A0A077YUK6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YUK6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 101 aa.

						>A0A077YUK6_TRITR|A0A077YUK6
MTKHSSVLLLLGRQLIVFFLVRLYGTVNLCQIFISNCELHRDDQLNRAAIAVANNVYGGDTVSFGKQVNFVNRNTWTKQTKMYTKCPSCSIETFVPARRSY
					

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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	38.2	Very low	46.5	Very low	243 Å²	243	124.2 Å²	124.2	100%	1.197	66%	0.661	S	S	*	*				0	84.1	0	-73.6	168.2	157.9	0	0	109.4
2	T	45.9	Very low	47.1	Very low	123 Å²	123	116.3 Å²	116.3	76%	0.755	63%	0.631	S	S	*	*			trans	-139.4	19.6	-173.5	42.7	0	0	0	0	114.3
3	K	48.5	Very low	47.2	Very low	186 Å²	186	117.4 Å²	117.4	81%	0.809	62%	0.62	S	S	*	*	S	Bend	trans	-84.9	-15.2	179.5	-78.3	-177.4	175	178.9	0	114.8
4	H	43.9	Very low	47.2	Very low	158 Å²	158	114.9 Å²	114.9	73%	0.731	60%	0.603	S	S	*	*	H	α-helix	trans	-80.7	-28.2	-177.7	-70.9	-76.9	0	0	0	113.9	S6 V7 L8	H4-S6 PolarHBondContact O-N 3.38Å; H4-V7 PolarHBondContact O-N 3.43Å; H4-L8 PolarHBondContact O-N 3.42Å
5	S	46.1	Very low	47.5	Very low	80 Å²	80	115.4 Å²	115.4	56%	0.559	61%	0.606	S	S	*	*	H	α-helix	trans	-65.6	-36.1	-177.4	-68	0	0	0	0	113.4	V7 L9	S5-V7 PolarHBondContact O-N 2.95Å; S5-L9 PolarHBondContact O-N 3.28Å; S5-L9 VanDerWaalsContact O-N 3.13Å
6	S	47.4	Very low	48.2	Very low	75 Å²	75	114.6 Å²	114.6	52%	0.524	60%	0.601	S	S	.	*	H	α-helix	trans	-67.4	-37.4	-179.2	-57.1	0	0	0	0	112.4	H4 L9 L10	H4-S6 PolarHBondContact O-N 3.38Å; S6-L9 PolarHBondContact O-N 2.88Å; S6-L10 WeakPolarHBondContact O-CB 3.37Å; S6-L10 VanDerWaalsContact O-CD1 3.29Å; S6-L10 WeakPolarHBondContact O-CD1 3.19Å; S6-L10 WeakPolarHBondContact O-CG 3.29Å; S6-L10 PolarHBondContact O-N 3.49Å
7	V	46.4	Very low	48.4	Very low	83 Å²	83	109.3 Å²	109.3	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-71.3	-39.8	-178.7	-175.8	0	0	0	0	111.3	H4 S5 L10 L11	H4-V7 PolarHBondContact O-N 3.43Å; S5-V7 PolarHBondContact O-N 2.95Å; V7-L10 PolarHBondContact O-N 3.45Å; V7-L11 HydrophobicContact CG1-CD1 3.97Å; V7-L11 HydrophobicContact CG1-CG 4.44Å; V7-L11 WeakPolarHBondContact O-CB 3.42Å; V7-L11 WeakPolarHBondContact O-CG 3.45Å; V7-L11 PolarHBondContact O-N 2.86Å
8	L	46.8	Very low	48.5	Very low	125 Å²	125	109.3 Å²	109.3	65%	0.654	57%	0.569	S	S	*	*	H	α-helix	trans	-64.4	-39.9	174.4	-88	152.4	0	0	0	112.1	H4 G12	H4-L8 PolarHBondContact O-N 3.42Å; L8-G12 PolarHBondContact O-N 2.88Å
9	L	51.6	Low	48.7	Very low	130 Å²	130	111 Å²	111	68%	0.681	57%	0.572	S	S	*	*	H	α-helix	trans	-64.5	-40.2	173.3	-106.9	133.1	0	0	0	112.1	S5 S6 R13	S5-L9 PolarHBondContact O-N 3.28Å; S5-L9 VanDerWaalsContact O-N 3.13Å; S6-L9 PolarHBondContact O-N 2.88Å; L9-R13 VanDerWaalsContact O-CB 3.26Å; L9-R13 WeakPolarHBondContact O-CB 3.43Å; L9-R13 PolarHBondContact O-N 2.99Å
10	L	46.9	Very low	48.7	Very low	76 Å²	76	108 Å²	108	40%	0.398	56%	0.556	S	S	.	*	H	α-helix	trans	-64.6	-46.8	176.3	-76	159.1	0	0	0	111.8	S6 V7 R13 Q14 L45	S6-L10 WeakPolarHBondContact O-CB 3.37Å; S6-L10 VanDerWaalsContact O-CD1 3.29Å; S6-L10 WeakPolarHBondContact O-CD1 3.19Å; S6-L10 WeakPolarHBondContact O-CG 3.29Å; S6-L10 PolarHBondContact O-N 3.49Å; V7-L10 PolarHBondContact O-N 3.45Å; L10-R13 PolarHBondContact O-N 3.13Å; L10-Q14 WeakPolarHBondContact O-CG 3.48Å; L10-Q14 PolarHBondContact O-N 3.04Å; L10-L45 HydrophobicContact CD2-CD2 3.53Å
11	L	49.7	Very low	48.7	Very low	87 Å²	87	104.1 Å²	104.1	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-43.8	177.3	-74.6	165.7	0	0	0	111.7	V7 R13 Q14 L15	V7-L11 HydrophobicContact CG1-CD1 3.97Å; V7-L11 HydrophobicContact CG1-CG 4.44Å; V7-L11 WeakPolarHBondContact O-CB 3.42Å; V7-L11 WeakPolarHBondContact O-CG 3.45Å; V7-L11 PolarHBondContact O-N 2.86Å; L11-R13 VanDerWaalsContact C-N 3.31Å; L11-R13 PolarHBondContact O-N 2.99Å; L11-Q14 PolarHBondContact O-N 2.91Å; L11-L15 WeakPolarHBondContact O-CG 3.36Å; L11-L15 PolarHBondContact O-N 2.96Å
12	G	53.4	Low	49.1	Very low	29 Å²	29	103.3 Å²	103.3	30%	0.299	52%	0.521	S	S	.	.	H	α-helix	trans	-59.6	-43.1	175.3	0	0	0	0	0	111.7	L8 L15 I16	L8-G12 PolarHBondContact O-N 2.88Å; G12-L15 PolarHBondContact O-N 3.01Å; G12-I16 WeakPolarHBondContact O-CD1 3.25Å; G12-I16 VanDerWaalsContact O-CG1 3.22Å; G12-I16 WeakPolarHBondContact O-CG1 3.46Å; G12-I16 PolarHBondContact O-N 3.37Å
13	R	49.3	Very low	49.3	Very low	131 Å²	131	102.8 Å²	102.8	49%	0.494	51%	0.513	S	S	.	.	H	α-helix	trans	-67.3	-38.3	176.7	-161.8	171.5	175.6	-175.3	-2.7	112	L9 L10 L11 I16 V17 N36	L9-R13 VanDerWaalsContact O-CB 3.26Å; L9-R13 WeakPolarHBondContact O-CB 3.43Å; L9-R13 PolarHBondContact O-N 2.99Å; L10-R13 PolarHBondContact O-N 3.13Å; L11-R13 VanDerWaalsContact C-N 3.31Å; L11-R13 PolarHBondContact O-N 2.99Å; R13-I16 PolarHBondContact O-N 3.26Å; R13-V17 VanDerWaalsContact O-CG2 3.29Å; R13-V17 WeakPolarHBondContact O-CG2 3.46Å; R13-V17 PolarHBondContact O-N 3.02Å; R13-N36 PolarHBondContact NH2-OD1 2.89Å
14	Q	47.3	Very low	49.2	Very low	82 Å²	82	100.2 Å²	100.2	38%	0.383	50%	0.499	S	S	.	.	H	α-helix	trans	-62.2	-43.6	173	-77.9	177.7	-11.4	0	0	112.2	L10 L11 V17 F18	L10-Q14 WeakPolarHBondContact O-CG 3.48Å; L10-Q14 PolarHBondContact O-N 3.04Å; L11-Q14 PolarHBondContact O-N 2.91Å; Q14-V17 PolarHBondContact O-N 3.04Å; Q14-F18 PolarHBondContact O-N 3.44Å
15	L	51	Low	49.4	Very low	123 Å²	123	94.5 Å²	94.5	64%	0.644	48%	0.483	S	S	*	.	H	α-helix	trans	-66	-41.1	177	-74.6	173.3	0	0	0	111.9	L11 G12 V17 F18 F19	L11-L15 WeakPolarHBondContact O-CG 3.36Å; L11-L15 PolarHBondContact O-N 2.96Å; G12-L15 PolarHBondContact O-N 3.01Å; L15-V17 VanDerWaalsContact C-N 3.33Å; L15-V17 PolarHBondContact O-N 3.43Å; L15-F18 PolarHBondContact O-N 3Å; L15-F19 WeakPolarHBondContact O-CB 3.43Å; L15-F19 PolarHBondContact O-N 3.48Å
