 PolarHBondContact NE2-OE2 3.41Å; M63-E124 CarbonylContact C-O 3.49Å; M63-E124 WeakPolarHBondContact CA-O 3.41Å; R64-E124 PolarHBondContact N-O 3.48Å; R64-E124 PolarHBondContact O-N 3.1Å; L66-E124 HydrophobicContact CD1-CB 4.27Å; L66-E124 HydrophobicContact CD2-CB 4.29Å; L66-E124 HydrophobicContact CG-CB 4.37Å; E124-K126 VanDerWaalsContact OE1-CE 3.25Å; E124-K126 WeakPolarHBondContact OE1-CE 3.45Å; E124-K126 IonicContact OE1-NZ 2.64Å
125	M	97.5	Very high	89.7	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.4	174.2	-175.9	176.1	62.9	0	0	110.1	V38 V39 L51 L61 Q62 M63 L72 F123 V127	V38-M125 CarbonylContact C-O 3.47Å; V38-M125 WeakPolarHBondContact CA-O 3.07Å; V39-M125 HydrophobicContact CB-CE 4.49Å; V39-M125 PolarHBondContact N-O 2.83Å; V39-M125 PolarHBondContact O-N 3.36Å; L51-M125 HydrophobicContact CD1-CE 3.49Å; L51-M125 VanDerWaalsContact CD1-CE 3.49Å; L61-M125 HydrophobicContact CB-SD 4.12Å; L61-M125 HydrophobicContact CD2-SD 4.25Å; Q62-M125 CarbonylContact O-C 3.53Å; Q62-M125 WeakPolarHBondContact O-CA 3.34Å; M63-M125 HydrophobicContact CB-CB 4.15Å; M63-M125 HydrophobicContact CB-CG 4.12Å; M63-M125 HydrophobicContact CG-CB 4.14Å; L72-M125 HydrophobicContact CD1-SD 4.21Å; F123-M125 HydrophobicContact CD2-CB 4.39Å; M125-V127 HydrophobicContact CE-CG2 4.28Å
126	K	97.5	Very high	87.2	Confident	43 Å²	43	65.9 Å²	65.9	19%	0.187	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.4	171.5	-62.4	-178.2	-173.3	167.5	0	109	E27 L35 V38 Q62 E124 Y128	E27-K126 IonicContact OE2-NZ 3.64Å; E27-K126 PolarHBondContact OE2-NZ 3.4Å; L35-K126 HydrophobicContact CD1-CB 3.81Å; L35-K126 HydrophobicContact CD1-CG 4.28Å; V38-K126 HydrophobicContact CG1-CG 4.36Å; V38-K126 HydrophobicContact CG2-CG 4.25Å; Q62-K126 PolarHBondContact N-O 3.37Å; Q62-K126 PolarHBondContact O-N 2.75Å; E124-K126 VanDerWaalsContact OE1-CE 3.25Å; E124-K126 WeakPolarHBondContact OE1-CE 3.45Å; E124-K126 IonicContact OE1-NZ 2.64Å; K126-Y128 HydrophobicContact CB-CD2 4.19Å; K126-Y128 HydrophobicContact CB-CE2 3.36Å; K126-Y128 HydrophobicContact CD-CE2 4.34Å; K126-Y128 WeakPolarHBondContact CD-OH 3.39Å; K126-Y128 HydrophobicContact CG-CE2 4.49Å
127	V	97.9	Very high	84.8	Confident	9 Å²	9	67.8 Å²	67.8	6%	0.055	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.4	-179.7	-176.5	0	0	0	0	107.7	L36 H37 L53 I59 L61 M125	L36-V127 WeakPolarHBondContact CB-O 3.22Å; L36-V127 PolarHBondContact N-O 2.93Å; H37-V127 HydrophobicContact CB-CB 4.17Å; H37-V127 HydrophobicContact CB-CG2 4.34Å; H37-V127 PolarHBondContact N-O 3.48Å; H37-V127 PolarHBondContact O-N 3.14Å; L53-V127 HydrophobicContact CD1-CG1 4.34Å; I59-V127 HydrophobicContact CG2-CG1 3.6Å; L61-V127 HydrophobicContact CD2-CB 4.42Å; L61-V127 HydrophobicContact CD2-CG1 4.01Å; L61-V127 HydrophobicContact CD2-CG2 3.93Å; M125-V127 HydrophobicContact CE-CG2 4.28Å
128	Y	97.5	Very high	82.5	Confident	11 Å²	11	72.6 Å²	72.6	4%	0.043	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.2	-178.7	-61.6	-90.9	0	0	0	111.8	V29 W33 I34 L35 I59 V60 Q62 K126	V29-Y128 HydrophobicContact CG1-CD1 4.22Å; V29-Y128 HydrophobicContact CG1-CE1 3.69Å; V29-Y128 HydrophobicContact CG2-CE1 4.47Å; W33-Y128 HydrophobicContact CB-CD1 3.89Å; W33-Y128 HydrophobicContact CB-CG 4.2Å; W33-Y128 HydrophobicContact CE3-CD1 4.42Å; W33-Y128 HydrophobicContact CE3-CD2 4.05Å; W33-Y128 AromaticContact CE3-CG 3.98Å; W33-Y128 HydrophobicContact CE3-CG 3.98Å; I34-Y128 CarbonylContact O-C 3.56Å; I34-Y128 WeakPolarHBondContact O-CA 3.5Å; L35-Y128 HydrophobicContact CB-CD1 4.04Å; L35-Y128 HydrophobicContact CB-CE1 3.83Å; L35-Y128 HydrophobicContact CD1-CD1 4.11Å; L35-Y128 HydrophobicContact CD1-CE1 3.72Å; L35-Y128 HydrophobicContact CD1-CE2 4.33Å; L35-Y128 HydrophobicContact CG-CE1 4.36Å; I59-Y128 CarbonylContact C-O 3.59Å; I59-Y128 VanDerWaalsContact CA-O 3.3Å; I59-Y128 WeakPolarHBondContact CA-O 3.2Å; I59-Y128 WeakPolarHBondContact CG2-O 3.39Å; V60-Y128 PolarHBondContact N-O 3.36Å; V60-Y128 PolarHBondContact O-N 2.82Å; Q62-Y128 HydrophobicContact CB-CD2 4.31Å; Q62-Y128 HydrophobicContact CB-CE2 3.95Å; Q62-Y128 PolarHBondContact OE1-OH 2.99Å; K126-Y128 HydrophobicContact CB-CD2 4.19Å; K126-Y128 HydrophobicContact CB-CE2 3.36Å; K126-Y128 HydrophobicContact CD-CE2 4.34Å; K126-Y128 WeakPolarHBondContact CD-OH 3.39Å; K126-Y128 HydrophobicContact CG-CE2 4.49Å