16	I	58.2	Low	49.6	Very low	103 Å²	103	95.1 Å²	95.1	53%	0.528	48%	0.484	S	S	.	.	H	α-helix	trans	-60.3	-46.6	174.6	-68.8	162.2	0	0	0	109.7	G12 R13 F18 F19 L20	G12-I16 WeakPolarHBondContact O-CD1 3.25Å; G12-I16 VanDerWaalsContact O-CG1 3.22Å; G12-I16 WeakPolarHBondContact O-CG1 3.46Å; G12-I16 PolarHBondContact O-N 3.37Å; R13-I16 PolarHBondContact O-N 3.26Å; I16-F18 VanDerWaalsContact C-N 3.35Å; I16-F18 PolarHBondContact O-N 3.19Å; I16-F19 PolarHBondContact O-N 2.92Å; I16-L20 HydrophobicContact CG2-CD1 3.87Å; I16-L20 HydrophobicContact CG2-CG 4.21Å; I16-L20 WeakPolarHBondContact O-CB 3.46Å; I16-L20 WeakPolarHBondContact O-CG 3.26Å; I16-L20 PolarHBondContact O-N 2.95Å
17	V	52	Low	49.5	Very low	24 Å²	24	97.2 Å²	97.2	15%	0.145	49%	0.493	C	S	.	.	H	α-helix	trans	-60.2	-45.7	176.1	173.7	0	0	0	0	110.5	R13 Q14 L15 F19 L20 V21 F33	R13-V17 VanDerWaalsContact O-CG2 3.29Å; R13-V17 WeakPolarHBondContact O-CG2 3.46Å; R13-V17 PolarHBondContact O-N 3.02Å; Q14-V17 PolarHBondContact O-N 3.04Å; L15-V17 VanDerWaalsContact C-N 3.33Å; L15-V17 PolarHBondContact O-N 3.43Å; V17-F19 VanDerWaalsContact C-N 3.33Å; V17-F19 PolarHBondContact O-N 3.35Å; V17-L20 PolarHBondContact O-N 3.01Å; V17-V21 HydrophobicContact CG1-CG2 4.3Å; V17-V21 WeakPolarHBondContact O-CB 3.31Å; V17-V21 WeakPolarHBondContact O-CG2 3.27Å; V17-V21 PolarHBondContact O-N 3.23Å; V17-F33 HydrophobicContact CG1-CD2 4.2Å; V17-F33 HydrophobicContact CG1-CE2 4.18Å
18	F	50.7	Low	49.3	Very low	109 Å²	109	98.1 Å²	98.1	48%	0.478	50%	0.495	S	S	.	.	H	α-helix	trans	-60.3	-39.6	175.2	-109	-83.3	0	0	0	113.3	Q14 L15 I16 V21 R22 V52 V56	Q14-F18 PolarHBondContact O-N 3.44Å; L15-F18 PolarHBondContact O-N 3Å; I16-F18 VanDerWaalsContact C-N 3.35Å; I16-F18 PolarHBondContact O-N 3.19Å; F18-V21 WeakPolarHBondContact O-CB 3.46Å; F18-V21 PolarHBondContact O-N 2.91Å; F18-R22 PolarHBondContact O-N 3.38Å; F18-V52 HydrophobicContact CE2-CG1 4.31Å; F18-V56 HydrophobicContact CZ-CG2 4.41Å
19	F	52.7	Low	49.2	Very low	142 Å²	142	92.3 Å²	92.3	62%	0.623	46%	0.464	S	S	*	.	H	α-helix	trans	-70.2	-43.8	180	-157.7	-93.5	0	0	0	110.7	L15 I16 V17 V21 R22 L23	L15-F19 WeakPolarHBondContact O-CB 3.43Å; L15-F19 PolarHBondContact O-N 3.48Å; I16-F19 PolarHBondContact O-N 2.92Å; V17-F19 VanDerWaalsContact C-N 3.33Å; V17-F19 PolarHBondContact O-N 3.35Å; F19-V21 PolarHBondContact O-N 2.9Å; F19-R22 PolarHBondContact O-N 3.24Å; F19-R22 VanDerWaalsContact O-N 3.16Å; F19-L23 HydrophobicContact CD1-CD1 4.44Å; F19-L23 HydrophobicContact CE1-CD1 3.93Å; F19-L23 WeakPolarHBondContact O-CB 3.22Å; F19-L23 PolarHBondContact O-N 3.44Å
20	L	48.3	Very low	48.8	Very low	50 Å²	50	86.5 Å²	86.5	26%	0.262	44%	0.435	S	S	.	.	H	α-helix	trans	-58.1	-40.8	169.8	-66.1	173.2	0	0	0	110.2	I16 V17 R22 L23 Y24 L29	I16-L20 HydrophobicContact CG2-CD1 3.87Å; I16-L20 HydrophobicContact CG2-CG 4.21Å; I16-L20 WeakPolarHBondContact O-CB 3.46Å; I16-L20 WeakPolarHBondContact O-CG 3.26Å; I16-L20 PolarHBondContact O-N 2.95Å; V17-L20 PolarHBondContact O-N 3.01Å; L20-R22 VanDerWaalsContact C-N 3.26Å; L20-R22 PolarHBondContact O-N 2.91Å; L20-L23 PolarHBondContact O-N 2.74Å; L20-L23 VanDerWaalsContact O-N 3.1Å; L20-Y24 HydrophobicContact CB-CD2 4.21Å; L20-Y24 HydrophobicContact CD2-CD2 3.77Å; L20-Y24 HydrophobicContact CD2-CE2 3.4Å; L20-Y24 PolarHBondContact O-N 3Å; L20-L29 HydrophobicContact CB-CD2 3.69Å; L20-L29 WeakPolarHBondContact O-CD2 3.47Å
21	V	48.6	Very low	48.6	Very low	27 Å²	27	90 Å²	90	16%	0.164	45%	0.449	C	S	.	.	H	α-helix	trans	-57.7	-42.5	177.4	168.4	0	0	0	0	111.3	V17 F18 F19 L29 V56	V17-V21 HydrophobicContact CG1-CG2 4.3Å; V17-V21 WeakPolarHBondContact O-CB 3.31Å; V17-V21 WeakPolarHBondContact O-CG2 3.27Å; V17-V21 PolarHBondContact O-N 3.23Å; F18-V21 WeakPolarHBondContact O-CB 3.46Å; F18-V21 PolarHBondContact O-N 2.91Å; F19-V21 PolarHBondContact O-N 2.9Å; V21-L29 VanDerWaalsContact CA-CD1 3.44Å; V21-L29 HydrophobicContact CB-CD1 4.02Å; V21-L29 HydrophobicContact CB-CD2 4.35Å; V21-L29 HydrophobicContact CG1-CD1 4.26Å; V21-L29 HydrophobicContact CG2-CD1 3.88Å; V21-L29 HydrophobicContact CG2-CD2 3.91Å; V21-L29 HydrophobicContact CG2-CG 4.37Å; V21-V56 HydrophobicContact CG1-CG1 3.99Å
22	R	47.3	Very low	48.4	Very low	227 Å²	227	89.1 Å²	89.1	86%	0.857	44%	0.444	S	S	*	.	H	α-helix	trans	-73.9	-30.6	177.9	-159.4	169.9	-174.2	172	0.6	112.8	F18 F19 L20	F18-R22 PolarHBondContact O-N 3.38Å; F19-R22 PolarHBondContact O-N 3.24Å; F19-R22 VanDerWaalsContact O-N 3.16Å; L20-R22 VanDerWaalsContact C-N 3.26Å; L20-R22 PolarHBondContact O-N 2.91Å
23	L	49.7	Very low	48.1	Very low	111 Å²	111	89 Å²	89	58%	0.581	44%	0.435	S	S	*	.	H	α-helix	trans	-85.2	-40.3	-174.2	-147.1	89.8	0	0	0	113.6	F19 L20	F19-L23 HydrophobicContact CD1-CD1 4.44Å; F19-L23 HydrophobicContact CE1-CD1 3.93Å; F19-L23 WeakPolarHBondContact O-CB 3.22Å; F19-L23 PolarHBondContact O-N 3.44Å; L20-L23 PolarHBondContact O-N 2.74Å; L20-L23 VanDerWaalsContact O-N 3.1Å
24	Y	47	Very low	48	Very low	133 Å²	133	85.2 Å²	85.2	52%	0.522	42%	0.424	S	S	.	.	H	α-helix	trans	-99.8	0.1	-169	-73.7	-83	0	0	0	114.9	L20	L20-Y24 HydrophobicContact CB-CD2 4.21Å; L20-Y24 HydrophobicContact CD2-CD2 3.77Å; L20-Y24 HydrophobicContact CD2-CE2 3.4Å; L20-Y24 PolarHBondContact O-N 3Å
25	G	47.7	Very low	47.7	Very low	37 Å²	37	84.9 Å²	84.9	38%	0.381	43%	0.431	S	S	.	.	H	α-helix	trans	69.3	160.3	-176.4	0	0	0	0	0	112.7	V27 L29	G25-V27 PolarHBondContact O-N 3.31Å; G25-V27 VanDerWaalsContact O-N 3.08Å; G25-L29 WeakPolarHBondContact O-CD1 3.34Å
26	T	48.8	Very low	47.2	Very low	94 Å²	94	82 Å²	82	58%	0.577	42%	0.416	S	S	*	.	H	α-helix	trans	-58.3	-26.8	-169.8	47.5	0	0	0	0	114.8
27	V	45.6	Very low	46.4	Very low	119 Å²	119	78.2 Å²	78.2	72%	0.721	40%	0.398	S	S	*	.	H	α-helix	trans	-79.6	-40.2	-166.5	-171.4	0	0	0	0	112.9	G25 L29	G25-V27 PolarHBondContact O-N 3.31Å; G25-V27 VanDerWaalsContact O-N 3.08Å; V27-L29 VanDerWaalsContact C-N 3.26Å; V27-L29 PolarHBondContact O-N 3.31Å
28	N	42.5	Very low	45.9	Very low	101 Å²	101	84.8 Å²	84.8	54%	0.54	43%	0.428	S	S	.	.	H	α-helix	trans	-78.8	-12.3	176.9	-86.9	-34.7	0	0	0	113.1