129	Y	95.6	Very high	79.9	Confident	27 Å²	27	72.4 Å²	72.4	11%	0.106	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123	162.4	-176.8	-94.8	0	0	0	109.4	W33 I34 I59 R131 Y143	W33-Y129 WeakPolarHBondContact CA-O 3.29Å; I34-Y129 HydrophobicContact CD1-CD1 3.78Å; I34-Y129 HydrophobicContact CD1-CG 4.36Å; I34-Y129 HydrophobicContact CG1-CD1 4.39Å; I34-Y129 PolarHBondContact N-O 2.75Å; I34-Y129 PolarHBondContact O-N 3.03Å; I59-Y129 HydrophobicContact CD1-CD2 3.88Å; Y129-R131 HydrophobicContact CD1-CG 3.76Å; Y129-R131 HydrophobicContact CE1-CB 4.5Å; Y129-R131 HydrophobicContact CE1-CG 3.84Å; Y129-Y143 HydrophobicContact CD1-CD1 4.41Å; Y129-Y143 AromaticContact CD1-CE1 3.89Å; Y129-Y143 HydrophobicContact CD1-CE1 3.89Å; Y129-Y143 AromaticContact CD2-CE1 3.99Å; Y129-Y143 HydrophobicContact CD2-CE1 3.99Å; Y129-Y143 HydrophobicContact CD2-CE2 4.12Å; Y129-Y143 AromaticContact CD2-CZ 3.66Å; Y129-Y143 AromaticContact CE1-CD1 3.6Å; Y129-Y143 HydrophobicContact CE1-CD1 3.6Å; Y129-Y143 AromaticContact CE1-CE1 3.52Å; Y129-Y143 HydrophobicContact CE1-CE1 3.52Å; Y129-Y143 HydrophobicContact CE1-CG 4.3Å; Y129-Y143 AromaticContact CE2-CD1 3.95Å; Y129-Y143 HydrophobicContact CE2-CD1 3.95Å; Y129-Y143 AromaticContact CE2-CD2 3.84Å; Y129-Y143 HydrophobicContact CE2-CD2 3.84Å; Y129-Y143 AromaticContact CE2-CE1 3.63Å; Y129-Y143 HydrophobicContact CE2-CE1 3.63Å; Y129-Y143 AromaticContact CE2-CE2 3.53Å; Y129-Y143 HydrophobicContact CE2-CE2 3.53Å; Y129-Y143 HydrophobicContact CE2-CG 4.03Å; Y129-Y143 AromaticContact CE2-CZ 3.42Å; Y129-Y143 VanDerWaalsContact CE2-CZ 3.42Å; Y129-Y143 HydrophobicContact CG-CE1 4.1Å; Y129-Y143 AromaticContact CZ-CD1 3.32Å; Y129-Y143 AromaticContact CZ-CD2 3.88Å; Y129-Y143 AromaticContact CZ-CE1 3.39Å; Y129-Y143 AromaticContact CZ-CE2 3.95Å; Y129-Y143 AromaticContact CZ-CG 3.57Å; Y129-Y143 AromaticContact CZ-CZ 3.71Å; Y129-Y143 WeakPolarHBondContact OH-CB 3.36Å; Y129-Y143 VanDerWaalsContact OH-CD1 3.23Å; Y129-Y143 WeakPolarHBondContact OH-CD1 3.5Å
130	D	94.9	Very high	77.2	Confident	6 Å²	6	74.5 Å²	74.5	3%	0.032	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	109.8	177.7	-177	-15.5	0	0	0	110.2	W33 K58 V60 T132	W33-D130 PolarHBondContact NE1-OD2 3.49Å; K58-D130 HydrophobicContact CB-CB 4.22Å; K58-D130 HydrophobicContact CD-CB 3.9Å; K58-D130 WeakPolarHBondContact CD-OD2 3.38Å; K58-D130 WeakPolarHBondContact CE-OD2 3.48Å; K58-D130 HydrophobicContact CG-CB 3.99Å; K58-D130 IonicContact NZ-OD2 2.66Å; K58-D130 PolarHBondContact NZ-OD2 2.83Å; K58-D130 PolarHBondContact O-N 2.94Å; V60-D130 HydrophobicContact CG2-CB 4Å; D130-T132 PolarHBondContact O-N 3.06Å; D130-T132 WeakPolarHBondContact OD1-CB 3.3Å; D130-T132 WeakPolarHBondContact OD1-CG2 3.48Å; D130-T132 PolarHBondContact OD1-N 2.95Å; D130-T132 PolarHBondContact OD1-OG1 3.19Å; D130-T132 PolarHBondContact OD2-OG1 2.95Å
131	R	90.9	Very high	74.7	Confident	146 Å²	146	75.5 Å²	75.5	55%	0.551	40%	0.401	S	S	*	.			trans	-77.2	-0.8	-179.9	-67.5	-179.4	160.9	165.5	7	114.3	E32 I34 Y129 V133	E32-R131 VanDerWaalsContact O-CB 3.27Å; E32-R131 WeakPolarHBondContact O-CB 3.34Å; E32-R131 WeakPolarHBondContact O-CG 3.3Å; E32-R131 PolarHBondContact O-N 3.22Å; I34-R131 HydrophobicContact CD1-CG 3.95Å; I34-R131 HydrophobicContact CG1-CG 3.95Å; I34-R131 VanDerWaalsContact CG1-NE 3.34Å; Y129-R131 HydrophobicContact CD1-CG 3.76Å; Y129-R131 HydrophobicContact CE1-CB 4.5Å; Y129-R131 HydrophobicContact CE1-CG 3.84Å; R131-V133 PolarHBondContact O-N 3.09Å
132	T	85.8	Confident	72.1	Confident	58 Å²	58	81 Å²	81	36%	0.356	44%	0.44	S	S	.	.			trans	-55.7	118.7	178.9	52.5	0	0	0	0	109.2	E32 K58 D130 V134	E32-T132 HydrophobicContact CB-CG2 4.15Å; E32-T132 HydrophobicContact CG-CG2 4.2Å; K58-T132 PolarHBondContact NZ-OG1 2.86Å; D130-T132 PolarHBondContact O-N 3.06Å; D130-T132 WeakPolarHBondContact OD1-CB 3.3Å; D130-T132 WeakPolarHBondContact OD1-CG2 3.48Å; D130-T132 PolarHBondContact OD1-N 2.95Å; D130-T132 PolarHBondContact OD1-OG1 3.19Å; D130-T132 PolarHBondContact OD2-OG1 2.95Å; T132-V134 PolarHBondContact O-N 3.48Å
133	V	61.4	Low	70	Confident	126 Å²	126	81.9 Å²	81.9	76%	0.764	44%	0.441	S	S	*	.			trans	-65.6	97.2	-174.7	-173.1	0	0	0	0	107.8	R131 Q135	R131-V133 PolarHBondContact O-N 3.09Å; V133-Q135 VanDerWaalsContact C-N 3.27Å; V133-Q135 HydrophobicContact CG1-CG 4.19Å; V133-Q135 PolarHBondContact O-N 3.36Å
134	V	55.2	Low	68.2	Low	78 Å²	78	84.5 Å²	84.5	47%	0.473	46%	0.455	S	S	.	.			trans	-74.6	94.1	166.8	-165.3	0	0	0	0	105.6	K58 T132 Y136	K58-V134 HydrophobicContact CD-CG2 4.5Å; T132-V134 PolarHBondContact O-N 3.48Å; V134-Y136 HydrophobicContact CB-CD2 3.94Å; V134-Y136 HydrophobicContact CB-CE2 4.05Å; V134-Y136 HydrophobicContact CG1-CD2 3.34Å; V134-Y136 HydrophobicContact CG1-CE2 3.29Å; V134-Y136 HydrophobicContact CG1-CG 4.24Å; V134-Y136 PolarHBondContact O-N 2.86Å
135	Q	42	Very low	66.1	Low	175 Å²	175	85.2 Å²	85.2	82%	0.818	46%	0.463	S	S	*	.			trans	-63.2	82.6	162.8	-75.9	-178	3.6	0	0	107.4	V133 P137	V133-Q135 VanDerWaalsContact C-N 3.27Å; V133-Q135 HydrophobicContact CG1-CG 4.19Å; V133-Q135 PolarHBondContact O-N 3.36Å; Q135-P137 WeakPolarHBondContact O-CD 3.18Å
136	Y	44.2	Very low	64.1	Low	130 Å²	130	92.2 Å²	92.2	51%	0.51	50%	0.496	S	S	.	.			trans	-69	126.4	160.3	-89.8	-82.9	0	0	0	106.5	V134 F138	V134-Y136 HydrophobicContact CB-CD2 3.94Å; V134-Y136 HydrophobicContact CB-CE2 4.05Å; V134-Y136 HydrophobicContact CG1-CD2 3.34Å; V134-Y136 HydrophobicContact CG1-CE2 3.29Å; V134-Y136 HydrophobicContact CG1-CG 4.24Å; V134-Y136 PolarHBondContact O-N 2.86Å; Y136-F138 PolarHBondContact O-N 3.29Å
137	P	46.3	Very low	62.2	Low	117 Å²	117	96 Å²	96	76%	0.76	51%	0.514	S	S	*	.	S	Bend	trans	-64.4	1	179.6	17.8	-24	0	0	0	113.9	Q135	Q135-P137 WeakPolarHBondContact O-CD 3.18Å
138	F	45.4	Very low	60.1	Low	193 Å²	193	97.7 Å²	97.7	85%	0.846	52%	0.522	S	S	*	.	S	Bend	trans	-135.5	99.8	176.8	-74.9	-86.9	0	0	0	110.7	Y136	Y136-F138 PolarHBondContact O-N 3.29Å
139	G	40.9	Very low	58.1	Low	70 Å²	70	104.1 Å²	104.1	72%	0.722	55%	0.552	S	S	*	*			trans	101.7	99.8	158.4	0	0	0	0	0	115.8	A141	G139-A141 PolarHBondContact O-N 3.14Å
140	E	42.7	Very low	55.9	Low	208 Å²	208	106.5 Å²	106.5	97%	0.972	57%	0.569	S	S	*	*			trans	-70	112.9	164.4	-69	-176.7	159.7	0	0	110
141	A	43.3	Very low	53.6	Low	95 Å²	95	110.9 Å²	110.9	79%	0.785	59%	0.593	S	S	*	*			trans	-108.9	105.8	154.3	0	0	0	0	0	106.6	G139 Y143	G139-A141 PolarHBondContact O-N 3.14Å; A141-Y143 PolarHBondContact O-N 2.9Å; A141-Y143 VanDerWaalsContact O-N 3.1Å
142	S	44.4	Very low	51.5	Low	117 Å²	117	106.8 Å²	106.8	82%	0.818	58%	0.58	S	S	*	*			trans	-67.4	108.7	175.9	63.3	0	0	0	0	108.8	N144	S142-N144 PolarHBondContact O-N 2.89Å
143	Y	53.6	Low	49.5	Very low	69 Å²	69	112.2 Å²	112.2	27%	0.271	60%	0.599	S	S	.	*			trans	-70.1	117.4	175.5	177.3	-99.7	0	0	0	110.1	Y129 A141 P145	Y129-Y143 HydrophobicContact CD1-CD1 4.41Å; Y129-Y143 AromaticContact CD1-CE1 3.89Å; Y129-Y143 HydrophobicContact CD1-CE1 3.89Å; Y129-Y143 AromaticContact CD2-CE1 3.99Å; Y129-Y143 HydrophobicContact CD2-CE1 3.99Å; Y129-Y143 HydrophobicContact CD2-CE2 4.12Å; Y129-Y143 AromaticContact CD2-CZ 3.66Å; Y129-Y143 AromaticContact CE1-CD1 3.6Å; Y129-Y143 HydrophobicContact CE1-CD1 3.6Å; Y129-Y143 AromaticContact CE1-CE1 3.52Å; Y129-Y143 HydrophobicContact CE1-CE1 3.52Å; Y129-Y143 HydrophobicContact CE1-CG 4.3Å; Y129-Y143 AromaticContact CE2-CD1 3.95Å; Y129-Y143 HydrophobicContact CE2-CD1 3.95Å; Y129-Y143 