29	L	44.2	Very low	45.4	Very low	4 Å²	4	85.9 Å²	85.9	2%	0.021	44%	0.438	C	S	.	.	H	α-helix	trans	-52.5	-48.4	172.2	43.6	59.6	0	0	0	115.5	L20 V21 G25 V27 Q31 I32 F33 Y57	L20-L29 HydrophobicContact CB-CD2 3.69Å; L20-L29 WeakPolarHBondContact O-CD2 3.47Å; V21-L29 VanDerWaalsContact CA-CD1 3.44Å; V21-L29 HydrophobicContact CB-CD1 4.02Å; V21-L29 HydrophobicContact CB-CD2 4.35Å; V21-L29 HydrophobicContact CG1-CD1 4.26Å; V21-L29 HydrophobicContact CG2-CD1 3.88Å; V21-L29 HydrophobicContact CG2-CD2 3.91Å; V21-L29 HydrophobicContact CG2-CG 4.37Å; G25-L29 WeakPolarHBondContact O-CD1 3.34Å; V27-L29 VanDerWaalsContact C-N 3.26Å; V27-L29 PolarHBondContact O-N 3.31Å; L29-Q31 VanDerWaalsContact C-N 3.28Å; L29-Q31 PolarHBondContact O-N 3.25Å; L29-I32 HydrophobicContact CB-CB 4.31Å; L29-I32 HydrophobicContact CB-CD1 4.3Å; L29-I32 HydrophobicContact CD2-CD1 4.18Å; L29-I32 PolarHBondContact O-N 3.09Å; L29-F33 PolarHBondContact O-N 2.98Å; L29-F33 VanDerWaalsContact O-N 3.09Å; L29-Y57 WeakPolarHBondContact CA-OH 3.23Å
30	C	44.1	Very low	44.7	Very low	8 Å²	8	82.6 Å²	82.6	5%	0.054	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-36.9	-168.2	-81.8	0	0	0	0	112.9	I34 C86 C89	C30-I34 WeakPolarHBondContact O-CD1 3.3Å; C30-I34 VanDerWaalsContact O-CG1 3.3Å; C30-I34 WeakPolarHBondContact O-CG1 3.38Å; C30-I34 PolarHBondContact O-N 3.27Å; C30-C86 WeakPolarHBondContact CB-SG 3.41Å; C30-C86 WeakPolarHBondContact SG-CB 3.45Å; C30-C86 CovalentContact SG-SG 2.03Å; C30-C86 PolarHBondContact SG-SG 3.45Å; C30-C89 HydrophobicContact CB-CB 3.47Å; C30-C89 VanDerWaalsContact CB-CB 3.47Å; C30-C89 WeakPolarHBondContact SG-CB 3.42Å; C30-C89 PolarHBondContact SG-SG 3.24Å
31	Q	43.1	Very low	44.4	Very low	150 Å²	150	92.5 Å²	92.5	70%	0.701	46%	0.458	S	S	*	.	H	α-helix	trans	-70.6	-46.1	177.8	-67.3	-104.6	-58.8	0	0	111.8	L29 F33 I34 S35	L29-Q31 VanDerWaalsContact C-N 3.28Å; L29-Q31 PolarHBondContact O-N 3.25Å; Q31-F33 VanDerWaalsContact C-N 3.3Å; Q31-F33 PolarHBondContact O-N 2.95Å; Q31-I34 PolarHBondContact O-N 2.86Å; Q31-S35 PolarHBondContact O-N 3.34Å; Q31-S35 VanDerWaalsContact O-N 3.13Å; Q31-S35 PolarHBondContact O-OG 3.32Å
32	I	45	Very low	44.2	Very low	67 Å²	67	95.9 Å²	95.9	34%	0.344	48%	0.475	S	S	.	.	H	α-helix	trans	-65.6	-35.3	-176.4	-62.4	169	0	0	0	111.5	L29 N36	L29-I32 HydrophobicContact CB-CB 4.31Å; L29-I32 HydrophobicContact CB-CD1 4.3Å; L29-I32 HydrophobicContact CD2-CD1 4.18Å; L29-I32 PolarHBondContact O-N 3.09Å; I32-N36 PolarHBondContact O-N 3.38Å; I32-N36 PolarHBondContact O-ND2 3.35Å
33	F	47.5	Very low	44.4	Very low	28 Å²	28	89.7 Å²	89.7	12%	0.123	46%	0.459	C	S	.	.	H	α-helix	trans	-72.6	-40	-179.3	-149.3	-94.2	0	0	0	112.4	V17 L29 Q31 N36 C37 A49 V52 A53 I91	V17-F33 HydrophobicContact CG1-CD2 4.2Å; V17-F33 HydrophobicContact CG1-CE2 4.18Å; L29-F33 PolarHBondContact O-N 2.98Å; L29-F33 VanDerWaalsContact O-N 3.09Å; Q31-F33 VanDerWaalsContact C-N 3.3Å; Q31-F33 PolarHBondContact O-N 2.95Å; F33-N36 PolarHBondContact O-N 2.99Å; F33-C37 PolarHBondContact O-N 3.48Å; F33-C37 VanDerWaalsContact O-N 3.17Å; F33-C37 PolarHBondContact O-SG 3.05Å; F33-A49 HydrophobicContact CE1-CB 3.6Å; F33-A49 WeakPolarHBondContact CE1-O 3.32Å; F33-A49 VanDerWaalsContact CZ-CA 3.48Å; F33-A49 HydrophobicContact CZ-CB 3.74Å; F33-A49 WeakPolarHBondContact CZ-O 3.29Å; F33-V52 HydrophobicContact CE2-CB 4.27Å; F33-V52 HydrophobicContact CE2-CG1 3.85Å; F33-V52 HydrophobicContact CZ-CB 3.99Å; F33-V52 HydrophobicContact CZ-CG1 4.07Å; F33-A53 HydrophobicContact CD1-CB 4.2Å; F33-A53 HydrophobicContact CE1-CB 3.72Å; F33-A53 HydrophobicContact CZ-CB 4.21Å; F33-I91 HydrophobicContact CD1-CD1 4.14Å; F33-I91 HydrophobicContact CE1-CD1 4.26Å
34	I	47	Very low	44.1	Very low	50 Å²	50	92.3 Å²	92.3	26%	0.256	47%	0.468	S	S	.	.	H	α-helix	trans	-65.4	-46.7	177.1	-69.1	169.8	0	0	0	110.7	C30 Q31 N36 C37 E38 C89	C30-I34 WeakPolarHBondContact O-CD1 3.3Å; C30-I34 VanDerWaalsContact O-CG1 3.3Å; C30-I34 WeakPolarHBondContact O-CG1 3.38Å; C30-I34 PolarHBondContact O-N 3.27Å; Q31-I34 PolarHBondContact O-N 2.86Å; I34-N36 PolarHBondContact O-N 2.81Å; I34-N36 VanDerWaalsContact O-N 3.12Å; I34-C37 PolarHBondContact O-N 3.48Å; I34-E38 PolarHBondContact O-N 3.05Å; I34-C89 HydrophobicContact CD1-CB 3.8Å
35	S	40.1	Very low	44.1	Very low	75 Å²	75	88.7 Å²	88.7	52%	0.524	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-26.1	179.3	-68.3	0	0	0	0	113.5	Q31	Q31-S35 PolarHBondContact O-N 3.34Å; Q31-S35 VanDerWaalsContact O-N 3.13Å; Q31-S35 PolarHBondContact O-OG 3.32Å
36	N	41.2	Very low	44.3	Very low	64 Å²	64	88.9 Å²	88.9	34%	0.342	45%	0.45	S	S	.	.	H	α-helix	trans	-85.2	-24	173.6	-81	-54.7	0	0	0	113.8	R13 I32 F33 I34	R13-N36 PolarHBondContact NH2-OD1 2.89Å; I32-N36 PolarHBondContact O-N 3.38Å; I32-N36 PolarHBondContact O-ND2 3.35Å; F33-N36 PolarHBondContact O-N 2.99Å; I34-N36 PolarHBondContact O-N 2.81Å; I34-N36 VanDerWaalsContact O-N 3.12Å
37	C	41.9	Very low	44.5	Very low	22 Å²	22	92.3 Å²	92.3	15%	0.149	45%	0.452	C	S	.	.	H	α-helix	trans	-81.5	-25.6	177.5	-68.1	0	0	0	0	112.9	F33 I34 L39 A49	F33-C37 PolarHBondContact O-N 3.48Å; F33-C37 VanDerWaalsContact O-N 3.17Å; F33-C37 PolarHBondContact O-SG 3.05Å; I34-C37 PolarHBondContact O-N 3.48Å; C37-L39 PolarHBondContact O-N 3.4Å; C37-A49 VanDerWaalsContact SG-CB 3.52Å
38	E	41.4	Very low	44.8	Very low	163 Å²	163	88.3 Å²	88.3	76%	0.762	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.7	177.9	-149	176.2	150.5	0	0	112.7	I34	I34-E38 PolarHBondContact O-N 3.05Å
39	L	39.2	Very low	45.4	Very low	132 Å²	132	84.3 Å²	84.3	69%	0.691	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	0.9	-161.4	-118	120.1	0	0	0	117.9	C37	C37-L39 PolarHBondContact O-N 3.4Å
40	H	38.3	Very low	46.1	Very low	72 Å²	72	85.2 Å²	85.2	33%	0.333	42%	0.418	S	S	.	.			trans	-126.4	114.5	180	-77.2	-52	0	0	0	114.6	D42 L45 N46	H40-D42 PolarHBondContact O-N 3.26Å; H40-L45 HydrophobicContact CB-CB 4.09Å; H40-L45 HydrophobicContact CB-CD1 3.9Å; H40-L45 VanDerWaalsContact CD2-CD1 3.43Å; H40-L45 WeakPolarHBondContact CD2-CD1 3.14Å; H40-N46 PolarHBondContact O-ND2 3.35Å