AromaticContact CE2-CD2 3.84Å; Y129-Y143 HydrophobicContact CE2-CD2 3.84Å; Y129-Y143 AromaticContact CE2-CE1 3.63Å; Y129-Y143 HydrophobicContact CE2-CE1 3.63Å; Y129-Y143 AromaticContact CE2-CE2 3.53Å; Y129-Y143 HydrophobicContact CE2-CE2 3.53Å; Y129-Y143 HydrophobicContact CE2-CG 4.03Å; Y129-Y143 AromaticContact CE2-CZ 3.42Å; Y129-Y143 VanDerWaalsContact CE2-CZ 3.42Å; Y129-Y143 HydrophobicContact CG-CE1 4.1Å; Y129-Y143 AromaticContact CZ-CD1 3.32Å; Y129-Y143 AromaticContact CZ-CD2 3.88Å; Y129-Y143 AromaticContact CZ-CE1 3.39Å; Y129-Y143 AromaticContact CZ-CE2 3.95Å; Y129-Y143 AromaticContact CZ-CG 3.57Å; Y129-Y143 AromaticContact CZ-CZ 3.71Å; Y129-Y143 WeakPolarHBondContact OH-CB 3.36Å; Y129-Y143 VanDerWaalsContact OH-CD1 3.23Å; Y129-Y143 WeakPolarHBondContact OH-CD1 3.5Å; A141-Y143 PolarHBondContact O-N 2.9Å; A141-Y143 VanDerWaalsContact O-N 3.1Å; Y143-P145 HydrophobicContact CD1-CG 4.23Å; Y143-P145 HydrophobicContact CE1-CB 4.13Å; Y143-P145 HydrophobicContact CE1-CG 3.82Å
144	N	58.6	Low	48.6	Very low	61 Å²	61	114.8 Å²	114.8	33%	0.326	60%	0.596	S	S	.	*			trans	-109.3	108.5	170.9	-173.6	-1.5	0	0	0	109.7	S142 E146 E147	S142-N144 PolarHBondContact O-N 2.89Å; N144-E146 PolarHBondContact O-N 2.79Å; N144-E146 PolarHBondContact OD1-N 3Å; N144-E147 HydrophobicContact CB-CB 4.34Å; N144-E147 HydrophobicContact CB-CG 4.39Å; N144-E147 PolarHBondContact O-N 2.86Å
145	P	51.8	Low	47.7	Very low	48 Å²	48	115.1 Å²	115.1	31%	0.312	60%	0.602	S	S	.	*	H	α-helix	trans	-59.5	-31.3	-179.8	-9.4	15.5	0	0	0	113.5	Y143 E147 M148 E149	Y143-P145 HydrophobicContact CD1-CG 4.23Å; Y143-P145 HydrophobicContact CE1-CB 4.13Å; Y143-P145 HydrophobicContact CE1-CG 3.82Å; P145-E147 PolarHBondContact O-N 2.86Å; P145-M148 PolarHBondContact O-N 3.33Å; P145-E149 PolarHBondContact O-N 3.28Å
146	E	55.8	Low	47.5	Very low	150 Å²	150	114.5 Å²	114.5	70%	0.701	60%	0.598	S	S	*	*	H	α-helix	trans	-72.8	-27.9	-176.3	-63.9	177.9	171	0	0	112.8	N144 T150	N144-E146 PolarHBondContact O-N 2.79Å; N144-E146 PolarHBondContact OD1-N 3Å; E146-T150 PolarHBondContact O-OG1 2.92Å
147	E	57.1	Low	47.2	Very low	122 Å²	122	111.8 Å²	111.8	57%	0.57	60%	0.599	S	S	*	*	H	α-helix	trans	-78.8	-23.3	176.4	-77.5	178.6	-169.9	0	0	112.5	N144 P145 T150 N151	N144-E147 HydrophobicContact CB-CB 4.34Å; N144-E147 HydrophobicContact CB-CG 4.39Å; N144-E147 PolarHBondContact O-N 2.86Å; P145-E147 PolarHBondContact O-N 2.86Å; E147-T150 WeakPolarHBondContact CA-OG1 3.44Å; E147-T150 PolarHBondContact O-OG1 2.98Å; E147-N151 PolarHBondContact O-N 3.26Å; E147-N151 VanDerWaalsContact O-N 3.14Å; E147-N151 PolarHBondContact O-ND2 2.79Å
148	M	55.3	Low	47.2	Very low	45 Å²	45	110.2 Å²	110.2	22%	0.222	59%	0.587	C	S	.	*	H	α-helix	trans	-80.3	-37.2	178.8	-165.9	123.6	-175.5	0	0	112.1	P145 T150 N151 Q152	P145-M148 PolarHBondContact O-N 3.33Å; M148-T150 VanDerWaalsContact C-N 3.28Å; M148-T150 PolarHBondContact O-N 2.81Å; M148-N151 PolarHBondContact O-N 3.06Å; M148-Q152 HydrophobicContact CG-CG 4.28Å; M148-Q152 VanDerWaalsContact O-CB 3.28Å; M148-Q152 WeakPolarHBondContact O-CB 3.37Å; M148-Q152 WeakPolarHBondContact O-CG 3.5Å; M148-Q152 PolarHBondContact O-N 3.44Å
149	E	54.1	Low	47.3	Very low	145 Å²	145	108.3 Å²	108.3	68%	0.678	58%	0.581	S	S	*	*	H	α-helix	trans	-62.7	-37.1	174.3	-68	-171.1	175.9	0	0	111.9	P145 K153	P145-E149 PolarHBondContact O-N 3.28Å; E149-K153 WeakPolarHBondContact O-CB 3.1Å; E149-K153 PolarHBondContact O-N 3.4Å
150	T	50.8	Low	47.5	Very low	77 Å²	77	112 Å²	112	47%	0.472	58%	0.584	S	S	.	*	H	α-helix	trans	-69.5	-45.7	175.7	48.8	0	0	0	0	111.4	E146 E147 M148 K153 Y154	E146-T150 PolarHBondContact O-OG1 2.92Å; E147-T150 WeakPolarHBondContact CA-OG1 3.44Å; E147-T150 PolarHBondContact O-OG1 2.98Å; M148-T150 VanDerWaalsContact C-N 3.28Å; M148-T150 PolarHBondContact O-N 2.81Å; T150-K153 WeakPolarHBondContact O-CB 3.36Å; T150-K153 PolarHBondContact O-N 2.82Å; T150-Y154 WeakPolarHBondContact O-CD2 3.33Å; T150-Y154 PolarHBondContact O-N 2.72Å
151	N	46.1	Very low	47.5	Very low	98 Å²	98	109 Å²	109	52%	0.524	57%	0.57	S	S	.	*	H	α-helix	trans	-65.6	-38.4	174.8	-80.8	-69.9	0	0	0	113.1	E147 M148 K153 Y154 S155	E147-N151 PolarHBondContact O-N 3.26Å; E147-N151 VanDerWaalsContact O-N 3.14Å; E147-N151 PolarHBondContact O-ND2 2.79Å; M148-N151 PolarHBondContact O-N 3.06Å; N151-K153 VanDerWaalsContact C-N 3.29Å; N151-K153 PolarHBondContact O-N 2.99Å; N151-Y154 CarbonylContact O-C 3.54Å; N151-Y154 WeakPolarHBondContact O-CA 3.21Å; N151-Y154 PolarHBondContact O-N 3.27Å; N151-S155 PolarHBondContact O-N 3.06Å; N151-S155 PolarHBondContact O-OG 2.97Å
152	Q	47.6	Very low	47.8	Very low	60 Å²	60	106.1 Å²	106.1	28%	0.28	54%	0.544	S	S	.	.	H	α-helix	trans	-63.6	-34.4	174.2	-79.1	-178.4	-6.4	0	0	111.9	H55 M148 Y154 S155 H156	H55-Q152 PolarHBondContact CE1-NE2 2.83Å; H55-Q152 PolarHBondContact ND1-NE2 3.04Å; M148-Q152 HydrophobicContact CG-CG 4.28Å; M148-Q152 VanDerWaalsContact O-CB 3.28Å; M148-Q152 WeakPolarHBondContact O-CB 3.37Å; M148-Q152 WeakPolarHBondContact O-CG 3.5Å; M148-Q152 PolarHBondContact O-N 3.44Å; Q152-Y154 VanDerWaalsContact C-N 3.27Å; Q152-Y154 PolarHBondContact O-N 3.23Å; Q152-S155 PolarHBondContact O-N 3.24Å; Q152-H156 WeakPolarHBondContact O-CB 3.42Å; Q152-H156 PolarHBondContact O-N 3.27Å
153	K	42.3	Very low	48	Very low	173 Å²	173	107 Å²	107	75%	0.752	54%	0.535	S	S	*	.	H	α-helix	trans	-67.3	-28.7	173	-150.3	175.1	-170.6	174.4	0	113	E149 T150 N151 S157	E149-K153 WeakPolarHBondContact O-CB 3.1Å; E149-K153 PolarHBondContact O-N 3.4Å; T150-K153 WeakPolarHBondContact O-CB 3.36Å; T150-K153 PolarHBondContact O-N 2.82Å; N151-K153 VanDerWaalsContact C-N 3.29Å; N151-K153 PolarHBondContact O-N 2.99Å; K153-S157 PolarHBondContact O-OG 2.91Å
154	Y	42.2	Very low	48.1	Very low	179 Å²	179	109.8 Å²	109.8	70%	0.702	56%	0.555	S	S	*	*	H	α-helix	trans	-83.3	-27.6	173	-81.7	-76.3	0	0	0	113.4	T150 N151 Q152 S157 T158	T150-Y154 WeakPolarHBondContact O-CD2 3.33Å; T150-Y154 PolarHBondContact O-N 2.72Å; N151-Y154 CarbonylContact O-C 3.54Å; N151-Y154 WeakPolarHBondContact O-CA 3.21Å; N151-Y154 PolarHBondContact O-N 3.27Å; Q152-Y154 VanDerWaalsContact C-N 3.27Å; Q152-Y154 PolarHBondContact O-N 3.23Å; Y154-S157 PolarHBondContact O-OG 3.3Å; Y154-T158 PolarHBondContact O-OG1 3Å
155	S	36.7	Very low	48.1	Very low	85 Å²	85	112 Å²	112	59%	0.594	56%	0.563	S	S	*	*	H	α-helix	trans	-88.1	-28.1	178	-51.7	0	0	0	0	113.2	N151 Q152 S157	N151-S155 PolarHBondContact O-N 3.06Å; N151-S155 PolarHBondContact O-OG 2.97Å; Q152-S155 PolarHBondContact O-N 3.24Å; S155-S157 PolarHBondContact O-N 3.43Å
156	H	38.4	Very low	48.5	Very low	162 Å²	162	115.7 Å²	115.7	75%	0.75	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-14.8	175	-163.2	-5.5	0	0	0	112.1	Q152	Q152-H156 WeakPolarHBondContact O-CB 3.42Å; Q152-H156 PolarHBondContact O-N 3.27Å
157	S	37.1	Very low	49.1	Very low	74 Å²	74	112 Å²	112	52%	0.517	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.2	6.7	-176.5	55.3	0	0	0	0	116.1	K153 Y154 S155	K153-S157 PolarHBondContact O-OG 2.91Å; Y154-S157 PolarHBondContact O-OG 3.3Å; S155-S157 PolarHBondContact O-N 3.43Å
158	T	47.5	Very low	50.2	Low	83 Å²	83	110.4 Å²	110.4	51%	0.509	57%	0.566	S	S	.	*	S	Bend	trans	-129	-13.8	-168.4	8.6	0	0	0	0	119.1	Y154 S162	Y154-T158 PolarHBondContact O-OG1 3Å; T158-S162 PolarHBondContact O-OG 3Å
159	E	46.8	Very low	51.6	Low	153 Å²	153	114.6 Å²	114.6	72%	0.715	58%	0.583	S	S	*	*	S	Bend	trans	-128.5	-19	-169.8	-69.1	-177.5	172.7	0	0	118.2
160	D	44.6	Very low	52.9	Low	149 Å²	149	115.3 Å²	115.3	80%	0.797	58%	0.579	S	S	*	*	S	Bend	trans	-120.4	-17.1	178.2	-83.1	-33.3	0	0	0	115.7
161	E	44.4	Very low	54.5	Low	145 Å²	145	116.5 Å²	116.5	68%	0.678	59%	0.586	S	S	*	*	S	Bend	trans	-97.3	-19.6	170.7	-94.9	-176.5	161.2	0	0	113.3	E165	E161-E165 WeakPolarHBondContact O-CG 3.11Å; E161-E165 PolarHBondContact O-N 2.96Å