41	R	42.9	Very low	46.8	Very low	258 Å²	258	87.1 Å²	87.1	97%	0.974	43%	0.434	S	S	*	.			trans	-62.8	-6.1	163.5	-77.4	-177.4	175.3	-174.3	0.4	113.2	D43	R41-D43 PolarHBondContact O-N 2.97Å
42	D	44.4	Very low	47.7	Very low	99 Å²	99	81.2 Å²	81.2	53%	0.529	41%	0.408	S	S	.	.			trans	-81.9	110.5	178.2	-78.2	-55	0	0	0	111.4	H40 Q44 L45 N46	H40-D42 PolarHBondContact O-N 3.26Å; D42-Q44 PolarHBondContact O-N 2.85Å; D42-L45 HydrophobicContact CB-CB 4.39Å; D42-L45 HydrophobicContact CB-CD1 4.17Å; D42-L45 HydrophobicContact CB-CG 4.47Å; D42-L45 PolarHBondContact O-N 2.92Å; D42-N46 PolarHBondContact O-N 2.8Å
43	D	51.2	Low	48.3	Very low	96 Å²	96	78 Å²	78	51%	0.513	39%	0.392	S	S	.	.	H	α-helix	trans	-51.3	-31.5	177.7	-168.6	39.5	0	0	0	112.3	R41 R47	R41-D43 PolarHBondContact O-N 2.97Å; D43-R47 WeakPolarHBondContact O-CB 3.36Å; D43-R47 VanDerWaalsContact O-CG 3.25Å; D43-R47 WeakPolarHBondContact O-CG 3Å; D43-R47 PolarHBondContact O-N 2.97Å; D43-R47 IonicContact OD1-NE 3.67Å; D43-R47 IonicContact OD2-CZ 3.35Å; D43-R47 IonicContact OD2-NE 3.01Å; D43-R47 PolarHBondContact OD2-NE 2.88Å; D43-R47 IonicContact OD2-NH2 2.88Å; D43-R47 PolarHBondContact OD2-NH2 2.77Å
44	Q	42.9	Very low	48.8	Very low	166 Å²	166	79.3 Å²	79.3	78%	0.776	40%	0.4	S	S	*	.	H	α-helix	trans	-68.9	-41.1	178.9	-65.7	-169.8	-2.5	0	0	113.3	D42 R47 A48	D42-Q44 PolarHBondContact O-N 2.85Å; Q44-R47 PolarHBondContact O-N 3.43Å; Q44-A48 WeakPolarHBondContact O-CB 3.41Å; Q44-A48 PolarHBondContact O-N 3.38Å
45	L	47.3	Very low	49.4	Very low	57 Å²	57	83.5 Å²	83.5	30%	0.298	42%	0.423	S	S	.	.	H	α-helix	trans	-69.9	-41.2	179.3	-80.1	167.8	0	0	0	110.7	L10 H40 D42 R47 A48 A49	L10-L45 HydrophobicContact CD2-CD2 3.53Å; H40-L45 HydrophobicContact CB-CB 4.09Å; H40-L45 HydrophobicContact CB-CD1 3.9Å; H40-L45 VanDerWaalsContact CD2-CD1 3.43Å; H40-L45 WeakPolarHBondContact CD2-CD1 3.14Å; D42-L45 HydrophobicContact CB-CB 4.39Å; D42-L45 HydrophobicContact CB-CD1 4.17Å; D42-L45 HydrophobicContact CB-CG 4.47Å; D42-L45 PolarHBondContact O-N 2.92Å; L45-R47 PolarHBondContact O-N 3.24Å; L45-A48 PolarHBondContact O-N 2.75Å; L45-A49 WeakPolarHBondContact O-CB 3.08Å; L45-A49 PolarHBondContact O-N 3.47Å
46	N	52.1	Low	50.1	Low	42 Å²	42	81.6 Å²	81.6	23%	0.225	41%	0.408	C	S	.	.	H	α-helix	trans	-62.1	-42.3	174.3	-75.2	-20.5	0	0	0	111.8	H40 D42 A49 I50	H40-N46 PolarHBondContact O-ND2 3.35Å; D42-N46 PolarHBondContact O-N 2.8Å; N46-A49 PolarHBondContact O-N 3.49Å; N46-I50 WeakPolarHBondContact O-CB 3.33Å; N46-I50 WeakPolarHBondContact O-CD1 3.31Å; N46-I50 WeakPolarHBondContact O-CG1 3.49Å; N46-I50 PolarHBondContact O-N 2.75Å
47	R	52.5	Low	50.8	Low	165 Å²	165	78.9 Å²	78.9	62%	0.623	39%	0.393	S	S	*	.	H	α-helix	trans	-63.8	-45.1	175.9	-77	178.1	-167.9	-142.4	8.3	112.9	D43 Q44 L45 A49 I50 A51	D43-R47 WeakPolarHBondContact O-CB 3.36Å; D43-R47 VanDerWaalsContact O-CG 3.25Å; D43-R47 WeakPolarHBondContact O-CG 3Å; D43-R47 PolarHBondContact O-N 2.97Å; D43-R47 IonicContact OD1-NE 3.67Å; D43-R47 IonicContact OD2-CZ 3.35Å; D43-R47 IonicContact OD2-NE 3.01Å; D43-R47 PolarHBondContact OD2-NE 2.88Å; D43-R47 IonicContact OD2-NH2 2.88Å; D43-R47 PolarHBondContact OD2-NH2 2.77Å; Q44-R47 PolarHBondContact O-N 3.43Å; L45-R47 PolarHBondContact O-N 3.24Å; R47-A49 VanDerWaalsContact C-N 3.3Å; R47-A49 PolarHBondContact O-N 2.77Å; R47-I50 PolarHBondContact O-N 3.21Å; R47-A51 WeakPolarHBondContact O-CB 3.38Å; R47-A51 PolarHBondContact O-N 2.83Å
48	A	52	Low	51.4	Low	35 Å²	35	79.3 Å²	79.3	29%	0.289	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-42.5	177.8	0	0	0	0	0	110.9	Q44 L45 A51 V52	Q44-A48 WeakPolarHBondContact O-CB 3.41Å; Q44-A48 PolarHBondContact O-N 3.38Å; L45-A48 PolarHBondContact O-N 2.75Å; A48-A51 PolarHBondContact O-N 3.23Å; A48-V52 WeakPolarHBondContact O-CG2 3.48Å; A48-V52 PolarHBondContact O-N 3.25Å
49	A	55.5	Low	51.7	Low	17 Å²	17	72.5 Å²	72.5	14%	0.14	37%	0.374	C	S	.	.	H	α-helix	trans	-62.5	-48.3	176.6	0	0	0	0	0	111.2	F33 C37 L45 N46 R47 A51 V52 A53	F33-A49 HydrophobicContact CE1-CB 3.6Å; F33-A49 WeakPolarHBondContact CE1-O 3.32Å; F33-A49 VanDerWaalsContact CZ-CA 3.48Å; F33-A49 HydrophobicContact CZ-CB 3.74Å; F33-A49 WeakPolarHBondContact CZ-O 3.29Å; C37-A49 VanDerWaalsContact SG-CB 3.52Å; L45-A49 WeakPolarHBondContact O-CB 3.08Å; L45-A49 PolarHBondContact O-N 3.47Å; N46-A49 PolarHBondContact O-N 3.49Å; R47-A49 VanDerWaalsContact C-N 3.3Å; R47-A49 PolarHBondContact O-N 2.77Å; A49-A51 VanDerWaalsContact C-N 3.31Å; A49-A51 PolarHBondContact O-N 2.88Å; A49-V52 PolarHBondContact O-N 3.17Å; A49-A53 WeakPolarHBondContact O-CB 3.43Å; A49-A53 PolarHBondContact O-N 3.29Å
50	I	58.2	Low	52.1	Low	24 Å²	24	71.4 Å²	71.4	12%	0.123	37%	0.369	C	S	.	.	H	α-helix	trans	-59	-41.7	175.9	-68.4	162.4	0	0	0	111.4	N46 R47 A53 N54 T93	N46-I50 WeakPolarHBondContact O-CB 3.33Å; N46-I50 WeakPolarHBondContact O-CD1 3.31Å; N46-I50 WeakPolarHBondContact O-CG1 3.49Å; N46-I50 PolarHBondContact O-N 2.75Å; R47-I50 PolarHBondContact O-N 3.21Å; I50-A53 PolarHBondContact O-N 3.15Å; I50-N54 VanDerWaalsContact O-CB 3.3Å; I50-N54 WeakPolarHBondContact O-CB 3.33Å; I50-N54 VanDerWaalsContact O-CG 3.22Å; I50-N54 PolarHBondContact O-N 2.79Å; I50-T93 HydrophobicContact CD1-CG2 4.12Å
51	A	59.5	Low	52.5	Low	47 Å²	47	71.3 Å²	71.3	39%	0.388	37%	0.374	S	S	.	.	H	α-helix	trans	-64.7	-42.6	179.1	0	0	0	0	0	112.1	R47 A48 A49 N54 N55	R47-A51 WeakPolarHBondContact O-CB 3.38Å; R47-A51 PolarHBondContact O-N 2.83Å; A48-A51 PolarHBondContact O-N 3.23Å; A49-A51 VanDerWaalsContact C-N 3.31Å; A49-A51 PolarHBondContact O-N 2.88Å; A51-N54 PolarHBondContact O-N 3.42Å; A51-N55 WeakPolarHBondContact O-CB 3.45Å; A51-N55 PolarHBondContact O-N 2.79Å; A51-N55 PolarHBondContact O-ND2 2.85Å