162	S	49.5	Very low	56.5	Low	34 Å²	34	116.2 Å²	116.2	24%	0.238	58%	0.584	C	S	.	*	H	α-helix	trans	-71.8	-31.2	-173.9	54.5	0	0	0	0	113.6	T158 E166	T158-S162 PolarHBondContact O-OG 3Å; S162-E166 WeakPolarHBondContact O-CB 3.17Å; S162-E166 WeakPolarHBondContact O-CG 3.47Å; S162-E166 PolarHBondContact O-N 3.31Å
163	Q	47.1	Very low	58.5	Low	136 Å²	136	118.3 Å²	118.3	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-73.7	-36.5	-176.1	-66.5	-174.3	19.4	0	0	113.1	S167	Q163-S167 PolarHBondContact O-N 2.86Å; Q163-S167 PolarHBondContact O-OG 3.11Å
164	D	56	Low	60.8	Low	126 Å²	126	114.5 Å²	114.5	67%	0.674	58%	0.583	S	S	*	*	H	α-helix	trans	-77.3	-41.1	178.3	-72.9	-20.9	0	0	0	111	S167 V168	D164-S167 PolarHBondContact O-N 3.48Å; D164-V168 WeakPolarHBondContact O-CG2 3.39Å; D164-V168 PolarHBondContact O-N 3.23Å
165	E	59	Low	62.9	Low	108 Å²	108	107.9 Å²	107.9	51%	0.505	57%	0.57	S	S	.	*	H	α-helix	trans	-68.9	-41.2	175.5	-67.2	-137.3	160.7	0	0	112.4	E161 S167 V168 F169	E161-E165 WeakPolarHBondContact O-CG 3.11Å; E161-E165 PolarHBondContact O-N 2.96Å; E165-S167 VanDerWaalsContact C-N 3.25Å; E165-S167 PolarHBondContact O-N 3.48Å; E165-V168 PolarHBondContact O-N 2.74Å; E165-V168 VanDerWaalsContact O-N 3.11Å; E165-F169 HydrophobicContact CB-CD2 4.16Å; E165-F169 HydrophobicContact CB-CE2 4.03Å; E165-F169 WeakPolarHBondContact O-CD2 3.48Å; E165-F169 PolarHBondContact O-N 3.01Å; E165-F169 WeakPolarHBondContact OE2-CE2 3.26Å
166	E	59.7	Low	65.5	Low	125 Å²	125	108.5 Å²	108.5	58%	0.584	57%	0.566	S	S	*	*	H	α-helix	trans	-58	-39.6	175	-83	-176.4	175.4	0	0	111.5	S162 V168 F169 W170	S162-E166 WeakPolarHBondContact O-CB 3.17Å; S162-E166 WeakPolarHBondContact O-CG 3.47Å; S162-E166 PolarHBondContact O-N 3.31Å; E166-V168 PolarHBondContact O-N 3.3Å; E166-F169 PolarHBondContact O-N 3.3Å; E166-W170 VanDerWaalsContact O-CB 3.26Å; E166-W170 WeakPolarHBondContact O-CB 3.43Å; E166-W170 PolarHBondContact O-N 3.42Å
167	S	68.9	Low	67.9	Low	74 Å²	74	106.2 Å²	106.2	52%	0.517	56%	0.558	S	S	.	*	H	α-helix	trans	-64.4	-37.9	177.1	-66.7	0	0	0	0	112.5	Q163 D164 E165 T171	Q163-S167 PolarHBondContact O-N 2.86Å; Q163-S167 PolarHBondContact O-OG 3.11Å; D164-S167 PolarHBondContact O-N 3.48Å; E165-S167 VanDerWaalsContact C-N 3.25Å; E165-S167 PolarHBondContact O-N 3.48Å; S167-T171 WeakPolarHBondContact O-CB 3.07Å; S167-T171 PolarHBondContact O-N 2.88Å; S167-T171 VanDerWaalsContact O-N 3.16Å; S167-T171 PolarHBondContact O-OG1 2.87Å
168	V	80	Confident	70.2	Confident	88 Å²	88	109.7 Å²	109.7	53%	0.533	56%	0.564	S	S	.	*	H	α-helix	trans	-72.2	-46.7	176.8	176.7	0	0	0	0	111	D164 E165 E166 W170 T171 I172	D164-V168 WeakPolarHBondContact O-CG2 3.39Å; D164-V168 PolarHBondContact O-N 3.23Å; E165-V168 PolarHBondContact O-N 2.74Å; E165-V168 VanDerWaalsContact O-N 3.11Å; E166-V168 PolarHBondContact O-N 3.3Å; V168-W170 PolarHBondContact O-N 3.37Å; V168-T171 PolarHBondContact O-N 3.48Å; V168-I172 HydrophobicContact CG1-CD1 4.02Å; V168-I172 WeakPolarHBondContact O-CG1 3.44Å; V168-I172 PolarHBondContact O-N 3.16Å
169	F	84.8	Confident	72.1	Confident	132 Å²	132	110.6 Å²	110.6	58%	0.579	57%	0.565	S	S	*	*	H	α-helix	trans	-62.2	-40.8	177.6	-75.8	-65.4	0	0	0	112.1	E165 E166 T171 I172 L173	E165-F169 HydrophobicContact CB-CD2 4.16Å; E165-F169 HydrophobicContact CB-CE2 4.03Å; E165-F169 WeakPolarHBondContact O-CD2 3.48Å; E165-F169 PolarHBondContact O-N 3.01Å; E165-F169 WeakPolarHBondContact OE2-CE2 3.26Å; E166-F169 PolarHBondContact O-N 3.3Å; F169-T171 VanDerWaalsContact C-N 3.34Å; F169-T171 PolarHBondContact O-N 3.03Å; F169-I172 PolarHBondContact O-N 2.92Å; F169-L173 WeakPolarHBondContact O-CB 3.39Å; F169-L173 PolarHBondContact O-N 3.35Å