52	V	60.9	Low	52.7	Low	27 Å²	27	62.5 Å²	62.5	16%	0.164	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-46.4	174.6	171.9	0	0	0	0	110.3	F18 F33 A48 A49 N54 N55 V56	F18-V52 HydrophobicContact CE2-CG1 4.31Å; F33-V52 HydrophobicContact CE2-CB 4.27Å; F33-V52 HydrophobicContact CE2-CG1 3.85Å; F33-V52 HydrophobicContact CZ-CB 3.99Å; F33-V52 HydrophobicContact CZ-CG1 4.07Å; A48-V52 WeakPolarHBondContact O-CG2 3.48Å; A48-V52 PolarHBondContact O-N 3.25Å; A49-V52 PolarHBondContact O-N 3.17Å; V52-N54 VanDerWaalsContact C-N 3.33Å; V52-N54 PolarHBondContact O-N 3.07Å; V52-N55 PolarHBondContact O-N 3.12Å; V52-V56 HydrophobicContact CG1-CG2 4.05Å; V52-V56 WeakPolarHBondContact O-CB 3.33Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.2Å; V52-V56 PolarHBondContact O-N 3.46Å
53	A	58.7	Low	52.9	Low	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.8	-39.1	178.1	0	0	0	0	0	112.3	F33 A49 I50 Y57 Y83 I91	F33-A53 HydrophobicContact CD1-CB 4.2Å; F33-A53 HydrophobicContact CE1-CB 3.72Å; F33-A53 HydrophobicContact CZ-CB 4.21Å; A49-A53 WeakPolarHBondContact O-CB 3.43Å; A49-A53 PolarHBondContact O-N 3.29Å; I50-A53 PolarHBondContact O-N 3.15Å; A53-Y57 HydrophobicContact CB-CD2 4.04Å; A53-Y57 HydrophobicContact CB-CE2 4.44Å; A53-Y57 WeakPolarHBondContact O-CA 3.35Å; A53-Y57 VanDerWaalsContact O-CB 3.32Å; A53-Y57 WeakPolarHBondContact O-CB 3.19Å; A53-Y57 WeakPolarHBondContact O-CD2 3.32Å; A53-Y57 PolarHBondContact O-N 3.39Å; A53-Y83 HydrophobicContact CB-CD1 4.33Å; A53-Y83 HydrophobicContact CB-CE1 3.48Å; A53-Y83 VanDerWaalsContact CB-CE1 3.48Å; A53-Y83 HydrophobicContact CB-CE2 4.21Å; A53-Y83 VanDerWaalsContact CB-CZ 3.42Å; A53-Y83 WeakPolarHBondContact CB-OH 3.05Å; A53-I91 HydrophobicContact CB-CD1 4.43Å
54	N	58.1	Low	52.8	Low	55 Å²	55	61.5 Å²	61.5	29%	0.294	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-45.1	173.9	-78.5	-13.3	0	0	0	111.9	I50 A51 V52 G58 Y83	I50-N54 VanDerWaalsContact O-CB 3.3Å; I50-N54 WeakPolarHBondContact O-CB 3.33Å; I50-N54 VanDerWaalsContact O-CG 3.22Å; I50-N54 PolarHBondContact O-N 2.79Å; A51-N54 PolarHBondContact O-N 3.42Å; V52-N54 VanDerWaalsContact C-N 3.33Å; V52-N54 PolarHBondContact O-N 3.07Å; N54-G58 WeakPolarHBondContact O-CA 3.43Å; N54-G58 PolarHBondContact O-N 2.96Å; N54-Y83 WeakPolarHBondContact OD1-CE1 3.37Å
55	N	58.2	Low	53	Low	138 Å²	138	56.2 Å²	56.2	74%	0.738	33%	0.331	S	S	*	.	H	α-helix	trans	-67.1	-41	178.4	-82	-38.9	0	0	0	112.5	A51 V52	A51-N55 WeakPolarHBondContact O-CB 3.45Å; A51-N55 PolarHBondContact O-N 2.79Å; A51-N55 PolarHBondContact O-ND2 2.85Å; V52-N55 PolarHBondContact O-N 3.12Å
56	V	56.4	Low	53.2	Low	35 Å²	35	60.7 Å²	60.7	21%	0.212	35%	0.349	C	S	.	.	H	α-helix	trans	-77.6	-47.9	-176.7	174.8	0	0	0	0	111.1	F18 V21 V52	F18-V56 HydrophobicContact CZ-CG2 4.41Å; V21-V56 HydrophobicContact CG1-CG1 3.99Å; V52-V56 HydrophobicContact CG1-CG2 4.05Å; V52-V56 WeakPolarHBondContact O-CB 3.33Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.2Å; V52-V56 PolarHBondContact O-N 3.46Å
57	Y	54.8	Low	53.1	Low	7 Å²	7	65 Å²	65	3%	0.027	37%	0.368	C	S	.	.	H	α-helix	trans	-101.7	2.1	-173.2	-53	-70.9	0	0	0	114.2	L29 A53 G59 K85 C86	L29-Y57 WeakPolarHBondContact CA-OH 3.23Å; A53-Y57 HydrophobicContact CB-CD2 4.04Å; A53-Y57 HydrophobicContact CB-CE2 4.44Å; A53-Y57 WeakPolarHBondContact O-CA 3.35Å; A53-Y57 VanDerWaalsContact O-CB 3.32Å; A53-Y57 WeakPolarHBondContact O-CB 3.19Å; A53-Y57 WeakPolarHBondContact O-CD2 3.32Å; A53-Y57 PolarHBondContact O-N 3.39Å; Y57-G59 PolarHBondContact O-N 3.25Å; Y57-K85 WeakPolarHBondContact O-CB 3.39Å; Y57-K85 VanDerWaalsContact O-CD 3.27Å; Y57-K85 WeakPolarHBondContact O-CD 3.07Å; Y57-K85 WeakPolarHBondContact O-CG 3.02Å; Y57-K85 PolarHBondContact O-N 3.13Å; Y57-C86 HydrophobicContact CD1-CB 4.18Å
58	G	54.2	Low	53.1	Low	31 Å²	31	59.4 Å²	59.4	32%	0.32	35%	0.351	S	S	.	.			trans	55.6	54.2	176.7	0	0	0	0	0	112.8	N54 D60	N54-G58 WeakPolarHBondContact O-CA 3.43Å; N54-G58 PolarHBondContact O-N 2.96Å; G58-D60 PolarHBondContact O-N 3.16Å; G58-D60 VanDerWaalsContact O-N 3.15Å
59	G	48.3	Very low	52.9	Low	19 Å²	19	63.5 Å²	63.5	20%	0.196	37%	0.369	C	S	.	.			trans	-69.2	106.7	-167.4	0	0	0	0	0	114.1	Y57 T61	Y57-G59 PolarHBondContact O-N 3.25Å; G59-T61 PolarHBondContact O-N 2.9Å
60	D	48.1	Very low	52.6	Low	109 Å²	109	67 Å²	67	58%	0.583	38%	0.38	S	S	*	.			trans	-68.8	110.3	152.5	-59.3	-58.2	0	0	0	107.2	G58 V62 T84	G58-D60 PolarHBondContact O-N 3.16Å; G58-D60 VanDerWaalsContact O-N 3.15Å; D60-V62 PolarHBondContact O-N 3.38Å; D60-T84 WeakPolarHBondContact CB-OG1 3.27Å; D60-T84 PolarHBondContact N-OG1 3.45Å; D60-T84 WeakPolarHBondContact OD2-CB 3.35Å; D60-T84 WeakPolarHBondContact OD2-CG2 3.37Å; D60-T84 PolarHBondContact OD2-OG1 3.26Å
61	T	46.9	Very low	52	Low	71 Å²	71	72.8 Å²	72.8	44%	0.436	42%	0.417	S	S	.	.			trans	-75	96.5	-178	-59.9	0	0	0	0	109.4	G59 S63 K81	G59-T61 PolarHBondContact O-N 2.9Å; T61-S63 PolarHBondContact O-N 3.4Å; T61-K81 HydrophobicContact CG2-CB 4.47Å; T61-K81 HydrophobicContact CG2-CD 3.84Å; T61-K81 HydrophobicContact CG2-CG 3.86Å
62	V	46	Very low	51.7	Low	72 Å²	72	76.8 Å²	76.8	44%	0.436	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	103.5	161.3	-170.8	0	0	0	0	106.8	D60 F64	D60-V62 PolarHBondContact O-N 3.38Å; V62-F64 HydrophobicContact CB-CE2 4.19Å; V62-F64 HydrophobicContact CG1-CD2 4.13Å; V62-F64 HydrophobicContact CG1-CE1 4.16Å; V62-F64 HydrophobicContact CG1-CE2 3.46Å; V62-F64 VanDerWaalsContact CG1-CE2 3.46Å; V62-F64 HydrophobicContact CG1-CZ 3.48Å; V62-F64 VanDerWaalsContact CG1-CZ 3.48Å
63	S	49.2	Very low	51.4	Low	55 Å²	55	86.6 Å²	86.6	39%	0.385	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	105.9	176.6	170	0	0	0	0	110	T61 G65 T80	T61-S63 PolarHBondContact O-N 3.4Å; S63-G65 PolarHBondContact O-N 3.2Å; S63-T80 WeakPolarHBondContact CA-O 3.45Å
64	F	49.3	Very low	51.3	Low	120 Å²	120	90.8 Å²	90.8	53%	0.526	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	104.1	167	-60.9	-82.2	0	0	0	108.9	V62 K66 Q79 T80 M82	V62-F64 HydrophobicContact CB-CE2 4.19Å; V62-F64 HydrophobicContact CG1-CD2 4.13Å; V62-F64 HydrophobicContact CG1-CE1 4.16Å; V62-F64 HydrophobicContact CG1-CE2 3.46Å; V62-F64 VanDerWaalsContact CG1-CE2 3.46Å; V62-F64 HydrophobicContact CG1-CZ 3.48Å; V62-F64 VanDerWaalsContact CG1-CZ 3.48Å; F64-K66 PolarHBondContact O-N 3.01Å; F64-Q79 WeakPolarHBondContact O-CA 3.09Å; F64-T80 PolarHBondContact N-O 2.67Å; F64-T80 VanDerWaalsContact N-O 3.17Å; F64-T80 PolarHBondContact O-N 2.76Å; F64-M82 HydrophobicContact CE2-SD 4.1Å
65	G	47.7	Very low	51.4	Low	54 Å²	54	90.7 Å²	90.7	56%	0.557	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	93.8	176.5	0	0	0	0	0	111.5	S63 K78	S63-G65 PolarHBondContact O-N 3.2Å; G65-K78 CarbonylContact C-O 3.47Å; G65-K78 VanDerWaalsContact CA-O 3.31Å; G65-K78 WeakPolarHBondContact CA-O 3.43Å
66	K	50.6	Low	51.2	Low	152 Å²	152	87.9 Å²	87.9	66%	0.661	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	123.7	167.7	-171.8	171.9	-178.9	177.5	0	108.9	F64 V68 K78	F64-K66 PolarHBondContact O-N 3.01Å; K66-V68 PolarHBondContact O-N 2.8Å; K66-K78 PolarHBondContact N-O 3.25Å; K66-K78 WeakPolarHBondContact O-CA 3.1Å; K66-K78 WeakPolarHBondContact O-CB 3.36Å; K66-K78 PolarHBondContact O-N 3.39Å
67	Q	49.8	Very low	51.4	Low	133 Å²	133	87.5 Å²	87.5	62%	0.621	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	128.4	171	-69.6	-172.9	5.8	0	0	109.5	T75 W76	Q67-T75 HydrophobicContact CB-CG2 4.13Å; Q67-T75 HydrophobicContact CG-CG2 4.2Å; Q67-W76 CarbonylContact C-O 3.43Å; Q67-W76 WeakPolarHBondContact CA-O 3.19Å
68	V	52.9	Low	51.7	Low	46 Å²	46	89.4 Å²	89.4	28%	0.279	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.6	175	-171.4	0	0	0	0	106.9	K66 F70 W76 K78 F94	K66-V68 PolarHBondContact O-N 2.8Å; V68-F70 HydrophobicContact CB-CE2 4.16Å; V68-F70 HydrophobicContact CG1-CD2 4.3Å; V68-F70 HydrophobicContact CG1-CE2 4.05Å; V68-F70 HydrophobicContact CG1-CZ 4.49Å; V68-F70 PolarHBondContact O-N 2.82Å; V68-W76 PolarHBondContact N-O 3.27Å; V68-W76 PolarHBondContact O-N 3.17Å; V68-K78 HydrophobicContact CG2-CB 3.54Å; V68-K78 HydrophobicContact CG2-CD 4.16Å; V68-K78 HydrophobicContact CG2-CG 4.49Å; V68-F94 HydrophobicContact CG2-CE1 4.36Å
69	N	47.6	Very low	51.8	Low	122 Å²	122	90.7 Å²	90.7	65%	0.652	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	114.9	171.5	-71.5	-33.3	0	0	0	107.8	T75	N69-T75 PolarHBondContact OD1-OG1 3.01Å
70	F	49.3	Very low	52.4	Low	89 Å²	89	90.8 Å²	90.8	39%	0.39	47%	0.47	S	S	.	.			trans	-84.5	158.6	171.1	-76.4	-96.6	0	0	0	110.3	V68 N72 R73 N74 W76 F94	V68-F70 HydrophobicContact CB-CE2 4.16Å; V68-F70 HydrophobicContact CG1-CD2 4.3Å; V68-F70 HydrophobicContact CG1-CE2 4.05Å; V68-F70 HydrophobicContact CG1-CZ 4.49Å; V68-F70 PolarHBondContact O-N 2.82Å; F70-N72 PolarHBondContact O-N 3.45Å; F70-R73 PolarHBondContact O-N 3.32Å; F70-R73 VanDerWaalsContact O-N 3.09Å; F70-N74 PolarHBondContact N-O 3.41Å; F70-W76 HydrophobicContact CD2-CB 3.87Å; F70-W76 AromaticContact CD2-CD1 3.28Å; F70-W76 AromaticContact CD2-CG 3.7Å; F70-W76 HydrophobicContact CD2-CG 3.7Å; F70-W76 HydrophobicContact CE2-CB 3.72Å; F70-W76 AromaticContact CE2-CD1 3.87Å; F70-W76 AromaticContact CE2-CG 3.82Å; F70-W76 HydrophobicContact CE2-CG 3.82Å; F70-F94 AromaticContact CE2-CD1 3.64Å; F70-F94 HydrophobicContact CE2-CD1 3.64Å; F70-F94 HydrophobicContact CE2-CE1 4Å; F70-F94 HydrophobicContact CE2-CG 4.32Å; F70-F94 AromaticContact CZ-CD1 3.61Å; F70-F94 HydrophobicContact CZ-CD1 3.61Å; F70-F94 AromaticContact CZ-CE1 3.67Å; F70-F94 HydrophobicContact CZ-CE1 3.67Å; F70-F94 HydrophobicContact CZ-CG 4.12Å; F70-F94 HydrophobicContact CZ-CZ 4.25Å
71	V	45.8	Very low	52.8	Low	146 Å²	146	87.2 Å²	87.2	89%	0.885	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-29.8	-176.9	-178.4	0	0	0	0	113.1	R73	V71-R73 VanDerWaalsContact C-N 3.3Å; V71-R73 PolarHBondContact O-N 2.88Å
72	N	52.4	Low	53.1	Low	132 Å²	132	87.4 Å²	87.4	71%	0.706	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	23.6	-178.6	-67.6	-6.5	0	0	0	115	F70 N74	F70-N72 PolarHBondContact O-N 3.45Å; N72-N74 PolarHBondContact O-N 3.38Å
73	R	56	Low	53.5	Low	232 Å²	232	84.2 Å²	84.2	88%	0.875	43%	0.426	S	S	*	.	S	Bend	trans	57.9	9.5	-178.6	-59.4	-175.7	-177.2	-177.1	1	115.9	F70 V71	F70-R73 PolarHBondContact O-N 3.32Å; F70-R73 VanDerWaalsContact O-N 3.09Å; V71-R73 VanDerWaalsContact C-N 3.3Å; V71-R73 PolarHBondContact O-N 2.88Å
74	N	55.3	Low	53.6	Low	89 Å²	89	85.4 Å²	85.4	48%	0.476	43%	0.431	S	S	.	.			trans	-83.1	122.3	170.8	-70.6	-22	0	0	0	108	F70 N72 W76	F70-N74 PolarHBondContact N-O 3.41Å; N72-N74 PolarHBondContact O-N 3.38Å; N74-W76 VanDerWaalsContact O-CD1 3.24Å
75	T	59.9	Low	53.4	Low	53 Å²	53	86.7 Å²	86.7	33%	0.325	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.8	170.1	-49.6	0	0	0	0	107.9	Q67 N69 A97	Q67-T75 HydrophobicContact CB-CG2 4.13Å; Q67-T75 HydrophobicContact CG-CG2 4.2Å; N69-T75 PolarHBondContact OD1-OG1 3.01Å; T75-A97 HydrophobicContact CG2-CB 3.59Å; T75-A97 VanDerWaalsContact O-CB 3.31Å; T75-A97 WeakPolarHBondContact O-CB 3.01Å; T75-A97 PolarHBondContact O-N 3.28Å
76	W	55.2	Low	53.4	Low	79 Å²	79	84.8 Å²	84.8	30%	0.299	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.8	173.1	-66.1	76.5	0	0	0	108.1	Q67 V68 F70 N74 F94 V95 P96	Q67-W76 CarbonylContact C-O 3.43Å; Q67-W76 WeakPolarHBondContact CA-O 3.19Å; V68-W76 PolarHBondContact N-O 3.27Å; V68-W76 PolarHBondContact O-N 3.17Å; F70-W76 HydrophobicContact CD2-CB 3.87Å; F70-W76 AromaticContact CD2-CD1 3.28Å; F70-W76 AromaticContact CD2-CG 3.7Å; F70-W76 HydrophobicContact CD2-CG 3.7Å; F70-W76 HydrophobicContact CE2-CB 3.72Å; F70-W76 AromaticContact CE2-CD1 3.87Å; F70-W76 AromaticContact CE2-CG 3.82Å; F70-W76 HydrophobicContact CE2-CG 3.82Å; N74-W76 VanDerWaalsContact O-CD1 3.24Å; W76-F94 HydrophobicContact CB-CB 4.47Å; W76-F94 HydrophobicContact CE3-CB 3.94Å; W76-F94 WeakPolarHBondContact CZ3-O 3.4Å; W76-V95 CarbonylContact C-O 3.56Å; W76-V95 VanDerWaalsContact CA-O 3.27Å; W76-V95 WeakPolarHBondContact CA-O 3.48Å; W76-P96 HydrophobicContact CE3-CG 4.31Å; W76-P96 HydrophobicContact CH2-CG 4.23Å; W76-P96 HydrophobicContact CZ3-CG 3.87Å