170	W	80.7	Confident	74.2	Confident	161 Å²	161	107.6 Å²	107.6	61%	0.61	55%	0.553	S	S	*	*	H	α-helix	trans	-62.9	-39.2	174.8	-106.3	101.1	0	0	0	112.9	E166 V168 L173 I174	E166-W170 VanDerWaalsContact O-CB 3.26Å; E166-W170 WeakPolarHBondContact O-CB 3.43Å; E166-W170 PolarHBondContact O-N 3.42Å; V168-W170 PolarHBondContact O-N 3.37Å; W170-L173 HydrophobicContact CE3-CD2 4.18Å; W170-L173 HydrophobicContact CZ3-CD2 4.17Å; W170-L173 PolarHBondContact O-N 3.45Å; W170-I174 HydrophobicContact CE3-CD1 3.7Å; W170-I174 HydrophobicContact CE3-CG1 3.85Å; W170-I174 HydrophobicContact CZ3-CD1 4Å; W170-I174 HydrophobicContact CZ3-CG1 4.01Å; W170-I174 WeakPolarHBondContact O-CG1 3.38Å; W170-I174 PolarHBondContact O-N 3.21Å
171	T	84.3	Confident	76.1	Confident	101 Å²	101	106.1 Å²	106.1	62%	0.62	55%	0.545	S	S	*	.	H	α-helix	trans	-65.9	-41.4	177.6	-58.9	0	0	0	0	111.2	S167 V168 F169 G175	S167-T171 WeakPolarHBondContact O-CB 3.07Å; S167-T171 PolarHBondContact O-N 2.88Å; S167-T171 VanDerWaalsContact O-N 3.16Å; S167-T171 PolarHBondContact O-OG1 2.87Å; V168-T171 PolarHBondContact O-N 3.48Å; F169-T171 VanDerWaalsContact C-N 3.34Å; F169-T171 PolarHBondContact O-N 3.03Å; T171-G175 PolarHBondContact O-N 3.39Å
172	I	88.4	Confident	77.9	Confident	93 Å²	93	105.9 Å²	105.9	48%	0.477	54%	0.543	S	S	.	.	H	α-helix	trans	-64	-44.3	175	-66.2	167.8	0	0	0	110.6	V168 F169 I174 G175 I176	V168-I172 HydrophobicContact CG1-CD1 4.02Å; V168-I172 WeakPolarHBondContact O-CG1 3.44Å; V168-I172 PolarHBondContact O-N 3.16Å; F169-I172 PolarHBondContact O-N 2.92Å; I172-I174 PolarHBondContact O-N 3.19Å; I172-G175 PolarHBondContact O-N 3.5Å; I172-I176 HydrophobicContact CG2-CD1 3.84Å; I172-I176 HydrophobicContact CG2-CG1 4.44Å; I172-I176 WeakPolarHBondContact O-CG1 3.4Å; I172-I176 PolarHBondContact O-N 2.93Å
173	L	91.3	Very high	79.6	Confident	103 Å²	103	110.6 Å²	110.6	54%	0.539	57%	0.565	S	S	.	*	H	α-helix	trans	-59	-48.4	178.8	-172.7	96.2	0	0	0	111.9	F169 W170 G175 I176 L177	F169-L173 WeakPolarHBondContact O-CB 3.39Å; F169-L173 PolarHBondContact O-N 3.35Å; W170-L173 HydrophobicContact CE3-CD2 4.18Å; W170-L173 HydrophobicContact CZ3-CD2 4.17Å; W170-L173 PolarHBondContact O-N 3.45Å; L173-G175 VanDerWaalsContact C-N 3.29Å; L173-G175 PolarHBondContact O-N 2.94Å; L173-I176 PolarHBondContact O-N 3.03Å; L173-L177 WeakPolarHBondContact O-CB 3.39Å; L173-L177 PolarHBondContact O-N 3.21Å
174	I	89.9	Confident	80.8	Confident	93 Å²	93	111 Å²	111	48%	0.477	57%	0.57	S	S	.	*	H	α-helix	trans	-62.4	-40.1	176.7	-68.4	168.2	0	0	0	110.5	W170 I172 L177 K178	W170-I174 HydrophobicContact CE3-CD1 3.7Å; W170-I174 HydrophobicContact CE3-CG1 3.85Å; W170-I174 HydrophobicContact CZ3-CD1 4Å; W170-I174 HydrophobicContact CZ3-CG1 4.01Å; W170-I174 WeakPolarHBondContact O-CG1 3.38Å; W170-I174 PolarHBondContact O-N 3.21Å; I172-I174 PolarHBondContact O-N 3.19Å; I174-L177 PolarHBondContact O-N 3.44Å; I174-K178 WeakPolarHBondContact O-CB 3.34Å; I174-K178 PolarHBondContact O-N 2.93Å
175	G	86	Confident	81.2	Confident	41 Å²	41	116 Å²	116	42%	0.423	59%	0.587	S	S	.	*	H	α-helix	trans	-59.5	-46.9	176.4	0	0	0	0	0	112.8	T171 I172 L173 K178 L179	T171-G175 PolarHBondContact O-N 3.39Å; I172-G175 PolarHBondContact O-N 3.5Å; L173-G175 VanDerWaalsContact C-N 3.29Å; L173-G175 PolarHBondContact O-N 2.94Å; G175-K178 PolarHBondContact O-N 3.05Å; G175-L179 PolarHBondContact O-N 3.34Å; G175-L179 VanDerWaalsContact O-N 3.08Å
176	I	90.3	Very high	82.3	Confident	98 Å²	98	116.4 Å²	116.4	50%	0.503	59%	0.591	S	S	.	*	H	α-helix	trans	-65.3	-44.5	177.4	-66.3	168.1	0	0	0	110.8	I172 L173 K178 L179 I180	I172-I176 HydrophobicContact CG2-CD1 3.84Å; I172-I176 HydrophobicContact CG2-CG1 4.44Å; I172-I176 WeakPolarHBondContact O-CG1 3.4Å; I172-I176 PolarHBondContact O-N 2.93Å; L173-I176 PolarHBondContact O-N 3.03Å; I176-K178 VanDerWaalsContact C-N 3.29Å; I176-K178 PolarHBondContact O-N 2.98Å; I176-L179 PolarHBondContact O-N 3.08Å; I176-I180 HydrophobicContact CG2-CD1 3.88Å; I176-I180 HydrophobicContact CG2-CG1 4.46Å; I176-I180 WeakPolarHBondContact O-CG1 3.41Å; I176-I180 PolarHBondContact O-N 2.98Å