77	T	60.6	Low	53.5	Low	26 Å²	26	81.9 Å²	81.9	16%	0.16	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	111.8	165.6	-53.9	0	0	0	0	107.3	Q79 V95	T77-Q79 HydrophobicContact CG2-CG 4.23Å; T77-Q79 PolarHBondContact O-N 3.05Å; T77-V95 PolarHBondContact N-O 2.61Å; T77-V95 WeakPolarHBondContact O-CG2 3.17Å; T77-V95 PolarHBondContact O-N 2.94Å
78	K	61.1	Low	53.6	Low	47 Å²	47	81 Å²	81	20%	0.204	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	116.5	162.9	179.1	177.1	175.9	167.6	0	107.1	G65 K66 V68 E92 T93 F94	G65-K78 CarbonylContact C-O 3.47Å; G65-K78 VanDerWaalsContact CA-O 3.31Å; G65-K78 WeakPolarHBondContact CA-O 3.43Å; K66-K78 PolarHBondContact N-O 3.25Å; K66-K78 WeakPolarHBondContact O-CA 3.1Å; K66-K78 WeakPolarHBondContact O-CB 3.36Å; K66-K78 PolarHBondContact O-N 3.39Å; V68-K78 HydrophobicContact CG2-CB 3.54Å; V68-K78 HydrophobicContact CG2-CD 4.16Å; V68-K78 HydrophobicContact CG2-CG 4.49Å; K78-E92 WeakPolarHBondContact CE-OE1 3.3Å; K78-E92 WeakPolarHBondContact CE-OE2 3.09Å; K78-E92 IonicContact NZ-OE1 2.67Å; K78-E92 PolarHBondContact NZ-OE1 3.1Å; K78-E92 IonicContact NZ-OE2 2.76Å; K78-E92 PolarHBondContact NZ-OE2 3.35Å; K78-T93 CarbonylContact C-O 3.52Å; K78-T93 WeakPolarHBondContact CA-O 3.38Å; K78-F94 HydrophobicContact CB-CD1 4.03Å; K78-F94 HydrophobicContact CB-CE1 3.86Å; K78-F94 HydrophobicContact CD-CE1 4.11Å; K78-F94 HydrophobicContact CD-CZ 4.39Å; K78-F94 HydrophobicContact CG-CD1 4.42Å; K78-F94 HydrophobicContact CG-CE1 3.94Å; K78-F94 HydrophobicContact CG-CZ 4.38Å
79	Q	56.6	Low	53.4	Low	58 Å²	58	79 Å²	79	27%	0.271	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	108	169.9	-69.6	-174.2	-21.5	0	0	107.5	F64 T77 T93 V95	F64-Q79 WeakPolarHBondContact O-CA 3.09Å; T77-Q79 HydrophobicContact CG2-CG 4.23Å; T77-Q79 PolarHBondContact O-N 3.05Å; Q79-T93 WeakPolarHBondContact CB-OG1 3.44Å; Q79-T93 PolarHBondContact N-O 3.15Å; Q79-T93 PolarHBondContact O-N 2.84Å; Q79-T93 PolarHBondContact O-OG1 3.47Å; Q79-V95 HydrophobicContact CG-CG2 4.12Å
80	T	60.6	Low	53.8	Low	22 Å²	22	75 Å²	75	14%	0.135	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	118.5	168.2	-58.9	0	0	0	0	107.5	S63 F64	S63-T80 WeakPolarHBondContact CA-O 3.45Å; F64-T80 PolarHBondContact N-O 2.67Å; F64-T80 VanDerWaalsContact N-O 3.17Å; F64-T80 PolarHBondContact O-N 2.76Å
81	K	56.5	Low	54.3	Low	34 Å²	34	71.2 Å²	71.2	15%	0.148	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.5	171.4	-64	-166.3	175.6	-173.8	0	109.4	T61 S90 I91	T61-K81 HydrophobicContact CG2-CB 4.47Å; T61-K81 HydrophobicContact CG2-CD 3.84Å; T61-K81 HydrophobicContact CG2-CG 3.86Å; K81-S90 CarbonylContact O-C 3.53Å; K81-S90 WeakPolarHBondContact O-CA 3.19Å; K81-I91 PolarHBondContact N-O 2.86Å; K81-I91 PolarHBondContact O-N 3.48Å
82	M	53.5	Low	54.7	Low	75 Å²	75	68.7 Å²	68.7	37%	0.369	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	149.6	168.7	-71.3	-179.7	150.8	0	0	110.2	F64	F64-M82 HydrophobicContact CE2-SD 4.1Å
83	Y	54.7	Low	54.8	Low	4 Å²	4	63.3 Å²	63.3	2%	0.016	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.5	175.3	-65.8	-90.4	0	0	0	109.9	A53 N54 K85 C86 I91	A53-Y83 HydrophobicContact CB-CD1 4.33Å; A53-Y83 HydrophobicContact CB-CE1 3.48Å; A53-Y83 VanDerWaalsContact CB-CE1 3.48Å; A53-Y83 HydrophobicContact CB-CE2 4.21Å; A53-Y83 VanDerWaalsContact CB-CZ 3.42Å; A53-Y83 WeakPolarHBondContact CB-OH 3.05Å; N54-Y83 WeakPolarHBondContact OD1-CE1 3.37Å; Y83-K85 VanDerWaalsContact C-N 3.31Å; Y83-K85 PolarHBondContact O-N 3.46Å; Y83-C86 CarbonylContact O-C 2.96Å; Y83-C86 PolarHBondContact O-N 3.22Å; Y83-C86 VanDerWaalsContact O-O 3.08Å; Y83-I91 HydrophobicContact CE2-CB 4.31Å; Y83-I91 HydrophobicContact CE2-CD1 3.68Å; Y83-I91 HydrophobicContact CE2-CG1 3.78Å; Y83-I91 WeakPolarHBondContact OH-CD1 2.99Å
84	T	50.9	Low	54.8	Low	80 Å²	80	56.4 Å²	56.4	49%	0.491	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-38.7	-176.3	-32	0	0	0	0	113	D60 C86	D60-T84 WeakPolarHBondContact CB-OG1 3.27Å; D60-T84 PolarHBondContact N-OG1 3.45Å; D60-T84 WeakPolarHBondContact OD2-CB 3.35Å; D60-T84 WeakPolarHBondContact OD2-CG2 3.37Å; D60-T84 PolarHBondContact OD2-OG1 3.26Å; T84-C86 VanDerWaalsContact C-N 3.3Å; T84-C86 PolarHBondContact O-N 3.41Å
85	K	45.1	Very low	55	Low	148 Å²	148	54.5 Å²	54.5	64%	0.643	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-5.4	176.7	-56.5	-179.2	-171.8	175.1	0	114	Y57 Y83	Y57-K85 WeakPolarHBondContact O-CB 3.39Å; Y57-K85 VanDerWaalsContact O-CD 3.27Å; Y57-K85 WeakPolarHBondContact O-CD 3.07Å; Y57-K85 WeakPolarHBondContact O-CG 3.02Å; Y57-K85 PolarHBondContact O-N 3.13Å; Y83-K85 VanDerWaalsContact C-N 3.31Å; Y83-K85 PolarHBondContact O-N 3.46Å
86	C	48.2	Very low	55	Low	13 Å²	13	56 Å²	56	9%	0.088	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	78.6	171.2	-171.8	0	0	0	0	110.2	C30 Y57 Y83 T84 S88 C89	C30-C86 WeakPolarHBondContact CB-SG 3.41Å; C30-C86 WeakPolarHBondContact SG-CB 3.45Å; C30-C86 CovalentContact SG-SG 2.03Å; C30-C86 PolarHBondContact SG-SG 3.45Å; Y57-C86 HydrophobicContact CD1-CB 4.18Å; Y83-C86 CarbonylContact O-C 2.96Å; Y83-C86 PolarHBondContact O-N 3.22Å; Y83-C86 VanDerWaalsContact O-O 3.08Å; T84-C86 VanDerWaalsContact C-N 3.3Å; T84-C86 PolarHBondContact O-N 3.41Å; C86-S88 PolarHBondContact O-N 3.37Å; C86-C89 HydrophobicContact CB-CB 4.35Å; C86-C89 WeakPolarHBondContact CB-SG 3.42Å; C86-C89 PolarHBondContact O-N 3.38Å; C86-C89 PolarHBondContact O-SG 3.28Å; C86-C89 VanDerWaalsContact SG-CB 3.59Å; C86-C89 PolarHBondContact SG-SG 3.47Å
87	P	52.4	Low	55.2	Low	92 Å²	92	53.1 Å²	53.1	60%	0.597	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	-24.7	-177.6	24.9	-34	0	0	0	112.4	C89	P87-C89 PolarHBondContact O-N 3.09Å
88	S	50.3	Low	54.9	Low	114 Å²	114	63.2 Å²	63.2	80%	0.797	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	-11.2	173	-43.1	0	0	0	0	113.4	C86	C86-S88 PolarHBondContact O-N 3.37Å
89	C	50.6	Low	54.1	Low	4 Å²	4	70.2 Å²	70.2	3%	0.027	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.8	179.1	86.4	0	0	0	0	111.3	C30 I34 C86 P87	C30-C89 HydrophobicContact CB-CB 3.47Å; C30-C89 VanDerWaalsContact CB-CB 3.47Å; C30-C89 WeakPolarHBondContact SG-CB 3.42Å; C30-C89 PolarHBondContact SG-SG 3.24Å; I34-C89 HydrophobicContact CD1-CB 3.8Å; C86-C89 HydrophobicContact CB-CB 4.35Å; C86-C89 WeakPolarHBondContact CB-SG 3.42Å; C86-C89 PolarHBondContact O-N 3.38Å; C86-C89 PolarHBondContact O-SG 3.28Å; C86-C89 VanDerWaalsContact SG-CB 3.59Å; C86-C89 PolarHBondContact SG-SG 3.47Å; P87-C89 PolarHBondContact O-N 3.09Å
90	S	55.3	Low	53.3	Low	37 Å²	37	73.4 Å²	73.4	26%	0.259	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.2	173.3	60.1	0	0	0	0	108.5	K81	K81-S90 CarbonylContact O-C 3.53Å; K81-S90 WeakPolarHBondContact O-CA 3.19Å
91	I	59.3	Low	52.3	Low	10 Å²	10	85 Å²	85	5%	0.051	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.1	167.8	-67	179.2	0	0	0	107.8	F33 A53 K81 Y83 T93	F33-I91 HydrophobicContact CD1-CD1 4.14Å; F33-I91 HydrophobicContact CE1-CD1 4.26Å; A53-I91 HydrophobicContact CB-CD1 4.43Å; K81-I91 PolarHBondContact N-O 2.86Å; K81-I91 PolarHBondContact O-N 3.48Å; Y83-I91 HydrophobicContact CE2-CB 4.31Å; Y83-I91 HydrophobicContact CE2-CD1 3.68Å; Y83-I91 HydrophobicContact CE2-CG1 3.78Å; Y83-I91 WeakPolarHBondContact OH-CD1 2.99Å; I91-T93 HydrophobicContact CG2-CG2 3.98Å
92	E	54.2	Low	52.1	Low	94 Å²	94	87.6 Å²	87.6	44%	0.439	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.2	172.5	-53.4	-164.7	146.2	0	0	108.8	K78	K78-E92 WeakPolarHBondContact CE-OE1 3.3Å; K78-E92 WeakPolarHBondContact CE-OE2 3.09Å; K78-E92 IonicContact NZ-OE1 2.67Å; K78-E92 PolarHBondContact NZ-OE1 3.1Å; K78-E92 IonicContact NZ-OE2 2.76Å; K78-E92 PolarHBondContact NZ-OE2 3.35Å
93	T	55.4	Low	52	Low	18 Å²	18	88.2 Å²	88.2	11%	0.11	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.3	173.2	51.1	0	0	0	0	109.4	I50 K78 Q79 I91	I50-T93 HydrophobicContact CD1-CG2 4.12Å; K78-T93 CarbonylContact C-O 3.52Å; K78-T93 WeakPolarHBondContact CA-O 3.38Å; Q79-T93 WeakPolarHBondContact CB-OG1 3.44Å; Q79-T93 PolarHBondContact N-O 3.15Å; Q79-T93 PolarHBondContact O-N 2.84Å; Q79-T93 PolarHBondContact O-OG1 3.47Å; I91-T93 HydrophobicContact CG2-CG2 3.98Å
94	F	54.6	Low	51.9	Low	88 Å²	88	92.9 Å²	92.9	39%	0.386	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109.3	174.8	-61.7	-87.3	0	0	0	107.6	V68 F70 W76 K78	V68-F94 HydrophobicContact CG2-CE1 4.36Å; F70-F94 AromaticContact CE2-CD1 3.64Å; F70-F94 HydrophobicContact CE2-CD1 3.64Å; F70-F94 HydrophobicContact CE2-CE1 4Å; F70-F94 HydrophobicContact CE2-CG 4.32Å; F70-F94 AromaticContact CZ-CD1 3.61Å; F70-F94 HydrophobicContact CZ-CD1 3.61Å; F70-F94 AromaticContact CZ-CE1 3.67Å; F70-F94 HydrophobicContact CZ-CE1 3.67Å; F70-F94 HydrophobicContact CZ-CG 4.12Å; F70-F94 HydrophobicContact CZ-CZ 4.25Å; W76-F94 HydrophobicContact CB-CB 4.47Å; W76-F94 HydrophobicContact CE3-CB 3.94Å; W76-F94 WeakPolarHBondContact CZ3-O 3.4Å; K78-F94 HydrophobicContact CB-CD1 4.03Å; K78-F94 HydrophobicContact CB-CE1 3.86Å; K78-F94 HydrophobicContact CD-CE1 4.11Å; K78-F94 HydrophobicContact CD-CZ 4.39Å; K78-F94 HydrophobicContact CG-CD1 4.42Å; K78-F94 HydrophobicContact CG-CE1 3.94Å; K78-F94 HydrophobicContact CG-CZ 4.38Å
95	V	59.5	Low	51.9	Low	48 Å²	48	93.6 Å²	93.6	29%	0.291	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	147.6	171	-62.1	0	0	0	0	108.9	W76 T77 Q79 A97	W76-V95 CarbonylContact C-O 3.56Å; W76-V95 VanDerWaalsContact CA-O 3.27Å; W76-V95 WeakPolarHBondContact CA-O 3.48Å; T77-V95 PolarHBondContact N-O 2.61Å; T77-V95 WeakPolarHBondContact O-CG2 3.17Å; T77-V95 PolarHBondContact O-N 2.94Å; Q79-V95 HydrophobicContact CG-CG2 4.12Å; V95-A97 PolarHBondContact O-N 3.19Å
96	P	59.9	Low	52.4	Low	86 Å²	86	90.3 Å²	90.3	56%	0.558	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.2	130.5	169.8	-19.2	30.1	0	0	0	108	W76 R98	W76-P96 HydrophobicContact CE3-CG 4.31Å; W76-P96 HydrophobicContact CH2-CG 4.23Å; W76-P96 HydrophobicContact CZ3-CG 3.87Å; P96-R98 PolarHBondContact O-N 3.27Å
97	A	60.2	Low	52.6	Low	17 Å²	17	95.4 Å²	95.4	14%	0.14	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-61	117	170.8	0	0	0	0	0	106	T75 V95 R99	T75-A97 HydrophobicContact CG2-CB 3.59Å; T75-A97 VanDerWaalsContact O-CB 3.31Å; T75-A97 WeakPolarHBondContact O-CB 3.01Å; T75-A97 PolarHBondContact O-N 3.28Å; V95-A97 PolarHBondContact O-N 3.19Å; A97-R99 PolarHBondContact O-N 2.9Å
98	R	54.9	Low	52.7	Low	239 Å²	239	95.6 Å²	95.6	90%	0.902	47%	0.472	S	S	*	.			trans	-54.9	114.4	172	-78.2	-173	179.9	-169.5	0.3	105.8	P96 S100	P96-R98 PolarHBondContact O-N 3.27Å; R98-S100 PolarHBondContact O-N 2.03Å
99	R	43.2	Very low	52.9	Low	194 Å²	194	94.2 Å²	94.2	73%	0.732	45%	0.447	S	S	*	.			trans	-57.6	112.1	162.5	-73.5	-174.4	-177.9	-174.9	0.9	104.4	A97 Y101	A97-R99 PolarHBondContact O-N 2.9Å; R99-Y101 VanDerWaalsContact C-N 3.29Å; R99-Y101 HydrophobicContact CB-CD2 4.36Å; R99-Y101 HydrophobicContact CB-CE2 4.44Å; R99-Y101 PolarHBondContact O-N 3.08Å
100	S	40.6	Very low	53	Low	124 Å²	124	101.8 Å²	101.8	87%	0.867	48%	0.482	S	S	*	.			trans	-63.4	107.3	157.6	-66.7	0	0	0	0	104	R98	R98-S100 PolarHBondContact O-N 2.03Å
101	Y	39.4	Very low	52.8	Low	266 Å²	266	107.6 Å²	107.6	100%	1.043	50%	0.502	S	S	*	.			trans	-74.4	0	161.4	-91.3	-83.3	0	0	0	107.6	R99	R99-Y101 VanDerWaalsContact C-N 3.29Å; R99-Y101 HydrophobicContact CB-CD2 4.36Å; R99-Y101 HydrophobicContact CB-CE2 4.44Å; R99-Y101 PolarHBondContact O-N 3.08Å

Retrieved 101 of 101 residues in 38.3 ms (Link to these results)

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