177	L	89.6	Confident	83.5	Confident	113 Å²	113	115.9 Å²	115.9	59%	0.592	59%	0.591	S	S	*	*	H	α-helix	trans	-59.9	-42.2	178.9	-175.9	67.8	0	0	0	111.5	L173 I174 I180 L181	L173-L177 WeakPolarHBondContact O-CB 3.39Å; L173-L177 PolarHBondContact O-N 3.21Å; I174-L177 PolarHBondContact O-N 3.44Å; L177-I180 PolarHBondContact O-N 3.32Å; L177-L181 WeakPolarHBondContact O-CB 3.36Å; L177-L181 PolarHBondContact O-N 3.19Å
178	K	85.3	Confident	84.3	Confident	148 Å²	148	118.3 Å²	118.3	64%	0.643	60%	0.595	S	S	*	*	H	α-helix	trans	-63.4	-42.7	176.9	-172.7	176.3	178.7	-179.2	0	111.8	I174 G175 I176 L181 E182	I174-K178 WeakPolarHBondContact O-CB 3.34Å; I174-K178 PolarHBondContact O-N 2.93Å; G175-K178 PolarHBondContact O-N 3.05Å; I176-K178 VanDerWaalsContact C-N 3.29Å; I176-K178 PolarHBondContact O-N 2.98Å; K178-L181 PolarHBondContact O-N 3.48Å; K178-E182 WeakPolarHBondContact O-CB 3.47Å; K178-E182 PolarHBondContact O-N 3.38Å
179	L	88.6	Confident	84.6	Confident	102 Å²	102	120.1 Å²	120.1	53%	0.534	60%	0.599	S	S	.	*	H	α-helix	trans	-63.6	-41.8	177.9	-172.9	152.7	0	0	0	111.9	G175 I176 E182 I183	G175-L179 PolarHBondContact O-N 3.34Å; G175-L179 VanDerWaalsContact O-N 3.08Å; I176-L179 PolarHBondContact O-N 3.08Å; L179-E182 PolarHBondContact O-N 3.43Å; L179-I183 HydrophobicContact CD2-CD1 3.55Å; L179-I183 WeakPolarHBondContact O-CG1 3.43Å; L179-I183 PolarHBondContact O-N 3.43Å; L179-I183 VanDerWaalsContact O-N 3.16Å
180	I	89.6	Confident	84.5	Confident	89 Å²	89	119.3 Å²	119.3	46%	0.456	60%	0.6	S	S	.	*	H	α-helix	trans	-64.2	-43.5	176.5	-66.8	168.4	0	0	0	110.6	I176 L177 E182 I183 L184	I176-I180 HydrophobicContact CG2-CD1 3.88Å; I176-I180 HydrophobicContact CG2-CG1 4.46Å; I176-I180 WeakPolarHBondContact O-CG1 3.41Å; I176-I180 PolarHBondContact O-N 2.98Å; L177-I180 PolarHBondContact O-N 3.32Å; I180-E182 VanDerWaalsContact C-N 3.33Å; I180-E182 PolarHBondContact O-N 3.16Å; I180-I183 PolarHBondContact O-N 3.45Å; I180-L184 HydrophobicContact CG2-CD1 4.38Å; I180-L184 PolarHBondContact O-N 3.11Å; I180-L184 VanDerWaalsContact O-N 3.11Å
181	L	85.6	Confident	84.8	Confident	119 Å²	119	116.5 Å²	116.5	62%	0.623	60%	0.599	S	S	*	*	H	α-helix	trans	-66	-36.4	-179.4	-163.7	141.8	0	0	0	112	L177 K178 I183 L184 F185	L177-L181 WeakPolarHBondContact O-CB 3.36Å; L177-L181 PolarHBondContact O-N 3.19Å; K178-L181 PolarHBondContact O-N 3.48Å; L181-I183 VanDerWaalsContact C-N 3.31Å; L181-I183 PolarHBondContact O-N 3.48Å; L181-L184 PolarHBondContact O-N 3.16Å; L181-F185 PolarHBondContact O-N 3.27Å; L181-F185 VanDerWaalsContact O-N 3.16Å
182	E	82.4	Confident	84.8	Confident	139 Å²	139	117.6 Å²	117.6	65%	0.65	60%	0.598	S	S	*	*	H	α-helix	trans	-68.2	-25.3	173.8	-173.6	173.4	175.2	0	0	113.4	K178 L179 I180	K178-E182 WeakPolarHBondContact O-CB 3.47Å; K178-E182 PolarHBondContact O-N 3.38Å; L179-E182 PolarHBondContact O-N 3.43Å; I180-E182 VanDerWaalsContact C-N 3.33Å; I180-E182 PolarHBondContact O-N 3.16Å
183	I	84.1	Confident	84.6	Confident	133 Å²	133	119.5 Å²	119.5	68%	0.682	61%	0.607	S	S	*	*	H	α-helix	trans	-80.4	-29	173.4	-70.2	170.1	0	0	0	111.4	L179 I180 L181	L179-I183 HydrophobicContact CD2-CD1 3.55Å; L179-I183 WeakPolarHBondContact O-CG1 3.43Å; L179-I183 PolarHBondContact O-N 3.43Å; L179-I183 VanDerWaalsContact O-N 3.16Å; I180-I183 PolarHBondContact O-N 3.45Å; L181-I183 VanDerWaalsContact C-N 3.31Å; L181-I183 PolarHBondContact O-N 3.48Å
184	L	73.1	Confident	84	Confident	144 Å²	144	120.9 Å²	120.9	75%	0.754	61%	0.613	S	S	*	*	H	α-helix	trans	-89	-14.9	-173.9	-125.5	146.5	0	0	0	113.4	I180 L181	I180-L184 HydrophobicContact CG2-CD1 4.38Å; I180-L184 PolarHBondContact O-N 3.11Å; I180-L184 VanDerWaalsContact O-N 3.11Å; L181-L184 PolarHBondContact O-N 3.16Å
185	F	63.7	Low	83.5	Confident	232 Å²	232	123.5 Å²	123.5	100%	1.018	63%	0.625	S	S	*	*			trans	-138	0	-178.2	-154.3	-81.4	0	0	0	111.6	L181	L181-F185 PolarHBondContact O-N 3.27Å; L181-F185 VanDerWaalsContact O-N 3.16Å

Retrieved 185 of 185 residues in 170.9 ms (Link to these results)

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